smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CCCCN(C(=O)CCl)[C@@H](C(=O)NC1CCCCC1)c1cccc(Br)c1 3040246 UIFIHPAYUQLFLD-LJQANCHMSA-N 443.813 4.807 50 10 IJGE Cc1ccc(C(=O)NNC(=O)c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2)cc1 12491972 RYMRTHNYZWOJKO-UHFFFAOYSA-N 429.520 4.620 50 10 IJGE C=CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccccc4)ccc32)cc1 38658281 BIHAYCFACVLINI-AREMUKBSSA-N 438.483 4.618 50 10 IJGE CCCCCCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)OC)cc2)cc1OC 40853583 SIPNQUFXMGGFKC-HMMYKYKNSA-N 436.508 4.987 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Br)Cc3ccccc3Cl)cc2[nH]1 109884251 BTAVDTYQZIKMBX-SNVBAGLBSA-N 430.527 4.951 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1Br)c1cc(Br)c(Br)s1 122898968 KKLKHICNKNHMPV-SVRRBLITSA-N 446.002 4.709 50 10 IJGE C[C@@](CI)(OC[C@@H]1CCCCO1)c1ccccc1Br 161960873 SMNUBASHXIIXIA-WFASDCNBSA-N 439.131 4.685 50 10 IJGE CCOC[C@H](C)O[C@@](C)(CI)c1ccccc1Br 233786227 YLCZEADFTXDHBY-FZMZJTMJSA-N 427.120 4.541 50 10 IJGE BrCc1cc(Br)cc(Br)c1OC[C@H]1CCCOC1 690497885 LKSUECBORDBUQY-VIFPVBQESA-N 442.973 4.912 50 10 IJGE Cc1cc([C@H](Br)c2c(Br)cnn2C)sc1Br 693045795 BLQZIEXZTFHTRN-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE CC[C@@H](Br)[C@@H](C)NC(=O)c1scc(Br)c1Br 705439961 VIYCEHLOTFOBBE-PHDIDXHHSA-N 433.991 4.565 50 10 IJGE Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)NNC(=O)c1cccc2cccnc12 729616615 SBCBPPNSOBPCHG-AWEZNQCLSA-N 449.511 4.511 50 10 IJGE C[C@@H](NC(=O)NNc1cccc(F)c1F)c1ccc(NC(=O)c2ccc(F)cc2)cc1 745705700 XCBNXIIEVCBMNQ-CYBMUJFWSA-N 428.414 4.744 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NC[C@@H]2CCCCC(F)(F)C2)c(-c2ccccc2)n1 816789147 HTSXJYQMZPPGEL-RXWSAZGZSA-N 437.494 4.703 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCN(c4ccccc4)CC3)c2C)cc1C 1084262536 KRGQLKWFDNRARI-XIEYBQDHSA-N 438.575 4.967 50 10 IJGE C=CCn1nc(C)c(-c2cc(C(=O)N3CCC[C@@H](O[Si](C)(C)C(C)(C)C)C3)n[nH]2)c1C 1298994371 KEGYVDXWFRUEDA-GOSISDBHSA-N 443.668 4.702 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)[C@@H](Sc2ccccc2F)c2ccccc2)c1 1471691194 SISJTKKJVVJCLT-NRFANRHFSA-N 435.549 4.658 50 10 IJGE C=CCNC(=S)NNC(=O)c1ccc(N[C@@H](C)c2cc(Cl)ccc2Cl)c(C)c1 1538840889 BQHMCCVPVRFKHU-ZDUSSCGKSA-N 437.396 4.770 50 10 IJGE Cc1ccc([C@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)cc1[N+](=O)[O-] 1614689535 BHAVFUQYDCQFEI-ZWKOTPCHSA-N 433.302 4.650 50 10 IJGE COc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)Oc3cc(C)cc(C)c3)c(C)c21 1772746504 WLSDDHLSTNDPOF-UHFFFAOYSA-N 446.503 4.903 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@H]1c1ccc(O)cc1 1865684258 OTOZJSKYFPQYJD-INIZCTEOSA-N 446.816 4.527 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CC(C)C)c1 1865690278 NHEMLHLBWWVUEY-JOCHJYFZSA-N 444.535 4.832 50 10 IJGE COc1cccc(-c2csc(/C(C#N)=C(\O)CCCN3C(=O)c4ccccc4C3=O)n2)c1 1872744559 YDHFFXWVVSOZSO-VZCXRCSSSA-N 445.500 4.688 50 10 IJGE Cc1ccc(-c2csc(/C(C#N)=C(\O)[C@@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1C 1872756436 JYLKOAKNOUFXBA-DSGGYQJVSA-N 429.501 4.904 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@H](C(F)(F)CCl)C1 1892719530 HAFKHHFEOVEDDU-LURJTMIESA-N 437.531 4.609 50 10 IJGE C[C@@](CBr)(NC(=O)c1cc(Br)c(Br)s1)C1CC1 1942792275 OANRVSZGRLRFNN-NSHDSACASA-N 446.002 4.567 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc([C@@]2(C)CC[C@@H](CI)O2)cc1 1987516538 ADSVXUJSQKRPMU-MAUKXSAKSA-N 431.314 4.541 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@H]1CCN(C(=O)OCc2ccccc2)C1 1999500158 DICABYZBXSONSH-SFTDATJTSA-N 431.374 4.508 50 10 IJGE CC[C@@H](CCCBr)NC(=O)c1cc(Br)ccc1Br 2036514456 UPCABODVELATGY-JTQLQIEISA-N 441.989 4.895 50 10 IJGE BrC[C@H]1C[C@H]2CC[C@H]1N2Cc1c(Br)cccc1Br 2039487044 BZZZDRLABOYARP-GPCCPHFNSA-N 438.001 4.959 50 10 IJGE O=C(CCl)c1ccc(C(F)(F)F)c(I)c1OC(F)(F)F 2055155249 FXYOIEOLHVFLSX-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE FC(F)(F)c1c(I)ccc(CCl)c1I 2060235702 LCEHZRVTUYCOEX-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE CCc1nn(-c2cc(OC)cc(C(F)(F)F)n2)c(C(F)(F)F)c1CBr 2079211973 GNSZVZSVVHCLJN-UHFFFAOYSA-N 432.162 4.771 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](Br)C(F)(F)F)[C@H](c2ccccc2)C1 2106785250 NYXGDJJROSLZFS-GJZGRUSLSA-N 437.300 4.606 50 10 IJGE CC(C)[C@H]1N(C(=O)OC(C)(C)C)CC12CCN(C[C@@H](Br)C(F)(F)F)CC2 2106787868 LCPPMVVSZGSNDA-ZIAGYGMSSA-N 443.348 4.670 50 10 IJGE Cc1cccc(C(=O)N[C@H](C)CCCCCBr)c1I 2117894984 OMYVXVOLVUFNRT-GFCCVEGCSA-N 438.147 4.673 50 10 IJGE C[C@H]1CCCN(C(=O)c2ccc(CBr)cc2)[C@@H]1CCNC(=O)OC(C)(C)C 2163053584 ORAIENQOOKTILC-MAUKXSAKSA-N 439.394 4.737 50 10 IJGE CN(Cc1c(F)ccc(Br)c1F)[C@H](CCBr)C(F)(F)F 2178518672 SPGMKTYNWSOSTO-SNVBAGLBSA-N 425.033 4.875 50 10 IJGE C[C@H]1CCC(C)(C)CN1S(=O)(=O)c1cc(CBr)sc1Br 2179791313 PQYXEBVKCPKXCY-VIFPVBQESA-N 445.242 4.605 50 10 IJGE Cc1ccc(C(=O)N2[C@H]3CCC[C@H](Br)[C@H]2CC3)cc1I 2232844592 YFRNBUZQMAJGLT-KCQAQPDRSA-N 448.142 4.520 50 10 IJGE C[C@H](Br)c1ccccc1NS(=O)(=O)Cc1ccsc1Br 2234500203 BSQZUZIAVADMMH-VIFPVBQESA-N 439.194 4.908 50 10 IJGE Cc1cc(Br)c(C(=O)N2CCC(CBr)(C(F)F)CC2)s1 2289949171 BGBWMHHJDDLIKJ-UHFFFAOYSA-N 431.140 4.701 50 10 IJGE COC(=O)c1ccc(COc2ccccc2C=C(C#N)C(=O)Nc2ccccc2C)cc1 2297388084 RLFQJSONWNVLDW-UHFFFAOYSA-N 426.472 4.906 50 10 IJGE CCC[C@H](O[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1I)c1ccccc1 2302032139 RMLCNYSQNGNADX-YESZJQIVSA-N 445.341 4.967 50 10 IJGE CCOC(=O)C(C#N)=C1C(=O)N2c3c1cc(CC)cc3[C@](C)(c1ccccc1)CC2(C)C 2313676853 PVJCWBMUANSRIN-MHZLTWQESA-N 428.532 4.924 50 10 IJGE Cn1cc(I)c(CC2(CBr)CCC(C)(C)CC2)n1 2319151783 KLCMOPWHJPFWQY-UHFFFAOYSA-N 425.152 4.549 50 10 IJGE CC[C@@H]1[C@@H](CCl)CCN1Cc1ccc(I)c(Br)c1 2325211662 AHHABFWIJMAEOW-BXUZGUMPSA-N 442.566 4.893 50 10 IJGE C[C@H]1C[C@@H](CBr)CN(Cc2cc(I)ccc2Cl)C1 2327397887 WTYYDNAJIVPWGR-QWRGUYRKSA-N 442.566 4.798 50 10 IJGE COc1ccc([C@@H](Cl)c2c(Br)c(Br)nn2C)c(Cl)c1 2338859769 HTHNBWXLOKJLJK-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE C#CCN(CC1(CBr)CC(C)(C)C1)C1CCN(C(=O)OC(C)(C)C)CC1 2345010823 OLIYSRODNUNKOF-UHFFFAOYSA-N 427.427 4.522 50 10 IJGE CCCCOc1ccc(C(=O)N[C@H](CCBr)COCc2ccccc2)cc1 2369432834 HTRCFNNCVNTISQ-HXUWFJFHSA-N 434.374 4.966 50 10 IJGE CC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(OCc3c(C)cccc3Cl)o2)cc1 20291624 YDWKDHDVOGGJQY-WYMPLXKRSA-N 425.872 4.543 50 10 IJGE Cc1cc(C)c(CNC(=O)CSc2nc3ccc(NC(=O)CCl)cc3s2)c(C)c1 59489695 OWWKUBLQLURFKB-UHFFFAOYSA-N 448.013 4.807 50 10 IJGE CCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2nc(-c3ccc4c(c3)OCCO4)cs2)c1C 97985692 QGZUIDBKFVSINF-ODLFYWEKSA-N 448.548 4.955 50 10 IJGE C[C@@H](Br)c1ccccc1NC(=O)c1ccc(I)c(O)c1 235062565 NSBYREQYASOLMT-SECBINFHSA-N 446.082 4.705 50 10 IJGE Cc1nnc(SCc2ccc(C(=O)NN=Cc3ccccc3C(F)(F)F)cc2)s1 254392929 KXPVVJFCALXPJX-UHFFFAOYSA-N 436.484 4.922 50 10 IJGE COc1ccc2ccccc2c1C=NNC(=O)CSc1nnc(-c2ccccc2)s1 256028312 FDDMHQDIHPNPOX-UHFFFAOYSA-N 434.546 4.609 50 10 IJGE Cc1cc(F)c([C@@H](Br)c2cnn(C)c2I)cc1Cl 395812638 KQYIKUFQNXRHCS-LLVKDONJSA-N 443.485 4.610 50 10 IJGE ClCCc1nc2c(Br)cccc2n1C1[C@H]2CN(Cc3ccccc3)C[C@H]12 398461378 RWNOGRNXURRPPZ-HOTGVXAUSA-N 430.777 4.883 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)/C=C(/c2ccc(Cl)cc2)C(F)(F)F)c1C 771015882 KYUPTYNSZCPMGI-WJDWOHSUSA-N 447.848 4.898 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)c(C(F)(F)F)c1 799746244 CBYIRAOOZSUMBM-UHFFFAOYSA-N 433.393 4.944 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)Nc2cccc(-n3ccnc3O)c2)c1C 1125333035 ICHNNMKLAUAQMQ-KGENOOAVSA-N 437.503 4.840 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1[C@H]1CN(C(=O)OCc2ccccc2)C[C@H]1CBr 1614643594 UBYXTBMTUAKLBT-APWZRJJASA-N 433.302 4.650 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc([N+](=O)[O-])cc2)CCC3)c1 1772745422 YZAHUOFXAAMVEN-UHFFFAOYSA-N 446.463 4.527 50 10 IJGE COc1ccccc1C(=O)NCc1ccc(OC(=O)Nc2ccc(SC#N)cc2)cc1 1858896510 CPCHPTCVGOEINE-UHFFFAOYSA-N 433.489 4.809 50 10 IJGE Cc1nc(-c2ccc(F)cc2)ccc1C(=O)NNC(=O)[C@H](C)Oc1ccc(C(C)C)cc1 1865758108 JKMJKYFFACSXPC-KRWDZBQOSA-N 435.499 4.548 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)c3ccc(CSC(C)C)o3)c(C)n2)cc1 1865758671 LQNCLIPQFGWJFI-UHFFFAOYSA-N 437.565 4.929 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N/N=C/c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1 1873794951 KSDWYAHVVFYOHU-CRXVIZHGSA-N 445.604 4.837 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1cc(Cl)ccc1Br 1882086206 ZQSSZTFZEAGLQF-LLVKDONJSA-N 427.564 4.933 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@H]2[C@H]3COCC[C@H]32)s1 1900919360 MNEKBUOHAYFTHB-MLTZYSBQSA-N 433.536 4.725 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@@H]1CCCC[C@H]1C(F)(F)F 1916349714 VXADKJXIXMQIQQ-GVDBMIGSSA-N 436.312 4.794 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]3(CC[C@@H]21)CC[C@@](C)(CI)O3 1935707892 ZDRVODWGSNOAMI-BODMPHMZSA-N 435.346 4.539 50 10 IJGE C[C@@H]1CCN(Cc2c(Br)cccc2Br)[C@H]1CBr 1945332687 GXRVDABUGIKGCP-RNCFNFMXSA-N 425.990 4.817 50 10 IJGE CC[C@H](C[C@H](C)Br)NCc1ccc(I)c(Cl)c1 2026565562 CDWVQTGXEAVOKU-GXSJLCMTSA-N 430.555 4.986 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCN(c2ncc(CCl)cc2Br)C1 2032234500 LJZHWBATJQFZCV-UHFFFAOYSA-N 430.724 4.540 50 10 IJGE C[C@]1(CCBr)CCN1C(=O)c1cc(Br)ccc1Br 2084700960 SYWKYUAOBWLSHS-ZDUSSCGKSA-N 439.973 4.601 50 10 IJGE CCc1nsc(COc2c(Br)cc(Br)cc2CCl)n1 2102671439 BDUUXWGJVQSRLH-UHFFFAOYSA-N 426.561 4.943 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@@H](CBr)C(C)(C)C)C[C@H]1C(F)(F)F 2106786460 VAGFLZDHLMWPPF-MGPQQGTHSA-N 445.364 4.679 50 10 IJGE O=C(NC[C@@]12CC[C@H]1CCCN2Cc1ccccc1)c1ccc(CBr)cc1 2145607683 OTGPCWGUGUSALT-GGAORHGYSA-N 427.386 4.756 50 10 IJGE O=C(c1ccc(OCc2ccccc2)cc1)N1C[C@H](CBr)[C@@H](C(F)(F)F)C1 2163358120 HVKACYFSUASTLF-WMZOPIPTSA-N 442.275 4.911 50 10 IJGE COc1cc(F)c([C@@H](Br)c2nc(C)sc2Br)cc1OC 2169497572 ZTCRBCKUBYOMIT-LLVKDONJSA-N 425.117 4.855 50 10 IJGE BrC[C@]12CCCC[C@H]1N(C[C@H]1CC1(Br)Br)CCC2 2218007184 QZQUBPIDIXSMNO-JHJVBQTASA-N 444.049 4.912 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1cc(Cl)ccc1NC(=O)OC(C)(C)C 2223967350 IHUOMZKIMMUADP-UHFFFAOYSA-N 431.758 4.933 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CCCCCCBr)CC[C@H]1C(F)(F)F 2231105236 YVXJEUYTSRWDJT-HUUCEWRRSA-N 445.364 4.967 50 10 IJGE Cc1c(Br)csc1C(=O)NC[C@]1(F)CC[C@@H](CBr)CC1 2234505934 HPKAZABEOIETBL-WJONMLJTSA-N 427.177 4.842 50 10 IJGE COc1ccc([C@H](Cl)c2coc(Br)c2)cc1I 2248890346 BDULFWQSPWXDFA-LBPRGKRZSA-N 427.463 4.984 50 10 IJGE Cc1c(Br)sc([C@@H](Cl)C2CC(S(C)(=O)=O)C2)c1Br 2257543383 ZEAAXLWHIVFVIX-IEIXJENWSA-N 436.618 4.685 50 10 IJGE C[C@@H](Cl)C(=O)N1CCC(c2nc(N(C)C)ncc2-c2ccc(C(F)(F)F)cc2)CC1 2296572539 NMSKKXYGKTVZMI-CYBMUJFWSA-N 440.897 4.562 50 10 IJGE ClCCCCCCNCc1ccc(I)c(Br)c1 2306220201 VFAQVUGWLDQZPN-UHFFFAOYSA-N 430.555 4.943 50 10 IJGE Cn1cc(I)c(C[C@@]2(CBr)CCCCC2(C)C)n1 2319144837 KBPWGQKXAFGVRJ-CQSZACIVSA-N 425.152 4.549 50 10 IJGE N#CC(=CNCCc1ccccc1Br)C(=O)Nc1cccc(Cl)c1Cl 2324381152 VAKNLICWJYFUPK-UHFFFAOYSA-N 439.140 4.934 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC=C(C#N)C(=O)N1CCC(Cc2ccccc2)CC1 2324765213 JCXJBLBTIHMJQI-OAQYLSRUSA-N 431.580 4.933 50 10 IJGE CC(=O)c1ccc(-c2ccc(C=NNC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)o2)cc1 2328796578 CMUOHZXBEZKHRP-FQEVSTJZSA-N 441.528 4.539 50 10 IJGE Clc1nccc(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1CBr 2344698326 JLUJHRQIQYJZAP-ROUUACIJSA-N 434.809 4.978 50 10 IJGE Cc1nn(C)c(Br)c1COc1cc(F)c(CBr)c(Cl)c1 2379785739 ABWQHEWEPIHQIK-UHFFFAOYSA-N 426.511 4.757 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1Cc2ccccc2N(C[C@@]2(CBr)CC2(F)F)C1 2379985105 FKMHLIJIPJELIU-KUHUBIRLSA-N 445.348 4.610 50 10 IJGE O=C(COc1ccc(Cl)cc1Br)N/N=C/c1c(Cl)cccc1Cl 3208293 DZKBQXKEWKHKTM-IFRROFPPSA-N 436.520 4.938 50 10 IJGE C[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)COc1cccc2ccccc12 14038721 VUMWMXOAEVGIHD-LJQANCHMSA-N 440.499 4.501 50 10 IJGE CCCCOc1ccc(/C=C(/C#N)C(=O)Nc2sc(C)c(C)c2C(=O)OC)cc1OC 33768307 DANIUCHIFXYJAF-BOPFTXTBSA-N 442.537 4.885 50 10 IJGE CCc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(C)cc2)cc1 38649276 FJIOCOQZAHADIK-AREMUKBSSA-N 440.499 4.760 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2Cl)cc1 38650983 QLRDIACLPHAUKV-XMMPIXPASA-N 446.890 4.851 50 10 IJGE CC1=C(C#N)C(=O)N(CCc2ccccc2)C(=O)/C1=C/Nc1ccc(Cl)cc1Cl 101232940 QJBUNKFPFOQJOL-QGOAFFKASA-N 426.303 4.741 50 10 IJGE C[C@@H](Br)c1ccccc1NC(=O)c1ccccc1I 125453342 VVOFEDKATQALSI-SNVBAGLBSA-N 430.083 4.999 50 10 IJGE N#C/C(=C/NCc1ccc(Br)cc1)C(=O)Nc1cccc(Cl)c1Cl 217129965 LSFAFMLMLTZRBK-BENRWUELSA-N 425.113 4.892 50 10 IJGE CCCCCOc1ccccc1CN1C(=O)C(=NNC(=O)c2ccccc2)c2ccccc21 252458633 YJFYEHQKHPFOEJ-UHFFFAOYSA-N 441.531 4.937 50 10 IJGE C[C@]12CCCC[C@H]1[C@@H]2C(=O)NN=Cc1ccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 254750133 MNSBUHVLKZLDLS-WEYGHZABSA-N 438.440 4.572 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccccc1[C@H]1Cc2ccccc2N(S(N)(=O)=O)C1 616690365 NPQCNVKHSWXSDB-IBGZPJMESA-N 432.662 4.558 50 10 IJGE C[C@@H](Br)CN(C(=O)c1cc(Br)c(Br)s1)C1CC1 691354568 AZTRKTZMCFFXDR-ZCFIWIBFSA-N 446.002 4.661 50 10 IJGE O=C(N[C@H]1CCC[C@@H](Br)C1)c1cc(Br)c(Br)s1 694586182 IENJNWOIPRWDMN-RQJHMYQMSA-N 446.002 4.709 50 10 IJGE O=C(NC1(CBr)CCCCCC1)c1cccc(I)c1 713460321 RDWCKMJVXZHEQI-UHFFFAOYSA-N 436.131 4.509 50 10 IJGE COc1cc(/C=C\C(=O)Cl)cc(I)c1OCc1ccc(C)cc1 725430954 JBBCGYHXYMNYLD-FPLPWBNLSA-N 442.680 4.966 50 10 IJGE COc1cccc(-c2ccc(CNC(=O)NNC(=O)c3cccc4ccccc34)cc2)c1 745870727 DRIKABBJDLFKMU-UHFFFAOYSA-N 425.488 4.660 50 10 IJGE Cc1cc(C)c(CNC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(Cl)c3)c2C)c(O)n1 790437123 DAMKGAHSNOKTEO-VXLYETTFSA-N 434.927 4.688 50 10 IJGE Cc1cc(C)cc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCN(c4ccccc4)CC3)c2C)c1 1084016194 CFIPVXKJRKZFAH-XIEYBQDHSA-N 438.575 4.967 50 10 IJGE O=C(NN=Cc1cccc(OCc2ccc(Cl)cc2)c1)C(=O)Nc1ccccc1Cl 1084035752 ZZXKXCFICRLACM-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE CC(C)c1ccc(OCC(=O)NN=Cc2c(F)cccc2Cl)c(Br)c1 1084513400 FXTURGGKPUBFBL-UHFFFAOYSA-N 427.701 4.894 50 10 IJGE C[C@@H](Oc1cccnc1NC(=O)Nc1ccc(SC#N)cc1)C(=O)OC1CCCCC1 1858847248 IQBXVAMAALUMEF-OAHLLOKOSA-N 440.525 4.942 50 10 IJGE Cc1sc(NC(=O)/C(C#N)=C/c2ccccc2)nc1-c1ccc2c(c1)C(C)(C)C(=O)N2C 1859513514 HDPYSJJXEVQBJQ-LDADJPATSA-N 442.544 4.918 50 10 IJGE N#CSc1ccc(NC(=O)c2cccc(NC(=O)CCC(=O)c3ccccc3)n2)cc1 1860565979 WNVHRWKLXKQECA-UHFFFAOYSA-N 430.489 4.509 50 10 IJGE COc1ccc(-c2nn(C)c3c2[C@@H](c2ccc(Cl)cc2Cl)C(C#N)=C(N)O3)cc1 1865685485 JKVWBPLLHITPCE-KRWDZBQOSA-N 427.291 4.621 50 10 IJGE COc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2cccs2)cc1 1865698354 QTNJPMLJGPGXHW-FQEVSTJZSA-N 426.501 4.828 50 10 IJGE COc1ccc(-c2nn(Cc3cccc(F)c3)c3c2[C@@H](c2ccco2)C(C#N)=C(N)O3)cc1 1865698617 YSKFKWGUVNCDRD-OAQYLSRUSA-N 442.450 4.557 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2-c1ccccn1 1865703198 POYATSNQKDPDQQ-HSZRJFAPSA-N 449.514 4.941 50 10 IJGE Cc1nn(Cc2ccccc2)c2c1[C@@H](NC(=O)/C(C#N)=C/c1ccc(Cl)cc1)CCC2 1866127905 LYOSXRCAQYDPBH-FGGAIWKESA-N 430.939 4.994 50 10 IJGE CC(=O)c1ccc(-c2ccc(/C=N/NC(=O)CCCCCNC(=O)OC(C)(C)C)o2)cc1 1873793131 XXVKIFHXLFOGKH-WGOQTCKBSA-N 441.528 4.684 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 1880762982 ZZPUHVIUKCZAAS-ZIAGYGMSSA-N 435.403 4.558 50 10 IJGE CN(NC1CCC([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1)C(=O)OCc1ccccc1 1893745555 LHGFBRJIUVCATF-KBWCOIMZSA-N 431.577 4.575 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)C(=O)Cc1ccc(Br)cc1 1914215275 HYRTZKCCHYQIEJ-CQSZACIVSA-N 425.164 4.804 50 10 IJGE COc1nc(N(Cc2ccccc2)[C@@H](CBr)C(C)C)ncc1Br 1915308713 PAWLBDCCQKLAOF-HNNXBMFYSA-N 443.183 4.674 50 10 IJGE CC1(C)OC[C@H](Cc2cccc(Br)c2Br)[C@@H]1Br 1943886694 XIONLLPAZLXSHR-CABZTGNLSA-N 426.974 4.943 50 10 IJGE Clc1nc(N2CC[C@@H]3CC[C@H](C2)N3Cc2ccccc2)sc1CBr 1949586548 SQULQQMBOPYWOS-LSDHHAIUSA-N 426.811 4.935 50 10 IJGE Cc1ccc(C[C@H](Br)CN2C(=O)c3ccccc3C2=O)cc1C(F)(F)F 1995361106 UYZOMKIIWLVTEO-ZDUSSCGKSA-N 426.232 4.616 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC[C@H]1C[C@@H]1c1ccccc1 2022691451 RCVXRKPLHAOUMR-MDZRGWNJSA-N 445.341 4.525 50 10 IJGE CC(C)[C@@H](Br)[C@@H](C)NC(=O)c1cc(Br)ccc1Br 2041309122 XTEDTRGZVKUGEN-PRHODGIISA-N 441.989 4.749 50 10 IJGE CCCN1CC[C@@H]([C@H](Br)c2cccc(OCc3ccccc3)c2)S1(=O)=O 2089515990 UQPDUIQEPZUBQY-VQTJNVASSA-N 438.387 4.516 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2[C@]1(C)CCN(Cc2ccccc2)C1 2096813963 UUPKXEYVDZERGR-HXUWFJFHSA-N 433.781 4.862 50 10 IJGE CN(CCN(Cc1ccc(CBr)cc1)CC(F)(F)F)C(=O)OC(C)(C)C 2126465667 IQVJOBVSWFLYEY-UHFFFAOYSA-N 439.316 4.813 50 10 IJGE Clc1nc(N2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)sc1CBr 2213943008 XRDCGCKGJVPHNB-GASCZTMLSA-N 426.811 4.935 50 10 IJGE CN(CC[C@H](Br)c1ccccc1)C[C@@H]1CC1(Br)Br 2218005889 KVMKHGPHKUTYSY-STQMWFEESA-N 440.017 4.951 50 10 IJGE Cc1ccc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)c(CBr)n1 2271443991 JBLNMAFMXXPNLA-SFHVURJKSA-N 428.296 4.538 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 2274219768 ICCPFUBNWXOVFU-ROUUACIJSA-N 425.411 4.742 50 10 IJGE O=C(NCC1(CCl)CC(F)(F)C1)c1cc(Br)ccc1Br 2281663605 NPPQYORPBIBCAE-UHFFFAOYSA-N 431.502 4.596 50 10 IJGE O=C(N[C@H]1C[C@H]2C[C@H]1C[C@@H]2Br)c1cc(F)c(Br)cc1Cl 2282978154 JUORDSVHTGFGKE-ICKFKABQSA-N 425.523 4.533 50 10 IJGE C[C@H]1CO[C@@](CBr)(Cc2cc(I)ccc2Cl)C1 2307276455 WSJMWYSYPFGPAJ-NOZJJQNGSA-N 429.523 4.677 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@@H](Cc2ccc(F)cc2)C(=O)N1c1ccc(C(C)C)cc1 2314593358 LSAXYUNWLIDAHU-QFIPXVFZSA-N 449.551 4.678 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=CN(Cc2ccccc2)c2ccccc2)cc1 2318455265 PXAKOYCVZOIQGY-UHFFFAOYSA-N 425.488 4.916 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Br)c2)CC[C@@H]1Cl 2325213608 VGSQCXIPLFXXLS-ZDUSSCGKSA-N 442.566 4.893 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNC(=O)c1c(Cl)cc(F)cc1Cl 2340758248 SEOIDAOJMHYUPL-UHFFFAOYSA-N 443.393 4.768 50 10 IJGE CCOc1ccccc1N1CSC2=C(C#N)[C@@H](c3ccc(Cl)cc3)CC(=O)N2C1 9693224 FAIDMUPIZZIWQW-QGZVFWFLSA-N 425.941 4.958 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2Cl)cc1 38650984 QLRDIACLPHAUKV-DEOSSOPVSA-N 446.890 4.851 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3cccc([N+](=O)[O-])c3)ccc2[C@@H]1c1cccc(Cl)c1 38651272 NRKMNSHHTFYLLV-NRFANRHFSA-N 447.834 4.686 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccc([N+](=O)[O-])cc3)ccc2[C@H]1c1ccc(Cl)cc1 38651329 GLQVMTSXAKGVQL-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE Cc1ccc2c(CC(=O)N/N=C3\CCCc4oc(C(=O)OC(C)C)c(C)c43)coc2c1C 40826801 MKAOXTMVVUJKDR-LGUFXXKBSA-N 436.508 4.916 50 10 IJGE COc1cc(Cl)c(/C=N/NC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)cc1OC 66202186 HOBWPEHVCYMUED-FAJRRQPCSA-N 431.703 4.582 50 10 IJGE CCc1cc(CC(CBr)(CBr)c2ccc(Cl)cc2)n(C)n1 118876981 QRNOGIZOBQIFOW-UHFFFAOYSA-N 434.603 4.906 50 10 IJGE O=C(N[C@H](CBr)Cc1ccccc1)c1ccc(Br)c(Cl)c1 122435927 GWRNMFGWEAQXTA-ZDUSSCGKSA-N 431.555 4.839 50 10 IJGE CCCOc1ccccc1/C=C/C(=O)Oc1ccc(/C=C(/C#N)C(=O)NC(C)C)cc1OC 207004352 OOTALMXIZHJSCQ-COYSUQGBSA-N 448.519 4.534 50 10 IJGE CC(C)[C@H](CCBr)NC(=O)c1cc(Br)c(Br)s1 231123423 MBUKHWUASCOPQJ-QMMMGPOBSA-N 448.018 4.813 50 10 IJGE CCn1c(SCC(=O)NN=Cc2ccccc2F)nnc1-c1ccc(C(C)(C)C)cc1 254696217 JMSJWFRGXQYTPJ-UHFFFAOYSA-N 439.560 4.644 50 10 IJGE COc1cc(Cl)c([C@@H](Br)c2nn(C)cc2Br)cc1Cl 693120327 DFOXGXISDSFIBY-LLVKDONJSA-N 428.939 4.982 50 10 IJGE C[C@@H]1CO[C@](CBr)(Cc2cc(Cl)ccc2I)C1 718539007 YHUFWNMBDPHNGA-ZANVPECISA-N 429.523 4.677 50 10 IJGE CC(C)c1ccc(-c2noc(CCC(=O)NNc3ccc(C#N)cc3C(F)(F)F)n2)cc1 1325172988 IMFYLKDHVVCXGI-UHFFFAOYSA-N 443.429 4.826 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2ccc(-c3cc(O)n[nH]3)cc2)c(C)n1-c1ccc(F)cc1 1441187680 PEDZBJFOYRWCMJ-XDHOZWIPSA-N 441.466 4.875 50 10 IJGE CC(C)c1ccccc1NC(=S)NNC(=O)c1cc2cccc(C(F)(F)F)c2nc1O 1448549990 NIQDOTZLGDGYNX-UHFFFAOYSA-N 448.470 4.714 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=S)Nc3ccc(C)c(C)c3)cc2)cc1 1540443502 CTORBCNZKVJQLH-UHFFFAOYSA-N 433.533 4.930 50 10 IJGE C/C(=C/c1ccncc1)C(=O)NNC(=O)c1cc(-c2ccccc2Cl)nc2ccccc12 1608433062 XJGCQDBACKDOII-PEZBUJJGSA-N 442.906 4.815 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@@H]1CCN(C(=O)c2cc3c(C(F)(F)F)cc(O)nc3o2)C1 1634077285 XLHSZZNDMYSAKK-LLVKDONJSA-N 430.499 4.789 50 10 IJGE C=CCCN(OCc1ccccc1)C(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C 1634163764 ODIYBJGEUOSNSB-NHOMFQCRSA-N 433.552 4.727 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(SC(C)(C)C)c(F)c2)cc1 1670382100 SRVMJQZCHKUEOX-AWEZNQCLSA-N 447.532 4.539 50 10 IJGE N#CSc1ccc(NC(=O)C2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)cc1 1860603939 XNRYAUZEUFISGP-UHFFFAOYSA-N 433.455 4.769 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)c3ccc([N+](=O)[O-])cc3)n2)c(OC)c1OC 1872759653 VILQNBUCUWLDNN-SDXDJHTJSA-N 439.449 4.694 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1cccc(Cl)c1Br 1882087426 JRFUPLKQROSMTP-JTQLQIEISA-N 427.564 4.933 50 10 IJGE O=C(N[C@H](CCSC[C@@H]1C[C@H]1Cl)C(=O)O)OCC1c2ccccc2-c2ccccc21 1883551937 LCHJKTXRJOLIKT-LVXYXVKQSA-N 445.968 4.729 50 10 IJGE C[C@H](CC(=O)NC[C@H]1C[C@@H](Br)C1)c1ccc(NC(=O)OC(C)(C)C)cc1 1887793005 GFWSISWEUYWEGR-FMKPAKJESA-N 425.367 4.817 50 10 IJGE O=S(=O)(c1ccc(Br)cc1)N(Cc1ccccc1)C1(CCl)CCC1 1915762192 FYFSDWYOCNSXFC-UHFFFAOYSA-N 428.779 4.802 50 10 IJGE O=C(N[C@H]1CC[C@H](CBr)C1)c1cc(Br)c(Br)s1 1942368283 QVEOXVSVVDYRSD-BQBZGAKWSA-N 446.002 4.567 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@@](C)(CI)O2)C[C@@H]1C1CC1 1990240814 MCQSNYUQGYIWMC-FHLIZLRMSA-N 435.346 4.539 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)c1cccc(Br)c1CBr 2020224322 BUECEASOOKZCIF-AOOOYVTPSA-N 425.990 4.954 50 10 IJGE O=C(N[C@H](CCBr)C1CC1)c1cc(Br)cc(Br)c1 2029971695 MEROVYXBFZTDEV-GFCCVEGCSA-N 439.973 4.505 50 10 IJGE BrC[C@@H]1[C@H]2CCN(Cc3c(Br)cccc3Br)C[C@H]21 2033087883 XVDPSXGEYARWJJ-GMTAPVOTSA-N 438.001 4.674 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)c2c(C)[nH]c3ccccc23)ccc1O[C@H](C)C(=O)N(C)C 2040797401 FKCKZGDBZHCNCU-QGZVFWFLSA-N 445.519 4.520 50 10 IJGE CN(c1ncc(Br)c(CCl)n1)[C@@H]1C[C@@H]2C[C@H](OCc3ccccc3)C[C@@H]21 2134002226 WAOQWTYQAWOLND-IUVQAAGXSA-N 436.781 4.798 50 10 IJGE Cc1nn(-c2ccccc2)c(N(CCN(C)C)Cc2ccccc2)c1CBr 2152195869 HBLGZORLFYATGN-UHFFFAOYSA-N 427.390 4.644 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2Cc1nccn1Cc1ccccc1 2153120394 SCBTXSHBBNZLER-UHFFFAOYSA-N 444.764 4.577 50 10 IJGE FC(F)(F)[C@@H]1CN(c2c(CBr)ccc(Br)c2Cl)CCO1 2154373389 MMSWAAKBXMRKJW-VIFPVBQESA-N 437.481 4.765 50 10 IJGE Cc1cnc(N2C[C@@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)c(CBr)c1 2159684964 BRGGTIRMMSFSLO-ZRZAMGCNSA-N 426.402 4.777 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1C1CCN(C(=O)[C@@H](Br)C2CCCC2)CC1 2167034462 RXMIDRKDPWJQSP-ROUUACIJSA-N 443.426 4.578 50 10 IJGE CN(C(=O)c1ccc(Br)cc1Br)C1(CCl)CCSCC1 2171186843 ZIXXXERVSOJVCX-UHFFFAOYSA-N 441.616 4.788 50 10 IJGE CN[C@@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@@H](Br)C1 2260005165 FFOIOKDRMJSDEG-ZWBHMBAVSA-N 447.943 4.924 50 10 IJGE CC1(C)[C@H](Br)CC[C@H]1NC(=O)c1cc(Br)c(F)cc1Cl 2285836943 IEKMRMBFMJIWFE-VXGBXAGGSA-N 427.539 4.924 50 10 IJGE N#CC(=Cc1ccccc1OCc1ccccc1Cl)C(=O)NCc1ccc2c(c1)OCO2 2295672670 MSYINSPEVVKPTJ-UHFFFAOYSA-N 446.890 4.871 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)C[C@H](Br)C1CC1 2300241211 WKVUWOLKHHYCCG-NSHDSACASA-N 428.539 4.550 50 10 IJGE CC1=C(C#N)C(=O)N(CCc2ccccc2)C(=O)C1=CNc1cccc(Cl)c1Cl 2314579050 IMXYZSHSNOUECR-UHFFFAOYSA-N 426.303 4.741 50 10 IJGE Cc1nc(CCl)cc(Oc2cc(Br)cc(I)c2)n1 2316852318 BUUJLPREDNEDCJ-UHFFFAOYSA-N 439.478 4.683 50 10 IJGE C[C@H]1CCC[C@H](C)N1C=C(C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 2324605998 IPDGRCWTWVYUKB-GOTSBHOMSA-N 442.607 4.591 50 10 IJGE COc1ccc(NC=C(C#N)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c(OC)c1 2325383021 GUUGKGHUGUVKOP-UHFFFAOYSA-N 425.794 4.834 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2C[C@H]1CC[C@@H]2Br 2327391840 MNFLSZNMRGAXRB-WQAKAFBOSA-N 440.550 4.692 50 10 IJGE COC[C@H]1C[C@@H](Cc2cc(I)ccc2Cl)[C@H](Br)C1 2327404995 AAXUFZHFKDVLRG-OUJBWJOFSA-N 443.550 4.923 50 10 IJGE COc1ccc(Cl)cc1-c1csc(C(C#N)=C(O)[C@H]2CC(=O)N(C(C)(C)C)C2)n1 2331410872 MROFBBIGAPFDJL-LBPRGKRZSA-N 431.945 4.912 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)C1CCC(C(F)(F)F)CC1 2343416443 QCHGIQPNSRVSRU-OFLPRAFFSA-N 436.312 4.842 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@H]1CC12CCC(F)(F)CC2 2343416827 TYOWYFCIKUAPQX-IAGOWNOFSA-N 430.333 4.689 50 10 IJGE CCCc1nn(-c2ccccc2)c2c1[C@H](c1ccc(OCC)c(OCC)c1)C(C#N)=C(N)O2 1472064 IMKOATWPJBYHRH-HSZRJFAPSA-N 444.535 4.840 50 10 IJGE CC[C@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)COc1ccc(-c2ccccc2)cc1 9873675 UYAXXNKBKQAICV-PMACEKPBSA-N 446.547 4.861 50 10 IJGE COc1ccc(/C=C/C(/C=C/c2ccc(OC)cc2)=NNC(=O)c2cccc(O)c2)cc1 18194433 NKPFCFGDCYYNBZ-PWHKKFIBSA-N 428.488 4.922 50 10 IJGE COc1ccc(/C=C\C(=O)NNC(=O)COc2ccc(C(C)(C)CC(C)(C)C)cc2)cc1 33377507 YLVIRAAWQRXUJY-SXGWCWSVSA-N 438.568 4.649 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1OCc1ccccc1 40144518 UVPDBDJXALIJHK-XDHOZWIPSA-N 429.432 4.728 50 10 IJGE O=S(=O)(c1cc(CCl)sc1Br)N(Cc1cccs1)C1CC1 91271083 OYAZZKNDKKWHIG-UHFFFAOYSA-N 426.810 4.664 50 10 IJGE CC(C)(CBr)COc1c(Br)cc([N+](=O)[O-])cc1Br 96869931 GHUNMUIKAPLGET-UHFFFAOYSA-N 445.933 4.920 50 10 IJGE N#C/C(=C/Nc1ccccc1C(N)=O)c1nc(-c2ccc(Br)cc2)cs1 102420277 ZKUWXUCOYBFLIX-RAXLEYEMSA-N 425.311 4.648 50 10 IJGE BrCCN(Cc1ccccc1)Cc1ccc(I)cc1 126491980 MGLKLGPJEIWGIC-UHFFFAOYSA-N 430.127 4.688 50 10 IJGE CCO[C@@H]1[C@@H](Br)C[C@@H]1Oc1c(Br)cccc1Br 229342619 CSFWSAAYDONJIV-JBLDHEPKSA-N 428.946 4.531 50 10 IJGE CC1(C)CCC(O[C@@](C)(CI)CNC(=O)OC(C)(C)C)CC1 231320585 FDGLCNLMWADERJ-KRWDZBQOSA-N 425.351 4.690 50 10 IJGE CCCCN(CCCl)C(=O)c1cc(Br)ccc1I 232988506 BTSYEUKTXQIRAO-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE CCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)COc3cccc(C)c3)cc2)cc1 254393191 SNKUKHDANCZIGK-UHFFFAOYSA-N 446.503 4.532 50 10 IJGE C[C@@H]1C[C@H](O[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2I)CC(C)(C)C1 299976517 CYWJNCPXJSGFOO-BARDWOONSA-N 437.362 4.641 50 10 IJGE ClCc1sc2c(I)cccc2c1I 306613437 NUEBKUBQYVBHPP-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE Cn1ncc(Br)c1[C@@H](Br)c1cc(F)c(Br)cc1F 693060269 DBFNWORULWQGNE-JTQLQIEISA-N 444.899 4.708 50 10 IJGE Cc1ccccc1NNC(=O)c1ccccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1 746682820 SPJZFXGNWCJKPP-UHFFFAOYSA-N 449.454 4.572 50 10 IJGE CN(Cc1c(F)cccc1Cl)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 914462910 HUUPOYSCVKZXAS-QGOAFFKASA-N 447.901 4.822 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2cc(C)n(-c3cccc(C(=O)OC(C)C)c3)c2C)cc1 1084115694 UIQWSVVHLGGZKF-UHFFFAOYSA-N 447.535 4.822 50 10 IJGE CC[C@@H](Oc1ccc2ccccc2c1Br)C(=O)NN=Cc1ccccc1OC 1084341907 OFHKZAGLJBOVJD-GOSISDBHSA-N 441.325 4.919 50 10 IJGE CCCCC(C)=NNC(=O)CSc1nnc(CNc2ccccc2)n1-c1ccccc1 1084356790 FUXIUIOZVZREEK-UHFFFAOYSA-N 436.585 4.654 50 10 IJGE N#C/C(=C\c1cc(Br)c(N2CCOCC2)o1)c1cccc(C(F)(F)F)c1 1084594215 LATPYHJWLVYPTE-UKTHLTGXSA-N 427.220 4.962 50 10 IJGE C/C(=C\C(=O)NNC(=O)CSc1ccc(Cl)cc1)c1ccccc1C(F)(F)F 1135577419 PKOYZKNWLPJLNL-ZRDIBKRKSA-N 428.863 4.702 50 10 IJGE Cc1ccc(Br)c2cc(C(=O)NNc3nc4ccccc4[nH]c3=S)[nH]c12 1301150435 VWMIPXHKLUDJFW-UHFFFAOYSA-N 428.315 4.602 50 10 IJGE C/C(=C\c1ccc(F)cc1)C(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(C)c1C 1465160795 MNMUODRVNKLLJA-BMRADRMJSA-N 442.494 4.688 50 10 IJGE CC1=C(C#N)C(=O)N(C[C@@H]2CCCO2)C(=O)/C1=C\Nc1ccc(N=Nc2ccccc2)cc1 1772742740 AANCYKFPSMORQE-GTSVOVDOSA-N 441.491 4.786 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccccc1Cl 1865691153 KQKVKMDXCBGCTI-QFIPXVFZSA-N 432.911 4.676 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@@H]1c1ccccc1O 1865708033 MGJCXKDTAHJCBW-MRXNPFEDSA-N 446.816 4.527 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1cnsc1Br 1887459349 YKCCKINZJMCQOW-UHFFFAOYSA-N 432.181 4.722 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1Cl 1914639251 RWIZKFOLFHUSKV-GFCCVEGCSA-N 437.186 4.968 50 10 IJGE C[C@@H]1OCCO[C@@H]1[C@@H](Br)c1cc(Br)c(Br)s1 1935543613 RZCGAFWUBMKJAJ-HQLVHBAOSA-N 434.975 4.513 50 10 IJGE BrCCN(Cc1ccc(Br)cc1Br)CC1CC1 1943852507 UPJIBQXOWWWDCB-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE CC1(C)OC[C@H](Cc2c(Br)cccc2Br)[C@@H]1Br 1945330435 LEHHXRSWYOUPJC-UFBFGSQYSA-N 426.974 4.943 50 10 IJGE CC[C@@H](CCCBr)NC(=O)c1c(Br)cccc1Br 2036509408 DVSLKDDRUWCVKX-VIFPVBQESA-N 441.989 4.895 50 10 IJGE CC(C)[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](CC(F)(F)F)C1 2055946996 CWYOJNLLQUEIIH-ZIAGYGMSSA-N 431.337 4.527 50 10 IJGE CN(c1ncc(I)cc1Br)[C@@H]1CCCCC[C@@H]1Cl 2069528695 LEHVMOYCQVMZBJ-NWDGAFQWSA-N 443.554 4.825 50 10 IJGE C[C@H](Cl)c1nc2cc(I)ccc2n1C[C@@H]1C[C@@H]1Br 2076170242 HAQXLAJKUBZBSB-NRPADANISA-N 439.522 4.724 50 10 IJGE C[C@@H]1CN(C[C@@H](CBr)c2ccccc2)C[C@@H](C)N(C(=O)OC(C)(C)C)C1 2106786909 HCEVZFPOISWKEQ-ZHALLVOQSA-N 425.411 4.742 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Br)c1cnc(Cl)n1C 2138246563 PEIASRHDXALFEW-SNVBAGLBSA-N 428.939 4.982 50 10 IJGE O=C(N[C@H]1CN(Cc2ccccc2)CC2(CCC2)C1)c1ccc(CBr)cc1 2151129166 YPYMCDVVBCBWKH-OAQYLSRUSA-N 427.386 4.756 50 10 IJGE CCn1cc(Br)c([C@H](Cl)c2cc(Br)c(F)cc2OC)n1 2181179233 YMKKZYCKQASLSR-GFCCVEGCSA-N 426.511 4.904 50 10 IJGE C[C@@H](Br)CCCc1cn(-c2cc(F)c(Br)c(Cl)c2)nn1 2189285789 ZOCSJCPYHASHAC-MRVPVSSYSA-N 425.527 4.928 50 10 IJGE ClCCc1nc2cc(I)ccc2n1Cc1nc(Cl)cs1 2197072464 CPBFZIBZIRTWTJ-UHFFFAOYSA-N 438.121 4.580 50 10 IJGE Cc1cc(C(=O)N2[C@@H](CBr)CCC23CCC3)ccc1I 2207103881 DPZHDWIWMYVAJX-CYBMUJFWSA-N 448.142 4.522 50 10 IJGE Cc1cc(Br)c([C@H](Cl)c2nn(C)nc2Br)c(C)c1Cl 2226973832 DKPKOPGGHKRHDQ-JTQLQIEISA-N 427.955 4.939 50 10 IJGE CC1(C)C[C@H](CBr)N(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285843799 DSLGIWDKVFRPRB-MRVPVSSYSA-N 427.539 4.877 50 10 IJGE Cc1nn(-c2ccccc2)c(O[C@H]2CCN(Cc3ccccc3)C2)c1CBr 2287642437 DWJNJYNVFCVWNX-FQEVSTJZSA-N 426.358 4.729 50 10 IJGE C[C@H](Br)C[C@@H]1CCCCN1Cc1sccc1I 2301076974 RPCVRBNMWAIZIG-QWRGUYRKSA-N 428.177 4.881 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1Cc1ccc(Cl)cc1I 2302325814 KPPFLPQBPPFPMZ-AAEUAGOBSA-N 428.539 4.692 50 10 IJGE FC1(F)CC[C@@H]1CO[C@@H](CI)c1ccccc1Br 2313738100 WYJWAKBSWKZMPU-SKDRFNHKSA-N 431.058 4.987 50 10 IJGE C[C@H]1CC[C@H](CBr)CN1Cc1ccc(Cl)c(I)c1 2315551059 LMKNPSMLJDSSOF-CMPLNLGQSA-N 442.566 4.940 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@]3(F)CCC[C@@]3(NC(=O)OC(C)(C)C)C2)C1 2345008196 LXNVZEQSUSKNNM-WOJBJXKFSA-N 433.406 4.659 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@](C)(CBr)C(C)(C)C)[C@@H](C(F)(F)F)C1 2352076622 JABOTJPOHPBBOF-CXAGYDPISA-N 445.364 4.917 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CCCC[C@H]2C[C@@H]1CNC(=O)[C@H](Br)C1CCCC1 2358977202 RHCOGNIATMOWMG-XWTMOSNGSA-N 443.426 4.625 50 10 IJGE CC(C)[C@@H](Br)C(=O)N1CCC(CC2CCN(C(=O)OC(C)(C)C)CC2)CC1 2361054677 LRHRBCJXTHCSRO-GOSISDBHSA-N 445.442 4.682 50 10 IJGE CCCOc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1Br 14647260 JASMHSDHPKXCMF-UHFFFAOYSA-N 446.128 4.620 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccccc4Cl)ccc32)cc1 38649219 MELYJTMDEJOVMQ-DEOSSOPVSA-N 446.890 4.851 50 10 IJGE CCc1ccc(OCC(=O)NNC(=O)COc2ccc(C(C)(C)CC(C)(C)C)cc2)cc1 40844443 GNEWQMGZMVHBPE-UHFFFAOYSA-N 440.584 4.568 50 10 IJGE CCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)CCc2ccc(C(C)C)cc2)c(OC)c1 40996240 PNUMLJZPZBQGKS-PXLXIMEGSA-N 434.536 4.790 50 10 IJGE COc1ccc([C@@H](C(=O)NC2CCCCC2)N(Cc2ccc(F)cc2)C(=O)CCl)cc1 97914316 RIMDTUNVGDTATQ-QHCPKHFHSA-N 446.950 4.592 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Cl)c3cc(F)cc(Br)c3)cc2[nH]1 109883696 MNTBAROLDIBZKE-ZDUSSCGKSA-N 434.490 4.849 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@@H]1Br)c1ccc(Br)cc1Cl 123839232 FHNLBEXOWJRGEA-ZFWWWQNUSA-N 429.539 4.893 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCCOC1CC1 711719651 PBWMWVRYECQLPI-UHFFFAOYSA-N 428.946 4.664 50 10 IJGE CN1CCC[C@@H](CNC(=O)NNc2nc(Cl)c(Cl)cc2Cl)[C@@H]1c1cccs1 745850330 WUUGDDPHKPSJNB-IINYFYTJSA-N 448.807 4.813 50 10 IJGE CCc1ccc(O)c(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)c1 759741262 CMSKTPRSDMRQBP-QGOAFFKASA-N 445.910 4.931 50 10 IJGE O=C(NNc1ccc(Br)nc1)c1csc(-c2cccc3ccccc23)n1 778505084 CFDKCNDWCUARNQ-UHFFFAOYSA-N 425.311 4.878 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2cccc(OCc3cccnc3)c2)c(C(F)(F)F)c1 799388107 RGOJAFBCCMAMDF-UHFFFAOYSA-N 427.386 4.700 50 10 IJGE Cc1ccccc1OCC(=O)NN=Cc1c(Br)c(C)n(-c2ccccc2)c1C 1084418205 ATPDLSDYVANVKB-UHFFFAOYSA-N 440.341 4.694 50 10 IJGE O=C(NNC(=O)[C@@H]1C[C@H]2CC[C@H]1C2)c1ccc(CSc2nc3ccccc3s2)cc1 1087068707 WMIVDVOMUFENBJ-RYQLBKOJSA-N 437.590 4.786 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cccc3c(Br)cccc23)c1C 1306606223 CFVVWEVFBBPTGF-UHFFFAOYSA-N 448.324 4.828 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2cccc3nc(O)[nH]c23)c(C)n1-c1ccc(Cl)cc1 1468618009 YVTOEUYLYOCSDB-LFIBNONCSA-N 431.883 4.875 50 10 IJGE Cc1occc1C(=O)NN=C1CCCc2oc(C(=O)Oc3cccc4cccnc34)c(C)c21 1772748260 BAYZMHNPCORERJ-UHFFFAOYSA-N 443.459 4.727 50 10 IJGE O=C(CSc1nc2ccccc2s1)NN=C(c1ccccc1)[C@@H](O)c1ccccc1 1772760549 COGXMSGESSQJQK-QFIPXVFZSA-N 433.558 4.643 50 10 IJGE C[C@@H](Br)C(C)(C)CNC(=O)c1cccc(Br)c1Br 1913831443 DMHUGPVFWBPQIJ-MRVPVSSYSA-N 441.989 4.751 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cc(F)ccc1Cl 1915077450 IKVLCGDZDIQGOT-AWEZNQCLSA-N 434.758 4.844 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1nn(C)c(Cl)c1Cl 1915292809 DZOJEJZWNGITIC-ZDUSSCGKSA-N 433.177 4.789 50 10 IJGE O=C(c1cncc(Br)c1)N(Cc1ccccc1)C1(CBr)CCC1 1915742079 RPIYTVWPLBJCAG-UHFFFAOYSA-N 438.163 4.804 50 10 IJGE CC[C@@H]1CN(C(=O)c2csc(Br)c2Br)C[C@H]1Br 1945187630 YOJHLHXJDVCKAP-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE C[C@H](CCBr)CCN1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]1C(F)(F)F 2052477554 GTKBSBWDVQJPJV-MCIONIFRSA-N 431.337 4.670 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)C(C)(C)C)C[C@H]1C(F)(F)F 2066632826 JWEWQNYNDCPEDB-STQMWFEESA-N 431.337 4.527 50 10 IJGE Brc1ccc(CN2CC[C@H](Br)[C@@H]2C2CC2)c(Br)c1 2067015098 FUFNCDSMCOWPJO-JSGCOSHPSA-N 438.001 4.959 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C[C@@H](CBr)c2ccccc2)CC1(C)C 2106786195 SVYQJDVSODFSCB-MSOLQXFVSA-N 425.411 4.790 50 10 IJGE ClCCC1(NCc2ccc(I)c(Cl)c2)CCSCC1 2142949902 NHRKMYFVICXHDV-UHFFFAOYSA-N 430.182 4.929 50 10 IJGE C[C@@](CCl)(Nc1ncc(C(F)(F)F)cc1I)C(F)(F)F 2161366588 KUYKNRNULKDOKM-QMMMGPOBSA-N 432.533 4.677 50 10 IJGE C[C@@H](Br)CN(c1ncc(Br)cc1Br)C(C)(C)C 2250593041 UTUFQEYOWDRVKC-MRVPVSSYSA-N 428.994 4.995 50 10 IJGE COC1(CO[C@H](CI)c2ccc(Br)cc2)CCC1 2254949580 JALWMKYRAINAKX-CYBMUJFWSA-N 425.104 4.511 50 10 IJGE O=C(NCCCCCCI)c1cccc(Cl)c1Br 2256124983 GMOPKOPOLDLDIM-UHFFFAOYSA-N 444.538 4.828 50 10 IJGE CC(C)(C)OC(=O)NCCCCCCCCCC(=O)NC[C@H]1C[C@@H](Br)C1 2269422927 LOSCUGGNXLWLCH-CALCHBBNSA-N 433.431 4.922 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@H](Br)[C@@H]2CC[C@@H]21 2282990865 XTXXMDROSCBPGS-XICLSFFLSA-N 425.523 4.630 50 10 IJGE Cc1c(CBr)cccc1NC(=O)c1ccc(F)cc1I 2283561330 SKYISWYCGDPMKH-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3cccc(C(=O)OC)c3)c2C)cc1 2294168489 NVUQOEWPWIUOPS-UHFFFAOYSA-N 443.503 4.825 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@H]2C[C@H]3CC[C@H](C3)C2)CC1 2299581609 AQCXOLHURUDJPK-MUJYYYPQSA-N 449.373 4.786 50 10 IJGE BrC[C@@H]1CCC2(CCC2)N1Cc1sccc1I 2301073826 MCFYOFBVKTWMOO-JTQLQIEISA-N 426.161 4.635 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@@H](C3CN(C(=O)OC(C)(C)C)C3)C2)C1 2345018170 AVLFMSWEKAOTGX-MRXNPFEDSA-N 429.443 4.767 50 10 IJGE O=C(c1ccc(Cl)cc1I)N1CCC[C@H](CCCl)CC1 2365598605 RCSLMIYVJUZLGJ-LLVKDONJSA-N 426.125 4.816 50 10 IJGE COc1ccc2nc(N(/N=C/c3ccc([N+](=O)[O-])o3)C(=O)C3CCCCC3)sc2c1 9629588 XITPNHHXZHLPRF-CIAFOILYSA-N 428.470 4.754 50 10 IJGE CC[C@@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)COc1ccc(Cl)cc1C 10683239 XBHDUGVJSSMAKI-DNVCBOLYSA-N 432.948 4.546 50 10 IJGE CCOC(=O)COc1ccc(/C=C(\C#N)c2nc(-c3ccc(F)cc3)cs2)cc1OC 35519881 OTFZFYFGTRHAHE-LICLKQGHSA-N 438.480 4.964 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)COc3ccccc3)ccc2[C@H]1c1cccc(Cl)c1 38651143 UQKCYSOPXFZDCK-HSZRJFAPSA-N 432.863 4.543 50 10 IJGE C=CCNC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(-c3ccccc3)cc1)CCC2 40822661 XGSDSPMNKXNZNY-SGWCAAJKSA-N 427.504 4.641 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)NNC(=O)c2ccccc2CCc2ccccc2)cc1 40846596 ZWUONTPQXFPRFF-UHFFFAOYSA-N 430.548 4.609 50 10 IJGE CCOc1ccccc1OCC(=O)N/N=C/c1ccc(OCc2ccccc2C)c(OC)c1 40911523 NRYHECXWOAYWSA-JVWAILMASA-N 448.519 4.510 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)NC(C)C)ccc1OCc1ccc(Br)cc1 59272315 ACDIOOKGNKRIRQ-WOJGMQOQSA-N 443.341 4.858 50 10 IJGE CCCCCCOc1c(OC)cc(/C=N\NC(=O)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] 169901864 RXUAOSLDIDFGPT-IWIPYMOSSA-N 447.919 4.909 50 10 IJGE Cc1cc(C=NNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c(C)n1-c1ccccc1 254766667 OIYLPMKRHQKGFW-UHFFFAOYSA-N 448.526 4.713 50 10 IJGE C[C@@H]1C[C@@H](n2c(CCCl)nc3cc(Br)cnc32)CN1Cc1ccccc1 398003327 PBBFPDMTNQJBLM-RHSMWYFYSA-N 433.781 4.811 50 10 IJGE FC(F)Oc1cc(I)c(CBr)cc1C(F)(F)F 575723607 RIGCCWISTQXEJV-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE Cc1ccc(F)c(NNC(=O)C2(c3ccccc3)CCN(C(=O)OC(C)(C)C)CC2)c1 748784649 CQCCMLJLGWHKOR-UHFFFAOYSA-N 427.520 4.546 50 10 IJGE Cc1ccccc1CC(=O)NN=Cc1c(C)nn(-c2cccc(C(F)(F)F)c2)c1Cl 763182562 IGLAIPWXQNXCDI-UHFFFAOYSA-N 434.849 4.854 50 10 IJGE CCCCC(=O)NN=Cc1ccc(Sc2nc3ccccc3c(=O)n2-c2ccccc2)o1 1083973046 HQKJABIEYDJCJF-UHFFFAOYSA-N 446.532 4.770 50 10 IJGE N#CCOC(=O)c1cc(-c2ccc(/C=C(\C#N)C(=O)Nc3ccccc3)o2)ccc1Cl 1084210810 HBEDUXOAPWHKCZ-FOWTUZBSSA-N 431.835 4.826 50 10 IJGE C=CC[C@]1(C(=O)N2CC[C@H](O[Si](C)(C)C(C)(C)C)C2)CCCN1C(=O)OC(C)(C)C 1470550373 BKSMIKMDNHQVGQ-FDDCHVKYSA-N 438.685 4.955 50 10 IJGE C=C(C)[C@H](NC(=O)NNC(=O)c1ccc(OCCC(C)C)cc1)c1ccc(F)c(F)c1 1671852328 WCDDGMXNWBQEBX-NRFANRHFSA-N 431.483 4.651 50 10 IJGE CCc1nn(-c2ccc(OC)cc2)c2c1[C@H](c1ccc(C(C)(C)C)cc1)C(C#N)=C(N)O2 1865682838 YPBAKCJMAQBKQZ-JOCHJYFZSA-N 428.536 4.959 50 10 IJGE CCc1nn(Cc2ccccc2F)c2c1[C@@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 1865686660 YTZYBDZWILTXJF-GOSISDBHSA-N 426.854 4.644 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)c3ccccc3C(F)(F)F)c(C)n2)cc1 1865758582 IBCBIWJIGYHZML-UHFFFAOYSA-N 427.426 4.713 50 10 IJGE Cc1nc(NC(=O)/C(C#N)=C/c2ccc(Br)cc2)sc1C(=O)OCC(C)C 1866128858 PRAAWVMEGZFXCQ-RIYZIHGNSA-N 448.342 4.573 50 10 IJGE N#C/C(=C(/O)CCCN1C(=O)c2ccccc2C1=O)c1nc(-c2ccc(F)cc2)cs1 1872751744 DKQJCGJCYMNIRJ-ZZEZOPTASA-N 433.464 4.818 50 10 IJGE CN[C@H](c1c(C)c(Br)cc(C)c1Br)[C@@H]1C[C@@H]1Br 1910989924 BLLCRPUVCUQDSC-DVYJOKAKSA-N 425.990 4.872 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)c1nccn2nc(C(F)(F)F)cc12 1915083215 OJZZUNSBWVJUNP-AWEZNQCLSA-N 427.268 4.928 50 10 IJGE CC1(C)CC[C@]2(CC[C@H](CI)O2)[C@H](CNC(=O)OC(C)(C)C)C1 1927121581 JTHSQUZVHBNOLG-PMUMKWKESA-N 437.362 4.690 50 10 IJGE C[C@@H]1OCCO[C@@H]1[C@@H](Br)c1cc(Br)sc1Br 1935544133 ZMBXYBCWJUXTII-HQLVHBAOSA-N 434.975 4.513 50 10 IJGE CC(C)N1C[C@H](Br)[C@H](c2c(Br)cccc2Br)C1 1950852598 ZVENDVCXTRCZRS-SKDRFNHKSA-N 425.990 4.783 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCc2cc(Br)ccc2C1 1975076819 OAKJXDVACNZIKJ-UKRRQHHQSA-N 433.184 4.842 50 10 IJGE CCN[C@H](c1cc(Br)c(C)cc1Br)[C@H]1C[C@@H]1Br 2020191281 VPDFRFIIYFKBSQ-TVYUQYBPSA-N 425.990 4.954 50 10 IJGE CCC(CC)(CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1 2066631536 BGDHIUZRHBZHJU-CYBMUJFWSA-N 431.337 4.671 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Br)c2cc(F)cc(Br)c2)c1 2093075604 YPPDOIDXKIMDGR-LBPRGKRZSA-N 428.142 4.538 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCCC2(CCC2)[C@@H]1NC(=O)CCCCBr 2106299200 VXCZMVXIQCKMGX-DOTOQJQBSA-N 431.415 4.532 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@H](C)[C@H](NC(=O)C(F)(F)F)[C@@H]1C 2106781012 DPEVQDHCVKLEQT-KKUMJFAQSA-N 429.365 4.745 50 10 IJGE CCn1cc(Br)c([C@H](Cl)c2sc(COC)cc2Br)n1 2124767412 CFCCNJWBYYWVSB-JTQLQIEISA-N 428.577 4.964 50 10 IJGE Clc1ccccc1C(CBr)(CBr)COC[C@@H]1CCCO1 2149039686 YCYYHNZAFRZKTI-LBPRGKRZSA-N 426.576 4.563 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCC[C@@H]2NC(=O)[C@H](Br)C2CCCC2)CC1 2167050731 NUUJFNUNSSFKGI-DLBZAZTESA-N 443.426 4.626 50 10 IJGE Brc1ccccc1[C@@H](CI)OC1CC(n2cccn2)C1 2183662573 KRLRHOHQAXNBBU-KOHJWAIASA-N 447.114 4.542 50 10 IJGE CC(C)CNCc1cc(Br)cc(Br)c1OC[C@@H]1C[C@H]1Cl 2196897178 VTVQZXSOVIGYQK-SMDDNHRTSA-N 425.592 4.963 50 10 IJGE ClCC1(NCc2ccc(I)c(Br)c2)CCCC1 2306216482 GQYNKVTYZFDDIL-UHFFFAOYSA-N 428.539 4.695 50 10 IJGE Cl[C@H]1CCC[C@H]1CNCc1ccc(I)c(Br)c1 2306221349 GZNHOCBHXFDTAY-JQWIXIFHSA-N 428.539 4.551 50 10 IJGE CCCN(Cc1cc(I)ccc1Cl)C[C@H](C)Br 2307334058 LVURYFVGIXYCIB-JTQLQIEISA-N 430.555 4.940 50 10 IJGE CN(CCCCCBr)Cc1cc(I)ccc1Cl 2307334679 UEXLYYXBUOJANY-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE Clc1ccc(CN2C[C@H](Br)[C@H](C3CC3)C2)c(I)c1 2318557927 POEJYIUZSMLGGP-STQMWFEESA-N 440.550 4.550 50 10 IJGE Cc1cc(Br)c(F)c(C(=O)N[C@@H](CCCl)COCc2ccccc2)c1 2320560961 JOQACENIGISYOR-HNNXBMFYSA-N 428.729 4.841 50 10 IJGE CCOc1c(Br)cc(C=NNC(=O)Nc2ccccc2)cc1Br 2323064985 JCVSOLDNHZROST-UHFFFAOYSA-N 441.123 4.766 50 10 IJGE Cl[C@@H]1CC[C@H]2C[C@H]1CN2Cc1ccc(I)c(Br)c1 2325205977 ABDDRNRMIBDMLX-GMXVVIOVSA-N 440.550 4.645 50 10 IJGE Cl[C@H]1C[C@@H]2C[C@H]1C[C@H]2NCc1ccc(I)c(Br)c1 2325231836 XGUNBOJZCMPMPQ-JYYRZZBQSA-N 440.550 4.549 50 10 IJGE Cl[C@@H]1C[C@@H]2C[C@H]1C[C@@H]2NCc1ccc(I)c(Br)c1 2325231838 XGUNBOJZCMPMPQ-XVMOGABASA-N 440.550 4.549 50 10 IJGE O=C(C=Cc1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc(-c2ccc3ccccc3c2)s1 2328785132 ATJDUNYKLCSWBW-UHFFFAOYSA-N 443.484 4.951 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Cl)[C@H]1C[C@H](S(C)(=O)=O)C1 2365175401 GRZFLAFIEKDYOO-UBJUHAIHSA-N 448.579 4.762 50 10 IJGE COc1ccc(CN(C(=O)CCl)[C@@H](C(=O)NC2CCCCC2)c2cccs2)cc1 3033968 ANRWOGLZFAYXEB-OAQYLSRUSA-N 434.989 4.514 50 10 IJGE Cc1ccc(C(=O)Oc2ccc(/C=C(/C#N)C(=O)Nc3ccccc3[N+](=O)[O-])cc2)cc1 33364408 HLQGSEBMJCHPEL-RGEXLXHISA-N 427.416 4.668 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccc(C)cc3)c(OC)c2)C1=O 38603539 WDEQMZBDQTVENL-FYJGNVAPSA-N 430.504 4.585 50 10 IJGE CCc1ccc(OCC(=O)N/N=C/c2ccc(OCc3ccc(C)cc3)c(OC)c2)cc1 40911142 ICEDOZNAYMRMFX-JVWAILMASA-N 432.520 4.674 50 10 IJGE COC(=O)c1ccc(COc2ccccc2/C=C(/C#N)C(=O)Nc2ccc(C)cc2)cc1 97993162 KQBWWUTUFCKFJL-JCMHNJIXSA-N 426.472 4.906 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CBr)OCc1cccc(Br)c1 231319405 AUFWYABRTMMFOM-INIZCTEOSA-N 437.172 4.644 50 10 IJGE C=CCOc1ccc(C(=O)NN=Cc2ccc(OC(=O)c3ccccc3)c(OCC)c2)cc1 254612014 KNYLZFDHMVUCCI-UHFFFAOYSA-N 444.487 4.633 50 10 IJGE CCCCCOc1ccc(O[C@@H](C)C(=O)NN=Cc2cc(OC)ccc2OCC)cc1 254844169 XONVKNXGLOPWLA-SFHVURJKSA-N 428.529 4.581 50 10 IJGE COc1ccc(Cl)cc1[C@H]1CN(Cc2ccccc2)C[C@H]1CI 382685135 FAUYSQJURSLDAN-QAPCUYQASA-N 441.740 4.999 50 10 IJGE FC(F)(F)c1cc(I)c(Br)cc1CBr 575691292 GOYBHUWMCRLXQL-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE Fc1ccc2nc(CCl)n([C@H]3[C@@H]4CN(Cc5ccccc5)C[C@@H]43)c2c1Br 689722711 GSLZTNWWMPACJL-BDQBCWGISA-N 434.740 4.980 50 10 IJGE C[C@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1nc3sccn3c1CBr)C2 705962852 MORLNJHKIVSHQH-NHCUHLMSSA-N 445.430 4.639 50 10 IJGE CC[C@H](C[C@@H](C)Br)NCc1cc(Cl)ccc1I 716806059 AZOXFHIADKBXIU-BXKDBHETSA-N 430.555 4.986 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=S)Nc3cc(Cl)cc(Cl)c3)n[nH]2)cc1C 764498593 WOPGOJKVLZLXBR-UHFFFAOYSA-N 434.352 4.632 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 775983447 MQEDTCRHWUWPED-ZDUSSCGKSA-N 439.743 4.606 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)c2ccc(C(F)(F)F)cc2)c1C 791191733 WVVNOKHADKRHBZ-GDXCHIGESA-N 448.441 4.664 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)OCc2ncccn2)c(C)n1-c1cccc(C(F)(F)F)c1 791287219 DOHPBQKQVFXUFJ-YVLHZVERSA-N 426.398 4.553 50 10 IJGE CC(=O)c1cc(C(=O)NNc2cc(Cl)ccc2Br)ccc1OC(C)C 1177458431 ZHDZBXZSXBSTHD-UHFFFAOYSA-N 425.710 4.849 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccn(-c3ccccc3C(F)(F)F)n2)c(C(F)(F)F)c1 1321223177 XFOGOWVRSLKMAR-UHFFFAOYSA-N 439.319 4.538 50 10 IJGE C=CCO[C@H]1CCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3cccc4ccccc34)c2C)C1 1435663947 CRNSWMFSEJZJBQ-ZBDCHNAPSA-N 425.532 4.958 50 10 IJGE C#CC1CCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Br)cc3)c2C)CC1 1537388532 IRLIESBQRWUCCQ-ZHZULCJRSA-N 436.353 4.635 50 10 IJGE COc1ccc(C(=O)NN=C2CCCc3oc(C(=O)Oc4ccc(C)cc4)c(C)c32)cc1 1772745668 GPAGGUSDWORFIJ-UHFFFAOYSA-N 432.476 4.595 50 10 IJGE Cc1c(C(=O)Nc2nccs2)oc2c1C(=NNC(=O)c1cccc3ccccc13)CCC2 1772748426 QBZXNKXCDXTZDQ-UHFFFAOYSA-N 444.516 4.920 50 10 IJGE CCOC(=O)c1c(-c2ccc(C)c(C)c2)csc1NC(=O)CI 1865947400 CJKMAKQLTBZGAR-UHFFFAOYSA-N 443.306 4.582 50 10 IJGE CCOc1ccccc1OC/C(O)=C(\C#N)c1nc(-c2ccc3c(c2)OCCO3)cs1 1872750496 FLJYONIDVAQCQG-VLGSPTGOSA-N 436.489 4.852 50 10 IJGE N#C/C(=C(O)\C=C/c1ccc2c(c1)OCCO2)c1nc(-c2ccc3c(c2)OCCO3)cs1 1872750839 MHCDNBXDHHZDBE-OZAFKZOASA-N 446.484 4.859 50 10 IJGE C[C@@H](c1ccc(Br)cc1F)[C@@H](CBr)NC(=O)OC(C)(C)C 1885096352 IQFLLDCMYNNODM-TVQRCGJNSA-N 425.136 4.980 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@@H](OCC2CCCCCCC2)C1 1902602513 PJHYLGKKHZGQDJ-HOTGVXAUSA-N 437.362 4.786 50 10 IJGE CN(CC(C)(C)CI)[C@@H]1C[C@@H]2C[C@H](OCc3ccccc3)C[C@H]21 1904649637 WIGPJQVCVONPEV-INDMIFKZSA-N 427.370 4.763 50 10 IJGE CC(C)(C)OC(=O)N(CC1CC1)C1CCN(C[C@@H](CBr)C2CCC2)CC1 1966286109 TWHGYAJNWFCKFV-GOSISDBHSA-N 429.443 4.909 50 10 IJGE CC(C)[C@H](Br)[C@H](C)NC(=O)c1cc(Br)c(Br)s1 1997051366 VQEFZFPMKFIXKY-RCOVLWMOSA-N 448.018 4.811 50 10 IJGE C[C@]1(CBr)CCCN1Cc1ccc(I)c(Cl)c1 2026567288 QOFPJUIAZLMXAE-CYBMUJFWSA-N 428.539 4.694 50 10 IJGE CC1(C)C[C@@H](Br)CN1Cc1ccc(I)c(Cl)c1 2026568298 ZQVPHVLWZOCPTI-SNVBAGLBSA-N 428.539 4.692 50 10 IJGE CC[C@@H](C[C@H](C)Br)NC(=O)c1c(Br)cccc1Br 2033085722 GGPBETQPBUQHPX-IUCAKERBSA-N 441.989 4.894 50 10 IJGE CN1C(=C(C#N)C(=O)CSc2nc(C3CC3)n(-c3ccccc3)n2)Sc2ccccc21 2040464025 WZBVRNNXFFHKPH-UHFFFAOYSA-N 445.573 4.783 50 10 IJGE CCC[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](CC(F)(F)F)C1 2055949141 RYWDPEYSSGBSRT-UONOGXRCSA-N 431.337 4.671 50 10 IJGE FC(F)Oc1c(I)ccc(OC(F)(F)F)c1CBr 2060219766 GCEOZHDJXNQXSN-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE CN(Cc1ccccc1)[C@H]1CCCCN(c2nc3sccn3c2CBr)C1 2112859560 SYDKQDDJGHHUGC-KRWDZBQOSA-N 433.419 4.782 50 10 IJGE ClCc1ccc(Br)cc1N1CC[C@H]2OCCN(Cc3ccccc3)[C@H]2C1 2129053711 NTMFDZZHTMJVOM-LEWJYISDSA-N 435.793 4.668 50 10 IJGE CC1(C)C[C@@H](CCl)CN(C(=O)c2ccc(I)c(Cl)c2)C1 2172580135 ILULKJBHUYKYKM-JTQLQIEISA-N 426.125 4.672 50 10 IJGE O=C(c1ccc(I)c(Cl)c1)N1CCCC[C@H]1CCCCl 2206694334 OWADXAFGLSLHNP-LBPRGKRZSA-N 426.125 4.958 50 10 IJGE C[C@H](CBr)CC1CN(Cc2ccc(I)c(Cl)c2)C1 2222849538 WVKYZRTZUKKAQK-JTQLQIEISA-N 442.566 4.798 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CC[S@@](=O)(=NCCCCCCBr)C1(C)C 2223292815 ZYVMCAHRJFOJPC-MQNRADLISA-N 439.460 4.733 50 10 IJGE Cc1ccc(I)c(C(=O)N[C@@H](C)CCCCCBr)c1 2232167291 TTYVFUJBTRTISZ-LBPRGKRZSA-N 438.147 4.673 50 10 IJGE C=CC[C@]1(CBr)CCCCN1C[C@@H]1CC1(Br)Br 2250407545 WNEOFGRVWYPBKL-NWDGAFQWSA-N 430.022 4.688 50 10 IJGE Cc1cc(F)c(Br)cc1C(=O)N(C)C[C@@H](Cl)COCc1ccccc1 2258016735 PGIMIXGLQVTXKV-OAHLLOKOSA-N 428.729 4.793 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H]1CN(CCCCCCCBr)C[C@@H]21 2277440984 YMLZUEUECLRIMU-XWSJACJDSA-N 429.443 4.909 50 10 IJGE COCCN(CCCCCCCBr)C[C@H]1CCCN1C(=O)OC(C)(C)C 2277449461 PDEPPALWAQGGAF-GOSISDBHSA-N 435.447 4.680 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@H](Br)[C@H]2CC[C@H]21 2285962984 KJBUCHVNRRJHQB-BZTNIEFMSA-N 425.523 4.630 50 10 IJGE Cc1ccc(C[C@@H]2SC(=C(C#N)C(=O)N3CCC(C)CC3)N(c3ccccc3)C2=O)cc1 2295998920 HTQCWUCIEFHFOG-QHCPKHFHSA-N 445.588 4.680 50 10 IJGE CC(C)[C@@H]1C[C@@H](Br)CN1c1ncc(Br)cc1Br 2304240419 WVZQMKYZQHLMDE-KOLCDFICSA-N 426.978 4.605 50 10 IJGE CC(C)C[C@@H](CCl)NCc1ccc(I)c(Br)c1 2306220461 XSRGYOVRNUPUKY-NSHDSACASA-N 430.555 4.797 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@H](C)C1Br 2315552050 YXABYJGQXJUCIT-UWVGGRQHSA-N 442.566 4.796 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H]2C[C@H]3CBr)cc1I 2315553684 VUNRNOLKIMUXHB-WDMOLILDSA-N 440.550 4.692 50 10 IJGE Clc1ccc(C[C@H](CBr)C2CCOCC2)c(I)c1 2318545367 IGPBVLDVSYIGSU-GFCCVEGCSA-N 443.550 4.925 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cc(F)ccc1C(F)F 2338322210 BQWGIRNEKNHYAC-AWEZNQCLSA-N 430.264 4.816 50 10 IJGE Cn1nc(C(F)(F)F)c(CBr)c1N1CCC[C@@H](OCc2ccccc2)C1 2339704634 CTYDKMZFUCTVNK-CQSZACIVSA-N 432.284 4.519 50 10 IJGE FC(F)(F)Cc1cccc(CO[C@H](CCl)[C@@H](I)CCl)c1 2381379395 BXQBXPRRXKAWHN-NWDGAFQWSA-N 441.058 4.958 50 10 IJGE CCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(C)cc1 38649306 XJBXXPJKNUARRC-DEOSSOPVSA-N 426.472 4.831 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3Cl)ccc2[C@@H]1c1ccc([N+](=O)[O-])cc1 38654395 PKVMYJKCCNHSKF-NRFANRHFSA-N 447.834 4.686 50 10 IJGE CCOc1cc(Br)c(/C=C(\C#N)C(=O)N[C@H](C)c2ccccc2)cc1OC 59297280 NMEHSHXJXOJACN-NGWPFTMJSA-N 429.314 4.641 50 10 IJGE O=S(=O)(NC[C@H]1CCC[C@H]1CCl)c1c(Cl)cc(Br)cc1Cl 91375710 CHHSZQZZUULLBC-DTWKUNHWSA-N 435.598 4.689 50 10 IJGE CSCC[C@H](C)n1c(CCCl)nc2cc(I)c(F)cc21 131556633 XUTDNYKYZYUGMQ-VIFPVBQESA-N 426.726 4.875 50 10 IJGE C[C@@H]1CCC[C@@](CCl)(NC(=O)c2ccc(I)c(Cl)c2)C1 232348698 JHBBEBXCRWFTAP-MEBBXXQBSA-N 426.125 4.862 50 10 IJGE BrCc1nnc(-c2ccc(Br)cc2Br)n1C1CC1 232453650 FWSSTWXRXXAXSO-UHFFFAOYSA-N 435.945 4.700 50 10 IJGE COC(=O)c1cccc(-c2ccc(C=NNC(=O)c3cccc(C(F)(F)F)c3)o2)c1C 254846586 NLGRDPHQHPSYRG-UHFFFAOYSA-N 430.382 4.824 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CCC[C@H]1CCBr 310724944 KHFPXGIJPAPNBE-LBPRGKRZSA-N 439.973 4.601 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](c2ccc(Cl)s2)[C@@H](CI)C1 394734209 RSWITXXPCVWLDS-VHSXEESVSA-N 427.735 4.787 50 10 IJGE ClCc1nc2cccc(Br)c2n1C[C@H]1CN(Cc2ccccc2)CCCO1 697736588 RYEFSEMFBCISSO-QGZVFWFLSA-N 448.792 4.829 50 10 IJGE CN(Cc1cc(Cl)ccc1I)C[C@H]1CCC[C@H]1Br 708342402 RUWHNOFWARTHMX-ZWNOBZJWSA-N 442.566 4.940 50 10 IJGE Cc1cc(C(=O)NNc2ccccc2OC(F)(F)F)ccc1NC(=O)c1cccs1 779208429 JFWRGOLAEAIOSE-UHFFFAOYSA-N 435.427 4.964 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)c(C(F)(F)F)c1 799391343 MNYBNDFILYRNDO-UHFFFAOYSA-N 445.445 4.788 50 10 IJGE Cc1ccc(NC(=O)CCC(=O)NN=Cc2ccc(OCc3ccccc3)cc2)cc1C 1084418936 HRMBINDAAUVQIY-UHFFFAOYSA-N 429.520 4.751 50 10 IJGE C=C(C)C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC=C(C#N)CC1 1151206432 IYWDWOZGXFRVHK-RUZDIDTESA-N 441.531 4.542 50 10 IJGE O=C(NN[C@H](c1ccccc1)c1nc(-c2ccccc2)no1)c1ccc(Br)cc1 1319711488 REPXEDBRJRGSTR-LJQANCHMSA-N 449.308 4.523 50 10 IJGE Cc1ccc(-c2csc3ncn(CC(=O)N/N=C/c4ccc(C(C)C)cc4)c(=O)c23)cc1 1860772981 MIKYIYQLLUCYLF-KKMKTNMSSA-N 444.560 4.707 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@@H]1c1ccc(O)cc1 1865683623 GIDOYIYETNEZAJ-MRXNPFEDSA-N 446.816 4.527 50 10 IJGE CCOc1ccc(/C=N\NC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)cc1OC 1865762287 XVMHWQGCHIHSNB-ZMFRSBBQSA-N 425.435 4.506 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)C(=O)c1cc(F)c(Br)cc1O 1901222544 HWWFQHUOMRJWCQ-NSHDSACASA-N 445.126 4.720 50 10 IJGE CC1([C@@H](Cl)c2c(Br)sc(Br)c2Cl)CS(=O)(=O)C1 1923055750 YHCZPAXZGIEOOI-LURJTMIESA-N 443.009 4.641 50 10 IJGE C[C@@H](Br)[C@@H]1CCN(Cc2ccc(Br)cc2Br)C1 1943846799 MEEJJFJDEYRKLP-NXEZZACHSA-N 425.990 4.817 50 10 IJGE CC1(C)C[C@H](O[C@@H](CI)c2ccc(Br)cc2)CO1 2052241283 ODCQAWFETLPJHG-STQMWFEESA-N 425.104 4.509 50 10 IJGE Brc1cccc(CN2C[C@H]3C[C@H](Br)C[C@H]3C2)c1Br 2065402801 LVSSHZLPHHUTSC-GDNZZTSVSA-N 438.001 4.817 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CNC(=O)C(C#N)=Cc1ccccc1)c1cccc(Cl)c1 2077535905 KHGOINZXNYQTPW-HXUWFJFHSA-N 425.916 4.629 50 10 IJGE ClCCc1nc2cncc(Br)c2n1Cc1cc(Br)cs1 2151791739 VQRPELSPZOLBKC-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2ccc(CBr)cc2)CC12CCC2 2162496408 ZHLCRNVOIWKUMX-QGZVFWFLSA-N 437.378 4.634 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1CN(CCO)CCCCCCCCCBr 2163058021 HCADKCPGTGZDPM-IBGZPJMESA-N 449.474 4.806 50 10 IJGE CC1(C)CC[C@H](NC(=O)[C@@H](Br)C2CCCC2)[C@@H](CNC(=O)OC(C)(C)C)C1 2167032403 MQALBXVXYOQHIY-IKGGRYGDSA-N 445.442 4.776 50 10 IJGE CC(C)(C)OC(=O)N(CC1CC1)C1CCN(C(=O)[C@@H](Br)C2CCCC2)CC1 2167033041 PJIJZGABTWBWKS-SFHVURJKSA-N 443.426 4.578 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccccc2OC(F)F)sc2c1CCCC2 2296500477 QWBIOPSXJCUURD-UHFFFAOYSA-N 446.475 4.951 50 10 IJGE Clc1ccc(CN(CCBr)C2CCC2)cc1I 2300238260 ITPZFVOORMFZFR-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](Br)[C@H](OCCCCC(F)(F)C(F)(F)F)C1 2315804623 UHHRNFPXWVVPKA-WDEREUQCSA-N 440.247 4.754 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Cl)C1CC(S(C)(=O)=O)C1 2365175400 GRZFLAFIEKDYOO-TYAJBCFHSA-N 448.579 4.762 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCOc2ccc(CNC(=O)OC(C)(C)C)cc21 2382184709 OVRPIUNMVFGYGG-KRWDZBQOSA-N 441.410 4.967 50 10 IJGE COc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccc(Cl)cc4)ccc32)c1 38650246 GPZQWASEQGDHLQ-DEOSSOPVSA-N 446.890 4.715 50 10 IJGE Cc1c(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)sc2nc(-c3ccccc3)cn12 40827985 IOQMFRSSHRYTHP-UHFFFAOYSA-N 432.549 4.744 50 10 IJGE CCCCCCCOc1ccc(C(=O)NNC(=O)COc2ccccc2C(C)C)cc1 100153547 YPVZXNIPYIFKGZ-UHFFFAOYSA-N 426.557 4.999 50 10 IJGE COc1ccc(CNc2ccc(C(=O)NN=Cc3cn(C(C)=O)c4ccccc34)cc2)cc1 254440654 DUGVKQZZKBYRGY-UHFFFAOYSA-N 440.503 4.686 50 10 IJGE CCOC(=O)[C@H](Br)Cc1c(Br)cc(Cl)cc1Br 304153341 RBBXERBMGPKVLJ-SNVBAGLBSA-N 449.364 4.734 50 10 IJGE CO[C@H](CO[C@@H](CI)c1ccccc1Br)C(C)C 380979457 YLCZXUYJWMFHRG-UONOGXRCSA-N 427.120 4.613 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@H]1n1c(CCCl)nc2cc(Br)cnc21 389782727 JEZGEBPZHDNJEY-RDTXWAMCSA-N 433.781 4.668 50 10 IJGE CC(C)S(=O)(=O)CCCOc1c(Br)cc(CCl)cc1Br 697085704 SQUMCIGHEZZICF-UHFFFAOYSA-N 448.604 4.543 50 10 IJGE COc1cc(CCl)cc(Br)c1OCc1ncc(Br)s1 713718667 VSAQFGNGNLOCMT-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE CC(C)C1CCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)CC1 742115381 AEOVPDZOOMWXOD-XSFVSMFZSA-N 435.959 4.919 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OC[C@@H]2CCC3(CCCCC3)O2)c(-c2ccccc2)n1 786266834 DRBOUOKVHXVYML-HWYOBBEWSA-N 444.535 4.796 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2)cc1O 1083978652 GYQOJUAGJLLVTD-UHFFFAOYSA-N 445.519 4.715 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3cc4oc(O)nc4cc3F)c2C)cc1 1629000673 KRVRASYFFZTRHS-SXGWCWSVSA-N 446.438 4.634 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNC(=O)c1ccc(F)cc1Br 1630596492 JAWZRFKIGXZOGH-VQHVLOKHSA-N 446.103 4.760 50 10 IJGE CC(=O)c1cc(F)c(O)c(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccccc3F)c2C)c1 1635383033 KMVZGAMMFOPXGS-GIJQJNRQSA-N 435.430 4.826 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2)cc1 1865692414 BIRQMNUNDPOPJX-GOSISDBHSA-N 440.425 4.898 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c2c1[C@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865704894 HECRWOIZDBDRQS-JOCHJYFZSA-N 434.927 4.899 50 10 IJGE FC(F)(F)[C@@H](Br)COc1cc(Br)cc(Br)c1 1901041336 DUCAJCVLFIIIQU-QMMMGPOBSA-N 426.852 4.916 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cccc2cc(C)cnc12 1915088374 JWSSJZSMXKFLAG-LJQANCHMSA-N 447.398 4.908 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@@]1(CC[C@](C)(CI)O1)C2 1949547701 KWEFGRWYZOHEJZ-MJGOQNOKSA-N 449.373 4.931 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCC[C@H](CI)O2)C12CCCCC2 1989552954 QLGIUJYKPDFTHU-RDTXWAMCSA-N 435.346 4.683 50 10 IJGE COc1cc(NC[C@H]2C[C@H](Br)C2)c(Br)cc1Br 2020204507 WGYQNQOYQNDOIE-ZKCHVHJHSA-N 427.962 4.806 50 10 IJGE CC(F)(F)C[C@H](CCl)NC(=O)c1cc(Br)sc1Br 2050365840 AKZAKDHISMTEQW-RXMQYKEDSA-N 425.520 4.656 50 10 IJGE FC(F)c1ccc(CCl)c(I)c1I 2060236799 XJAIZJOOSLWKBY-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE CCCc1cccc(-n2nc(CBr)c(Br)c2C(F)(F)F)n1 2078912913 BEOSMYVKLWUZBH-UHFFFAOYSA-N 427.062 4.896 50 10 IJGE C[C@H](c1cnn(Cc2ccccc2)c1)n1c(CCl)nc2cncc(Br)c21 2095439356 JCTWPAUYBNWAOB-CYBMUJFWSA-N 430.737 4.787 50 10 IJGE O=C(c1cc(Br)sc1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Cl)C2 2134132019 XYEHSMSCYDLAQZ-BNJNZJEJSA-N 431.552 4.596 50 10 IJGE C[C@H]1[C@@H](Br)C[C@@H](C)CN1Cc1cc(Cl)ccc1I 2220346365 YNTIKWMUSNMOHT-NRUUGDAUSA-N 442.566 4.938 50 10 IJGE CC(C)(C)C[C@@H](Br)CNC(=O)Cc1ccc(Br)cc1Cl 2237437739 ZVMMXUFEBMSWRG-GFCCVEGCSA-N 425.592 4.961 50 10 IJGE O=C(OCc1ccccc1)N1CC2(CC=CCN2CCCCCCCBr)C1 2252610895 LSXGUJGLIJXQNH-UHFFFAOYSA-N 435.406 4.985 50 10 IJGE Cn1ncc([C@H](Br)c2ccc(C3CCC3)s2)c1I 2259355837 GQXVVDSFWZYBEJ-LBPRGKRZSA-N 437.144 4.838 50 10 IJGE CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(CC3(CBr)CC(F)C3)C2)CC1 2280359147 JYWJMQUOBGRULM-XPQZIERPSA-N 447.433 4.859 50 10 IJGE O=C(N[C@@H]1CCC[C@@H](CBr)C1)c1cc(Br)c(F)cc1Cl 2285843993 GZYYYFCUXZLUAQ-RKDXNWHRSA-N 427.539 4.925 50 10 IJGE CS(=O)(=O)C1([C@@H](Cl)c2cc(Br)ccc2OCc2ccccc2)CC1 2299489489 PVSGJLWWJYDCPG-KRWDZBQOSA-N 429.763 4.885 50 10 IJGE Clc1ccc(C[C@@H]2CCOCC[C@H]2Br)c(I)c1 2302330022 XYFNERUYMSJCOT-JOYOIKCWSA-N 429.523 4.677 50 10 IJGE FC1(F)C[C@]1(CBr)COc1cc(I)ccc1Cl 2306895653 PSHQFFYXWLONOP-JTQLQIEISA-N 437.449 4.744 50 10 IJGE CC(C)[C@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)CCCCBr)n1 2315742390 NTVKODJTOPSEIT-AWEZNQCLSA-N 434.400 4.869 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2ccc(-c3ccc(OC)c(OC)c3)nc2C)cc1 2321248519 NSLWYTXYDLXVMH-UHFFFAOYSA-N 446.551 4.684 50 10 IJGE CCOc1c(Br)cc(C=C(C#N)c2nc(O)c3ccccc3n2)cc1OC 2323870441 BBHISPXSMPXLKW-UHFFFAOYSA-N 426.270 4.569 50 10 IJGE O=C(N[C@@H](CCl)c1ccsc1)c1ccc(Cl)cc1I 2340052038 KJBLIZVDCSZPMP-LBPRGKRZSA-N 426.106 4.716 50 10 IJGE CC(C)C[C@@H](CBr)CN1C[C@H](NC(=O)OC(C)(C)C)Cc2ccccc21 2353827033 PBOBEFWWIYICJL-FUHWJXTLSA-N 425.411 5.000 50 10 IJGE CN(C)c1ccnc(N(C)[C@H]2CN(Cc3ccccc3)C(C)(C)C2)c1CBr 2377474213 KDTVWPVXGIYXQD-GOSISDBHSA-N 431.422 4.532 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4cc(C)cc(C)c4)ccc32)cc1 38649254 OETSDOQUTIPSAF-AREMUKBSSA-N 440.499 4.814 50 10 IJGE O=C(NNC(=O)c1cccnc1-c1nc2ccccc2s1)c1ccc(Cl)cc1Cl 39881388 SKHOJYJZTFAUNE-UHFFFAOYSA-N 443.315 4.740 50 10 IJGE CCCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccco3)ccc21 40529709 RLQHHRCXRPQJEQ-HSZRJFAPSA-N 430.460 4.896 50 10 IJGE O=C(COc1ccccc1Cl)N/N=C/c1cn(-c2ccccc2)nc1-c1ccccc1 48572831 MXCCKJBMWJNZHZ-CVKSISIWSA-N 430.895 4.722 50 10 IJGE CC(C)(C)OCCO[C@H](CI)c1ccc(Br)cc1 162574771 RKXQXDFUWYWNLO-CYBMUJFWSA-N 427.120 4.757 50 10 IJGE COc1ccc(Br)cc1/C=N\NC(=O)c1ccc2nc(SC(C)C)[nH]c2c1 169917800 OQJCQLCJJNYPKY-FBHDLOMBSA-N 447.358 4.598 50 10 IJGE CCCCCOc1ccc(/C=N/NC(=O)c2nn(-c3ccccc3)c3c2CCC3)cc1OC 169927624 CTWOVMXCGISMPV-OVVQPSECSA-N 446.551 4.703 50 10 IJGE O=C(NC[C@@H]1CC[C@H](Br)C1)c1cc(Br)c(Br)s1 227667772 LFMPBAQMCLFNSU-RQJHMYQMSA-N 446.002 4.567 50 10 IJGE C[C@@H](CBr)CCCNC(=O)c1cc(Br)ccc1Br 228277370 LAUVQKIOJPITFQ-SECBINFHSA-N 441.989 4.753 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccncc2)cc(Cl)c1OCc1ccccc1F 252595063 BYHIYBQZFJONGA-UHFFFAOYSA-N 427.863 4.616 50 10 IJGE O=C(NN=Cc1ccc2c(c1)OCO2)c1cc(-c2c[nH]c3ccccc23)n(-c2ccccc2)n1 254439432 OUZWWCFMATWKNY-UHFFFAOYSA-N 449.470 4.513 50 10 IJGE COc1ccc(OC)c(C(C)=NNC(=O)CCC(=O)N(c2ccccc2)c2ccccc2)c1 254615156 WHQGFFLJEOOHKP-UHFFFAOYSA-N 445.519 4.689 50 10 IJGE O=C(NC[C@H](Br)C1CCC1)c1cc(Br)c(Br)s1 316281388 JVJZPDHQZNPCPJ-QMMMGPOBSA-N 446.002 4.567 50 10 IJGE CC(C)(C)C[C@@H](CCl)NS(=O)(=O)c1cc(Br)ccc1Br 393428047 HEHVLDCYZMYYMQ-JTQLQIEISA-N 447.620 4.534 50 10 IJGE C[C@H](CCCCBr)NC(=O)c1cc(Br)sc1Br 398427757 ITBIZKYDZJIRTF-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE O=C(CC1CCCC1)NNC(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 757755514 KFZCRPDJHNNFQJ-UHFFFAOYSA-N 439.903 4.809 50 10 IJGE Cc1cc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)c2cc(Br)ccc2n1 799748263 PINSARUUNBYFPC-UHFFFAOYSA-N 449.230 4.953 50 10 IJGE C=CCCC[C@@H](C(=O)NNC(=O)Nc1cc(OC)c(Cl)cc1OC)c1ccccc1 1155437252 HQMNOUUDSGPZKA-MRXNPFEDSA-N 431.920 4.650 50 10 IJGE CC(=O)N(C)c1ccc(CNC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C)c3)c2C)cc1 1529209819 JURVLNRPLCCLRL-BUVRLJJBSA-N 440.547 4.609 50 10 IJGE Cc1cccc(Cl)c1NNC(=O)CCSCc1nc(O)c2c3c(sc2n1)CCC3 1636833334 LLTOVRXXKSVVOX-UHFFFAOYSA-N 449.001 4.614 50 10 IJGE BrC[C@@H](CN1CC[C@@H](Cc2cccc(I)c2)C1)C1CC1 1645784590 YJAMVMGXCXKOEU-HOCLYGCPSA-N 448.186 4.577 50 10 IJGE C=CCOc1cccc(NC(=O)NNc2cccc(OC(F)F)c2Br)c1 1666342693 JQQNRTNNWGPARE-UHFFFAOYSA-N 428.233 4.764 50 10 IJGE C=CCn1cc2ccc(NC(=O)NNC(=O)c3sc4ccccc4c3Cl)cc2n1 1673220557 LGFUXQNURCZDJZ-UHFFFAOYSA-N 425.901 4.557 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(F)c2)[C@@H]1c1ccc(Cl)cc1 1865683125 GMSDVLVGNGYZRU-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@H]2c1cccc(OC)c1OCC 1865694613 ZVXUPZYFRUKHLT-HXUWFJFHSA-N 430.508 4.586 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CC(C)C)cc1 1865694945 GGICRNDRJHAXAS-QFIPXVFZSA-N 444.535 4.832 50 10 IJGE CCN(CC)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(Cl)cc2)cc1 1865702553 WSGTYGKHFRJPOS-QHCPKHFHSA-N 447.970 4.958 50 10 IJGE N#C/C(=C\c1cccc(Br)c1)C(=O)Nc1c(Cl)cc(Cl)cc1C(=O)O 1866130840 PKAPFHLCGIBUMV-ONNFQVAWSA-N 440.080 5.000 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)C(=O)c1ccc(Br)cc1O 1914229246 QYITXTPCSOLSKF-LBPRGKRZSA-N 427.136 4.581 50 10 IJGE N#C[C@H]1CN(c2ccc(CBr)cc2Br)CCN1Cc1ccccc1 1914889121 CPULCKHBPLZGMH-KRWDZBQOSA-N 449.190 4.558 50 10 IJGE O=C(c1cc(F)c(F)c(O)c1F)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915315324 VSTNYZYTBWCUIS-OAHLLOKOSA-N 428.248 4.625 50 10 IJGE C[C@H]1C[C@@H](CBr)CN1C(=O)c1cc(Br)sc1Br 1950506981 FGUAAPKYJRJPSM-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE CCOc1c(Br)cc(C=C(CBr)OC)cc1Br 2004767098 PXGHGZFBTPZARD-UHFFFAOYSA-N 428.946 4.993 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CBr)c1F)N(Cc1ccccc1)C1CC1 2009659083 YDYLZASESMNSRP-UHFFFAOYSA-N 432.742 4.727 50 10 IJGE ClCC1(CNc2ncc(I)cc2Br)CCCC1 2015756913 MJDBEHLVPSPCLN-UHFFFAOYSA-N 429.527 4.660 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1C(=O)c1cccc(Br)c1Br 2031480518 WKFSONRPLBIPCR-SCZZXKLOSA-N 439.973 4.600 50 10 IJGE CC(C)(C)OC(=O)N1CCC([S@](C)(=O)=NC[C@H](CBr)C(C)(C)C)CC1 2044698447 BUZJIDPTSSVBEI-SXBQZSJRSA-N 439.460 4.541 50 10 IJGE C[C@@H](CCBr)CCN1CCC[C@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2044704355 BYPPGCDBOPCJDF-BBRMVZONSA-N 431.337 4.719 50 10 IJGE Brc1ccc(Br)c(CN2CC[C@H](Br)[C@@H]3CC[C@H]32)c1 2070006756 HCWAMOSDOWKNGD-FPMFFAJLSA-N 438.001 4.959 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1C1[C@H]2CN(Cc3ccccc3)C[C@H]12 2095438853 BFHGMGGXEBZGMH-QEJZJMRPSA-N 431.765 4.797 50 10 IJGE CC(C)[C@@H](Br)C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C2(CCCCC2)C1 2106203421 HLYXNYPMODREHZ-JKSUJKDBSA-N 431.415 4.625 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1[C@H](CCl)C[C@H]2CCC[C@H]21 2108400127 UJDMSSALWMHSMP-KHQFGBGNSA-N 427.589 4.895 50 10 IJGE C[C@@H]1[C@H](Br)C[C@H]2CC[C@H]1N2C(=O)c1cc(Br)c(Cl)s1 2115941799 DQGZTGUNNWKZFH-FDDDBJFASA-N 427.589 4.941 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1cccc(OC(F)F)n1 2125359611 PJOHSLQZLTXLDY-INIZCTEOSA-N 427.289 4.745 50 10 IJGE CCCN(CCCCl)S(=O)(=O)c1cc(Br)c(C)cc1Br 2149423357 YWZJZXILKSRKDC-UHFFFAOYSA-N 447.620 4.550 50 10 IJGE CN(Cc1ccccc1)[C@]1(Cn2c(CCl)nc3ccc(Br)cc32)CCOC1 2155116202 QYWMCWNXUHGDRN-NRFANRHFSA-N 448.792 4.829 50 10 IJGE Fc1cc2c(cc1Br)nc(CCCl)n2[C@]12C[C@H]1CN(Cc1ccccc1)C2 2155862864 KJUBBHIHJQHHNZ-BTYIYWSLSA-N 448.767 4.950 50 10 IJGE COCC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1CC1(CBr)CCCCCC1 2163058320 JOVRUAUHAYOZFP-GOSISDBHSA-N 447.458 4.680 50 10 IJGE Cn1nc([C@@H](Br)c2c(F)c(F)cc(F)c2F)c(Br)c1Cl 2167042048 LIAKXTMZFQOENT-LURJTMIESA-N 436.428 4.877 50 10 IJGE Cc1cc(C(=O)N2C3CCC2([C@H](C)Br)CC3)ccc1I 2207097647 QWGNEAFRLSERLQ-XOMBGVMMSA-N 448.142 4.520 50 10 IJGE CCN(C[C@@](C)(CI)OCCCCC(F)F)C(=O)OC(C)(C)C 2212213232 GIDHGXXMPPFCGY-MRXNPFEDSA-N 449.320 4.889 50 10 IJGE Cc1sc(Br)c([C@H](Br)c2nn(C)nc2Br)c1C 2214372677 JNRDMVNFMVHUAN-ZETCQYMHSA-N 443.990 4.503 50 10 IJGE Cc1cc(CBr)cnc1N(C)Cc1ccccc1I 2265529910 MBBAAPAHRQSRLT-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE Cc1cc(Br)c(C)c([C@@H](Cl)[C@H]2C[C@H](S(C)(=O)=O)C2)c1Br 2285396032 PSXGOHZXSMOWRN-BHDSKKPTSA-N 444.616 4.932 50 10 IJGE C[C@@H]1[C@H](CBr)CCN1Cc1ccc(Cl)c(I)c1 2300240293 KIFFXXABILPAQL-KOLCDFICSA-N 428.539 4.550 50 10 IJGE CCC[C@H](CCl)CNCc1ccc(I)c(Br)c1 2306228567 RDVQJGMOYOEYRW-LLVKDONJSA-N 430.555 4.798 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)COc2cc(C)c(Cl)c(C)c2)cc1 2314790160 VRUNHSRZFWHZII-UHFFFAOYSA-N 440.927 4.765 50 10 IJGE CC[C@@H](NC(=O)C(C#N)=CN[C@@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 2318467234 CCDOGXUQFZICQM-MHECFPHRSA-N 447.579 4.908 50 10 IJGE Cl[C@H]1CN(Cc2ccc(I)c(Br)c2)CC2(CC2)C1 2325225173 DAAOSERXUQVKEA-LLVKDONJSA-N 440.550 4.647 50 10 IJGE Cc1ccc(C(=O)Nc2ccc(CBr)c(F)c2)cc1I 2367666596 KYGGGXCTFAKNJF-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE Cc1ccc(-c2n[nH]c3c2[C@@H](c2ccc(F)c(Br)c2)C(C#N)=C(N)O3)cc1 10013818 URIPJPAJSDXFCA-INIZCTEOSA-N 425.261 4.505 50 10 IJGE CC[C@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C)c(C)c1 10153682 RRKFUUNEEZNTSM-PERKRYKHSA-N 426.557 4.589 50 10 IJGE CC(C)CCOc1cccc(C(=O)NNC(=O)c2ccccc2OCc2ccccc2)c1 14644647 YMIUAAKAQRWHJP-UHFFFAOYSA-N 432.520 4.765 50 10 IJGE CCCn1c(C)cc(/C=C(\C#N)C(=O)N(C)CC(=O)Nc2c(Cl)cccc2Cl)c1C 24861562 RANVBROBCDVRRB-GZTJUZNOSA-N 447.366 4.826 50 10 IJGE COc1ccc(CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(Cl)cc2)cc1 38651428 QPHDKFSXTZCVTR-DEOSSOPVSA-N 446.890 4.715 50 10 IJGE Cc1ccc(C(=O)NNc2ncnc(Nc3cccc(Cl)c3Cl)c2[N+](=O)[O-])cc1 40646702 QMOUCBMESFSHRX-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE Cc1c(C(=O)N2CCCc3ccccc32)oc2c1/C(=N/NC(=O)Cc1ccccc1)CCC2 40815812 XHJGIFKRGLAPNY-SGWCAAJKSA-N 441.531 4.580 50 10 IJGE NCC(CP(c1ccccc1)c1ccccc1)CP(c1ccccc1)c1ccccc1 100557241 WQOBLSBHKPSXCB-UHFFFAOYSA-N 441.495 4.827 50 10 IJGE CCCOc1c(OC)cc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)cc1OC 169891174 IQQCVCKKYCQHMW-YKVGDQEKSA-N 449.551 4.863 50 10 IJGE CCCCCCCCCOc1ccc(/C=N\NC(=O)c2cccn(C)c2=O)cc1Cl 169918741 AHHBGSDXLPEKCK-UQQQWYQISA-N 431.964 4.932 50 10 IJGE CC1(C)O[C@H]2[C@H](CO[Si](C)(C)C(C)(C)C)O[C@H](n3ccc4c(Cl)ncnc43)[C@@H]2O1 195779501 PTFANUVYJLNMOM-AFIMGQEJSA-N 440.016 4.524 50 10 IJGE CCc1ccc2c(Cl)c(C(=O)NN=Cc3cc(OC)c(OC)c(OC)c3)sc2c1 252600534 DSFCKVOZIHAWDC-UHFFFAOYSA-N 432.929 4.907 50 10 IJGE O=C(NN=Cc1c[nH]c2ccccc12)/C(=C/C=C\c1ccccc1)NC(=O)c1ccccc1 254592659 HGMWTWDZWWPSEF-CRODFMFNSA-N 434.499 4.645 50 10 IJGE ClCc1ccc(I)c2c(I)csc12 306920613 MZKLVSZMFXKWOZ-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CC(C)[C@@H]1CN(c2ccc([N+](=O)[O-])cc2CBr)CCN1Cc1ccccc1 704740784 RYHRFVLXXPZNJO-NRFANRHFSA-N 432.362 4.837 50 10 IJGE C[C@H]1CN(C(=O)c2scc(Br)c2Br)CC[C@@H]1Br 707799487 DYOIJNMASKCYPW-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE Fc1ccc2nc(CCCl)n(C[C@@H]3CCN3Cc3ccccc3)c2c1Br 716232717 ZMLHCLKKMHEASX-HNNXBMFYSA-N 436.756 4.994 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@H](Cc2nccn2C)c2ccccc2)c(C)n1CCC(C)C 744351235 YHZVYQHTPQALRG-NPWCAHBGSA-N 443.595 4.892 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1ccccc1Oc1cc(F)cc(F)c1 757689254 JZFLSTLRYOCNDC-UHFFFAOYSA-N 434.402 4.772 50 10 IJGE Cc1cc(N2CCCC2)ccc1C=NNC(=O)c1cc2cc(Br)ccc2o1 1082937256 IMMHBPNPHSELDN-UHFFFAOYSA-N 426.314 4.868 50 10 IJGE CNC(=O)/C(C#N)=C\c1ccc(-c2ccc(C34CC5CC(CC(C5)C3)C4)cc2[N+](=O)[O-])o1 1084148831 RVJHGAUXLYIKHJ-NVMNQCDNSA-N 431.492 4.976 50 10 IJGE O=C(NN(c1ccccc1)c1ccccc1)c1ccc2nc(O)n(CC(F)(F)F)c2c1 1290606596 ONKBAQWOPAVJGK-UHFFFAOYSA-N 426.398 4.787 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NNc1nc2ccccc2[nH]c1=S 1557584771 PLXDKPQUTCDNKL-UHFFFAOYSA-N 438.944 4.564 50 10 IJGE Cc1sc2nc(CCC(=O)NNc3ccccc3Cc3ccccc3)nc(O)c2c1C 1583742630 CZWOAVYBQYYFSA-UHFFFAOYSA-N 432.549 4.680 50 10 IJGE Cc1ccc(NC(=O)NNC(=O)c2ccc(-c3cccc(Cl)c3)nc2O)c(Cl)c1 1634950074 UPQCSVQVPSCCGT-UHFFFAOYSA-N 431.279 4.536 50 10 IJGE CCCc1nn(Cc2ccccc2F)c2c1[C@H](c1cccc(OCC)c1)C(C#N)=C(N)O2 1865690110 IWYSNWLEZFQVQM-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE O=C1/C(=C/c2cc(Cl)cc3c2OCOC3)Oc2cc(OC(=O)C(Cl)Cl)ccc21 1871385089 FLMSYLZUSPXMFT-WCSRMQSCSA-N 441.650 4.532 50 10 IJGE COc1cc(/C=C(\C#N)c2nc3ccccc3n2C)ccc1OCC(=O)Nc1ccccc1 1872726828 ONJJWQJSJJIOSJ-XMHGGMMESA-N 438.487 4.664 50 10 IJGE COc1ccc(Cl)cc1-c1csc(/C(C#N)=C(\O)CNC(=O)c2ccccc2)n1 1872758574 HCHULPQZNRPURO-VLGSPTGOSA-N 425.897 4.695 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C/c3ccc4c(c3)OCCO4)n2)c(OC)c1OC 1872795228 UWQHYDYBDLHPEX-XNTDXEJSSA-N 436.489 4.671 50 10 IJGE CC(C)C[C@@H](CBr)NC(=O)c1csc(Br)c1Br 1945189243 MJJRLYFUHRAFEH-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE C[C@@H]1CN(C(=O)c2csc(Br)c2Br)CC[C@@H]1Br 1945189438 QMQKPDOGNHQBPS-SVRRBLITSA-N 446.002 4.519 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1Cc1cc(Cl)ccc1I 2018105818 YJBUUSLWJHPKQX-RNCFNFMXSA-N 428.539 4.692 50 10 IJGE Clc1cc(CN2CCC[C@H](CBr)C2)ccc1I 2026562228 ZEIMHYOHDQRYAQ-LLVKDONJSA-N 428.539 4.552 50 10 IJGE Clc1cc(CN2CCCC[C@@H]2CBr)ccc1I 2026564980 XZDSFNUFJNIAQA-LLVKDONJSA-N 428.539 4.694 50 10 IJGE Cc1sc(Br)cc1[C@@H](Br)c1cc(S(C)(=O)=O)cs1 2034557417 RTEMPUCLOJTWLO-LLVKDONJSA-N 430.208 4.768 50 10 IJGE CC(C)(C)[C@@H]1[C@@H](Cl)CCN1c1ncc(I)cc1Br 2069532818 XIJZSLUCILQLIF-QWRGUYRKSA-N 443.554 4.681 50 10 IJGE CCC(CC)(CBr)CN=[S@](C)(=O)CC1(C)CN(C(=O)OC(C)(C)C)C1 2072635749 HMZARCVINJCFIJ-RUZDIDTESA-N 439.460 4.543 50 10 IJGE C[C@]1(CCBr)CCN1C(=O)c1ccc(Br)cc1Br 2084698820 AIQITGYOFYHQJZ-ZDUSSCGKSA-N 439.973 4.601 50 10 IJGE Cc1cc(Br)ccc1S(=O)(=O)N(Cc1ccccc1)[C@@H](CCl)C1CC1 2085732567 UHNFYWKYEIJZJI-SFHVURJKSA-N 442.806 4.966 50 10 IJGE ClCc1cc(Br)cc(Br)c1OCCS[C@H]1CCOC1 2092688577 FJKZWYMECJTLGP-NSHDSACASA-N 430.589 4.851 50 10 IJGE ClCCc1nc2cncc(Br)c2n1[C@H]1CCCN(Cc2ccccc2)C1 2095445943 OFQZJCHDGAZLFM-INIZCTEOSA-N 433.781 4.812 50 10 IJGE C[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)N(C[C@@H](CBr)c2ccccc2)C1 2106787543 ZTURUBRGGVOLQK-BHIYHBOVSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@H](NC(=O)[C@@H](Br)C2CCCC2)C1 2110716188 VDDICGPZCSULMP-XIRDDKMYSA-N 431.415 4.530 50 10 IJGE CN(C(=O)OC(C)(C)C)C1CCC2(CCCN2C(=O)CCCCBr)CC1 2111605313 MWGHXLKXLXIQHG-UHFFFAOYSA-N 431.415 4.722 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@]2(CCC[C@H]2Br)C1 2115924476 LSKICXCDCTZACQ-ZWNOBZJWSA-N 427.589 4.944 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@@H]2C[C@H](Br)CC[C@@H]21 2115927850 GLZNMCATBLZYIO-MRTMQBJTSA-N 427.589 4.942 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@@H](Cl)C2(CCCC2)C1 2117744746 WKGPQOPPMXBWFT-SECBINFHSA-N 427.589 4.897 50 10 IJGE COCc1cc(Br)c([C@H](Br)C2C[C@@H](OC)[C@H](OC)C2)s1 2174889806 VMULKBAXOGEDML-JHJVBQTASA-N 428.186 4.533 50 10 IJGE Clc1ccc(CBr)c(OCCOCCOCCOCc2ccccc2)c1 2227772835 TZFVMPCTXZQYJL-UHFFFAOYSA-N 443.765 4.864 50 10 IJGE CN[C@H](c1c(F)cc(Br)c(F)c1Br)C1CC(Br)C1 2260005164 FFOIOKDRMJSDEG-WOKRAHDESA-N 447.943 4.924 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1C(=O)c1cc(Br)cc(Br)c1 2260379071 KVQBKLVHPJOXIY-RYUDHWBXSA-N 439.973 4.600 50 10 IJGE CN(C[C@@H]1C[C@@H]1Br)C(=O)CCCCCCCCCNC(=O)OC(C)(C)C 2269414616 GGLMPIVHSDTTFG-IRXDYDNUSA-N 433.431 4.874 50 10 IJGE N#CC(C(=O)Nc1ccccc1)=C1S[C@H](Cc2ccccc2)C(=O)N1c1ccccc1 2296509327 OHKVOWSLKADTAZ-JOCHJYFZSA-N 425.513 4.752 50 10 IJGE CC[C@H]1CN(Cc2ccc(I)c(Br)c2)C[C@H]1Cl 2306219931 RLFQXMYCFOUYCD-CMPLNLGQSA-N 428.539 4.503 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)[C@@H]2[C@H]3CCCO[C@H]32)c1 2313495376 AIMRLQXKYUXFEA-YIYPIFLZSA-N 438.985 4.943 50 10 IJGE CCCCc1ccc(C[C@H]2SC(=C(C#N)C(=O)NC)N(c3ccc(CC)cc3)C2=O)cc1 2314593868 VDZPAQDSQVQCSM-HSZRJFAPSA-N 447.604 4.764 50 10 IJGE Clc1ccc(CN2C[C@@H]3CC[C@@]3(CBr)C2)cc1I 2315548818 LGJZMEXVDVGNOJ-SMDDNHRTSA-N 440.550 4.552 50 10 IJGE CCO[C@@H]1[C@@H](Br)C[C@@H]1OCc1c(Br)cccc1Br 2318173537 XZDJUDNDRXNSEM-RWMBFGLXSA-N 442.973 4.669 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)cc2I)C[C@]1(C)CBr 2318529749 UQOAPXOCYHPJES-HZMBPMFUSA-N 442.566 4.798 50 10 IJGE CCCN1C[C@H](Cc2ccc(Cl)cc2I)[C@@H](Br)C1 2318558445 VEJRDBPQKYKOHX-AAEUAGOBSA-N 442.566 4.592 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cc(F)c(Cl)cc1F 2320362251 UIECDTKHVNUWFI-ZDUSSCGKSA-N 432.692 4.718 50 10 IJGE O=C(NN=Cc1c(Cl)cccc1Cl)c1cccn(Cc2ccc(Cl)cc2)c1=O 2323651118 YEFCCRAZMSWMGY-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE COc1ccc(C2CCN(C(=O)C(C#N)=Cc3cccc(Br)c3)CC2)cc1 2324521979 ARUADIJFVZASGA-UHFFFAOYSA-N 425.326 4.771 50 10 IJGE Clc1ccc(I)cc1CN1[C@H]2CC[C@@H](C2)[C@@H]1CBr 2327405675 DYOHSFPZHUHOQH-WFBYXXMGSA-N 440.550 4.692 50 10 IJGE CN(Cc1cc(I)ccc1Cl)[C@@H](CBr)CC1CC1 2327410224 YHWPCIFCXBLYOZ-CYBMUJFWSA-N 442.566 4.940 50 10 IJGE CC(C)N(C[C@H]1CCCN(C[C@@]2(CBr)CC2(F)F)C1)C(=O)OC(C)(C)C 2351889119 OPPOJEBHYZAMHU-YJBOKZPZSA-N 439.385 4.764 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc(OC(F)(F)F)cc1 2369430693 HGFUFAQZESMFMI-MRXNPFEDSA-N 446.263 4.685 50 10 IJGE Cc1ccn2c(C(=O)NN=Cc3nn(-c4ccccc4)cc3-c3ccccc3)c(C)nc2c1 642404 LZVGBLLHGSFNSG-UHFFFAOYSA-N 434.503 4.568 50 10 IJGE COc1cccc(-c2nn(-c3ccccc3)cc2/C=C(\C#N)S(=O)(=O)c2ccccc2)c1 35446354 WZACNXKIFOTQQA-LFVJCYFKSA-N 441.512 4.886 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)Nc2ccccc2)ccc1OC(=O)c1ccc(OC)cc1 59116733 CZVOCSFQMIQOHN-HKWRFOASSA-N 442.471 4.859 50 10 IJGE COc1cccc([C@@H](C(=O)NC2CCCCC2)N(Cc2ccc(F)cc2)C(=O)CCl)c1 97915135 XZKHNRPAADRDTE-QHCPKHFHSA-N 446.950 4.592 50 10 IJGE COc1cccc(CBr)c1OCc1ccc(I)cc1 115098485 PXFPPDRHAXUINQ-UHFFFAOYSA-N 433.083 4.774 50 10 IJGE Cc1cccc(C(=O)NCC(C)(C)CCCBr)c1I 227925635 JNJITEIUJKIMFK-UHFFFAOYSA-N 438.147 4.531 50 10 IJGE Brc1cc([C@H]2CCC[C@@H](CI)O2)oc1Br 306180382 JLXIVQSLWAROJR-POYBYMJQSA-N 449.908 4.850 50 10 IJGE Oc1ccc([C@@H]2CN(Cc3ccccc3)C[C@H]2CI)cc1Cl 382687052 GGLZHAWAZMUHFO-CVEARBPZSA-N 427.713 4.696 50 10 IJGE Clc1cc(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@H]32)ccc1CBr 404156388 PVNGKUCAURVNAJ-NHCUHLMSSA-N 435.793 4.715 50 10 IJGE O=C(Nc1sccc1C(=O)NNc1cccc(F)c1F)c1ccc2c(c1)CCCC2 748805764 ULRWWNSZMMYIHR-UHFFFAOYSA-N 427.476 4.914 50 10 IJGE COc1ccccc1Nc1nc2sc(C(=O)NNc3nccnc3C(C)C)cc2s1 772832344 YPWAKBSJPKUIKC-UHFFFAOYSA-N 440.554 4.780 50 10 IJGE O=C(NNc1cccc(F)c1F)C(=O)Nc1ccc(Sc2ccccc2)c(Cl)c1 785016580 DHBQIXZMESNVQY-UHFFFAOYSA-N 433.867 4.851 50 10 IJGE COCCSc1ccc([C@H](C)NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1 799578154 QHSGHKIOAVBZHY-ZDUSSCGKSA-N 438.475 4.703 50 10 IJGE C[C@@H](Cc1ccccc1Cl)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 918581958 BSONEENIELSZRS-IGCAKMCNSA-N 443.938 4.772 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)NCc2cnc(O)c3ccccc23)c1C 1471924034 XOZGKVREOSAJOV-BKUYFWCQSA-N 436.515 4.880 50 10 IJGE CCOc1cccc([C@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)c1O 1614624005 VOOLCAIJSHQBAD-WMZOPIPTSA-N 434.330 4.538 50 10 IJGE C/C(=C/C(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(C)c1C)c1cccc(F)c1 1629181449 OXRNCPZFOXFPTF-VKAVYKQESA-N 442.494 4.688 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2)[C@H]1c1c(F)cccc1Cl 1865686720 ZQZRWWBSXJEGKG-OAHLLOKOSA-N 448.807 4.961 50 10 IJGE Cc1ccc(C)c(Cn2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2cccnc2)c1 1865700277 OTOJVXFGTYQMGO-QHCPKHFHSA-N 433.515 4.828 50 10 IJGE C[C@@H](NCc1ccc(Br)cc1Br)c1nnc(CCl)s1 1877574108 SKWHNGMCJPVJMC-SSDOTTSWSA-N 425.577 4.653 50 10 IJGE CN(C[C@H]1C[C@H]1Br)C(=O)C(C)(C)c1ccc(NC(=O)OC(C)(C)C)cc1 1887829641 LTKYKVWZSXCGDI-CZUORRHYSA-N 425.367 4.553 50 10 IJGE C[C@H]1[C@@H](OC2(CI)CCN(C(=O)OC(C)(C)C)CC2)CC1(C)C 1901818108 FRIGVPBAHSLATE-KBPBESRZSA-N 437.362 4.642 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2ncccc12 1915301182 RNOPNSBEVZOHPO-HXUWFJFHSA-N 447.398 4.845 50 10 IJGE CCCc1ccc([C@@H](Br)c2cnn(C)c2I)s1 1940257459 AEHOHLHFQTWAIK-NSHDSACASA-N 425.133 4.523 50 10 IJGE C[C@H](Br)[C@@H]1CCN(C(=O)c2csc(Br)c2Br)C1 1945183592 JDVJYDWGLGKTFX-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)[C@@H]1CCC[C@H]1Br 2026567341 QZWAONXCSMUUCF-ZWNOBZJWSA-N 428.539 4.692 50 10 IJGE FC(F)(F)c1ccc(CBr)c(Br)c1I 2054871347 YSMQNEKATWZMLF-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE COc1c(CBr)cc(Cl)cc1S(=O)(=O)N(Cc1ccccc1)C(C)C 2059285866 FBSNEIZEXKFMBZ-UHFFFAOYSA-N 446.794 4.843 50 10 IJGE O=C(CBr)c1c(I)cc(C(F)F)cc1C(F)(F)F 2060394219 CTILQWDJEZIWHC-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE C[C@@H]1CCCN(C[C@H](CBr)c2ccccc2)[C@H]1CNC(=O)OC(C)(C)C 2106782685 SFSSKXMIHYYXBV-NEWSRXKRSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CC2(CBr)CCCCCC2)C[C@H]1C(F)F 2106784618 JVHFGCKENHNALP-CABCVRRESA-N 439.385 4.812 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1 2106784869 LRLFSRRTUKYDFU-FHWLQOOXSA-N 425.411 4.933 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)N(C[C@@H](CBr)CC1CC1)CCO2 2169172404 NSUANHCTRDRRRK-QGZVFWFLSA-N 439.394 4.721 50 10 IJGE FC(F)(F)CC1(CBr)CCN(Cc2cnsc2Br)CC1 2188332781 LCNPVZDQBDCKHR-UHFFFAOYSA-N 436.135 4.835 50 10 IJGE Cc1nn(C)c([C@@H](Cl)c2c(Br)cc(F)c(F)c2F)c1Br 2192375610 QNTYWHNNFIWMDN-VIFPVBQESA-N 432.465 4.999 50 10 IJGE O=C(NC[C@]1(CBr)C[C@H]1C(F)(F)F)c1cccc(OCc2ccccc2)c1 2192581191 OZMLNRVIPJQNSE-IEBWSBKVSA-N 442.275 4.959 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@@H]([C@H](C)Br)C(F)(F)F)cc1Cl 2195319752 CNZGQFARXQLKRN-WKEGUHRASA-N 437.481 4.855 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@@]1(F)CN(C[C@H](CBr)c1ccccc1)C2 2198086870 OPFGTJIIFQTCNO-WMQCIHAUSA-N 441.385 4.636 50 10 IJGE COc1cc(CCl)cc(Br)c1OCc1nscc1Br 2227113658 RNSFOKOLTOSGEH-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE Cc1ccccc1[C@@H](CBr)OCCOCCOCCOCc1ccccc1 2236089335 QKLWPITXAFUSQE-JOCHJYFZSA-N 437.374 4.698 50 10 IJGE C[C@@H]1C[C@H]([C@H](Br)Cc2cc(Br)cc(Br)c2)CO1 2252834149 GVNHUQLIPHKEBR-DFAYQTQMSA-N 426.974 4.943 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)[C@H]3CC[C@H]32)cc1I 2315552397 DQCYPLZRFLHJCS-UHIISALHSA-N 440.550 4.692 50 10 IJGE CC(C)N1C[C@@H](Br)[C@@H](Cc2ccc(Cl)cc2I)C1 2318531151 IHPJNTLHYFUKDT-WCQYABFASA-N 442.566 4.591 50 10 IJGE COc1cc(C=NNC(=O)c2cccc(N)c2)ccc1OCc1c(Cl)cccc1Cl 2323211660 PTQSQKGIXQXACA-UHFFFAOYSA-N 444.318 4.927 50 10 IJGE N#CC(=CNc1cccc(S(=O)(=O)O)c1)C(=O)NC1CCCCCCCCCCC1 2325471455 CCXVQMHYOHPWQJ-UHFFFAOYSA-N 433.574 4.542 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)cc([N+](=O)[O-])c1O 2325901948 ADFLZJRMAVNXQG-UHFFFAOYSA-N 447.472 4.955 50 10 IJGE Clc1ccc(I)cc1CN1CC2(CC(CBr)C2)C1 2327406695 LXRYDNVUUQEDRE-UHFFFAOYSA-N 440.550 4.552 50 10 IJGE CCC(=CC(=O)N[C@@](C)(CC)C(=O)Nc1ccc(SC#N)cc1)c1ccc(OC)cc1 2329560294 HDKHPTZIUVXNTF-DEOSSOPVSA-N 437.565 4.985 50 10 IJGE CC(C)n1ncc(Br)c1CN[C@@H](C)CCCCCI 2342244581 ZKXNIXRSNNGTBC-LBPRGKRZSA-N 442.183 4.700 50 10 IJGE C[C@H](Oc1cccc(Cl)c1)C(=O)N[C@H](CCBr)COCc1ccccc1 2343704074 FJNPDRSSGYCHFV-MAUKXSAKSA-N 440.765 4.594 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)[C@]1(C(=O)O)CCC(C)(C)C[C@H]1OCc1ccccc1 2378156736 QPUWQBALYRUTLC-VQQMMKBISA-N 438.406 4.711 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(C(=O)O)cc2)cc1OCc1ccc(F)cc1 33651126 OHOAYKDWJKOVDO-UNOMPAQXSA-N 446.434 4.657 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccccc2Cl)ccc1OCc1ccccc1C 40911535 AUNOQRZUPULBDR-VULFUBBASA-N 438.911 4.765 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NC(C)C)ccc1OC(=O)CCc1ccc(C(C)C)cc1 40996238 HHWZYBUMQRKKRI-HYARGMPZSA-N 434.536 4.788 50 10 IJGE O=C(CC[C@H](O)c1ccccc1)N/N=C\c1cn(Cc2ccccc2F)c2ccccc12 58891083 SMSUJBIEKMEMQS-WWUVGGQHSA-N 429.495 4.793 50 10 IJGE CC[C@H](Cl)c1noc(-c2cc(Br)ccc2I)n1 234028943 BRZRYJUBWCGDFP-QMMMGPOBSA-N 427.467 4.794 50 10 IJGE C[C@@H]1[C@H](n2c(CCCl)nc3cc(Br)cnc32)CCN1Cc1ccccc1 311901635 ALXGBJNVVVBECB-RDTXWAMCSA-N 433.781 4.811 50 10 IJGE CCC(CC)[C@H](Br)CNS(=O)(=O)c1c(Cl)cccc1Br 312322313 HNLMGKUDYVPUGC-LLVKDONJSA-N 447.620 4.581 50 10 IJGE Nc1ccc(Cl)c([C@H]2CN(Cc3ccccc3)C[C@H]2CI)c1 382696503 SFBRBWKAFIRAND-PBHICJAKSA-N 426.729 4.573 50 10 IJGE O=C(N[C@H](CCl)C1CCCCC1)c1cc(Cl)ccc1I 386038015 AGQGNGMMOOWUMX-CQSZACIVSA-N 426.125 4.862 50 10 IJGE CC(C)S(=O)(=O)CCC[C@@H](CBr)Cc1ccccc1Br 696943473 HSCBOVXSFCAKMH-CYBMUJFWSA-N 426.214 4.606 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N(C)[C@H](C)Cc2ccc(Cl)cc2)c(C)n1C[C@@H]1CCCO1 736516464 GHKDFPPEXUHRKZ-PPMZMRJGSA-N 439.987 4.934 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])c2ncccc12)c1nc(-c2ccccc2)n(-c2ccccc2)n1 770136931 WPHJZSHARZOOPN-UHFFFAOYSA-N 437.415 4.610 50 10 IJGE CCc1cc(NNC(=O)/C=C(\c2ccc(Cl)cc2)C(F)(F)F)nc(-c2ccccn2)n1 771008901 NKPJHZVWSZAHFK-FOWTUZBSSA-N 447.848 4.843 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(Oc3ccc(Cl)nn3)cc2)c(C(F)(F)F)c1 799401647 RTUCVMNIYLXSQN-UHFFFAOYSA-N 448.792 4.961 50 10 IJGE C#C[C@@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(OC)cc2)c1C)c1ccc(F)cc1 1129717070 PGOZRNHSSJHAAZ-KQQLFIIESA-N 427.479 4.640 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2nc3ccc(Cl)cc3s2)cc1)[C@H]1C[C@H]1C 1218458655 LFBJHEGYILWMBD-DIFFPNOSSA-N 429.933 4.860 50 10 IJGE O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc(-c2ccc3ccccc3c2)s1 1860391334 ATJDUNYKLCSWBW-VGOFMYFVSA-N 443.484 4.951 50 10 IJGE Cn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@H]2c1ccc(OCc2ccccc2)cc1 1865690230 MBMWINAXBCHVLM-HSZRJFAPSA-N 434.499 4.884 50 10 IJGE COc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2cccs2)cc1 1865698355 QTNJPMLJGPGXHW-HXUWFJFHSA-N 426.501 4.828 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1ccccc1OC)C(C#N)=C(N)O2 1865709738 FXHVOHJPDDGKLE-FQEVSTJZSA-N 438.890 4.513 50 10 IJGE Cc1ccc(-c2csc(/C(C#N)=C(\O)c3ccc(NS(C)(=O)=O)cc3)n2)cc1C 1872756639 TYRXGSWYYINAAI-ZZEZOPTASA-N 425.535 4.748 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)C(=O)Cc1cccc(Br)c1 1914609237 TUOSJRYRGLJZTM-AWEZNQCLSA-N 425.164 4.804 50 10 IJGE CCCCOCCOCCOCCN(Cc1ccccc1)[C@H](C)CCBr 1915114004 DYAUVADHIGRNOY-HXUWFJFHSA-N 430.427 4.512 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cccc(C(F)(F)F)c1 1916346829 FMBCLGCFANMWDW-KRWDZBQOSA-N 430.264 4.758 50 10 IJGE CC[C@H](Br)[C@H](C)NC(=O)c1cccc(Br)c1Br 1943882780 HUUJUYFXYXPNOU-CBAPKCEASA-N 427.962 4.503 50 10 IJGE BrC[C@H]1C[C@H]2CC[C@H]1N2Cc1ccc(Br)cc1Br 2039488785 VKWFBCZEBNKPIY-MPKXVKKWSA-N 438.001 4.959 50 10 IJGE C[C@H](CCBr)CCN1CCCCN(C(=O)OC(C)(C)C)CC(F)(F)C1 2046339875 RLUNLUMLFLBZFH-OAHLLOKOSA-N 427.374 4.766 50 10 IJGE O=C(NC[C@@H](Cl)CC(F)(F)F)c1cc(Br)c(Br)s1 2055503095 RMKSWLCDRKXNTO-BYPYZUCNSA-N 429.483 4.563 50 10 IJGE C[C@@H](Br)CCc1cn(-c2ccc(Br)c(Br)c2)nn1 2068982873 YNEJWMXYKHSZHG-MRVPVSSYSA-N 437.961 4.508 50 10 IJGE C=CCC[C@H](CBr)NC(=O)c1cc(Br)cc(Br)c1 2075329155 LGSLIYBEFQIUHF-GFCCVEGCSA-N 439.973 4.671 50 10 IJGE Cc1cc(C)c(-n2nc(CCl)c(I)c2C(F)(F)F)c(C)n1 2078889542 STKIKGWFYNLBHE-UHFFFAOYSA-N 429.611 4.555 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@H]1CCCCN(C(=O)OC(C)(C)C)C1 2112846759 JSVKGJQMNKZDPD-OALUTQOASA-N 425.411 4.887 50 10 IJGE Clc1cccc(CBr)c1N1CC[C@H]2COC[C@@H](C1)N2Cc1ccccc1 2139651560 DNDRSIVGZIRJPJ-RBUKOAKNSA-N 435.793 4.715 50 10 IJGE BrCc1c(N2CCC[C@@H]2[C@H]2CCN(Cc3ccccc3)C2)nc2sccn12 2145252391 DYTLJTRPUMJFAF-ZWKOTPCHSA-N 445.430 4.782 50 10 IJGE CCn1cc(Br)c(COc2c(F)cc(Br)cc2CCl)n1 2181149477 CNQVHALZBNXLBI-UHFFFAOYSA-N 426.511 4.885 50 10 IJGE F[C@@]12CCC[C@@]1(CCl)CN(Cc1ccc(I)c(Cl)c1)C2 2208029215 JNRMQNWHSFOWQA-HUUCEWRRSA-N 428.116 4.878 50 10 IJGE Cc1cc(Cl)cc(C(=O)NC[C@H]2C[C@@H](Br)C2)c1NC(=O)OC(C)(C)C 2223986250 ZEEIREPLHDHGFV-TXEJJXNPSA-N 431.758 4.899 50 10 IJGE C=CCOc1ccc(Br)cc1C=C(C#N)c1nn(-c2ccccc2)c(N)c1C#N 2297372314 WTQDKKWCWFIWKH-UHFFFAOYSA-N 446.308 4.718 50 10 IJGE O=C(C=Cc1ccccc1)NNc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCCC3 2297451032 BKXHYPAEUDFVOX-UHFFFAOYSA-N 448.592 4.999 50 10 IJGE C[C@H](CCCCBr)NCc1ccc(Cl)c(I)c1 2300238522 LYQYSISPOHPJDZ-SNVBAGLBSA-N 430.555 4.988 50 10 IJGE CC[C@H](Br)CN(CC)C(=O)c1ccc(Cl)cc1I 2317774704 RXZNSDGHKFHVRS-VIFPVBQESA-N 444.538 4.580 50 10 IJGE Cn1cc(I)c(C[C@@H](CBr)C2CCCCCC2)n1 2319155716 BDSMVCRSVVGEIM-LBPRGKRZSA-N 425.152 4.549 50 10 IJGE COc1ccc(OC)c(-c2csc(C(C#N)=C(O)Cc3ccc(OC)c(OC)c3)n2)c1 2331324500 IRGGUNYCICJGKV-UHFFFAOYSA-N 438.505 4.880 50 10 IJGE CC(C)(C)[C@@H]1CC[C@@H](Br)[C@@H](Cc2ncc(I)cn2)C1 2353065763 QVGYTFIAQAGOST-NQBHXWOUSA-N 437.163 4.850 50 10 IJGE Fc1c(Br)cc(Cl)c([C@H](Cl)[C@@H]2CO[C@@H]3COC[C@@H]32)c1Br 2362230953 CGCKSJGRCGDCIN-VVXOZJSZSA-N 448.941 4.945 50 10 IJGE CC1(C)C[C@H](Cl)C[C@H](NC(=O)c2ccc(Cl)cc2I)C1 2365587814 BNVIHRNMAREKCZ-MNOVXSKESA-N 426.125 4.861 50 10 IJGE O=C(c1cc(Br)sc1Br)N(CCCCl)C1CCOCC1 2381020467 DDRFWIWJKLGOTO-UHFFFAOYSA-N 445.604 4.523 50 10 IJGE Cc1ccc(Cn2c(SCC(=O)NN=Cc3cccc(C)c3)nc3ccccc32)cc1 8573200 DILSWXGKTMEQAS-UHFFFAOYSA-N 428.561 4.944 50 10 IJGE Cc1ccc(-n2ncc3c(NNC(=O)c4ccc(C(C)(C)C)cc4)ncnc32)cc1Cl 10386994 KCNGODXBJXHRDK-UHFFFAOYSA-N 434.931 4.832 50 10 IJGE O=C(COc1ccc(Cl)cc1Br)N/N=C/c1ccccc1C(F)(F)F 14018318 ZNVXPHYDIDHMAU-GZIVZEMBSA-N 435.627 4.650 50 10 IJGE Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@@H](C)Oc2ccc(-c3ccccc3)cc2)c1 14038714 KQDRONPKEYRSRO-HXUWFJFHSA-N 446.547 4.779 50 10 IJGE CCCCCN1C(=O)/C(=N\NC(=O)COc2cccc3ccccc23)c2cc(C)ccc21 38180240 BRJAZPOFSXDNID-FVDSYPCUSA-N 429.520 4.584 50 10 IJGE Cc1cccnc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccc1Cl)CCC2 40812573 HBCXDVVJOWCPFC-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE COc1cc(/C=N/NC(=O)COc2cc(C)cc(C)c2C)ccc1OCCc1ccccc1 40888753 ULORVZJNWISENU-OGLMXYFKSA-N 446.547 4.771 50 10 IJGE COc1cc(Br)cc(/C=N/NC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)c1O 169889081 AXKCZMQEVHTZGQ-XQFVPSOISA-N 435.362 4.610 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)/C(C#N)=C\Nc1ccccc1Br 217186706 GXTWFRDIGVGUEU-NWCRWOLESA-N 428.330 4.853 50 10 IJGE O=C(NC[C@@H]1CCC[C@H](CCl)C1)c1cc(Cl)ccc1I 312524997 USAQMUONRFYAOE-WDEREUQCSA-N 426.125 4.720 50 10 IJGE CC[C@](C)(CO[C@@](C)(CI)c1ccccc1Br)OC 319264029 BYDPGBVDKWNUIC-CABCVRRESA-N 441.147 4.931 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)CCN1S(=O)(=O)c1cc(Cl)cc(CCl)c1Cl 382647769 PHRFPOUSKQAIEA-CQSZACIVSA-N 447.815 4.627 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2c(F)cccc2Br)[C@@H](CBr)C1 382689016 KNYJYJFCXGJNBZ-QWRGUYRKSA-N 437.147 4.934 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2ccc(F)c(Br)c2)[C@@H](CBr)C1 382693825 ANTMUFJZZCQKOM-NWDGAFQWSA-N 437.147 4.934 50 10 IJGE C[C@H]1CN(S(=O)(=O)c2cc(CCl)c(Cl)cc2Cl)CCN1Cc1ccccc1 396341699 NQYXXSGUYJAFMR-AWEZNQCLSA-N 447.815 4.627 50 10 IJGE ClCc1ccc(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@@H]32)cc1Br 404208345 VJRBOZYRWCJAGY-SFTDATJTSA-N 435.793 4.668 50 10 IJGE C[C@H](Cl)c1nc2cccc(Br)c2n1C[C@@H]1CN(Cc2ccccc2)CCO1 697705904 BRULOGTVAUUVOC-RDJZCZTQSA-N 448.792 5.000 50 10 IJGE CN(C(=O)c1cc(Br)sc1Br)[C@H]1CCC[C@@H]1Br 709101713 GDOIVCXYYAHHMH-YUMQZZPRSA-N 446.002 4.661 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N2[C@H]3CC[C@H]2CC(O)C3)c(C)n1-c1cccc(Cl)c1Cl 736189745 UTNLYZCGFSQWRF-FHMFCWSGSA-N 444.362 4.822 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CC(=O)Oc1ccc([N+](=O)[O-])c2ncccc12)c1ccccc1 770126619 BZDSUENNNUGPGR-QGZVFWFLSA-N 437.452 4.705 50 10 IJGE Cn1cc(C(=O)NNC(=O)c2[nH]ccc2-c2c(Cl)cccc2Cl)c2ccccc21 799527300 YDLRXUIBYSKEIK-UHFFFAOYSA-N 427.291 4.555 50 10 IJGE CC(=O)CCc1ccc(OCCC(=O)NNc2ccc(Cl)cc2Br)cc1 1148973277 VGFVABUFTNYCJY-UHFFFAOYSA-N 439.737 4.536 50 10 IJGE COc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(C)cc2)CCC3)cc1 1772744689 GLAJIHNEIXIFFN-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE Cc1ccc(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)cc1 1865707934 JUVPDQLZMXVFDW-KRWDZBQOSA-N 428.389 4.616 50 10 IJGE CCC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1882088526 RXMCAANCDIWADN-PMPSAXMXSA-N 449.430 4.948 50 10 IJGE Brc1cccnc1C[C@H](Br)c1ncsc1Br 1924866219 TXTPJEFYQHGETK-ZETCQYMHSA-N 426.959 4.742 50 10 IJGE CN(C[C@@]1(C(C)(C)C)CC[C@](C)(CI)O1)C(=O)OC(C)(C)C 1929974649 KJBZKPUYMUXCCM-IAGOWNOFSA-N 425.351 4.642 50 10 IJGE O=C(NCC[C@H](Br)C1CC1)c1scc(Br)c1Br 1942746977 YRAMWGQTEVLFJM-ZETCQYMHSA-N 446.002 4.567 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CCCC[C@@H](Br)C1 2050109094 WQLRQUNVLHMWRJ-SNVBAGLBSA-N 439.973 4.601 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)C(C)(C)C)[C@@H](CC(F)F)C1 2063525290 TXOJGSMPEQCZOH-KBPBESRZSA-N 427.374 4.620 50 10 IJGE Cl[C@@H]1CCC[C@H]2CC[C@H]1N2c1ncc(I)cc1Br 2069534613 XRBHVMLRRZUWHT-MVWJERBFSA-N 441.538 4.577 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1C1CCN(CC2(CBr)CCC2)CC1 2129053752 DMOKBTRTVFKSHH-UHFFFAOYSA-N 427.387 4.501 50 10 IJGE O=C(c1ccc(Cl)cc1Br)N1CC[C@H](Br)C(F)(F)CC1 2150019896 WBQQJMOCAIHYPD-NSHDSACASA-N 431.502 4.737 50 10 IJGE O=C(NC[C@H]1CCCC[C@H](Cl)C1)c1cc(Cl)ccc1I 2163753133 FXVYDARRJQNUMY-QWRGUYRKSA-N 426.125 4.862 50 10 IJGE CCCN(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)[C@@H](Br)C1CCCC1 2167031237 HXILNHVAKYYMSB-AEFFLSMTSA-N 445.442 4.826 50 10 IJGE CCCN(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2167033898 TZKCSFJQVSQSAY-ZWKOTPCHSA-N 445.442 4.968 50 10 IJGE Clc1cc2c(cc1[C@@H](Cl)c1cc(I)sn1)OCCCO2 2176535414 ACXSDWJMZYHOFR-CYBMUJFWSA-N 442.105 4.891 50 10 IJGE C[C@@H](CCC1CC1)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2179788644 FTBCINMZAROIOU-VIFPVBQESA-N 445.242 4.605 50 10 IJGE N[C@H](c1c(F)cc(Br)c(F)c1Br)C1CC(Br)C1 2250746815 DLTFQLCQBXFKMG-UTNXVAPVSA-N 433.916 4.663 50 10 IJGE N#CC(N=Cc1ccc(Cl)cc1)=C(C#N)NC(=O)Nc1ccc(OC(F)(F)F)cc1 2297563748 PAMAMOBIHBGHGA-UHFFFAOYSA-N 433.777 4.738 50 10 IJGE CC(C)(CCCl)C(=O)Nc1ccc(Br)cc1I 2300172866 XSXJAMVULPYBRT-UHFFFAOYSA-N 430.511 4.647 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@H]2CCCC[C@@H]3C[C@H]23)CC1 2302658514 RWRYBCLCFKEFCP-PMPSAXMXSA-N 449.373 4.786 50 10 IJGE C[C@H](CCCCCl)NCc1ccc(I)c(Br)c1 2306219938 RLKYQWKQABMRJT-SNVBAGLBSA-N 430.555 4.941 50 10 IJGE COc1ccc(C=C(C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1Cc1ccccc1 2313567307 IOOFXFVKNKNCED-UHFFFAOYSA-N 437.543 4.542 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Br)Cc1ccccc1F 2316702138 WBOSZOYOQBMCME-QMMMGPOBSA-N 440.936 4.763 50 10 IJGE CN(c1nc(C(F)(F)F)ccc1CBr)[C@H]1CCN(Cc2ccccc2)C1 2343787549 HWHASDHATFVFCH-INIZCTEOSA-N 428.296 4.706 50 10 IJGE O=[N+]([O-])c1ccc(OCc2cccc(I)c2)c(CBr)c1 2367525881 GXAHDDIGOKFUTI-UHFFFAOYSA-N 448.054 4.673 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@]1(CBr)CC1(F)F 2379981023 CAFPGLZQQRGHTN-LJQANCHMSA-N 445.348 4.884 50 10 IJGE CC(C)(C)c1n[nH]c2c1[C@@H](c1ccc(OC(=O)c3ccccc3Cl)cc1)C(C#N)=C(N)O2 9861005 NRBAHNGZSAUMSR-SFHVURJKSA-N 448.910 4.798 50 10 IJGE CCOc1c(Cl)cc(/C=C/C(=O)NNC(=O)c2cc(Cl)ccc2Cl)cc1OC 15985931 VJRHWNCWZUQEKQ-QPJJXVBHSA-N 443.714 4.529 50 10 IJGE COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(C)o2)cc1Cl 38688700 UDJQEHIQIDQQKS-NRFANRHFSA-N 436.851 4.687 50 10 IJGE CCCCCCCCCOc1ccc(C(NC(=O)CCl)NC(=O)CCl)cc1OC 101118297 KMGCDAXWKUOBBE-UHFFFAOYSA-N 447.403 4.533 50 10 IJGE N#C/C(=C/c1ccc(-c2cc(Cl)c([N+](=O)[O-])cc2Cl)o1)C(=O)NCc1ccco1 111463637 UWZMSFCOLQPZJM-WDZFZDKYSA-N 432.219 4.978 50 10 IJGE CCCOCCO[C@@](C)(CI)c1ccccc1Br 162335018 WRKAJYJMVZHVPW-AWEZNQCLSA-N 427.120 4.543 50 10 IJGE COc1cccc(/C=N/NC(=O)c2cc3ccccc3n2C)c1OCc1cccc(C)c1 169926288 UQVFKCQENZIYJE-JVWAILMASA-N 427.504 4.838 50 10 IJGE C[C@@H]1[C@H](Br)C[C@H]2CC[C@H]1N2c1ncc(Br)cc1Br 686175220 DPFFOHBFKAUJBZ-UGKPPGOTSA-N 438.989 4.747 50 10 IJGE COc1ccc(NC(=S)NNC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)cc1F 732681733 KAAHMEACNXPWCF-UHFFFAOYSA-N 447.438 4.536 50 10 IJGE CCOc1cc(C=NNC(=O)CC[C@@H](O)c2ccccc2)ccc1OCc1ccccc1 1084005517 BKVODXRRQGEUTK-HSZRJFAPSA-N 432.520 4.628 50 10 IJGE O=C(NN=Cc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc(Oc2ccccc2)cc1 1084209179 FYRLVQCKTTXPTG-UHFFFAOYSA-N 428.275 4.875 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)s1 1446388298 RTZYXCZCEBFXCV-UHFFFAOYSA-N 446.907 4.872 50 10 IJGE C#CCN(CC1CC1)C(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1535756126 MAJIQZZBVDSUEQ-UDWIEESQSA-N 425.454 4.892 50 10 IJGE C=CC[C@@H]1CCCC[C@@H]1NC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12 1565063749 SEDFICIXTJKUGM-GCJKJVERSA-N 428.536 4.981 50 10 IJGE Cc1ccc2cccc(OC(=O)c3oc4c(c3C)C(=NNC(=O)c3ccco3)CCC4)c2n1 1772746389 BMUDMGQNJZWRAC-UHFFFAOYSA-N 443.459 4.727 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3-c2ccccc2)cc1OC 1865697190 PBMYOOIDZYVXSC-HSZRJFAPSA-N 444.535 4.840 50 10 IJGE COc1ccc(C)cc1-c1csc(/C(C#N)=C/c2cc3c(cc2[N+](=O)[O-])OCCO3)n1 1872791346 FGTLVDAYXLFWPG-OVCLIPMQSA-N 435.461 4.871 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@]23CC[C@H](CI)O3)C1 1939507019 RURZTYCNAZCZCT-OLMNPRSZSA-N 435.346 4.540 50 10 IJGE C[C@H]1C[C@@H]1CCCOC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1985940437 LJJLTEUSYVGDOT-GJZGRUSLSA-N 437.362 4.644 50 10 IJGE C[C@H](NC(=O)c1cccc(Br)c1Br)C1(CBr)CC1 2031479185 VTUGVCVBINPCNT-QMMMGPOBSA-N 439.973 4.505 50 10 IJGE COCCOC[C@H](Br)CCc1ccc(Br)cc1Br 2038173305 IPTGVXUUWUKITN-GFCCVEGCSA-N 444.989 4.571 50 10 IJGE Cc1sc(Br)cc1C(=O)N[C@@H](C)CCCCCI 2054162964 VOEDITXIOIEJOJ-VIFPVBQESA-N 444.176 4.933 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCN[C@@H]1CCc2ccc(Br)cc21 2061264710 SUNIQMCJJACRDT-MRXNPFEDSA-N 447.464 4.932 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](C(F)(F)F)CCN1C[C@H](CBr)C1CC1 2107587291 UQDODWPJUPPSQF-ZNMIVQPWSA-N 443.348 4.575 50 10 IJGE Cc1cc(N2CCC[C@@]3(CN(Cc4ccccc4)CCO3)C2)ccc1CBr 2151739474 NISZUWHOJUFZCB-HSZRJFAPSA-N 429.402 4.761 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@H](CBr)c2ccccc2)CC12CCC2 2163059309 RYUJAABKUJYQMK-RBUKOAKNSA-N 437.422 4.934 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2CCN(C[C@H](CBr)c3ccccc3)C[C@H]2C1 2163062279 KPULMVCZAXAOTJ-UFYCRDLUSA-N 437.422 4.744 50 10 IJGE CC(C)CNCc1cc(Br)c(OC[C@@H]2C[C@@H]2Cl)c(Br)c1 2196896953 TUBQKIGXPROQSQ-FZMZJTMJSA-N 425.592 4.963 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@]12C[C@@H](CBr)C2 2282967041 MNUINUSCTNITRP-PWRNUNNXSA-N 425.523 4.631 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)ccc1OCc1ccc(C(=O)O)cc1 2294187379 HSAARHKTHWEWCV-UHFFFAOYSA-N 442.471 4.827 50 10 IJGE Br[C@H]1CCC2(CCC2)N(Cc2sccc2I)C1 2301069308 VKQGCVGOMKVXFV-JTQLQIEISA-N 426.161 4.635 50 10 IJGE CC1=C(C#N)C(=O)N(C2CCCCC2)C(=O)C1=Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 2314617527 ZYINPWINKLJSMN-UHFFFAOYSA-N 431.448 4.780 50 10 IJGE CCn1cnc(Oc2cc(Br)cc(I)c2)c1CCl 2316758606 SFFYNQVISBLNSW-UHFFFAOYSA-N 441.494 4.801 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)CCc3nc4ccccc4[nH]c3=O)n2)cc1F 2331337633 NZKQGMNANGBXLZ-UHFFFAOYSA-N 448.479 4.620 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(O[C@H]2CCOc3ccccc32)C1 2340300322 XFENJBIVMNUGFK-FXAWDEMLSA-N 426.351 4.691 50 10 IJGE CCCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2351887543 ALCALDJPGPCJQJ-QAPCUYQASA-N 439.385 4.908 50 10 IJGE CCOc1cccc(N2C[C@@H]3CN(Cc4ccccc4)C[C@@]3(C)C2)c1CBr 2367569956 JLCNTCJCPBYHFR-CVDCTZTESA-N 429.402 4.939 50 10 IJGE Cc1cccc(C)c1OCC(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1C(C)(C)C 14661620 VGSLKIGATOHKEF-UHFFFAOYSA-N 440.584 4.504 50 10 IJGE COc1ccc(C)cc1NC(=O)[C@@H](NNC(=O)c1ccc(C(C)(C)C)cc1)c1ccccc1 15474806 YRDPLFYAAGFVBY-DEOSSOPVSA-N 445.563 4.916 50 10 IJGE CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3cccc(C)c3)ccc21 38650427 RCPXBYLQKDJCBB-XMMPIXPASA-N 426.472 4.831 50 10 IJGE Cc1ccc(-c2ccc(/C=C(\C#N)C(=O)Nc3sc4c(c3C(N)=O)CCCC4)o2)cc1 39884980 BZGNCWGNPMVZNK-FOWTUZBSSA-N 431.517 4.840 50 10 IJGE O=C1CCc2cc([C@H](Br)c3cccc(I)c3)ccc2N1 40283379 QDWBYHRZMQUHOS-MRXNPFEDSA-N 442.094 4.660 50 10 IJGE COc1ccccc1CN(C(=O)CCl)[C@@H](C(=O)NC1CCCCC1)c1ccccc1C 97914444 CDMGAMUOZAQFBF-XMMPIXPASA-N 442.987 4.761 50 10 IJGE CNC(=O)/C(C#N)=C1\S[C@H](Cc2ccc(Cl)cc2)C(=O)N1c1ccc(C(C)C)cc1 101240533 WXVDGBVENXTEGK-LBMWUGKUSA-N 439.968 4.636 50 10 IJGE Br[C@@H](c1ccc2c(c1)OCCO2)c1ccccc1I 109851440 PFBSQZKYEFZBBW-HNNXBMFYSA-N 431.067 4.547 50 10 IJGE O=C(N[C@@H](CCl)Cc1ccccc1)c1cc(Br)ccc1Br 161205912 OIJBZWQQDGUOOR-CYBMUJFWSA-N 431.555 4.792 50 10 IJGE COc1cc(/C=N\NC(=O)c2cccnc2)ccc1OCc1ccc(Cl)c(Cl)c1 169888171 GORRHYZWZVJGGU-GATIEOLUSA-N 430.291 4.740 50 10 IJGE Cc1cccc(C(=O)N[C@H](CCBr)C(C)(C)C)c1I 231171897 JLWPCMUDKHXFCF-GFCCVEGCSA-N 438.147 4.529 50 10 IJGE CCC[C@H](C)CO[C@](C)(CI)CN(CC)C(=O)OC(C)(C)C 233338328 HVYMGRFPMYJIDS-WMLDXEAASA-N 427.367 4.890 50 10 IJGE Cc1ccc(C)c(-n2c(C)cc(C=NNC(=O)C(=O)Nc3cccc4ccccc34)c2C)c1 254591225 MTRVUKWNPVUZEL-UHFFFAOYSA-N 438.531 4.953 50 10 IJGE CC(=O)[C@@H](Br)[C@H](C)c1cc(Br)ccc1I 300899878 KHASSOBOJBMQOV-KBUNVGBDSA-N 445.920 4.510 50 10 IJGE CC[C@H](C[C@@H](C)Br)NC(=O)c1scc(Br)c1Br 716903966 AAXZGNYPFSYGOQ-RNFRBKRXSA-N 448.018 4.955 50 10 IJGE N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NNC(=O)c2cccc3cccnc23)c1 735036973 BQTCVKJUPBLEQI-UHFFFAOYSA-N 442.862 4.627 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)NNc1ccc(F)cc1Br)O[C@H](C)C2 748073889 GMRBOOOVRWUSSY-DIOULYMOSA-N 449.320 4.557 50 10 IJGE O=C(NCCS(=O)(=O)c1ccccc1)Nc1ccc(S(F)(F)(F)(F)F)cc1 752971578 CCMTVOJWFUABGN-UHFFFAOYSA-N 430.420 4.939 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)NCc2cc(O)nc3ccccc23)c1C 754317349 HMKGTDCNQCXVLN-FYJGNVAPSA-N 436.515 4.880 50 10 IJGE Cc1ccccc1CC(=O)NNC(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 763633485 IIVRYORGKGHUCS-AWEZNQCLSA-N 442.972 4.714 50 10 IJGE O=C(NNc1ccnc(Br)c1)c1csc(-c2cccc3ccccc23)n1 771542684 ZBBCSIWDHXKCJA-UHFFFAOYSA-N 425.311 4.878 50 10 IJGE CCc1noc(C2CCC(=NNC(=O)c3ccccc3OCc3ccc(F)cc3)CC2)n1 778538131 GDCZVXIKEODWHZ-UHFFFAOYSA-N 436.487 4.794 50 10 IJGE N#C/C(=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)NCc1ccc([N+](=O)[O-])cc1 787149669 UAVRDNFZJAJDOC-WLRTZDKTSA-N 443.303 4.856 50 10 IJGE CCCCCCCCC(=O)NN=Cc1ccccc1OS(=O)(=O)c1ccc(C)cc1 1081086827 RQJRVOIRNKLXBR-UHFFFAOYSA-N 430.570 4.963 50 10 IJGE C/C(=C\C(=O)NNC(=O)Nc1ccc(Br)cc1)c1cccc(C(F)(F)F)c1 1467430039 UMKUJGDPUFIZPB-PKNBQFBNSA-N 442.235 4.724 50 10 IJGE C=CCOc1cccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)c1 1667733211 MXVNMBRQSJVTNU-UHFFFAOYSA-N 438.487 4.933 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)CCOc1ccccc1)c1ccc(C(F)(F)F)cc1 1685817723 VRYXXNYAUVAHDZ-LJQANCHMSA-N 435.446 4.512 50 10 IJGE Cc1c(C(=O)Nc2cccc(Cl)c2)oc2c1C(=NNC(=O)c1ccc(O)cc1)CCC2 1772744824 KRJDFHOVYRTLKU-UHFFFAOYSA-N 437.883 4.670 50 10 IJGE Cc1ccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4ccc(Cl)cn4)c(C)c32)cc1 1772745061 RANMQEXORDQTGP-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE COc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)Nc3cccc(C)c3)c(C)c21 1772745983 NBBYJQAAQHGKQP-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE CC(C)(C)c1ccc(/C=N/NC(=O)Cn2cnc3scc(-c4ccccc4)c3c2=O)cc1 1860773104 QTDKJNWQHYPDEJ-UVHMKAGCSA-N 444.560 4.573 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)c1cccc(C(F)(F)F)c1 1865755899 WHHKJDVXQILPDD-UHFFFAOYSA-N 433.817 4.804 50 10 IJGE CCOC(=O)c1cc(CC)sc1NC(=O)/C(C#N)=C/c1ccc(Br)cc1 1866129561 ZDQQTUKBIQDSBJ-UKTHLTGXSA-N 433.327 4.795 50 10 IJGE Clc1ccc(-n2cnc(CBr)c2)c(Cl)c1I 1937733252 BJVPZRDSSOLGBO-UHFFFAOYSA-N 431.886 4.679 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1Cc1ccc(Br)cc1Br 1943859443 PCQCZWKMNRZHNC-CABZTGNLSA-N 425.990 4.959 50 10 IJGE O=S(=O)(c1cc(CCl)ccc1Br)N(Cc1ccccc1)CC(F)F 1946836122 UCBUANWVWIGAPA-UHFFFAOYSA-N 438.721 4.644 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)C(=O)c1ncc(Br)cc1Cl 1974521649 RMNCBMWCFQTGPY-LLVKDONJSA-N 446.570 4.923 50 10 IJGE Cc1cc(Br)c(CNCCSSCCNC(=O)OC(C)(C)C)s1 1985347512 TXZIKYMIRADMQE-UHFFFAOYSA-N 441.482 4.815 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CC12CCC1(CC2)CC[C@@](C)(CI)O1 1996430096 GSEVDOPMWRJWMK-WBQSDOAFSA-N 449.373 4.834 50 10 IJGE Brc1cnc(N2C[C@@H](Br)CC3(CCC3)C2)c(Br)c1 2033947242 XTOKVEIEOZUXSY-JTQLQIEISA-N 438.989 4.751 50 10 IJGE CCC[C@@H](CBr)CN1CCCCN(C(=O)OC(C)(C)C)CC(F)(F)C1 2046340054 UOUVUOUYMQTVNN-HNNXBMFYSA-N 427.374 4.766 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1Cc2ccccc2N(C[C@H](CBr)C(C)(C)C)C1 2106787897 LIZLYIJSSFJWPM-DLBZAZTESA-N 425.411 5.000 50 10 IJGE Cc1cc(Br)c(CCl)c(N2C[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)c1 2116805422 GVKIHBZMWBHGNL-SFTDATJTSA-N 435.793 4.586 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(Cc2ccc(CBr)cc2)CCC1(F)F 2126471846 OYDDDMCZIFYBNZ-INIZCTEOSA-N 433.337 4.706 50 10 IJGE O=C(NC1(CCCl)CCSCC1)c1c(Br)cccc1Br 2150492709 CVQRAERPPUTTEK-UHFFFAOYSA-N 441.616 4.836 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(NC(=O)c3ccc(CBr)cc3)CCC[C@@H]12 2162588703 IYSMJZXKHJLYMQ-DYESRHJHSA-N 437.378 4.634 50 10 IJGE BrC[C@@H]1CCC2(CCC2)CN1C[C@H]1CC1(Br)Br 2213086922 BSLDYQSBERSSQA-MNOVXSKESA-N 430.022 4.522 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@@H]1CCOC1 2250737371 CDYTVLNSMDGXAJ-MLUIRONXSA-N 434.900 4.962 50 10 IJGE Cc1cnc(N(C)Cc2ccc(I)cc2)c(CBr)c1 2265601835 CFQHVFLXMUZPMK-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE N#CC(=Cc1ccc(-c2cccc(F)c2)o1)C(=O)Nc1sc2c(c1C(N)=O)CCCC2 2296836378 BESYJBAYLUMEHP-UHFFFAOYSA-N 435.480 4.671 50 10 IJGE C=CCOc1cc(Br)c(C=C(C#N)C(=O)Nc2ccc(C)cc2)cc1OC 2313566994 AIIRPQIPGORMJL-UHFFFAOYSA-N 427.298 4.877 50 10 IJGE N#CC(=CNCCc1cccc(Br)c1)C(=O)Nc1ccc(Cl)cc1Cl 2324495531 KNIHCHBDOOEARG-UHFFFAOYSA-N 439.140 4.934 50 10 IJGE C[C@H](Cl)[C@H]1CCCN(Cc2ccc(I)c(Br)c2)C1 2325214129 NNUSJNXLNFOHBX-JQWIXIFHSA-N 442.566 4.893 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN(Cc2cc(I)ccc2Cl)C1 2327397886 WTYYDNAJIVPWGR-MNOVXSKESA-N 442.566 4.798 50 10 IJGE COc1ccc([C@H](Br)c2c(Br)ncn2C)c(Cl)c1Cl 2337273346 ADJXZXJWBNMJMO-QMMMGPOBSA-N 428.939 4.982 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)CCN(c2nc(C(F)(F)F)ccc2CBr)C1 2369840060 NQKUOFVWTBADNV-OAHLLOKOSA-N 442.323 4.954 50 10 IJGE COc1ccc(C(=O)N/N=C/c2ccccc2OCc2ccc(Br)cc2)cc1 1949863 VTFKAXLVVYCOOM-ZVHZXABRSA-N 439.309 4.801 50 10 IJGE C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1 14665992 NYJWMWLPUVBAKJ-ZWKOTPCHSA-N 434.536 4.520 50 10 IJGE CC[C@@H](C)c1nc(N2CCN(C(=O)CCCl)CC2)c2c3c(sc2n1)C[C@H](C)CC3 35865713 YPNDOAIXAOVHJE-HUUCEWRRSA-N 435.037 4.607 50 10 IJGE CC(C)COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccco2)cc1 38657465 PYMBCMLTQOMDNT-QHCPKHFHSA-N 430.460 4.752 50 10 IJGE COc1ccc(/C=C/C(=O)Oc2ccc(/C=C(\C#N)c3nc4ccccc4c(=O)[nH]3)cc2)cc1 39868089 QEUIAWMLWQZSTA-XRSREISPSA-N 449.466 4.615 50 10 IJGE Cc1c(Cl)cccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1cccnc1)CCC2 40814120 SOPBBGLHYFRYAB-OVVQPSECSA-N 436.899 4.668 50 10 IJGE Cc1ccc(N/C=C(/C#N)C(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1 216485749 DJQMYXARCBYREO-DAFNUICNSA-N 436.559 4.748 50 10 IJGE Cc1ccc(C(C)C)cc1OCC(=O)NN=Cc1ccc(OC(=O)c2ccccc2)cc1 254555589 ZROQIDXURKWMOC-UHFFFAOYSA-N 430.504 4.867 50 10 IJGE O=S(=O)(c1cc(Br)cc(CCl)c1F)N(Cc1ccccc1)C1CC1 383679676 WHZGVAONRSABJL-UHFFFAOYSA-N 432.742 4.680 50 10 IJGE C/C(NCCSSCCN/C(C)=C1/C(=O)C[C@@H]2[C@@H]1C2(C)C)=C1/C(=O)C[C@@H]2[C@H]1C2(C)C 503976547 SZFRXFHQDNKSIE-HLWUAPEASA-N 448.698 4.585 50 10 IJGE Cn1ncc(Br)c1[C@H](Br)c1ccc(F)c(Br)c1 693046241 GZSXIGHVVPUEFB-SNVBAGLBSA-N 426.909 4.569 50 10 IJGE C[C@@H](CC(C)(C)C)CC(CBr)(CBr)[C@H]1CCS(=O)(=O)C1 709256890 FYBGABQDHBNLID-STQMWFEESA-N 432.262 4.660 50 10 IJGE Clc1ccc(CBr)c(N2CC[C@@]3(CN(Cc4ccccc4)CCO3)C2)c1 717591038 HQPSQYNWKWDWCU-OAQYLSRUSA-N 435.793 4.716 50 10 IJGE COc1ccc(Cl)cc1[C@@H](CC(C)C)NC(=O)NNC(=O)c1cn(C)c2ccccc12 738449990 IVOHXQMVTPPMJR-LJQANCHMSA-N 442.947 4.572 50 10 IJGE CCN(CC)c1c(C=NNC(=O)CCCNc2cccc(C)c2)c(C)nn1-c1ccccc1 1084059156 ATSISOWFNOQDEH-UHFFFAOYSA-N 446.599 4.678 50 10 IJGE COc1ccc(C=NNC(=O)COc2ccc(C(C)(C)C)cc2Br)cc1C 1084064031 DKZYCWKEZBCNMS-UHFFFAOYSA-N 433.346 4.593 50 10 IJGE C=CCN(CC=C)C(=O)c1ccc(NC(=O)NNc2cccc(F)c2Br)cc1 1214914503 RWRCKGVNHQMLDB-UHFFFAOYSA-N 447.308 4.551 50 10 IJGE Cc1ccc(Cn2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2cccc(Br)c2)cc1 1865683666 HRFCBASGPBHJEP-FQEVSTJZSA-N 435.325 4.529 50 10 IJGE CCOc1ccc(/C=N\NC(=O)c2ccc(-c3ccccc3OC)nc2C)cc1OCC 1865762432 FWFMGBUJPKHJSH-QQXSKIMKSA-N 433.508 4.627 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)NC2(c3ccc(Br)cc3)CCC2)cc1OC 1866130186 GFVYBGRZGYUUSW-FOWTUZBSSA-N 441.325 4.569 50 10 IJGE O=C(c1c(F)ccc([N+](=O)[O-])c1F)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915265993 SYEWRDDMBPAAKY-MRXNPFEDSA-N 439.256 4.689 50 10 IJGE CC(C)N(C[C@H](C)Br)C(=O)c1csc(Br)c1Br 1945186052 ACHBDYOFHCHGMC-ZETCQYMHSA-N 448.018 4.907 50 10 IJGE CC(C)[C@H](CCBr)NC(=O)c1csc(Br)c1Br 1945189307 NOXACLNVWMMARU-QMMMGPOBSA-N 448.018 4.813 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@@H]2CC[C@@H]3CC[C@H]2C3)C1 1947121237 RLGDHLKHQCFEJR-YIOZNXECSA-N 449.373 4.786 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@]1(CCC[C@H](CI)O1)C2 1949545465 AGKZDVKFMWUETI-DNVCBOLYSA-N 449.373 4.931 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCCC[C@@H](Br)C1 2003408863 AFAVBAKVMITFQM-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE CC1(C)[C@@H](Br)CCCN1c1ncc(Br)cc1Br 2020205852 KKFSGKKITUDWHN-JTQLQIEISA-N 426.978 4.749 50 10 IJGE C[C@@](CBr)(NC(=O)c1cc(Br)cc(Br)c1)C1CC1 2029956291 FUXQCLBAUGBHHB-ZDUSSCGKSA-N 439.973 4.505 50 10 IJGE CC[C@@H](Br)c1cn(Cc2cccc(Br)c2Br)nn1 2031481865 MJHNQNICADTXDA-SECBINFHSA-N 437.961 4.697 50 10 IJGE O=C(CBr)c1c(I)ccc(C(F)(F)F)c1C(F)F 2060394348 HGIHXOVUUKJZRK-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE CC1(C)[C@@H]([C@H](Br)c2cc(I)cc3c2OCC3)C1(F)F 2097390567 NCBXUFRWPRJXOV-ZYHUDNBSSA-N 443.069 4.953 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1[C@@]12C[C@@H]1CN(Cc1ccccc1)C2 2099678488 JAOOCDSFRQWAPN-XBHMSOGKSA-N 431.765 4.725 50 10 IJGE Clc1cc(Br)cnc1CNC1(CCBr)CCSCC1 2127191371 WBXFNXYFYIFUDV-UHFFFAOYSA-N 428.621 4.638 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 2153115064 VBMVDWJYWWQETL-IGOJGBNBSA-N 445.792 4.586 50 10 IJGE CCN(c1ncc(Br)cc1Br)[C@@H]1CCC[C@H]1Br 2212910297 FWYZDHCDFLCCCO-MWLCHTKSSA-N 426.978 4.749 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@H]2[C@H]3CCOC[C@@H]32)c1 2263519219 OVIPCZRMKQZRID-XDQVBPFNSA-N 438.985 4.800 50 10 IJGE COc1ccc([C@@H](Cl)c2c(Br)cnn2C)c(Br)c1Cl 2268264430 SIZQUUIEGRJMAZ-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE COc1ccc([C@H](Cl)c2cn(C)nc2Br)c(Br)c1Cl 2268266045 MZDJAJMXCSSUTP-JTQLQIEISA-N 428.939 4.935 50 10 IJGE C=CCNC(=O)C(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc(OCCCC)cc1 2296706743 NNZHYMHXGPVIKQ-UHFFFAOYSA-N 426.520 4.927 50 10 IJGE COC[C@@H]1C[C@H](Br)[C@@H](Cc2ccc(Cl)cc2I)C1 2318528865 KALFIMZSKDCAIN-NDMJEZRESA-N 443.550 4.923 50 10 IJGE ClCc1cccnc1OCc1ccc(I)c(Br)c1 2325382042 QJCDROXKYNKWLE-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE CC(C)[C@@H]1C[C@@H](Br)CN1Cc1cc(I)ccc1Cl 2327398786 IRVJLRPHGPNTDT-RISCZKNCSA-N 442.566 4.938 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@H]2C[C@@H](Cl)CC[C@H]21 2328608803 WBXIGAGWDQPYFX-OYNCUSHFSA-N 427.589 4.895 50 10 IJGE CC(=O)Nc1ccc2nc(NC(=O)C(C#N)=Cc3cccc(Br)c3)sc2c1 2329698753 BYLWZGPLYGPVEM-UHFFFAOYSA-N 441.310 4.563 50 10 IJGE Cc1cc(S(=O)(=O)N(C[C@@H](C)Br)C2CCCC2)sc1Br 2368873138 KQBQVZLHUVJDOP-SNVBAGLBSA-N 445.242 4.536 50 10 IJGE O=C(CSc1nc(-c2ccccc2)cs1)N/N=C/c1cc(Br)ccc1O 40924313 DZZHRBGGSVVAFC-AWQFTUOYSA-N 448.367 4.521 50 10 IJGE O=C(CCC(=O)Nc1ccccc1Br)N/N=C/c1ccc(Cl)c(Cl)c1 59379431 DYYCJQABTYEXDS-UFFVCSGVSA-N 443.128 4.625 50 10 IJGE C[C@@H]1CCCC[C@H]1NC(=O)[C@H](c1ccccc1Cl)N(Cc1ccco1)C(=O)CCl 230275349 QZISYCZGFXOATA-VMRPVKRXSA-N 437.367 4.937 50 10 IJGE C[C@H]1CCC[C@@](CCl)(NC(=O)c2cc(Cl)ccc2I)C1 235628313 POAJXRIDRIZFPK-ZUZCIYMTSA-N 426.125 4.862 50 10 IJGE Nc1ccc(C(=O)NN=Cc2cn(Cc3ccc(Cl)cc3)nc2-c2ccccc2)cc1 254480407 OHZQOTZSBGOAQU-UHFFFAOYSA-N 429.911 4.598 50 10 IJGE CC(=O)[C@H](Br)[C@H](C)c1cc(I)ccc1Br 300889920 DLYGKXKEFOOPSQ-KSBSHMNSSA-N 445.920 4.510 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1C(=O)c1cc(Br)ccc1Br 384245008 JFVXECZQEVDZMJ-KWQFWETISA-N 439.973 4.600 50 10 IJGE CC1(C)OC[C@@H](Cc2cc(Cl)ccc2I)[C@@H]1Br 405540283 RMYOJPTYBICSLN-SKDRFNHKSA-N 429.523 4.676 50 10 IJGE C[C@@H]1[C@@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1scc(Br)c1Br 686181227 MGSCPWFMYUXLMI-GTDKDYCYSA-N 427.589 4.894 50 10 IJGE O=C(NC1(CCBr)CCCCC1)c1ccccc1I 687326871 QWBXXGWPQWBSCI-UHFFFAOYSA-N 436.131 4.509 50 10 IJGE O=C(NNc1cccc(F)c1F)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl 764409494 QQEAVHMTUAPPET-UHFFFAOYSA-N 432.814 4.895 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNC(=O)c1ccccc1Br 1135495527 INDMYQNHCWDVHY-KTKRTIGZSA-N 428.113 4.620 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)C1(Cc2ccccc2Br)CC1 1641877375 OHIRQSGHOWENFE-UHFFFAOYSA-N 429.343 4.521 50 10 IJGE C[C@@]12CC[C@@H](CC1=NOC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)[C@@]2(C)CBr 1772722837 XJKXRLUWKUHDCV-YMRXKLBXSA-N 429.698 4.982 50 10 IJGE CCOc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)Cc1ccccc1)CCC2 1772748597 MATZQSRSZAQHHN-UHFFFAOYSA-N 445.519 4.638 50 10 IJGE CC(C)Cn1nc(C(F)(F)F)c2c1OC(N)=C(C#N)[C@@H]2c1cccc(Br)c1 1865684017 LFDUNSJRFIKUKK-ZDUSSCGKSA-N 441.251 4.539 50 10 IJGE C[C@@H](NCc1c(Br)cccc1Br)c1nnc(CCl)s1 1877574679 ZNPKDGDBWAAEIM-SSDOTTSWSA-N 425.577 4.653 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCN(C(=O)OC(C)(C)C)C(C)(C)C1 1880760151 DTGXGAQTYKXQOB-KBPBESRZSA-N 435.403 4.700 50 10 IJGE Cc1nsc(Br)c1[C@H](Br)c1cc2c(cc1Cl)NC(=O)C2 1912982546 ODDZRJILYQXRQW-GFCCVEGCSA-N 436.556 4.846 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1nscc1Br 1915092044 FGGSPXQITAKTRX-NSHDSACASA-N 432.181 4.722 50 10 IJGE O=C(NC1(CCBr)CCC1)c1scc(Br)c1Br 1942475831 UNTNILRNKBVOBH-UHFFFAOYSA-N 446.002 4.711 50 10 IJGE COc1ccc([C@H](Br)c2cc(I)sn2)cc1Cl 2007643069 CVETWDMPENXTRQ-NSHDSACASA-N 444.519 4.894 50 10 IJGE CCC[C@H](Br)CCNC(=O)c1ccc(I)c(Cl)c1 2029921551 GLBFLBOWJAASOA-JTQLQIEISA-N 444.538 4.628 50 10 IJGE Clc1sc(Br)c(Cl)c1[C@H](Br)[C@@H]1CO[C@H]2COC[C@@H]12 2040325160 JSJHUUGFHXUNJW-SKHQTKALSA-N 436.980 4.915 50 10 IJGE CCC[C@H](Br)c1cn(-c2cc(Cl)ccc2I)nn1 2057429890 UELLBASZLXLIRD-VIFPVBQESA-N 440.510 4.761 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2C[C@@H]1CCN1Cc1ccccc1 2096782701 JAYSKSGDJRGUHE-INIZCTEOSA-N 433.781 4.558 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@@H](C)CN(C)Cc1ccccc1 2096784721 LVZMIZTXOZUXRS-AWEZNQCLSA-N 435.797 4.977 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CC2(CBr)CCCCCC2)C[C@H]1C(F)F 2106784620 JVHFGCKENHNALP-HUUCEWRRSA-N 439.385 4.812 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(CC3(CBr)CCCCC3)C[C@H]21 2106787575 IZTZDVJIFUCSMY-KZNAEPCWSA-N 429.443 4.957 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CC2(CBr)CCCCCC2)CC(F)(F)C1 2127775124 GFTIWSZCBPXUGE-HNNXBMFYSA-N 439.385 4.956 50 10 IJGE CC[C@H]1CCCCN(S(=O)(=O)c2cc(CBr)sc2Br)C1 2179787780 UEHDGYAHWXWYOB-JTQLQIEISA-N 445.242 4.606 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@H]1CN(Cc2ccccc2)C[C@@H]1C 2184936329 VSNDSURDPLDEBR-KSSFIOAISA-N 447.808 4.977 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@H]1CCN2C[C@H](CBr)c1ccccc1 2197355195 GINOMPLIYMCOBC-CNNODRBYSA-N 437.422 4.934 50 10 IJGE ICCCCCN1CCC[C@]2(CCCN(Cc3ccccc3)C2)C1 2214705231 PASAIUMRJJQIFY-NRFANRHFSA-N 440.413 4.970 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CCC[C@@H](C)O2)cc1I 2257355484 PDYJQQOQCHFTSE-IIMNLJJBSA-N 425.104 4.693 50 10 IJGE COC(=O)c1cc(-c2ccccc2)sc1NC(=O)C(C#N)=Cc1cnc2ccccc2n1 2295669872 CUAGLERUDKIVPJ-UHFFFAOYSA-N 440.484 4.691 50 10 IJGE BrC[C@H]1C[C@@H]2CC[C@H]1N2Cc1cccc(Br)c1Br 2308524574 JNSYZZFYZKXGAO-NTZNESFSSA-N 438.001 4.959 50 10 IJGE BrC[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cc(Br)ccc1Br 2309796170 MZYRRXFRWMTFOW-BHYNMZESSA-N 438.001 4.959 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)cc(Br)c1OCC#N 2313568009 NIVAMHKYTZNUAH-UHFFFAOYSA-N 440.297 4.604 50 10 IJGE COc1ccc([C@@H](Cl)c2c(Br)ncn2C)c(Br)c1Cl 2337277826 YUCNMHOGVXLCTH-SECBINFHSA-N 428.939 4.935 50 10 IJGE CCN(CCCOCc1ccccc1)c1c(CBr)c(C(F)(F)F)nn1C 2339727743 UBRRSPWZBFJAII-UHFFFAOYSA-N 434.300 4.767 50 10 IJGE CC[C@@H](Cl)[C@@H]1CCCCN1C(=O)c1ccc(Cl)cc1I 2365582025 LYYDJDGABNQDTR-OCCSQVGLSA-N 426.125 4.957 50 10 IJGE CC[C@@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)COc1ccc(Cl)c(C)c1 10682229 GVUPPJVYHLZEOC-FOIQADDNSA-N 432.948 4.546 50 10 IJGE CC(C)Oc1ccc(Br)cc1C(=O)N/N=C/c1c(O)ccc2ccccc12 27528140 XBJPAEXGRPDYAE-FSJBWODESA-N 427.298 4.859 50 10 IJGE O=C(N/N=C/c1ccc(F)cc1)c1ccc(-n2nc(C(F)(F)F)c3c2CCCC3)cc1 33960727 AMXBQCZVXVRDLR-UVHMKAGCSA-N 430.405 4.673 50 10 IJGE CCN1C(=O)/C(=N/NC(=O)c2cc(-c3ccccc3)nc3ccccc23)c2cc(C)ccc21 38180192 LOHBWZHRTNKSSJ-XLVZBRSZSA-N 434.499 4.711 50 10 IJGE Cc1cccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2Cl)c1 38651024 UKPGPLRGWJHYMI-DEOSSOPVSA-N 446.890 4.851 50 10 IJGE C=CCNC(=O)/C(C#N)=C1\S[C@@H](Cc2ccc(F)cc2)C(=O)N1c1ccc(C(C)C)cc1 101241543 LSAXYUNWLIDAHU-JSIHEXFSSA-N 449.551 4.678 50 10 IJGE CCOc1cc(/C=N\NC(=O)Cc2ccc(O)cc2)ccc1OCc1cc(C)ccc1C 169901497 GDXZYOYKUJXHDE-YUMHPJSZSA-N 432.520 4.680 50 10 IJGE CCOc1ccc(CCN/C=C(/C#N)C(=O)Nc2cccc(Cl)c2Cl)cc1OCC 217128272 HHVPJDYENFCTKO-PEZBUJJGSA-N 448.350 4.969 50 10 IJGE Clc1ccc(CBr)c(N2CC[C@@H](N3CCN(Cc4ccccc4)CC3)C2)c1 380114088 PMFZNUMABPCZDV-OAQYLSRUSA-N 448.836 4.631 50 10 IJGE O=C(NNC(=O)[C@H](Sc1ccccc1F)c1ccccc1)c1cccc2cccnc12 729970827 BZJZRHVXOHKHOD-JOCHJYFZSA-N 431.492 4.669 50 10 IJGE Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)NNC(=O)c3ccc(Cl)cc3)s2)cc1 730914495 QJBDRCWAKGXICV-CQSZACIVSA-N 428.945 4.786 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(C)n([C@H](C)c3ccccc3)c2C)c1C 736694257 TUSKMATWQFAWDG-LJQANCHMSA-N 440.551 4.940 50 10 IJGE N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NNC(=O)CCOc2ccccc2)cc1Cl 755946150 XREAUOTWEQQRPV-NRFANRHFSA-N 448.910 4.617 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C2(c3c(Cl)cccc3Cl)CC2)c1C 759259287 RDCPKLXHBWFDRL-UHFFFAOYSA-N 428.323 4.637 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNC(=O)c2ccc(Cl)cc2F)cc1 1587479692 UNWMEGLHSRJINB-UHFFFAOYSA-N 425.847 4.500 50 10 IJGE CCOc1cc([C@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)ccc1O 1614707136 YUOSZTDDEDPSGZ-ZWKOTPCHSA-N 434.330 4.538 50 10 IJGE Cc1sc2nc(CS[C@@H](C)C(=O)NNc3ccc(Cl)cc3F)nc(O)c2c1C 1653145812 LYJZXUMGEZRWAQ-JTQLQIEISA-N 440.953 4.571 50 10 IJGE CCc1ccccc1OCC(=O)NN=Cc1ccc(OCc2ccc(C)cc2)c(OC)c1 1772753347 USIAZVOYTCRCPN-UHFFFAOYSA-N 432.520 4.674 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccn2)[C@H]1c1ccc(Cl)cc1 1865683148 HAKXCTCIXBTGLQ-FQEVSTJZSA-N 425.879 4.806 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CC)c1 1865692668 DRJAQCXVEDFMJK-NRFANRHFSA-N 430.508 4.586 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccc(Cl)cc2)[C@H]1c1cccc(F)c1 1865710852 JZHXRCQOSGAMHZ-HNNXBMFYSA-N 434.780 4.902 50 10 IJGE CCN(C[C@](C)(CBr)OCCOCc1ccccc1)C(=O)OC(C)(C)C 1880585182 JLSHPBHWMHVBET-FQEVSTJZSA-N 430.383 4.630 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C[C@H]1CN(C(=O)OC(C)(C)C)C(C)(C)C1 1881244839 WYJXHRWVZKTXLM-KGLIPLIRSA-N 435.403 4.700 50 10 IJGE CN(Cc1ccc(I)cc1)C[C@@H](Cl)COCc1ccccc1 1916371418 SFCKNWFRUNYPLX-QGZVFWFLSA-N 429.729 4.547 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H](C)CC1CC1)C(=O)OC(C)(C)C 1917441138 CLQINUIVMWEQNR-GUYCJALGSA-N 425.351 4.642 50 10 IJGE CC1(C)CC[C@@H](Br)CN1c1ncc(Br)cc1Br 1950231376 WDFDFSBGXYKDCR-MRVPVSSYSA-N 426.978 4.749 50 10 IJGE CC[C@H](Br)CN(CC)C(=O)c1cc(Br)sc1Br 1999377901 OOKMNZCYORQLMG-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE O=S(=O)(c1cc(F)ccc1CBr)N(Cc1ccccc1)C1CCCC1 2059266706 IKCKVONFJNELAM-UHFFFAOYSA-N 426.351 4.854 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@H]1CCC[C@]2(C1)CC2(F)F 2099946173 QGFUIUDQJTWKGI-LNLFQRSKSA-N 430.333 4.641 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H](C)CC[C@H]1CNC(=O)C(F)(F)F 2106784711 KREKQSZWKCQAGY-CABCVRRESA-N 429.365 4.747 50 10 IJGE CC(C)[C@@H](CBr)CN1C[C@@H](CNC(=O)OC(C)(C)C)Cc2ccccc21 2106787164 YEMFOHPRYFRKHW-AEFFLSMTSA-N 425.411 4.857 50 10 IJGE CC(C)[C@@H](CBr)CN1CCC[C@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2129043060 LKDPWCABKFYLOR-GJZGRUSLSA-N 429.403 4.603 50 10 IJGE CCCCCCN(C)S(=O)(=O)c1ccc(CBr)cc1Br 2196728436 LUQMZHWWQRWXKX-UHFFFAOYSA-N 427.202 4.545 50 10 IJGE Cc1c(Br)csc1C(=O)N[C@H](C)CCCCCI 2219003661 SQRWQWUHUVLAFJ-SECBINFHSA-N 444.176 4.933 50 10 IJGE O=C(N1CCC[C@H]([C@H]2CCCCN2CCCCCCBr)C1)C(F)(F)F 2231102141 CDTOELTWNVDYEG-JKSUJKDBSA-N 427.349 4.597 50 10 IJGE CC(C)N(CCCCI)C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2243586152 MDZGLPGYSJXHQR-INIZCTEOSA-N 438.394 4.559 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NC(=O)c1ccc(Cl)c(I)c1 2256387863 GXIPPEDSMBVXFV-SCZZXKLOSA-N 444.538 4.627 50 10 IJGE Cc1sc([C@H](Br)c2cscc2S(C)(=O)=O)cc1Br 2260093827 BVEVZZQLPKIQMV-LLVKDONJSA-N 430.208 4.768 50 10 IJGE COc1ccc([C@H](Br)[C@H]2C[C@@H]3CC[C@H](C2)O3)cc1I 2269533530 FUKZHWOIOAJRRK-OHTBPHCPSA-N 437.115 4.693 50 10 IJGE CC[C@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@H]1CBr 2285961184 XPUPATWTXPDDQO-DTWKUNHWSA-N 427.539 4.735 50 10 IJGE CCOc1ccc(C=C(C#N)C(=O)Nc2cc(C)cc(C)c2)cc1I 2293740361 QACJTQQBACSYTF-UHFFFAOYSA-N 446.288 4.852 50 10 IJGE FC1(F)CN(c2nc3ccc(Br)cc3s2)CC[C@@H]1CBr 2296517000 YDTUKIRNYTWDPY-MRVPVSSYSA-N 426.124 4.915 50 10 IJGE CCCOc1ccccc1C=CC(=O)NNC(=O)c1ccc(-c2ccc(C)cc2)nc1C 2321124248 RVHSNQXVOPRCIK-UHFFFAOYSA-N 429.520 4.629 50 10 IJGE CC(C)COc1ccccc1C=NNC(=O)c1ccc2nc(-c3ccccc3O)[nH]c2c1 2323739854 UUSUFQLEVBHSLC-UHFFFAOYSA-N 428.492 4.734 50 10 IJGE CC[C@@H](NC=C(C#N)C(=O)N1CCN(c2ccc(F)cc2)CC1)c1ccc2c(c1)CCCC2 2325272781 WWNIVMOYADZTTF-AREMUKBSSA-N 446.570 4.501 50 10 IJGE COc1cc(C(O)=C(C#N)c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)cc(OC)c1OC 2331279516 ISLWLXIEEBIYFR-UHFFFAOYSA-N 439.449 4.694 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@@H]1CCC[C@@]2(C1)CC2(F)F 2343415235 ZVABWCUJHVWNDV-ZIFCJYIRSA-N 430.333 4.689 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]2CCC[C@@H]2N1C[C@@H](CBr)c1ccccc1 2354693522 AELCOYANOIHHPM-NMLBUPMWSA-N 437.422 4.933 50 10 IJGE CCCN1CC2=C(OC(N)=C(C#N)[C@@H]2c2ccc(OC)cc2)/C(=C\c2ccc(OC)cc2)C1 33288393 FVBNCSSBLXIBEE-OKPLFKEKSA-N 443.547 4.575 50 10 IJGE Cc1cccc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)c2nc3ccccc3n2C)c1 35549710 QSPHPMUTZKXADV-OBGWFSINSA-N 433.471 4.746 50 10 IJGE C/C(=N/NC(=O)CCCSc1nc2ccc([N+](=O)[O-])cc2s1)c1ccc(C)cc1 58991024 LMHUWNGFZSVAST-HMAPJEAMSA-N 428.539 4.926 50 10 IJGE CCCCCOc1ccccc1C(=O)N/N=C1\C(=O)N(Cc2ccccc2)c2ccccc21 59157192 VDBINEQBXCDVIV-FVDSYPCUSA-N 441.531 4.937 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(=O)Nc1ccccc1C(=O)O 103485546 IQFUSZBVWQVKHU-XFXZXTDPSA-N 437.795 4.752 50 10 IJGE CCOC(=O)/C(C#N)=C\c1cccc(OC(=O)COc2ccc(-c3ccccc3)cc2)c1 206734938 PZSJNIYJHKXJLM-JCMHNJIXSA-N 427.456 4.808 50 10 IJGE C[C@@H](Br)CCCNC(=O)c1cc(Br)cc(Br)c1 227717628 LHNYALGOJVSEGJ-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE C[C@@H](CCCBr)NC(=O)c1cc(Br)sc1Br 235065845 IXCGMDFGGFVPMS-LURJTMIESA-N 433.991 4.567 50 10 IJGE COc1cc2c(cc1NC(=O)CC(C)=NNC(=O)Cc1cccs1)oc1ccccc12 254412683 XNGUSESWNIHMPA-UHFFFAOYSA-N 435.505 4.720 50 10 IJGE C[C@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1cc(CCl)c(Br)cn1)C2 705898759 VFHWAHWDWXNOFG-NHCUHLMSSA-N 434.809 4.931 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3C[C@H](Br)C[C@H]2C3)c1 709787224 JKDIZSOWOWMXSR-XHVZSJERSA-N 440.550 4.692 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N2CCc3n[nH]cc3C2)c(C)n1-c1cc(Cl)ccc1Cl 743901314 GBBTTYLGFUUOMT-LZYBPNLTSA-N 440.334 4.616 50 10 IJGE CO[C@H](C(=O)NN=Cc1cc(C)n(-c2cccc(Br)c2)c1C)c1ccccc1 1084151369 TZZWNEQXSPLCQN-NRFANRHFSA-N 440.341 4.694 50 10 IJGE Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C=NNC(=O)c1ccc(Br)cc1 1329192620 BTZPEEMLZFCUPD-UHFFFAOYSA-N 445.748 4.728 50 10 IJGE C[C@H](C(=O)NNc1nc2ccccc2[nH]c1=S)c1cccc(C(=O)c2ccccc2)c1 1585173505 HCRJXRHBVKUJAA-HNNXBMFYSA-N 428.517 4.770 50 10 IJGE CCCc1ccc(OCC(=O)NN=Cc2ccc(OCCc3ccccc3)c(OC)c2)cc1 1772753629 WJBWAZVXTKNHIL-UHFFFAOYSA-N 446.547 4.798 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccccc2F)cc1 1865685548 JYHVWAVMPDVWOE-QGZVFWFLSA-N 428.389 4.616 50 10 IJGE CCOc1cc(OCC)cc(C(=O)NNC(=O)c2ccc(-c3ccc(C)c(C)c3)nc2C)c1 1865756094 GADQOGIOWGLBCG-UHFFFAOYSA-N 447.535 4.546 50 10 IJGE N#C/C(=C\c1ccc(Br)cc1)C(=O)NC1CCC(C2CCC(N)CC2)CC1 1866128829 OJUMRQJXAIKYGS-QGOAFFKASA-N 430.390 4.549 50 10 IJGE CC(C)(NC(=O)[C@@H](Cc1ccccn1)c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1866688318 IOHVRQFOWILWKE-QFIPXVFZSA-N 444.560 4.515 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1880757524 YPWMAWCHGXYQFG-RRFJBIMHSA-N 435.403 4.606 50 10 IJGE C[C@H](C1CCC(NC(=O)OC(C)(C)C)CC1)[C@@H](CBr)NC(=O)OC(C)(C)C 1882086962 GLUDYOZOFOXJDC-PRLABOORSA-N 449.430 4.994 50 10 IJGE CC1(C)CN(Cc2c(Br)cccc2Br)[C@@H]1CBr 1945329056 AMTUFCBPTUMFRF-GFCCVEGCSA-N 425.990 4.817 50 10 IJGE C[C@H](Cl)c1cn(-c2cc(Br)c(Br)c(Br)c2)nn1 1946435647 YWKQPTVDNYQGTN-YFKPBYRVSA-N 444.352 4.855 50 10 IJGE O=C(NC1(CBr)CCCC1)c1c(Br)cccc1Br 2033096874 ZOGUFDXJWPUFES-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE O=C(Nc1cc(Br)cc(Br)c1)N1CCC(Br)CC1 2043837257 NSBNQQMTUWHBFM-UHFFFAOYSA-N 440.961 4.603 50 10 IJGE CN(C(=O)c1sccc1I)[C@H]1CCCCC[C@@H]1Br 2052430060 VISIRNXKARHUHC-ONGXEEELSA-N 442.160 4.521 50 10 IJGE O=S(=O)(c1ccccc1CBr)N(CCC(F)(F)F)Cc1ccccc1 2059286814 PWDYFCHKTSLKSN-UHFFFAOYSA-N 436.293 4.725 50 10 IJGE O=C(CBr)c1c(C(F)F)ccc(I)c1C(F)(F)F 2060391683 BZCMHLWAYWSYED-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE BrC[C@@H]1C[C@@H]2CC[C@H](C1)N2c1ncc(Br)cc1Br 2064848936 WXRLOHHQUVULAD-GUDFOSOFSA-N 438.989 4.749 50 10 IJGE CCC[C@H]1CN(c2ncc(Br)cc2Br)C[C@@H]1CBr 2084887513 BYNJJTKUIMJOCD-UWVGGRQHSA-N 441.005 4.854 50 10 IJGE CN(C(=O)c1cc(Br)c(Br)s1)[C@@H](CCCl)C(F)(F)F 2121994361 GYKLKHNCYWYIPQ-ZETCQYMHSA-N 443.510 4.905 50 10 IJGE Oc1nc2ccc([C@H](Br)Cc3ccccc3I)cc2o1 2143869112 WCPWWPMLFIIXLK-LLVKDONJSA-N 444.066 4.817 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1ccc(F)c(C(F)(F)F)c1 2181746562 IWTUQJQSISLMMM-UHFFFAOYSA-N 428.517 4.840 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@H]([C@@H](C)Br)C(F)(F)F)cc1Cl 2195319737 CNZGQFARXQLKRN-LHLIQPBNSA-N 437.481 4.855 50 10 IJGE C[C@H](C(=O)N(C)C[C@H]1C[C@H](Br)C1)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 2196913803 HLBLTTPJGGXVQV-UOVPBQLFSA-N 439.394 4.520 50 10 IJGE FC1(F)C[C@]1(Br)Cn1c(CCCl)nc2ccc(Br)cc21 2202506027 OWWDKNSCHWQXIE-LBPRGKRZSA-N 428.502 4.753 50 10 IJGE CC(C)(C)[C@H](CCBr)NC(=O)Cc1ccc(Br)cc1Cl 2237436452 LAVQLSOHCXQVOZ-ZDUSSCGKSA-N 425.592 4.961 50 10 IJGE CCN(C[C@](C)(CI)OCCc1ccccc1)C(=O)OC(C)(C)C 2246335461 SNBHBJNIPOJZPG-IBGZPJMESA-N 447.357 4.696 50 10 IJGE CCN(C[C@@](C)(CI)OCCc1ccccc1)C(=O)OC(C)(C)C 2246335462 SNBHBJNIPOJZPG-LJQANCHMSA-N 447.357 4.696 50 10 IJGE O=C(NCC1(CBr)CC(F)(F)C1)c1cccc(Cl)c1Br 2283189443 UJLIRUJUBWVNKY-UHFFFAOYSA-N 431.502 4.643 50 10 IJGE CN(C(=O)c1ccc(Cl)c(I)c1)C1CCC(CCl)CC1 2283665430 VQCKQVVGDGYASR-UHFFFAOYSA-N 426.125 4.814 50 10 IJGE C[C@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)CC[C@@H]1CBr 2285845702 DSNKRDHEGZBFLD-DTWKUNHWSA-N 427.539 4.735 50 10 IJGE N#CC(=Cc1cn(CC(=O)Nc2ccccc2)c2ccccc12)C(=O)NCc1ccccc1 2294193027 IHENEQVQKBPQFA-UHFFFAOYSA-N 434.499 4.503 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)[C@@H]1CCC[C@H]1Br 2300241304 XJASLUYEANKFFY-ZWNOBZJWSA-N 428.539 4.692 50 10 IJGE C[C@@H](Br)[C@H]1CCN(Cc2cc(I)ccc2Cl)C1 2307315741 KKYICNWGSLRSQZ-ZJUUUORDSA-N 428.539 4.550 50 10 IJGE COc1ccc(C(=O)NN=CC=C(C)CCC=C(C)C)cc1I 2313513083 FKNXGOPXHPSHSN-UHFFFAOYSA-N 426.298 4.708 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@H]3CCC[C@]32CNC(=O)OC(C)(C)C)C1 2345008336 NOXAHXXFVPKXOA-IERDGZPVSA-N 429.443 4.957 50 10 IJGE COc1cc(F)c([C@@H](Cl)c2c(Br)nc(C)n2C)cc1Br 2362441121 IGOASFCBWIQDFM-LLVKDONJSA-N 426.511 4.729 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Cl)c1cc(Cl)cc2c1OCC2 2364228187 JTZFNQOTPHDABE-JTQLQIEISA-N 440.950 4.862 50 10 IJGE O=C(c1ccc(Cl)cc1I)N1CCC[C@@H](CCCl)CC1 2365598606 RCSLMIYVJUZLGJ-NSHDSACASA-N 426.125 4.816 50 10 IJGE O=C(NC(=S)NNC(=O)c1ccc(Cl)cc1Cl)c1ccc(-c2ccccc2)cc1 12500682 KJXRZIYMFRWTQH-UHFFFAOYSA-N 444.343 4.610 50 10 IJGE C/C(=N\NC(=O)c1ccco1)c1ccc(NC(=O)[C@H](C)Oc2ccc(C)cc2Cl)cc1 20357135 XIYVPRKDFRPREQ-WBILBPDKSA-N 439.899 4.801 50 10 IJGE COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccccc3Cl)ccc21 38649937 BDGWAXDUQIGBLN-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE C[C@@H]1CCCC[C@@H]1NC(=O)[C@@H](c1ccccc1Cl)N(Cc1ccco1)C(=O)CCl 97914413 QZISYCZGFXOATA-MFMILTCTSA-N 437.367 4.937 50 10 IJGE CC1=C(C#N)C(=O)N([C@H](C)c2ccccc2)C(=O)/C1=C/Nc1ccccc1Br 101234020 LHTGBVIGJOFXOC-COYFKBPASA-N 436.309 4.715 50 10 IJGE O=C(NC[C@@H]1CCCC[C@H]1CBr)c1c(F)cc(Br)cc1F 126942787 MTHVXDFHNKGBIH-UWVGGRQHSA-N 425.111 4.658 50 10 IJGE ClCCc1nc2ccc(Br)cc2n1Cc1ncc(Br)s1 714928009 TYDYBPZCLXESJB-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CN(C[C@@H]1CCCCN1Cc1ccccc1)c1ccc(CBr)cc1[N+](=O)[O-] 720017108 QHCNUXNUPBTLPU-IBGZPJMESA-N 432.362 4.981 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1C 736696963 PRPKNMHPBFZTKR-UHFFFAOYSA-N 447.502 4.523 50 10 IJGE CS(=O)(=O)c1ccccc1NNC(=O)/C(=C/c1ccc(Cl)cc1)c1ccc(F)cc1 766668999 CLBYEGJFDBMEIF-XMHGGMMESA-N 444.915 4.567 50 10 IJGE CC(C)(C)C(=O)Nc1nnc(CC(=O)NN=Cc2c3ccccc3cc3ccccc23)s1 1084194458 HHSITUJUNMTSTR-UHFFFAOYSA-N 445.548 4.522 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1 1290128890 JWJGHIIIMMECPT-OAHLLOKOSA-N 447.560 4.894 50 10 IJGE C=CCO[C@H]1CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1 1566816828 VBNQEFRTFQRMJW-PSXBWXLBSA-N 443.469 4.823 50 10 IJGE COc1ccc(/C(C#N)=C/c2cccc(OC(=O)COc3ccccc3OC)c2)cc1OC 1615066774 OEOTYIHGWJRNOQ-DEDYPNTBSA-N 445.471 4.761 50 10 IJGE Cc1cc(OC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccco2)CCC3)ccc1Cl 1772746529 DAFYVMIANULYMM-UHFFFAOYSA-N 426.856 4.832 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3CC)cc1OCC 1865691098 JDDNPAQPXWOSTQ-JOCHJYFZSA-N 444.535 4.976 50 10 IJGE Cc1cc(C)c(S(=O)(=O)N(Cc2ccccc2)[C@H](CBr)C2CC2)s1 1915164758 JSYIGUAFAQSDLV-QGZVFWFLSA-N 428.417 4.729 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@]23CCC[C@H](CI)O3)C1 1918346847 NZJDOOKFNPRUBB-OLMNPRSZSA-N 435.346 4.540 50 10 IJGE C[Si](C)(C)O[Si@@](C)(O[Si@](C)(O[Si](C)(C)C)c1ccccc1)c1ccccc1 1933213628 MRUHXDZUINGBFB-SVBPBHIXSA-N 434.833 4.664 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CC[C@](C)(CI)O2)C12CCC2 1991817464 GFODWXQVXNVGEK-SJLPKXTDSA-N 435.346 4.683 50 10 IJGE CC(C)[C@@H](Br)CN(C)C(=O)c1cc(Br)c(Br)s1 2002410107 GHUZQMKBBXCWNU-QMMMGPOBSA-N 448.018 4.765 50 10 IJGE Fc1ccc(C[C@@H](Br)c2cc(I)sn2)c(F)c1 2007643918 LZNQNDDMFXRSMQ-MRVPVSSYSA-N 430.055 4.705 50 10 IJGE Fc1ccc([C@H](CI)OCCOCCOCc2ccccc2)cc1 2007813838 CTWDRMHBRXMDOY-IBGZPJMESA-N 444.284 4.552 50 10 IJGE CN[C@H](c1cc(Br)c(C)cc1Br)[C@H]1C[C@H](Br)C1 2020167578 SEZKDDQZNHUKCM-RVBZMBCESA-N 425.990 4.954 50 10 IJGE Brc1cnc(N2C[C@@H](Br)C3(CCCC3)C2)c(Br)c1 2054049795 ICHXXORJWBIQHC-LLVKDONJSA-N 438.989 4.751 50 10 IJGE COC[C@H](C)CCO[C@@H](CI)c1ccc(Br)cc1 2067236907 CLEZVPUHIJYECS-RISCZKNCSA-N 427.120 4.614 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1C(=O)c1cccc(Br)c1Br 2073326223 HNEVIFWOSMKFFX-KCJUWKMLSA-N 439.973 4.600 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CC[C@H](C(F)(F)CBr)C1 2077092416 OBCHULXIWSBYFF-AWEZNQCLSA-N 430.314 4.819 50 10 IJGE Cc1c(Br)ccc([C@H](Br)[C@]2(C)COCCO2)c1Br 2083319181 WJAJOUYPBKDAMF-STQMWFEESA-N 442.973 4.762 50 10 IJGE CCC[C@H](CBr)CN=[S@@](=O)(CCNC(=O)OC(C)(C)C)c1ccccc1 2107397840 WXEDOQCPLLCNGB-AKJBCIBTSA-N 447.439 4.849 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@H](CBr)CC2CC2)CC[C@@H]1C(F)(F)F 2112873946 HWGVUXATFBZRKL-SOUVJXGZSA-N 443.348 4.575 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@H](CBr)C12CCC2 2133828028 ONDWUJXLHJIQRM-MRVPVSSYSA-N 427.589 4.944 50 10 IJGE Cc1c(Br)ccc([C@H](Cl)[C@H]2CCCS(=O)(=O)C2)c1Br 2138873143 WMJUJEBXOKNGFC-TVQRCGJNSA-N 430.589 4.625 50 10 IJGE Cc1sc(Br)c(C(=O)N2CC(F)(F)C[C@]2(C)CBr)c1C 2159049211 MARDKIRIWJHSCC-GFCCVEGCSA-N 431.140 4.762 50 10 IJGE Cc1cc(Br)c([C@@H](Br)c2ccc3c(c2)CCS3(=O)=O)s1 2170066523 HXRFZPWTVXEAMP-ZDUSSCGKSA-N 436.190 4.633 50 10 IJGE Clc1cc2c(cc1[C@H](Cl)c1cc(I)sn1)OCCCO2 2176535415 ACXSDWJMZYHOFR-ZDUSSCGKSA-N 442.105 4.891 50 10 IJGE CN(c1ncc(Br)cc1C(F)(F)F)[C@@H](CCBr)C(F)F 2178514882 GZPHEDFFNNSJNB-QMMMGPOBSA-N 426.021 4.718 50 10 IJGE CC(C)CC[C@H](C)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2186024804 JNFVDQSKLIWKPV-JTQLQIEISA-N 447.258 4.851 50 10 IJGE O=C(NC[C@]1(CBr)C[C@@H]1C(F)(F)F)c1ccc(OCc2ccccc2)cc1 2192580059 LIZRPOWLFMYTIB-PKOBYXMFSA-N 442.275 4.959 50 10 IJGE CCC[C@H](CC)N(C)S(=O)(=O)c1ccc(Br)c(CBr)c1 2193558792 YPLHBDCFZMRADK-LBPRGKRZSA-N 427.202 4.543 50 10 IJGE Clc1cc(CN2[C@H]3CC[C@@H](Br)[C@H]2CC3)ccc1I 2222293109 PGIZCQWZKADWBV-MISXGVKJSA-N 440.550 4.835 50 10 IJGE Cn1ncc([C@@H](Br)c2ccc(C3CCC3)s2)c1I 2259355836 GQXVVDSFWZYBEJ-GFCCVEGCSA-N 437.144 4.838 50 10 IJGE Cc1c(Cl)cccc1NC(=O)C(C#N)=Cc1ccc(O)c(I)c1 2293544002 JGXSFZZCQJTOLC-UHFFFAOYSA-N 438.652 4.504 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C1(C)C 2297077789 AARLRZZRWDBISQ-AJNGGQMLSA-N 447.414 4.556 50 10 IJGE CCOC(=O)C(C#N)=Cc1[nH]c(C)c(C(=O)OCC)c1Cc1cc(Cl)ccc1Cl 2297403720 YPODRJXANRSPEA-UHFFFAOYSA-N 435.307 4.868 50 10 IJGE CC1(C)CC(CBr)(CN2CC3(CC(NC(=O)OCc4ccccc4)C3)C2)C1 2304517415 NYVMRFGHKMFAAX-UHFFFAOYSA-N 435.406 4.579 50 10 IJGE CCOc1ccc(C=C(C#N)C(=O)Nc2ccc(CC)cc2Br)cc1OC 2314951436 RBBLEVKZCNBBHF-UHFFFAOYSA-N 429.314 4.964 50 10 IJGE CC(C)n1ncc(Br)c1CC(CBr)(CBr)C1CC1 2319522038 YGLNVMQOGZMDOU-UHFFFAOYSA-N 443.021 4.955 50 10 IJGE CCOc1ccc(NC=C(C#N)C(=O)N2CCC(Cc3ccccc3)CC2)cc1OCC 2324765136 KGMZKBRGNFGKJV-UHFFFAOYSA-N 433.552 4.785 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@H]1CN(C[C@@H](CBr)c2ccccc2)CC1(C)C 2336372496 CWWJFALXCCSONN-QZTJIDSGSA-N 425.411 4.742 50 10 IJGE CC1(C)CC(CBr)(CN(CCCNC(=O)OC(C)(C)C)CC(F)(F)F)C1 2345009597 FKHCODDVBOGIAQ-UHFFFAOYSA-N 445.364 4.967 50 10 IJGE CN(Cc1c(Br)c(Br)nn1C)c1ccc(Cl)cc1CCl 2364376272 JLLFYFOVYLNZIS-UHFFFAOYSA-N 441.982 4.974 50 10 IJGE C[C@@H]1CC2CC([C@H](Br)c3cc(I)cc4c3OCC4)(C2)O1 2368035743 MNKXMJGYGGRWMH-XQGWUASRSA-N 449.126 4.620 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)Cc3ccc(Cl)cc3)ccc2[C@H]1c1ccc(F)cc1 38653216 SDHRAUNMSGUQSJ-HSZRJFAPSA-N 434.854 4.845 50 10 IJGE Cc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)N4c5ccccc5C[C@H]4C)c(C)c32)cc1 40804560 GORWIEYORMIFTF-QPGLCGFSSA-N 441.531 4.958 50 10 IJGE Cc1ccc(CNC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(Cl)cc2)CCC3)cc1 40811598 KYEUNUKGHMXMGA-VFCFBJKWSA-N 449.938 4.950 50 10 IJGE COc1cccc(O[C@H](C)C(=O)N/N=C/c2ccc(OCc3ccccc3C)c(OC)c2)c1 40960831 HDTXGQQVKUSGRN-BWJYWGHISA-N 448.519 4.509 50 10 IJGE C=CCc1cc(/C=N\NC(=O)CC[C@@H](O)c2ccccc2)ccc1OCc1ccccc1 58891708 QFDYVSCEWOULOS-GZSUAHBPSA-N 428.532 4.958 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C/c2cc(C)n(-c3ccc(C)cc3)c2C)cc1 58893054 LEMOTRREOXZAOB-JOWQQVNMSA-N 433.552 4.765 50 10 IJGE COc1ccc(CCC(=O)N/N=C/c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c(O)c1 59166176 QCSMWOQJQFNSIT-CVKSISIWSA-N 426.557 4.784 50 10 IJGE O=CC1=CO[C@H](COCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 137417264 PIPPBUYLQJWFCS-FCEKVYKBSA-N 444.527 4.856 50 10 IJGE CC(C)(C)OCCO[C@H](CI)c1ccccc1Br 162578462 PMXGOGRQMCBTCQ-CYBMUJFWSA-N 427.120 4.757 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)cc(Cl)c1O 169891410 KQAVFWQUZPQHMS-QOWQLIIWSA-N 425.916 4.814 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C\NCc1ccc(Br)cc1)c1ccc2c(c1)CCCC2 217204673 UROOVRHIFHEUEU-KQRQPNSISA-N 438.369 4.702 50 10 IJGE Fc1cc2nc(CCCl)n(-c3cnn(Cc4ccccc4)c3)c2cc1Br 389693236 AGLYLLTZWJBDLB-UHFFFAOYSA-N 433.712 4.953 50 10 IJGE CCCCOc1cc(Br)c(/C=C(/C#N)C(=O)NCc2cccs2)cc1OC 725401365 IXWPALQXGDFTLB-DHDCSXOGSA-N 449.370 4.921 50 10 IJGE O=C(NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1)c1cc(Cl)sc1Cl 728215624 PVDCITNTIGWMDF-UHFFFAOYSA-N 442.349 4.613 50 10 IJGE CSc1ccc(F)cc1CNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 744682642 BMCLOMOTTBLQBD-LDADJPATSA-N 445.523 4.548 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)Cc1csc(-c2ccc(OC)c(OC)c2)n1 746182653 CRQADZPPNKREHG-UHFFFAOYSA-N 440.477 4.612 50 10 IJGE Cc1cccc(F)c1NNC(=O)CSc1nnc(-c2ccco2)n1C1CCCCC1 771693158 UKEPFQIRWISNCZ-UHFFFAOYSA-N 429.521 4.726 50 10 IJGE Cc1nn(Cc2ccccc2)c(C)c1C=NNC(=O)CSCc1ccc(Cl)cc1 1084206979 SAXVPVZJFNMYNX-UHFFFAOYSA-N 426.973 4.585 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCCCC[C@H]1NC(=O)OC(C)(C)C 1880761482 NTZAQNKGUKUECK-RRFJBIMHSA-N 435.403 4.748 50 10 IJGE Cc1nsc(Br)c1C(=O)N(Cc1ccccc1)C[C@@H](C)Br 1914609577 VFLDSDZUQMWFAJ-SNVBAGLBSA-N 432.181 4.640 50 10 IJGE COc1cc(OC)c(C(=O)N(Cc2ccccc2)[C@H](C)CCBr)cc1OC 1915091448 XOFKNNNNPBRLDZ-OAHLLOKOSA-N 436.346 4.528 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)cc1F 1915295753 NGWIVLCHYFWEJQ-QGZVFWFLSA-N 432.330 4.575 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC2(CCC2)[C@@]12CCC[C@H](CI)O2 1924959153 SVPNNTYFVSSVFT-QMTMVMCOSA-N 449.373 4.834 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@@]12CCC[C@@H](C1)OC2 1925087718 HCKSABXOOBJSOR-MAZHCROVSA-N 449.126 4.621 50 10 IJGE CC(C)CC(CBr)(CBr)Cc1nn(C)cc1Br 1940259417 VCIVXDIWKNPCHT-UHFFFAOYSA-N 431.010 4.547 50 10 IJGE O=C(N[C@@H](CCBr)C1CC1)c1scc(Br)c1Br 1942807786 KRVMNMXMINQTJA-QMMMGPOBSA-N 446.002 4.567 50 10 IJGE CCC(CC)(CBr)CN1CCC[C@@H](CNC(=O)OCc2ccccc2)C1 1977948108 CELCQVGKPLBAFA-IBGZPJMESA-N 425.411 4.826 50 10 IJGE C[C@H](Br)CN(Cc1cc(Br)ccc1Br)C1CC1 2006498326 CKFYIWWKACLOBZ-VIFPVBQESA-N 425.990 4.959 50 10 IJGE O=C(N[C@H]1C[C@@H](CCBr)C1)c1cc(Br)sc1Br 2021790515 BRMJAPJHHAHJCZ-KNVOCYPGSA-N 446.002 4.567 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CCC[C@H](Br)CC1 2031477552 CVZRUCARCZEXGY-VIFPVBQESA-N 439.973 4.601 50 10 IJGE CC(C)[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(CBr)cc1F 2059265136 PYBUMDPQNAJFLT-OAHLLOKOSA-N 428.367 4.956 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@H](NC(=O)OC(C)(C)C)CCc2ccccc21 2106782154 OIXBDTKEAVUSOF-QZTJIDSGSA-N 425.411 5.000 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N(C)[C@H](CBr)C(C)(C)C)c1Br 2143915386 OGLOGYNCQHAOHH-SNVBAGLBSA-N 447.258 4.558 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(CBr)cc1 2162871982 MOPXOSXLTHGLRA-PIIMJCKOSA-N 437.378 4.584 50 10 IJGE Cc1c([C@@H](Cl)c2c(Br)cc(F)c(F)c2F)c(Br)nn1C 2188150739 QUPXCAHJOWANET-SECBINFHSA-N 432.465 4.999 50 10 IJGE CN(Cc1cscc1Br)C[C@@H](Br)COCc1ccccc1 2209665094 BGJKKPUVWBNBJU-OAHLLOKOSA-N 433.209 4.923 50 10 IJGE Cl[C@@H]1CN(c2ncc(I)cc2Br)C2(CCCC2)C1 2224093301 GRPARFWRVKCWGR-VIFPVBQESA-N 441.538 4.579 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](OCC[C@@H]2CCCCC23CC3)C1 2246605882 HUQUJNZTNJMDQQ-HRCADAONSA-N 449.373 4.786 50 10 IJGE O=C(N[C@H]1C[C@H]2CC[C@H]1[C@@H](Br)C2)c1scc(Br)c1Cl 2264503453 GHDIENPPGPHGBW-GHCJXIJMSA-N 427.589 4.846 50 10 IJGE CC1CC(CBr)(CN2CC[C@@](NC(=O)OC(C)(C)C)(c3ccccc3)C2)C1 2280055486 RKOIEWHORIEXIV-IVXJCAOYSA-N 437.422 4.924 50 10 IJGE N#CC(=Cc1ccc(I)o1)C(=O)Nc1ccc(Cl)c(Cl)c1 2294193054 LOPVDMYFCCIPRW-UHFFFAOYSA-N 433.032 4.737 50 10 IJGE COc1cc(C=C(C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OCc1ccccc1 2294516821 IVJIXOYYIQIRPV-LAUBAEHRSA-N 449.507 4.784 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)N(C)C)cc(Br)c1OCc1cccc(F)c1 2313567069 CJBHNCDLEOKGON-UHFFFAOYSA-N 447.304 4.561 50 10 IJGE CCCOc1cc(Br)c(C=C(C#N)C(=O)Nc2ccc(F)cc2)cc1OC 2313630825 VNPZOFRBLBLFSA-UHFFFAOYSA-N 433.277 4.931 50 10 IJGE CCOc1cc(C=C2C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1 2314610320 GAXUACDHPHLEPJ-UHFFFAOYSA-N 430.504 4.665 50 10 IJGE Cc1ccc(COc2cccc(C=NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)c2)cc1 2328833175 WDEKUYQQMGCXDM-QFIPXVFZSA-N 439.556 4.573 50 10 IJGE FC(F)(F)[C@H]1C[C@H](Br)CCN1Cc1ccc(I)cc1 2336292825 XJNLLHCLDRZBNW-ZYHUDNBSSA-N 448.064 4.581 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)Nc1ccc(CBr)c(F)c1 2367654070 PBUVOMKGDXTDNG-UHFFFAOYSA-N 443.157 4.654 50 10 IJGE CC(C)CCOc1ccccc1C(=O)NNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 14033695 CYHUZYZICFUVFV-CQSZACIVSA-N 439.339 4.647 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)Nc2ccccc2)ccc1OCc1ccc(C(=O)O)cc1 33319806 XJWSSQDYOWIMML-DEDYPNTBSA-N 428.444 4.518 50 10 IJGE CCCCCCOc1ccc(/C=N/NC(=O)COc2ccccc2OCC)cc1OC 40866711 CKEHYTHHKZZAHM-KOEQRZSOSA-N 428.529 4.582 50 10 IJGE COC(=O)/C(C#N)=C/c1cccc(OC(=O)/C=C\c2ccc(OCc3ccccc3)cc2)c1 98028246 WTRFPSQAKJUFCF-IWXIFQLRSA-N 439.467 4.964 50 10 IJGE O=C1[C@@H](I)CCCCCCCCC[C@H]1I 100486890 LBWPQSVNTNSWKP-PHIMTYICSA-N 434.099 4.687 50 10 IJGE Br[C@H](c1csc(I)c1)c1ccc2c(c1)OCCO2 124411269 GCYHZPCLDDBDAN-ZDUSSCGKSA-N 437.096 4.608 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)/C(C#N)=C\Nc1ccc(Br)cc1 217182394 NHJOZYMPROQZBR-NWCRWOLESA-N 428.330 4.853 50 10 IJGE Cc1cccc(C(=O)Nc2ccccc2CBr)c1I 235915241 JHNGKDONORDEPA-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1)c1ccc(N2C(=O)CS[C@@H]2c2ccccc2)cc1 252598902 DEHHBVFZHPUZPC-HSZRJFAPSA-N 435.936 4.883 50 10 IJGE C[C@H](CNC(=O)c1cc(Br)c(Br)s1)C[C@@H](C)Br 397720112 JNCYKQMZADKNJF-NKWVEPMBSA-N 448.018 4.813 50 10 IJGE C[C@H]1[C@H](Br)CCCN1Cc1cc(Cl)ccc1I 405325036 BRFQLVLZZUYEJM-JOYOIKCWSA-N 428.539 4.692 50 10 IJGE O=C(NC[C@@H](c1c(F)cccc1Cl)N1CCCC1)NNc1ccc(OC(F)F)cc1 726705209 DNWQWPRCUVLZIM-KRWDZBQOSA-N 442.869 4.544 50 10 IJGE CC[C@@H](C)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC=C(C#N)CC1 760002911 DTJWGMQSINONJA-CJAUYULYSA-N 443.547 4.622 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799748813 APFGUXXRGSTLKQ-UHFFFAOYSA-N 429.320 4.918 50 10 IJGE O=C(NN=Cc1cc(F)cc(F)c1)C(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1 1088681257 WEQZFYIWIYFPEV-UHFFFAOYSA-N 435.257 4.658 50 10 IJGE C#C[C@@H](NC(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1)c1ccccc1 1478895267 CNVBEUZQEABMTQ-JOCHJYFZSA-N 449.963 4.951 50 10 IJGE C=C(C)[C@@H](NC(=O)NNC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)c(F)c1 1671851657 HTGZCJPIMHKWGY-MRXNPFEDSA-N 429.254 4.925 50 10 IJGE CC(C)(C)c1cc(Br)ccc1OCC(=O)NN=Cc1c[nH]c2ccccc12 1772754331 XXDNJUAEMARCGW-UHFFFAOYSA-N 428.330 4.757 50 10 IJGE CCCc1nn(Cc2ccccc2F)c2c1[C@@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689340 QATBVOSZXLRGDE-FQEVSTJZSA-N 438.890 4.600 50 10 IJGE COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)/C(C#N)=C/c1ccc(C)cc1 1866127169 MGLMQCXJVNWPCG-DEDYPNTBSA-N 441.487 4.810 50 10 IJGE CC(C)c1nc(Nc2ccc(SC#N)cc2)cc(N2CCO[C@H](c3ccncc3)C2)n1 1868231421 GJRUOJQTGSJREF-FQEVSTJZSA-N 432.553 4.890 50 10 IJGE COc1ccc(OC)c(C/C(O)=C(\C#N)c2nc(-c3cc(OC)ccc3OC)cs2)c1 1873921078 UAFCTNRUXIFNBP-ZZEZOPTASA-N 438.505 4.880 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2ncccc12 1915771181 KOWRBIXCQFQGAJ-UHFFFAOYSA-N 433.371 4.599 50 10 IJGE CC[C@H](Br)CCNC(=O)c1c(Br)cccc1Br 1945332880 IZHNYZSFUYZCIG-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE CN(Cc1ccc(Br)cc1Br)C[C@H]1C[C@H](Br)C1 2020194923 RIMICJLDDYJPQR-OTCDBFHCSA-N 425.990 4.817 50 10 IJGE COc1ccc([C@@H](Br)c2nn(C)c(Cl)c2Cl)cc1Br 2094338298 BWXGMWGTNNXDCY-SECBINFHSA-N 428.939 4.982 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@H]2CCN(CC3(CBr)CCCCCC3)C2)C1 2106784355 IBWSKXXKULADAN-KRWDZBQOSA-N 429.443 4.911 50 10 IJGE CN(C(=O)c1scc(Br)c1Br)[C@H](CCCl)C(F)(F)F 2122008693 KKZANWROOGMQCV-ZCFIWIBFSA-N 443.510 4.905 50 10 IJGE CCN(c1cc([N+](=O)[O-])ccc1CBr)C1CCN(Cc2ccccc2)CC1 2176904962 QAWSXLQIIIGTTD-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE Cc1nc(NCCSSCCNC(=O)OC(C)(C)C)c2c(C)c(C)sc2n1 2181742490 ZKDSRNNFIMSGRI-UHFFFAOYSA-N 428.649 4.935 50 10 IJGE COC(=O)[C@@H](Br)C1(Oc2c(Cl)cc(Br)cc2Cl)CCC1 2203006348 FGPQBIZJXRQKER-LLVKDONJSA-N 446.950 4.994 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@H]2COC[C@@H](C1)N2Cc1ccccc1 2204518090 QFINMKRXTFKIGV-FCHUYYIVSA-N 437.466 4.943 50 10 IJGE CCCN(C[C@H](C)Br)C(=O)c1cccc(Br)c1Br 2259746164 JYDJAXWDFHBRRF-VIFPVBQESA-N 441.989 4.847 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CN(CC2(CBr)CC(F)C2)C2CC2)CC1 2265631777 HFMZYAQVWINFEY-UHFFFAOYSA-N 433.406 4.611 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CCC[C@@H](CN(CC3(CBr)CC(F)C3)C1)C2 2265632183 LFXUQTIYFCYIJY-GGYOGLCLSA-N 433.406 4.517 50 10 IJGE O=C(c1ccc(Cl)c(I)c1)N1CCCC[C@@H]1CCCCl 2283652108 PXIRDWFQMMLEFU-GFCCVEGCSA-N 426.125 4.958 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3ccc(C(=O)O)cc3)c2C)cc1 2294168601 UPDXXLDIHPORPO-UHFFFAOYSA-N 429.476 4.737 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1Cc1ccc(Cl)c(I)c1 2300236689 OJYYZBVFAARIMT-RNCFNFMXSA-N 428.539 4.692 50 10 IJGE CC(C)[C@@H](Br)CN(C)Cc1cc(I)ccc1Cl 2307332621 RFBYTUMLYMILBN-LBPRGKRZSA-N 430.555 4.796 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)N(C)C)cc(Br)c1OCc1ccc(F)cc1 2313567071 CJZKWILQAHHTFF-UHFFFAOYSA-N 447.304 4.561 50 10 IJGE Cc1nc(Br)c(C[C@H](Br)c2ccccc2Br)n1C 2315671415 DVLXNGSMHUUQFI-NSHDSACASA-N 436.973 4.932 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@H]2CC(Br)C3)c(I)c1 2318525989 FJRWQGKEWXKAJX-STQMWFEESA-N 440.550 4.835 50 10 IJGE Cl[C@@H]1CN(Cc2ccc(I)c(Br)c2)C2(CCC2)C1 2325219082 VLUKTSQXOMCBKW-NSHDSACASA-N 440.550 4.790 50 10 IJGE CC1(C)CN(Cc2cc(I)ccc2Cl)CC[C@@H]1Br 2327396930 JLEVUWJTYZTEOO-ZDUSSCGKSA-N 442.566 4.940 50 10 IJGE CC1(C)C[C@](C)(CCl)CN1C(=O)c1ccc(Cl)cc1I 2365588443 JJGLJXJHMMPSEI-OAHLLOKOSA-N 426.125 4.814 50 10 IJGE FC(F)(F)[C@@H]1C[C@]1(CCl)CNCc1cc(I)ccc1Cl 2380513313 SMKNUMYLSRWPLO-NEPJUHHUSA-N 438.058 4.842 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NNC(=S)Nc3ccccc3)cc2)cc1 12491985 VYXJGGVTTSUWKX-UHFFFAOYSA-N 446.576 4.868 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4Cl)ccc32)cc1 38650276 ROFJELMRTXYPRY-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE C=CCOc1ccc(-n2c(C)cc(/C=N\NC(=O)CC[C@@H](O)c3ccccc3)c2C)cc1 58890786 NIVFXKFXHSCQGK-JZXRGVEXSA-N 431.536 4.623 50 10 IJGE Cc1ccc(C)c(OCCCC(C)(C)C(=O)NNC(=O)[C@@H](C)Oc2ccc(C)c(C)c2)c1 66201486 ZZYLXHQEGXLHCP-OAQYLSRUSA-N 440.584 4.720 50 10 IJGE N#C/C(=C(/O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O)c1ccc2ccccc2n1 103441126 YIRNAZDMNMQISK-CLCOLTQESA-N 438.464 4.562 50 10 IJGE O=C(N[C@@H](CCl)Cc1ccccc1)c1cc(Br)c(Br)s1 137228545 HHJFGQJCZQAJON-SNVBAGLBSA-N 437.584 4.853 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2ccc3nc(S)[nH]c3c2)cc(Cl)c1OCC(C)C 169917548 YRJLXXWNDRUGAT-RMORIDSASA-N 446.960 4.702 50 10 IJGE COc1ccc(OCCN/C=C(/C#N)C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1 217211715 PJQNRNBMHOQGIE-HNENSFHCSA-N 429.476 4.502 50 10 IJGE CCCS(=O)(=O)CCC(CBr)(CBr)c1cccc(Cl)c1 233257878 KRQMEFGPAXKEPE-UHFFFAOYSA-N 446.632 4.583 50 10 IJGE CC(C)N(C[C@H](C)Cl)C(=O)c1cc(I)ccc1Br 691349058 GEKMKFONJYNACG-VIFPVBQESA-N 444.538 4.532 50 10 IJGE O=C1NCCc2ccc([C@H](Cl)c3scc(Br)c3Br)cc21 705447379 HZMISGVSPKYEAY-LBPRGKRZSA-N 435.568 4.887 50 10 IJGE CC[C@@H](C[C@H](C)Br)NC(=O)c1cc(Br)c(Br)s1 716854503 ILNDOUWHAJGNQJ-BQBZGAKWSA-N 448.018 4.955 50 10 IJGE CC(C)c1ccccc1NC(=S)NNC(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 741282258 HEVJXSLDTRDMNL-HZPDHXFCSA-N 437.487 4.830 50 10 IJGE O=C(NN=Cc1cccc(Br)c1OC(F)F)c1ccc(Br)cc1 1320671169 YBQVPFBIAKGDAD-UHFFFAOYSA-N 448.061 4.577 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(F)c2)[C@H]1c1cccc(Cl)c1 1865683716 NQSLSYBXNXWASM-INIZCTEOSA-N 448.807 4.961 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@@H]1c1cccc(F)c1 1865710889 KTCHAUAXACDUBW-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE Cc1ccc([C@H](Br)c2c(Br)c(Br)nn2C)s1 1901043401 SZSLCQSPQXITKA-ZETCQYMHSA-N 428.975 4.799 50 10 IJGE CN(Cc1ccccc1NC(=O)OC(C)(C)C)CC(C)(C)CI 1904649325 SETKTFYSXRWICT-UHFFFAOYSA-N 432.346 4.927 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)C(=O)Cc1ccccc1Br 1914226773 GKTXUVWMQPAMNM-CQSZACIVSA-N 425.164 4.804 50 10 IJGE O=S(=O)(c1ccc(Cl)cc1)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915165343 LSCAFTHJTNMZMR-GOSISDBHSA-N 428.779 4.704 50 10 IJGE Cc1cc(Br)c(F)c(C(=O)N(C)C[C@H](Cl)COCc2ccccc2)c1 1916335705 UTGRBHHMCABPRT-HNNXBMFYSA-N 428.729 4.793 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1ccc(OC(F)(F)F)cc1 1916353788 GUHNUYCHBOKTOI-MRXNPFEDSA-N 446.263 4.638 50 10 IJGE Cc1ccc(Br)c(C(=O)N(Cc2ccccc2)C[C@H](C)Br)n1 1961084535 YWXLZEVHNYOEDP-LBPRGKRZSA-N 426.152 4.578 50 10 IJGE Brc1cccc(C[C@@H]2CN(C3CC3)C[C@@H]2Br)c1Br 2039252295 WKPJZLFORHUVLW-MFKMUULPSA-N 438.001 4.612 50 10 IJGE C[C@H](C[S@](C)(=O)=NCC1(CBr)CCCCCC1)NC(=O)OC(C)(C)C 2044699430 KYXIOESLMPKTQO-BZQUYTCOSA-N 439.460 4.733 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1cccc(Br)c1Br 2081242778 PUFUMGZYHJYYGP-GZMMTYOYSA-N 441.989 4.751 50 10 IJGE C[C@]1(CCl)CC(F)(F)CN1C(=O)c1csc(Br)c1Br 2102800519 DIMODRWBLJDECZ-SNVBAGLBSA-N 437.531 4.752 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1CCCl)c1cc(Cl)ccc1I 2146741695 YRKGRONGEKOKKE-HZMBPMFUSA-N 426.125 4.862 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CCl)c1F)N1CCC[C@@H](OCc2ccccc2)C1 2186391264 UFLBCKGWSKALAS-QGZVFWFLSA-N 432.344 4.588 50 10 IJGE Cc1nn(Cc2ccccc2)c(C)c1Cn1c(CCl)nc2cncc(Br)c21 2187792924 YPNAWVCQCVCXGW-UHFFFAOYSA-N 444.764 4.843 50 10 IJGE CCC[C@@H]1CN(C(=O)c2ccc(I)c(Cl)c2)C[C@H]1CCl 2205698769 SQUVYYUNGYAGKO-VXGBXAGGSA-N 426.125 4.672 50 10 IJGE FCCOCCC(CBr)(CBr)c1ccccc1Br 2224058993 HJVUUTUAROIPGJ-UHFFFAOYSA-N 446.980 4.853 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CCCCCCCBr)C[C@@H]1C(F)(F)F 2263154713 SGZQBRLYVZDWPY-KBPBESRZSA-N 431.337 4.719 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2[C@@]12C[C@H]1CN(Cc1ccccc1)C2 2286081313 QYRUXNXBNDPJFU-YCRPNKLZSA-N 446.776 4.777 50 10 IJGE C[C@H](Br)CN(C(C)(C)C)S(=O)(=O)c1c(Cl)cccc1Br 2288120635 HUGYTUCSUKLVRQ-VIFPVBQESA-N 447.620 4.675 50 10 IJGE CCN(CCCCBr)Cc1ccc(Cl)c(I)c1 2300241975 FJAYUHBASFDSMW-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE COc1cccc(OCC(=O)Oc2ccc(C=C(C#N)c3ccccc3F)cc2OC)c1 2320507046 XMYFZFQZZIKZSB-UHFFFAOYSA-N 433.435 4.891 50 10 IJGE CC(C)(C)c1cc(C=NNC(=O)c2cc(-c3ccccc3)nc(O)n2)cc(C(C)(C)C)c1O 2323693354 IHBNNLWZEZKGRE-UHFFFAOYSA-N 446.551 4.914 50 10 IJGE COc1c(Cl)cc(C=NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cc1Cl 2323766801 BJMYPVGYCKTEFZ-UHFFFAOYSA-N 442.517 4.703 50 10 IJGE Clc1ccc(I)cc1CN1CCC(CCBr)CC1 2327398329 BWLRISUKZMYCCX-UHFFFAOYSA-N 442.566 4.942 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H](Br)[C@@H](C2CC2)C1 2327406980 XKWIXBAXPQPORB-CHWSQXEVSA-N 440.550 4.550 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(C[C@@H](CBr)c2ccccc2)CC1 2340134871 LGXPALFXWCJXQH-RTBURBONSA-N 425.411 4.887 50 10 IJGE CCCC(CBr)(CBr)Cc1c(Br)c(CC)nn1C 118670017 CSQLVAISFOVXKX-UHFFFAOYSA-N 445.037 4.864 50 10 IJGE COc1cccc(/C=N\NC(=O)c2ccc3nc(S)[nH]c3c2)c1OCc1cccc(C)c1 169917710 DIGBWVPSISSSGE-MXAYSNPKSA-N 446.532 4.512 50 10 IJGE Cc1cccc([C@@H](Br)c2ccc3[nH]c(=O)oc3c2)c1I 235995069 PFBPQKZYMDHKLG-ZDUSSCGKSA-N 444.066 4.518 50 10 IJGE O=C(NC[C@H]1CCCC[C@@H]1CCl)c1cc(Cl)ccc1I 236012855 UNFXXXLINDAQAW-GHMZBOCLSA-N 426.125 4.720 50 10 IJGE CC(C)(CCl)CCCNS(=O)(=O)c1cc(Br)ccc1Br 393373023 IABIFAXVJJBLCN-UHFFFAOYSA-N 447.620 4.535 50 10 IJGE ClCCc1nc2c(Br)cccc2n1C1[C@@H]2CN(Cc3ccccc3)C[C@@H]12 398461383 RWNOGRNXURRPPZ-HZPDHXFCSA-N 430.777 4.883 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccccc1[C@@H]1COCCN1S(=O)(=O)c1ccccc1 616603340 LYXAJFQENZDFCO-QFIPXVFZSA-N 447.673 4.971 50 10 IJGE O=[N+]([O-])c1ccc(-n2nc(-c3ccc(I)cc3)cc2CCl)cc1 725401204 DHJZDBGSKMQUIL-UHFFFAOYSA-N 439.640 4.791 50 10 IJGE CC(=O)c1ccc(CCNC(=O)/C(C#N)=C/c2cc(C)n(-c3ccccc3F)c2C)cc1 1466358983 ULTWUXLVHGBHSK-HZHRSRAPSA-N 429.495 4.702 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNc2ccc(OC(F)(F)F)cc2)s1 1557838419 IYOMYTLUDBVPGN-UHFFFAOYSA-N 437.896 4.881 50 10 IJGE CCCc1nn(Cc2cccc(F)c2)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699622 YMRRKDUHFPOJFB-HSZRJFAPSA-N 441.510 4.733 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1ccc(F)cc1 1865702771 FBQDVSFQURVQEU-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)Cc1nn(C)c(Cl)c1Br 1914337420 NQSOYOHCNSMSLO-LLVKDONJSA-N 435.591 4.622 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2cccnc12 1915109418 GKBZGEQUOPKSDY-MRXNPFEDSA-N 433.371 4.599 50 10 IJGE O=S(=O)(c1cscc1Br)N(Cc1ccccc1)[C@H](CCl)C1CC1 1915153473 VAKHSLCPWQSSIH-OAHLLOKOSA-N 434.808 4.719 50 10 IJGE Cc1ccc(F)cc1S(=O)(=O)N(Cc1ccccc1)C1(CBr)CCC1 1915750075 DMVSGZIZASQYDD-UHFFFAOYSA-N 426.351 4.643 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@@H]2C[C@@H](Cl)CC[C@H]21 2087665445 WBXIGAGWDQPYFX-KHQFGBGNSA-N 427.589 4.895 50 10 IJGE CC[C@@H](Cl)CN(CC)S(=O)(=O)c1cc(Br)c(C)cc1Br 2162888379 FBUBFMBWYQZMKS-SNVBAGLBSA-N 447.620 4.548 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CCCCCCCCCBr)[C@H]2CCOC2)C1 2163062100 JPSFLMVWXKSPEA-SFHVURJKSA-N 447.458 4.822 50 10 IJGE CC(C)(C)OC(=O)N1CCc2cccc(NC(=O)[C@H](Br)C3CCCC3)c2C1 2167040273 PNVXVIFKHTZHFY-GOSISDBHSA-N 437.378 4.872 50 10 IJGE CN(Cc1cnn(C)c1Br)c1ccc(F)c(Cl)c1CBr 2173263799 BORKNZBJXGWVET-UHFFFAOYSA-N 425.527 4.506 50 10 IJGE Cc1cc(Br)c(C)c([C@H](Cl)[C@H]2CCCS(=O)(=O)C2)c1Br 2201071229 QBJJJFBLYXVJGS-IINYFYTJSA-N 444.616 4.933 50 10 IJGE FC1(F)COC[C@H]1n1c(CCl)nc2cc(Br)c(Br)cc21 2234076847 XMGISAPWDQJZGB-SNVBAGLBSA-N 430.474 4.507 50 10 IJGE C[C@H](Br)CN(CC(C)(C)C)C(=O)c1sccc1I 2259778933 OJBSQABRYNORSP-VIFPVBQESA-N 444.176 4.624 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2C[C@@H]3CC[C@H](C2)O3)cc1I 2269533525 FUKZHWOIOAJRRK-MCYUEQNJSA-N 437.115 4.693 50 10 IJGE COc1ccc([C@H](Br)[C@H]2C[C@H](C)O[C@H](C)C2)cc1I 2269555932 KCQPSNMVCAVRTB-HOZXKAFVSA-N 439.131 4.939 50 10 IJGE CCCN(Cc1ccc(Cl)cc1I)C[C@@H](C)Br 2302320298 MRDVZBMCRDAQLN-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE CCN[C@@H](c1c(F)cc(Br)c(F)c1Br)[C@@H]1C[C@H]1Br 2313273612 SPCQWMZLVIHLAO-IJESPZCISA-N 447.943 4.924 50 10 IJGE CNC(=O)C(C#N)=C1S[C@@H](Cc2ccccc2Cl)C(=O)N1c1ccc(C(C)C)cc1 2314592934 DSTMRUIZPMYUSH-FQEVSTJZSA-N 439.968 4.636 50 10 IJGE F[C@@]1(CBr)CCCN(Cc2ccc(Cl)c(I)c2)C1 2315553277 PVOOXHCYVFSANW-CYBMUJFWSA-N 446.529 4.644 50 10 IJGE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1ccccc1OCc1ccccc1 2328821113 DFADIXRJMSYCCT-AVRDEDQJSA-N 439.556 4.655 50 10 IJGE COc1cc(F)c([C@@H](Cl)c2c(Br)c(Br)nn2C)c(F)c1 2364063804 LZABPVNBEFRAPT-SNVBAGLBSA-N 430.474 4.560 50 10 IJGE C[C@H](Cl)CN(C(=O)c1ccc(I)c(Cl)c1)C1CCCC1 2368851279 OFOKYRFHTHOUAO-JTQLQIEISA-N 426.125 4.957 50 10 IJGE CCOC(=O)[C@@]1(C)c2[nH]c3ccccc3c2[C@@H](c2ccc(Cl)cc2)CN1C(=O)CCl 11767142 GMTABGKMARAVLC-UZUQRXQVSA-N 445.346 4.813 50 10 IJGE Cc1ccc(CNC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2C)CCC3)cc1 40811449 JQADTICBICZBID-SGWCAAJKSA-N 429.520 4.605 50 10 IJGE Cc1c(C(=O)N2CCCc3ccccc32)oc2c1/C(=N/NC(=O)c1ccc(F)cc1)CCC2 40811931 BHJZGSOZRSBTRO-VFCFBJKWSA-N 445.494 4.791 50 10 IJGE Cc1c(C(=O)Nc2ccccc2Cl)oc2c1/C(=N/NC(=O)Cc1ccccc1)CCC2 40815822 HKMTVOKBOAHYEI-ZXVVBBHZSA-N 435.911 4.893 50 10 IJGE O=S(=O)(Nc1ccccc1CBr)c1cc(Cl)c(Br)s1 136813472 JYRQWEOIXUEBFJ-UHFFFAOYSA-N 445.585 4.860 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Br)c3cccc(F)c3Cl)cc2[nH]1 165448325 LTSWFEKFOFLNID-GFCCVEGCSA-N 434.490 4.896 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)/C(C#N)=C\Nc1ccc(Cl)c([N+](=O)[O-])c1 217183993 LEMHRMGQYRLQDS-QAALXFNPSA-N 428.876 4.652 50 10 IJGE BrCc1cc(Br)c(OCOCC2CC2)c(Br)c1 232484660 SOEIEJKUAYQPIA-UHFFFAOYSA-N 428.946 4.869 50 10 IJGE CC(C)(C)c1ccc(OCCN2C(=O)C(=NNC(=O)c3ccccc3)c3ccccc32)cc1 252474378 CGMHMYXDSUCVKM-UHFFFAOYSA-N 441.531 4.544 50 10 IJGE CCN(CC)c1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)NN=Cc2cccs2)cc1 252620384 MCZBPMRKIHNGQM-IVDVRSPQSA-N 446.576 4.516 50 10 IJGE CCOc1cc(C=NNC(=O)NC2CCCCC2)ccc1OCCOc1cccc(C)c1 254871746 INYMWEUPLWRCLR-UHFFFAOYSA-N 439.556 4.817 50 10 IJGE O=C(NNc1nccnc1C1CCC1)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 805463559 DLXRNLPYNQAYJL-UHFFFAOYSA-N 444.470 4.721 50 10 IJGE O=C(Cc1cccc2ccccc12)NN=Cc1cc(Br)c(O)c2ncccc12 1084224864 NGNKGYDYQPNQGT-UHFFFAOYSA-N 434.293 4.549 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)O[C@@H]3N=C(/C(C#N)=C\c4ccc(Cl)cc4)S[C@H]32)cc1 1088740828 VTBXPKSDIVVDMG-LEUBZZSFSA-N 448.935 4.603 50 10 IJGE CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NNc1ccc(OCc2ccccc2)cc1 1646171812 LCEVFDUZLRRQNO-RUZDIDTESA-N 427.504 4.673 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccccc2Cl)[C@@H]1c1ccc(F)cc1 1865707869 IFXBHIIPBYNVIP-OAHLLOKOSA-N 434.780 4.902 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1ccccc1OC)C(C#N)=C(N)O2 1865710391 XBAHOJKKWWXHMB-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1cccc(OC)c1)C(C#N)=C(N)O2 1865712282 UWJNUGUIHASYJS-NRFANRHFSA-N 434.927 4.764 50 10 IJGE COc1ccccc1-c1csc(/C(C#N)=C(\O)CCCN2C(=O)c3ccccc3C2=O)n1 1872747335 XTSRHWNAOYCVKL-ZZEZOPTASA-N 445.500 4.688 50 10 IJGE CS(=O)(=O)Nc1ccc(/C(O)=C(\C#N)c2nc(-c3c[nH]c4ccccc34)cs2)cc1 1872753021 DMMLKSJDSKCWEI-SILNSSARSA-N 436.518 4.613 50 10 IJGE CC[C@@H]1CC[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)CN1C(=O)OC(C)(C)C 1880755237 ORFMABSNMKNPHI-ZNMIVQPWSA-N 435.403 4.700 50 10 IJGE CC[C@H](C)[C@H](Br)CNC(=O)c1csc(Br)c1Br 1945189001 GPFLUXXPYDCBDM-POYBYMJQSA-N 448.018 4.813 50 10 IJGE CC(C)[C@@H](Br)C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C2(CCCCC2)C1 2106203420 HLYXNYPMODREHZ-HZPDHXFCSA-N 431.415 4.625 50 10 IJGE CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(CC3(CBr)CCC3)C2)CC1 2106788260 OCTUZMCPGLCNIS-GOSISDBHSA-N 429.443 4.911 50 10 IJGE CCC[C@]1(NC(=O)[C@@H](Br)C2CCCC2)CCCN(C(=O)OC(C)(C)C)C1 2110714157 ARDDTTZZTQUUPW-JXFKEZNVSA-N 431.415 4.626 50 10 IJGE CCc1ccc(NC(=O)[C@@H](Br)C2CCCC2)cc1I 2128669004 CIWAGQFVHIQUQH-AWEZNQCLSA-N 436.131 4.746 50 10 IJGE C[C@H]1CCCN(C(=O)c2ccc(CBr)cc2)[C@H]1CCNC(=O)OC(C)(C)C 2163053586 ORAIENQOOKTILC-YJBOKZPZSA-N 439.394 4.737 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)[C@]12COC[C@@H]1C2 2213490824 XBJGIHHZZVJCDN-HQDFOZKBSA-N 428.921 4.823 50 10 IJGE BrCCC[C@H]1CCCN(c2ncc(Br)cc2Br)C1 2218743902 HCWHZOUPXFWSHP-JTQLQIEISA-N 441.005 4.998 50 10 IJGE Cc1c(Br)csc1C(=O)N(C)C1(CBr)CCSCC1 2226127379 VCYUMFGZTSRENC-UHFFFAOYSA-N 427.227 4.552 50 10 IJGE COc1ccc([C@@H](Br)CC2CC(OC)C2)cc1I 2257357118 WSSHFTNTQWIODN-NHNAUAITSA-N 425.104 4.551 50 10 IJGE O=C(c1cccc(Cl)c1Br)N1CCC(F)(F)[C@H](CBr)C1 2283192312 VZPDJOCHPHGHFP-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE Cc1cc(N2C[C@@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)cc(CBr)n1 2288446209 VHUJXXWWBWKAGI-ZRZAMGCNSA-N 426.402 4.777 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2cc(Br)c(Br)o2)cc1 2294146920 CDZJTFWSTQXJGQ-UHFFFAOYSA-N 440.091 4.749 50 10 IJGE Clc1ccc(I)cc1CN(CCCBr)C1CC1 2307325705 CZZUZLVAOQGVCW-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE CC[C@@H](NC(=O)C(C#N)=CNc1ccc(Br)cn1)c1ccc2c(c1)CCCC2 2318468210 KKZFYLUFYNAVGX-HXUWFJFHSA-N 439.357 4.810 50 10 IJGE CCSc1ccc(Cl)cc1CC(=O)NN=Cc1cc(Br)ccc1OC 2323678083 KEPOPEAWTHROHH-UHFFFAOYSA-N 441.778 4.916 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)C(C#N)=CN1CCC(Cc2ccccc2)CC1 2325069042 ZRBKBAYQJVPKET-OAQYLSRUSA-N 431.580 4.933 50 10 IJGE ClC1CC2(CCN(Cc3ccc(I)c(Br)c3)C2)C1 2325231313 TYYCXLZGYFYFOC-UHFFFAOYSA-N 440.550 4.647 50 10 IJGE COC[C@@]1(C)C[C@]1(CBr)Cc1cc(I)ccc1Cl 2327405722 PJXFRPCTFVMPIO-KGLIPLIRSA-N 443.550 4.925 50 10 IJGE CC1(C)CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)C[C@H]2CC(F)F)C1 2345005389 XXRFRHBDNMTWDE-CQSZACIVSA-N 439.385 4.764 50 10 IJGE C[C@@H]1[C@H](Br)CCN(C(=O)c2cc(F)c(Br)cc2Cl)[C@@H]1C 2370651738 WPBAWYKMCQBBNY-QXFUBDJGSA-N 427.539 4.876 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@]3(CN(Cc4ccccc4)CCO3)C2)C1 2371133117 LDGKOSVIQNVQRY-QHCPKHFHSA-N 435.450 4.555 50 10 IJGE C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 14031622 UPTFNBXZHYWZLB-KBPBESRZSA-N 447.318 4.529 50 10 IJGE O=C(CBr)Nc1ccc(Br)cc1C(=O)c1ccccc1Cl 26438721 TULBCJGXZMKLGT-UHFFFAOYSA-N 431.511 4.667 50 10 IJGE CCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(F)c2)c1 38678225 TVHKJYLPRSJUSI-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE COc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4ccc(C)cc4)c(C)c32)cc1 40813872 YXGUPPQVOPRZMB-NHFJDJAPSA-N 431.492 4.628 50 10 IJGE O=C(CCCNc1ccc(Br)cc1)N/N=C/c1ccc(Br)cc1 59507558 ZQEIZSWVNIGFPE-CIAFOILYSA-N 439.151 4.554 50 10 IJGE CC1=C(C#N)C(=O)N(C2CCCCC2)C(=O)/C1=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 101339026 RXMZFLYNJQANCS-DEDYPNTBSA-N 431.448 4.780 50 10 IJGE N#C/C(=C/c1ccc(OCc2ccc(C(=O)O)cc2)c(Cl)c1)C(=O)NCc1ccccc1 101392073 BNHWWGKAVXTASR-MTJSOVHGSA-N 446.890 4.841 50 10 IJGE Cc1ccc(C(CBr)(CBr)Cc2cn3ccsc3n2)cc1 149646641 SNUFMZPKCVRIKT-UHFFFAOYSA-N 428.193 4.975 50 10 IJGE CCOc1cc(/C=N\NC(=O)Cc2ccc(N)cc2)ccc1OCc1ccccc1Cl 169900481 YEIZIFDGUNDBIT-DICXZTSXSA-N 437.927 4.593 50 10 IJGE CCCOc1ccccc1/C=C\C(=O)Oc1ccc(/C=C(\C#N)C(=O)NC(C)C)cc1OC 207004276 OOTALMXIZHJSCQ-PIFYNPJRSA-N 448.519 4.534 50 10 IJGE Cc1cc([C@H](Br)c2cc(I)cc3c2OCC3)c(C)o1 388910802 OKAPMTXPIVDPBV-AWEZNQCLSA-N 433.083 4.920 50 10 IJGE Clc1cccc(CBr)c1N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21 404182629 KRTPCJIPJXHQGM-WOJBJXKFSA-N 435.793 4.715 50 10 IJGE FC(F)Oc1cc(I)cc(C(F)(F)F)c1CBr 575723270 OIFLVAUYERKAMP-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE COc1ccc(CCNC(=O)Nc2ccc(C(=O)Nc3ccc(SC#N)cc3)cc2)cc1 586609611 AEHXLNANLCIARA-UHFFFAOYSA-N 446.532 4.885 50 10 IJGE C[C@H](Br)C[C@H](C)NC(=O)c1scc(Br)c1Br 705513511 PUWFRTSYXNGITC-WDSKDSINSA-N 433.991 4.565 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2cc(C)n(C3CCCCC3)c2C)cc1 725384643 LRPHIXMWSGSPFB-XMMPIXPASA-N 425.573 4.973 50 10 IJGE Cc1c(C=NNC(=O)CC[C@@H](O)c2ccccc2)c2ccccc2n1Cc1ccccc1 725435509 RJQICWFYFZZRAU-AREMUKBSSA-N 425.532 4.962 50 10 IJGE Cc1ccccc1NNC(=O)Cc1ccc(NC(=O)c2cccc(Br)c2)cc1 739388199 YHYTXELWAUYZQR-UHFFFAOYSA-N 438.325 4.696 50 10 IJGE O=C(NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl)[C@@H]1C[C@H]1c1cc(F)ccc1F 743301049 QYPOGKBLFMVSIY-CMPLNLGQSA-N 449.832 4.758 50 10 IJGE C[C@H]1CCC[C@H](OCc2cccc(NC(=O)NNC(=O)c3cccc4cccnc34)c2)C1 756256385 HXMXRJWMNRGUML-UWJYYQICSA-N 432.524 4.797 50 10 IJGE COc1ccc2cc([C@H](C)C(=O)NN=Cc3ccc(O)c(Br)c3)ccc2c1 1083895532 KZDFDBKZWKCQAV-ZDUSSCGKSA-N 427.298 4.570 50 10 IJGE COc1cccc(C(CSc2nc3ccccc3s2)=NNC(=O)c2ccccc2O)c1 1084492879 FFUVJAKRIVDRAQ-UHFFFAOYSA-N 449.557 4.937 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@@H]1CCCN(C(=O)CCCc2nc(O)c3ccccc3n2)C1 1275315681 TYENXQIMDKJIKK-QGZVFWFLSA-N 429.637 4.671 50 10 IJGE C=CCCC[C@@H](NC(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1)c1ccccc1 1313217984 BWFFBZWIHWCCPN-HXUWFJFHSA-N 425.529 4.524 50 10 IJGE C#CCCCC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)C[C@@H](C)C2 1597394169 QHZSTOIQJYRAOF-AZZGVMCLSA-N 437.543 4.922 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)cc1 1666462123 XKFPLHZCUKDTLU-SFHVURJKSA-N 447.491 4.610 50 10 IJGE O=S(=O)(c1ccc(F)cc1Br)N(Cc1ccccc1)[C@@H](CCl)C1CC1 1915158531 DDBSYTFBBHVJSB-KRWDZBQOSA-N 446.769 4.797 50 10 IJGE CC1(CO[C@@](C)(CI)CNC(=O)OC(C)(C)C)CCCCC1 1930933197 UAQAQYLIFQKYKG-KRWDZBQOSA-N 425.351 4.692 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]2(CCC13CCC3)CC[C@](C)(CI)O2 1983725572 UVVBNXKTSQRTJD-AEFFLSMTSA-N 435.346 4.683 50 10 IJGE Cc1cc(CNCCSSCCNC(=O)OC(C)(C)C)sc1Br 1993785816 ZICCDLYCLZQZDD-UHFFFAOYSA-N 441.482 4.815 50 10 IJGE Brc1cccc(CN2C[C@H]3[C@@H](Br)CC[C@H]3C2)c1Br 2031477597 MTBGMJXFWZPEPC-WCQGTBRESA-N 438.001 4.817 50 10 IJGE Clc1c(Br)sc(Br)c1[C@H](Cl)[C@@H]1CO[C@@H]2COC[C@@H]21 2040325991 OKHHADRTWKEMMJ-UAKXSSHOSA-N 436.980 4.868 50 10 IJGE Cn1nc(C[C@H](CBr)c2cccc(Br)c2)cc1Br 2049248427 DSLPUHVWJGOYOE-SNVBAGLBSA-N 436.973 4.666 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@@H]1CCCCN1C[C@H](CBr)C1CCC1 2128719416 FCLCXFSOVAOODS-HOTGVXAUSA-N 439.385 4.812 50 10 IJGE C[C@@H]1[C@H](NC(=O)OC(C)(C)C)CC(C)(C)CN1C(=O)c1ccc(CBr)cc1 2162872360 MEACROVBBPIAHD-RHSMWYFYSA-N 439.394 4.735 50 10 IJGE CO[C@@H]1CCN(CC2(CBr)CCCCCC2)[C@H](CNC(=O)OC(C)(C)C)C1 2163063241 PCPWZBFFJIKLLS-ZWKOTPCHSA-N 447.458 4.726 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC(CCCBr)C1 2216705451 JKAVPQMZLWUUGM-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC[C@](C)(CI)O2)C[C@H]2CCCC[C@@H]21 2246604627 ZETSDKIUZBWJGK-OHQAAIJDSA-N 449.373 4.929 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)C(=O)c1cc(F)c(Br)cc1F 2255687619 KCIOQYMFSQKMJG-CYBMUJFWSA-N 432.692 4.624 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1C(=O)c1cccc(Br)c1Br 2260388997 SIYFPLLNCWZJTK-GXSJLCMTSA-N 439.973 4.600 50 10 IJGE COc1ccc([C@@H](Br)C(C)(C)[C@@H]2CCCO2)cc1I 2269555012 ZEQOZRJXQRRLRE-UONOGXRCSA-N 439.131 4.941 50 10 IJGE Cc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)C(C#N)=Cc2cccs2)cc1 2293152721 XJHQKXLDDXGSFR-UHFFFAOYSA-N 437.546 4.711 50 10 IJGE CSCC[C@H](Cl)CCNC(=O)Cc1cc(Br)cc(Br)c1 2295309687 MKCDOJZJAJTYQZ-CYBMUJFWSA-N 443.632 4.621 50 10 IJGE C[P@]1(=O)C[C@@H](Br)[C@@H](Cc2ccc(Cl)c(I)c2)C1 2300238427 KSGOKAWHNQIJSU-YAXFVEMYSA-N 447.478 4.873 50 10 IJGE N#CC(=Cc1ccc(I)o1)C(=O)Nc1cccc(Cl)c1Cl 2313571194 PKVHNSKAJDNFLT-UHFFFAOYSA-N 433.032 4.737 50 10 IJGE N#CC(=Cc1ccc(-c2ccc(F)cc2)o1)C(=O)Nc1sc2c(c1C(N)=O)CCCC2 2314571644 JGPIIDAGDMHODX-UHFFFAOYSA-N 435.480 4.671 50 10 IJGE Clc1ccc(CN2CC[C@@H](Br)CC23CC3)cc1I 2315555015 MFQIVFCTKKQEHT-LLVKDONJSA-N 440.550 4.837 50 10 IJGE BrC[C@@H]1CN(Cc2sccc2I)CC12CCCC2 2316753428 YLZYOYNRUZSFPJ-LLVKDONJSA-N 440.188 4.740 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)[C@H]3CC[C@H]32)c(I)c1 2318524250 LYJLRIZEFTZIQM-MBNYWOFBSA-N 440.550 4.692 50 10 IJGE C[C@H]1CCCN(Cc2ccc(Cl)cc2I)[C@@H]1CBr 2318529890 WFQLNXRNJQCLIR-IINYFYTJSA-N 442.566 4.940 50 10 IJGE O=C(NN=Cc1ccccc1OCc1ccccc1)c1nn(-c2ccccc2)c2c1CCC2 2323763166 ULPMBDZJNYPVOD-UHFFFAOYSA-N 436.515 4.704 50 10 IJGE N#CC(=CNc1ccc(N2CCCCC2)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 2325255277 SOJYOBLBCTULQR-UHFFFAOYSA-N 425.876 4.697 50 10 IJGE FC1(F)[C@@H]2CC[C@@H](O[C@@H](CI)c3cccc(Br)c3)[C@@H]21 2333884486 SYDVBOGKIHDCOG-FVCCEPFGSA-N 443.069 4.986 50 10 IJGE Cc1scc(C(=O)N2C[C@]3(F)CCC[C@]3(CBr)C2)c1Br 2369603289 KCKZWMIFAIJMIN-UONOGXRCSA-N 425.161 4.548 50 10 IJGE COc1cccc(N/C=C(\C#N)C(=O)CSc2ncc(C(F)(F)F)cc2Cl)c1 3046874 LNRIWWMJQFQTJD-DHZHZOJOSA-N 427.835 4.943 50 10 IJGE COc1cc(OC)c([C@@H]2C(C#N)=C(N)C(C#N)(C#N)C3=CC[C@@H](C(C)(C)C)C[C@H]32)cc1OC 35168893 XPUFJDNCDUJFAM-CKNGIIGNSA-N 446.551 4.578 50 10 IJGE Cc1cccc(-c2nc(C)c(Cc3ccccc3)c(N3CCN(C(=O)[C@@H](C)Cl)CC3)n2)c1 35889873 YIJMPUROGVFUAR-LJQANCHMSA-N 448.998 4.627 50 10 IJGE O=C(NNc1ncnc(Sc2ccccc2)c1[N+](=O)[O-])c1ccc(Cl)cc1Cl 40650112 YHOGPVKYBCVNNZ-UHFFFAOYSA-N 436.280 4.600 50 10 IJGE Cc1nn(Cc2ccccc2)c(C)c1/C=N/NC(=O)CSCc1ccc(Cl)cc1 59156642 SAXVPVZJFNMYNX-WYMPLXKRSA-N 426.973 4.585 50 10 IJGE Br[C@@H](Cc1ccccc1)c1cc(I)cc2c1OCC2 306070745 WGBUGNHZCFCOGZ-HNNXBMFYSA-N 429.095 4.905 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CI)[C@@H](c2cccc(Cl)c2F)C1 382682815 CHDACDDJQDIXPV-PWSUYJOCSA-N 439.696 4.865 50 10 IJGE C[C@H](Br)[C@H]1CCN(C(=O)c2scc(Br)c2Br)C1 719869148 HEGDBXJGZUNOJE-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE O=C(NNc1c(Cl)cc(Br)cc1Cl)c1cc(-c2cccnc2)on1 742005294 SFDUXBVJNRJTBA-UHFFFAOYSA-N 428.073 4.563 50 10 IJGE O=C(NN=Cc1cc(Br)cc(Br)c1O)c1ccc2ccccc2c1 1084151286 PIEQPGPQLWGUGH-UHFFFAOYSA-N 448.114 4.834 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2nc3ccc(Cl)cc3s2)cc1)[C@H]1C[C@@H]1C 1218458656 LFBJHEGYILWMBD-GTNSWQLSSA-N 429.933 4.860 50 10 IJGE Cc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2Cc1cccc(F)c1 1865712930 MIADZGQPUIYRDI-KRWDZBQOSA-N 428.389 4.616 50 10 IJGE C[C@@H](C(=O)N[C@H](Cc1ccc(F)cc1)C(=O)Nc1ccc(SC#N)cc1)C1CCCC1 1867009153 FAGCROFSSFYSTP-OPAMFIHVSA-N 439.556 4.891 50 10 IJGE CCN(C[C@](C)(CI)OCCC[C@@H]1C[C@@H]1C)C(=O)OC(C)(C)C 1896109094 IEMBDBSLSVJOAP-DAYGRLMNSA-N 439.378 4.890 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]3(CC[C@](C)(CI)O3)C[C@H]21 2001952406 RDNNIRCHJFVSKB-RGCFKVTRSA-N 449.373 4.929 50 10 IJGE C[C@]1(NC(=O)c2csc(Br)c2Br)CCC[C@@H]1Br 2011549665 UUAYGRIYEWXSLM-CPCISQLKSA-N 446.002 4.709 50 10 IJGE ClCC[C@H]1CCC[C@H]1Nc1ncc(I)cc1Br 2015765382 FPIUAWWSAZWPMX-LDYMZIIASA-N 429.527 4.658 50 10 IJGE O=C(NCC1(CCBr)CC1)c1cccc(Br)c1Br 2031487130 QTJOJFVMJDBXSH-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE CC(C)(C)C[C@H](CBr)CNC(=O)c1sccc1I 2038695332 AHCKQRAHMVGHKV-SECBINFHSA-N 444.176 4.530 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([S@](C)(=O)=NC[C@H](CBr)C(C)(C)C)C1 2044695421 CZOADLLRLHHNFH-XHQUFGICSA-N 439.460 4.541 50 10 IJGE Cc1ccnc(CN[C@H](C)CCCCCI)c1Br 2054166104 YNZLCPRQWLSRAQ-GFCCVEGCSA-N 425.152 4.626 50 10 IJGE O=S(=O)(c1cc(Cl)ccc1F)N(Cc1ccccc1)C1(CBr)CCC1 2057408827 XPXIVDJZKBRECF-UHFFFAOYSA-N 446.769 4.988 50 10 IJGE CN(C[C@@H](Cl)C1CCCC1)c1ncc(I)cc1Br 2069526566 XSTTWPOTBMERNR-GFCCVEGCSA-N 443.554 4.683 50 10 IJGE COc1cc(-n2nc(CCl)c(I)c2C(F)(F)F)ccc1C 2079211775 APVBWMLTIHZDIK-UHFFFAOYSA-N 430.595 4.552 50 10 IJGE CN(C[C@@]1(Br)CC1(F)F)c1cc(Br)ccc1CBr 2082521474 HYVHBXKIVJQYNM-NSHDSACASA-N 447.943 4.953 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1ccc(Cl)cc1Br 2090386857 DPTUNKRIWMPAIA-VIFPVBQESA-N 429.605 4.739 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1Cc2ccccc2N(C[C@H](Br)C(F)(F)F)C1 2106783719 CCIZRRGJNGKJPC-WFASDCNBSA-N 437.300 4.516 50 10 IJGE O=C(c1scc(Br)c1Br)N1[C@H](CCl)C[C@@H]2CCC[C@H]21 2108397732 VYDJWGORGYUBEX-OYNCUSHFSA-N 427.589 4.895 50 10 IJGE CC(C)N(CCOCCBr)Cc1ccc(Cl)c(Br)c1F 2166829813 DWYFFWNKDJHYOI-UHFFFAOYSA-N 431.571 4.864 50 10 IJGE O=[N+]([O-])c1ccc(CBr)c(N2[C@H]3CCC[C@H]2CN(Cc2ccccc2)C3)c1 2182304199 PZXCZTQVHAERBJ-PMACEKPBSA-N 430.346 4.733 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C(F)(F)F)N(CCCCCCBr)CC1 2223283622 UZLROEJSZXJUES-CQSZACIVSA-N 431.337 4.815 50 10 IJGE CO[C@@H]1CC([C@H](Cl)Cc2cc(Br)cc(Br)c2)C[C@H]1OC 2295332509 XSMUUHUUSDRZCL-RBSFLKMASA-N 426.576 4.802 50 10 IJGE CN(Cc1ccc(Cl)cc1I)C(C)(C)CCBr 2302318150 QCDCGAWDDFPQPS-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE CC[C@H](NC(=O)C(C#N)=CN1CCN(c2cccc(C)c2)CC1)c1ccc2c(c1)CCCC2 2325092624 AMNIGJUDPRMYRK-MHZLTWQESA-N 442.607 4.671 50 10 IJGE FC(F)(F)c1ccc(CBr)c(N2CCCN(Cc3ccccc3)CC2)n1 2343786966 FBIZREPUFDRDCJ-UHFFFAOYSA-N 428.296 4.708 50 10 IJGE COc1ccc([C@H](C(=O)NC2CCCC2)N(CCC2=CCCCC2)C(=O)CCl)cc1 4672986 HXBYNHOJECDEES-HSZRJFAPSA-N 432.992 4.753 50 10 IJGE Cc1cc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccco2)CCC3)ccc1Cl 40814510 DAFYVMIANULYMM-LFVJCYFKSA-N 426.856 4.832 50 10 IJGE O=C(CSc1nc(-c2ccccc2)cs1)N/N=C/c1ccc(Br)cc1 40924261 MEQISICFOSCOOU-KEBDBYFISA-N 432.368 4.815 50 10 IJGE O=[N+]([O-])c1cc(Cl)cc(Br)c1OCC1(CBr)CCOCC1 96870308 SLNLNJFJOVLQQY-UHFFFAOYSA-N 443.519 4.581 50 10 IJGE C[C@@H]1CC(O[C@H](CI)c2ccc(Br)cc2)C[C@@H](C)O1 231320028 FNYCRCULNQUCNT-UEKVPHQBSA-N 439.131 4.898 50 10 IJGE COc1ccc(C=NNC(=O)COc2ccc(C34CC5CC(CC(C5)C3)C4)cc2)cc1OC 252637378 XSNPCHOUXMIUPU-UHFFFAOYSA-N 448.563 4.701 50 10 IJGE Oc1nc2ccc([C@@H](Br)c3cccc(F)c3I)cc2o1 721698032 NKNQBPXIRKTZNF-GFCCVEGCSA-N 448.029 4.761 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2CC[C@H](c3cccc(F)c3)C2)c(-c2ccccc2)n1 729444725 BDVKSNBVSFCWGU-PIUNUONSSA-N 439.494 4.526 50 10 IJGE Cc1cccc(COc2cccc(NC(=O)NNC(=O)c3cccc4cccnc34)c2)c1 756534452 KVGXAQQLZWXCIY-UHFFFAOYSA-N 426.476 4.589 50 10 IJGE O=C(NNc1ccc(Cl)nn1)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 770074320 VPSFDYDTXQSIKO-UHFFFAOYSA-N 442.266 4.668 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N2CCn3c(C(C)C)nnc3[C@@H]2C)c(C)n1C1CCCCC1 784698002 FWFFTUXSDGOLAI-ORTNRGLGSA-N 434.588 4.835 50 10 IJGE C#CCN(CC1CC1)C(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1535756125 MAJIQZZBVDSUEQ-NDENLUEZSA-N 425.454 4.892 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C)c1ccccc1OC(F)F 1538746668 ZBLSFXUIYYZTTE-SEYXRHQNSA-N 443.475 4.584 50 10 IJGE C=C(Cl)C[C@H](NS(=O)(=O)c1cccc(S(F)(F)(F)(F)F)c1)C(=O)OCC 1664946865 DLLDCJRIAAUINS-LBPRGKRZSA-N 443.843 4.697 50 10 IJGE Cc1c(C(=O)NCc2ccccc2Cl)oc2c1C(=NNC(=O)c1cccs1)CCC2 1772748249 AWOWSVUPOYJAMN-UHFFFAOYSA-N 441.940 4.703 50 10 IJGE CCCc1nn(-c2ccc(Br)cc2)c2c1[C@H](c1cccs1)C(C#N)=C(N)O2 1865698050 IVRBXVUXLVZKOU-KRWDZBQOSA-N 441.354 4.867 50 10 IJGE CCCc1nn(Cc2ccccc2)c2c1[C@@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865705293 QOBUZHSNTOBDLY-QHCPKHFHSA-N 428.536 4.889 50 10 IJGE C[C@H](CCCl)N(Cc1ccccc1)C(=O)c1cc(I)ccc1O 1915093711 YMLAWWVMZVRPDK-CYBMUJFWSA-N 443.712 4.657 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1F 1915104849 INIGHTYRPRFSOL-HNNXBMFYSA-N 434.758 4.797 50 10 IJGE C[C@@H](CCBr)CCN(Cc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 1953585783 YMOHRZQIHQDGEK-KRWDZBQOSA-N 425.411 4.919 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@@H]1CC[C@H]1NC(=O)OCc1ccccc1 1999516123 XTMPRXKSWGPYNT-PWRODBHTSA-N 431.374 4.554 50 10 IJGE O=C(CBr)c1c(OC(F)(F)F)ccc(Br)c1C(F)(F)F 2054796450 HDNZMWAMHYBHBX-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE CC(C)[S@@](=O)(=NCC[C@H](C)CCBr)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2063273347 LQRNAKIHKSQKEX-RKPUJPDHSA-N 439.460 4.683 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)c1ccc(Cl)c(NC(=O)OC(C)(C)C)c1 2076209530 ROUDDKOZDGBFJA-AULYBMBSSA-N 431.758 4.933 50 10 IJGE CC(C)(C)c1ccc(-n2nc(CCl)c(I)c2C(F)(F)F)cn1 2078890246 LMXINKAOMCRRBU-UHFFFAOYSA-N 443.638 4.927 50 10 IJGE C=CC[C@H](CBr)CNC(=O)c1c(Br)cccc1Br 2082046882 MXPTUNAGWCOHMY-SECBINFHSA-N 439.973 4.529 50 10 IJGE CC[C@@H]1CCOC[C@@H]1O[C@H](CI)c1cccc(Br)c1 2096207826 QNGNAVZQOBDORP-DFBGVHRSSA-N 439.131 4.757 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1nc(CCl)ccc1Br)C2 2120532096 QPGABURLJHZGHZ-OYRHEFFESA-N 434.809 4.931 50 10 IJGE ClCCc1nc2ccncc2n1Cc1scc(Br)c1Br 2150583977 VUMVHXHSDHUEQC-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2CCc1cnn(Cc2ccccc2)c1 2153146482 PAKMXZCSPKMINN-UHFFFAOYSA-N 444.764 4.729 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@@]12C[C@@H]1CN(Cc1ccccc1)C2 2155872535 JWIKGTZHSLESFV-IIBYNOLFSA-N 445.792 4.515 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C(=O)[C@H](Br)C2CCCC2)Cc2ccccc21 2167033097 LXKWTHIITBKNDI-ZWKOTPCHSA-N 437.378 4.548 50 10 IJGE COCCN(c1c(CBr)ccc(Br)c1Cl)[C@@H]1CCSC1 2170157119 MKWCZSGARYJURF-LLVKDONJSA-N 443.632 4.956 50 10 IJGE Cc1sc(Br)cc1C(=O)NC[C@@]1(CBr)C[C@H]1C(F)(F)F 2192585897 IYZOOCJAPBEFIE-KCJUWKMLSA-N 435.103 4.512 50 10 IJGE Cc1sc([C@H](Br)c2nn(C)nc2Br)c(Br)c1C 2246428151 VRPPRRYRIROWKV-SSDOTTSWSA-N 443.990 4.503 50 10 IJGE COc1ccc([C@@H](Br)C(F)(F)C(F)F)cc1I 2248890747 XCTIFGCHABJQNX-MRVPVSSYSA-N 426.973 4.636 50 10 IJGE COc1ccc([C@H](Br)[C@H]2C[C@@]23CCCOC3)cc1I 2269547752 DRKLWIYNSFCWKT-BYCMXARLSA-N 437.115 4.553 50 10 IJGE CCc1cc([C@@H](Br)c2cccc(S(C)(=O)=O)c2)sc1Br 2282912838 BTMDVCVFFCMOKA-ZDUSSCGKSA-N 438.206 4.961 50 10 IJGE CC1([C@H](CBr)NCc2ccc(Cl)c(I)c2)CC1 2300240518 NBBSBJFCBVFSIM-LBPRGKRZSA-N 428.539 4.598 50 10 IJGE CC(C)[C@@H](Cl)C(C)(C)Nc1ncc(I)cc1Br 2301981830 OEPWAOUIWLJECW-SNVBAGLBSA-N 431.543 4.903 50 10 IJGE CC[C@@H](Br)CN(CC)Cc1ccc(Cl)cc1I 2302336081 KUUBEWRQWLYWLV-LLVKDONJSA-N 430.555 4.940 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc3c(c2)C[C@H](C)O3)sc2c1CCCC2 2314617621 KYTBYPICQQIZEE-AWEZNQCLSA-N 436.533 4.673 50 10 IJGE Clc1ccc(CN2CC3(CC(CBr)C3)C2)cc1I 2315548178 DPFSREZOSBYYJP-UHFFFAOYSA-N 440.550 4.552 50 10 IJGE Clc1ccc(I)cc1COc1ccc(CBr)cn1 2327236675 FIBDZDCPBWFMAO-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE CO[C@@H](CO[C@@]1(CBr)CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1 2336212981 TZBKKXBAJXMGOF-FXAWDEMLSA-N 428.367 4.555 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@H]3CCN(C(=O)OC(C)(C)C)C[C@H]3C2)C1 2345004701 NXVJZPTUFNPFDQ-DLBZAZTESA-N 429.443 4.767 50 10 IJGE O=C(NC[C@@H]1CCCC[C@H]1CCl)c1ccc(Cl)cc1I 2365588572 LDNZQPLLUYVGRD-QWRGUYRKSA-N 426.125 4.720 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc2cc(O)ccc2c1 2369687466 LVIMWEZVJSPVDC-HXUWFJFHSA-N 428.326 4.646 50 10 IJGE COc1ccc2nc(/C(C#N)=C/c3cc(C)n(-c4cc([N+](=O)[O-])ccc4OC)c3C)[nH]c2c1 33472977 MKAKIFTYWPEMQI-LICLKQGHSA-N 443.463 4.960 50 10 IJGE CCOC(=O)c1cc([C@H](C)CC)n(-c2ccc(C(=O)Oc3ccc([N+](=O)[O-])cc3)cc2)n1 97940680 NNVQSSBEZAEDSS-OAHLLOKOSA-N 437.452 4.690 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H]1Br)c1cc(Br)ccc1Br 161223134 ITBFFJIRVKLPNX-KWQFWETISA-N 439.973 4.505 50 10 IJGE CCCOc1c(Cl)cc(/C=N\NC(=O)CSc2nc3ccccc3[nH]2)cc1OCC 169886276 YHTNKZUPBBRBPN-FMCGGJTJSA-N 446.960 4.646 50 10 IJGE CC(C)C[C@H](CBr)NC(=O)c1cc(Br)cc(Br)c1 232626015 FLNRUFSDWGMRHA-GFCCVEGCSA-N 441.989 4.751 50 10 IJGE CC(C)COc1ccc(C=NNC(=O)CSCc2ccccc2Br)cc1 252623339 OOSVJZXJPPJRDN-UHFFFAOYSA-N 435.387 4.867 50 10 IJGE NNC(=O)c1ccc2nc(-c3ccc(OCc4c(Cl)cccc4Cl)cc3)[nH]c2c1 256047491 MRXMEGHKVKTMGK-UHFFFAOYSA-N 427.291 4.719 50 10 IJGE C[C@@]1(CI)CC[C@](C)(c2ccc(I)cc2)O1 309350933 BSPLKVLJVCEUMH-QWHCGFSZSA-N 442.078 4.511 50 10 IJGE O=S(=O)(NCc1ccccc1OCc1ccccc1)c1ccc(CBr)cc1 312596542 QZPDJJSWNYGHPP-UHFFFAOYSA-N 446.366 4.639 50 10 IJGE COC[C@H]1C[C@@H](Cc2cc(Cl)ccc2I)[C@H](Br)C1 698765358 JCGBFZJVSQVXPD-OUJBWJOFSA-N 443.550 4.923 50 10 IJGE O=C(NC1(CBr)CCCCCC1)c1sccc1I 713449586 MNHIDLRUGZXMJT-UHFFFAOYSA-N 442.160 4.570 50 10 IJGE CC[C@H](C[C@H](C)Br)NC(=O)c1ccc(Br)cc1Br 716939262 ODHAULQIRACONX-WCBMZHEXSA-N 441.989 4.894 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CSc2cc(Cl)ccc2Cl)c1C 736695156 WDKDXSWELIRGOO-UHFFFAOYSA-N 434.352 4.698 50 10 IJGE COc1cc(-c2cc(C(=O)NN=C(C)C(F)(F)F)c3ccccc3n2)cc(OC)c1OC 761742852 HGTSBQAKNNOSAM-UHFFFAOYSA-N 447.413 4.596 50 10 IJGE O=C(NN=C1CCN(CCC(F)(F)F)CC1)c1ccccc1OCc1ccc(F)cc1 779759711 YGWCAJSJTRZLKA-UHFFFAOYSA-N 437.437 4.539 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2ccc(OCc3ccccc3C#N)c(OCC)c2)cc1 1083949415 VGIZGMGSVSWJFK-UHFFFAOYSA-N 443.503 4.699 50 10 IJGE CCc1ccccc1NC(=O)C(=O)NN=Cc1cccc(OCc2ccc(Cl)cc2)c1 1084071493 FSZVJESXGCMTCL-UHFFFAOYSA-N 435.911 4.570 50 10 IJGE Cc1ccc(-n2c(C)c(Br)c(C=NNC(=O)COc3ccccc3)c2C)cc1 1084184815 QESLGQWKSGPMRS-UHFFFAOYSA-N 440.341 4.694 50 10 IJGE O=C(NN=Cc1cccc(OCc2ccc(F)cc2)c1)c1ccccc1Br 1084275500 APFPWZJJOTUMAM-UHFFFAOYSA-N 427.273 4.931 50 10 IJGE Cc1c(C(=O)N2c3ccc(F)cc3CC[C@@H]2C)oc2c1C(=NNC(=O)c1ccco1)CCC2 1772748088 YCTJNCHJPDTTJT-AWEZNQCLSA-N 449.482 4.772 50 10 IJGE Cc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1cccc(Cl)c1)C(C#N)=C(N)O2 1865683739 ODHSBMWCCKLCPJ-LJQANCHMSA-N 429.282 4.904 50 10 IJGE N#CSc1ccc(NC(=O)CNC(=O)C[C@@H](c2ccccc2)c2cccc(F)c2)cc1 1868142452 IFPTZFDBRUECNY-QFIPXVFZSA-N 433.508 4.676 50 10 IJGE C[C@H](Br)C(C)(C)CNC(=O)c1cc(Br)ccc1Br 1913837981 NMRYWLKKXJPQPM-QMMMGPOBSA-N 441.989 4.751 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1ncccc1Br 1915128343 XBGHUXBMBIVMTB-AWEZNQCLSA-N 426.152 4.660 50 10 IJGE Cc1c(Br)sc([C@@H](Cl)[C@@H]2CCCCS2(=O)=O)c1Br 1922942219 QXYAAPUSYHAEKF-CBAPKCEASA-N 436.618 4.829 50 10 IJGE C[C@H](c1ccncc1Br)[C@H](Br)c1nn(C)cc1Br 1924058240 VJCJQSZQIIOGAG-HQJQHLMTSA-N 437.961 4.580 50 10 IJGE CCCN1C[C@H](Br)[C@H](Cc2cccc(Br)c2Br)C1 2039263863 ZJLKQCDWTYFAJR-YPMHNXCESA-N 440.017 4.859 50 10 IJGE CC(C)(C)OC(=O)NCC[S@@](=O)(=NCCCCCBr)c1ccccc1 2045261729 VIFMXGBJAILBIZ-VWLOTQADSA-N 433.412 4.603 50 10 IJGE CSC(N=CN(C)C)=C(C#N)[P+](c1ccccc1)(c1ccccc1)c1ccccc1 2051913108 UFDWTORMQBJKGO-UHFFFAOYSA-N 430.537 4.626 50 10 IJGE Brc1ccc(Br)c(CN2C[C@@H](Br)[C@H](C3CC3)C2)c1 2054716419 DEHDCUHFDCQANT-GXTWGEPZSA-N 438.001 4.817 50 10 IJGE Cc1cc(Br)ccc1C(=O)N[C@@H](C)CCCCCI 2117894118 JZYNHLDUNGBJFR-LBPRGKRZSA-N 438.147 4.871 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C[C@@H](CBr)C(C)(C)C)C1 2185505347 ZLXNKCCOPZLIJS-HUUCEWRRSA-N 443.430 4.993 50 10 IJGE C[C@H](Cl)c1nc2cccc(Br)c2n1C[C@H]1COCCN1Cc1ccccc1 2194649713 OFKGPYJPRZYZIW-RDJZCZTQSA-N 448.792 5.000 50 10 IJGE ClCc1ccc(OCCOCCOCCOCc2ccccc2)cc1Br 2227772217 PFDWWBWTRIIWQJ-UHFFFAOYSA-N 443.765 4.817 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C)CCC[C@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 2241896365 GUUIGLGGKMWBBB-KSMMKXTCSA-N 435.403 4.606 50 10 IJGE CCn1nc(C)c(CBr)c1Oc1cccc(C)c1I 2277889495 PIDVPJDVCBNOCG-UHFFFAOYSA-N 435.103 4.812 50 10 IJGE Clc1ccc(CN2CC3(CC3)C[C@H]2CBr)cc1I 2315557840 PPXZBGCOKAFTHS-NSHDSACASA-N 440.550 4.694 50 10 IJGE N#CC(=Cc1cccc(Cl)c1)C(=O)Nc1ccc(I)cc1F 2329684320 LPDCPXHVUOJJLO-UHFFFAOYSA-N 426.616 4.629 50 10 IJGE CN(C)c1ccnc(N(C)C[C@@H]2CCCCN2Cc2ccccc2)c1CBr 2377473400 SAZAPSRCTUQTRB-IBGZPJMESA-N 431.422 4.533 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2F)cc1C 38652168 AXRCANDFSNVJEH-VWLOTQADSA-N 444.462 4.645 50 10 IJGE Cc1ccccc1C(=O)NNc1ncnc(Nc2cc(Cl)ccc2Cl)c1[N+](=O)[O-] 40646574 ITJWSUQFZGFBCE-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE O=C(NC[C@H]1CCC[C@H]1Br)c1cc(C(F)(F)F)ccc1Br 124440922 GWKWHZDWAWHFIP-LDYMZIIASA-N 429.074 4.761 50 10 IJGE FC(F)(F)c1ccc(Br)c(-c2nnc(CBr)n2C2CC2)c1 163154289 DFWZMTWQCGVKAQ-UHFFFAOYSA-N 425.046 4.956 50 10 IJGE Cc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2F)cc1 205644776 OMBCEEXOFXSFPP-RPIOBPNHSA-N 426.447 4.971 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2ccc3c(c2)C[C@@H](C)O3)sc2c1CCCC2 214202463 KYTBYPICQQIZEE-RFRKOGIWSA-N 436.533 4.673 50 10 IJGE COc1ccc(C=NNC(=O)c2cccc(N3Cc4cc(C)c(C)cc4C3)c2)cc1OC 252639715 YNDDZBDKENUNHE-UHFFFAOYSA-N 429.520 4.605 50 10 IJGE CO[C@@H](COc1c(Br)cc(Br)cc1CBr)C1CC1 400150139 BLUQNJGSQJMPKA-LBPRGKRZSA-N 442.973 4.910 50 10 IJGE C[C@@H]1OCC[C@@]1(CBr)Cc1cc(Cl)ccc1I 405501595 CDCXTNSBVZFQLL-ZANVPECISA-N 429.523 4.677 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN(Cc2cc(Cl)ccc2I)C1 689037940 PMSMULUVYXYBFY-GHMZBOCLSA-N 442.566 4.940 50 10 IJGE O=C(NC1CCC1)[C@H](c1cccs1)N(C(=O)CCl)c1cccc(C(F)(F)F)c1 725237412 GHPLNSLTJOOHNP-KRWDZBQOSA-N 430.879 4.749 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)c1ccc(S(=O)(=O)Cc2ccccc2)cc1 741176302 PPNGDWQNVOAFBI-UHFFFAOYSA-N 437.473 4.516 50 10 IJGE Cn1cc(C(=O)NNC(=O)N[C@H](c2cccc3ccccc23)C(F)(F)F)c2ccccc21 776009045 QGFZUKVHJGJGMB-HXUWFJFHSA-N 440.425 4.579 50 10 IJGE C=CCC[C@H](C(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1)c1ccccc1 1182129767 ZWIJQLVPHBRNEL-VWLOTQADSA-N 439.515 4.501 50 10 IJGE C[C@@H](SCc1nc(O)c2ccccc2n1)C(=O)N1CC[C@@H](O[Si](C)(C)C(C)(C)C)C1 1557691315 YQUSCSUTQZZFSI-HZPDHXFCSA-N 447.677 4.580 50 10 IJGE C#C[C@@H](NC(=O)/C(C#N)=C/c1cc(C)n(CC(C)C)c1C)c1ccc(Br)cc1 1596979002 SEPGLBVBEWMAGA-FNUHDPNESA-N 438.369 4.921 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)c1C 1650818183 WLZRASAHAWFQSR-WMZOPIPTSA-N 425.895 4.585 50 10 IJGE Cc1cccc(OCCCOc2cccnc2NC(=O)Oc2ccc([N+](=O)[O-])cc2F)c1 1858692197 ACSBHNIHQVTRCM-UHFFFAOYSA-N 441.415 4.896 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc3ccccc23)c(OC)c1 1865707655 CIJJSBLEZMYAGL-XMMPIXPASA-N 438.487 4.569 50 10 IJGE CCCC[C@@H](NC(=O)[C@H](C)Cc1ccc(F)cc1)C(=O)Nc1ccc(SC#N)cc1 1866840965 RDELNJJTEOSFEP-IIBYNOLFSA-N 427.545 4.891 50 10 IJGE CC(C)[C@@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1sccc1Br 1915261743 KXENDIZMTOPQEP-OAHLLOKOSA-N 436.824 4.965 50 10 IJGE C[Si]1(C)C[C@H](C(=O)NN(Cc2ccccc2)Cc2ccccc2)N(Cc2ccccc2)C1 1923941695 CYPPVZKYPXRJED-AREMUKBSSA-N 443.667 4.852 50 10 IJGE Cc1cc([C@H](Br)c2cc(Br)n(C)n2)sc1Br 1937821237 FGJJJMZNFWSAHA-SECBINFHSA-N 428.975 4.799 50 10 IJGE CC1(C)CN(Cc2c(Br)cccc2Br)C[C@H]1Br 1945332348 BMADOMXAFRQARA-GFCCVEGCSA-N 425.990 4.817 50 10 IJGE C[P@]1(=O)C[C@H](Br)[C@H](Cc2cc(Cl)ccc2I)C1 2005165376 SBEQROXFSKMNLP-MIHTYCSTSA-N 447.478 4.873 50 10 IJGE O=C(N[C@H]1CC[C@@H](CBr)C1)c1ccc(Br)cc1Br 2029531652 AHMSEIRKDHSPGF-SCZZXKLOSA-N 439.973 4.505 50 10 IJGE Brc1ccc(Br)c(CN2CC[C@H](Br)[C@@H]3CC[C@@H]32)c1 2070006758 HCWAMOSDOWKNGD-UBHSHLNASA-N 438.001 4.959 50 10 IJGE Fc1cccc(I)c1Cn1nc(C2CCC2)cc1CBr 2070029186 ZXHUJPKLEWLYRR-UHFFFAOYSA-N 449.105 4.838 50 10 IJGE O=C1Cc2cc([C@H](Br)[C@H]3C[C@@H](Br)C3)c(Br)cc2N1 2076181763 IULSZLBEDARHRU-BFHDXFOESA-N 437.957 4.553 50 10 IJGE FC(F)(F)c1c(Br)c(CBr)nn1-c1cc(C2CC2)ccn1 2078915564 IYBQUQWOWPDFIL-UHFFFAOYSA-N 425.046 4.821 50 10 IJGE ClCc1ccc(N2CC[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)cc1Br 2129055636 RSNYEAPEDALTIK-NHCUHLMSSA-N 435.793 4.668 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Br)C2 2134105742 UJANCDYGDBVXGP-NVGOVIIQSA-N 431.552 4.643 50 10 IJGE CC1(C)CC(CCl)(CNC(=O)c2cc(Cl)ccc2I)C1 2158310158 XLANRUKLSGBHQO-UHFFFAOYSA-N 426.125 4.720 50 10 IJGE O=C(c1cccc(OCc2ccccc2)c1)N1C[C@@H](CBr)[C@@H](C(F)(F)F)C1 2163357766 FEOWUSJHNKFFLQ-AEFFLSMTSA-N 442.275 4.911 50 10 IJGE Cc1c(Cl)cc(C(=O)N(CCBr)CC(F)(F)F)cc1Br 2167388409 RXQZWKLCPPAMKU-UHFFFAOYSA-N 437.481 4.810 50 10 IJGE O=C(c1c(Cl)cccc1Br)N1CCC(F)(F)[C@H](CBr)C1 2169465757 UISSWLKCGPRQHM-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE COCCO[C@@H]1[C@H](Br)C[C@H]1Oc1ccc(Cl)c(Cl)c1Br 2206355620 AOMCPXSSFOUFKG-XBURVNOZSA-N 448.966 4.702 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)C[C@H]1CC1(Br)Br 2208937064 KDNDXGRVDONJFT-DGCLKSJQSA-N 440.017 4.778 50 10 IJGE C[C@@]1(C2CC2)CN(CCCCCI)CCN1Cc1ccccc1 2211186939 RFBCLFFEAZTGBA-FQEVSTJZSA-N 426.386 4.578 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C[C@@H](C)O[C@@H]2C)cc1I 2257373261 LZXFYQULCYYOLE-FTBFGRRBSA-N 425.104 4.549 50 10 IJGE Cc1cc(F)c(CBr)c(N2CCN(Cc3ccccc3)CC(F)(F)C2)c1 2268145967 KUNHJEZWZJSQFV-UHFFFAOYSA-N 427.308 4.987 50 10 IJGE C[C@](CBr)(NC(=O)c1cc(F)c(Br)cc1Cl)C(F)(F)F 2282987625 GITHALFBZVLCGJ-SNVBAGLBSA-N 441.444 4.687 50 10 IJGE O=C(Cc1ccc(Br)c2ccccc12)NN=CC=Cc1ccccc1[N+](=O)[O-] 2293115999 ACBKGAWVUFWMNY-UHFFFAOYSA-N 438.281 4.868 50 10 IJGE N#CC(=C(O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O)c1ccc2ccccc2n1 2297398557 YIRNAZDMNMQISK-UHFFFAOYSA-N 438.464 4.562 50 10 IJGE N#CC(=Cc1cc(Br)c(O)c(Br)c1O)c1nc2ccccc2[nH]1 2297454014 LBAAAJBGYHICCV-UHFFFAOYSA-N 435.075 4.563 50 10 IJGE C[C@H](NCc1ccc(I)c(Br)c1)C1(CCl)CC1 2306220340 WREOMZQBQPPANC-VIFPVBQESA-N 428.539 4.551 50 10 IJGE C=CCN1C(=O)C(=Cc2ccc(OCc3ccc(C)cc3)c(OCC)c2)C(C)=C(C#N)C1=O 2314617424 YBKHYWTURJJCRB-UHFFFAOYSA-N 442.515 4.751 50 10 IJGE Clc1cc(CN2C[C@H]3CC[C@H]2C[C@@H]3Br)ccc1I 2315477285 ZWSBUQKCBLEUQJ-WOPDTQHZSA-N 440.550 4.692 50 10 IJGE BrCC1(OCc2c(Br)cccc2Br)CCOCC1 2318172547 KXQDGWJXWPFEAD-UHFFFAOYSA-N 442.973 4.672 50 10 IJGE CC(C)N(C)C[C@@H](Br)CCc1ccc(Cl)cc1I 2318542670 XFGUTRWBNOYZRF-LBPRGKRZSA-N 444.582 4.981 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNC(=O)C=Cc2ccc(C(C)C)cc2)c(C)n1 2321184572 KTDLSEDYPDACTL-UHFFFAOYSA-N 429.520 4.663 50 10 IJGE CC1(C)COC[C@@H]1CO[C@H](CI)c1ccc(Br)cc1 2339010396 KUVFVPAQSBPECK-TZMCWYRMSA-N 439.131 4.614 50 10 IJGE CN(Cc1cnn(Cc2ccccc2)c1)c1nc(C(F)(F)F)ccc1CBr 2369845422 SXWZMUOGVDHKHK-UHFFFAOYSA-N 439.279 4.877 50 10 IJGE COc1cc(-c2cc(C(=O)NN=Cc3ccccc3)n[nH]2)ccc1OCc1ccc(C)cc1 2369749 CORFCGCRBHUXAT-UHFFFAOYSA-N 440.503 4.737 50 10 IJGE Cc1cc(Br)cc(Br)c1OCC(=O)N/N=C1\CCC[C@H](C)C1 12483288 LNEJYPQQINUPKD-AUXBAGKGSA-N 432.156 4.581 50 10 IJGE C/C(=N/NC(=O)CCCSc1nc2ccc([N+](=O)[O-])cc2s1)c1ccc(F)cc1 58991112 ZCERSXFLBMIRBC-UUYOSTAYSA-N 432.502 4.756 50 10 IJGE COc1cccc(/C(CSc2nc3ccccc3s2)=N\NC(=O)c2ccccc2O)c1 59460786 FFUVJAKRIVDRAQ-PLRJNAJWSA-N 449.557 4.937 50 10 IJGE Cc1nc(COc2ccc(/C=C(/C#N)C(=O)Nc3ccc(Cl)cc3Cl)cc2)no1 109086542 SCQVQZUUBDVMIC-ZSOIEALJSA-N 429.263 4.810 50 10 IJGE CCCOc1ccc(/C=N\NC(=O)CSc2nc3ccccc3s2)cc1OCC 137779542 IUQFLIWOYFIMKA-XKZIYDEJSA-N 429.567 4.726 50 10 IJGE CC(C)(C)[C@H](Br)CNC(=O)c1scc(Br)c1Br 705439075 OQFCCTTZCJGJBR-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE O=C(NN=Cc1ccc(OCc2ccc(F)cc2)cc1)c1ccccc1Br 725441549 YZEBEDDGMIOEAO-UHFFFAOYSA-N 427.273 4.931 50 10 IJGE Cc1nc([C@H]2CCCCN2C(=O)/C(C#N)=C/c2cc(C)n(-c3ccccc3C)c2C)no1 737613815 BAHGOAVBFRJIAD-XOYGFPHKSA-N 429.524 4.755 50 10 IJGE COc1cc(NNC(=O)Cc2c(C)nn(-c3ccc(C)c(Cl)c3)c2C)ccc1Cl 790188719 KJBQDMBRZCBNOO-UHFFFAOYSA-N 433.339 4.799 50 10 IJGE C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F 1087433621 DORICNQCXRLSNI-GKCIPKSASA-N 442.437 4.577 50 10 IJGE N#CC1=C(N)Nc2c(N=Nc3ccc(Cl)cc3)c(N)nn2[C@@H]1c1ccc(Cl)cc1 1088724929 KWBXMULDAIDAEH-MRXNPFEDSA-N 425.283 4.896 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNC(=O)c1cc(-c2ccc(C)c(C)c2)[nH]n1 1153205911 VDCOKUZGWBVKTA-GXDHUFHOSA-N 443.334 4.865 50 10 IJGE C=CCC1(C(=O)NNc2nc3ccccc3c(=O)n2-c2ccc(C)cc2C)CCCCC1 1565754958 WLOLWGAJWHIMKB-UHFFFAOYSA-N 430.552 4.972 50 10 IJGE CN1C[C@H](c2cc(C(F)(F)F)ccc2Br)[C@@H](CI)C1 1614693914 MMVPUZUZJIKCFL-KWQFWETISA-N 448.064 4.548 50 10 IJGE CCOC(=O)c1sc(NC(=O)/C(C#N)=C/c2cccc(Cl)c2)c(C(=O)OCC)c1C 1866129698 GYWADCZPDAVHQR-NTEUORMPSA-N 446.912 4.609 50 10 IJGE COc1cc2nc(/C(C#N)=C/c3ccc(OCc4ccccc4)cc3)nc(O)c2cc1OC 1872727495 FNBPYGOLVDACMJ-XDHOZWIPSA-N 439.471 4.996 50 10 IJGE CCCCCOc1ccc(/C=C(\C#N)c2nc(O)c3ccc(C(=O)OC)cc3n2)cc1OC 1872727654 QLDIVCWACWYWKM-LDADJPATSA-N 447.491 4.764 50 10 IJGE COc1ccccc1-c1csc(/C(C#N)=C(\O)c2ccc3c(c2)C(=O)N(C(C)C)C3=O)n1 1872747227 SXWQQKGTPZAANU-UZYVYHOESA-N 445.500 4.773 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)c3cc(OC)c(OC)c(OC)c3)n2)cc1F 1872752590 KKDDWKIPNAUIGW-ZHZULCJRSA-N 442.468 4.933 50 10 IJGE CCCCCCOc1ccc(/C=N/NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc1OC 1873795409 HZIMSJBGINRZAB-HUXSYLCKSA-N 449.592 4.654 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCCN(C(=O)OC(C)(C)C)C12CCC2 1883670720 QRCQUKAFHSBSDD-CABCVRRESA-N 447.414 4.844 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C(=O)NC[C@H]2C[C@H]2Br)cc1C(F)(F)F 1887785011 XUDQMKGSKSUMMQ-ZYHUDNBSSA-N 437.256 4.566 50 10 IJGE CCc1nn(C)c(CN(Cc2ccccc2)[C@@H](C)CBr)c1Br 1914375941 YRZBQTCJXQUTDB-ZDUSSCGKSA-N 429.200 4.531 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@H](CCl)C2(CCC2)C1 1914477710 OUYMBAWGAXLILJ-QMMMGPOBSA-N 427.589 4.754 50 10 IJGE Cc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@@H](CBr)C(C)C)c(F)c1 1915299973 KNFVQQGRLQBLDA-SFHVURJKSA-N 428.367 4.745 50 10 IJGE CC1(C)C[C@H](N(Cc2ccccc2)S(=O)(=O)c2ccc(CCl)cc2Cl)CO1 1915483410 ZVSQYTSENXPQMQ-KRWDZBQOSA-N 428.381 4.837 50 10 IJGE CCCN1C[C@H](Br)[C@H](c2c(Br)cccc2Br)C1 1950850556 LDYPZSGVGMLQPX-SKDRFNHKSA-N 425.990 4.784 50 10 IJGE CC1(Nc2ncc(I)cc2Br)CCC(Cl)CC1 2015763861 FLVSJAJEQKWKPR-UHFFFAOYSA-N 429.527 4.801 50 10 IJGE CC(C)N(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@@H](Br)C(F)(F)F 2044699486 LTEWFXDPNKSUIN-ZIAGYGMSSA-N 431.337 4.670 50 10 IJGE CC1CC(CBr)(NC(=O)c2c(Br)cccc2Br)C1 2045117253 XSPDQQARVOGVDA-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE C=CC[C@@H](CBr)CNC(=O)c1c(Br)cccc1Br 2082046883 MXPTUNAGWCOHMY-VIFPVBQESA-N 439.973 4.529 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CCCCN(C[C@@H](CBr)c2ccccc2)C1 2106786254 TUWJMCDYRWHBFK-IEBWSBKVSA-N 425.411 4.792 50 10 IJGE Cn1ncc(Br)c1CC(CCl)(CCl)c1ccccc1Br 2143632647 CUFRCWJRMFFITJ-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE COc1ccc(OC)c([C@H](Br)Cc2ccccc2I)c1 2143868408 OALOQBGIZVTOPP-CQSZACIVSA-N 447.110 4.987 50 10 IJGE CN(Cc1nn(C)cc1Br)c1c(CCl)ccc(Br)c1Cl 2154363750 TWVZYCSMZRIFNR-UHFFFAOYSA-N 441.982 4.974 50 10 IJGE CN(C[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(CBr)c([N+](=O)[O-])c1 2188571237 BTXGMWMXPFQUCD-SFHVURJKSA-N 432.362 4.838 50 10 IJGE CN(CC1CC(Br)C1)C(=O)CC[C@H](CCNC(=O)OC(C)(C)C)C(C)(C)C 2196907109 NPPJXHUIIGBMFZ-AQFXKWCLSA-N 447.458 4.976 50 10 IJGE Br[C@@H]1CN(C[C@@H]2CC2(Br)Br)CC12CCCCC2 2213081643 DCXPXDISSHIQFU-WDEREUQCSA-N 430.022 4.522 50 10 IJGE BrCc1c(N2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)nc2sccn12 2226349303 GYUYQCBGNVIBJO-CALCHBBNSA-N 431.403 4.534 50 10 IJGE CCC[C@@H](Br)CCNC(=O)c1ccc(Cl)c(I)c1 2256374147 FKKMNCRAMDAOPM-SNVBAGLBSA-N 444.538 4.628 50 10 IJGE C[C@H](Br)CN(CCC(C)(C)C)c1ccc(I)cn1 2259670804 WLISSJICQQOPFS-NSHDSACASA-N 425.152 4.712 50 10 IJGE C[C@H](Br)[C@H]1CCCN1Cc1ccc(Cl)c(I)c1 2300236690 OJYYZBVFAARIMT-TVQRCGJNSA-N 428.539 4.692 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@@H]1Cc1ccc(Cl)cc1I 2302316006 QDZJQZWRVBXJBO-OPQQBVKSSA-N 429.523 4.676 50 10 IJGE O=S(=O)(N[C@@H](CCCl)COCc1ccccc1)c1ccc(Cl)c(F)c1Cl 2343789975 WXFHSKKBEZBLCD-ZDUSSCGKSA-N 440.751 4.625 50 10 IJGE C[C@@H]1CN(C(=O)c2ccc(Cl)cc2I)CC[C@@H]1CCCl 2365582992 XUPKLPHLAGLYFG-MNOVXSKESA-N 426.125 4.672 50 10 IJGE CCOc1ccc(NC(=O)CCC(=O)N/N=C/c2cccc(OCc3ccccc3)c2)cc1 12579190 JYWBWZZUWIZHJA-OVVQPSECSA-N 445.519 4.533 50 10 IJGE CC[C@@H](C)c1ccc(OCC(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)cc1 13983233 VYNLHQLVGIYZJI-KGLIPLIRSA-N 439.339 4.501 50 10 IJGE CCCCOc1cccc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)c1 14041640 VUCTUIWEUVGPQO-UHFFFAOYSA-N 439.339 4.793 50 10 IJGE COc1cc(OC)c([C@@H]2C(C#N)=C(N)C(C#N)(C#N)C3=CC[C@H](C(C)(C)C)C[C@H]32)cc1OC 35168894 XPUFJDNCDUJFAM-NXHTTZLHSA-N 446.551 4.578 50 10 IJGE Cc1c(C(=O)Nc2cccc3cccnc23)oc2c1/C(=N/NC(=O)c1ccccc1)CCC2 40804348 ZYJDNMCNPFYZPQ-VUTHCHCSSA-N 438.487 4.859 50 10 IJGE CO[C@@H]1CCC[C@H](O[C@@H](CI)c2ccccc2Br)C1 162372957 SMCBBEKNHLOQGJ-XUJVJEKNSA-N 439.131 4.899 50 10 IJGE C[Si](C)(C)O[C@@H]1[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)OC[C@H]1O[Si](C)(C)C 195803883 KEOUSSOURMHEKN-LTIDMASMSA-N 438.862 4.855 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2CCSC(F)(F)F 231964085 DYGUBYCIUAKIMC-UHFFFAOYSA-N 438.615 4.772 50 10 IJGE CC(C)(CBr)CCNC(=O)c1ccc(Br)cc1Br 395111364 AMUSDUQTEKJNEK-UHFFFAOYSA-N 441.989 4.753 50 10 IJGE CN(Cc1cc(Cl)ccc1I)[C@@H]1CCC[C@@H]1Br 709295046 BMXSNFKIMQDHLG-WCQYABFASA-N 428.539 4.692 50 10 IJGE CCCN(Cc1ccc(F)cc1)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 745843508 FOBWHWYMRDHXMV-JWGURIENSA-N 441.510 4.949 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N[C@H]2CC23CCCCC3)c(-c2ccc(Cl)cc2)n1 770822549 BWMGRHGEIQHVML-DOIQENQNSA-N 433.943 4.863 50 10 IJGE N#Cc1ccc(NNC(=O)C(=O)Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)cc1 773692281 CCZYRBMHRGIELK-UHFFFAOYSA-N 425.275 4.614 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)c(C(F)(F)F)c1 799387188 CEWCJFJMHAWXON-UHFFFAOYSA-N 445.445 4.742 50 10 IJGE C[C@@H](NC(=O)NNc1ccc(C#N)cc1C(F)(F)F)c1nc2ccccc2n1C(F)F 799531032 PBLPYAOIKDTSIZ-SNVBAGLBSA-N 438.360 4.709 50 10 IJGE Cc1[nH]nc(O)c1NC(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1141578058 DKYAMWLGQPGOGQ-VGOFMYFVSA-N 430.295 4.684 50 10 IJGE C=CCn1ncc2ccc(NC(=O)NNC(=O)c3ccc(OCCCCCC)cc3)cc21 1220204424 MOWXOYNXVPHHGH-UHFFFAOYSA-N 435.528 4.648 50 10 IJGE C/C(=C\c1ccccc1Cl)C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1 1349416078 AMOAIYVXGSNOAL-JQIJEIRASA-N 438.886 4.923 50 10 IJGE C=C(C)COCCNC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1457814367 WNQWLDFQKYTBOM-ODLFYWEKSA-N 431.458 4.729 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2cc3ccccc3nc2O)c(C)n1-c1ccc(F)cc1 1463478499 YBTZWHSVYWRQKK-DEDYPNTBSA-N 440.478 4.710 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)[C@H](C)Oc3cccc(C)c3C)cc2)cc1 1628346765 ACFLECWWQJRUKO-IBGZPJMESA-N 446.503 4.527 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1cc(C)ccc1O)C(C#N)=C(N)O2 1865686985 GTEHAHGHBQJUIG-OAQYLSRUSA-N 434.927 4.770 50 10 IJGE COc1cc(-c2csc(/C(C#N)=C(\O)[C@@H]3CC(=O)N(C(C)C)C3)n2)c(OC)cc1Cl 1872754882 NFDKCPRUUKYDFO-KMCFQHSYSA-N 447.944 4.530 50 10 IJGE CN(CC1CC(Br)C1)C(=O)CC1(N(C)C(=O)OC(C)(C)C)CCCCC1 1887830277 VNEJQFMHAAXHKU-UHFFFAOYSA-N 431.415 4.578 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1cc(Br)ccc1O 1915079542 CXDLTNNAJUQQQI-AWEZNQCLSA-N 441.163 4.971 50 10 IJGE O=C(Cl)Nc1cc(Br)c(I)c(Br)c1 1931649779 HPBCPROYYFSWIK-UHFFFAOYSA-N 439.272 4.587 50 10 IJGE C[C@@H]1CCN(Cc2cccc(Br)c2Br)[C@H]1CBr 1943882392 VQKKCWFYRIBITM-SKDRFNHKSA-N 425.990 4.817 50 10 IJGE C[C@@H]1[C@@H](CBr)CCN1C(=O)c1csc(Br)c1Br 1945189476 RBIAUFVFQHAGTK-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE C[C@@H]1CCN(Cc2c(Br)cccc2Br)C[C@H]1Br 1945333881 WEOZQKCKLPMBID-NOZJJQNGSA-N 425.990 4.817 50 10 IJGE CN[C@@H](c1cc(Br)c(C)cc1Br)C1CC(Br)C1 2020154347 SEZKDDQZNHUKCM-KJHLLKJSSA-N 425.990 4.954 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)c1cc(Br)c(Br)s1 2020193833 ICUKKXPKBVJZTG-KNVOCYPGSA-N 446.002 4.519 50 10 IJGE COC[C@@H](C)OC[C@H](Br)Cc1c(Br)cccc1Br 2038123955 NNGANZYNVDRZNS-NXEZZACHSA-N 444.989 4.569 50 10 IJGE CC(C)N1C[C@@H](Br)[C@H](Cc2cccc(Br)c2Br)C1 2039262940 RXTVJTRSWVBFKR-DGCLKSJQSA-N 440.017 4.858 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2C[C@H](Br)C[C@H]2C1 2065397932 VBLNJWCEANEPHM-URLYPYJESA-N 438.001 4.817 50 10 IJGE O=S(=O)(C[C@@H](Br)c1cccc(OCc2ccccc2)c1)N1CCCCC1 2089398448 RASDRFBNMBQHNE-HXUWFJFHSA-N 438.387 4.517 50 10 IJGE CS(=O)(=O)c1csc([C@H](Cl)c2ccc(I)c(Cl)c2)c1 2093077182 PHLNNOFZJBNQRE-GFCCVEGCSA-N 447.146 4.738 50 10 IJGE CC(C)[C@@H](CBr)CN1CC[C@@](NC(=O)OC(C)(C)C)(c2ccccc2)C1 2106780834 BWIQFJRDDBQJIM-UWJYYQICSA-N 425.411 4.779 50 10 IJGE O=C(c1ccc(Br)cc1Cl)N1CC[C@H](Br)C(F)(F)CC1 2150019675 UKUWSOQKLJBVCK-NSHDSACASA-N 431.502 4.737 50 10 IJGE C[C@]1(C(F)F)CN(c2c(CBr)ccc(Br)c2Cl)CCO1 2154373761 PQCRTZXIFXFWIC-CYBMUJFWSA-N 433.518 4.858 50 10 IJGE CC[C@H](Br)[C@@H]1CCCCN1S(=O)(=O)c1cc(C)c(Br)s1 2170612129 GSHWBNCSKFGWHI-QWRGUYRKSA-N 445.242 4.536 50 10 IJGE CC(C)(CNC(=O)OC(C)(C)C)CC1CN(C(=O)c2ccc(CBr)cc2)C1 2199518883 FIIVBDWTTBPRQF-UHFFFAOYSA-N 439.394 4.595 50 10 IJGE CC1(C)C[C@@](C)(CCl)CN1C(=O)c1ccc(I)c(Cl)c1 2199541908 UPCRTIZVOZXRIT-HNNXBMFYSA-N 426.125 4.814 50 10 IJGE F[C@@H]1C[C@H](Br)CN(Cc2ccc(Br)cc2Br)C1 2213901141 PRGXSFMUPFEPRX-WDEREUQCSA-N 429.953 4.519 50 10 IJGE FC1(F)[C@@H]2[C@@H](O[C@@H](CI)c3cccc(Br)c3)CC[C@H]21 2230328892 SYDVBOGKIHDCOG-VOAKCMCISA-N 443.069 4.986 50 10 IJGE C[C@](CI)(O[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1F 2250381576 PNDLOEOIRGLOPF-YLJYHZDGSA-N 439.312 4.767 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CC[C@@H](OC)C2)cc1I 2257356064 RDQTWSOMVPSYSR-DRCTWCGVSA-N 425.104 4.551 50 10 IJGE CC(C)(C)OC(=O)NCC(C)(C)C1CCN(CC2(CBr)CC(F)C2)CC1 2265639508 SSNWUASEWXVIFA-UHFFFAOYSA-N 435.422 4.763 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC2(CC2)C[C@H]1CBr 2282968012 SSHQJOXUSOIBMS-QMMMGPOBSA-N 425.523 4.631 50 10 IJGE ClCC[C@H]1CCN(Cc2ccc(I)c(Br)c2)C1 2306228740 UJRLVFLFBUQPGM-JTQLQIEISA-N 428.539 4.505 50 10 IJGE ClCCCC1CN(Cc2ccc(I)c(Br)c2)C1 2306232696 XWTBXTZPGJBZKJ-UHFFFAOYSA-N 428.539 4.505 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H]2C[C@H](C[C@H]2Br)C1 2327390045 OSNPGNKWHMPOQB-GBIKHYSHSA-N 440.550 4.550 50 10 IJGE CN(Cc1ccccc1)[C@@H]1CCN(c2nc(C(F)(F)F)ccc2CBr)C1 2343785687 PFTLIIYROJQLOT-MRXNPFEDSA-N 428.296 4.706 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCN(C[C@]3(CBr)CC3(F)F)CC2)CC1 2351887166 KOGACDDXFZPDDX-GOSISDBHSA-N 437.369 4.520 50 10 IJGE O=C(NCC1CCC(CCl)CC1)c1ccc(Cl)cc1I 2365593100 RYNHCKDFAUTRBF-UHFFFAOYSA-N 426.125 4.720 50 10 IJGE COc1cc(/C=C(/C#N)c2ccccc2OC)ccc1OC(=O)c1ccc2c(c1)OCO2 31901969 NEYFKKZYIXSPKM-WQRHYEAKSA-N 429.428 4.716 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCc2ccco2)ccc1OCCOc1ccc(C)cc1C 34828030 KXSCVLLUHWOPLC-STZFKDTASA-N 446.503 4.586 50 10 IJGE O=C(N/N=C\c1c(Cl)ccc(Cl)c1Cl)c1cccn(Cc2ccccc2)c1=O 169919788 WFVSSGOZWROMGG-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE ClCc1c(Br)cccc1N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21 404212714 XHRUVROZCUHHIJ-LEWJYISDSA-N 435.793 4.668 50 10 IJGE C[C@H]1[C@@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1cc(Br)sc1Br 686186477 QXTWWMNNCNRVLN-WPYKOPORSA-N 427.589 4.894 50 10 IJGE CCn1cc([C@@H](Br)c2ccc(Br)s2)nc1Br 698483390 VHAYVRKPZMKIMY-SECBINFHSA-N 428.975 4.974 50 10 IJGE Cc1ccc(C(=O)Oc2cccc(/C=C(/C#N)C(=O)Nc3cccc([N+](=O)[O-])c3)c2)cc1 1083996616 VCSIATANMIPUJO-UNOMPAQXSA-N 427.416 4.668 50 10 IJGE COc1ccccc1-c1ccc(C(=O)N2CC[C@@H](O[Si](C)(C)C(C)(C)C)C2)c(O)n1 1149156491 PKVDXJIXCKACMX-MRXNPFEDSA-N 428.605 4.699 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 1557584353 GTTMUHLWPDKMHL-UHFFFAOYSA-N 433.449 4.750 50 10 IJGE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=S)Nc1cccc(Cl)c1 1587210768 MERAPZLDKDMDAP-LUAWRHEFSA-N 429.851 4.660 50 10 IJGE C#CCN(C(=O)/C(C#N)=C\c1cc(C)n([C@H](C)COC)c1C)[C@@H]1CCCc2ccccc21 1617567225 UWWLKOKVOJYIBW-JLQMUEJASA-N 429.564 4.759 50 10 IJGE Cc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc([N+](=O)[O-])cc1)CCC2 1772744533 FGJIGRVUPKHFAC-UHFFFAOYSA-N 446.463 4.527 50 10 IJGE N#CSc1ccc(NC(=O)c2cccc(NC(=O)COc3ccc(Cl)cc3)n2)cc1 1860554248 NMEBWCBHJSOBRB-UHFFFAOYSA-N 438.896 4.578 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1c(F)ccc([N+](=O)[O-])c1F 1915766061 UHDYVGCLHJBPSL-UHFFFAOYSA-N 427.245 4.689 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)C(=O)c1ccc(Cl)cc1Br 1916354986 OJXBLBMHKOFITA-HNNXBMFYSA-N 431.157 4.999 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1Cc1c(Br)cccc1Br 1945321269 GABOGEPGENWRBE-ZJUUUORDSA-N 425.990 4.959 50 10 IJGE CCn1cc(Br)c(CN(Cc2ccccc2)[C@H](CBr)C2CC2)n1 1985197545 FDFZHSGVYLKDLF-GOSISDBHSA-N 441.211 4.841 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCC[C@@H](CI)O2)C12CCCCC2 1989552951 QLGIUJYKPDFTHU-KBXCAEBGSA-N 435.346 4.683 50 10 IJGE BrC[C@H](CC1CC1)NCc1cc(Br)ccc1Br 2006499277 IWQPBHDATBNKHY-LBPRGKRZSA-N 425.990 4.865 50 10 IJGE CCC[C@@H](Br)CCNC(=O)c1ccc(I)c(Cl)c1 2029921552 GLBFLBOWJAASOA-SNVBAGLBSA-N 444.538 4.628 50 10 IJGE C[C@@H]1CCCN(C[C@H](Br)C(F)(F)F)[C@H]1CCCNC(=O)OC(C)(C)C 2044704976 HXTCPTGLCSJPJA-RDBSUJKOSA-N 431.337 4.718 50 10 IJGE ClC[C@H]1CCC[C@@H](CNc2ncc(I)cc2Br)C1 2069526479 WJNPWYNOZZPUMF-VHSXEESVSA-N 443.554 4.906 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@@H]2C[C@H](Cl)CC[C@H]21 2087666439 CBMSRTQSYNZESJ-NQMVMOMDSA-N 427.589 4.895 50 10 IJGE CCN(C(=O)OC(C)(C)C)C1CCN(C[C@H](CBr)c2ccccc2)CC1 2106786608 VKSOISURTWWUFV-SFHVURJKSA-N 425.411 4.887 50 10 IJGE Clc1ccc(CBr)c(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)c1 2129053633 NSBLYIFLBWEXJK-SFTDATJTSA-N 435.793 4.715 50 10 IJGE Cc1cc(Br)c(C)c([C@H](Cl)[C@@H]2CCCS2(=O)=O)c1Br 2136380484 UYNUFLLEUCPUAT-GXFFZTMASA-N 430.589 4.686 50 10 IJGE CC(C)(C)OC(=O)N1Cc2ccccc2CN1C(=O)c1ccc(CBr)cc1 2163054573 YJVZAYHPUJIOAN-UHFFFAOYSA-N 431.330 4.890 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@@]2(C1)CN(C(=O)OC(C)(C)C)CCO2 2163063280 PJWZHSLKCOMVFV-OAQYLSRUSA-N 447.458 4.680 50 10 IJGE CC(C)N(C[C@H]1CCCN(C(=O)[C@@H](Br)C2CCCC2)C1)C(=O)OC(C)(C)C 2167033382 QYFPZRUSXJTZDU-WMZOPIPTSA-N 445.442 4.824 50 10 IJGE O=C(c1cccc(Br)c1Cl)N1CC[C@@H](C(F)(F)CBr)C1 2197764643 VIXYCAQWPIMCBC-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE CC(C)(CCl)N(Cc1ccccc1)S(=O)(=O)Cc1ccsc1Br 2210632864 LLKCZIRUSWPJNT-UHFFFAOYSA-N 436.824 4.860 50 10 IJGE Cc1sc(C(=O)NC2(CCBr)CCSCC2)cc1Br 2226077972 KKSONNOMAGCAQU-UHFFFAOYSA-N 427.227 4.600 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2Cc1csnc1Br 2232924010 RQMWTXTURMZHBZ-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)[C@H]2CCCS(=O)(=O)C2)c(C)c1Br 2235609004 AOOPMDRXYLWHGU-HZMBPMFUSA-N 444.616 4.933 50 10 IJGE Cc1nscc1C[C@H](Br)c1c(F)cccc1I 2247948555 BPNDNFAMCRUZLT-VIFPVBQESA-N 426.092 4.874 50 10 IJGE CO[C@@H]1C[C@]2([C@H](Br)Cc3cc(Br)cc(Br)c3)C[C@H]12 2263525609 NZUWAWAFMZHAHD-AAVRWANBSA-N 438.985 4.943 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN(CC2(CBr)CC(F)C2)C1 2265638372 LXIOIPKYZBOOPH-RPTYLJJZSA-N 433.406 4.611 50 10 IJGE O=C(Nc1cc(F)ccc1I)c1ccc(CBr)cc1 2271720560 QMKZPQSUBJWXIL-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE Cc1nn(-c2ccccc2)c(O[C@@H]2CCN(Cc3ccccc3)C2)c1CBr 2287652169 DWJNJYNVFCVWNX-HXUWFJFHSA-N 426.358 4.729 50 10 IJGE Cc1cc(C(=O)COC(=O)C(C#N)=Cc2ccc(N(C)C)cc2)c(C)n1Cc1cccs1 2297487540 BMCWXLFBPMCYPE-UHFFFAOYSA-N 447.560 4.614 50 10 IJGE CC[C@H](C)N(CCBr)Cc1ccc(Cl)c(I)c1 2300237541 AGUNFKWKOKZWPM-JTQLQIEISA-N 430.555 4.940 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1Cc1ccc(Cl)c(I)c1 2300239139 UNVUTUTXRDVMOE-ONGXEEELSA-N 428.539 4.692 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3CC[C@H](Br)[C@H]3C2)c1 2309796511 ZMRNBMFDAFSOSV-LQJRIPTKSA-N 438.001 4.817 50 10 IJGE COC(=O)C(C#N)=Cc1cccc(OC(=O)CCCOc2cc(C)c(Cl)c(C)c2)c1 2314760356 MONLTTHMBOXPGJ-UHFFFAOYSA-N 427.884 4.801 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@H](C3)[C@H]2CBr)c(I)c1 2318523747 GWQQHBFQYLNNQP-LJWDBELGSA-N 440.550 4.692 50 10 IJGE CCOc1cccc(C=NNC(=O)c2ccc3nc(-c4ccccc4Cl)[nH]c3c2)c1O 2323744401 ZVPKWTGXIJKFQB-UHFFFAOYSA-N 434.883 4.752 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2cc(I)ccc2Cl)C[C@H]1CCl 2380516984 IYIOLAHOXYXDEP-MWLCHTKSSA-N 438.058 4.794 50 10 IJGE C/C(=N/NC(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1)c1cc(O)ccc1O 20115304 YKIANUZNKSRLHY-NTFVMDSBSA-N 445.519 4.802 50 10 IJGE Cc1sc2nc(C3CC3)nc(N3CCN(C(=O)[C@H](Cl)c4ccccc4)CC3)c2c1C 35866670 AQDRSWVXQSQKPV-LJQANCHMSA-N 441.000 4.814 50 10 IJGE C=CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)cc1 38652776 DZMFSMKOVYBETQ-XMMPIXPASA-N 442.446 4.828 50 10 IJGE Cc1nn(-c2ccccc2)c(Cl)c1/C=N/NC(=O)CSCc1ccc(Cl)cc1 59382031 KYFNQDUFHZQSMU-FOKLQQMPSA-N 433.364 4.871 50 10 IJGE O=C(NN=Cc1ccc(Sc2nc3ccccc3[nH]2)o1)c1cc2ccccc2cc1O 252604486 GAMJTNYFMHSKEV-UHFFFAOYSA-N 428.473 4.930 50 10 IJGE COc1cc(OC)c(OC)cc1C=NNC(=O)c1cc(-c2ccccc2)nc2ccccc12 254746513 CYTFJLRDXNDRHT-UHFFFAOYSA-N 441.487 4.692 50 10 IJGE C[C@H]1CCN(Cc2cc(Cl)ccc2I)C[C@H]1CBr 700418763 NLUJKPKURYOOAX-CMPLNLGQSA-N 442.566 4.798 50 10 IJGE C/C(=C/C(=O)NNC(=S)Nc1ccc(OC(C)C)cc1)c1ccccc1C(F)(F)F 743820538 MTXSAPMRKCPZQE-OWBHPGMISA-N 437.487 4.914 50 10 IJGE CCOc1ccc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N[C@@H](C)c2cc3ccccc3o2)cc1 744569333 AEUJMKWDDRBQPL-FQNYJXRJSA-N 432.476 4.548 50 10 IJGE Cc1cc(F)ccc1NNC(=O)c1cccnc1Oc1ccc(F)cc1Br 748561166 CJDNVHPUPJSFAZ-UHFFFAOYSA-N 434.240 4.980 50 10 IJGE O=C(NCc1cccc(N2CCOCC2)n1)Nc1ccc(S(F)(F)(F)(F)F)cc1 752982039 LFMUBXSDNGKRPJ-UHFFFAOYSA-N 438.422 4.897 50 10 IJGE CCCc1c(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cnn1-c1cccc(C)c1 799754060 CKXVOYZHINOPRE-UHFFFAOYSA-N 427.430 4.781 50 10 IJGE O=C(CC[C@@H](O)c1ccccc1)NN=Cc1cn(Cc2ccccc2F)c2ccccc12 1084354935 SMSUJBIEKMEMQS-RUZDIDTESA-N 429.495 4.793 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C)[C@@H]1CCCO1 1435967825 WSWAIRCFZDPXID-ZXEMQFLKSA-N 442.346 4.605 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCN(C[C@@H](CBr)C3CC3)C2)C1 1643212855 MIANQKOMPQWMHG-GBESFXJTSA-N 429.443 4.767 50 10 IJGE C=Cc1ccc(CCNC(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)cc1 1672973748 LNRGPJISTHANRQ-UHFFFAOYSA-N 449.938 4.749 50 10 IJGE CCOc1ccc(N2C(=O)[C@H](CC)S/C2=C(\C#N)C(=O)N[C@H](C)c2ccccc2)cc1 1772742953 YICHTOFEFGIBLM-OVCUOPESSA-N 435.549 4.556 50 10 IJGE Cc1c(C(=O)Nc2cccc3ccccc23)oc2c1C(=NNC(=O)c1cccnc1)CCC2 1772746565 WOSIPGFZMREYFF-UHFFFAOYSA-N 438.487 4.859 50 10 IJGE O=C(CSc1nc2ccccc2s1)NN=C(c1ccccc1)[C@H](O)c1ccccc1 1772760547 COGXMSGESSQJQK-JOCHJYFZSA-N 433.558 4.643 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3CC)cc1OCC 1865691099 JDDNPAQPXWOSTQ-QFIPXVFZSA-N 444.535 4.976 50 10 IJGE COc1cccc(-c2ccc(C(=O)NNC(=O)CCCc3ccc(Cl)cc3)c(C)n2)c1 1865758525 FAETXRCKOCPPGD-UHFFFAOYSA-N 437.927 4.503 50 10 IJGE C[C@H](CBr)CCCNC(=O)c1csc(Br)c1Br 1945189748 YXWTZGUPGZHJBS-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE C[C@@H]1C[C@H](Br)CN(Cc2c(Br)cccc2Br)C1 1945323941 UWFCMHQKWQWSOT-ZJUUUORDSA-N 425.990 4.817 50 10 IJGE ClC[C@@H]1CCCC[C@H]1Nc1ncc(I)cc1Br 2015756817 LDUDJUXEPOTEPJ-GZMMTYOYSA-N 429.527 4.658 50 10 IJGE CN(CC1CC(Br)C1)c1ccc(CBr)cc1Br 2020226084 BPUNCPWUTQCNGY-UHFFFAOYSA-N 425.990 4.954 50 10 IJGE CC(C)Cc1ccc([C@@H](Br)c2cnn(C)c2I)s1 2027127344 FGUPOORXLBXMMX-LBPRGKRZSA-N 439.160 4.769 50 10 IJGE Brc1ccc(CN2C[C@H]3C[C@H](Br)C[C@H]2C3)c(Br)c1 2031403627 RWDKWQCFEIZYMO-TVYUQYBPSA-N 438.001 4.959 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc([S@@](C)(=O)=NC[C@H](CBr)C2CC2)c1 2044693319 JXCRYNNXZYSUHF-HWRSSNJWSA-N 431.396 4.911 50 10 IJGE C[C@@]12CN(Cc3cc(Cl)ccc3I)C[C@@]1(CBr)C2 2046801302 GPOQZZYHUMDTJE-KGLIPLIRSA-N 440.550 4.552 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CCCC[C@H](Br)C1 2050104617 NXDACEXGKNRVPE-VIFPVBQESA-N 439.973 4.601 50 10 IJGE FC(F)c1c(Br)ccc(CBr)c1I 2054782062 UONVRNPUJAWOEF-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE Brc1cccc(CN2C[C@H]3C[C@H](Br)C[C@H]3C2)c1Br 2065397098 LVSSHZLPHHUTSC-GDNZZTSVSA-N 438.001 4.817 50 10 IJGE O=[N+]([O-])c1c(CBr)nn(-c2cccc(C(F)(F)F)c2F)c1C(F)(F)F 2079143956 QLWCRTARRKCPAX-UHFFFAOYSA-N 436.081 4.852 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@H](CBr)C(F)(F)C1 2115929383 KJXRKTONBFDVBY-ZCFIWIBFSA-N 437.531 4.656 50 10 IJGE CCCN(C1CCN(Cc2ccccc2)CC1)S(=O)(=O)c1cc(CCl)cs1 2143613059 DCCGVOWZSOGSRA-UHFFFAOYSA-N 427.035 4.552 50 10 IJGE O=C(N[C@H]1CN(Cc2ccccc2)C2(CCCCC2)C1)N1CCC(Br)CC1 2162076377 VQMABBXYGLRYHU-HXUWFJFHSA-N 434.422 4.533 50 10 IJGE CCC1(CNC(=O)c2ccc(CBr)cc2)CCN(C(=O)OC(C)(C)C)CC1 2162493848 AXZLCQDYUOMRIY-UHFFFAOYSA-N 439.394 4.739 50 10 IJGE CC1CCC(N(C)S(=O)(=O)c2cc(CBr)sc2Br)CC1 2179790181 AGGVHJAKPHGOLW-UHFFFAOYSA-N 445.242 4.605 50 10 IJGE COc1cc2c(cc1Br)nc(CCCl)n2CC1CN(Cc2ccccc2)C1 2202309544 QBCKLGOAJKQXDU-UHFFFAOYSA-N 448.792 4.721 50 10 IJGE COC[C@]12C[C@]([C@@H](Cl)c3cc(Br)c(Br)cc3F)(CO1)C2 2233969683 LQLVFHYRRJVOIF-IHRRRGAJSA-N 428.523 4.826 50 10 IJGE Br[C@@H]1C[C@@H]2CCCC[C@H]2N(C[C@H]2CC2(Br)Br)C1 2246599616 UNVDVMBKXZOGML-IRCOFANPSA-N 430.022 4.520 50 10 IJGE COCC1([C@@H](Br)c2ccc(OC)c(I)c2)CCC1 2257369687 OHLDCYAOUOEVSS-ZDUSSCGKSA-N 425.104 4.553 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)c1csc(NC(=O)[C@H](Br)C2CCCC2)n1 2267697476 JQYVTGSASOVAKG-CYBMUJFWSA-N 446.411 4.795 50 10 IJGE Clc1ccc(C[C@H]2CCOCC[C@@H]2Br)cc1I 2300265705 OLIFYQGSMVZBLJ-MNOVXSKESA-N 429.523 4.677 50 10 IJGE CC(C)c1ccc(NC(=O)C(C#N)=Cc2ccccc2OCC(=O)Nc2nccs2)cc1 2314488614 LOSFHFGCZQZQFV-UHFFFAOYSA-N 446.532 4.830 50 10 IJGE Cc1cccc(N2CCN(C=C(C#N)C(=O)N[C@@H](C)c3ccc4c(c3)CCCC4)CC2)c1C 2318463185 YDADSGKPXAQJKV-QFIPXVFZSA-N 442.607 4.589 50 10 IJGE O=C(CSc1nc(O)c2c(-c3ccccc3)csc2n1)NN=CC=Cc1ccccc1 2320486435 MWLOUOHQZDTZSI-UHFFFAOYSA-N 446.557 4.971 50 10 IJGE COc1ccc(-c2ccc(C(=O)NN=Cc3ccc(F)c(Br)c3)c(C)n2)cc1 2321218626 WMYLJAJFGNZLQG-UHFFFAOYSA-N 442.288 4.731 50 10 IJGE COc1cc(C=NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCc1cccc(Cl)c1 2322974995 MHMSOZXLLSYWJK-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3C2(C)C)C1 2345004477 KZJWUKIOEWEUOM-HOTGVXAUSA-N 429.443 4.765 50 10 IJGE CC(C)COc1ccc(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1Br 14653072 ICWNUBBNHBNEHH-UHFFFAOYSA-N 447.373 4.856 50 10 IJGE CCOC(=O)c1c(NC(=O)CCl)sc(C(=O)Nc2cc(Cl)ccc2Cl)c1C 20882435 OSNQYFYIUKOYST-UHFFFAOYSA-N 449.743 4.970 50 10 IJGE CCCN(Cc1cc(NC(=O)CCCCl)ccc1N(C)C)C(=O)c1ccc(F)cc1 34921608 IWXTYBRXYKSBKI-UHFFFAOYSA-N 433.955 4.902 50 10 IJGE COC(=O)/C(C#N)=C\c1ccc(OC(=O)/C(=C\c2ccccc2)c2ccccc2)c(OC)c1 35238346 FLHSZFGKYFGNLJ-OZKZUFLSSA-N 439.467 4.921 50 10 IJGE CCOc1cccc(-c2nn(-c3ccccc3)cc2/C=C(/C#N)C(=O)N2CCCCC2)c1 35446452 KODRSIBAFPGMSH-PGMHBOJBSA-N 426.520 4.857 50 10 IJGE COc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4ccccc4C)c(C)c32)cc1 40813864 BCLQGASJXHYQSS-NHFJDJAPSA-N 431.492 4.628 50 10 IJGE Cc1c(Cl)cccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccncc1)CCC2 40813969 BQHYBWVIIAJCBP-OVVQPSECSA-N 436.899 4.668 50 10 IJGE O=C(CC[C@H](O)c1ccccc1)N/N=C\c1ccc(-c2cccc(Br)c2)o1 58891161 UVCHVUGFLVLCOL-CSMVZQPBSA-N 427.298 4.673 50 10 IJGE CCOc1ccc(NC(=O)/C(C#N)=C/c2cc(OC)c(OCC)cc2Br)cc1 59224893 FFTLICKRXZFJQP-XNTDXEJSSA-N 445.313 4.801 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)Nc3cccc([N+](=O)[O-])c3)o2)cc1 207161546 FDCRBJVDRIBIMF-ATVHPVEESA-N 431.404 4.577 50 10 IJGE Cc1cccc(N2CCN(/C=C(/C#N)C(=O)N[C@H](C)c3ccc4c(c3)CCCC4)CC2)c1C 217203919 YDADSGKPXAQJKV-NILAOQAMSA-N 442.607 4.589 50 10 IJGE CC(C)C[C@H](CBr)NC(=O)c1ccc(Br)cc1Br 232626730 HSDXRNJLFXBWQD-SNVBAGLBSA-N 441.989 4.751 50 10 IJGE CCN(C[C@](C)(CBr)OC[C@@H]1C[C@H]2CCCC[C@H]2O1)C(=O)OC(C)(C)C 380803945 LCFWSTZHXZUGIB-YZLZLFLDSA-N 434.415 4.761 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@H]2C[C@H]2c2ccc(Cl)cc2Cl)c1C 736694127 OWLAAPYBKGEDKJ-IRXDYDNUSA-N 428.323 4.709 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N2CCc3n[nH]cc3C2)c(C)n1-c1cc(Cl)ccc1Cl 743901315 GBBTTYLGFUUOMT-PXNMLYILSA-N 440.334 4.616 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)CSc1nnc(-c2ccccc2C)n1CC 746181356 XWHCWCSBLAVUAM-UHFFFAOYSA-N 438.509 4.608 50 10 IJGE CC(=NNC(=O)c1ccc(CSc2nc(C)cc(C)n2)cc1)c1ccc(C#N)cc1F 781117282 OZLPTRRZPSURFP-UHFFFAOYSA-N 433.512 4.551 50 10 IJGE CCOc1cc(C=NNC(=O)COc2ccccc2)ccc1OCc1ccccc1Cl 1084120408 OBIDTBLRNYUDJV-UHFFFAOYSA-N 438.911 4.847 50 10 IJGE O=C(NN=Cc1ccc(-c2ccc(Cl)c(Cl)c2)o1)C(=O)Nc1ccc(Cl)cc1 1084328534 SQVXRVFSGYYHDR-UHFFFAOYSA-N 436.682 4.996 50 10 IJGE CC(=O)N(Cc1ccc(NC(=O)NNc2nc3ccc(Cl)cc3s2)cc1)C1CC1 1465679636 ZDYNTCOLQOUFBX-UHFFFAOYSA-N 429.933 4.609 50 10 IJGE CC(=O)CCc1ccc(OCc2cccc(C(=O)NNc3cc(F)cc(F)c3F)c2)cc1 1583331501 LVYYEIPHPLUJRD-UHFFFAOYSA-N 442.437 4.961 50 10 IJGE CCCCCc1ccc(C(=O)C(I)I)cc1 1615950878 ZKMBYCHSOWPFSW-UHFFFAOYSA-N 442.078 4.798 50 10 IJGE Cc1cc(Nc2ccc3c(c2)CCCC3)c(C(=O)NNc2cc(F)c(F)cc2F)c(O)n1 1631864706 CCRBOCTYXHCWPO-UHFFFAOYSA-N 442.441 4.892 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)c1C 1648570731 ZEMXSBLGZRNYTD-RDJZCZTQSA-N 425.895 4.585 50 10 IJGE N#C/C(=C(/O)CCc1nc2ccccc2[nH]c1=O)c1nc(-c2c[nH]c3ccccc23)cs1 1872753040 FIOUBTULQOPGGT-JCMHNJIXSA-N 439.500 4.953 50 10 IJGE O=C(N[C@@H](CCl)[C@H]1CC=CCC1)c1csc(Br)c1Br 1885065447 UDRAHLSLBHXJMV-WPRPVWTQSA-N 427.589 4.967 50 10 IJGE N[C@H](c1c(Cl)cc(Br)c(F)c1Br)[C@H]1C[C@@H]1Br 1900373197 TVLUXIIFELNDMY-UKGLUQRTSA-N 436.344 4.787 50 10 IJGE CN(N[C@H]1[C@H](CNC(=O)OC(C)(C)C)CCCC12CCC2)C(=O)OCc1ccccc1 1924832728 SRFXOQHXWYPTPP-PMACEKPBSA-N 431.577 4.623 50 10 IJGE Fc1cc(Br)c2nc(CCCl)n(-c3csnc3Br)c2c1 1926869689 NHTNNOOHQILVII-UHFFFAOYSA-N 439.535 4.927 50 10 IJGE C[C@H](CBr)CCCNC(=O)c1cccc(Br)c1Br 2031487432 UKLWKWVOBIBYBQ-VIFPVBQESA-N 441.989 4.753 50 10 IJGE C[C@@H](Cl)CC(=O)N(CCCNC(=O)OC(C)(C)C)c1cccc(Br)c1 2054473794 FTBVKBUIBXPRLY-CYBMUJFWSA-N 433.774 4.714 50 10 IJGE CCC[C@@H](Cl)c1cn(-c2cc(Br)ccc2I)nn1 2057419857 CTFYRJSTKQKXGJ-SECBINFHSA-N 440.510 4.714 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(C[C@@H](CBr)c2ccccc2)CC1(C)C 2106788167 NMXSHDHQLUOMHL-MSOLQXFVSA-N 425.411 4.648 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H](N(C[C@@H](CBr)C1CC1)C1CC1)C(F)(F)F 2106788752 SFSOXFWTLVEHAI-UKRRQHHQSA-N 443.348 4.718 50 10 IJGE COc1ccc(CN[C@H](C)CCCCCI)cc1Br 2117886740 OFJLXEFUFJMLOE-GFCCVEGCSA-N 440.163 4.931 50 10 IJGE CCN(CC)[C@@H](C)CO[C@@H](CI)c1cccc(Br)c1 2119217495 HMQCRVBYPXOTPV-WFASDCNBSA-N 440.163 4.672 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2CN(CC3(CBr)CCCCC3)C[C@H]2C1 2141250584 UFRMZKVETFFMMD-RCCFBDPRSA-N 429.443 4.957 50 10 IJGE O=S(=O)(NC1(CBr)CCCCCCC1)c1cscc1Br 2143910598 MOCBUPZAMHJIMS-UHFFFAOYSA-N 445.242 4.667 50 10 IJGE O=C(c1cc(Cl)ccc1I)N1CCC[C@H](CCCl)CC1 2149732300 APYALGOSIZQSBJ-LLVKDONJSA-N 426.125 4.816 50 10 IJGE CN(C(=O)c1cc(Br)ccc1Cl)[C@@H](CCBr)C(F)(F)F 2178514215 AMWDKDIFSPZISU-JTQLQIEISA-N 437.481 4.890 50 10 IJGE C[C@@H](Br)CCCc1cn(-c2cc(Cl)c(Br)cc2F)nn1 2189279202 NSDYEODQMBMCAT-MRVPVSSYSA-N 425.527 4.928 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2ccc(CBr)cc2)[C@@H]1C(C)(C)C 2192487583 HBYSACTZZCLXHZ-DLBZAZTESA-N 439.394 4.735 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Br)c2n1C[C@@]1(Br)CC1(F)F 2202505260 LVXJIJTZFHOURB-KBUNVGBDSA-N 429.490 4.666 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1C[C@]1(Br)CC1(F)F 2202505263 LVXJIJTZFHOURB-UPONEAKYSA-N 429.490 4.666 50 10 IJGE C[C@@H]1CCCN(CCCCCI)[C@H]1CCNC(=O)OC(C)(C)C 2211184281 LEBKUBFIPXGCKI-CVEARBPZSA-N 438.394 4.607 50 10 IJGE Cc1cc(Br)c([C@@H](Br)C(C)(C)S(C)(=O)=O)c(C)c1Cl 2224317298 MEVUWRXRULFIKY-GFCCVEGCSA-N 432.605 4.979 50 10 IJGE Cc1ccc(I)c(-c2nnc(CBr)n2C(C)(C)C)c1 2232215587 IXBOBCTXEMEHHF-UHFFFAOYSA-N 434.119 4.508 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@@H]2CCCS(=O)(=O)C2)c(C)c1Cl 2232511293 PUGWKOYHRLRMSR-ZWNOBZJWSA-N 444.616 4.980 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@@H]2CC[C@@H](Br)C[C@H]2C1 2264503120 CIMVVBUVZFYWEX-XHNCKOQMSA-N 427.589 4.800 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@@H]2CCC[C@@]2(CBr)C1 2264516073 WPPQWHMUUUZYMD-ISVAXAHUSA-N 427.589 4.801 50 10 IJGE C[C@H](Br)[C@H]1CCN(Cc2ccc(Cl)cc2I)C1 2302325405 HFCPFWNLQZUTMN-UWVGGRQHSA-N 428.539 4.550 50 10 IJGE CC(C)(C)[C@H](CCl)NCc1ccc(I)c(Br)c1 2306219339 LADQNTAUIYGSLW-LBPRGKRZSA-N 430.555 4.797 50 10 IJGE Cc1nc(Br)c([C@H](Br)Cc2ccc(Br)cc2)n1C 2315580844 VOWJQCAHXOKTLK-LLVKDONJSA-N 436.973 4.932 50 10 IJGE CN(C[C@H](Br)CCc1ccc(Cl)cc1I)C1CC1 2318532112 UJUHNGFZLKIAML-LLVKDONJSA-N 442.566 4.735 50 10 IJGE Clc1ccc(CN2C[C@@H]3C[C@H](C[C@@H]3Br)C2)c(I)c1 2318558470 VLYXGVWKEGQEAS-CDMKHQONSA-N 440.550 4.550 50 10 IJGE Clc1ccc(C[C@@]2(CBr)O[C@H]3CC[C@H]2C3)cc1I 2327570037 YPHHXHFGCVOOPQ-MJVIPROJSA-N 441.534 4.820 50 10 IJGE COc1ccc(C)cc1N(C(=O)CCl)[C@H](C(=O)NC1CCCCC1)c1cccs1 3034947 AXBYSQVFKPTWSO-NRFANRHFSA-N 434.989 4.827 50 10 IJGE O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)COc1cccc2ccccc12 12488382 FBVIZAUTPRSYGS-UHFFFAOYSA-N 447.318 4.532 50 10 IJGE CC1=C(C#N)C(=O)N(C(C)C)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1ccc(C)cc1 38604277 AHFZNTJWEQDRGR-OEAKJJBVSA-N 436.515 4.848 50 10 IJGE CCN(C(=O)c1oc2c(c1C)/C(=N/NC(=O)c1cccc(OC)c1)CCC2)c1ccccc1 40822424 QLTUMFGTHYRTOV-SZXQPVLSSA-N 445.519 4.734 50 10 IJGE COc1cc(-c2ccc(NC(=O)[C@@H](C)Cl)c(OC)c2)ccc1NC(=O)[C@H](C)Cl 101260719 YIZIHDGOENRNMZ-TXEJJXNPSA-N 425.312 4.502 50 10 IJGE COc1cc(-c2ccc(NC(=O)[C@@H](C)Cl)c(OC)c2)ccc1NC(=O)[C@@H](C)Cl 101260724 YIZIHDGOENRNMZ-VXGBXAGGSA-N 425.312 4.502 50 10 IJGE CCCCOCCO[C@H](CI)c1ccc(Br)cc1 162119151 SWZOERUPLQHEFE-CQSZACIVSA-N 427.120 4.759 50 10 IJGE COCCO[C@@H]1[C@@H](Br)C[C@@H]1Oc1cc(Cl)c(Br)cc1Cl 234685551 YONWPCOBPPNMRT-AQUOVQTQSA-N 448.966 4.702 50 10 IJGE C[C@@H](Br)C[C@@H](C)NC(=O)c1cc(Br)sc1Br 235182590 ZQHXDBBIEOENCO-PHDIDXHHSA-N 433.991 4.565 50 10 IJGE ClCCCc1nnc(-c2cc(Br)ccc2I)s1 236013030 NWGNOKUSGAYHLR-UHFFFAOYSA-N 443.535 4.744 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccc(I)cc1)[C@H]2Br 261366805 VJQSDLVJNQHEIL-MAZHCROVSA-N 448.142 4.820 50 10 IJGE Nc1cccc(Cl)c1[C@H]1CN(Cc2ccccc2)C[C@@H]1CI 382715607 KBPPUJIBYCQNOH-GJZGRUSLSA-N 426.729 4.573 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)N[C@H](c1cccc(F)c1)c1cccc(Cl)c1 758860651 AUMFUSXAEJGBNS-NRFANRHFSA-N 448.885 4.761 50 10 IJGE Cc1ccccc1-n1c(C)c(Br)c(C=NNC(=O)c2ccccc2O)c1C 1084214695 XDGFXJMHUIPERM-UHFFFAOYSA-N 426.314 4.635 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)Nc2cccc(-n3ccnc3O)c2)c1C 1125333036 ICHNNMKLAUAQMQ-STZFKDTASA-N 437.503 4.840 50 10 IJGE C#CCOc1ccc(COC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 1127864609 SJMWHMSCEUOROX-PXLXIMEGSA-N 428.463 4.896 50 10 IJGE C/C(=C\c1ccncc1)C(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12 1463942475 ZFYDYSPQHRMFIC-JQIJEIRASA-N 442.906 4.815 50 10 IJGE Cc1ccc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)cc1[N+](=O)[O-] 1614689533 BHAVFUQYDCQFEI-ROUUACIJSA-N 433.302 4.650 50 10 IJGE C=CCc1cc(CNC(=O)NNc2ccc(Cl)c(C(F)(F)F)c2)cc(OC)c1OC 1677640760 AQCNEROMFVVWMG-UHFFFAOYSA-N 443.853 4.931 50 10 IJGE C=CC[C@@H]1CCCC[C@@H]1NC(=O)NNC(=O)Nc1ccc(Br)cc1Cl 1682683257 KOOXSOXCDGOBHT-RISCZKNCSA-N 429.746 4.573 50 10 IJGE O=C(CSc1nc2ccccc2[nH]1)NN=Cc1ccccc1OCc1ccc(F)cc1 1772760329 CSQHNUAPQIZQIU-UHFFFAOYSA-N 434.496 4.523 50 10 IJGE COc1ccc(C/C(O)=C(\C#N)c2nc(-c3ccc(OC)cc3OC)cs2)c(OC)c1 1872755341 ISQYXVIESILBJN-ZZEZOPTASA-N 438.505 4.880 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@@H](C(F)(F)CCl)C1 1892708425 WHRDFDGHEMNUNU-ZCFIWIBFSA-N 437.531 4.609 50 10 IJGE COc1cc(Br)ccc1C(=O)N(CCCBr)Cc1ccccc1 1914643201 KZCMMHUUNWBHOW-UHFFFAOYSA-N 441.163 4.885 50 10 IJGE C[C@@H](CCl)N(Cc1ccccc1)C(=O)c1cc(I)ccc1F 1961216088 REYAINQWCAZSIM-LBPRGKRZSA-N 431.676 4.700 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCc2cc(Br)ccc2C1 1975076813 OAKJXDVACNZIKJ-DZGCQCFKSA-N 433.184 4.842 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]([C@@]2(C)CC[C@](C)(CI)O2)CC1 1993736346 WAQQOMDDQRBYFY-LTCOOKNTSA-N 437.362 4.833 50 10 IJGE C[C@@H]1C[C@H]1N(CCBr)Cc1ccc(Br)cc1Br 2002025353 BYFCEZCBOAJTME-NOZJJQNGSA-N 425.990 4.817 50 10 IJGE O=C(N[C@H](CCBr)C1CC1)c1c(Br)cccc1Br 2033091092 MZFJTCAMUDXLSC-LLVKDONJSA-N 439.973 4.505 50 10 IJGE O=S1(=O)CCCC[C@@H]1[C@@H](Br)c1cc(Br)c(Cl)cc1F 2097835179 QNFJLAFNPLOEGB-NEPJUHHUSA-N 434.552 4.645 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2CCCN(C)Cc1ccccc1 2128512722 BEFVZTJUJRKGTM-UHFFFAOYSA-N 435.797 4.806 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N[C@H](CBr)CC(C)(C)C)c1Br 2143909567 ASBQMVWSWKIHAQ-JTQLQIEISA-N 447.258 4.605 50 10 IJGE CCN(C1CCCCC1)S(=O)(=O)c1cc(CBr)sc1Br 2179790427 DRJYVNDFNHNJMC-UHFFFAOYSA-N 445.242 4.749 50 10 IJGE O=C(c1c(Cl)cccc1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Br)C2 2190671294 RDZJFVJFFRRGEV-VXPJTOPCSA-N 425.523 4.581 50 10 IJGE COc1cc(F)c([C@@H](Cl)c2c(C)nn(C)c2Br)cc1Br 2202902835 WINQNRUEKBMDDY-GFCCVEGCSA-N 426.511 4.729 50 10 IJGE Br[C@H]1CN(C[C@@H]2CC2(Br)Br)C2(CCCCC2)C1 2217451631 ONRQBTUEBQIWAP-WDEREUQCSA-N 430.022 4.665 50 10 IJGE CC(C)(C)[C@@H]1C[C@@H](CBr)CN(C[C@@H]2CC2(Br)Br)C1 2218004266 BLQRCNMSLGRRNF-TUAOUCFPSA-N 446.065 4.872 50 10 IJGE CC(C)C1(O[C@](C)(CI)c2ccccc2Br)COC1 2272857767 NZEWIGIWPTUWQP-CQSZACIVSA-N 439.131 4.541 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCCC[C@H](CBr)C1 2282975060 MBOGGBFKOGEXJD-SECBINFHSA-N 427.539 4.879 50 10 IJGE COC(=O)c1cccc(-n2c(C)cc(C=C(C#N)c3nc4ccc(OC)cc4[nH]3)c2C)c1 2294284585 IRDSZGGZRBUZLE-UHFFFAOYSA-N 426.476 4.830 50 10 IJGE COc1ccc(-c2ccc(C(=O)NN=C(C)c3ccc(F)c(F)c3)c(C)n2)cc1OC 2321281137 QNQYNJODKBIODR-UHFFFAOYSA-N 425.435 4.506 50 10 IJGE CCCCOc1cccc(C=NNC(=O)c2ccc3nc(-c4ccccc4O)[nH]c3c2)c1 2323743509 CVTGUGADAABTEN-UHFFFAOYSA-N 428.492 4.878 50 10 IJGE CCC(CC)(CBr)CN1CC(F)(F)[C@](C)(CNC(=O)OC(C)(C)C)C1 2326658536 GFGIFWHOVZRNFC-MRXNPFEDSA-N 427.374 4.670 50 10 IJGE CC(C)N(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2326915123 OHOSGQNKJDIBFH-YOEHRIQHSA-N 425.358 4.517 50 10 IJGE CCOC(=O)c1cnn(-c2cccc(Cl)c2)c1NC(=O)C(C#N)=Cc1ccc(C)cc1 2329635285 VINPDJQGPMTSDL-UHFFFAOYSA-N 434.883 4.557 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@](C)(Br)[C@](C)(F)C2)c1 2365819766 SDUOLLNLNJQELG-UONOGXRCSA-N 429.555 4.945 50 10 IJGE CC(C)[C@H](Cl)C(C)(C)CNC(=O)c1ccc(Cl)cc1I 2366004592 FDFGLFNIYUQENZ-ZDUSSCGKSA-N 428.141 4.964 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3cccc([N+](=O)[O-])c3)ccc2[C@@H]1c1ccccc1Cl 38651110 ITNRVBQZYLSIEI-NRFANRHFSA-N 447.834 4.686 50 10 IJGE CCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccccc1F 38652287 JGHRBUCKNNAMCC-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE O=C(CSc1nnc(CNc2ccccc2)n1-c1ccccc1)NN=C1CCCCCC1 59261260 BXZWJECJCTVZHI-UHFFFAOYSA-N 448.596 4.798 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@@H]1Br)c1ccc(Br)cc1Cl 123838883 FHNLBEXOWJRGEA-DZGCQCFKSA-N 429.539 4.893 50 10 IJGE CC(=NNC(=O)COc1cc(C)ccc1C)c1cccc(NC(=O)c2ccccc2F)c1 252588406 ACBYQYSTQUHHOL-UHFFFAOYSA-N 433.483 4.614 50 10 IJGE CC(C)(C)c1ccc(OCCCOc2cccc(C=NNC(=O)c3ccncc3)c2)cc1 254481916 UDDUFKQXYBCFGA-UHFFFAOYSA-N 431.536 4.991 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CCC[C@@H](Br)CC1 378697452 LQZOEXPYQQGACW-SECBINFHSA-N 439.973 4.601 50 10 IJGE CC[C@H](Br)CCCNC(=O)c1cc(Br)cc(Br)c1 398587112 WGUXFAVNEISFDR-JTQLQIEISA-N 441.989 4.895 50 10 IJGE FC(F)c1ccc(Br)c(I)c1CBr 575684453 GKXKUGVOJCMNCZ-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1S[C@@H](C)C(=O)NN=C(C)CC(C)C 1083891728 BBBBZQWOHRLHRW-INIZCTEOSA-N 449.024 4.748 50 10 IJGE COc1cc(C=NNC(=O)CC[C@@H](O)c2ccccc2)ccc1OCc1cccc(C)c1 1084009789 SDDPKHZRGHVMMJ-HSZRJFAPSA-N 432.520 4.547 50 10 IJGE C#Cc1ccc(NC(=O)NNc2c(Br)cccc2Br)c(Cl)c1 1220235489 WLXFTPXDJBVZKR-UHFFFAOYSA-N 443.526 4.995 50 10 IJGE C=CC[C@@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc3ccccc23)c1C)C(=O)OCC 1632655801 DNWZYZJEGVBWKG-FVIVVMBBSA-N 441.531 4.778 50 10 IJGE Cc1c(C(=O)N2CCCCC2)oc2c1C(=NNC(=O)c1cccc3ccccc13)CCC2 1772747860 LLWGRHZVEZNMFB-UHFFFAOYSA-N 429.520 4.838 50 10 IJGE CCCc1nn(Cc2cccc(F)c2)c2c1[C@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689179 LYMHGIWZHNPVMK-HXUWFJFHSA-N 438.890 4.600 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(CCC)nn3-c2ccc(OC)cc2)c1 1865693507 KDLRDYOBENBPPR-QHCPKHFHSA-N 444.535 4.840 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1cc(C)ccc1C 1865704127 NZJPTHJBXLDITL-XMMPIXPASA-N 428.536 4.864 50 10 IJGE Cc1nc(-c2ccc(F)cc2)ccc1C(=O)NNC(=O)/C=C/c1ccc(Cl)cc1Cl 1865758396 YATCWOXWHMIAHA-VZUCSPMQSA-N 444.293 4.977 50 10 IJGE CSCC[C@H](NC(=O)c1sc(C)nc1C(C)C)C(=O)Nc1ccc(SC#N)cc1 1867156025 BEQJXSMKDGZGKB-INIZCTEOSA-N 448.639 4.638 50 10 IJGE COCc1cc(Br)c([C@@H](Cl)c2c(Br)c(C)nn2C)s1 1877182200 PWLLOGBRAMETOC-JTQLQIEISA-N 428.577 4.790 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)C12CCC2 1882085699 VNVBZFBMGDRUCD-RRFJBIMHSA-N 447.414 4.606 50 10 IJGE O=S(=O)(c1ccc(Cl)c(Br)c1)N(CCCCl)Cc1ccccc1 1914609456 NGLLEHLGGDELFL-UHFFFAOYSA-N 437.186 4.922 50 10 IJGE O=C(Cc1ccccc1Br)N(CCCBr)Cc1ccccc1 1914653561 VROGSEDMEYSPEY-UHFFFAOYSA-N 425.164 4.805 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1ccncc1Br 1915092322 HXPGSGYHIHDSHS-ZDUSSCGKSA-N 426.152 4.660 50 10 IJGE O=C(c1ccc(Br)cn1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915314799 SSWYUBBKJXAKJJ-KRWDZBQOSA-N 438.163 4.660 50 10 IJGE CCn1ncc(Br)c1CN(Cc1ccccc1)C(C)(C)CBr 1915749926 QNNQEKHRAZSUCE-UHFFFAOYSA-N 429.200 4.841 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F 1916349712 VXADKJXIXMQIQQ-BBWFWOEESA-N 436.312 4.794 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@]2(CCC[C@H]2Cl)C1 1918932508 ARJKBHRECRYAIF-NOZJJQNGSA-N 427.589 4.897 50 10 IJGE Cc1nn(C)c(N(CCN(C)Cc2ccccc2)Cc2ccccc2)c1CBr 1931964829 DKLSCQRBQQYBQE-UHFFFAOYSA-N 441.417 4.762 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1cscc1OCc1ccccc1 1993390810 LDAYWWKDAYIDLM-CZUORRHYSA-N 443.350 4.907 50 10 IJGE Cl[C@@H]1CCCC[C@H]1CNc1ncc(I)cc1Br 2015756615 INIFFQQLKQNPJB-GZMMTYOYSA-N 429.527 4.658 50 10 IJGE Brc1ccc(CN2C[C@@H](Br)[C@H](C3CC3)C2)c(Br)c1 2031403278 PEVLKZWCQZKAIM-GXTWGEPZSA-N 438.001 4.817 50 10 IJGE CC(C)(C)OC(=O)NCC(C)(C)C1CCN(C[C@H](Br)C(F)(F)F)CC1 2044706807 XIBBFSPVXWJTTD-ZDUSSCGKSA-N 431.337 4.575 50 10 IJGE CC[C@@H](Br)[C@H]1CCCCN1C(=O)c1sccc1I 2051079129 PEQWLVNKSZKRSZ-MWLCHTKSSA-N 442.160 4.521 50 10 IJGE O=C(CBr)c1cc(C(F)F)c(C(F)(F)F)cc1I 2060395067 CCTKZDQYDWZPTJ-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE Fc1ccc(-n2nc(CBr)c(Cl)c2C(F)(F)F)nc1C(F)(F)F 2078913732 HCROITANMMDVCP-UHFFFAOYSA-N 426.517 4.992 50 10 IJGE O=C(NC[C@]1(CCl)CC12CCC2)c1cc(Br)c(Br)s1 2097910431 LIDPBCBHILABEM-CYBMUJFWSA-N 427.589 4.802 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1[C@]12C[C@H]1CN(Cc1ccccc1)C2 2099678709 KZRSSKLEQKXOPV-KPHUOKFYSA-N 431.765 4.725 50 10 IJGE C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CCN1C[C@H](CBr)c1ccccc1 2106786338 UNTDSOZSVCMNQV-LMMKCTJWSA-N 425.411 4.790 50 10 IJGE C[C@H]1CN(C[C@@H](CBr)c2ccccc2)C(C)(C)CN1C(=O)OC(C)(C)C 2106786374 USIJPYPNWIVTKT-FUHWJXTLSA-N 425.411 4.885 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@@H](Cl)C2(CCCC2)C1 2117757362 YUQFIXFWGUCVNA-SNVBAGLBSA-N 427.589 4.897 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1c(F)cccc1Br 2117894090 JVEOISYKTDQCLA-SNVBAGLBSA-N 442.110 4.702 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CC[C@@H](CN(CC3(CBr)CCCCC3)C1)C2 2120404350 XDPCQMHKBAMMOI-UTKZUKDTSA-N 429.443 4.959 50 10 IJGE CCN(CCCOCc1ccccc1)S(=O)(=O)c1ccc(C)c(CBr)c1 2123199660 VYABOSWJQOWWHX-UHFFFAOYSA-N 440.403 4.507 50 10 IJGE Cc1csc(CCl)c1S(=O)(=O)N(C)[C@@H]1CC(C)(C)[C@@H]1OCc1ccccc1 2156446153 ZQIMLIDZMNTCBV-VQIMIIECSA-N 428.019 4.800 50 10 IJGE FC(F)(F)CC1(CBr)CCN(Cc2ncc(Br)s2)CC1 2188333221 SHZPNGAYVJVWLI-UHFFFAOYSA-N 436.135 4.835 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)CC[C@H](CCNC(=O)OC(C)(C)C)C(C)(C)C 2196914477 NPPJXHUIIGBMFZ-ZACQAIPSSA-N 447.458 4.976 50 10 IJGE O=S1(=O)CCCC[C@@H]1[C@H](Cl)c1cc(Br)c(Br)cc1F 2225633507 KBWSUAWJUKUKOQ-VXGBXAGGSA-N 434.552 4.598 50 10 IJGE O=S1(=O)C[C@@H]2[C@H]([C@H](Cl)c3c(Br)cc(Cl)c(Cl)c3Cl)[C@@H]2C1 2232511182 JSQHBMGVQHJOFY-JHMDGNCFSA-N 438.985 4.980 50 10 IJGE Cc1ccc(I)c(C(=O)N2CC[C@@H](Br)CC23CCC3)c1 2240924784 NDDVBBLTNMQWAA-GFCCVEGCSA-N 448.142 4.522 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCC[C@H](CI)O2)C[C@H]2CCCC[C@H]21 2246608481 ZNWJAJNWMMAMIA-NNFUDEMPSA-N 449.373 4.929 50 10 IJGE COc1c(Br)cc(C=C(C#N)C(=O)Nc2ccccc2)cc1Br 2313510974 HCUPAHVPXCGEQE-UHFFFAOYSA-N 436.103 4.766 50 10 IJGE Clc1ccc(CN2CCC3CC2(CBr)C3)c(I)c1 2318538878 KFDBIVWSWFZYSF-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE COc1ccc(C=NNC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)c(Br)c1O 2323138823 ZMKGYHYOGAIFBY-SWOGZVPRSA-N 435.362 4.610 50 10 IJGE CC(C)(C)OC(=O)NCCC[C@H]1CCCCN1C[C@]1(CBr)CC1(F)F 2326917280 NRJFLVQHIXNVCJ-RHSMWYFYSA-N 425.358 4.566 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CC2CCN(CC3(CBr)CC3)CC2)CC1 2335972661 SPXGLEKKDWYDNV-UHFFFAOYSA-N 429.443 4.911 50 10 IJGE C=CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2F)cc1 38652069 HQGUMAWBPYHMGX-DEOSSOPVSA-N 442.446 4.828 50 10 IJGE Nc1c(NNC(=O)c2cccc3ccccc23)ncnc1Nc1ccc(C(F)(F)F)cc1 40793324 WIQUBIFUQQQPGF-UHFFFAOYSA-N 438.413 4.731 50 10 IJGE ClCc1nc2cc(Br)cnc2n1-c1ccc(I)cc1 98039907 XWMRFOUOGNWQIW-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE CC[C@H](C)c1ccccc1OCC(=O)NNC(=O)[C@@H](C)Oc1ccccc1[C@H](C)CC 251393959 XMLIQPCEBUCTLO-IPMKNSEASA-N 426.557 4.707 50 10 IJGE Cc1cccc(C(=O)Oc2ccc3ccccc3c2C=NNC(=O)COc2ccccc2)c1 254288330 GXFWUFFAJUVOMI-UHFFFAOYSA-N 438.483 4.897 50 10 IJGE CC(C)(C)OC(=O)N1[C@H](Br)C(=O)O[C@@H](c2ccccc2)[C@H]1c1ccccc1 301054863 NOVNBQKUIAJJBO-SQNIBIBYSA-N 432.314 4.984 50 10 IJGE CO[C@@H](CO[C@@H](CI)c1cccc(Br)c1)C(C)C 386715828 WRZBIAFXWXDCEV-KBPBESRZSA-N 427.120 4.613 50 10 IJGE CC(C)[C@@H](CBr)CNC(=O)c1cc(Br)cc(Br)c1 394185831 YKMOTUYPZSEUMA-JTQLQIEISA-N 441.989 4.609 50 10 IJGE C[C@H](COC1(CI)CCN(C(=O)OC(C)(C)C)CC1)C1CCC1 398358599 MDXHVNCJOBKWMH-CQSZACIVSA-N 437.362 4.644 50 10 IJGE O=C(CBr)c1cc(Br)cc(OC(F)(F)F)c1OC(F)F 575686074 LYUAXMJCJGBENN-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE C[C@@H](C[C@@H](C)Br)Nc1ncc(C(F)(F)F)cc1I 686108135 ASMQZUUOHRZFOD-RQJHMYQMSA-N 437.041 4.679 50 10 IJGE N#Cc1ccc(-c2cccc(CNC(=O)NNC(=O)c3ccc4ccccc4c3)c2)s1 740034852 FDTLTOLPULMKIB-UHFFFAOYSA-N 426.501 4.584 50 10 IJGE O=C(NNc1cc(C(F)(F)F)ccc1F)C1CCN(c2nc3ccccc3s2)CC1 754154203 SYRYVQQVZLPRBB-UHFFFAOYSA-N 438.450 4.814 50 10 IJGE Cc1cc(Br)ccc1NNC(=O)c1cc2cccc(C(F)(F)F)c2nc1O 1545926214 LZKHCFAPNLOIPQ-UHFFFAOYSA-N 440.219 4.787 50 10 IJGE BrC[C@H](CN1CCN(Cc2cccc(OCc3ccccc3)c2)CC1)C1CC1 1655284217 QPSQFQCXUPHEHU-HSZRJFAPSA-N 443.429 4.804 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccccc2F)cc1 1865685545 JYHVWAVMPDVWOE-KRWDZBQOSA-N 428.389 4.616 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccn2)[C@@H]1c1ccccc1Cl 1865686457 WDWYUYVLEAXFEH-HXUWFJFHSA-N 425.879 4.806 50 10 IJGE O=C(N[C@@H](CC1CC(Br)C1)C(=O)O)OCC1c2ccccc2-c2ccccc21 1880432090 OECLZONWYNIENY-DHRDCHLVSA-N 444.325 4.542 50 10 IJGE C[C@@H]1C[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)C1 1880756377 SYHMFMOZVXLZJT-RBSFLKMASA-N 435.403 4.558 50 10 IJGE O=C(NC1(C(F)(F)F)CCC(Cl)CC1)c1csc(I)c1 1924743488 BPBFDLCJSGBCPJ-UHFFFAOYSA-N 437.652 4.565 50 10 IJGE C[C@@H](CCCCBr)NC(=O)c1csc(Br)c1Br 1945186543 JLBNIYDPOCNMEE-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE CCC[C@H](CCBr)NC(=O)c1csc(Br)c1Br 1945189270 MUBGMDSNMIXGNT-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE CCCOCCCO[C@@H](CI)c1ccc(Br)cc1 2031754772 NMJJXYFEFXQZDE-AWEZNQCLSA-N 427.120 4.759 50 10 IJGE Cc1sc(Br)cc1[C@H](Br)c1ccsc1S(C)(=O)=O 2033136119 OZRYOZWUNFLXIG-SNVBAGLBSA-N 430.208 4.768 50 10 IJGE C[C@@H]1CN(Cc2cc(Cl)ccc2I)CC[C@H]1CBr 2046687347 RKIFUCSUDQEKLB-MNOVXSKESA-N 442.566 4.798 50 10 IJGE CC(C)[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1cc(F)ccc1CBr 2059268184 WFTMBPJHLUWMCD-HNNXBMFYSA-N 428.367 4.956 50 10 IJGE Clc1cc(CN2C3CCC2(CBr)CC3)ccc1I 2086661888 PZJJDBYXGCTLSQ-UHFFFAOYSA-N 440.550 4.837 50 10 IJGE CCN(c1nc2sccn2c1CBr)C1CCN(Cc2ccccc2)CC1 2087295083 KNTDMADAPLGJST-UHFFFAOYSA-N 433.419 4.782 50 10 IJGE O=C(c1scc(Br)c1Br)N1[C@H]2CC[C@@H]1C[C@H](CCl)C2 2128150841 ZELNMQZMCBVYJC-AYMMMOKOSA-N 427.589 4.895 50 10 IJGE O=C(c1ccc(Br)cc1Cl)N1CC[C@@H](CBr)C(F)(F)C1 2146375438 NIYYOPKPZXONFL-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CCC(F)(F)[C@H](CCl)C1 2150492455 ADHIJWMQDRUQBV-MRVPVSSYSA-N 431.502 4.548 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C(=O)c2ccc(CBr)cc2)C2(CCCC2)C1 2162874537 WZEUSSJESYSZQF-QGZVFWFLSA-N 437.378 4.634 50 10 IJGE CCCC[C@H](C)N(C)S(=O)(=O)c1cc(CBr)ccc1Br 2179861742 LVYGZMVRGKFKPN-NSHDSACASA-N 427.202 4.543 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)c1cccc2c1CCCN2C(=O)OC(C)(C)C 2196914650 PKRZCSFBOPCCHX-GASCZTMLSA-N 437.378 4.620 50 10 IJGE Cc1cc(Br)c(C)c([C@@H](Cl)C2CCS(=O)(=O)CC2)c1Br 2201069857 MBUFJVPFIZRRFQ-AWEZNQCLSA-N 444.616 4.933 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Br)[C@@]12COC[C@@H]1C2(F)F 2202999829 RPAAAVVQTOAOLF-ZMLRMANQSA-N 432.486 4.829 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CCCCCCBr)C[C@@H]1C(F)(F)F 2223283104 PAKRGWKXINRPSS-KGLIPLIRSA-N 431.337 4.577 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2Cc1ccn(Cc2ccccc2)n1 2224722978 WGBJKMJUBANPFJ-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE CC1CC(CBr)(CN(CC2CC2)C[C@H]2CCCN2C(=O)OC(C)(C)C)C1 2265312644 WLMOGXZMWJALRJ-NCYVPVAZSA-N 429.443 4.909 50 10 IJGE Cc1cncc(CO[C@H](CI)c2ccc(Br)cc2)c1 2279030838 QQJYRMFFTHAVSV-OAHLLOKOSA-N 432.099 4.845 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3CC[C@H]2C[C@H]3Br)c1 2315503233 HOUXYHNVJFYNCZ-LJWDBELGSA-N 438.001 4.959 50 10 IJGE CC(C)N1C[C@H](Cc2ccc(Cl)cc2I)[C@@H](Br)C1 2318531149 IHPJNTLHYFUKDT-AAEUAGOBSA-N 442.566 4.591 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@H]1CCCC[C@H]1C(F)(F)F 2343414959 VPBLMEYKWDLHQP-IXDOHACOSA-N 436.312 4.842 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)c2ccc(Br)cc2)c(OCC)c1 957976 IOHCJXQXYKWIEG-WJDWOHSUSA-N 444.281 4.537 50 10 IJGE C=CCNC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccc(OCC)c(Cl)c1 35447269 PXUUIYVIFZJJOS-AQTBWJFISA-N 432.911 4.801 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)COc2ccccc2)CCC3)c1C 40815974 UHOSQKZFCBTMPA-SGWCAAJKSA-N 445.519 4.693 50 10 IJGE CC1=C(C#N)C(=O)N([C@@H](C)c2ccccc2)C(=O)/C1=C/Nc1ccccc1Br 101234017 LHTGBVIGJOFXOC-VUODPORTSA-N 436.309 4.715 50 10 IJGE Br[C@@H](c1ccc(I)cc1)c1cnn(-c2ccccc2)c1 109864303 KEZJERRHABENDY-INIZCTEOSA-N 439.094 4.961 50 10 IJGE COC(C)(C)CCO[C@H](CI)c1ccc(Br)cc1 234694593 OIOUPTMDJNANFZ-CYBMUJFWSA-N 427.120 4.757 50 10 IJGE Cc1nn(-c2ccccc2)c(Cl)c1/C=N/NC(=O)CCCNc1ccc(Cl)cc1 253570428 NOOLQERSCUAPLE-AFUMVMLFSA-N 430.339 4.830 50 10 IJGE CCn1c(SCC(=O)NN=Cc2cccc(C)c2)nnc1-c1ccc(C(C)(C)C)cc1 254512411 MSAOVTWLAIDHKD-UHFFFAOYSA-N 435.597 4.813 50 10 IJGE COc1ccc(C(=O)NN=C(C)CC(=O)Nc2cc3oc4ccccc4c3cc2OC)cc1 254714752 ZHPFSTGFTPVKPX-UHFFFAOYSA-N 445.475 4.738 50 10 IJGE O=C(NN=Cc1cccc(C(F)(F)F)c1)c1cnn(-c2ccccc2)c1C(F)(F)F 263628360 NBRSVKHWCSXBLX-UHFFFAOYSA-N 426.320 4.674 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CI)[C@@H](c2ccc(F)c(Cl)c2)C1 394705499 DVVOWMNCNFMPFC-VXGBXAGGSA-N 439.696 4.865 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1ccc([C@H]2Cc3ccccc3N(S(N)(=O)=O)C2)cc1 616691131 TZXYUYRXQKDEBW-NRFANRHFSA-N 446.689 4.601 50 10 IJGE O=C(NN=Cc1cnn2ccccc12)c1cc(-c2ccccc2Cl)nc2ccccc12 729633325 MQWIRENAPMFNLV-UHFFFAOYSA-N 425.879 4.967 50 10 IJGE CC(=C/c1ccc(Cl)cc1)/C=C(\C#N)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 753716319 YDMOKJIQYZVUGX-HARCQHEZSA-N 432.911 4.630 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(-c3ccccn3)ccc2Cl)c1C 755277207 OGUPSPXAEHMRJM-UHFFFAOYSA-N 430.899 4.628 50 10 IJGE C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F 792383467 CJKCWSYAPCDITB-RFXMVYNHSA-N 448.816 4.644 50 10 IJGE CC(C)c1ccc(-n2c(NNC(=O)c3ccoc3C3CC3)nc3ccccc3c2=O)cc1 798967317 VKOPCHWLLSEQAG-UHFFFAOYSA-N 428.492 4.736 50 10 IJGE N#C/C(=C\c1ccc(OCC(=O)O)c(Cl)c1)C(=O)Nc1ccc(Cl)cc1Cl 1084373201 MOUPTNMMEFEVNG-VZUCSPMQSA-N 425.655 4.656 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc3cccc(C(F)(F)F)c3nc2O)cc1C(F)(F)F 1137652651 CGZZKKRCSXIGEQ-UHFFFAOYSA-N 440.303 4.607 50 10 IJGE C=CCCC[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2)c1C)C(=O)OC 1558384503 ZTAUSRFNYRIUSJ-JJEHFPDLSA-N 439.943 4.669 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)Nc2ccc3nc(O)n(C)c3c2)c1C 1617357649 RSBLNLNLSYWEEW-UNOMPAQXSA-N 425.492 4.541 50 10 IJGE CCOc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(F)cc2)CCC3)cc1 1772744896 MAMYZCWRDKPPRW-UHFFFAOYSA-N 449.482 4.849 50 10 IJGE Cc1ccc(SCCCC(=O)NNC(=O)c2sc(Cc3ccccc3)nc2C)cc1 1865845252 OOZAWMZHNMIYSW-UHFFFAOYSA-N 439.606 4.684 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)C(=O)c1cccc(Br)c1Cl 1916352812 BVYBJJZTGOGUEJ-AWEZNQCLSA-N 431.157 4.999 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)CN1c1nc2ccccn2c1CBr 1921468412 DTCYWSHOYFNYFY-MSOLQXFVSA-N 427.390 4.576 50 10 IJGE Cc1cc(Br)sc1[C@H](Br)c1nn(C)cc1Br 1939452747 VXPLYMCWBXGJRW-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE CN(CCN(C[C@H](CBr)C1CCC1)CC(F)(F)F)C(=O)OC(C)(C)C 1966496109 LSQUUWXYSCYRML-AWEZNQCLSA-N 431.337 4.529 50 10 IJGE Cc1nn(C)c(Br)c1CN(Cc1ccccc1)[C@H](CBr)C(C)C 1986916030 XMUJVRDCDSWFBG-QGZVFWFLSA-N 443.227 4.913 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1ccc(Br)cc1F 2010825696 PBHMHOPKIJYYGD-UHFFFAOYSA-N 439.416 4.584 50 10 IJGE O=C(NCC[C@H](Br)C1CC1)c1cc(Br)cc(Br)c1 2029910826 CYXAWJNPWWUQFM-LBPRGKRZSA-N 439.973 4.505 50 10 IJGE Cc1cc(S(=O)(=O)N(Cc2ccccc2)CC(C)C)cc(CBr)c1F 2059311799 BONHAVAZCZBQFT-UHFFFAOYSA-N 428.367 4.876 50 10 IJGE CCC[C@@H](CBr)CN1CCCC[C@@H]1C(F)(F)CNC(=O)OC(C)(C)C 2065453439 ROGMIZSMIURULD-LSDHHAIUSA-N 427.374 4.812 50 10 IJGE CN(C(=O)c1cccc(Br)c1Br)C1(CCBr)CC1 2069693956 NOYCEPCJUITJHV-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC2(CCC2)C[C@@H]1CCl 2095167635 FCJRDTZTIZZBAO-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](CN(C[C@@H](CBr)C2CCC2)C2CC2)C1 2106784033 FKKBNJFMZZZTPF-SJLPKXTDSA-N 429.443 4.909 50 10 IJGE CCCC1(CNC(=O)[C@@H](Br)C2CCCC2)CCN(C(=O)OC(C)(C)C)CC1 2167049608 XLRFUCLKFRRLGN-KRWDZBQOSA-N 445.442 4.874 50 10 IJGE Cc1ccc(C(=O)NC[C@@H](Br)CC(C)(C)C)cc1I 2224619837 YSQVXCOTAHXHDD-LBPRGKRZSA-N 438.147 4.529 50 10 IJGE Cc1cc(S(=O)(=O)Nc2cccc(CBr)c2C)sc1Br 2283637387 OXOWMELIJYEGPP-UHFFFAOYSA-N 439.194 4.823 50 10 IJGE CN(CC[C@H](Br)c1cccs1)c1ccc(I)cn1 2318121122 VZHGUBQRNZJDBI-NSHDSACASA-N 437.144 4.710 50 10 IJGE CC(C)[C@H](CBr)N(C)C(=O)c1cc(Br)cc(Br)c1 2318842925 ZJQYNHHQYOEZKP-LBPRGKRZSA-N 441.989 4.703 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc1[N+](=O)[O-] 2323608979 YOCXEAAOORBSGY-UHFFFAOYSA-N 441.513 4.524 50 10 IJGE CCn1c(C)c(C=NNC(=O)c2cccn(Cc3ccc(Cl)cc3)c2=O)c2ccccc21 2323650744 BGJTVMWWABVNNM-UHFFFAOYSA-N 446.938 4.597 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@H]1CCCC[C@H]1C(F)(F)F 2343417128 VPBLMEYKWDLHQP-YESZJQIVSA-N 436.312 4.842 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2ccc(-c3cccc(Cl)c3)o2)cc1 58893130 RMMVZZKBCOWBPG-QEMKNDADSA-N 426.900 4.963 50 10 IJGE Cc1cc([C@H](Br)c2cccc(S(C)(=O)=O)c2)c(C)cc1Br 70472128 UEFGZQVFRRFAHP-MRXNPFEDSA-N 432.177 4.954 50 10 IJGE COc1ccc(N/C=C(\C#N)c2nc(-c3cc4ccccc4oc3=O)cs2)c(OC)c1 100335126 UYENAKBGTBCXSP-NTCAYCPXSA-N 431.473 4.910 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(-c3ccc(Br)cc3)o2)C1=O 103693570 GXCLSZRWZVVPOF-BOPFTXTBSA-N 425.282 4.711 50 10 IJGE CCc1ccc(/C=N\NC(=O)c2cccn(Cc3ccc(Cl)c(Cl)c3)c2=O)cc1 169920469 JOXWJGWSXSOYLO-MXAYSNPKSA-N 428.319 4.530 50 10 IJGE N#C/C(=C/N1CCN(c2ccccc2F)CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1 217212018 MAKJUUHXSVSMRI-VXPUYCOJSA-N 442.494 4.786 50 10 IJGE C[C@@H](N/C=C(/C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C12CC3CC(CC(C3)C1)C2 217234113 DZEUOLRPNLNNKE-LSXFSIBFSA-N 428.920 4.789 50 10 IJGE COc1ccc(C=NNC(=O)c2cc(-c3cc(C)ccc3C)nc3ccccc23)cc1O 252628704 SVZJQKSIZQSKOD-UHFFFAOYSA-N 425.488 4.997 50 10 IJGE Cc1cc(C)cc(-n2c(C)cc(C=NNC(=O)CSc3ccc([N+](=O)[O-])cc3)c2C)c1 254558147 HFHWPEZWNCPNBE-UHFFFAOYSA-N 436.537 4.862 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CCl)c1Cl)N1CC[C@H](COCc2ccccc2)C1 383955044 BAMZNNGVFYWRQE-HNNXBMFYSA-N 448.799 4.960 50 10 IJGE CO[C@@H](COc1c(Br)cc(CBr)cc1Br)C1CC1 400243832 LARMFVRPVUVVER-LBPRGKRZSA-N 442.973 4.910 50 10 IJGE Brc1ccc([C@H](CI)OCCOC2CCC2)cc1 400776871 QCEDTJZKVWLDMH-AWEZNQCLSA-N 425.104 4.511 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccccc1[C@H]1CCN(S(N)(=O)=O)c2ccccc21 616589746 URCMYWAKJPEQPL-LJQANCHMSA-N 432.662 4.754 50 10 IJGE CC(C)(C)N(CCBr)C(=O)c1cc(Br)cc(Br)c1 707922950 VIXUBCWVSRJRSH-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE CC(C)C[C@H]1CCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)C1 744639745 GIRDZDNTYQMUBG-RXWSAZGZSA-N 435.959 4.919 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N[C@H](C)c2cc3cccc(OC)c3o2)c1C 1087703531 KCRGSGDSZGOKBC-VJJRWWOPSA-N 435.524 4.852 50 10 IJGE C=CCn1ncc2ccc(NC(=O)NNC(=O)c3ccc(-c4ccc(F)cc4)s3)cc21 1209767183 DLEITSUGIZHSDT-UHFFFAOYSA-N 435.484 4.556 50 10 IJGE BrC[C@@H](CN1CCC[C@@H]1c1ccc(I)cc1)C1CC1 1307642802 INHVKEHYSGQXFL-GOEBONIOSA-N 434.159 4.849 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2cccnc2O)c(C)n1-c1cccc(Cl)c1Cl 1596034508 WZHZYNLJSGBCND-YVLHZVERSA-N 441.318 4.725 50 10 IJGE O=C(Nc1ccccc1)Nc1ccc(C(=O)NNc2nc3ccccc3[nH]c2=S)s1 1641877101 CHTJZASNZAXJDV-UHFFFAOYSA-N 436.522 4.755 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2cc(-c3ccccc3)nc3ccc(C)cc23)c1 1644838271 PSCOAFKDFHBZAW-UHFFFAOYSA-N 436.540 4.823 50 10 IJGE Cc1ccc(C)c(Cn2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2cccnc2)c1 1865700276 OTOJVXFGTYQMGO-HSZRJFAPSA-N 433.515 4.828 50 10 IJGE CC(C)(C)c1nc(Nc2ccc(SC#N)cc2)cc(N2CCC(c3ncncn3)CC2)n1 1868342122 KYDMMRSOVSODGN-UHFFFAOYSA-N 446.584 4.660 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)CNC(=O)c3ccc(Cl)cc3)n2)cc1 1872745974 LYHRVFNAALSNKE-ZPHPHTNESA-N 425.897 4.695 50 10 IJGE CN(Cc1cccc(Br)c1Br)C1(CBr)CCC1 1914970472 CGRROWWHMSPDGQ-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1sncc1Br 1915290118 AFOSJUZNMZTBCW-CQSZACIVSA-N 446.208 4.968 50 10 IJGE BrCC[C@@H]1CCCN1Cc1c(Br)cccc1Br 1945333741 UNYYRRJLMALMEP-JTQLQIEISA-N 425.990 4.961 50 10 IJGE CCN(C[C@@](C)(CI)OCc1ccccc1C)C(=O)OC(C)(C)C 2024649207 PNVZRKHJSYODJP-LJQANCHMSA-N 447.357 4.962 50 10 IJGE COc1ccc([C@@H](Br)c2cn(C)nc2Br)c(Cl)c1Cl 2138628754 WONVNLMMJMTXBL-SECBINFHSA-N 428.939 4.982 50 10 IJGE Fc1cc(Br)cc2c1nc(CCCl)n2[C@@]12C[C@@H]1CN(Cc1ccccc1)C2 2232924914 WRDLDDHKWLETDT-QVKFZJNVSA-N 448.767 4.950 50 10 IJGE CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2[C@@H](CBr)NC(=O)OC(C)(C)C 2241740020 VSTCTWNVWWBEOZ-WJTFHPDPSA-N 447.414 4.604 50 10 IJGE COC1(CO[C@@H](CI)c2ccc(Br)cc2)CCC1 2254949581 JALWMKYRAINAKX-ZDUSSCGKSA-N 425.104 4.511 50 10 IJGE CN(C(=O)c1ccc(Cl)c(I)c1)[C@H]1CCCCC[C@H]1Cl 2283657065 RPSMJLBMVZELPF-OCCSQVGLSA-N 426.125 4.957 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H]2CC[C@@H]1C[C@H](Br)C2 2285960968 WPENQKGLSBDQLG-AYMMMOKOSA-N 425.523 4.772 50 10 IJGE C[C@@H](Br)COCc1cn(-c2c(Cl)cc(Cl)cc2Br)nn1 2295832410 DNXVXSJKVICISV-SSDOTTSWSA-N 443.954 4.637 50 10 IJGE Cc1ccc([N+](=O)[O-])cc1-c1ccc(C=C(C#N)c2nn(-c3ccccc3)c(N)c2C#N)o1 2297578023 WBNHGCSVKGEIHA-UHFFFAOYSA-N 436.431 4.867 50 10 IJGE C=CCOc1ccc(C=C2C(=O)N(Cc3ccc(F)cc3)C(=O)C(C#N)=C2C)cc1OCC 2314619747 DTDIGSYHELUGAH-UHFFFAOYSA-N 446.478 4.582 50 10 IJGE COC(=O)C(C#N)=Cc1cccc(OC(=O)CCCOc2ccc(Cl)cc2Cl)c1 2314760373 NGKSVDQOXSZQAD-UHFFFAOYSA-N 434.275 4.838 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@]1(C)CBr 2315552011 YIPGVBJMQYURRQ-YGRLFVJLSA-N 442.566 4.798 50 10 IJGE C[C@@H]1CCc2[nH]c3ccc(C(=O)NN=Cc4cc(Br)ccc4O)cc3c2C1 2323163626 SDBBTLYAJIEIFW-GFCCVEGCSA-N 426.314 4.525 50 10 IJGE C[C@H]1[C@H](C)N(Cc2ccc(I)c(Br)c2)CC[C@H]1Cl 2325214243 NUAWTQREJWNBJQ-OUJBWJOFSA-N 442.566 4.891 50 10 IJGE CC1(C)CN(Cc2cc(I)ccc2Cl)C[C@@H]1CBr 2327392154 NWPPTFLCESHEDH-NSHDSACASA-N 442.566 4.798 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2ccc(-c3ccc(N(C)C)cc3)cc2)cc1OC 2329703090 PUPHOPSIAPFBRD-UHFFFAOYSA-N 427.504 4.982 50 10 IJGE Cc1cc(-c2csc(C(C#N)=C(O)CCN3C(=O)c4ccccc4C3=O)n2)ccc1F 2331320450 ORGCVVGUGYCBRE-UHFFFAOYSA-N 433.464 4.737 50 10 IJGE O=C(N[C@H]1C[C@@H](CBr)C12CCC2)c1cc(Br)c(Cl)s1 2351615746 VCMACFIZVZXGAP-XVKPBYJWSA-N 427.589 4.848 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@H]1CCl 2362380223 PZPKWIPSMRAJBB-ZJUUUORDSA-N 438.058 4.794 50 10 IJGE Cc1ccc(C)c([C@H](C)NC(=O)/C(C#N)=C/c2cc3c(cc2Br)OCO3)c1 20356968 IZHZCYWYKVMDHM-WBNYAZSOSA-N 427.298 4.579 50 10 IJGE Cc1ccc2c(c1)/C(=N\NC(=O)CCCOc1ccc(Cl)cc1Cl)C(=O)N2C(C)C 38180201 UWPZRYSNBPWNDC-YYADALCUSA-N 448.350 4.736 50 10 IJGE C=CCNC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc(OCCCC)cc1 39983128 NNZHYMHXGPVIKQ-HEHNFIMWSA-N 426.520 4.927 50 10 IJGE CCc1ccccc1OCC(=O)N/N=C/c1ccc(OCc2ccc(C)cc2)c(OC)c1 40888541 USIAZVOYTCRCPN-JVWAILMASA-N 432.520 4.674 50 10 IJGE O=C(CCC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N/N=C\c1ccc(Cl)cc1 96095848 MCSUSZNXRSAUOD-VROXFSQNSA-N 432.229 4.881 50 10 IJGE O=C(NC[C@@H](c1ccccc1)N1CCCC1)[C@H](Br)Cc1ccccc1Cl 96568400 KBFBQYDRGNTRKT-QUCCMNQESA-N 435.793 4.599 50 10 IJGE N#C/C(=C/Nc1ccccc1N1CCOCC1)C(=O)Nc1ccc(Oc2ccccc2)cc1 217211344 WNRGOSKTNOQFTG-VXPUYCOJSA-N 440.503 4.774 50 10 IJGE Cc1ccc(-n2nc(C)c(CC(=O)NNc3ccc(-c4ccccc4)nn3)c2C)cc1Cl 754471302 YJRXWDKMWDIFDT-UHFFFAOYSA-N 446.942 4.594 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2cc(Cl)c(OCC)c(OCC)c2)cc1 1083923282 WFMYZGBQHVPXRZ-FQEVSTJZSA-N 448.947 4.500 50 10 IJGE CCN(CC)c1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CBr)c(O)c1 1614704399 LMDXZGCFYRBLCI-WMLDXEAASA-N 427.383 4.584 50 10 IJGE Cc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2ccccc2[N+](=O)[O-])cc1 1865710116 OPYKNRKFDRNKGY-JOCHJYFZSA-N 449.470 4.974 50 10 IJGE COc1ccc(-c2csc([C@H](C#N)C(=O)/C(C#N)=C/c3ccccc3)n2)c(OC)c1OC 1872789043 WZKNNJMIESMSSA-QIPHDZALSA-N 445.500 4.619 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H](CCC(=O)NCC1CC(Br)C1)C(C)(C)C 1887795111 XLCMQLSYKMWMEA-HWOWSKLDSA-N 433.431 4.633 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]([C@]2(C)CC[C@](C)(CI)O2)CC1 1993736347 WAQQOMDDQRBYFY-NONVJHHQSA-N 437.362 4.833 50 10 IJGE CN(C[C@H](Br)C1CCCC1)c1ncc(Br)cc1Br 2048739349 JFFXKYBPWQYSMZ-LBPRGKRZSA-N 441.005 4.997 50 10 IJGE CC1(C)C[C@@H](O[C@H](CI)c2ccc(Br)cc2)CO1 2052241277 ODCQAWFETLPJHG-CHWSQXEVSA-N 425.104 4.509 50 10 IJGE O=C(CCl)c1c(I)cc(OC(F)(F)F)cc1C(F)(F)F 2055151440 IFONBIUYEJJSEZ-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE CN(C(=O)c1cc(Br)c(Br)s1)[C@H](CCCl)C(F)F 2058230902 CWPYOPOCNMSIOE-ZCFIWIBFSA-N 425.520 4.608 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CC2(CBr)CCCCC2)CC(F)(F)C1 2064309953 HNSJMUXPTDQEHV-CQSZACIVSA-N 425.358 4.566 50 10 IJGE BrC[C@@H]1CCN(Cc2ccc(Br)cc2Br)C12CC2 2070107135 SIYSMDXCEURIIO-NSHDSACASA-N 438.001 4.961 50 10 IJGE C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1N(C)C[C@H](CBr)c1ccccc1 2107354785 BALSSNLDPIQULW-NZSAHSFTSA-N 425.411 4.742 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1[C@H](CBr)C[C@H]2CCC[C@H]21 2115940080 LCCKJKDOWAXFIF-KHQFGBGNSA-N 427.589 4.942 50 10 IJGE CCC[C@H](Br)c1cn(-c2ccc(CC)c(I)c2)nn1 2128670768 ILTOXJLONQZSMB-LBPRGKRZSA-N 434.119 4.670 50 10 IJGE CC(C)(CNC(=O)OC(C)(C)C)CC1CN(Cc2ccc(CBr)cc2)C1 2134810634 IMIWNBFRGICGHI-UHFFFAOYSA-N 425.411 4.954 50 10 IJGE O=C(c1ccc(Br)cc1Cl)N1CC[C@@H](Br)C(F)(F)CC1 2150019674 UKUWSOQKLJBVCK-LLVKDONJSA-N 431.502 4.737 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 2163057293 AFUWIXNZVOOGJH-NBYUQASBSA-N 437.422 4.885 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@@H]1CC2(CCC2)CO1 2166445576 XLKHHUZSVINTRD-KBPBESRZSA-N 449.126 4.621 50 10 IJGE Cc1cc([C@H](Br)c2ccc3c(c2)CC(=O)N3)ccc1I 2207106333 XDOITOOCYJWSRG-INIZCTEOSA-N 442.094 4.579 50 10 IJGE FC(F)OCCCn1c(CCl)nc2cc(Br)c(Br)cc21 2234075367 XHUDJFWBKIWSTQ-UHFFFAOYSA-N 432.490 4.929 50 10 IJGE C[C@H](Cl)CN(CC(C)(C)C)c1ncc(I)cc1Br 2259770423 QQDCQVCGEUHIDI-VIFPVBQESA-N 445.570 4.929 50 10 IJGE COc1ccc([C@H](Br)[C@@]23C[C@@H](CO2)C3(C)C)cc1I 2273463127 RCIQHGULUXMZDW-VZJVUDMVSA-N 437.115 4.551 50 10 IJGE C[C@@H](Br)[C@H](NC(=O)c1cc(Br)c(F)cc1Cl)C(F)(F)F 2285836054 WLYWSHRXRGSKTF-MOFOKWOHSA-N 441.444 4.686 50 10 IJGE CC1(C)OC[C@H](Cc2cc(I)ccc2Cl)[C@@H]1Br 2307330026 IZNSLEQRAUIDIC-CABZTGNLSA-N 429.523 4.676 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@@H]1COCCO1 2317395529 JGSNJZXITGNGSJ-WCBMZHEXSA-N 446.936 4.511 50 10 IJGE Cc1sc(NC(=O)C(C#N)=Cc2ccccc2)nc1-c1ccc2c(c1)C(C)(C)C(=O)N2C 2320934068 HDPYSJJXEVQBJQ-UHFFFAOYSA-N 442.544 4.918 50 10 IJGE CC(C)OC(=O)c1ccc(C(C#N)=Cc2ccc(OCC(=O)Nc3ccccc3)cc2)o1 2331048951 PCCMNVQYAZYMIN-UHFFFAOYSA-N 430.460 4.926 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)c3ccc(N(C)C)cc3)n2)c(OC)c1OC 2331413732 MBTXXDUNYQEJPK-UHFFFAOYSA-N 437.521 4.852 50 10 IJGE C[C@](CI)(OCc1ccncc1)c1ccccc1Br 2340084965 NABDVATZZGPAIX-OAHLLOKOSA-N 432.099 4.711 50 10 IJGE CCOc1c(Cl)cc(/C=N\NC(=O)CSc2nc3ccccc3s2)cc1OC 33332842 PCTMWISHYFQECK-FBHDLOMBSA-N 435.958 4.599 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(C)c1/C=N/NC(=O)[C@@H](C)SCc1ccccc1 59153557 LVKPTJYJHBCAJH-YBNTXHARSA-N 441.000 4.974 50 10 IJGE Br[C@H](c1cccc(I)c1)c1ccc2c(c1)OCCCO2 109843314 BXGFCUFJQSLMFD-MRXNPFEDSA-N 445.094 4.937 50 10 IJGE CC[C@H](C)N1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccccc3)c(OC)c2)C1=O 214265627 ZJPMXPQWVUETIE-WBRURWICSA-N 430.504 4.665 50 10 IJGE Br[C@H](CC[C@H]1CCCO1)c1cc(I)cc2c1OCC2 388617660 DZGBRUXYDROHIO-TZMCWYRMSA-N 437.115 4.621 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCc1csnn1 393877914 IFCLGOHXTLXLDU-UHFFFAOYSA-N 442.958 4.537 50 10 IJGE Clc1ccc(I)c(CN(CCCBr)C2CC2)c1 405313482 VMVWLIILMAATGU-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE C[C@@H]1C[C@H](Br)CN(C(=O)c2scc(Br)c2Br)C1 705469078 VQVBLDPYASRIGB-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE Cc1ccc(C)c(-n2c(C)cc(C=NNC(=O)C(=O)Nc3ccc(Cl)cc3C)c2C)c1 725387601 SZCWFCHRQYWHAN-UHFFFAOYSA-N 436.943 4.762 50 10 IJGE CC(C)(C)Oc1ccc(CNC(=O)NNC(=O)c2ccc(Cl)cc2)c(C(F)(F)F)c1 745914956 UIKLPBBXBDVUIO-UHFFFAOYSA-N 443.853 4.680 50 10 IJGE Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)C(=O)NNc1cccc(F)c1F 785015091 CLBZVLFSDLFPFH-UHFFFAOYSA-N 445.853 4.587 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C)[C@@H]1CCCO1 1459223777 JFDCTZXBHAXILF-TXHRQLKOSA-N 442.346 4.605 50 10 IJGE CSCc1ccc(C(=O)N/N=C2\C(=O)N(Cc3ccccc3Cl)c3ccccc32)cc1 1860822397 CJKSWSUKVZEXDK-ROMGYVFFSA-N 449.963 4.884 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccc(F)cc2)[C@H]1c1cccc(O)c1 1865680951 AVDZDHIHTYOPEX-QFIPXVFZSA-N 438.462 4.661 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1ccc(OC)cc1)C(C#N)=C(N)O2 1865712638 DHYCGQBXNQZBLL-FQEVSTJZSA-N 438.890 4.513 50 10 IJGE CN(Cc1ccc(NC(=O)OC(C)(C)C)cc1)CC(C)(C)CI 1904648150 CRGYKOGPMZRMAO-UHFFFAOYSA-N 432.346 4.927 50 10 IJGE Cc1nn(C)c(CN(Cc2ccccc2)[C@H](CBr)C(C)C)c1Br 1915258373 XMIHMEAAULJJIM-MRXNPFEDSA-N 443.227 4.913 50 10 IJGE Cn1ncc(Br)c1C[C@H](CBr)c1cccc(Br)c1 2027123071 VEGIRVFRWIGXLP-SNVBAGLBSA-N 436.973 4.666 50 10 IJGE C=C(C)CSc1nnc(SCC(=O)C(C#N)=C2Sc3ccccc3N2C)s1 2040463755 MIIPWFLJTIVBNP-UHFFFAOYSA-N 432.621 4.845 50 10 IJGE C[C@H](Cl)[C@@H](NC(=O)c1scc(Br)c1Br)C(F)(F)F 2074713947 VMDUWBLRIGKQLS-CLTAVNFZSA-N 429.483 4.561 50 10 IJGE C[C@@H](Cl)[C@H](NC(=O)c1scc(Br)c1Br)C(F)(F)F 2074713950 VMDUWBLRIGKQLS-NFNCENRGSA-N 429.483 4.561 50 10 IJGE O=C(N[C@@H]1C[C@H]2CC[C@H]1[C@@H](Br)C2)c1cc(Br)c(Cl)s1 2139707340 RTHYQZQPDOGATD-AZQAYCESSA-N 427.589 4.846 50 10 IJGE Cc1cccc(C(=O)N2C3CCC2([C@H](C)Br)CC3)c1I 2153387087 UZBXPMZWQAPHIB-FZWSLVFFSA-N 448.142 4.520 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CNC(=O)c1ccc(CBr)cc1)c1ccccc1 2162494720 MFRXLMWNWGIVMA-GOSISDBHSA-N 433.346 4.577 50 10 IJGE O=C(NC[C@@H]1CCCC[C@@H](Cl)C1)c1ccc(I)c(Cl)c1 2163752857 COMJBYHWXWTTAT-ZYHUDNBSSA-N 426.125 4.862 50 10 IJGE CC(C)N(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2167033297 QLHRXIWRFWWMNI-ROUUACIJSA-N 445.442 4.967 50 10 IJGE Cc1cccc(C(=O)N2C[C@@H](Br)CCC23CCC3)c1I 2174539391 DHHMWHKWZBZJDD-LBPRGKRZSA-N 448.142 4.522 50 10 IJGE Brc1cccc([C@@H](CI)O[C@H]2C[C@H](n3cccn3)C2)c1 2183664010 BCGWNUDVGGRIAS-RBSFLKMASA-N 447.114 4.542 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)[C@@H](C)CBr)c(Br)c1 2212711182 GCFZHVZHLKTYAO-ZDUSSCGKSA-N 441.163 4.884 50 10 IJGE F[C@H]1C[C@H](Br)CN(Cc2cc(Br)ccc2Br)C1 2213905862 FXTOXDYWYKSJGK-QWRGUYRKSA-N 429.953 4.519 50 10 IJGE C[C@@H]1C[C@]1(F)CO[C@](C)(CI)c1ccccc1Br 2219942500 LSWQOWYQPZUWKJ-HONMWMINSA-N 427.095 4.864 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C)CCC[C@@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 2241896366 GUUIGLGGKMWBBB-LPMFXHHGSA-N 435.403 4.606 50 10 IJGE CCN(CC1(CBr)CC(F)C1)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2265632002 JLNLUPZLDOBTJU-UJSOSYCASA-N 433.406 4.752 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@H](Br)C2(CCC2)C1 2282987713 HOCUTDJVRNFKGE-LBPRGKRZSA-N 425.523 4.631 50 10 IJGE C[C@H]1CC[C@@H](CBr)N(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282987913 KQVZLCZGCGKEHN-IUCAKERBSA-N 427.539 4.877 50 10 IJGE CC1([C@H](Cl)c2cc(Br)ccc2OCc2ccccc2)CS(=O)(=O)C1 2299525217 LQEWUHARSXUQAY-QGZVFWFLSA-N 429.763 4.743 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1Cc1cc(I)ccc1Cl 2307320779 WIMCSEBZMSAEAV-NOZJJQNGSA-N 428.539 4.692 50 10 IJGE CCCN(C[C@@]1(CBr)CC1(F)F)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2326918531 AEICGJDQWJKPAB-YOEHRIQHSA-N 425.358 4.518 50 10 IJGE CCCCCOc1ccc(C=C(C#N)c2nc(O)c3cc(OC)c(OC)cc3n2)cc1OC 2331039517 KRPVJQDVWJPLOX-UHFFFAOYSA-N 449.507 4.994 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)c3ccc4c(c3)C(=O)N(C(C)C)C4=O)n2)cc1 2331273848 VWAMUUHPYRRBDI-UHFFFAOYSA-N 445.500 4.773 50 10 IJGE COC(=O)c1ccc(C=CC(O)=C(C#N)c2nc(-c3ccc4c(c3)OCCO4)cs2)cc1 2331331061 UOZKPJZGQCTLBG-UHFFFAOYSA-N 446.484 4.874 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1 2340266720 BFLXZTXDMBTXGF-HRAATJIYSA-N 435.793 4.954 50 10 IJGE ClCCC1(NCc2ccc(Cl)cc2I)CCSCC1 2341053833 ZMGZFARZABSKFN-UHFFFAOYSA-N 430.182 4.929 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccccc1C(F)(F)F 2343418055 KKDSHWGKSOBSGZ-OAHLLOKOSA-N 430.264 4.806 50 10 IJGE Clc1cc(Br)c(CN2CC3(CCOCC3)[C@@H]2CBr)s1 2352873445 JPVLCAWBJSMZLL-NSHDSACASA-N 429.605 4.540 50 10 IJGE CC[C@H](Oc1ccccc1[C@@H](C)CC)C(=O)NNC(=O)COc1cccc2ccccc12 10683593 VWCLHBSXQZYSGW-AVRDEDQJSA-N 434.536 4.737 50 10 IJGE CC(C)CC(=O)Nc1ccc(C(=O)NNC(=O)c2sc3ccccc3c2Cl)cc1 12493962 MFBSVHQLRABRBI-UHFFFAOYSA-N 429.929 4.614 50 10 IJGE CC(C)c1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(OCc3ccccc3)cc2)cc1 14040295 VOABYNMJMMRSBA-IBGZPJMESA-N 432.520 4.618 50 10 IJGE CCCCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccco1 38657573 ABFMHXDGEGRMCQ-HSZRJFAPSA-N 430.460 4.896 50 10 IJGE COc1ccc([C@@H](Br)c2ccc(I)cc2)c(OC)c1 104045232 QACFWPFYTIXXTI-HNNXBMFYSA-N 433.083 4.793 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2Br)CC[C@@H]1Br 167754232 MNMZEMUHLNUMDD-KCJUWKMLSA-N 429.074 4.713 50 10 IJGE CC[C@H](NC(=O)c1cc(Br)sc1Br)[C@H](Br)CC 313125242 VKWBVNKSVXRVMA-SFYZADRCSA-N 448.018 4.955 50 10 IJGE C[C@H](CCCBr)CNC(=O)c1cc(Br)ccc1Br 384363484 IEFVMKDMRVFUQF-SECBINFHSA-N 441.989 4.753 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1C(=O)c1cc(Br)sc1Br 399489601 SPPCRFYVZLEPNV-RNFRBKRXSA-N 446.002 4.661 50 10 IJGE C[C@H]1[C@@H](C)N(c2ccc([N+](=O)[O-])cc2CBr)C[C@@H](C)N1Cc1ccccc1 404258186 BYONFXINWGIMBX-IXDOHACOSA-N 432.362 4.977 50 10 IJGE C[C@@H](Br)CCCNC(=O)c1scc(Br)c1Br 705510144 IEJQSEXPJNDZFQ-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNc1cc(F)c(F)cc1F 734551953 DMLJRLJIEYITQL-KRWDZBQOSA-N 448.272 4.699 50 10 IJGE O=C(CSc1nnc(-c2ccco2)n1C1CCCCC1)NNc1cccc(F)c1F 768159112 JGTZZHOSYBNAQG-UHFFFAOYSA-N 433.484 4.557 50 10 IJGE CN(C(=O)c1ccc(C(=O)Oc2ccc([N+](=O)[O-])c3ncccc23)cc1)c1ccccc1 770131358 QWCPERSKRRAHRV-UHFFFAOYSA-N 427.416 4.639 50 10 IJGE CC(C)n1cnnc1-c1ccccc1NC(=O)NNc1ccc(C#N)cc1C(F)(F)F 799406145 ZVBXGRSMDDHRAL-UHFFFAOYSA-N 429.406 4.565 50 10 IJGE Cc1cc(C=NNC(=O)C(=O)Nc2ccc(F)cc2)c(C)n1-c1cc(Cl)ccc1Cl 1084504056 YPGPEECYFJUGSN-UHFFFAOYSA-N 447.297 4.629 50 10 IJGE C#CCCCC(=O)NNC(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1C 1215430090 IUCAHBMVEUVSMP-UHFFFAOYSA-N 435.503 4.688 50 10 IJGE CC(=O)c1cc2c(cc1NC(=O)/C(C#N)=C\c1cc(C)n(-c3cccc(C)c3)c1C)OCO2 1353027623 QFZUZUDUNGEKTQ-JMIUGGIZSA-N 441.487 4.880 50 10 IJGE Cc1ccc(CNC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2C)CCC3)cc1 1772743705 JQADTICBICZBID-UHFFFAOYSA-N 429.520 4.605 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2)[C@H]1c1ccc(Cl)cc1 1865682968 BZXUFSPTGVUTDO-INIZCTEOSA-N 430.817 4.822 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2-c1ccccc1 1865702858 GXOVYDQXOJYFAO-GOSISDBHSA-N 440.425 4.898 50 10 IJGE CCc1ccc(-c2csc(/C(C#N)=C(\O)[C@@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1 1872744284 KWSRXCYLPROIJB-DIGCTUSJSA-N 429.501 4.850 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCN(Cc2ccccc2)C(C)(C)C1 1881488955 CQPNQBHHUXHHQV-QZTJIDSGSA-N 425.411 4.965 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C(C)(C)C(=O)NCC2CC(Br)C2)cc1 1887793143 HCLBXGKAZCQBIF-UHFFFAOYSA-N 425.367 4.601 50 10 IJGE CCC[C@@]1(C(=O)N(C)C[C@H]2C[C@@H](Br)C2)CCCCN1C(=O)OC(C)(C)C 1887828821 BAGDIHBZEJZRRJ-YRNRMSPPSA-N 431.415 4.578 50 10 IJGE O=S(=O)([C@H]1CC[C@@H](CBr)C1)N(Cc1ccccc1)Cc1cccs1 1908084811 VLJWKEBWDRUKKN-AEFFLSMTSA-N 428.417 4.644 50 10 IJGE Brc1cccc(Br)c1C[C@H]1CCOCC[C@@H]1Br 2001024584 TUDTUGKQUXOYNZ-KOLCDFICSA-N 426.974 4.944 50 10 IJGE CCCCCN1C(=O)C(=C(C#N)C(=O)Nc2cc(C)nn2-c2ccccc2)c2ccccc21 2040469344 NMOBNOQWGDIUGP-UHFFFAOYSA-N 439.519 4.633 50 10 IJGE CCCC(CBr)(CCC)CN=[S@@](C)(=O)C1CN(C(=O)OC(C)(C)C)C1 2044697214 SHEDOTAOCTUNFX-VWLOTQADSA-N 439.460 4.685 50 10 IJGE C[C@H]1CCCN(c2ncc(I)cc2Br)[C@H]1CCCl 2069527302 BDOXWSXEPSRBQB-CABZTGNLSA-N 443.554 4.683 50 10 IJGE Fc1cc2nc(CCl)n([C@@]34C[C@H]3CN(Cc3ccccc3)C4)c2cc1Br 2099678578 JQDNOAUTVVMUGW-VBKZILBWSA-N 434.740 4.908 50 10 IJGE O=C(NC1(CCl)CC2(CCC2)C1)c1cc(Br)sc1Br 2107263821 MGBYEDSUEVBHHV-UHFFFAOYSA-N 427.589 4.945 50 10 IJGE CC1(C)COC[C@@H](COc2c(Br)cc(Cl)cc2CBr)O1 2145715233 VGLYRCAXSMVHSN-NSHDSACASA-N 428.548 4.570 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](N(C(=O)c2ccc(CBr)cc2)C2CC2)C1 2162875357 BKNNEKHVVNRKAY-SFHVURJKSA-N 437.378 4.586 50 10 IJGE Fc1cncc(N2CCC[C@@]3(CCCN(Cc4ccccc4)C3)C2)c1CBr 2163305471 DTVDXTQQYYWGQH-JOCHJYFZSA-N 432.381 4.998 50 10 IJGE CC(C)(C)OC(=O)N1CC2(CCOCCN2CCCCCCCCCBr)C1 2167623073 XSFDSWIWYAZBBN-UHFFFAOYSA-N 447.458 4.824 50 10 IJGE CC[C@]1(CBr)COCCN1Cc1ccc(Cl)c(Br)c1F 2169024572 APFBUQNNOOVTFL-AWEZNQCLSA-N 429.555 4.618 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CCCCCCBr)C[C@@H]1C(F)(F)F 2223283103 PAKRGWKXINRPSS-KBPBESRZSA-N 431.337 4.577 50 10 IJGE FC(F)(F)CC1(CCl)CCN(C[C@@H]2CC2(Br)Br)CC1 2224800444 HQHHBBIOHOUACD-VIFPVBQESA-N 427.530 4.766 50 10 IJGE Cc1ccc([C@H](Br)c2ccc3nc(O)[nH]c3c2)cc1I 2232832734 GIKVZRAHGOXZHH-AWEZNQCLSA-N 443.082 4.666 50 10 IJGE C[C@H]1CCCN(CCCCI)[C@@H]1CCCNC(=O)OC(C)(C)C 2243585949 IZBURZGFRDVWPO-JKSUJKDBSA-N 438.394 4.607 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CN(CCCCI)c2ccccc21 2248241989 QYLPDAGKALQPGN-OAHLLOKOSA-N 444.357 4.720 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CC23CCOCC3)cc1I 2269540742 HFFIXRUVMIOMLI-FZMZJTMJSA-N 437.115 4.553 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(CC3(CBr)CC(F)C3)CC2)C1 2280358696 GKJXQZCQNOZISV-MPQSDHOMSA-N 447.433 4.859 50 10 IJGE COC(=O)c1ccc(COc2ccccc2C=C(C#N)C(=O)Nc2ccccc2F)cc1 2297387985 DISMWXZYYXYYOT-UHFFFAOYSA-N 430.435 4.737 50 10 IJGE CCOc1cc(C=NNC(=O)CCc2ccccc2)ccc1OC(=O)C=Cc1ccccc1 2297454017 NNGHGWOWEJEUPC-UHFFFAOYSA-N 442.515 4.787 50 10 IJGE BrCCC[C@@H]1CCCCN1Cc1sccc1I 2301075050 YOJNJXJMPADLFA-NSHDSACASA-N 428.177 4.882 50 10 IJGE C[C@@H]1[C@H](CBr)CCN1Cc1ccc(Cl)cc1I 2302335130 BBRBLKRDNHHULB-ZJUUUORDSA-N 428.539 4.550 50 10 IJGE COc1c(Br)cc(C)c([C@H](N)[C@H]2C[C@H](Br)C2)c1Br 2317427350 VGXSATWAFHCOBJ-DNSOKLHBSA-N 441.989 4.702 50 10 IJGE O=C(NCCCCCCBr)c1ccc(Cl)cc1I 2317766486 MHDXMWSUUUVRQM-UHFFFAOYSA-N 444.538 4.630 50 10 IJGE COc1cc(NC=C(C#N)C(=O)Nc2ccc(Br)cc2)c(OC)cc1Cl 2324090731 DHNMEFKPOCHNAI-UHFFFAOYSA-N 436.693 4.578 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@]3(C)CN(C(=O)OC(C)(C)C)C[C@]3(C)C2)C1 2345011950 XSDIGNNKCPZULY-PMACEKPBSA-N 429.443 4.767 50 10 IJGE C#CCN(C[C@@](C)(CBr)C(C)(C)C)C1CCN(C(=O)OC(C)(C)C)CC1 2352080547 LUIWADCSCDCGIS-OAQYLSRUSA-N 429.443 4.768 50 10 IJGE Cc1ccc(N2C(N)=C(C#N)[C@H](c3ccc([N+](=O)[O-])cc3)C3=C2CC(C)(C)CC3=O)cc1 20367519 CEXBNCIARJUNKE-QFIPXVFZSA-N 428.492 4.844 50 10 IJGE CCc1ccc(O[C@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(C)o2)cc1 38659356 XQDYYWKVDYSKGK-VOIUYBSRSA-N 444.487 4.742 50 10 IJGE Cc1ccc(C(=O)NNC(=O)CCCc2c(-c3ccccn3)[nH]c3ccc(C)cc23)cc1 39852551 IQOPHZSRUKDFKR-UHFFFAOYSA-N 426.520 4.631 50 10 IJGE CCNC(=O)c1c(NC(=O)/C(C#N)=C\c2c(C)[nH]c3ccccc23)sc2c1CCCC2 40570686 VALQNKFGXSVOBO-QINSGFPZSA-N 432.549 4.712 50 10 IJGE Cc1c(C(=O)N2CCC(C)CC2)oc2c1/C(=N/NC(=O)c1ccc(Cl)cc1)CCC2 40811592 RQOWKIXDWRGNOG-XIEYBQDHSA-N 427.932 4.584 50 10 IJGE COc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4cccc(C)c4)c(C)c32)cc1 40813868 CJFTVKKAXXTAOL-NHFJDJAPSA-N 431.492 4.628 50 10 IJGE COc1ccc([C@H](Br)c2csc(I)c2)cc1OC 124406073 NWTYFLCXTNJPJU-ZDUSSCGKSA-N 439.112 4.854 50 10 IJGE COc1c(Cl)cc(/C=N/NC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cc1Cl 169928040 BJMYPVGYCKTEFZ-IPBDZQFASA-N 442.517 4.703 50 10 IJGE COc1cc(/C=N\NC(=O)Nc2ccccc2C)cc([N+](=O)[O-])c1OCc1ccccc1C 169940074 BFFHAEPTZWNXHM-QFEZKATASA-N 448.479 4.955 50 10 IJGE CCCCCOC(=O)c1ccc(NC(=O)/C(C#N)=C\c2ccc(OCC)c(OC)c2)cc1 206243733 YXRHQIXHDJVAAC-HKWRFOASSA-N 436.508 4.987 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3cccc(C)c3)cc2OCC)cc1 254412798 XOVRZFXGQAGRHO-UHFFFAOYSA-N 446.503 4.776 50 10 IJGE O=S(=O)(Nc1c(Br)cccc1Br)c1cccc(CCl)c1 312625138 YHFFTRVPFRJLBG-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE CC[C@H](NS(=O)(=O)c1cc(Br)c(C)cc1Br)[C@H](Cl)CC 313139856 HFWLCIQCBWSOIP-NEPJUHHUSA-N 447.620 4.594 50 10 IJGE O=S(=O)(c1ccc(Cl)c(CCl)c1Cl)N1CC[C@@H](OCc2ccccc2)C1 383924118 STQRXISWYPOXQG-CQSZACIVSA-N 434.772 4.712 50 10 IJGE O=S(=O)(Nc1cc(Br)ccc1Br)c1ccc(CCl)cc1 394412779 WMYLWGYPEASINZ-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE C[C@H]1[C@@H](C)N(c2nc3sccn3c2CBr)C[C@@H](C)N1Cc1ccccc1 404295731 WZWNLWBSRJJDBV-OWCLPIDISA-N 433.419 4.778 50 10 IJGE CCO[C@H](CO[C@@H](CI)c1ccccc1Br)C1CC1 703472121 VSLHKMRHWNFGOM-LSDHHAIUSA-N 439.131 4.757 50 10 IJGE COc1ccc(C(=O)NN=C/C=C(\C)CCC=C(C)C)cc1I 1084028548 FKNXGOPXHPSHSN-NLRSGHBVSA-N 426.298 4.708 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2ccccc2OCc2ccc(C)cc2)cc1 1084274710 HWCJAWXFOTXCSY-RUZDIDTESA-N 446.547 4.937 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2c(-c3ccc(Cl)cc3Cl)noc2C)c1 1176937417 LVXPJKXNSDNZRF-UHFFFAOYSA-N 445.331 4.570 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1)c1ccccc1 1469468774 NYHCDKYUHPMABQ-DEOSSOPVSA-N 443.547 4.694 50 10 IJGE CC(C)(C)OC(=O)Nc1cc(C(=O)NNc2nc3ccccc3[nH]c2=S)ccc1F 1633439507 KFNZOFARKKGLFM-UHFFFAOYSA-N 429.477 4.535 50 10 IJGE COc1cc(C(=O)NNc2nc3ccccc3[nH]c2=S)ccc1OCc1ccccc1 1641873921 GLKBKZWEEOGBPP-UHFFFAOYSA-N 432.505 4.637 50 10 IJGE C=CCCC1(CNC(=O)NNC(=O)c2ccc(Br)cc2Cl)CCCC1 1682691696 DGGJLBIREBAXEB-UHFFFAOYSA-N 428.758 4.573 50 10 IJGE CCCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccncc1)C(C#N)=C(N)O2 1865700271 OMDPWXOVITVYRX-SFHVURJKSA-N 426.307 4.745 50 10 IJGE CCCc1nn(-c2ccc(C)cc2)c2c1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865705947 KGNJDCKPLJBDGX-HXUWFJFHSA-N 449.898 4.913 50 10 IJGE CCOc1ccc(CCNC(=O)/C(C#N)=C/c2cccc(Br)c2)cc1OCC 1866131047 WIXPWGIVGZJMAV-LDADJPATSA-N 443.341 4.512 50 10 IJGE CCCC[C@H](NC(=O)c1cccc(-n2cccc2)c1)C(=O)Nc1ccc(SC#N)cc1 1866614833 ZZSHIPNTVUMLSF-QFIPXVFZSA-N 432.549 4.978 50 10 IJGE COc1ccc(C)cc1-c1csc(/C(C#N)=C(\O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)n1 1873921271 ZNZFUXMQWLXLDT-FCZGTTMTSA-N 445.544 4.969 50 10 IJGE CN(CC1CC(Br)C1)C(=O)CCc1cccc(NC(=O)OC(C)(C)C)c1 1887829677 MHDAGLMWXSPROR-UHFFFAOYSA-N 425.367 4.598 50 10 IJGE FC[C@H](Br)CCc1ccc(I)c(Br)c1 1893242100 VDVFCYSPNZMNJL-MRVPVSSYSA-N 435.900 4.719 50 10 IJGE O=C(c1cccc(I)c1)N(Cc1ccccc1)[C@H](CCl)C1CC1 1915210697 UAUJTCANVYQGGR-GOSISDBHSA-N 439.724 4.951 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)Cc1c(Br)cnn1C 1915299280 CFIUHJQWBXJPDR-MRXNPFEDSA-N 429.200 4.604 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1C(=O)c1csc(Br)c1Br 1945186180 CQSHCLRPWQYFCK-NKWVEPMBSA-N 446.002 4.661 50 10 IJGE CCn1cc(Br)c(CC(CBr)(CBr)C(C)C)n1 2010550166 NVXBNWCOOBBFFL-UHFFFAOYSA-N 431.010 4.640 50 10 IJGE C[C@H]1CCN(Cc2ccc(I)c(Cl)c2)C[C@@H]1Br 2026560973 OHSXJHICNRKRES-ONGXEEELSA-N 428.539 4.550 50 10 IJGE O=C(CBr)c1cc(Br)c(OC(F)(F)F)c(OC(F)F)c1 2054828589 YDNGSCWTJIWSSV-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE FC(F)(F)c1c(CCl)ccc(I)c1I 2060238197 CWWRKOHYSTYLKI-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE CCC(CC)(CBr)CN=[S@]1(=O)CCN(C(=O)OC(C)(C)C)CC1(C)C 2069025692 ONCUWSQSKKBSNY-VWLOTQADSA-N 439.460 4.685 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 2096805022 ZVJRBCQFGMUSHB-QWHZDKJVSA-N 431.765 4.544 50 10 IJGE CC(C)(C)OC(=O)NCCCC[S@@](C)(=O)=NC[C@@H](CBr)c1ccccc1 2110302296 IBTSWBJYBMNEKD-WGDIFIGCSA-N 447.439 4.568 50 10 IJGE CC(C)([C@H](Br)c1c(Br)cc(F)c(Cl)c1F)S(C)(=O)=O 2136966992 PCWDZNYOZLUCQE-SNVBAGLBSA-N 440.531 4.640 50 10 IJGE CC1(C)COC[C@@H](COc2c(Br)cc(Br)cc2CCl)O1 2145713657 DOMIJZXRPTUIKI-NSHDSACASA-N 428.548 4.523 50 10 IJGE BrCc1c(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)nc2sccn12 2148938549 JBCOFJOGHILEAI-ZWKOTPCHSA-N 445.430 4.639 50 10 IJGE COc1ccc(Br)cc1S(=O)(=O)N(Cc1ccccc1)C(C)(C)CCl 2220401683 ZJTMVQICHOUXSY-UHFFFAOYSA-N 446.794 4.666 50 10 IJGE Cc1ccc(C(=O)Nc2ccccc2CCBr)cc1I 2239244500 QGGBBPXYDMCQGG-UHFFFAOYSA-N 444.110 4.789 50 10 IJGE COc1cc(N(C)Cc2ccc(I)cc2)ccc1CBr 2280337501 NDZHHCROEXWTRT-UHFFFAOYSA-N 446.126 4.831 50 10 IJGE CN(C(=O)c1cc(Br)c(F)cc1Cl)[C@@H](CBr)CC1CC1 2285849051 UNAWDDDHEVMGKH-SECBINFHSA-N 427.539 4.877 50 10 IJGE C[C@@H](Sc1ccccc1)C(=O)NN=Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1 2297708715 JTAJEFTUAFEWRJ-QGZVFWFLSA-N 435.505 4.805 50 10 IJGE CC(C)[C@H](Br)CN(C)Cc1ccc(Cl)cc1I 2302325861 KVUNFHHWXNVWRE-GFCCVEGCSA-N 430.555 4.796 50 10 IJGE Clc1ccc(I)cc1COc1nc(CBr)cs1 2307200698 IEYFTYFUVIVXQQ-UHFFFAOYSA-N 444.519 4.875 50 10 IJGE CCCCOc1ccc(C=C(C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1OC 2314489139 OPFABGOVBWSYKE-UHFFFAOYSA-N 429.860 4.981 50 10 IJGE BrC[C@H]1C[C@@H]2C[C@H](C1)CN(Cc1sccc1I)C2 2320231704 HVVLOVKNZDHOFC-ZSBIGDGJSA-N 440.188 4.596 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2Cl)cc(Br)c1OC(C)C 2323078913 XQIRQKJLXGXGOK-UHFFFAOYSA-N 425.710 4.662 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc(Cl)c1O 2323608824 QAZTUARGLPKWIJ-UHFFFAOYSA-N 432.933 4.585 50 10 IJGE Cn1nc(C(F)F)c(CBr)c1Oc1ccccc1I 2339764792 LUVDKIGKUKCLII-UHFFFAOYSA-N 443.029 4.650 50 10 IJGE O=C(NC1CCCCC1)[C@H](c1ccc(F)cc1)N(CCc1ccccc1)C(=O)CCl 3037406 VFBVCNZAMOXNAW-QHCPKHFHSA-N 430.951 4.626 50 10 IJGE CC[C@@H](C)c1ccccc1OCC(=O)NNC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 13980336 YBVNWALWQPDDRT-KGLIPLIRSA-N 439.339 4.501 50 10 IJGE N#C/C(=C/c1ccccc1[N+](=O)[O-])c1nc(-c2cc3cc([N+](=O)[O-])ccc3oc2=O)cs1 33398803 WQVAQFABKUFXCH-AUWJEWJLSA-N 446.400 4.797 50 10 IJGE O=C(NNc1ncnc(Nc2ccc(Oc3ccccc3)cc2)c1[N+](=O)[O-])c1ccccc1 40657372 VGBXYXZRBQURFP-UHFFFAOYSA-N 442.435 4.678 50 10 IJGE COc1cc(/C=N/NC(=O)COc2cc(C)ccc2C)ccc1OCc1ccccc1C 40911569 JWPLGSIFAHRXHQ-JFLMPSFJSA-N 432.520 4.729 50 10 IJGE N#C/C(=C\c1ccc(OC(=O)/C=C/c2cccc(Cl)c2)cc1)C(=O)NCc1ccco1 40945476 HWMZQNYRUTXTKJ-UQNIYPKTSA-N 432.863 4.775 50 10 IJGE N#C/C(=C/c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)C(=O)NC[C@@H]1CCCO1 59297325 ATZUATLKZLYPMV-DDYRAIOVSA-N 431.319 4.775 50 10 IJGE COc1cc(Cl)c(/C=N/NC(=O)CCCOc2ccc(Cl)cc2Cl)cc1OC 66202188 HYQYMJQAKWCOQK-FOKLQQMPSA-N 445.730 4.973 50 10 IJGE C[C@H](Br)[C@](Br)(CBr)C(=O)Oc1ccc(Cl)cc1 205782799 KTCDUXGRNCZTMN-WRWORJQWSA-N 449.364 4.557 50 10 IJGE CC(C)(CCCBr)CNS(=O)(=O)c1ccc(Cl)c(Br)c1 227947739 RSVVXLWHZRALJI-UHFFFAOYSA-N 447.620 4.582 50 10 IJGE ClCc1nc2cc(I)ccc2n1-c1cncc(Br)c1 311316688 DBAXRPLSUVNYMM-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)c1ccc(Cl)c(NC(=O)c2cccs2)c1 727759522 BIXCNDQMDUUAIP-UHFFFAOYSA-N 425.819 4.828 50 10 IJGE O=S(=O)(NCc1ccnc(OC(F)F)c1)c1ccc(S(F)(F)(F)(F)F)cc1 790437653 HRXBNJAKPNTUQJ-UHFFFAOYSA-N 440.362 4.819 50 10 IJGE Cc1onc(-c2cccc(Cl)c2Cl)c1C(=O)NNC(=O)c1cn(C)c2ccccc12 797702082 QIGXCNLYBQXQQC-UHFFFAOYSA-N 443.290 4.523 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2ccc(Br)cc2C)cc1)[C@@H]1C[C@@H]1C 1625067207 YSSOOWUPSLWPPP-ORAYPTAESA-N 431.334 4.667 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1ccccc1F)C(C#N)=C(N)O2 1865683514 LMZYWPCJVBSXKE-IBGZPJMESA-N 426.854 4.644 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)cc1OCC 1865688600 WBZVNVZSMVSUPG-HSZRJFAPSA-N 430.508 4.586 50 10 IJGE Cc1ccc(C)c(-c2csc(/C(C#N)=C(\O)CCN3C(=O)c4ccccc4C3=O)n2)c1 1872750117 XHZHWHFGYVDYBO-VZCXRCSSSA-N 429.501 4.906 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)[C@@H]3CC(=O)N(C(C)(C)C)C3)n2)c(C)c1C 1872753993 XPCRDBPXJZWZKY-OVFHLDOESA-N 425.554 4.875 50 10 IJGE COc1ccc(/C=N/NC(=O)c2cccnc2)cc1OCc1ccc(Cl)cc1Cl 1873498458 OCYRBVDONNJANF-OPEKNORGSA-N 430.291 4.740 50 10 IJGE C[C@@H](NC(=O)c1ccc(OCc2ccccc2)cc1)c1nnc(CBr)s1 1877570948 LPMQJMAIVYJORZ-CYBMUJFWSA-N 432.343 4.503 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Cl)CCc1cccc(Br)c1Cl 1905406111 RKUKMIYCVWVFGP-LBPRGKRZSA-N 427.125 4.939 50 10 IJGE CC(C)CCN(CCBr)S(=O)(=O)c1c(Cl)cccc1Br 1924442193 MNZQDLYAASIMDJ-UHFFFAOYSA-N 447.620 4.534 50 10 IJGE CN(N[C@@H]1[C@@H](CNC(=O)OC(C)(C)C)CCCC12CCC2)C(=O)OCc1ccccc1 1924832731 SRFXOQHXWYPTPP-WOJBJXKFSA-N 431.577 4.623 50 10 IJGE Brc1cccc(Br)c1[C@H]1CC[C@@H](CI)O1 1931393614 BJPZZFPHTQEYAV-OIBJUYFYSA-N 445.920 4.867 50 10 IJGE CC(C)CN(CCBr)C(=O)c1csc(Br)c1Br 1948620067 UWLZSXZVXGNRBN-UHFFFAOYSA-N 448.018 4.766 50 10 IJGE CO[C@@H](C)CCOc1c(Br)cc(Br)cc1CBr 2001107135 XJKQORUMDPOAAF-QMMMGPOBSA-N 430.962 4.910 50 10 IJGE ClCC[C@@H]1CCC[C@@H]1Nc1ncc(I)cc1Br 2015765378 FPIUAWWSAZWPMX-KWQFWETISA-N 429.527 4.658 50 10 IJGE BrC[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccc(Br)cc1Br 2039488786 VKWFBCZEBNKPIY-ZKYQVNSYSA-N 438.001 4.959 50 10 IJGE CCC[C@H](CBr)CN1CC[C@H](C(F)(F)F)[C@@H](NC(=O)OC(C)(C)C)C1 2044695253 BQYJYYPQCMBHKN-RDBSUJKOSA-N 431.337 4.575 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Cl)c2)[C@H](C)C[C@H]1Br 2086659017 SHJCNJWMTPQLKX-CKYFFXLPSA-N 442.566 4.938 50 10 IJGE C[C@@]1(Cn2c(CCl)nc3cncc(Br)c32)CCCN1Cc1ccccc1 2095446265 SKHYYLNVJFAMGP-FQEVSTJZSA-N 433.781 4.987 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CCN(C[C@@H](Br)C(F)(F)F)c2ccccc21 2106782857 USZCNWMVQDUCHK-IUODEOHRSA-N 437.300 4.831 50 10 IJGE CN(C(=O)OC(C)(C)C)C1(C)CCN(C[C@@H](CBr)c2ccccc2)CC1 2106787844 KZDITCJCEMYVSU-GOSISDBHSA-N 425.411 4.887 50 10 IJGE C[C@@]1(CCl)CC(F)(F)CN1C(=O)c1cc(Br)ccc1Br 2159054493 MLWZUXZYPOLOJP-LBPRGKRZSA-N 431.502 4.690 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc2c(c1)CCCN2CC1(CBr)CCOCC1 2163059399 SQCXVHPCXWKZSH-UHFFFAOYSA-N 439.394 4.978 50 10 IJGE CCCC[C@@H](C)N(C)S(=O)(=O)c1ccc(CBr)c(Br)c1 2179950123 FPNSIXRVGNUHPS-LLVKDONJSA-N 427.202 4.543 50 10 IJGE COc1cc(F)c(Br)cc1[C@@H](Cl)c1c(C)nn(C)c1Br 2185751821 SDTXSTUYUNGEFS-GFCCVEGCSA-N 426.511 4.729 50 10 IJGE CC(C)(C)[C@@H]1C[C@H](CBr)CN(C[C@H]2CC2(Br)Br)C1 2218004261 BLQRCNMSLGRRNF-IJLUTSLNSA-N 446.065 4.872 50 10 IJGE Cc1sc(C(=O)N2CC[C@@H](Br)C(F)(F)CC2)c(Br)c1C 2237631075 DQSDYUSQXMLYFY-SECBINFHSA-N 431.140 4.762 50 10 IJGE CC(C)OC(=O)c1c(NC(=O)C(C#N)=Cc2ccc([N+](=O)[O-])cc2)sc2c1CCCC2 2296818992 ITWQQRUAYREYIU-UHFFFAOYSA-N 439.493 4.646 50 10 IJGE COc1cc(C=C(C#N)C(=O)N(C)C)c(Br)cc1OCc1ccccc1Cl 2313567607 ITWXQMXHYJHASM-UHFFFAOYSA-N 449.732 4.685 50 10 IJGE CCOc1ccc(CCNC=C(C#N)C(=O)Nc2cccc(C(F)(F)F)c2)cc1OCC 2324407452 XOKABUKNOVTOQX-UHFFFAOYSA-N 447.457 4.681 50 10 IJGE COc1ccc(CC(O)=C(C#N)c2nc(-c3ccc(OC)c(OC)c3OC)cs2)cc1 2331411986 ZIHWQXUKOFEVHZ-UHFFFAOYSA-N 438.505 4.880 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@H]1CCCC[C@@H]1C(F)(F)F 2343417127 VPBLMEYKWDLHQP-ULQDDVLXSA-N 436.312 4.842 50 10 IJGE CCCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2351888861 LNSDIWQJRGFPMM-CRAIPNDOSA-N 439.385 4.908 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CBr)OCc1cccc(CC(F)(F)F)c1 2353124007 PJWFXYGQWDAAMA-QGZVFWFLSA-N 440.300 4.986 50 10 IJGE C[C@@H](Cl)CN(C(=O)c1cc(Cl)ccc1I)C1CCCC1 2368857313 GYQOJIHMPZWHIR-SNVBAGLBSA-N 426.125 4.957 50 10 IJGE CC(C)c1ccc(OCC(=O)N/N=C/c2ccc(F)cc2Cl)c(Br)c1 14014550 RMCJHXXXFGNXIZ-LSFURLLWSA-N 427.701 4.894 50 10 IJGE COc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCc3ccc(C(=O)O)cc3)cc2)cc1 33409333 QCGYUCABEPBSDF-XSFVSMFZSA-N 428.444 4.518 50 10 IJGE CCCc1cc(C(=O)OC)c(NC(=O)/C(C#N)=C\c2c[nH]nc2-c2ccc(C)cc2)s1 34983479 XLQFFURHWLFJMT-YBEGLDIGSA-N 434.521 4.731 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)cc2/C=C(/C#N)C(=O)NCc2ccco2)cc1C 35123768 YUZZHETUPKPIJW-ZHZULCJRSA-N 438.487 4.673 50 10 IJGE O=[N+]([O-])c1cc(CBr)ccc1OCc1ccc(I)cc1 115901807 QPJQSNRTHQSKCN-UHFFFAOYSA-N 448.054 4.673 50 10 IJGE O=C(NCCCCCCBr)c1ccc(I)c(Cl)c1 236035569 YXYGWIDFTLUKIE-UHFFFAOYSA-N 444.538 4.630 50 10 IJGE C/C(C=NNC(=O)c1ccc(C(=O)NN=C/C(C)=C\c2ccccc2)o1)=C/c1ccccc1 252599398 DIJFCQHYJVBWTA-ZHNUIDLLSA-N 440.503 4.918 50 10 IJGE CN(Cc1ccccc1)CC(C)(C)n1c(CCCl)nc2cc(Br)cnc21 379609529 NVZCZXNTXZSIGO-UHFFFAOYSA-N 435.797 4.842 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CBr)[C@H](c2ccc(Br)c(O)c2)C1 382673325 GEWMQEMTOOHNRI-RYUDHWBXSA-N 435.156 4.500 50 10 IJGE O=S(=O)(c1cc(CCl)c(Cl)cc1Cl)N1CC[C@@H](OCc2ccccc2)C1 383912179 PQWIKGGYHJWDLY-OAHLLOKOSA-N 434.772 4.712 50 10 IJGE CC(=NNC(=O)CSc1nc2ccccc2n1Cc1ccc(Cl)cc1)c1ccco1 585656433 DCQUBLPWBODXKH-UHFFFAOYSA-N 438.940 4.964 50 10 IJGE CC(C)N(C[C@@H](C)Br)C(=O)c1cc(Br)cc(Br)c1 691343099 HYNFVBABWXWSPP-SECBINFHSA-N 441.989 4.846 50 10 IJGE CCC[C@@H](CCBr)NC(=O)c1ccc(Br)cc1Br 716856204 RHTJCOKTQPDESP-JTQLQIEISA-N 441.989 4.895 50 10 IJGE CCCc1nc(COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cs1 728312932 AEMYANSXCYHDNN-PDGQHHTCSA-N 431.521 4.523 50 10 IJGE O=C(Nc1ccccc1S[C@@H](Cl)C(F)(F)F)N[C@@H]1CCN(c2ccccc2)C1=O 731751928 JRQAJMHAMBZITD-RHSMWYFYSA-N 443.878 4.833 50 10 IJGE CCOc1ccc(C=NNC(=O)c2cc3cc(Br)ccc3o2)cc1OCC 1083972511 CKRMGCIOBHKKAM-UHFFFAOYSA-N 431.286 4.757 50 10 IJGE C#Cc1cccc(NC(=O)CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)c1 1628196510 LLUYSGHOGPCFQT-UHFFFAOYSA-N 427.620 4.573 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2ccccc2NCc2ccccc2Cl)c1 1637299210 OCYCIUZLGLMFCE-UHFFFAOYSA-N 434.952 4.565 50 10 IJGE Cc1c(C(=O)NCc2ccccc2Cl)oc2c1C(=NNC(=O)c1ccccc1)CCC2 1772745261 WKODKIVOALPQPH-UHFFFAOYSA-N 435.911 4.642 50 10 IJGE COc1cc(C=NNC(=O)COc2cc(C)cc(C)c2C)ccc1OCCc1ccccc1 1772753610 ULORVZJNWISENU-UHFFFAOYSA-N 446.547 4.771 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@H]1c1ccccc1 1865680183 AYQBPOXULBMVHA-INIZCTEOSA-N 430.817 4.822 50 10 IJGE CCCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccccn1)C(C#N)=C(N)O2 1865700559 XKGNAUHSMQSDIJ-SFHVURJKSA-N 426.307 4.745 50 10 IJGE CCCc1nc(Nc2ccc(SC#N)cc2)cc(N2CCN(c3ccccc3)C(=O)C2)n1 1868389475 VUGWPJBCGOZDBC-UHFFFAOYSA-N 444.564 4.599 50 10 IJGE COc1cc(/C(O)=C(\C#N)c2nc(-c3ccc(F)cc3F)cs2)c([N+](=O)[O-])cc1OC 1872818018 JABBLUIGMLUBGU-UYRXBGFRSA-N 445.403 4.964 50 10 IJGE Cc1ccc(S(=O)(=O)N(CCCBr)Cc2ccccc2)c2cccnc12 1914647998 NMBLWZLBDXZDBG-UHFFFAOYSA-N 433.371 4.519 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)S(=O)(=O)c1ccc(Cl)c(F)c1Cl 1916332844 LMAPNCQCXMAAPF-CYBMUJFWSA-N 440.751 4.577 50 10 IJGE C[C@](CBr)(NC(=O)c1cc(Br)sc1Br)C1CC1 1942791428 FBZZBXHYYRCRNI-LLVKDONJSA-N 446.002 4.567 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)C(=O)c1c(Cl)cccc1Br 2003557895 MGUOXOAIPHMGIO-AWEZNQCLSA-N 431.157 4.999 50 10 IJGE CC(C)[C@H]1[C@@H](Br)CCN1c1ncc(Br)cc1Br 2011341943 QGDCOKISYBSLPH-ONGXEEELSA-N 426.978 4.605 50 10 IJGE O=C(N[C@H]1CC[C@@H](CBr)C1)c1cccc(Br)c1Br 2031482291 QKSDVOSGBJSLOC-BDAKNGLRSA-N 439.973 4.505 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CCC([C@@H](F)CBr)CC1 2044829374 FYHODJIQEXJMOI-KRWDZBQOSA-N 426.351 4.912 50 10 IJGE Cc1c(Br)sc([C@@H](Cl)[C@@H]2CCn3ncnc3C2)c1Br 2108968480 HQSZIJSWHRGJRJ-XCBNKYQSSA-N 425.577 4.716 50 10 IJGE CN(c1ncc(Br)c(CCl)n1)[C@@H]1C[C@@H]2C[C@@H](OCc3ccccc3)C[C@@H]21 2134002223 WAOQWTYQAWOLND-CYJAXWMASA-N 436.781 4.798 50 10 IJGE Clc1cc(CBr)ccc1N1CC[C@H]2COC[C@@H](C1)N2Cc1ccccc1 2139651865 HZPXHAFCBKUEHZ-RBUKOAKNSA-N 435.793 4.715 50 10 IJGE CC(C)(C)[C@@H](CBr)CN1CCC([C@H]2CCCN(C(=O)C(F)(F)F)C2)CC1 2163065182 YDOUFENVEOSMMJ-HOTGVXAUSA-N 441.376 4.557 50 10 IJGE CC[C@H](Cl)[C@H]1CCCCN1C(=O)c1ccc(I)c(Cl)c1 2170618734 REUWDICRJBZZQC-SMDDNHRTSA-N 426.125 4.957 50 10 IJGE O=C(N[C@H](CBr)Cc1ccccc1)c1cc(Br)c(Cl)s1 2172565615 WTUMPEZBYGUHOK-JTQLQIEISA-N 437.584 4.900 50 10 IJGE FC1(F)[C@@H]2CC[C@H](O[C@@H](CI)c3cccc(Br)c3)[C@@H]21 2230328891 SYDVBOGKIHDCOG-MROQNXINSA-N 443.069 4.986 50 10 IJGE C[C@H]1C[C@H](Br)CCN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285846213 LJQSVJVLFYZMHM-DTWKUNHWSA-N 427.539 4.877 50 10 IJGE Cc1cccn2c(=O)c(C=C(C#N)c3nc4ccccc4s3)c(N3CCC(C)CC3)nc12 2297455813 AJHMKUJCFBEHCI-UHFFFAOYSA-N 441.560 4.913 50 10 IJGE C[C@@H](c1ccncc1F)[C@H](Br)c1cc(I)sn1 2304297462 GVNAQZKSMYSXTA-KGFZYKRKSA-N 427.080 4.522 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@H](Cc2ccccc2)C(=O)N1c1ccc(C(C)C)cc1 2314593037 GKFPLBFYKMGRQC-JOCHJYFZSA-N 431.561 4.538 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@@H](Br)[C@@H]1C1CC1 2327406803 MNLXPKXYCLRNDP-OCCSQVGLSA-N 440.550 4.692 50 10 IJGE Cc1ccc(-c2csc(C(C#N)=C(O)CCN3C(=O)c4ccccc4C3=O)n2)cc1C 2331382659 SUYLETNLAMXTDT-UHFFFAOYSA-N 429.501 4.906 50 10 IJGE CCCCO[C@@H]1[C@@H](Br)C[C@@H]1OCc1cccc(I)c1 2341609193 NQLNBUXGPHWKHQ-SOUVJXGZSA-N 439.131 4.529 50 10 IJGE CN(CC[C@@H](Br)c1cccs1)Cc1nn(C)c(Cl)c1Br 2365979347 ATWVAZBNMSRRTJ-SECBINFHSA-N 441.620 4.856 50 10 IJGE Cc1ccc([C@@H](C)NC(=O)/C(C#N)=C/c2c[nH]nc2-c2ccc(Br)cc2)cc1 2769819 DRAPYGDIGRDRPI-CLXYIWAZSA-N 435.325 4.932 50 10 IJGE O=C(CSc1nc2ccccc2s1)N/N=C(\C(=O)c1ccccc1)c1ccccc1 32519866 CCDMJMGDVBRKDR-QLYXXIJNSA-N 431.542 4.792 50 10 IJGE N#C/C(C(=O)Nc1ccccc1)=C1\S[C@H](Cc2ccccc2)C(=O)N1c1ccccc1 33783507 OHKVOWSLKADTAZ-FNBPXTNNSA-N 425.513 4.752 50 10 IJGE O=C([C@H](Cl)c1ccccc1)N1CCC2(CC1)SCC(=O)N2c1ccc(Cl)cc1 34924420 XQTSJYXPSTZKEU-LJQANCHMSA-N 435.376 4.719 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)Cc3ccccc3)ccc2[C@@H]1c1c(F)cccc1Cl 38680735 XFLJELHSGPKUSQ-QFIPXVFZSA-N 434.854 4.845 50 10 IJGE COc1ccc(C(=O)Oc2cccc(/C=N/NC(=O)c3ccc(C(C)(C)C)cc3)c2)cc1 48573597 KIRMYWKANLHKQI-WPWMEQJKSA-N 430.504 4.976 50 10 IJGE COC(=O)c1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3cccc(OC)c3)c2C)c1C 96476255 VSZBBTAHOQUKDA-MOSHPQCFSA-N 443.503 4.743 50 10 IJGE O=S(=O)(Nc1ccccc1CBr)c1ccc(Br)cc1Cl 136817707 RXOOMFCUSYMESQ-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE CC(C)OCCO[C@](C)(CI)c1ccccc1Br 162068238 LKRAYQJIXYRMEB-CQSZACIVSA-N 427.120 4.541 50 10 IJGE Cc1ccc(O[C@H](C)C(=O)NN=Cc2ccc(Cl)cc2Cl)c(Br)c1 256017629 XEKOOAUXNGNCRY-LLVKDONJSA-N 430.129 4.982 50 10 IJGE COc1cc(Cl)c([C@H](Br)c2cn(C)c(Br)n2)cc1Cl 698450029 AWUAIUSKVXRWCH-NSHDSACASA-N 428.939 4.982 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc3c4ccccc4n(C)c3s2)c1C 736693510 JEYSRCILRKCTNI-UHFFFAOYSA-N 428.521 4.619 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1cccc(Cl)c1SCC(F)F 756675305 BDHSAIPHKNATDF-UHFFFAOYSA-N 436.871 4.712 50 10 IJGE Cc1cc(F)ccc1NNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 1319369465 BCHACKSXBVFNRI-ATVHPVEESA-N 448.889 4.615 50 10 IJGE O=C(NNS(=O)(=O)c1cccc(Cl)c1)c1ccc(-c2ccc3ccccc3c2)s1 1860405366 KZQLKMFTYKEGEW-UHFFFAOYSA-N 442.949 4.845 50 10 IJGE CC(C)[C@H](CCNC(=O)OC(C)(C)C)CCC(=O)N(C)CC1CC(Br)C1 1887828812 AZRJJIMFZSVWPH-CGZBRXJRSA-N 433.431 4.586 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Cl)Cc1c(Br)ccc(Cl)c1F 1905370620 BNBUIOCMWVVJCW-VIFPVBQESA-N 431.088 4.688 50 10 IJGE CC(C)[C@@H]1[C@H](Br)CCN1c1ncc(Br)cc1Br 2011341942 QGDCOKISYBSLPH-MWLCHTKSSA-N 426.978 4.605 50 10 IJGE CN(CCN(C[C@H](CBr)C(C)(C)C)CC(F)(F)F)C(=O)OC(C)(C)C 2044699851 OKMLWAPWEULMTI-ZDUSSCGKSA-N 433.353 4.775 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1CN(C[C@@H](Br)C(F)(F)F)C1CC1 2044702032 XTIZRVSXWYNWLK-ZIAGYGMSSA-N 429.321 4.566 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)C(C)(C)C)C[C@H]1CC(F)F 2057192328 GCEXOOXQLVVDET-UONOGXRCSA-N 427.374 4.620 50 10 IJGE CCN(C[C@H](CBr)c1ccccc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2106784309 HTOLEKXCQBPEKQ-RBUKOAKNSA-N 425.411 4.887 50 10 IJGE N#Cc1cc(CBr)ccc1N1CCCN(Cc2ccccc2)CC(F)(F)C1 2152790728 PZAKIBKINWMEIJ-UHFFFAOYSA-N 434.328 4.801 50 10 IJGE O=C(NC[C@@]1(CBr)C[C@@H]1C(F)(F)F)c1ccccc1OCc1ccccc1 2192585218 ZJBONZFOVPSMRZ-HKUYNNGSSA-N 442.275 4.959 50 10 IJGE FCC12CC(COc3c(Br)cc(Cl)cc3CBr)(CO1)C2 2202753470 GECMCSXOZBCNIF-UHFFFAOYSA-N 428.523 4.895 50 10 IJGE Cn1cc(-n2c(CCl)nc3cc(Br)c(Br)cc32)c(Cl)n1 2238988066 CFIKAOZWUDMLTM-UHFFFAOYSA-N 438.938 4.676 50 10 IJGE CCCN(CCCCI)CC1CCN(C(=O)OC(C)(C)C)CC1 2243590803 KHRYGJBWLOZVFG-UHFFFAOYSA-N 438.394 4.561 50 10 IJGE CC1([C@@H](Br)c2cc3sc(Br)cc3s2)CS(=O)(=O)C1 2263632959 MSSVWGXMUMZUQE-JTQLQIEISA-N 430.208 4.596 50 10 IJGE C[C@@H]1CCCN(CC2(CBr)CC(F)C2)[C@H]1CCCNC(=O)OC(C)(C)C 2265638709 NPVOZFIWSOMYTQ-YJBCQJRQSA-N 435.422 4.905 50 10 IJGE C[C@@H]1CCC[C@@](CCl)(NC(=O)c2ccc(Cl)c(I)c2)C1 2283655791 KEQAUOHKWRBKKP-MEBBXXQBSA-N 426.125 4.862 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2c[nH]nc2-c2ccc(Br)cc2)cc1 2295672627 DHISOKMUVKKBLC-UHFFFAOYSA-N 437.297 4.784 50 10 IJGE CC1(C)[C@H](Cl)C[C@H]1OCc1ccc(I)c(Br)c1 2306296871 CAJXNKOBFVLVBL-VXGBXAGGSA-N 429.523 4.976 50 10 IJGE CC(C)(C)[C@@](C)(CBr)CN1CC2(CC(NC(=O)OCc3ccccc3)C2)C1 2307108790 HFHXGQZAVUPGFG-NRFANRHFSA-N 437.422 4.825 50 10 IJGE C[C@@]1(CBr)CCN(Cc2cc(I)ccc2Cl)C1 2307328632 PICZYCGKXUHLJQ-ZDUSSCGKSA-N 428.539 4.552 50 10 IJGE COc1ccc(C(=O)Oc2ccc(C=C(C#N)C(=O)Nc3ccc(C)cc3)cc2OC)cc1 2313631706 UPMBCXATWPULIT-UHFFFAOYSA-N 442.471 4.777 50 10 IJGE C=CCOc1ccc(C=C2C(=O)N(Cc3ccccc3Cl)C(=O)C(C#N)=C2C)cc1OC 2314620806 VKGOLCJLDKKETO-UHFFFAOYSA-N 448.906 4.706 50 10 IJGE Cc1c(F)ccc(CO[C@@H](CCl)[C@@H](I)CCl)c1Cl 2317183801 NJJQHVKSGAFZQB-QWRGUYRKSA-N 425.496 4.954 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2CC[C@@]1(CBr)C2 2327391429 KNABKZNHMFCHRS-HZMBPMFUSA-N 440.550 4.694 50 10 IJGE Cn1nc(Br)c([C@@H](Br)CCc2cc(Cl)cc(Cl)c2)n1 2341190742 SPSBWRWPQWTMLT-JTQLQIEISA-N 427.955 4.953 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@@H]1CC12CCC(F)(F)CC2 2343414821 TYOWYFCIKUAPQX-IRXDYDNUSA-N 430.333 4.689 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@]3(C)CN(C(=O)OC(C)(C)C)C[C@@]3(C)C2)C1 2345011949 XSDIGNNKCPZULY-BGYRXZFFSA-N 429.443 4.767 50 10 IJGE Cn1nc(C(F)(F)F)c(CBr)c1N1CC2(CC(OCc3ccccc3)C2)C1 2365282204 XNZQOIVJBSIJBK-UHFFFAOYSA-N 444.295 4.519 50 10 IJGE C[C@H]1[C@@H](C)N(c2c(CBr)c(C(F)F)nn2C)C[C@@H](C)N1Cc1ccccc1 2365337340 KCWWXWALZFGBKM-QLFBSQMISA-N 441.364 4.740 50 10 IJGE C[C@H](O[C@H](CCl)[C@H](I)CCl)c1cccc(OC2CC2)c1 2368478128 APPUQEVKIUDZTM-COLVAYQJSA-N 429.125 4.955 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NCc2ccco2)ccc1OC(=O)c1ccc(C(C)C)cc1 33332623 JXDQOAQUPPHQMI-FYJGNVAPSA-N 444.487 4.854 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccccc3)c(OCC)c2)C1=O 38603501 SJNADAFHOVQGNS-KGENOOAVSA-N 430.504 4.667 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Cl)c3ccc(Br)cc3F)cc2[nH]1 109883926 KLZCRNHASFXJNU-CYBMUJFWSA-N 434.490 4.849 50 10 IJGE CC(=NNC(=O)COc1cccc(C)c1C)c1cccc(NC(=O)c2ccc(C)s2)c1 252613512 JCMNEQXPDCLYDM-UHFFFAOYSA-N 435.549 4.845 50 10 IJGE CC(/C=C/c1ccccc1)=NNC(=O)c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1 254383532 ASMUQJIDNIXRLY-OYBDUZOJSA-N 433.533 4.615 50 10 IJGE O=C(CBr)c1c(Br)cc(OC(F)(F)F)cc1OC(F)F 575684942 JBNSMXHOMMKTCO-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE C[C@H]1CCCN(C(=O)c2ccc(I)c(Cl)c2)[C@H]1CCCl 697196109 YJZYKKCRHUUBDV-HZMBPMFUSA-N 426.125 4.814 50 10 IJGE O=C(NNc1ccnc2cc(Cl)ccc12)c1cc(O)nc2ccc(Br)cc12 738507257 ILLMIGSMZQPAIG-UHFFFAOYSA-N 443.688 4.661 50 10 IJGE O=C(NNc1nc(-c2ccc(Cl)cc2)no1)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 741220006 OSSUTURYNGWBOS-UONOGXRCSA-N 438.793 4.535 50 10 IJGE O=C(NCCc1cccs1)NNC(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1 746166631 BNUOKAREKPSSQQ-UHFFFAOYSA-N 433.892 4.520 50 10 IJGE O=C(NNc1cccc([N+](=O)[O-])c1)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 748004702 OLUQGCFGZYUMPM-UHFFFAOYSA-N 433.399 4.571 50 10 IJGE O=C(Cc1nc(-c2ccccc2)cs1)NN=C1CCCc2ncc(C(F)(F)F)cc21 777431691 AAXMZAUMYAAKCW-UHFFFAOYSA-N 430.455 4.623 50 10 IJGE CCC(=O)Nc1ccc(Cl)c(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1 799387015 HOVIVWOTBPQJSD-UHFFFAOYSA-N 425.798 4.728 50 10 IJGE Cc1ccc(-n2nc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c3c2CCCC3)cc1 799747553 DLEZQSLHFJDVEP-UHFFFAOYSA-N 439.441 4.707 50 10 IJGE N#Cc1ccc(NNC(=O)c2cccc(-n3ccc(C(F)(F)F)n3)c2)c(C(F)(F)F)c1 799749796 MWEJGXMJDBTMLU-UHFFFAOYSA-N 439.319 4.538 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1Br 1083997324 SYHSGQUZKMYPDO-WDZFZDKYSA-N 436.649 4.565 50 10 IJGE C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](O[Si](C)(C)C(C)(C)C)C1 1149155863 BXOPKCWSNYTNQD-CVEARBPZSA-N 433.065 4.645 50 10 IJGE CC(C)(C)OC(=O)Nc1ccccc1NS(=O)(=O)c1ccc(CBr)cc1 1260508540 QMJOVBVXYLVROJ-UHFFFAOYSA-N 441.347 4.729 50 10 IJGE C/C(=C\c1ccc(F)cc1)C(=O)NNc1c(Br)cccc1Br 1568131097 SBEVMBTZXJSQQF-MDZDMXLPSA-N 428.099 4.897 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2cc(Br)c3ccccc3c2)c1C 1610903227 MWACNUSYAYTXHZ-UHFFFAOYSA-N 448.324 4.828 50 10 IJGE CCc1nn(-c2ccc(C)cc2)c2c1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706110 NVWRYLMOPPZIKB-IBGZPJMESA-N 435.871 4.523 50 10 IJGE CCc1ccc(OCCCC(=O)NNC(=O)c2ccc(-c3ccc(CC)cc3)nc2C)cc1 1865758857 VHVKHCFVYXTEGV-UHFFFAOYSA-N 445.563 4.802 50 10 IJGE N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCCO2)c1nc(-c2ccc(F)c(F)c2)cs1 1872793320 UJXNCUMAWUNCNW-WLRTZDKTSA-N 427.388 4.832 50 10 IJGE Fc1cc(Br)c2nc(CCCl)n(-c3cnn(Cc4ccccc4)c3)c2c1 1912692005 BRMZOEYCVYHVBA-UHFFFAOYSA-N 433.712 4.953 50 10 IJGE O=C(NCCNC(=O)[C@@H](Cl)c1ccccc1)OCC1c2ccccc2-c2ccccc21 1956262757 YAUUBCCAYFNNNR-QHCPKHFHSA-N 434.923 4.621 50 10 IJGE Brc1cccc(CN2CCCC[C@H](Br)C2)c1Br 2003417221 LKCFEMGDMCTZBS-NSHDSACASA-N 425.990 4.961 50 10 IJGE O=S(=O)(c1ccc(CBr)o1)N(Cc1ccccc1)Cc1cccs1 2009660809 WZLUSAZYSGZLEY-UHFFFAOYSA-N 426.357 4.627 50 10 IJGE Cc1cc(Br)c(CBr)c(N(C)C[C@H]2C[C@@H]2Br)c1 2020222635 AYFVBLBVJLEXOX-KOLCDFICSA-N 425.990 4.872 50 10 IJGE Cc1cc(Br)c(CBr)c(N(C)C[C@H]2C[C@H]2Br)c1 2020222636 AYFVBLBVJLEXOX-MWLCHTKSSA-N 425.990 4.872 50 10 IJGE FC1(CBr)CCN(Cc2cccc(Br)c2Br)CC1 2039794784 MRXPKIGXJUFXGB-UHFFFAOYSA-N 443.980 4.911 50 10 IJGE COc1sc([C@H](Cl)c2nn(C)c(Cl)c2Br)cc1Br 2048155777 LXNGAPNEGAYMFO-ZETCQYMHSA-N 434.968 4.997 50 10 IJGE C[C@@H]1COc2ccc([C@@H](Br)c3cc(I)sn3)cc21 2056489771 GRBNTOMTNNDPBC-FUXBKTLASA-N 436.112 4.728 50 10 IJGE FC(F)Oc1cc(CBr)c(I)c(OC(F)(F)F)c1 2060222414 PNOYWWWTSWQATG-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE FC1(F)C(O[C@@H](CI)c2ccccc2Br)C1(F)F 2062577185 BODPTPDKNYYMQR-QMMMGPOBSA-N 438.984 4.595 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCCCC2)C[C@@H](Br)C(F)(F)F)C1 2106783839 CYIGYHMMLRKSST-OAHLLOKOSA-N 443.348 4.814 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CCN(CC3(CBr)CCCCCC3)C[C@H]2C1 2106784584 JQYDQPSIEAXDCV-MSOLQXFVSA-N 429.443 4.911 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@@H](CBr)C(C)(C)C)C[C@@H]1C(F)(F)F 2106786459 VAGFLZDHLMWPPF-MCIONIFRSA-N 445.364 4.679 50 10 IJGE COc1cccc(N2CCN(Cc3ccccc3)CC(F)(F)C2)c1CBr 2138410735 BXFCGRYSSBZZFK-UHFFFAOYSA-N 425.317 4.548 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2CCN(C[C@@H](CBr)c3ccccc3)C[C@@H]2C1 2163062281 KPULMVCZAXAOTJ-XUVXKRRUSA-N 437.422 4.744 50 10 IJGE CC(C)CN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2167030586 CTECFFVGNHWKQK-MSOLQXFVSA-N 445.442 4.824 50 10 IJGE CCCN(C(C)(C)C)S(=O)(=O)c1ccc(Br)c(CBr)c1 2179954054 JEQDKGXGLBJJEN-UHFFFAOYSA-N 427.202 4.543 50 10 IJGE O=C(c1ccc(Cl)cc1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Br)C2 2190677305 HVAWVKJZZHMMLJ-MHNYQROPSA-N 425.523 4.581 50 10 IJGE CC1(C)CN(c2ccc([N+](=O)[O-])c(CBr)c2)CCCN1Cc1ccccc1 2193719434 KGVMSNDFHANMCO-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE CCOCc1cc(Br)c([C@H](Br)c2nn(C)cc2Cl)s1 2224801673 AHRAPNVLOCJJQR-SNVBAGLBSA-N 428.577 4.918 50 10 IJGE F[C@H]1COCC[C@H]1n1c(CCl)nc2cc(Br)c(Br)cc21 2234073219 JEGSJHGWRRJIIF-GXSJLCMTSA-N 426.511 4.600 50 10 IJGE CCCN(C[C@H](C)Br)C(=O)c1csc(Br)c1Br 2250583588 XQLGAJXFBCZKBT-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE Cc1c(NC(=O)OC(C)(C)C)ccc(C(=O)N(C)CC2CC(Br)C2)c1C 2268159599 GCMJTEXEWLUFCW-UHFFFAOYSA-N 425.367 4.896 50 10 IJGE CC1(C)OC[C@H](Cc2ccc(Cl)cc2I)[C@@H]1Br 2302335864 JACRVIQDARPHGH-CABZTGNLSA-N 429.523 4.676 50 10 IJGE CC(C)[C@H]1C[C@H](Br)CN1c1ncc(Br)cc1Br 2304240418 WVZQMKYZQHLMDE-GXSJLCMTSA-N 426.978 4.605 50 10 IJGE CC(C)[C@@H]1[C@H](Br)CCN1Cc1ccc(Cl)cc1I 2318521908 MYDKHWYIZNTZPO-TZMCWYRMSA-N 442.566 4.938 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@H]2CC[C@H]1C[C@H]2Br 2362207824 UXHFNTUUSOCIIS-KHQFGBGNSA-N 425.523 4.630 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)[C@@H]1CO[C@H]2COC[C@H]12 2365229150 XBDCTFJNMHRVOG-WKRBSTNYSA-N 428.523 4.600 50 10 IJGE Cc1scc(C(=O)N2CCC(CBr)(C(F)F)CC2)c1Br 2369604881 QNCBIUZBUQESBT-UHFFFAOYSA-N 431.140 4.701 50 10 IJGE CCCCCOc1ccc(/C=N/NC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cc1 169928089 YVQWDUHKOGKVIQ-AUEPDCJTSA-N 429.735 4.957 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2cccc([N+](=O)[O-])c2)sc2c1CC[C@@H](C)C2 209405537 MAWXBNSRRRVNLD-NWFCWYBLSA-N 439.493 4.503 50 10 IJGE COc1cccc(C=NNC(=O)c2cc3cc(Br)ccc3o2)c1OC(C)C 252629309 UDGMQWCYKYQUBB-UHFFFAOYSA-N 431.286 4.755 50 10 IJGE CCOc1cc(C=NNC(=O)NC2CCCCC2)ccc1OCCOc1ccc(C)cc1 254576745 AKTFNTAIXSRLNW-UHFFFAOYSA-N 439.556 4.817 50 10 IJGE C[C@H](Br)[C@H](Br)[C@@H]1CC[C@@H](Br)[C@@H](Br)C1 256837861 GBWKXPCFLWAUOQ-ABRLLLAPSA-N 441.827 4.860 50 10 IJGE COc1ccc(CBr)c(OCc2ccccc2)c1I 398699988 VYYZBIFQQUIUHN-UHFFFAOYSA-N 433.083 4.774 50 10 IJGE Cc1sc(Br)cc1[C@@H](Br)c1c(Br)cnn1C 693048583 VPEJFWQVIJGENK-SECBINFHSA-N 428.975 4.799 50 10 IJGE O=C(NNc1nc(-c2ccncc2)no1)/C(=C/c1ccc(Cl)cc1)c1ccc(F)cc1 732065851 YSSBJTADGPNMMH-CPNJWEJPSA-N 435.846 4.608 50 10 IJGE COc1cc(NC(=O)OC(C)(C)C)c(Cl)cc1C(=O)NNc1ccc(F)c(F)c1F 743332010 HODGJSVGUTUXAP-UHFFFAOYSA-N 445.825 4.870 50 10 IJGE CCc1cc(SC#N)cc(CC)c1NC(=O)CCn1cnc2sc(C)c(C)c2c1=O 748670936 ZNJQVWHKDAJJSD-UHFFFAOYSA-N 440.594 4.802 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2cc3c(cc2Cl)OCCCO3)c(C(F)(F)F)c1 799382104 GERSNJGNNVDVSA-UHFFFAOYSA-N 426.782 4.540 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc3sc(N4CCCC4)nc3s2)c(C(F)(F)F)c1 799752468 MFJWUSORRTZHSY-UHFFFAOYSA-N 437.472 4.605 50 10 IJGE CC(=O)c1ccc(Br)c(NC(=O)NNc2ccccc2OC(F)(F)F)c1 1219895740 UDSLBQWCZUYBEK-UHFFFAOYSA-N 432.196 4.699 50 10 IJGE C=C(C)C[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc3ccccc23)c1C)C(=O)OC 1535097234 AESMHMVKRNQWGP-NLZIUFDSSA-N 441.531 4.778 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCc3cc4ccccc4nc3O)c2C)c1 1586632878 GDRZVZMUZMHDOX-HYARGMPZSA-N 436.515 4.880 50 10 IJGE N#CC1=NN(c2ccccc2)[C@H](c2ccccc2)[C@@H]2[C@@H]1OC(N)=C(C#N)[C@@H]2c1ccccc1 1616047637 XEYUYBYGHLJCJG-BKKFENPESA-N 431.499 4.620 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@@H]1c1ccccc1 1865680184 AYQBPOXULBMVHA-MRXNPFEDSA-N 430.817 4.822 50 10 IJGE COc1ccc(-c2nn(-c3ccccn3)c3c2[C@H](c2sccc2C)C(C#N)=C(N)O3)cc1 1865698867 FFJCBUJGZMHTCC-LJQANCHMSA-N 441.516 4.531 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)c3c2[C@H](c2cccc(F)c2)C(C#N)=C(N)O3)cc1 1865711340 VWMXSRQSYCITNQ-JOCHJYFZSA-N 438.462 4.905 50 10 IJGE CCN(CC)c1ccc(/C=N\NC(=O)c2ccc(-c3ccc(OC)c(OC)c3)nc2C)cc1 1865760771 NSLWYTXYDLXVMH-PKAZHMFMSA-N 446.551 4.684 50 10 IJGE Cc1ccc(C(=O)N(C)C[C@H]2C[C@H](Br)C2)c(NC(=O)OC(C)(C)C)c1C 1887829692 MJJIBQBAJWYAPE-SHTZXODSSA-N 425.367 4.896 50 10 IJGE O=C(NN(Cc1ccccc1)Cc1ccccc1)c1cc(=O)c(OCc2ccccc2)co1 1923810619 LAROZXASGQKCLN-UHFFFAOYSA-N 440.499 4.566 50 10 IJGE C[C@@H](Br)[C@@H]1CCN(Cc2cccc(Br)c2Br)C1 1943905256 FPWOBAFPUZLJKM-NXEZZACHSA-N 425.990 4.817 50 10 IJGE CC[C@H](CCCBr)NC(=O)c1scc(Br)c1Br 1948449664 NWQGJWRLBUUYOJ-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE CC1(C)C[C@@H](Br)CN1C(=O)c1scc(Br)c1Br 1949214258 HKKPRCVWDFPZQM-ZCFIWIBFSA-N 446.002 4.661 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@H](CI)O2)C[C@@H]1C1CC1 1990238796 GTDNOYDBPHDUCD-HDMKZQKVSA-N 435.346 4.539 50 10 IJGE C[P@@]1(=O)C[C@H](Cc2ccc(I)c(Cl)c2)[C@@H](Br)C1 2026559706 CPQUKMUPJVLUEA-FJHFEUQMSA-N 447.478 4.873 50 10 IJGE Brc1ccc(CN2CC[C@H](Br)C3(CC3)C2)c(Br)c1 2032265481 BFEYSHATNOEPGB-ZDUSSCGKSA-N 438.001 4.961 50 10 IJGE O=C(N[C@@H]1CC[C@@H](CBr)C1)c1c(Br)cccc1Br 2033091276 OYFCYVDNKOTMNP-RKDXNWHRSA-N 439.973 4.505 50 10 IJGE C[C@]12CN(Cc3c(Br)cccc3Br)C[C@]1(CBr)C2 2046802409 NJHQISQWCOHTQZ-UONOGXRCSA-N 438.001 4.819 50 10 IJGE F[C@H]1CCO[C@H]1COc1c(Br)cc(CBr)cc1Br 2058657254 XRMGIIKQHPYGJB-QWRGUYRKSA-N 446.936 4.612 50 10 IJGE CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)cc(F)c1F 2059311858 CBDVWIIWTDVPMT-ZDUSSCGKSA-N 432.330 4.849 50 10 IJGE C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C)[C@H](C)N1C[C@@H](CBr)c1ccccc1 2106788814 SVYYGBOWSDMZMZ-IMBTUZDBSA-N 425.411 4.883 50 10 IJGE CCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2110714205 AZIFTPBTDYQHMU-DLBZAZTESA-N 431.415 4.578 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](CN(C[C@@H](CBr)CC2CC2)C2CC2)C1 2112869923 XZADFSMDOJGTTK-ZWKOTPCHSA-N 429.443 4.909 50 10 IJGE Cc1sc(CCl)cc1S(=O)(=O)N(C)[C@H]1CC(C)(C)[C@@H]1OCc1ccccc1 2156441974 KHDXXMUVGITLSE-PKOBYXMFSA-N 428.019 4.800 50 10 IJGE Cc1cc(Br)c(C(=O)N(C)[C@H](CCBr)C(F)F)cc1Cl 2178508995 BPMJBITYSNLLIQ-LLVKDONJSA-N 433.518 4.902 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](Br)[C@H](OCc2ccc(Cl)cc2Cl)C1 2212516489 ODMSPLISTHWROF-GXTWGEPZSA-N 425.150 4.893 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1C[C@@H]2CC[C@@H]1C[C@H]2NC(=O)OC(C)(C)C 2241631270 VSBSKOSZELPMCK-YIDVYQOGSA-N 447.414 4.604 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCc2ccco2)ccc1OCCOc1cc(C)ccc1C 2293117078 TVHZVKXQTRDPSG-UHFFFAOYSA-N 446.503 4.586 50 10 IJGE CC(C)[C@@H](CBr)N(C)Cc1ccc(Cl)c(I)c1 2302493175 SKLZXYMBXOTIFN-CYBMUJFWSA-N 430.555 4.796 50 10 IJGE C[C@H]1C[C@H](Cl)CCN1Cc1ccc(I)c(Br)c1 2306221631 KNNBADUSWQKFFA-GXSJLCMTSA-N 428.539 4.645 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC=C(C#N)C(=O)Nc1ccc(Br)cc1 2324084628 WAZUHJNWNWSORX-OAHLLOKOSA-N 428.330 4.853 50 10 IJGE CCc1ccc(NC=C(C#N)C(=O)Nc2ccc(I)cc2C)cc1 2325406356 WSKHCGZLKRSUCZ-UHFFFAOYSA-N 431.277 4.620 50 10 IJGE C[C@@H](Br)[C@H]1CCCN(Cc2cc(I)ccc2Cl)C1 2327403114 LVGWVNVVWKCSGB-MNOVXSKESA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)Nc1nc2cc(NC(=O)[C@H]3C[C@H](Br)C3)ccc2s1 2328526079 QPHGHRLTTHBNQD-MGCOHNPYSA-N 426.336 4.755 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Br)c1ccc2c(c1)CCC2 2338722921 RPVNPBBJBUKNLX-NSHDSACASA-N 448.984 4.918 50 10 IJGE CCc1nn(CC2(CBr)CC(C)(C)C2)c(CC)c1I 2344984466 SOKPKHQUPYNHEL-UHFFFAOYSA-N 439.179 4.814 50 10 IJGE C[C@H](CC1CCN(C[C@@]2(CBr)CC2(F)F)CC1)N(C)C(=O)OC(C)(C)C 2351892751 TXNRFEVAXKVJFS-KDOFPFPSSA-N 439.385 4.764 50 10 IJGE FC(F)(F)[C@H]1C[C@@]1(CCl)CNCc1ccc(Cl)c(I)c1 2362371370 PTQTZARHQVTGQM-NWDGAFQWSA-N 438.058 4.842 50 10 IJGE CN(Cc1ccccc1)CC1CCN(c2c(CBr)c(C(F)F)nn2C)CC1 2365331404 GAWQDZZUSSWAHI-UHFFFAOYSA-N 441.364 4.601 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)cc1 13978939 LYLHAXXJCVGITG-UHFFFAOYSA-N 431.561 4.600 50 10 IJGE O=C(NNc1ncnc(NCc2ccc(Cl)cc2)c1[N+](=O)[O-])c1cccc2ccccc12 40657080 LXTSKDRCSZUQEW-UHFFFAOYSA-N 448.870 4.560 50 10 IJGE O=c1c2ccccc2nc(CCl)n1-c1cc(Br)ccc1Br 49121912 SVMLYPKCUUNEHO-UHFFFAOYSA-N 428.511 4.650 50 10 IJGE C/C(=N\NC(=O)CCCSc1nc2ccccc2n1C)c1ccc(Br)cc1 58990949 ZNIZXGDIPPQXPW-OEAKJJBVSA-N 445.386 4.749 50 10 IJGE O=C(NC[C@@H]1CCCC[C@@H]1CBr)c1c(F)cc(Br)cc1F 126942346 MTHVXDFHNKGBIH-ZJUUUORDSA-N 425.111 4.658 50 10 IJGE CCC(CC)N(CCBr)c1ncc(Br)cc1Br 129137175 FKVXOWRFCMUTHF-UHFFFAOYSA-N 428.994 4.997 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1cccc([C@@H]2Cc3ccccc3N(S(N)(=O)=O)C2)c1 616669047 JVALJXHXDDJOHO-HXUWFJFHSA-N 432.662 4.558 50 10 IJGE C[C@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1ncc(Br)cc1CCl)C2 706636683 FHZXNDWSFOJIJC-NHCUHLMSSA-N 434.809 4.931 50 10 IJGE Cc1cc(F)ccc1NNC(=O)CSc1nnc(-c2ccco2)n1C1CCCCC1 748549327 KQKGGODUYONDFF-UHFFFAOYSA-N 429.521 4.726 50 10 IJGE CCc1cc(Br)ccc1NNC(=O)CCc1ncc(-c2ccc(OC)cc2)o1 753169607 KSOGUOVVXVCJPS-UHFFFAOYSA-N 444.329 4.751 50 10 IJGE CCCCSc1ccc(C(=O)NNc2ccc(C(=O)OC)cn2)cc1C(F)(F)F 760924042 PGSQTMBQPMBTLI-UHFFFAOYSA-N 427.448 4.536 50 10 IJGE CC(C)(C)c1nn(-c2ccccc2)cc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799747014 NVBQRMNYFBJHQG-UHFFFAOYSA-N 427.430 4.817 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2ccc3oc(O)nc3c2)c(C)n1-c1cccc(Cl)c1 1133240332 JLFQWYFAGYTHPH-ZDLGFXPLSA-N 446.894 4.818 50 10 IJGE Cc1c(C(=O)NC(C)(C)C)oc2c1C(=NNC(=O)c1ccc(Cl)cc1Cl)CCC2 1772748569 RJDAMOMSXIVAOS-UHFFFAOYSA-N 436.339 4.894 50 10 IJGE CCc1nn(-c2ccccc2Cl)c2c1[C@@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689017 HSPJIUWCTQQSDH-SFHVURJKSA-N 427.291 4.665 50 10 IJGE Cc1ccc(C)c(Cn2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(Cl)c([N+](=O)[O-])c2)c1 1865705990 LHVUHDFSBYUGQD-NRFANRHFSA-N 449.898 4.636 50 10 IJGE CC(C)(C)OC(=O)NCCCCCC(=O)N/N=C/c1ccccc1OCc1ccccc1 1873795602 SPNNXJAVCPSODN-OVVQPSECSA-N 439.556 4.801 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)c1ncc(Br)cc1Br 1916347918 LTIQEYXTOQWGBM-CQSZACIVSA-N 448.586 4.867 50 10 IJGE Cc1cnc(N(C)C[C@@H](Br)COCc2ccccc2)c(Br)c1 1916350446 ZFDMNFXPBYDFIG-OAHLLOKOSA-N 428.168 4.569 50 10 IJGE O=C(NC1CC(CCBr)C1)c1cc(Br)c(Br)s1 1942857641 CXTKDBGSMKPKCO-UHFFFAOYSA-N 446.002 4.567 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1Cc1ccc(I)c(Cl)c1 2026566329 JHSWWCPKNDYCMK-MWLCHTKSSA-N 428.539 4.692 50 10 IJGE CC(C)N(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C[C@H](Br)C(F)(F)F 2044698758 FIDBCPAIWFVBSD-KBPBESRZSA-N 431.337 4.812 50 10 IJGE Br[C@@H](Cc1nc2ccccc2o1)c1cc(I)sn1 2056487965 PZCPDMRLHPXGBR-ZETCQYMHSA-N 435.084 4.568 50 10 IJGE ClCCc1nc2cc(I)ccc2n1[C@H]1C[C@@H](Br)C1 2063145764 PKYBUNHBECTBOJ-WAAGHKOSSA-N 439.522 4.521 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN(Cc2ccc(I)c(Cl)c2)C1 2086652305 OLYMQZPQEKQFLV-PWSUYJOCSA-N 442.566 4.940 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@H](CCl)C(F)(F)C1 2090184476 QONKVKWEUGMJMH-ZCFIWIBFSA-N 437.531 4.609 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@H]2[C@H](Cl)CCC[C@H]2C1 2094592418 VXXHBTGOQSJNEW-QXFUBDJGSA-N 427.589 4.753 50 10 IJGE Br[C@@H](Cc1ccc2c(c1)CCO2)c1cccc(I)c1 2112337409 FHUKJPDCWQDSIT-HNNXBMFYSA-N 429.095 4.905 50 10 IJGE Clc1cccc(C(CBr)(CBr)COC[C@@H]2CCCO2)c1 2149035740 MNXXFBQXMJTDEP-AWEZNQCLSA-N 426.576 4.563 50 10 IJGE COCCN(C)C[C@@H](Br)CCc1ccc(Cl)c(Br)c1F 2166834553 ZZPCHLUOHNPWPE-NSHDSACASA-N 431.571 4.516 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)c1cc(Cl)ccc1NC(=O)OC(C)(C)C 2223967349 IHUOMZKIMMUADP-HAQNSBGRSA-N 431.758 4.933 50 10 IJGE Cc1nc(-c2ccc(I)cc2)nc(C)c1[C@@H](C)CBr 2228790281 VNTFPIBKMXKWGK-VIFPVBQESA-N 431.115 4.863 50 10 IJGE O=C(Nc1ccccc1CBr)c1cc(I)ccc1F 2230655298 LJKUKXSDVKTKEC-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE Cn1nc([C@@H](Br)c2ccc([C@H]3CCOC3)s2)c(Br)c1Cl 2240422641 XAHOGNIXSJDURH-XVKPBYJWSA-N 440.588 4.886 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC[C@H]2CCC2(C)C)C1 2243127477 OLBLHEXNBVMUSY-RDTXWAMCSA-N 437.362 4.644 50 10 IJGE COc1ccc([C@H](Br)C[C@H]2CO[C@H](C)C2)cc1I 2257353251 GMBLPQKBMJACSU-JFGNBEQYSA-N 425.104 4.551 50 10 IJGE COc1ccc([C@H](Br)[C@H]2C[C@@]23CC3(F)F)cc1I 2257367862 DFHWYBKWTMUSII-JFUSQASVSA-N 429.042 4.781 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](N)[C@H]1C[C@@H](Br)C1 2301490880 ZLAZINVVLFCLKW-KEHGIVTQSA-N 429.953 4.832 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)[C@H]3CC[C@@H]32)cc1I 2315552396 DQCYPLZRFLHJCS-SUNKGSAMSA-N 440.550 4.692 50 10 IJGE Clc1ccc(CN2CC3(CC3)C[C@H]2CBr)c(I)c1 2318516875 XXQMMDRBFQJXDF-LBPRGKRZSA-N 440.550 4.694 50 10 IJGE N#CC(=CNCCc1cccc(Br)c1)C(=O)Nc1cccc(Cl)c1Cl 2324381145 SEGPJZPQDXLMJA-UHFFFAOYSA-N 439.140 4.934 50 10 IJGE CN(Cc1cc(I)ccc1Cl)C1(CCl)CCSCC1 2352414815 YQGSUMJKJKLLHI-UHFFFAOYSA-N 430.182 4.881 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)c(Br)cc2n1[C@@H]1COC[C@@H]1F 2358565750 OAXHMQNFHOVKKB-PUQNFTFYSA-N 426.511 4.771 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Cl)c1cc(F)c(F)c(F)c1F 2364226522 MSNSUUCWKIYFBX-LURJTMIESA-N 436.428 4.830 50 10 IJGE CN(Cc1c(Br)c(Br)nn1C)c1ccc(CCl)cc1Cl 2364376108 HOXSUCNQEPEYIW-UHFFFAOYSA-N 441.982 4.974 50 10 IJGE COc1cc(CBr)c([N+](=O)[O-])cc1OCc1ccc(Br)s1 37226633 QVGSVCUFWOCXOV-UHFFFAOYSA-N 437.109 4.901 50 10 IJGE O=C(CN(Cc1ccccc1)Cc1ccccc1)N/N=C/c1ccc(Br)cc1 59166765 WOFHNMSMPBSCEP-MFKUBSTISA-N 436.353 4.602 50 10 IJGE CC1=C(C#N)C(=O)N([C@H](C)c2ccccc2)C(=O)/C1=C/Nc1ccccc1C(F)(F)F 101233459 YZMSEWFRFOYOHJ-COYFKBPASA-N 425.410 4.971 50 10 IJGE CCN(CC)/C(=C(\C#N)C(=O)COC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(F)cc1 107992013 KFTGMODCLAVDGG-ZNTNEXAZSA-N 438.543 4.731 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Cl)c3cccc(F)c3Br)cc2[nH]1 156116466 CFTRZMSPMRZAIW-CYBMUJFWSA-N 434.490 4.849 50 10 IJGE CCCCCOc1ccc(/C=N\NC(=O)c2cccn(Cc3cccc(C)c3)c2=O)cc1 169918210 AQQCOLRXYWVQNR-IMRQLAEWSA-N 431.536 4.538 50 10 IJGE N#C/C(=C/Nc1ccc(N2CCCCC2)cc1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 217229290 YRFNACCBCKECSM-PFONDFGASA-N 425.876 4.697 50 10 IJGE CC[C@@H](CBr)N(C)C(=O)c1cc(Br)c(Br)s1 379045635 FZTSJIKTCJQPOZ-LURJTMIESA-N 433.991 4.519 50 10 IJGE Oc1ccc(Br)cc1[C@@H]1CN(Cc2ccccc2)C[C@@H]1CBr 382704612 DZKMEUPRRZSXCK-WMLDXEAASA-N 425.164 4.765 50 10 IJGE ClCc1cc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)ncc1Br 705846033 OMARHRHVHIUOLZ-RBAQFSTRSA-N 446.820 4.930 50 10 IJGE O=C(NNC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)c1ccc(COc2ccccc2)o1 731185080 DNUAQLQZVFIFOR-PKTZIBPZSA-N 426.472 4.577 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)c1csc(-c2ccc(OC)c(OC)c2)n1 746184438 BUOZATPCYZDAQT-UHFFFAOYSA-N 426.450 4.683 50 10 IJGE COc1ccccc1[C@H](NC(=O)NNc1ccc(C#N)cc1C(F)(F)F)c1ccco1 799605499 DTQUQXMMJMWDPB-IBGZPJMESA-N 430.386 4.594 50 10 IJGE O=C(CSc1nc2ccccc2[nH]1)NN=Cc1ccc(OCc2ccc(F)cc2)cc1 1084654702 QOGXUKGFHVNZPJ-UHFFFAOYSA-N 434.496 4.523 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNc1cccc(F)c1Br 1176977091 JKUJTTIAWVWMSU-UHFFFAOYSA-N 433.199 4.929 50 10 IJGE C=CCOc1ccc(CNC(=O)NNc2ccc(Br)cc2C(F)(F)F)cc1 1248612550 VWAKCWXUIPRGRY-UHFFFAOYSA-N 444.251 4.859 50 10 IJGE Cc1cc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)nc(C)c1Br 1256568070 SVRMXFZQQGQCRK-UHFFFAOYSA-N 428.212 4.500 50 10 IJGE O=C(CCCSc1ccccc1)N/N=C/c1cc(Cl)cc(Br)c1O 1865761527 MEZSXCXAEWPBRG-RGVLZGJSSA-N 427.751 4.831 50 10 IJGE CC[C@H](NC(=O)[C@@H](Cc1ccncc1)c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1866708600 WFHMPOQPMBULSE-GOTSBHOMSA-N 444.560 4.515 50 10 IJGE Cc1oc2cc(OC(=O)C(Cl)Cl)ccc2c(=O)c1-c1ccc2c(c1)OCCCO2 1871386361 QNJBADIXOMDTLJ-UHFFFAOYSA-N 435.259 4.639 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)Cc3ccc(OC)c(OC)c3)n2)c(OC)c1 1872755472 PKEKILAUVRWBAU-ZPHPHTNESA-N 438.505 4.880 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C[C@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C 1890792164 SHZRTEQOQQLTKB-ILXRZTDVSA-N 435.403 4.748 50 10 IJGE C[C@@H](CS(=O)(=O)N(Cc1ccccc1)[C@H](CBr)C1CC1)c1ccccc1 1915171230 CTWUTORIPFDLIJ-LAUBAEHRSA-N 436.415 4.796 50 10 IJGE ClCCc1nc2c(Br)cccc2n1Cc1csnc1Br 1926872953 OIWYGLGLFZXALT-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE O=C(NC[C@@H]1CC[C@@H](Br)C1)c1csc(Br)c1Br 1945188813 BRROOXSULZYQFH-RNFRBKRXSA-N 446.002 4.567 50 10 IJGE Cc1cc(C(=O)NCCCCCCI)c(Br)s1 1951014970 RPNRMKQEZSBTNJ-UHFFFAOYSA-N 430.149 4.544 50 10 IJGE FC(F)(CBr)c1cccc(Br)c1I 1952535656 DZASFILHKLWLIR-UHFFFAOYSA-N 425.836 4.540 50 10 IJGE C[C@]1(CBr)C[C@H](NC(=O)c2cc(Br)sc2Br)C1 2009754324 KVGSDDBBQSSXER-MHWOZMEASA-N 446.002 4.567 50 10 IJGE Cc1ccc(NC(=O)COC(=C(C#N)c2nnc3n2CCCCC3)c2ccccc2)cc1C 2040430802 QXLNHKFFJYUALR-UHFFFAOYSA-N 441.535 4.669 50 10 IJGE O=[N+]([O-])c1c(CBr)nn(-c2ccc(C(F)(F)F)c(F)c2)c1C(F)(F)F 2079141404 DXWNQLAPFRLGQO-UHFFFAOYSA-N 436.081 4.852 50 10 IJGE Cl[C@@H]1C[C@H]2CC[C@H]1[C@@H](Nc1ncc(I)cc1Br)C2 2084033129 AXHPTANUXYYODA-QNKRVWAESA-N 441.538 4.657 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@]1(C)CBr 2086658264 LYGXXIJSFMADQY-HZMBPMFUSA-N 442.566 4.798 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@H](CBr)C(C)(C)C)CC[C@@H]1C(F)(F)F 2106781642 JVENBZGPLGFLAL-HZSPNIEDSA-N 445.364 4.821 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1cn(C)nc1C(F)(F)F 2122210555 XGAVSXKODULFRF-OAHLLOKOSA-N 432.284 4.501 50 10 IJGE CCCC[C@@H](C)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2123201325 VGLUJPWPIIQQPU-SECBINFHSA-N 433.231 4.605 50 10 IJGE Br[C@@H](Cc1ccccc1I)c1ccc2c(c1)OCCO2 2143867641 FJVHGPTXWKAUJL-ZDUSSCGKSA-N 445.094 4.741 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)N(CC1(CBr)CCCC1)CCO2 2163059194 RFGOWXLMMAOUGS-UHFFFAOYSA-N 439.394 4.865 50 10 IJGE Clc1c(Br)ccc(CBr)c1N1CCS[C@@H]2COCC[C@H]21 2170504242 LKMRAOBXQAVOJG-VXGBXAGGSA-N 441.616 4.708 50 10 IJGE CC(C)C[C@H]1CCCN1S(=O)(=O)c1cc(CBr)sc1Br 2179784600 BFIQTFUUMFFYLF-SNVBAGLBSA-N 445.242 4.605 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1ccc2cc(O)ccc2c1 2184259325 YZLYHPBEZQFVGY-FQEVSTJZSA-N 428.326 4.598 50 10 IJGE COc1ccc(Br)c(CBr)c1OC[C@H]1C[C@@H]1Br 2214869737 IDCJDEYWXHCUGX-XCBNKYQSSA-N 428.946 4.515 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Br)c1c(Cl)cnn1C 2264356792 QMMPPNUZJKBINA-SNVBAGLBSA-N 428.939 4.982 50 10 IJGE C=CC[C@]1(CBr)CCN(C(=O)c2cc(Br)c(Cl)s2)C1 2272143813 OBSLRYKIEZDNNF-CYBMUJFWSA-N 427.589 4.967 50 10 IJGE COc1cc(SC#N)ccc1NC=C1C(=O)N(c2ccc(Br)cc2)N=C1C 2296740252 OTCLWDGEQSQNEN-UHFFFAOYSA-N 443.326 4.749 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(C)C[C@H]2CC[C@H]1C[C@]21CC[C@@](C)(CI)O1 2307494021 AJJVEBQKRHMUPP-HLULTAIVSA-N 449.373 4.833 50 10 IJGE CCS(=O)(=O)C[C@H](Br)c1c(F)cc(Cl)c(Br)c1Cl 2313812930 FDNHDNYWTAAYIC-YFKPBYRVSA-N 442.959 4.766 50 10 IJGE C[C@H](c1ccncc1Br)[C@H](Br)c1c(Br)ncn1C 2315592687 ZSCSVCGUWHCARN-XCBNKYQSSA-N 437.961 4.580 50 10 IJGE N#CC(=Cc1cccc(OC(=O)CCCN2C(=O)c3ccccc3C2=O)c1)c1ccccc1 2320506922 USBZNJBVTMZFKA-UHFFFAOYSA-N 436.467 4.733 50 10 IJGE C[C@H]1CCN(Cc2cc(I)ccc2Cl)C[C@@H]1CBr 2327398419 DIVZJEZNVMTGFX-JQWIXIFHSA-N 442.566 4.798 50 10 IJGE N#CC(=C(O)CN1C(=O)COc2ccc(Cl)cc21)c1nc(-c2cccs2)cs1 2331327413 CRRPREBWCBSPAS-UHFFFAOYSA-N 429.910 4.743 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)[C@@H](CCCl)C(F)(F)F 2337231061 ZLNANIQFDIRTFC-NSHDSACASA-N 426.047 4.936 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCN(C[C@H]2C[C@@H](Br)C2)[C@H](C(F)(F)F)C1 2337544376 BGHUALQPXGHHBK-KBXIAJHMSA-N 443.348 4.718 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H](NC(=O)OC(C)(C)C)C[C@]1(C)COC 2364208795 MCFZBCOOHOQPCX-YLJYHZDGSA-N 449.474 4.972 50 10 IJGE CN(C[C@H]1CN(C[C@H](CBr)c2ccccc2)CC12CC2)C(=O)OC(C)(C)C 2366104155 MJSRUHJTVLYVRO-OALUTQOASA-N 437.422 4.744 50 10 IJGE CCCCCCOc1ccc(/C=N/NC(=O)CSc2nc3ccccc3[nH]2)cc1OC 32519896 NOODEPTYIQGVCI-BUVRLJJBSA-N 440.569 4.773 50 10 IJGE COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2Cl)cc1 38650959 WQNKPSBIPJUMIN-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE CCc1ccccc1Nc1ncnc(NNC(=O)C(c2ccccc2)c2ccccc2)c1N 40688313 IHMKDSVXJRGCKE-UHFFFAOYSA-N 438.535 4.640 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1cccc(C)c1)CCC2 40811321 SMEVIKFCDYIWBO-TURZUDJPSA-N 445.519 4.936 50 10 IJGE O=[N+]([O-])c1cc(Br)c(OCCCCBr)c(Br)c1 50441334 XZIJIHUBBLEYJL-UHFFFAOYSA-N 431.906 4.674 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)Nc1ccccc1CBr 136815569 JRPRARGQKWUHIN-UHFFFAOYSA-N 425.167 4.515 50 10 IJGE CCOc1ccc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccccc4)nc3c2)cc1OCC 169925732 QNDKWMPATDMYBG-PKAZHMFMSA-N 442.519 4.715 50 10 IJGE CCCCCCCCO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1I 231314195 OPFVRCSZBZUERI-GJZGRUSLSA-N 425.351 4.786 50 10 IJGE CC(C)S(=O)(=O)CCC(CBr)(CBr)c1ccc(Cl)cc1 232696608 DBMJQOGECNANTR-UHFFFAOYSA-N 446.632 4.581 50 10 IJGE CCOc1cccc(C=NNC(=O)c2cc(-c3ccc(OC)cc3)nc3ccccc23)c1O 252633285 WBNYRYYLVCMLAZ-UHFFFAOYSA-N 441.487 4.779 50 10 IJGE CCn1cc(C(C)=NNC(=O)c2sc3cc(Br)ccc3c2Cl)c(C)n1 254289801 FINJAPDMFYZLOC-UHFFFAOYSA-N 439.766 4.996 50 10 IJGE O=C(NN=Cc1c[nH]c2ccccc12)c1cc(-c2ccc(OCc3ccccc3)cc2)n[nH]1 263632565 TXTMTDCIEINMGB-UHFFFAOYSA-N 435.487 4.901 50 10 IJGE CC(C)(C)[C@H](Br)CNC(=O)c1cc(Br)ccc1Br 324423361 NXIMSWCYRWJELV-LLVKDONJSA-N 441.989 4.751 50 10 IJGE Cc1cc(F)c([C@H](Br)c2cnn(C)c2I)cc1Cl 395812642 KQYIKUFQNXRHCS-NSHDSACASA-N 443.485 4.610 50 10 IJGE CO[C@H](COc1c(Br)cc(Br)cc1CBr)C1CC1 400150137 BLUQNJGSQJMPKA-GFCCVEGCSA-N 442.973 4.910 50 10 IJGE BrCC1(CN2CCO[C@H]3CCN(Cc4ccccc4)C[C@H]32)CCCCCC1 404261218 RNBRBQAJRRBTMC-YADHBBJMSA-N 435.450 4.697 50 10 IJGE FC(F)Oc1cc(Br)c(CBr)cc1I 575682457 REPQJGYMNKLHHP-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1cc(CCl)c(Br)cn1)C2 705898760 VFHWAHWDWXNOFG-OYRHEFFESA-N 434.809 4.931 50 10 IJGE CN(Cc1cc(Cl)ccc1I)[C@H]1CCC[C@H]1Br 709295047 BMXSNFKIMQDHLG-YPMHNXCESA-N 428.539 4.692 50 10 IJGE O=C(NN=Cc1ccccc1Oc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1O 1083956005 VLFBAFZRKWBZAG-UHFFFAOYSA-N 445.353 4.875 50 10 IJGE COc1cc(C=NNC(=O)c2cccs2)cc(Br)c1OCc1ccccc1 1084654698 OLHVCOLJGFQKFQ-UHFFFAOYSA-N 445.338 4.862 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2cc3ccccc3nc2O)c(C)n1-c1ccc(F)cc1 1463478500 YBTZWHSVYWRQKK-MOSHPQCFSA-N 440.478 4.710 50 10 IJGE CCOc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccc1)CCC2 1772744308 BIBPIBAXYIOWAE-UHFFFAOYSA-N 431.492 4.709 50 10 IJGE O=C(ON=C1C(=O)N(Cc2ccc(Cl)cc2)c2ccc(Cl)cc21)C(Cl)Cl 1848352934 GPRHUVFJDICUPG-UHFFFAOYSA-N 432.090 4.591 50 10 IJGE CC(C)(NC(=O)[C@H](Cc1ccncc1)c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1866696751 XKOLQJWYLCZNLW-JOCHJYFZSA-N 444.560 4.515 50 10 IJGE C[C@@H](Br)C(C)(C)CNC(=O)c1cc(Br)cc(Br)c1 1913838015 OAHGSUPYAZFXDK-MRVPVSSYSA-N 441.989 4.751 50 10 IJGE O=C(NCCC1(CBr)CC1)c1csc(Br)c1Br 1945189283 NAJFACBHZITNIP-UHFFFAOYSA-N 446.002 4.568 50 10 IJGE CCC[C@@](C)(CBr)NC(=O)c1csc(Br)c1Br 1945189368 OXZTZLNYCPXIGL-NSHDSACASA-N 448.018 4.957 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@@H]1Cc1cccc(Br)c1Br 2007137382 OUOSSSZXPWVNOO-JBLDHEPKSA-N 426.974 4.943 50 10 IJGE CC(C)CCN(CCCl)c1ncc(I)cc1Br 2015764173 IDIBTVQFGRHPHX-UHFFFAOYSA-N 431.543 4.540 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1cccc(OCc2ccccc2)c1 2023034520 VNNWEXSJDHXSKE-DNVCBOLYSA-N 437.321 4.845 50 10 IJGE CN(CC(C)(C)CBr)C(=O)c1cccc(Br)c1Br 2033573467 ZXPSYPSEDHBLTA-UHFFFAOYSA-N 441.989 4.705 50 10 IJGE BrC[C@H]1CCC2(CC2)CN1c1ncc(Br)cc1Br 2036626557 UGAYINIFSPGFFJ-SNVBAGLBSA-N 438.989 4.751 50 10 IJGE CC1(C)C[C@@H](Br)CN1C(=O)c1cccc(Br)c1Br 2037325391 NCRNCTSYKTVIQU-MRVPVSSYSA-N 439.973 4.600 50 10 IJGE Clc1ccc(I)c(CN2[C@H]3CC[C@@H]2C[C@@H](Br)C3)c1 2037416887 PMPXPGCDHCIRMT-UOJUARBOSA-N 440.550 4.835 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1cc(Br)c(Cl)s1 2052441087 DLGQIJQTLMJQBX-ZETCQYMHSA-N 435.634 4.801 50 10 IJGE N#CC(=Cc1cccc([N+](=O)[O-])c1)c1nc(-c2cc3cc([N+](=O)[O-])ccc3oc2=O)cs1 2053574500 LQTCZDZIIDJAIU-UHFFFAOYSA-N 446.400 4.797 50 10 IJGE CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)ccc1OC 2059312619 NOADEKHBXCCGPW-OAHLLOKOSA-N 426.376 4.580 50 10 IJGE CC1(C)C[C@H](Cl)CCN(c2ncc(I)cc2Br)C1 2069530643 YCWGVIZHPXEQQC-SECBINFHSA-N 443.554 4.683 50 10 IJGE Clc1cc(CN2CC[C@@H](CBr)C23CC3)ccc1I 2086655415 NKPONSNXDLDVJA-NSHDSACASA-N 440.550 4.694 50 10 IJGE CC(C)[C@@H]1[C@H](Br)CCN1Cc1ccc(I)c(Cl)c1 2086660066 BELXRWUUXCNYJB-BXUZGUMPSA-N 442.566 4.938 50 10 IJGE Clc1cc(CN2C[C@@H]3C[C@H](C[C@H]3Br)C2)ccc1I 2086662246 STBODYRACSFOMK-GRYCIOLGSA-N 440.550 4.550 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@@H](CCl)C(F)(F)C1 2093947851 JEOGJWOGKMIEKH-LURJTMIESA-N 437.531 4.609 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2CN(CC3(CBr)CCCCCC3)CC[C@H]2C1 2106784586 JQYDQPSIEAXDCV-ROUUACIJSA-N 429.443 4.911 50 10 IJGE COc1ccc([C@H](Cl)c2nn(C)c(Cl)c2Br)cc1Br 2110721223 HFDRCNJLTCASDJ-JTQLQIEISA-N 428.939 4.935 50 10 IJGE COc1ccc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)[C@H](C)C1CC1 2123271891 UYCYGEXZSYEHJR-OAHLLOKOSA-N 438.387 4.580 50 10 IJGE Cl[C@@H]1Cc2ccccc2[C@@H]1Nc1ncc(I)cc1Br 2133370368 ACZQYCJNORXCLD-OLZOCXBDSA-N 449.517 4.765 50 10 IJGE O=S1(=O)CCC[C@@H]([C@@H](Br)c2csc3c(Br)cccc23)C1 2146094562 HVBPVBAJIHMVSY-NOZJJQNGSA-N 438.206 4.925 50 10 IJGE O=C(c1ccc(Cl)c(Br)c1)N1CC[C@@H](CBr)C(F)(F)C1 2146375609 PKNNYTZPNMBHTN-VIFPVBQESA-N 431.502 4.595 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1CCCl)c1cc(Cl)ccc1I 2146741696 YRKGRONGEKOKKE-IINYFYTJSA-N 426.125 4.862 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCC[C@H](NC(=O)c2ccc(CBr)cc2)C1 2162592882 YPBIXVRGYWDDSG-QAPCUYQASA-N 439.394 4.785 50 10 IJGE CN(Cc1ccccc1)CC1CCN(c2cc([N+](=O)[O-])ccc2CBr)CC1 2176909528 VXSIZAHWZYCVES-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE FC(F)(F)CC1(CBr)CCN(Cc2sncc2Br)CC1 2188333294 UBKZMNBNMGUTES-UHFFFAOYSA-N 436.135 4.835 50 10 IJGE O=[N+]([O-])c1cc(Cl)cc(Br)c1OCCCCCI 2220213713 FMYOMQGKENXCMP-UHFFFAOYSA-N 448.482 4.995 50 10 IJGE CCOCc1cc(Br)c([C@@H](Br)c2c(Cl)cnn2C)s1 2224797558 YXUGRCJLAOUXIS-JTQLQIEISA-N 428.577 4.918 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Cl)c1nn(C)cc1Br 2264356177 JALQOCKDCVMQDD-JTQLQIEISA-N 428.939 4.935 50 10 IJGE CC1(CBr)CCN(C(=O)c2cc(Br)c(F)cc2Cl)CC1 2285961305 YENJYLMQMIGQPV-UHFFFAOYSA-N 427.539 4.879 50 10 IJGE Clc1ccc(C[C@@H]2CCOCC[C@@H]2Br)cc1I 2300265706 OLIFYQGSMVZBLJ-QWRGUYRKSA-N 429.523 4.677 50 10 IJGE CCc1ccc(C[C@@H]2SC(=C(C#N)C(=O)NC)N(c3ccc(C(C)C)cc3)C2=O)cc1 2314593078 HGPFIKKYLXYIEC-QFIPXVFZSA-N 433.577 4.545 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)cc2I)C[C@@H](C)[C@@H]1Br 2318537944 LCLIQUHJLFNXBQ-MSRIBSCDSA-N 442.566 4.796 50 10 IJGE CC(C)[C@H](CBr)N(C)C(=O)c1cccc(Br)c1Br 2318856947 SQTSCLPDGIIGCP-NSHDSACASA-N 441.989 4.703 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4O)[nH]c3c2)cc1 2323740076 RPFGJRCNWHAJOV-UHFFFAOYSA-N 427.508 4.546 50 10 IJGE Cc1cc(Br)cc([N+](=O)[O-])c1OCC(C)(C)CI 2326705452 ZDNPMBSRBWHYFZ-UHFFFAOYSA-N 428.064 4.506 50 10 IJGE Clc1ccc(I)cc1C[C@@]1(CBr)C[C@]12CCOC2 2327399505 SFCWJDLSLCXHNE-KBPBESRZSA-N 441.534 4.679 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C)CN(Cc2ccc(CBr)cc2)CC1(F)F 2351603451 JPHGJFSDOMDWCU-GOSISDBHSA-N 433.337 4.563 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(O[C@H]2CCCCC23CCOCC3)CC1 2368371615 LSQXMSPUMPGGKM-KRWDZBQOSA-N 446.426 4.907 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)Nc3ccc([N+](=O)[O-])cc3)o2)cc1 6599940 ULKHKRXGOAHJGM-LGMDPLHJSA-N 431.404 4.577 50 10 IJGE CSc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccccc4)ccc32)cc1 38682142 VGKRULHHJVLVDT-DEOSSOPVSA-N 444.512 4.611 50 10 IJGE O=C(N/N=C/c1ccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1)c1cc2ccccc2o1 59305300 VOHNXVHPDDJFBD-YDZHTSKRSA-N 446.375 4.805 50 10 IJGE CCN(CC)c1ccc(/C=N/NC(=O)c2cc(Br)ccc2OC(C)C)cc1 96095887 QZDSQQFPOQSNSS-OEAKJJBVSA-N 432.362 4.846 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccccc2)C(=O)/C1=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 101335072 NOUHCCFVXQDCGP-FYJGNVAPSA-N 439.427 4.647 50 10 IJGE C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC/C2=N/NC(=O)c1cccc([N+](=O)[O-])c1 105436445 PEVAPRZFSJGMGN-GGBUZDNBSA-N 433.508 4.943 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2ccc3nc(N)sc3c2)cc(Cl)c1OCC(C)C 169916810 MDUBWSNSQZRIIQ-VROXFSQNSA-N 446.960 4.729 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@H](CCBr)C1 232461934 IDOYESUVUXEFDS-ZETCQYMHSA-N 446.002 4.520 50 10 IJGE CCn1c2ccccc2c2cc(NC(=O)CC(C)=NNC(=O)c3ccccc3N)ccc21 254866612 NGIQVMZXIJRIHW-UHFFFAOYSA-N 427.508 4.531 50 10 IJGE ClCc1nc2cnccc2n1-c1ccc(Br)c(I)c1 302340123 HKDMMSYUGDSDDP-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE Clc1ccc(I)c(C[C@@]2(CBr)CCCCO2)c1 405328495 FBZWXXVWNNOEAF-CYBMUJFWSA-N 429.523 4.821 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1C(=O)c1ccc(Br)cc1Br 705610500 CXOXSLKCRLLTMU-SCZZXKLOSA-N 439.973 4.600 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1 746185276 MRUJMWWJYKKTTQ-UHFFFAOYSA-N 444.487 4.934 50 10 IJGE O=C(Cc1csc(-c2cccc(Br)c2)n1)NNc1ccc(F)c(F)c1F 748213884 BETZTVFOZFOPPX-UHFFFAOYSA-N 442.260 4.676 50 10 IJGE COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C(=O)NNc2cc(C)ccc2F)c1 760136814 GEDLICAVZOVWEK-UHFFFAOYSA-N 446.482 4.761 50 10 IJGE O=C(NNc1cc(F)c(F)c(F)c1)c1cc(Oc2cccc(Br)c2)ccn1 762543648 CPGBLHGPRAYGFH-UHFFFAOYSA-N 438.203 4.811 50 10 IJGE Cc1sccc1CC(=O)NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1 787886272 WMERICKZRXOCAG-UHFFFAOYSA-N 428.579 4.699 50 10 IJGE O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)NN=Cc1cccc(Cl)c1Cl 1083885837 PXRNQKCONPGEGP-UHFFFAOYSA-N 441.321 4.754 50 10 IJGE O=C(NNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc2nc(O)n(C3CC3)c2c1 1450195223 OIHBEFPZPHUHHF-UHFFFAOYSA-N 444.335 4.871 50 10 IJGE C=CC1(CC(=O)NNc2nc3ccccc3c(=O)n2-c2ccc(C)cc2C)CCCCC1 1543607957 KDYDERWTGMYVLO-UHFFFAOYSA-N 430.552 4.972 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)[C@@H](Oc1ccc(F)c(F)c1)c1ccccc1 1557584556 KAXGYOBTCAGVCJ-IBGZPJMESA-N 438.459 4.834 50 10 IJGE O=C(CSc1ccc(Cl)cc1Cl)NNC(=O)Nc1cccc(C(F)(F)F)c1 1616049219 WFBGRRZDYYYZNV-UHFFFAOYSA-N 438.258 4.957 50 10 IJGE Cc1cccc(Cl)c1NNC(=O)[C@H](C)SCc1nc(O)c2c(C)c(C)sc2n1 1624314361 MXLLXTSFHGAIDR-LBPRGKRZSA-N 436.990 4.741 50 10 IJGE COc1cccc(C(=O)NCc2ccc(OC(=O)Nc3ccc(SC#N)cc3)cc2)c1 1858896502 CMYNYBWKYBVHPA-UHFFFAOYSA-N 433.489 4.809 50 10 IJGE CCN(CC)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(Cl)cc2)cc1 1865701954 JGOABTAZVDGKMS-JOCHJYFZSA-N 433.943 4.899 50 10 IJGE Cc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865705289 QLRVEGFLQPPMHU-QFIPXVFZSA-N 434.927 4.899 50 10 IJGE CN(CCc1cnc[nH]1)c1cc(Nc2ccc(SC#N)cc2)nc(-c2ccccc2)n1 1868365898 YBPYYLCXOKTYSM-UHFFFAOYSA-N 427.537 4.862 50 10 IJGE N#C/C(=C(/O)CCc1nc2ccccc2[nH]c1=O)c1nc(-c2ccc(F)c(F)c2)cs1 1872751803 UJMHRZDCZSHNMV-MOSHPQCFSA-N 436.443 4.750 50 10 IJGE CCN[C@H](c1sc(Cl)cc1I)[C@H]1C[C@H](Br)C1 1900961459 JOFBCJJODIZDTH-BYULHYEWSA-N 434.568 4.830 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)C(=O)c1cc(F)c(Br)cc1O 1901222543 HWWFQHUOMRJWCQ-LLVKDONJSA-N 445.126 4.720 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)Cc1nn(C)c(C)c1Br 1915097062 QDSDNDRURMEASQ-HNNXBMFYSA-N 429.200 4.667 50 10 IJGE CN(CCN(C[C@@H](CBr)C1CCC1)CC(F)(F)F)C(=O)OC(C)(C)C 1966496110 LSQUUWXYSCYRML-CQSZACIVSA-N 431.337 4.529 50 10 IJGE Cl[C@@H](c1cc(I)cc2c1OCC2)[C@H]1C[C@H](Br)C1 2020157733 QFOXKCORBJSSKS-KBVBSXBZSA-N 427.507 4.680 50 10 IJGE FC1(F)C[C@@]1(Br)COc1cc(Br)ccc1CBr 2023778085 ASCDGKVFGLSXTK-SNVBAGLBSA-N 434.900 4.896 50 10 IJGE Cc1cc(CBr)cc(S(=O)(=O)N(Cc2ccccc2)CC(F)F)c1C 2059312503 MFEPEXHDDZTXHI-UHFFFAOYSA-N 432.330 4.654 50 10 IJGE C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1N(C)C[C@@H](CBr)c1ccccc1 2107354770 BALSSNLDPIQULW-BHIYHBOVSA-N 425.411 4.742 50 10 IJGE CN(CC[C@H]1CCCCN1C(=O)[C@H](Br)C1CCCC1)C(=O)OC(C)(C)C 2110716096 UJEHDKSWXGHQSL-IAGOWNOFSA-N 431.415 4.578 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC2(CCC(Cl)CC2)C1 2124669352 NGXYGNDEZOCXCK-UHFFFAOYSA-N 427.589 4.897 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CC[C@H](Cl)C(F)(F)CC1 2150038334 FDIBAUIYUORYOJ-NSHDSACASA-N 431.502 4.690 50 10 IJGE FC(F)(F)[C@H]1CN(c2c(CBr)ccc(Br)c2Cl)CCO1 2154373388 MMSWAAKBXMRKJW-SECBINFHSA-N 437.481 4.765 50 10 IJGE Cc1ccc(N2CCOCC23CCN(Cc2ccccc2)CC3)c(CBr)c1 2163146640 IEJLKJNXHPMLCU-UHFFFAOYSA-N 429.402 4.761 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCC2(CCC2)N(C(=O)c2ccc(CBr)cc2)C1 2193440262 RFZHCSWGVZRETL-KRWDZBQOSA-N 437.378 4.634 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CC[C@H](C(F)(F)CCl)C1 2197757851 XCLCBBKFYDRUSE-QMMMGPOBSA-N 431.502 4.548 50 10 IJGE COc1ccc([C@H](Br)C[C@@H]2CO[C@@H](C)C2)cc1I 2257353249 GMBLPQKBMJACSU-HOSYDEDBSA-N 425.104 4.551 50 10 IJGE CN(Cc1cccc(I)c1)c1ccc(CBr)cc1F 2265532914 OWBJIFSYOXGNMK-UHFFFAOYSA-N 434.090 4.962 50 10 IJGE C[C@@H](Br)CN(CCC(C)(C)C)S(=O)(=O)c1cscc1Br 2288046940 FAGSJYBNWWZIEJ-SNVBAGLBSA-N 447.258 4.721 50 10 IJGE CC(C=NNC(=O)CSc1nc2ccccc2n1Cc1ccccc1)=Cc1ccco1 2296679456 GFEPLSSQNMEKGI-UHFFFAOYSA-N 430.533 4.975 50 10 IJGE BrCCC1(NCc2sccc2I)CCCCC1 2301079001 OVKUXGKMMCBDSL-UHFFFAOYSA-N 428.177 4.930 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1Cc1cc(I)ccc1Cl 2307328230 KJJKDGITJJKUTF-ONGXEEELSA-N 428.539 4.692 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)C=Cc4ccc(C)cc4)ccc32)cc1 2314634229 HVZZNDHFWRXIOK-SANMLTNESA-N 438.483 4.841 50 10 IJGE Clc1ccc(COc2cccc(CBr)n2)c(I)c1 2317809555 BGXMJCATPVBGQN-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)cc1Br 2323150847 NSMOVHUOHKNYKC-UHFFFAOYSA-N 440.341 4.972 50 10 IJGE CC(C)[C@@H]1C[C@H](Br)CN1Cc1cc(I)ccc1Cl 2327398785 IRVJLRPHGPNTDT-FZMZJTMJSA-N 442.566 4.938 50 10 IJGE CC(C)C[C@@H](CBr)CN1CC[C@H](NC(=O)OC(C)(C)C)C(F)(F)CC1 2328520989 LMXIJDGQHMPAMW-GJZGRUSLSA-N 427.374 4.668 50 10 IJGE CCN(c1nccc(N(C)C)c1CBr)C1CCN(Cc2ccccc2)CC1 2377470871 QUJDWZPLQVUYLZ-UHFFFAOYSA-N 431.422 4.533 50 10 IJGE ClCC(CCl)(Cc1ncc(I)cn1)c1ccccc1Cl 2381293164 KUJKRBUIXXBGDR-UHFFFAOYSA-N 441.527 4.693 50 10 IJGE CCCCCOc1ccccc1C(=O)NNC(=O)c1ccc(OCc2ccccc2)cc1 14035855 LZIWWDHLSNVFON-UHFFFAOYSA-N 432.520 4.909 50 10 IJGE Cc1cc(C(=O)NNC(=O)c2ccc(CSc3nc4ccccc4s3)cc2)c(C)o1 15662506 GHKQBARZWSRNNH-UHFFFAOYSA-N 437.546 4.873 50 10 IJGE CCCOc1ccc(/C=N/NC(=O)CSc2nc3ccccc3s2)cc1OCC 32520508 IUQFLIWOYFIMKA-LPYMAVHISA-N 429.567 4.726 50 10 IJGE COc1cc(/C=N\NC(=O)c2cccc(N)c2)ccc1OCc1ccc(C(C)(C)C)cc1 169894131 DPTLJJQHGUSUAU-NTFVMDSBSA-N 431.536 4.918 50 10 IJGE O=C(NN=C/C=C/c1ccccc1)/C(=C/c1cccs1)NC(=O)c1ccccc1Cl 252607622 HDEGMMMKAFSUJO-DIYSZESKSA-N 435.936 4.988 50 10 IJGE CCOc1ccc(C(C)=NNC(=O)c2cc(-c3c(OC)ccc4ccccc34)n[nH]2)cc1 254293793 MDOKXRWSHAIJQB-UHFFFAOYSA-N 428.492 4.791 50 10 IJGE CC(=NNC(=O)c1cc(C)nc2c1c(C)nn2-c1ccccc1)c1ccc(OC(F)F)cc1 254625527 WUWQCIWGYHQLQF-UHFFFAOYSA-N 449.461 4.793 50 10 IJGE Cc1ccccc1[C@@H]1CN(C(=O)OCc2ccccc2)C[C@H]1CI 382684315 GLXQMGUOMQAZFQ-IEBWSBKVSA-N 435.305 4.782 50 10 IJGE CC[C@@H]1CN(C(=O)c2cc(Br)c(Br)s2)C[C@H]1Br 399999728 MHANCYXZBKSAKX-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE CCCOCC(CBr)(CBr)c1ccccc1Br 709731793 YVRFUJOPQNVNAP-UHFFFAOYSA-N 428.990 4.903 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@]3(CC[C@@](C)(CI)O3)[C@H]1C2 721762728 RPBPCLVVQGMRFY-KJWYOANISA-N 435.346 4.539 50 10 IJGE O=C(NNc1nc(-c2ccc(Cl)cc2)no1)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 741219997 OSSUTURYNGWBOS-KBPBESRZSA-N 438.793 4.535 50 10 IJGE CSc1ccc(C(=O)c2ccccc2C(=O)NNc2cccc(F)c2F)cc1[N+](=O)[O-] 743721949 OBIGXRVLGPCCDZ-UHFFFAOYSA-N 443.431 4.583 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)Nc2nc(C3CCC3)cs2)c(-c2ccccc2)n1 769187056 DQSWKKDTVRKFPL-PDGQHHTCSA-N 428.521 4.733 50 10 IJGE N#Cc1ccc(NNC(=O)c2cn(-c3ccccc3)nc2-c2cccnc2)c(C(F)(F)F)c1 799753904 XNMNQYNSOYIYJX-UHFFFAOYSA-N 448.408 4.582 50 10 IJGE N#C/C(=C/c1cn(Cc2ccc(F)cc2)c2ccc(Br)cc12)C(=O)NC1CC1 1083944816 PTHUDZPNRAVFMF-DHDCSXOGSA-N 438.300 4.777 50 10 IJGE CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)NNc2nc3ccccc3[nH]c2=S)c1 1148223037 JCPJHKNRBFFKSL-UHFFFAOYSA-N 444.948 4.623 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNC(=O)c1cccc(Br)c1 1361082044 SIAQXACQPVVQEK-CSKARUKUSA-N 428.113 4.620 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3cccc(-n4ccnc4O)c3)c2C)cc1 1534563494 CPPHDLIFHWTSJB-STZFKDTASA-N 437.503 4.840 50 10 IJGE CCN(C(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccc1OC)CCC2)c1ccccc1 1772746212 RZDNZAKDDXXGCN-UHFFFAOYSA-N 445.519 4.734 50 10 IJGE C[C@@H](C1CCN(C(=O)OC(C)(C)C)CC1)[C@H](CBr)NC(=O)OC(C)(C)C 1880759866 BMKVRRULBSRLQW-ZFWWWQNUSA-N 435.403 4.558 50 10 IJGE C[C@@H]1CCN(Cc2c(Br)cccc2Br)[C@@H]1CBr 1945332686 GXRVDABUGIKGCP-NOZJJQNGSA-N 425.990 4.817 50 10 IJGE Clc1ncn(-c2cc(Br)cc(Br)c2)c1CBr 1982516021 BAUKZZQAMIHPGU-UHFFFAOYSA-N 429.337 4.946 50 10 IJGE C[C@H]1C[C@@H](Br)CCN(c2ncc(Br)cc2Br)C1 1997236368 HZDZZTGZGNIAKZ-IUCAKERBSA-N 426.978 4.606 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@@H]2C[C@@H]2C2CCC2)CC1 2022600438 ZASOGZGLUKTRAF-JKSUJKDBSA-N 449.373 4.644 50 10 IJGE C[C@]1(CCBr)CCN1C(=O)c1csc(Br)c1Br 2025223524 PBVPLBUVULNPNJ-NSHDSACASA-N 446.002 4.663 50 10 IJGE Cn1cc(Br)c(C[C@H](CBr)c2ccccc2Br)n1 2027110929 ANBCFVYNXLSNJZ-SECBINFHSA-N 436.973 4.666 50 10 IJGE N#CC(=Cc1ccccc1)S(=O)(=O)c1cc(Br)ccc1Br 2040461445 QEVSLVXVIJMHBI-UHFFFAOYSA-N 427.117 4.550 50 10 IJGE Cl[C@H]1C[C@H](CNc2ncc(I)cc2Br)C12CCC2 2069527891 FLUSYVMSNDXYRF-KCJUWKMLSA-N 441.538 4.658 50 10 IJGE CCC(CC)(CBr)CN=[S@@](C)(=O)[C@H]1C[C@H](CNC(=O)OC(C)(C)C)C1 2072485612 HSIUYWMPGBCMRS-XHQUFGICSA-N 439.460 4.589 50 10 IJGE BrC[C@@]12CCC[C@@H]1N(Cc1ccc(I)cc1)CCC2 2108953150 SMHBMOMNRINQNQ-HOTGVXAUSA-N 434.159 4.821 50 10 IJGE CC(C)(C)OC(=O)N(CC(F)F)[C@H]1CCCN(C[C@@H](CBr)CC2CC2)C1 2112865629 DRBRDFSWSIUKLW-CVEARBPZSA-N 439.385 4.764 50 10 IJGE CCN(c1nc2ccccn2c1CBr)C1CCN(Cc2ccccc2)CC1 2143592395 BHWJRLAFQVFPRG-UHFFFAOYSA-N 427.390 4.720 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CCC(F)(F)[C@@H](CCl)C1 2148750627 MLPUELHYGNONNK-QMMMGPOBSA-N 431.502 4.548 50 10 IJGE CCC(CC)(CBr)CN1C[C@@H](CCNC(=O)C(F)(F)F)c2ccccc21 2163062129 JUJHNFSIIPHNEL-CQSZACIVSA-N 435.328 4.860 50 10 IJGE O=C(c1cc(Cl)ccc1Br)N1CCC([C@@H](F)CBr)CC1 2163244780 ITCOBJGSZLTCOR-ZDUSSCGKSA-N 427.539 4.688 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N(C)[C@H]1CCCCC[C@H]1Br 2172541855 AEHUZITUDZIIQI-MNOVXSKESA-N 445.242 4.536 50 10 IJGE CCc1ccc(-n2cc(CCC[C@H](C)Br)nn2)cc1I 2189280876 XQORXDVBKVZQGJ-NSHDSACASA-N 448.146 4.540 50 10 IJGE CN(CCCCCI)[C@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2211188415 ZIVLWOFUJXFYCT-HOTGVXAUSA-N 438.394 4.607 50 10 IJGE Cc1c(Br)csc1C(=O)NC1(CCBr)CCSCC1 2226126480 PZKYNGVRJVTLJU-UHFFFAOYSA-N 427.227 4.600 50 10 IJGE O=C(N1CCC[C@@H]([C@H]2CCCCN2CCCCCCBr)C1)C(F)(F)F 2231102140 CDTOELTWNVDYEG-HZPDHXFCSA-N 427.349 4.597 50 10 IJGE ClCc1nc2ccncc2n1-c1ccc(Br)cc1I 2231445882 KGHDJKLHQXFGRP-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@@H](OCC[C@@H]2CCCCC23CC3)C1 2246605883 HUQUJNZTNJMDQQ-JYJNAYRXSA-N 449.373 4.786 50 10 IJGE CC1CCC(CCl)(NC(=O)c2ccc(Cl)c(I)c2)CC1 2283651608 JPCISSRSJRLNBG-UHFFFAOYSA-N 426.125 4.862 50 10 IJGE O=C(NC[C@@H]1CCCC[C@@H](Cl)C1)c1ccc(Cl)c(I)c1 2283661107 FEGLJQAYWHCRJK-ZYHUDNBSSA-N 426.125 4.862 50 10 IJGE C[C@@H](Cl)c1cnn(Cc2ccc(I)c(Br)c2)c1 2306198799 FIQWKTQVMJHZPS-MRVPVSSYSA-N 425.495 4.598 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)[C@H]2[C@@H]3CCCO[C@@H]32)c1 2313495374 AIMRLQXKYUXFEA-DGAVXFQQSA-N 438.985 4.943 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)N(C)C)c(Br)cc1OCc1ccccc1F 2313567602 IRPMRCRKRFEUQE-UHFFFAOYSA-N 447.304 4.561 50 10 IJGE CCS(=O)(=O)C[C@@H](Br)c1c(F)cc(Cl)c(Br)c1Cl 2313812929 FDNHDNYWTAAYIC-RXMQYKEDSA-N 442.959 4.766 50 10 IJGE C=CCN1C(=O)C(=Cc2ccc(OCc3ccccc3Cl)c(OC)c2)C(C)=C(C#N)C1=O 2314617368 WWXISDBOONKZCC-UHFFFAOYSA-N 448.906 4.706 50 10 IJGE CCCCOc1ccc(C=C2C(=O)N(Cc3ccc(OC)cc3)C(=O)C(C#N)=C2C)cc1 2314617484 ZDCBPJQWTWBEPB-UHFFFAOYSA-N 430.504 4.667 50 10 IJGE BrCC12CC(CCN1Cc1c(Br)cccc1Br)C2 2314868608 MRTVGJODHHIWAF-UHFFFAOYSA-N 438.001 4.961 50 10 IJGE N=c1[nH]c2ccc(C(=O)NN=Cc3cccc(OCc4ccc(Cl)cc4)c3)cc2s1 2323595956 VNYUWLDPDQQAFZ-UHFFFAOYSA-N 436.924 4.705 50 10 IJGE Clc1cc2c(cc1[C@H](Br)c1cnsc1Br)OCCO2 2337303228 FJTGCTVLXQDHSC-NSHDSACASA-N 425.529 4.815 50 10 IJGE Cc1nc(C(=O)N(C)CC[C@@H](Br)c2cccs2)c(Br)s1 2366235992 DVHKKPBFPTWDIH-SECBINFHSA-N 438.210 4.874 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2ccc(OCc3cccc(C)c3)cc2)cc1 58893241 FEKFWOVNDGAJRF-ZABXAGCJSA-N 446.547 4.937 50 10 IJGE COc1ccc(C(=O)N/N=C/c2ccc(Sc3nc4ccccc4s3)o2)cc1OC 59383737 QOSWZIFAXDCGQR-WSDLNYQXSA-N 439.518 4.822 50 10 IJGE CC1=C(C#N)C(=O)N([C@H](C)c2ccccc2)C(=O)/C1=C/Nc1cccc(C(F)(F)F)c1 101234951 RSJZYMHXPQKARE-OOWUWCJESA-N 425.410 4.971 50 10 IJGE CCC(CCl)(CCl)Nc1ncc(C(F)(F)F)cc1I 686114492 QFJPSTKJIZILHJ-UHFFFAOYSA-N 427.035 4.743 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N(C[C@H]2CCCO2)c2ccncc2)c(C)n1-c1ccccc1F 733969723 AIHATYLUYITYDK-JDCXBEBJSA-N 444.510 4.747 50 10 IJGE CS(=O)(=O)c1ccc(F)c(NC(=O)CNc2cccc(S(F)(F)(F)(F)F)c2)c1 762533516 DVJSQOLRUSGHLL-UHFFFAOYSA-N 448.410 4.937 50 10 IJGE COc1ccc([C@H](C)COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cc1 768822226 GFTYUVCPHRPMRH-MLPWYGTASA-N 440.503 4.726 50 10 IJGE CC(C)c1nccnc1NNC(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 772845542 SQXVIZJGOIVKRJ-UHFFFAOYSA-N 432.459 4.577 50 10 IJGE CC(C)(C(=O)NNc1cc(Cl)ccn1)[C@H](O)c1ccc(OCc2ccccc2)cc1 778967375 RZIFZZNUYNKBTN-OAQYLSRUSA-N 425.916 4.517 50 10 IJGE Cc1cc(NC(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)n(-c2ccccc2C)n1 788051387 KLNDHXZXNRWSQY-CLMUKVTESA-N 443.551 4.632 50 10 IJGE Cc1cc(/C=C(/C#N)c2nnc(-c3cn(C)c4ccccc34)o2)c(C)n1C[C@H]1CCCO1 1341502959 CUYIUQKCMVZABO-NURJGKTBSA-N 427.508 4.890 50 10 IJGE C=CCn1c(SCC(=O)NNc2ccc(C)cc2Cl)nnc1-c1ccc(Cl)cc1 1468131382 NQFLLDWDHVKWET-UHFFFAOYSA-N 448.379 4.982 50 10 IJGE C/C(=C/C(=O)NNC(=O)CSc1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 1538917880 PDJLZBAUYKJZOH-XFXZXTDPSA-N 428.863 4.702 50 10 IJGE O=C(CCC(=O)c1cc(Cl)sc1Cl)NNc1nc2ccccc2[nH]c1=S 1640943620 WMRAAWYDLPXYPC-UHFFFAOYSA-N 427.338 4.767 50 10 IJGE Cc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccccc1F)C(C#N)=C(N)O2 1865681555 QJTDMWXOFOCPIQ-LJQANCHMSA-N 429.282 4.904 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1ccccc1OC)C(C#N)=C(N)O2 1865710266 SLPMLQHQZDBTIE-NRFANRHFSA-N 434.927 4.764 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)c3ccc(C(F)(F)F)cc3)c(C)n2)cc1C 1865756259 OLSAEEALZIKDMJ-UHFFFAOYSA-N 427.426 4.767 50 10 IJGE Cc1ccc(/C=C(\C#N)C(=O)Nc2ccc3c(c2)C(=O)N(c2c(C)cccc2C)C3=O)cc1 1866127103 IPGJOLPCDLUAGI-DEDYPNTBSA-N 435.483 4.958 50 10 IJGE Brc1ccc([C@H](CI)O[C@@H]2COC3(CCC3)C2)cc1 1889721372 CSPOTDVWRRYCSG-KBPBESRZSA-N 437.115 4.653 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)cc(Cl)c1 1914351808 BMWKUJKKOWMSID-GFCCVEGCSA-N 437.186 4.968 50 10 IJGE COc1ccc(CC(=O)N(Cc2ccccc2)[C@@H](CBr)C(C)C)cc1OC 1915272619 JSJIIRZPHVECRQ-IBGZPJMESA-N 434.374 4.695 50 10 IJGE C[C@@H]1OCCO[C@@H]1[C@@H](Br)c1cc(Br)sc1Br 1935560528 ZMBXYBCWJUXTII-HQLVHBAOSA-N 434.975 4.513 50 10 IJGE Brc1cccc(CN2CCC[C@@H](Br)CC2)c1Br 1943880332 DCDGJHHDTKUFLF-LLVKDONJSA-N 425.990 4.961 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@]23CCC[C@H](CI)O3)C1 1950281064 NNSWIOITOQUADZ-LZQZEXGQSA-N 449.373 4.931 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Cl)c(Cl)nc(C[C@H](O)CBr)c1Cl 1952709977 RWPZDHZUCQKYJH-LURJTMIESA-N 434.545 4.687 50 10 IJGE C=CCC[C@@H](CBr)NC(=O)c1scc(Br)c1Br 2019477776 LXBWSIYZKHTTPE-ZETCQYMHSA-N 446.002 4.733 50 10 IJGE Cc1c(F)ccc([C@H](Br)c2cc(I)sn2)c1C 2024312647 VIOIXATUEWNJML-LBPRGKRZSA-N 426.092 4.988 50 10 IJGE CC(C)N1C[C@H](Br)[C@H](Cc2cc(Cl)ccc2I)C1 2039249208 ASEBIKGXJUMKGQ-YPMHNXCESA-N 442.566 4.591 50 10 IJGE CCN(CCCCBr)C(=O)c1ccc(Br)cc1Br 2041184288 XGMBPBQLYVMOSM-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE O=C(CCl)c1cc(OC(F)(F)F)cc(C(F)(F)F)c1I 2055151204 BYSMWPDLOALNTE-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE FC(F)(F)c1ccc(I)c(CCl)c1I 2060238247 DYJCAFDABWXTLM-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE CC(C)[C@H](CBr)CN=[S@@](=O)(C(C)C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2063273396 MHDGDVSDYCKBCW-WHEFHEQHSA-N 439.460 4.539 50 10 IJGE CC(C)(C)[Si](OCCOc1cccc(N)c1Cl)(c1ccccc1)c1ccccc1 2080501990 STCTWLFYHWUGLV-UHFFFAOYSA-N 426.032 4.878 50 10 IJGE Clc1cc(CN2CC3(CC(CBr)C3)C2)ccc1I 2086656643 XTVHNZYQAAHYEZ-UHFFFAOYSA-N 440.550 4.552 50 10 IJGE CN(CC[C@H](Br)c1ccccc1)c1ccc(I)cn1 2111804546 GHYMGQYVTNYQRK-AWEZNQCLSA-N 431.115 4.649 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C[C@H](CBr)C2CCC2)C1 2185499687 HEAXZXPHQLWYGH-CVEARBPZSA-N 441.414 4.747 50 10 IJGE O=S(=O)(c1cc(F)c(Cl)c(CCl)c1)N1CCC[C@H](OCc2ccccc2)C1 2186388170 AWVFWXYHVGOBMV-INIZCTEOSA-N 432.344 4.588 50 10 IJGE COC[C@@H]1C[C@H]1[C@H](Br)Cc1cc(Br)cc(Br)c1 2252830729 HTRDTUZITSPVHC-ZWKOPEQDSA-N 426.974 4.800 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@H]2C[C@@H]3C[C@H]3CO2)c1 2263514869 HPPYRCWSNICRBG-NUZBWSBOSA-N 438.985 4.943 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CC(F)C2)c2ccccc2C1 2265639034 PLMSVGRLJZWBPW-UHFFFAOYSA-N 427.358 4.757 50 10 IJGE COC[C@]1([C@@H](Br)c2ccc(OC)c(Cl)c2Br)CCCO1 2283559421 GIMZCXXRXSLUQU-KBPBESRZSA-N 428.548 4.743 50 10 IJGE CC(C)(CBr)CCNCc1ccc(Cl)c(I)c1 2300238675 NSUKTNZAPLKASS-UHFFFAOYSA-N 430.555 4.845 50 10 IJGE Clc1ccc(CN2CC[C@@H](Br)[C@@H]2C2CC2)c(I)c1 2318539139 LHSMEAARDJRKHA-OCCSQVGLSA-N 440.550 4.692 50 10 IJGE CCN(C[C@@](C)(CBr)OC[C@@H]1C[C@H]2[C@@H](C1)C2(F)F)C(=O)OC(C)(C)C 2320756898 FSNRJDNRNMGJKP-UMPJEAMMSA-N 426.342 4.705 50 10 IJGE C[C@H]1C[C@H](Cl)CCN(Cc2ccc(I)c(Br)c2)C1 2325223223 WQESIQPSZKYYPA-CMPLNLGQSA-N 442.566 4.893 50 10 IJGE CN(c1c(CBr)c(C(F)F)nn1C)[C@H]1CN(Cc2ccccc2)C(C)(C)C1 2365332033 DJDKICKEIBNJJW-OAHLLOKOSA-N 441.364 4.742 50 10 IJGE O=C(c1ccc(Cl)cc1I)N(CCCl)Cc1ccsc1 2365583001 XWIBRXIXWACLBZ-UHFFFAOYSA-N 440.133 4.887 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4OC)ccc32)cc1 38685619 UJFNWRNXNSDOCO-XMMPIXPASA-N 442.471 4.531 50 10 IJGE CC(C)COCCO[C@H](CI)c1cccc(Br)c1 232698707 HYKHOLLMTNZGKC-CQSZACIVSA-N 427.120 4.614 50 10 IJGE CC(C)(C)[C@@H]1CCc2[nH]nc(C(=O)NN=C/C(Br)=C\c3ccccc3)c2C1 254835790 AGJBWSPGTINURG-ZUFRZZPGSA-N 429.362 4.712 50 10 IJGE CCc1ccc(O[C@H](C)C(=O)NN=Cc2ccc(OCc3ccccc3)c(OC)c2)cc1 256018506 NHOZFMVNCPMRIS-LJQANCHMSA-N 432.520 4.754 50 10 IJGE COc1ccc2cc(C(=O)O/N=C3\C[C@H]4CC[C@@]3(C)[C@@]4(C)CBr)c(=O)oc2c1 256020112 ZBFCKTZGCANFNK-VCHQNULYSA-N 448.313 4.536 50 10 IJGE Brc1cccc([C@H](CI)OCCOC2CCC2)c1 400782285 VIZFGEOLVCFVBP-AWEZNQCLSA-N 425.104 4.511 50 10 IJGE COc1cc(COc2c(Br)cc(Br)cc2CCl)sn1 401029825 DHONIEPIVXMZOP-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2Cc1cnc(Cl)s1 718897498 WEJQEJGQXUKGAI-UHFFFAOYSA-N 442.084 4.677 50 10 IJGE C[C@@H](NC(=O)NNC(=O)c1ccc(Cl)cc1)c1ccc(OCc2ccc(F)cc2)cc1 728753924 ZPAMHTFZMABPCF-OAHLLOKOSA-N 441.890 4.763 50 10 IJGE CCCn1c(C)cc(/C=C(\C#N)C(=O)Oc2ccc(OCc3nc(CC)no3)cc2)c1C 741625603 OFKHLTBUHJJESO-CPNJWEJPSA-N 434.496 4.552 50 10 IJGE O=C(CCCNc1ccc(Br)cc1)NN=Cc1cccc(Br)c1 1083956036 IXMBTIRTXQUNHE-UHFFFAOYSA-N 439.151 4.554 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2cc(Br)ccc2C2CC2)c1C 1472512952 PQEOVTQCRSMEOO-UHFFFAOYSA-N 438.329 4.552 50 10 IJGE CC[C@@H](Cc1cccc(Br)c1)C(=O)NNc1nc2ccccc2[nH]c1=S 1646013295 JKNWUTPPSXLOLF-ZDUSSCGKSA-N 431.359 4.767 50 10 IJGE CCCOc1c(OC)cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2CCC 1865693649 PRHKIZKRDIYLOC-OAQYLSRUSA-N 444.535 4.976 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2cccc(F)c2)cc1 1865694165 QUDVAPVKVRYZAK-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3Cl)c3c2[C@@H](c2ccc[nH]2)C(C#N)=C(N)O3)cc1 1865709753 GDCZOICZLTWSKZ-HXUWFJFHSA-N 443.894 4.748 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)CC1(N(C)C(=O)OC(C)(C)C)CCCCC1 1887824049 VNEJQFMHAAXHKU-IYBDPMFKSA-N 431.415 4.578 50 10 IJGE O=S(=O)(c1cccc2cnccc12)N(Cc1ccccc1)C1(CBr)CCC1 1915755101 IRJURJUHADLJDO-UHFFFAOYSA-N 445.382 4.743 50 10 IJGE CC1(CO[C@](C)(CI)CNC(=O)OC(C)(C)C)CCCCC1 1930933198 UAQAQYLIFQKYKG-QGZVFWFLSA-N 425.351 4.692 50 10 IJGE CC(C)C[C@H](CNC(=O)OC(C)(C)C)[C@@H]1CCC[C@H](CI)O1 1931100230 YHHBILQQZOQXLO-KFWWJZLASA-N 425.351 4.546 50 10 IJGE C[C@H]1CCN(Cc2cccc(Br)c2Br)C[C@@H]1Br 1943880794 KEAPXVAIJIJPGF-CABZTGNLSA-N 425.990 4.817 50 10 IJGE COc1cc(F)c([C@H](Br)c2cc(I)sn2)c(F)c1 2056487276 JJPJFYRBZUELHQ-LLVKDONJSA-N 446.054 4.519 50 10 IJGE CCC(CC)(CBr)CN=[S@@](C)(=O)CC1(C)CN(C(=O)OC(C)(C)C)C1 2072635750 HMZARCVINJCFIJ-VWLOTQADSA-N 439.460 4.543 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1ccc(Br)cc1Cl 2081235313 DPVQUBDOYLXXES-PELKAZGASA-N 444.538 4.682 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1ccc(F)cc1Br 2117894806 MTZICYYPUPMELD-JTQLQIEISA-N 442.110 4.702 50 10 IJGE CCCn1cc(S(=O)(=O)N(Cc2ccccc2)C2CCCC2)cc1CBr 2123272078 WIIHNQYPGBCSQD-UHFFFAOYSA-N 439.419 4.927 50 10 IJGE CC[C@H](CBr)CN1C[C@H](CNC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2129068457 QVYIODQJSIMUPT-NEWSRXKRSA-N 425.411 4.648 50 10 IJGE CC[C@@H]1CC[C@@H]([C@@H](Br)c2cc(I)cc3c2OCC3)O1 2136704937 BPYCWLKWAILPJM-XBFCOCLRSA-N 437.115 4.620 50 10 IJGE CO[C@H]1CC(Oc2c(CBr)ccc(Br)c2Cl)C[C@@H]1OC 2166419619 QRACKNOSUAEKPP-RYUDHWBXSA-N 428.548 4.569 50 10 IJGE CCc1ccc(-n2cc(CCC[C@@H](C)Br)nn2)cc1I 2189280875 XQORXDVBKVZQGJ-LLVKDONJSA-N 448.146 4.540 50 10 IJGE Cc1cc(Br)c(C(=O)NC[C@@]2(CBr)C[C@H]2C(F)(F)F)s1 2237621434 HMKSZNOOWWOHOK-KCJUWKMLSA-N 435.103 4.512 50 10 IJGE CC1CC(CBr)(CN(CCN(C)C(=O)OC(C)(C)C)CC(F)(F)F)C1 2254143225 KVTBJHIESHRAEB-UHFFFAOYSA-N 431.337 4.529 50 10 IJGE O=C(N[C@H]1C[C@H]2C[C@H]1C[C@H]2Br)c1cc(Br)c(F)cc1Cl 2285846737 RNXRPZWAXXDHIE-HQSAUTQVSA-N 425.523 4.533 50 10 IJGE Cc1nn(-c2cccc(Cl)c2)c(Cl)c1C=C(C#N)C(=O)NCCc1ccccc1 2297488370 RSPLPEUBKPNPGO-UHFFFAOYSA-N 425.319 4.753 50 10 IJGE Clc1ccc(C[C@]2(CBr)CCCCO2)c(I)c1 2302329177 PXYPEBVBKXHLKV-ZDUSSCGKSA-N 429.523 4.821 50 10 IJGE Clc1cc(CN2C[C@@]3(CBr)CC[C@H]2C3)ccc1I 2314922756 SOCNVTJHHGKJCT-FZMZJTMJSA-N 440.550 4.694 50 10 IJGE Cn1cc(I)c(C[C@@H]2CCC(C)(C)CC[C@H]2Br)n1 2319208500 VYPWXDJOYNXMHQ-WDEREUQCSA-N 425.152 4.547 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NN=Cc1ccc2c(c1)OCO2 2321250713 AVLRTPDYFMWCKV-UHFFFAOYSA-N 428.275 4.856 50 10 IJGE O=C(c1csc(Br)c1Br)N1[C@H]2CCC[C@H]2C[C@@H]1CCl 2329612909 QYQGDXYXVCNLTI-XKSSXDPKSA-N 427.589 4.895 50 10 IJGE CCN(C[C@@](C)(CBr)O[C@@H]1CCOc2ccccc21)C(=O)OC(C)(C)C 2340299608 QEIXXLVMTZJJNP-YLJYHZDGSA-N 428.367 4.937 50 10 IJGE O=C(Cc1ccc2ccccc2c1)N[C@H](CCBr)COCc1ccccc1 2369430991 LIVXXICHIMBTRQ-JOCHJYFZSA-N 426.354 4.869 50 10 IJGE Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2ccc(OCc3ccccc3)cc2)c1 14027885 WSWZFWGOIDZDKQ-UHFFFAOYSA-N 432.520 4.537 50 10 IJGE N#C/C(=C/c1cc2ccccc2nc1N1CCCCC1)c1nn(-c2ccccc2)c(N)c1C#N 33247495 QQFDTIFDLSCISV-PGMHBOJBSA-N 445.530 4.929 50 10 IJGE N#C/C(=C/c1cn(CCOc2ccccc2F)c2ccccc12)C(=O)NCc1ccco1 33929545 VUVLHEIVDTTZPV-JXAWBTAJSA-N 429.451 4.676 50 10 IJGE Cc1cccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccs2)c1C 38656537 PJJRMFZQNAKLIH-QHCPKHFHSA-N 432.501 4.568 50 10 IJGE N#C/C(=C/c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)C(=O)NCc1cccnc1 102855447 BGITWBBRXWZLAH-MOSHPQCFSA-N 439.906 4.811 50 10 IJGE C[C@H]1CCN(C(=O)c2cc(Br)sc2Br)[C@H]1CBr 235617567 GMWDNJCIFSZZJE-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](O[C@H]2C[C@H]3CC[C@@]2(C)C3(C)C)C1 303741835 PZNCMNCMCWAADV-JCJIIYQNSA-N 449.373 4.641 50 10 IJGE CC[C@H](Br)[C@@H](CC)NC(=O)c1cc(Br)c(Br)s1 313102113 FYQLCUGIVXHQRE-POYBYMJQSA-N 448.018 4.955 50 10 IJGE O=C(c1ccc(F)c(F)c1F)N(CCNC=S)Nc1ccc(Oc2ccccc2)cc1 586420383 HISMWSSHUCXTKY-UHFFFAOYSA-N 445.466 4.912 50 10 IJGE CC(C)C[C@@H]1CCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)C1 744639746 GIRDZDNTYQMUBG-YNGKYYQNSA-N 435.959 4.919 50 10 IJGE COc1ccccc1Nc1nc2sc(C(=O)NNc3cc(Cl)nc(C)n3)cc2s1 748334297 IPZHAZFAPVSDGZ-UHFFFAOYSA-N 446.945 4.619 50 10 IJGE O=C(NNC(=O)c1ccccc1)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 775354060 REZLTJZDIRNIBI-UHFFFAOYSA-N 433.855 4.542 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2nccc(C(F)F)n2)c(C)n1-c1ccc(Cl)cc1 809291508 AEMPEFZZMUHIRS-YBEGLDIGSA-N 441.869 4.699 50 10 IJGE C=CC[C@@H]1CCCC[C@H]1NC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12 1565063751 SEDFICIXTJKUGM-XMSQKQJNSA-N 428.536 4.981 50 10 IJGE C=CCCc1ccccc1NC(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1 1624133364 VJVKQLVEDUTAMC-UHFFFAOYSA-N 445.548 4.981 50 10 IJGE CCc1nn(-c2ccc(OC)cc2)c2c1[C@@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 1865686634 YHQMFJCODPIQKB-IBGZPJMESA-N 441.318 4.968 50 10 IJGE CC(C)(C)OC(=O)Nc1ccccc1C[C@@H](CBr)NC(=O)OC(C)(C)C 1880761414 NFKRJMCUYPLBHH-AWEZNQCLSA-N 429.355 4.864 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1sccc1Br 1916370378 MHZJOSVFAWRGHV-CYBMUJFWSA-N 447.192 4.563 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2ccc(CBr)cc2[N+](=O)[O-])C1 1921468088 CIHUVVWKXQZUSQ-IAGOWNOFSA-N 432.362 4.837 50 10 IJGE CC(C)CC(CBr)(CBr)Cc1c(Br)cnn1C 1940254912 BLRYNXADLZPTBD-UHFFFAOYSA-N 431.010 4.547 50 10 IJGE C[C@@H]1C[C@@H]1N(CCBr)Cc1ccc(Br)cc1Br 2002025354 BYFCEZCBOAJTME-RNCFNFMXSA-N 425.990 4.817 50 10 IJGE CSCC[C@H](Cl)CCNC(=O)c1scc(Br)c1Br 2029925978 UQSKCFAIQOLEJR-SSDOTTSWSA-N 435.634 4.754 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1C(=O)c1cccc(Br)c1Br 2031477829 OEEBEQUDMXUNEM-BDAKNGLRSA-N 439.973 4.600 50 10 IJGE Cc1oc(C)c(S(=O)(=O)N(Cc2ccccc2)[C@H](C)C2CC2)c1CBr 2059265261 SAKXQGGDMPIRBU-CYBMUJFWSA-N 426.376 4.781 50 10 IJGE FC(F)[C@H]1CCc2c3c(cc(I)c2[C@@H](Br)C1)CCO3 2094490336 ZPBWNDLVZJOQDD-WPRPVWTQSA-N 443.069 4.880 50 10 IJGE CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C[C@H](Br)C(F)(F)F)C2)CC1 2106785144 ARRYQZVFDAORSL-CABCVRRESA-N 443.348 4.671 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@@H]2CCCN(CC3(CBr)CCCCC3)C2)C1 2106788634 RHVXCCWTRLXICU-QGZVFWFLSA-N 429.443 4.911 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C(F)(F)F)CCCN1C[C@H](CBr)C(C)(C)C 2106789114 WGNMSRBDYOSJAV-SUMWQHHRSA-N 445.364 4.965 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C(F)(F)F)CCCN1C[C@@H](CBr)C1CCC1 2106789158 WRJNUZXRVPJTFN-RHSMWYFYSA-N 443.348 4.719 50 10 IJGE COc1cc(CBr)ccc1S(=O)(=O)N(Cc1ccccc1)[C@H](C)C(C)C 2123271676 TYGSWQWWHVIRKG-MRXNPFEDSA-N 440.403 4.826 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1ncccc1[C@@H](F)C(F)(F)F 2199311310 SXTVTRYLOATKND-GFCCVEGCSA-N 429.505 4.973 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(C[C@H](CBr)c3ccccc3)C[C@@H]2C1 2206174412 DBGXSTWZSRQNFE-FUMNGEBKSA-N 437.422 4.790 50 10 IJGE FCCOCCC(CBr)(CBr)c1cccc(Br)c1 2224060487 YWAZPWUVWUNUDL-UHFFFAOYSA-N 446.980 4.853 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2CCC[C@H](C1)[C@]21CCC[C@H](CI)O1 2249353369 DJXQVCSPTYMESE-LAIHZFQQSA-N 449.373 4.833 50 10 IJGE CCO[C@@H]1C[C@H]1[C@H](Br)Cc1cc(Br)cc(Br)c1 2252837344 OAVMJGQZSWJZCA-YNEHKIRRSA-N 426.974 4.943 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)[C@H](C)C[C@@H]1Br 2285845165 WPJDMBCJAAMDDX-MRTMQBJTSA-N 427.539 4.876 50 10 IJGE C[C@H]1CCCN(C(=O)c2cc(Br)c(F)cc2Cl)[C@H]1CBr 2285960161 TVSXBISDVVIQLD-SDBXPKJASA-N 427.539 4.877 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccccc2C(=O)O)ccc1OCc1ccc(F)cc1 2293531517 XJNSVGSKERYPTN-UHFFFAOYSA-N 446.434 4.657 50 10 IJGE CCO[C@H]1[C@@H](Oc2cc(Br)cc(Br)c2)C[C@H]1Br 2301115260 OJKRTZOZDJPANW-GRYCIOLGSA-N 428.946 4.531 50 10 IJGE C[C@H]1CCN(Cc2ccc(Cl)cc2I)[C@@H]1CBr 2302314875 BWSPETBNJMONGD-TVQRCGJNSA-N 428.539 4.550 50 10 IJGE CN(Cc1cc(I)ccc1Cl)CC(C)(C)CBr 2307315426 HWAAIKTVYDAMBB-UHFFFAOYSA-N 430.555 4.798 50 10 IJGE C=CC[C@]1(CBr)CCCN(Cc2sccc2I)C1 2316760146 QYRCYUQMBKQBLL-CQSZACIVSA-N 440.188 4.906 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)cc2I)C[C@@]1(C)CBr 2318529751 UQOAPXOCYHPJES-QMTHXVAHSA-N 442.566 4.798 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3CC2)C1 2345011736 VOTVADXNGKHWKZ-CALCHBBNSA-N 429.443 4.767 50 10 IJGE COc1cc(/C=N\NC(=O)CC[C@H](O)c2ccccc2)ccc1OCc1cccc(C)c1 58887878 SDDPKHZRGHVMMJ-WCFTWNFSSA-N 432.520 4.547 50 10 IJGE COc1ccc(OC)c(N/C=C(\C#N)c2nc(-c3cc4ccccc4oc3=O)cs2)c1 100312959 GXIUBPBILHVZOJ-NTCAYCPXSA-N 431.473 4.910 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)Nc1ccc(CCBr)cc1 136848659 UXMFJQDVKRIFAM-UHFFFAOYSA-N 439.194 4.557 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)N/C=C(/C#N)C(=O)N1CCC(Cc2ccccc2)CC1 216874684 JCXJBLBTIHMJQI-AZJLSSPBSA-N 431.580 4.933 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)N/C=C(/C#N)C(=O)N1CCC(Cc2ccccc2)CC1 216874721 JCXJBLBTIHMJQI-GHIWRQRASA-N 431.580 4.933 50 10 IJGE O=C(NC[C@@H]1CCCC[C@@H]1CCl)c1cc(Cl)ccc1I 236014935 UNFXXXLINDAQAW-MNOVXSKESA-N 426.125 4.720 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cnn(C(C)(C)C)c2-c2ccccc2)c1C 754248829 SWRGHBPPHYUEHF-UHFFFAOYSA-N 441.539 4.531 50 10 IJGE CC(C)(C(=O)NNc1nccnc1C1CCC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1 805473028 IHEGKRNIDYMQFT-QHCPKHFHSA-N 446.551 4.526 50 10 IJGE C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@@]2(c3ccccc3)C[C@H]2Br)cc1 1142298643 POODPCIZWCAOJL-NFBKMPQASA-N 439.353 4.545 50 10 IJGE C[C@H](SCc1nc(O)c2ccccc2n1)C(=O)NN(c1ccccc1)c1ccccc1 1264355909 IMGLUUSFYJVBBU-KRWDZBQOSA-N 430.533 4.827 50 10 IJGE C#CC[C@@H]1CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1438021304 UZZJTGFTVCQNFX-JZQBQCRLSA-N 436.353 4.635 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865702029 KXBGUYNRBUHSRC-QFIPXVFZSA-N 434.490 4.997 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)N/N=C\c1ccc(Br)cc1 1865762281 XRCASCIAJUXXHZ-MYKKPKGFSA-N 430.252 4.862 50 10 IJGE COc1ccc(-c2ccc(C(=O)N/N=C(/C)c3cc(F)ccc3F)c(C)n2)cc1OC 1865763629 VEJRXNPYHXWJAG-VYYCAZPPSA-N 425.435 4.506 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@H](CCl)C2(CCC2)C1 1914476372 ACOCUENROOVANE-QMMMGPOBSA-N 427.589 4.754 50 10 IJGE O=C(NCCCCCI)c1cscc1OCc1ccccc1 1934835335 CKCCBZLNQHVEMM-UHFFFAOYSA-N 429.323 4.662 50 10 IJGE CC(C)(C)OC(=O)NCCN(Cc1ccccc1)C[C@H](CBr)CC1CC1 1953667408 SNZLAGPATHKRNN-IBGZPJMESA-N 425.411 4.825 50 10 IJGE CC(C)[C@H](Br)CN(C)C(=O)c1csc(Br)c1Br 2002410796 OBAYOVUEPCOHSO-MRVPVSSYSA-N 448.018 4.765 50 10 IJGE BrCc1cc(Br)c(OCc2cnns2)c(Br)c1 2016181539 SPKWJOWUKCNGGK-UHFFFAOYSA-N 442.958 4.537 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H]3CC[C@@]3(CBr)C2)c1 2078145549 FFFBFEMNMWCIDR-SMDDNHRTSA-N 440.550 4.552 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@H](CNC(=O)OC(C)(C)C)C(F)(F)F 2106783743 CJSGYLXJABUTCP-LSDHHAIUSA-N 439.316 4.553 50 10 IJGE Clc1cc2c(cc1[C@H](Br)c1cc(Br)sn1)OCCO2 2120038452 IIBIOLPSWWCEDJ-LBPRGKRZSA-N 425.529 4.815 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@H](OC)C[C@H]1CNC(=O)OC(C)(C)C 2163060299 AOOVJLYMIUDKGM-ROUUACIJSA-N 449.474 4.972 50 10 IJGE CC(C)N(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)[C@H](Br)C1CCCC1 2167031230 HWHBUGXAYOYZSU-FUHWJXTLSA-N 445.442 4.824 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Cl)C2 2190671249 QXOTZWVJYQGPAK-WTFGDDLMSA-N 425.523 4.534 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1sc(C)c(C)c1Br 2221820989 VQNHEQFFKTXDBM-OIBJUYFYSA-N 444.176 4.707 50 10 IJGE CC[C@H](Br)CCCNC(=O)c1ccc(Cl)c(I)c1 2256387821 GROLIJMZCPUWEK-JTQLQIEISA-N 444.538 4.628 50 10 IJGE Cc1ccc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)c(CBr)n1 2287030544 JOHCSSOHEYYGNN-VMBXEPDQSA-N 426.402 4.632 50 10 IJGE COC[C@]1([C@@H](Cl)c2c(F)cc(Br)c(F)c2Br)CCCO1 2288481550 XDDJHDQEKDDFMH-STQMWFEESA-N 434.502 4.965 50 10 IJGE FC1(F)CCN(c2nc3ccc(Br)cc3s2)C[C@@H]1CBr 2296513040 BASGACNXCRRKDE-QMMMGPOBSA-N 426.124 4.915 50 10 IJGE C[C@H](c1ccncc1F)[C@H](Br)c1cc(I)sn1 2304297461 GVNAQZKSMYSXTA-KBUNVGBDSA-N 427.080 4.522 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccccc2OC)sc2c1CC[C@H](CC)C2 2314572171 VGABVXACWBFVRZ-HNNXBMFYSA-N 438.549 4.994 50 10 IJGE C[C@@H]1C[C@H](Br)[C@@H](C)N(Cc2ccc(Cl)c(I)c2)C1 2315548221 DWXYRILLOWORSW-FOGDFJRCSA-N 442.566 4.938 50 10 IJGE Clc1ccc(CN2C[C@@]3(CBr)CC[C@H]2C3)cc1I 2315550151 ADQXZKWZODPMNT-FZMZJTMJSA-N 440.550 4.694 50 10 IJGE Br[C@@H]1CC[C@@H]2CCN(Cc3sccc3I)C[C@@H]2C1 2316764704 PICONBPJPZEKTG-GRYCIOLGSA-N 440.188 4.738 50 10 IJGE Cn1cc(I)c(C[C@](C)(CBr)C2CCCCC2)n1 2319142438 CDWXOSHQZRCPCZ-CQSZACIVSA-N 425.152 4.549 50 10 IJGE CC(C)c1ccccc1NC(=O)C(C#N)=CNc1ccc(I)cc1 2324366032 BIOVZZMFMDNCTJ-UHFFFAOYSA-N 431.277 4.873 50 10 IJGE C[C@H](Cl)[C@@H]1CCCN(Cc2ccc(I)c(Br)c2)C1 2325214127 NNUSJNXLNFOHBX-CMPLNLGQSA-N 442.566 4.893 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@H](CN(C[C@@H](CBr)CC3CC3)C1)C2 2332632000 VMNGYLDVIJLLTC-WAOWUJCRSA-N 429.443 4.815 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@](C)(CBr)C(C)(C)C)C[C@H]1C(F)(F)F 2352072651 OJUDENYMBFBDCN-XNJGSVPQSA-N 445.364 4.821 50 10 IJGE COc1cccc([C@@H](CBr)OCc2cccc(I)c2)c1 2367352397 KXLKKBYYJFQJPA-MRXNPFEDSA-N 447.110 4.953 50 10 IJGE Cc1ccc(NS(=O)(=O)c2cccc(C(=O)N/N=C3\CCCc4ccccc43)c2)c(C)c1 12564757 DASDDZSOZAFJSL-SHHOIMCASA-N 447.560 4.575 50 10 IJGE Cc1cc(C(=O)O)ccc1-c1ccc(/C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)o1 33740797 XUQWUHLGJJWPGM-CPNJWEJPSA-N 439.471 4.700 50 10 IJGE CCCCc1nc(N2CCN(C(=O)CCCCl)CC2)c2c3c(sc2n1)CCCC3 35864954 HDDURKDICQYLAL-UHFFFAOYSA-N 435.037 4.580 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4OC)ccc32)cc1 38685621 UJFNWRNXNSDOCO-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE Cc1nn(-c2cccc([N+](=O)[O-])c2)c(C)c1/C=N/NC(=O)[C@H](C)c1ccc(CC(C)C)cc1 59158312 RVWFHKYUUAWWBV-CIRUFVMISA-N 447.539 4.850 50 10 IJGE CN(Cc1ccc(Cl)cc1)S(=O)(=O)c1cc(CCl)sc1Br 91271161 AKIBWCYFRZLRQP-UHFFFAOYSA-N 429.188 4.724 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C\NCc1cccc(Br)c1)c1ccc2c(c1)CCCC2 217204660 AGCLLDRBSQBYRV-KQRQPNSISA-N 438.369 4.702 50 10 IJGE CC[C@@](C)(CCBr)NC(=O)c1cc(Br)c(Br)s1 228569711 MXFXBJFENUNMBR-NSHDSACASA-N 448.018 4.957 50 10 IJGE Cc1cc(Br)c(S(=O)(=O)NCCCCCCCl)cc1Br 235784048 MATZHGIYSAPKIW-UHFFFAOYSA-N 447.620 4.598 50 10 IJGE CCCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3ccccc3O)cc2)cc1 254614524 LJGLLXZNJXEXAF-UHFFFAOYSA-N 432.476 4.554 50 10 IJGE O=C(OCc1ccccc1)N1C[C@H](c2ccccc2F)[C@@H](CI)C1 382697090 SOXDARICFPJRGU-RDJZCZTQSA-N 439.268 4.613 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CBr)[C@H](c2ccc(Br)c(F)c2)C1 382702510 PSRWPHABJLKSKN-RYUDHWBXSA-N 437.147 4.934 50 10 IJGE CC[C@H](Br)[C@H](C)NC(=O)c1cc(Br)ccc1Br 386799696 PWDOOPOTVDQXPK-XVKPBYJWSA-N 427.962 4.503 50 10 IJGE CCCCN(CCBr)Cc1cc(Cl)ccc1I 405356946 YWIPRFTUDKLBQK-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccc([C@H]2CNCCN2S(=O)(=O)c2ccccc2)cc1 616638938 LQUUOQILSLNWGJ-JOCHJYFZSA-N 446.689 4.544 50 10 IJGE Cc1sc([C@@H](Br)c2c(Br)cnn2C)cc1Br 693047020 INFHJRHCUUSLMV-SECBINFHSA-N 428.975 4.799 50 10 IJGE C[C@H](CCl)[C@@H]1CCCCN1C(=O)c1cc(Cl)ccc1I 696709570 BIHOPWFHQDBCTB-YGRLFVJLSA-N 426.125 4.814 50 10 IJGE O=C([C@@H](c1cccs1)N(C(=O)CCl)c1cccc(C(F)(F)F)c1)N1CCCC1 725237712 MIPKGVUTFWMUEL-QGZVFWFLSA-N 430.879 4.702 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F 768714094 JZOPRLHNKGIQQG-VQIMIIECSA-N 442.441 4.534 50 10 IJGE Cc1ccc(C(=O)O)cc1-c1ccc(C=NNC(=O)Cc2cccc(C(F)(F)F)c2)o1 1083995621 HBFZKVDKSNCCEB-UHFFFAOYSA-N 430.382 4.665 50 10 IJGE CC(C)c1ccccc1NC(=S)NNC(=O)c1cc2ccc(C(F)(F)F)cc2nc1O 1139339644 LURGOWYDLJAHBS-UHFFFAOYSA-N 448.470 4.714 50 10 IJGE C#CCC1(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)nc3ccccc23)CCCCC1 1521289407 HFCNEAYNWUIYDK-UHFFFAOYSA-N 425.532 4.945 50 10 IJGE COCCCN(C[C@@H]1CCCN2CCCC[C@@H]12)C(=O)CCCC[C@@H]1CCSS1 1614472313 YNUNLQRCFFUJHD-HBMCJLEFSA-N 428.708 4.830 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)CCOc1ccccc1)c1ccc(C(F)(F)F)cc1 1685817722 VRYXXNYAUVAHDZ-IBGZPJMESA-N 435.446 4.512 50 10 IJGE N#C/C(=C(/O)CCc1nc2ccccc2[nH]c1=O)c1nc(-c2ccc(F)cc2F)cs1 1872818198 RGRVCSHAYSNERH-ZHZULCJRSA-N 436.443 4.750 50 10 IJGE CC(C)(C)OC(=O)N1CC2(CCC3(CC2)CC[C@@](C)(CI)O3)C1 1923328284 ZETBAWORKKPHIJ-INIZCTEOSA-N 435.346 4.540 50 10 IJGE BrCC[C@H](NCc1cccc(Br)c1Br)C1CC1 1943885449 VPPPHGAVOBJFFU-LBPRGKRZSA-N 425.990 4.865 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OC[C@H]1CC12CCCCC2 1992224776 IWUOBMHXNARJAT-RHSMWYFYSA-N 437.362 4.692 50 10 IJGE Cc1cc(F)c([C@@H](Br)c2cc(I)sn2)cc1F 2007642675 APUKFILTYYOTRL-LLVKDONJSA-N 430.055 4.819 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)C1(CCBr)CC1 2026563087 HESGHIREOOZYBO-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE CC[C@@H](Br)CN(CC)C(=O)c1ccc(I)c(Cl)c1 2044549496 AOLZQLYPKASFOU-SNVBAGLBSA-N 444.538 4.580 50 10 IJGE BrC[C@]12CC[C@@H]1CN(Cc1ccc(Br)cc1Br)C2 2078136077 XOLJILJODADAIK-RISCZKNCSA-N 438.001 4.819 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@@H]2CCCCN(C[C@@H](CBr)CC3CC3)C2)C1 2112862128 ALYSOJNUSMAKAK-QZTJIDSGSA-N 429.443 4.767 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Br)c2n1CCc1cnn(Cc2ccccc2)c1 2151790175 PEJBOTURBSGIIF-CQSZACIVSA-N 444.764 4.981 50 10 IJGE Cc1c(Br)csc1C[C@@H](Br)c1ccc(S(C)(=O)=O)cc1 2169231871 MWQBGZWWYWDDBG-GFCCVEGCSA-N 438.206 4.901 50 10 IJGE O=C(c1c(Cl)cccc1Br)N1CC[C@@H](CBr)C(F)(F)C1 2169457323 BRCGZCBJECOPOL-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1ccc2scnc2c1[N+](=O)[O-] 2181740656 DFTNKGRBWKWYEH-UHFFFAOYSA-N 430.577 4.523 50 10 IJGE Brc1ccccc1[C@H](CI)O[C@H]1C[C@H](n2ccnc2)C1 2183661254 UIRTUCYWJUIFDW-HUBLWGQQSA-N 447.114 4.542 50 10 IJGE CC(C)(C)[C@H]1[C@H](Cl)CCN1C(=O)c1cc(Cl)ccc1I 2185112376 AZRUBZUHTQBBIE-DGCLKSJQSA-N 426.125 4.813 50 10 IJGE Fc1cccc([C@H](CI)OC2CCN(Cc3ccccc3)CC2)c1 2250369779 VXZWYFLAYJGQFZ-FQEVSTJZSA-N 439.312 4.983 50 10 IJGE Fc1cccc(I)c1[C@@H](Br)c1ccc2c(c1)OCCO2 2282783598 IYUXAQOOJHWFON-HNNXBMFYSA-N 449.057 4.686 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@H]2C[C@H]1CC[C@@H]2Br 2282975238 NUJLOKGWPMNLJX-MRTMQBJTSA-N 425.523 4.630 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@H]1[C@@H](CBr)C2 2282978912 SNYCUBXSGZLNGL-UJVNDKKSSA-N 425.523 4.630 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@H](CNC(=O)c2ccc(CBr)cc2)CC1 2295179822 KCXATMRAZQKHQI-KRWDZBQOSA-N 439.394 4.739 50 10 IJGE O=C(Cc1cc(Br)cc(Br)c1)N[C@@H](CCl)c1cccs1 2295311476 LCRNHGLVTMXKRH-LBPRGKRZSA-N 437.584 4.912 50 10 IJGE CC[C@@H](C)N(CCBr)Cc1ccc(Cl)cc1I 2302315444 JIHMSYGORDPRKE-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE CC(C)(CI)CN1Cc2ccccc2[C@H](NC(=O)OC(C)(C)C)C1 2306815766 MRNHXGLPKLROPY-MRXNPFEDSA-N 444.357 4.529 50 10 IJGE Brc1cc2c(cc1[C@@H](Br)[C@@H]1C[C@@H]1Br)OCCCO2 2311267502 XQSFLEITDXWPIM-CERSQZSQSA-N 440.957 4.830 50 10 IJGE COc1cc(C=C(C#N)C(=O)N(C)C)cc(Br)c1OCc1ccccc1Cl 2313566925 DPEKXHIWHLNEHG-UHFFFAOYSA-N 449.732 4.685 50 10 IJGE Cc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)cc1 2314634487 ZFMOOPUZGHEWKD-RUZDIDTESA-N 426.447 4.971 50 10 IJGE CC[C@H]1[C@@H](CBr)CCN1Cc1ccc(Cl)c(I)c1 2315551749 VMYQSXYYQNUGBB-RISCZKNCSA-N 442.566 4.940 50 10 IJGE COc1ccc(C=NNC(=O)c2cccc([N+](=O)[O-])c2)cc1OCc1cccc(Cl)c1 2321680364 UIVPHGRPQRGESV-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4)[nH]c3c2)cc1Br 2323744097 XHMGLCYAIKLYRB-UHFFFAOYSA-N 449.308 4.765 50 10 IJGE CC(C)CO[C@@H]1[C@@H](Cl)C[C@@H]1OCc1ccc(Cl)cc1I 2365647024 GEIKBYVLAGFLBR-AEGPPILISA-N 429.125 4.882 50 10 IJGE CCc1nc(C(=O)NCC(C)(C)[C@@H](Br)C(C)C)c(Br)s1 2365868302 PXHISHCFUMKCPS-NSHDSACASA-N 426.218 4.644 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CN(C[C@](C)(CBr)C(C)(C)C)CCO2)C1 2380167078 DFDPTOPLZRJNEW-SFTDATJTSA-N 447.458 4.536 50 10 IJGE Cc1cnc(N2C[C@@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)cc1CBr 2380366176 UPWJLVUYZLZFNX-ZRZAMGCNSA-N 426.402 4.777 50 10 IJGE CCOC(=O)c1sc(NC(=O)/C(C#N)=C/c2ccc(Cl)cc2)c(C(=O)OCC)c1C 1939981 XCFLHJWVQWERAK-GXDHUFHOSA-N 446.912 4.609 50 10 IJGE CC1(C)OB(c2cccc(-c3ncc(CO[Si](C)(C)C(C)(C)C)cn3)c2)OC1(C)C 205696593 NHEPQLBLCBEZOH-UHFFFAOYSA-N 426.442 4.965 50 10 IJGE Cc1ccc(C=NNC(=O)CSc2nnc(-c3ccccc3)n2-c2ccc(C)cc2)cc1 254824595 MKEVPEMLJXRAMX-UHFFFAOYSA-N 441.560 4.794 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@H]2CCSc3ccc(F)cc32)c(C)n1C[C@H]1CCCO1 302816412 QLOJRTYGYAOUSV-FKFKDJSOSA-N 439.556 4.683 50 10 IJGE C[C@@H]1[C@@H](n2c(CCCl)nc3cc(Br)cnc32)CCN1Cc1ccccc1 311901631 ALXGBJNVVVBECB-KDOFPFPSSA-N 433.781 4.811 50 10 IJGE Cc1ccc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CI)s1 382723989 PCJYJGUYAHIUJS-HZPDHXFCSA-N 441.334 4.844 50 10 IJGE COc1ccc(-c2cc(N)c(C(=O)NN=C3CCN(Cc4ccccc4)C[C@@H]3C)s2)cc1 734365479 IROWQONHVMQNJM-KRWDZBQOSA-N 448.592 4.634 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 756583913 RSCBWBKZVQRFDR-UHFFFAOYSA-N 443.290 4.712 50 10 IJGE Cc1c(C(=O)NNc2nc3ccccc3[nH]c2=S)cnn1-c1ccc(C(F)(F)F)cc1 1557584542 WILGKHQVPTWONG-UHFFFAOYSA-N 444.442 4.562 50 10 IJGE CC(=O)N(C)c1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(Cl)c3)c2C)cn1 1626948855 DXOHJIMBRSWRHL-YBFXNURJSA-N 447.926 4.671 50 10 IJGE CC[C@@H](C)NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc(Cl)cc1Cl)CCC2 1772749118 WULWUAKWNZTRTC-LLVKDONJSA-N 436.339 4.894 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccccc2)cc1 1865694109 PQAYZKWRRVMPKW-SFHVURJKSA-N 440.425 4.567 50 10 IJGE COc1cccc(-c2csc(/C(C#N)=C(\O)c3ccc4c(c3)C(=O)N(C(C)C)C4=O)n2)c1 1872744107 GYWBLRGBMCGYNX-VZCXRCSSSA-N 445.500 4.773 50 10 IJGE COc1cc(/C=C(\C#N)c2nc(-c3ccccc3)cs2)ccc1OCCN1CCOCC1 1872790169 OTQDUYNKUFQVPO-RCCKNPSSSA-N 447.560 4.594 50 10 IJGE C[C@@H](/C(O)=C(\C#N)c1nc(-c2cccc(Cl)c2)cs1)N1C(=O)c2ccccc2C1=O 1872818006 IAGFYIVYSDJBTF-LCIOQVQZSA-N 435.892 4.941 50 10 IJGE COC[C@@]1([C@@H](Br)c2cc(Br)sc2Br)CCCO1 1943037277 RAVYERHCHFIRFZ-GXSJLCMTSA-N 449.002 4.905 50 10 IJGE BrCCN(Cc1cc(Br)ccc1Br)C1CCC1 2006503224 LRTSKYLLKKZMNU-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE BrCC1CC2(CCN2Cc2ccc(Br)cc2Br)C1 2042651336 HKCORIMTNFNEMC-UHFFFAOYSA-N 438.001 4.961 50 10 IJGE CCN(C[C@H](Br)C(F)(F)F)[C@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2044700640 RREBRLDFUGNXET-RDBSUJKOSA-N 431.337 4.718 50 10 IJGE CCC[C@H](CBr)CN1CCC[C@@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2044705211 JMDAWTFBGTZACO-CZUORRHYSA-N 431.337 4.719 50 10 IJGE BrC[C@@H]1C[C@H]2CN(Cc3ccc(Br)cc3Br)C[C@H]12 2053979283 DMDHFDYIXMUSMU-GMXVVIOVSA-N 438.001 4.674 50 10 IJGE FC(F)(F)c1c(Br)c(CBr)nn1-c1ccc(C2CC2)nc1 2078912900 ARQLRLRZRLJTBY-UHFFFAOYSA-N 425.046 4.821 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@@H]2CCC[C@H](Cl)[C@H]2C1 2094588911 VSUDVRKYMGSWOV-NRPADANISA-N 427.589 4.753 50 10 IJGE O=S(=O)(Nc1cccc(CCCBr)c1)[C@H]1C[C@H](OCc2ccccc2)C1 2105018415 CHHUKZNVTVEGRU-MXVIHJGJSA-N 438.387 4.504 50 10 IJGE C[C@H]1CN(C[C@@H](CBr)c2ccccc2)C[C@@H](C)[C@@H]1NC(=O)OC(C)(C)C 2106789130 WLSLYOKAWVMGPU-JFRXWTBNSA-N 425.411 4.646 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@@H]1CCCN(C[C@H](Br)C(F)(F)F)C1 2106789422 YKAXEOQZXXIDGF-KFWWJZLASA-N 443.348 4.814 50 10 IJGE Cc1ccc(C(=O)N[C@@H](C)CCCCCI)cc1Br 2117896351 ZTBNVFHVLVIMAR-LBPRGKRZSA-N 438.147 4.871 50 10 IJGE O=C(N[C@@H]1C[C@H]2CC[C@H]1[C@H](Br)C2)c1cc(Br)c(Cl)s1 2139707344 RTHYQZQPDOGATD-QHOPCYEYSA-N 427.589 4.846 50 10 IJGE Clc1ccc(CN2CCC(COCCBr)CC2)c(Br)c1 2167402548 WZWZDBJQVXBKBL-UHFFFAOYSA-N 425.592 4.726 50 10 IJGE CC(C)C[C@@H]1CCCN1S(=O)(=O)c1cc(CBr)sc1Br 2179784599 BFIQTFUUMFFYLF-JTQLQIEISA-N 445.242 4.605 50 10 IJGE COc1cc(CCl)cc(Br)c1OCc1ncsc1Br 2226134112 OHDHFFMTXDRFJS-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CCCCCCBr)C[C@H]1c1ccccc1 2231090859 XKCBFDKJKXAQFH-OALUTQOASA-N 425.411 4.934 50 10 IJGE C[C@@]1(CNc2ncc(I)cc2Br)CCC[C@@H]1Cl 2249866240 XJXZGSFETVLIBR-JQWIXIFHSA-N 429.527 4.658 50 10 IJGE CCCN(C[C@@H](C)Br)C(=O)c1cc(Br)sc1Br 2250567345 BYRKUZPCKFUQAM-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE O[C@@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@H](Br)C1 2250732968 SXXVMHVIYJSVOU-RDSNPXOSSA-N 434.900 4.697 50 10 IJGE C[C@@H](Br)[C@H](NC(=O)c1cc(F)c(Br)cc1Cl)C(F)(F)F 2282966615 HHSANAZDQUHLRF-MOFOKWOHSA-N 441.444 4.686 50 10 IJGE O=C(NC[C@H]1CCC[C@@H](Br)C1)c1cc(F)c(Br)cc1Cl 2282970430 OLMPSJANCIRCIZ-DTWKUNHWSA-N 427.539 4.925 50 10 IJGE C=CC[C@]1(CBr)CCCN1C(=O)c1ccc(I)c(C)c1 2287793146 ROLCNYJTJRMCMI-MRXNPFEDSA-N 448.142 4.545 50 10 IJGE CC1(C)OC[C@H](Cc2cc(I)ccc2Cl)[C@H]1Br 2307330027 IZNSLEQRAUIDIC-JOYOIKCWSA-N 429.523 4.676 50 10 IJGE Brc1cnc(N2CC[C@H]3CC[C@H](Br)[C@@H]2C3)c(Br)c1 2310077607 QXOPQLBMMQPVIN-QRTLGDNMSA-N 438.989 4.749 50 10 IJGE BrC[C@@]12CCC[C@@H]1N(Cc1sccc1I)CCC2 2316760188 RLPWFLIOAORCMD-KBPBESRZSA-N 440.188 4.882 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C2)C1 2345004703 NXVJZPTUFNPFDQ-IRXDYDNUSA-N 429.443 4.767 50 10 IJGE COc1nc(OCc2cc(I)ccc2Cl)c(CCl)s1 2352251483 HKZOZLCMGYSFNF-UHFFFAOYSA-N 430.094 4.728 50 10 IJGE C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)COc1ccc(-c2ccccc2)cc1 14665909 FUDROHFUBDLRPO-LJQANCHMSA-N 446.547 4.645 50 10 IJGE Cc1c(C(=O)Nc2cccc(Cl)c2)oc2c1/C(=N/NC(=O)c1ccc(O)cc1)CCC2 40812088 KRJDFHOVYRTLKU-NLRVBDNBSA-N 437.883 4.670 50 10 IJGE CCc1ccccc1OCC(=O)N/N=C/c1ccc(OCc2ccccc2C)c(OC)c1 40888723 VPAGFQAITFJFBK-JVWAILMASA-N 432.520 4.674 50 10 IJGE CCCCC(=O)N/N=C/c1ccc(Sc2nc3ccccc3c(=O)n2-c2ccccc2)o1 59392340 HQKJABIEYDJCJF-PCLIKHOPSA-N 446.532 4.770 50 10 IJGE CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=C/c1cc(Br)c(N2CCCC2)o1 59678482 YFIVMAYFLGXSLH-VGOFMYFVSA-N 436.313 4.651 50 10 IJGE O=C(N[C@H](CCl)Cc1ccccc1)c1cc(Br)c(Br)s1 137228496 HHJFGQJCZQAJON-JTQLQIEISA-N 437.584 4.853 50 10 IJGE CCCCN(CCBr)C(=O)c1cc(Br)sc1Br 232951181 YWZKIMUUKGKXOU-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE COc1cc(Br)ccc1[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1CBr 382681394 BIZZBRQVLVNZQA-SMDDNHRTSA-N 449.183 4.803 50 10 IJGE CCCCOCCCNC(=O)Nc1cccc(C(=O)Nc2ccc(SC#N)cc2)c1 586626231 QIZUOFOANSEBMJ-UHFFFAOYSA-N 426.542 4.840 50 10 IJGE CCN(CC)CCCCNC(=O)c1cccc(NC(=O)Nc2ccc(SC#N)cc2)c1 586699919 CPKNPCVCZMYIMQ-UHFFFAOYSA-N 439.585 4.756 50 10 IJGE CCCC(CBr)(CCC)CN(C)C[C@]1(O)CCN(Cc2ccccc2)C1 711756068 LHBQHUHQDQZWSU-JOCHJYFZSA-N 425.455 4.537 50 10 IJGE O=C(NC1(CBr)CCCCCC1)c1ccccc1I 713459752 WETLVDXVQRLDLO-UHFFFAOYSA-N 436.131 4.509 50 10 IJGE O=C(NNc1cccc(F)c1F)c1ccccc1C(=O)c1ccc(Br)cc1 743725483 FPNZLYUCRJSUOH-UHFFFAOYSA-N 431.236 4.715 50 10 IJGE O=C(CCOc1ccccc1)NNC(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F 755614320 MDCXIEUDBZTCDD-MRXNPFEDSA-N 447.866 4.528 50 10 IJGE Cc1c(C(=O)N2CCCc3ccccc32)oc2c1C(=NNC(=O)c1ccccc1F)CCC2 1772744238 STFSZWZCKPKXMC-UHFFFAOYSA-N 445.494 4.791 50 10 IJGE COc1cc(C=NNC(=O)COc2cccc(C)c2)ccc1OCc1ccccc1Cl 1772752559 IJOAEGYTONQCDB-UHFFFAOYSA-N 438.911 4.765 50 10 IJGE Cc1ccc(Cn2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(O)cc2)cc1 1865683885 KHTBQUMERQXWGP-QHCPKHFHSA-N 434.499 4.831 50 10 IJGE CSCC[C@H](NC(=O)/C(C)=C/c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1866810885 APYOTYDFTIEBNS-VISDOYDDSA-N 425.579 4.540 50 10 IJGE Cc1ccc(COc2ccc(/C=N/NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc2)cc1 1873792388 ADCNWYNNALCSPI-WGLQLPMYSA-N 439.556 4.573 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCCCC[C@H]1NC(=O)OC(C)(C)C 1880761481 NTZAQNKGUKUECK-RBSFLKMASA-N 435.403 4.748 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)CC1(NC(=O)OC(C)(C)C)CCCCC1 1890316571 KXGDCRVDPNCOOA-AWEZNQCLSA-N 435.403 4.892 50 10 IJGE O=C(N[C@H](CCCl)C(F)(F)F)c1csc(Br)c1Br 1918540881 MWBROXKLLQMPRT-RXMQYKEDSA-N 429.483 4.563 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OC[C@@H]1CC12CCCCC2 1992224777 IWUOBMHXNARJAT-WMLDXEAASA-N 437.362 4.692 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@@](C)(CI)O2)C[C@@H]1C1CCC1 2018371738 OMMWTXWVQMOFSK-AYOQOUSVSA-N 449.373 4.929 50 10 IJGE O=C(N[C@H]1C[C@H](CCBr)C1)c1cc(Br)c(Br)s1 2021778643 CXTKDBGSMKPKCO-LJGSYFOKSA-N 446.002 4.567 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@@H]1Cc1ccc(I)c(Cl)c1 2026564483 UEUHSWOLXXQQHL-OPQQBVKSSA-N 429.523 4.676 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@H]2OCCO[C@H]2C)cc1Br 2027178979 UNDZQPAUBORDOP-HJIKLVIJSA-N 442.973 4.760 50 10 IJGE CC(C)[C@H](CBr)CN=[S@@](C)(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C 2044705872 ORFXXRWFXGZAEK-XGZNKIABSA-N 441.476 4.691 50 10 IJGE CN(C(=O)c1sccc1I)[C@@H]1CCCCC[C@@H]1Br 2052430057 VISIRNXKARHUHC-GXSJLCMTSA-N 442.160 4.521 50 10 IJGE Brc1ccc(CN2CC[C@H](Br)[C@H]2C2CC2)c(Br)c1 2067015097 FUFNCDSMCOWPJO-GXTWGEPZSA-N 438.001 4.959 50 10 IJGE ClC[C@@H](Nc1ncc(I)cc1Br)[C@H]1CC=CCC1 2075336708 XQKUXUUYORZPKD-JOYOIKCWSA-N 441.538 4.824 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 2106784872 LRLFSRRTUKYDFU-OTWHNJEPSA-N 425.411 4.933 50 10 IJGE CCC[C@@]1(CNC(=O)[C@H](Br)C2CCCC2)CCCN1C(=O)OC(C)(C)C 2110720100 BEONVKSVOQMOTD-UZLBHIALSA-N 431.415 4.626 50 10 IJGE C[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)N(C(=O)c2ccc(CBr)cc2)[C@@H]1C 2163056326 QEFZZDPFJOKLHQ-RKVPGOIHSA-N 439.394 4.735 50 10 IJGE CC(C)(C)OC(=O)NC1(C2CCN(C(=O)[C@@H](Br)C3CCCC3)CC2)CCC1 2167030391 BENPDJQBCQYPEV-KRWDZBQOSA-N 443.426 4.626 50 10 IJGE F[C@@]12CCC[C@]1(CBr)CN(Cc1ncc(Br)cc1Cl)C2 2183581816 QAPHTMKURLSGRF-UONOGXRCSA-N 426.555 4.587 50 10 IJGE O=C(c1ccc(Br)c(Cl)c1)N1CC[C@H](C(F)(F)CBr)C1 2197763404 NTOSBFVEQMDZMF-VIFPVBQESA-N 431.502 4.595 50 10 IJGE C[C@](CI)(O[C@@H]1[C@@H]2[C@H]3C[C@@H]4[C@@H]([C@H]32)[C@@H]41)c1ccccc1Br 2208404056 BWOBTWGJKJTBCG-MKCWFBDCSA-N 445.138 4.626 50 10 IJGE Cc1c(Br)sc([C@H](Br)[C@]23CCC[C@@H]2CS(=O)(=O)C3)c1C 2234212173 CHAKOKARWRQJAP-OSMZGAPFSA-N 442.238 4.778 50 10 IJGE CC(C)(C)OC(=O)N1[C@H](CNC(=O)[C@@H](Br)C2CCCC2)C[C@H]2CCCC[C@H]21 2240968530 RHCOGNIATMOWMG-XDNAFOTISA-N 443.426 4.625 50 10 IJGE O=C(N[C@H](CBr)Cc1ccccc1)c1scc(Br)c1Cl 2279174580 AGOWMMLEXHQRKD-JTQLQIEISA-N 437.584 4.900 50 10 IJGE C[C@H](Sc1ccccc1)C(=O)NN=Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1 2297708714 JTAJEFTUAFEWRJ-KRWDZBQOSA-N 435.505 4.805 50 10 IJGE C[C@@H](Br)CCCN(C)C(=O)c1cc(Br)sc1Br 2299590188 SMEXMJAPWVXRAC-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE CC(C)[C@@H](CCCl)NCc1ccc(I)c(Br)c1 2306216008 AQEMVAFQJLHOBJ-CYBMUJFWSA-N 430.555 4.797 50 10 IJGE COc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2F)cc1 2314634060 HTTQVIVUOUHWBQ-VWLOTQADSA-N 442.446 4.671 50 10 IJGE O=C(NN=Cc1cccc(Cl)c1Cl)c1cccn(Cc2ccc(Cl)cc2)c1=O 2323650809 DLKDULNFIJAIIH-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE CCOc1c(Cl)cc(C=NNC(=O)c2nc(-c3ccccc3)sc2C)cc1OC 2323752418 DIFNCQZBLWCSNP-UHFFFAOYSA-N 429.929 4.943 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc(C(F)(F)F)cc1 2343419378 YZLPQJVCCQVUHB-QGZVFWFLSA-N 430.264 4.806 50 10 IJGE COc1cccc(/C=C(/C#N)c2nn(-c3ccccc3)c(N)c2C#N)c1OCc1ccccc1 33926524 BWYAGEKERVFOQB-QNGOZBTKSA-N 447.498 4.978 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(C)cc1)CCC2 40804510 SXPADKTZXBXSIB-TURZUDJPSA-N 445.519 4.936 50 10 IJGE Cc1cc(C)cc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(O)cc2)CCC3)c1 40812020 UHQNPPRTPMHMLT-NHFJDJAPSA-N 431.492 4.633 50 10 IJGE COc1cccc(O[C@@H](C)C(=O)N/N=C/c2ccc(OCc3ccc(C)cc3)c(OC)c2)c1 40960761 OTRQPGCLGVNXJV-FQNOVECQSA-N 448.519 4.509 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C/c2cc(C)n(-c3ccc(C)cc3)c2C)cc1 58893058 LEMOTRREOXZAOB-YYYGAUAXSA-N 433.552 4.765 50 10 IJGE COc1cc(/C=C2/C(=O)N(Cc3ccccc3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 101335171 BRRKRFMJJWOXJL-CIAFOILYSA-N 430.504 4.522 50 10 IJGE CCCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccccc3)c(OC)c2)C1=O 214229166 RNDDWJCGHBTMRT-STZFKDTASA-N 430.504 4.667 50 10 IJGE CCN(CC)c1ccc(N/C=C(/C#N)C(=O)N[C@@H](C)c2ccc(OC)c(OC)c2)c(C)c1 217174816 PXUSCKUERGJOLL-OBKVJGTNSA-N 436.556 4.555 50 10 IJGE CCCCCCOC1(CI)CCN(C(=O)OC(C)(C)C)CC1 231314061 MGSNNIDXZGEQIX-UHFFFAOYSA-N 425.351 4.788 50 10 IJGE ClCc1nc2cc(Br)cnc2n1C[C@H]1CCCCN1Cc1ccccc1 379577968 BGFRIOJRHMVKAE-QGZVFWFLSA-N 433.781 4.987 50 10 IJGE CO[C@@](C)(COCc1ccccc1)Cn1c(CCl)nc2cc(Br)cnc21 702773785 QURRVUFGAGXPJO-LJQANCHMSA-N 438.753 4.555 50 10 IJGE CCOc1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CBr)cc1OCC 725392529 UWZFLZDXUFJQKO-HZPDHXFCSA-N 428.367 4.829 50 10 IJGE O=C(NNc1ncnc2ccsc12)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 766674062 WACNCEWSFSSTHJ-UHFFFAOYSA-N 446.467 4.668 50 10 IJGE Cc1cc2ccc(Cl)cc2nc1NNC(=O)c1ccc2c(c1)nc(O)n2CC(F)(F)F 779035400 GGRIUMIKPBUJBN-UHFFFAOYSA-N 449.820 4.571 50 10 IJGE COc1ccc(C(=O)c2ccccc2C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1 799751178 JSIIUNJYIKJCNS-UHFFFAOYSA-N 439.393 4.574 50 10 IJGE C=CCOc1cc(Br)c(C=NNC(=O)c2cc3ccccc3o2)cc1OC 1084275530 NGZGZIRXVZGHHD-UHFFFAOYSA-N 429.270 4.533 50 10 IJGE Cc1ccccc1OCC(=O)NN=Cc1cc(C)n(-c2cccc(Br)c2)c1C 1084591830 QZVKTIDDIFUDCZ-UHFFFAOYSA-N 440.341 4.694 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1)c1ccc(C(F)(F)F)cc1 1135740434 HIBZEZRMQAINLE-JQIJEIRASA-N 434.458 4.995 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=S)Nc3cccc(Cl)c3)cc2)cc1 1538892439 WEXRIQAKJHEOBD-UHFFFAOYSA-N 439.924 4.966 50 10 IJGE C=CCO[C@H]1CCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1 1566816827 VBNQEFRTFQRMJW-LPRAYXGFSA-N 443.469 4.823 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(CC(C)C)c1C)c1ccc(Br)cc1 1596979001 SEPGLBVBEWMAGA-AFHVAHMMSA-N 438.369 4.921 50 10 IJGE C[C@@H](CC(=O)NNc1nc2ccccc2[nH]c1=S)c1ccc(F)c(Br)c1 1646017024 DUTJHXUSSLLFQH-JTQLQIEISA-N 435.322 4.831 50 10 IJGE Cn1cc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccccc2)c2ccccc21 1865699244 OFXZXPHHVVPNQC-IBGZPJMESA-N 449.436 4.660 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2)[C@H]1c1ccc([N+](=O)[O-])cc1 1865712745 GQFJXTPYBARCPB-QFIPXVFZSA-N 449.470 4.725 50 10 IJGE COc1ccc(-c2ccc(C(=O)NNC(=O)/C=C/c3ccc(C(C)C)cc3)c(C)n2)cc1 1865756863 APSVUZMYZDSKKJ-FRKPEAEDSA-N 429.520 4.663 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@]2(CCC[C@H]2Cl)C1 1918918064 XCZAYEXQMLASNA-NOZJJQNGSA-N 427.589 4.897 50 10 IJGE CC[C@@H](Br)CCNC(=O)c1csc(Br)c1Br 1937737556 KPRNVZPHMIRQNL-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE O=C(NCC[C@@H](Br)C1CC1)c1cc(Br)c(Br)s1 1942740273 CAZWKASJKOPWDT-SSDOTTSWSA-N 446.002 4.567 50 10 IJGE CN(Cc1c(Br)cccc1Br)CC(F)(F)CBr 1945725140 CWFPPIYFAIYZAC-UHFFFAOYSA-N 435.932 4.674 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@@H]2CCCCN(C[C@H](CBr)C3CCC3)C2)C1 1966480593 CKNFHIVAFWRPCS-MSOLQXFVSA-N 429.443 4.767 50 10 IJGE C[C@@H]1CCN(Cc2cc(Br)ccc2Br)C[C@H]1Br 2006503568 PUWZRSLUMJVFPO-NOZJJQNGSA-N 425.990 4.817 50 10 IJGE Brc1ccc(CN2C[C@H]3C[C@@H](Br)C[C@H]2C3)c(Br)c1 2031403628 RWDKWQCFEIZYMO-ZWKOPEQDSA-N 438.001 4.959 50 10 IJGE CN(C(=O)c1csc(I)c1)[C@@H]1CCCCC[C@@H]1Br 2052427311 BUAYTIOINKPLKX-WDEREUQCSA-N 442.160 4.521 50 10 IJGE Cc1ccc(Br)c(CN[C@H](C)CCCCCI)n1 2054155905 UWOGBLLVCGFKCP-LLVKDONJSA-N 425.152 4.626 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)CC2CC2)C[C@@H]1CC(F)(F)F 2119510932 BIXFIICJRRGCGC-CABCVRRESA-N 443.348 4.671 50 10 IJGE CCCn1cc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)C2CC2)cc1CBr 2123267712 AZFGKAKWPGOASA-INIZCTEOSA-N 439.419 4.782 50 10 IJGE C[C@H](CCBr)CCN1CCC[C@@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2129042649 JSIMLGGIKOCERZ-HUUCEWRRSA-N 429.403 4.747 50 10 IJGE Brc1cccc([C@@H](CI)OC[C@H]2C3C[C@@H]4C2[C@@H]4C3)c1 2134516177 FKOJSISRKQDBLI-IRQMMQKESA-N 433.127 4.844 50 10 IJGE Cc1cnc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)c(CBr)c1 2159669433 DASMPWXNPCIQHW-GBAJDQEWSA-N 426.402 4.632 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@H]2C[C@@H]([C@@H](F)CBr)C2)cc1Cl 2199059216 QSLSPHPFRSHONL-RWEMILLDSA-N 427.539 4.652 50 10 IJGE CCC12COC([C@@H](Br)c3cc(I)cc4c3OCC4)(C1)C2 2205185631 GDBVVRLMARAQTR-FHERZECASA-N 449.126 4.621 50 10 IJGE C[C@H]1[C@H](C)CC[C@@H](CNC(=O)OC(C)(C)C)N1CCCCCI 2211188875 GYEYMQOFFXKQEW-PMPSAXMXSA-N 438.394 4.605 50 10 IJGE Cc1c(Br)csc1[C@@H](Br)c1cc(S(C)(=O)=O)cs1 2219004331 CCLSFAUZFKCTDB-JTQLQIEISA-N 430.208 4.768 50 10 IJGE CN(C)CCCN(CCNC(=O)OC(C)(C)C)CC1(CBr)CCCCCC1 2280549529 YVFQUSKDRZTVHB-UHFFFAOYSA-N 448.490 4.500 50 10 IJGE COC[C@]1([C@H](Br)c2ccc(OC)c(Cl)c2Br)CCCO1 2283559422 GIMZCXXRXSLUQU-KGLIPLIRSA-N 428.548 4.743 50 10 IJGE CN(C(=O)c1cc(Br)c(F)cc1Cl)[C@@H](CCBr)C(F)F 2285845510 BKFRWWKZMNOUJB-JTQLQIEISA-N 437.481 4.732 50 10 IJGE COc1ccc(Br)c2c1nc(CCCl)n2C[C@H]1CCN1Cc1ccccc1 2286081594 VJEFHCPCOZUVKL-MRXNPFEDSA-N 448.792 4.863 50 10 IJGE COC[C@H]1C[C@H](CNC(=O)OC(C)(C)C)N(CC2(CBr)CCCCCC2)C1 2289590996 YHXZSHOTYUQZJT-ZWKOTPCHSA-N 447.458 4.584 50 10 IJGE Cc1ccc(NC(=O)COc2ccc(C=C(C#N)C(=O)N[C@H]3CCCC[C@H]3C)cc2)cc1 2297500520 LTHDIUBJMWFOSZ-DVECYGJZSA-N 431.536 4.614 50 10 IJGE CC(C)(CBr)CCNCc1cc(I)ccc1Cl 2307328336 LQUXYGNTWBUQTH-UHFFFAOYSA-N 430.555 4.845 50 10 IJGE FC(F)C(F)(F)CO[C@@H](CI)c1ccccc1Br 2315878044 OXJBADYHWPJWAF-VIFPVBQESA-N 441.000 4.842 50 10 IJGE Cc1ccc(C=NNC(=O)CSc2nc(O)c3c(-c4ccc(C)cc4)csc3n2)cc1 2320488254 VBCNJFMRUGZZNE-UHFFFAOYSA-N 448.573 4.923 50 10 IJGE N#CC(=CNCc1cccc(Br)c1)C(=O)Nc1cccc(Cl)c1Cl 2324381119 NELBYTXGGAPCOS-UHFFFAOYSA-N 425.113 4.892 50 10 IJGE C=CC[C@H](Cl)[C@H]1CCN1Cc1ccc(I)c(Br)c1 2325230214 RJTIXYRCIUQDPB-GXTWGEPZSA-N 440.550 4.812 50 10 IJGE N#CC(=CNC[C@@H]1COc2ccccc2O1)C(=O)Nc1ccccc1Sc1ccccc1 2325339644 XRNSNNVJNZVIJF-LJQANCHMSA-N 443.528 4.613 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3C[C@H](NC(=O)OC(C)(C)C)CC[C@H]3C2)C1 2345010867 OQZCMEBPRXWNLY-GVDBMIGSSA-N 429.443 4.813 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN(C[C@@]2(CBr)CC2(F)F)C1 2351886686 CLWRLQLZCWIWAB-DAYGRLMNSA-N 437.369 4.518 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1I)[C@H]1CCCCC[C@H]1Cl 2365582951 XMBRISNOODSXSV-OCCSQVGLSA-N 426.125 4.957 50 10 IJGE Cc1nc(C(=O)N(C)CC[C@H](Br)c2cccs2)c(Br)s1 2366235993 DVHKKPBFPTWDIH-VIFPVBQESA-N 438.210 4.874 50 10 IJGE N#CC1=C2N=C(N)c3ccccc3N2C2=C(C(=O)C[C@H](c3ccccc3)C2)[C@@H]1c1cccnc1 9590742 GLSSQZYFICLYKJ-KBMIEXCESA-N 443.510 4.540 50 10 IJGE C=CCn1c(C)cc(C(=O)/C(C#N)=C\c2ccc(Sc3nccn3C)c([N+](=O)[O-])c2)c1C 35684929 CVGUAERBDAUGQQ-PDGQHHTCSA-N 447.520 4.874 50 10 IJGE COc1ccc(/C=N\NC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc1OC(C)C 169917933 QEWIMWFYJDEHBF-FMCGGJTJSA-N 426.542 4.623 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C\NCc1cccc(Br)c1)c1ccc2c(c1)CCCC2 217204666 AGCLLDRBSQBYRV-NOEYKIMYSA-N 438.369 4.702 50 10 IJGE O=C1NCCc2ccc([C@@H](Cl)c3cc(Br)sc3Br)cc21 236047020 BUUPVLXOCHQFHO-GFCCVEGCSA-N 435.568 4.887 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccncc2)ccc1OCCCOc1c(C)cccc1C 254404425 BHWRQOWJZCHMDP-UHFFFAOYSA-N 447.535 4.709 50 10 IJGE CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NN=Cc2cc(O)ccc2[N+](=O)[O-])cc1 254618617 QZGYLUZTPLRKSU-UHFFFAOYSA-N 427.501 4.543 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CCC[C@@H]1CCBr 306078319 HEVMLFSXAMGNOO-SNVBAGLBSA-N 439.973 4.601 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2Cc1ccn(Cc2ccccc2)n1 389610396 IRRGZQXCQRFWHY-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE Clc1ccc(I)c(CN2CCC[C@H](CBr)C2)c1 405337562 LBCRQIUXAVKIDC-SNVBAGLBSA-N 428.539 4.552 50 10 IJGE Cn1nc(COc2c(Br)cc(Cl)cc2CBr)cc1Cl 708075953 KEDASWATMJUKRZ-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE CN(CCCCCCl)C(=O)c1ccc(I)c(Br)c1 721607395 YVYNYYRREKFKNI-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE COc1cc([C@H](C)NC(=O)NNc2cccc(F)c2F)ccc1OCc1ccccc1 745668270 UJJYINWMIDGRRH-HNNXBMFYSA-N 427.451 4.940 50 10 IJGE Cc1ccc(-n2nc(C)c(C=NNC(=O)CSCc3ccc(Cl)cc3)c2C)cc1 1084484037 ZLZVJXDGQXKZLS-UHFFFAOYSA-N 426.973 4.834 50 10 IJGE O=C(NNc1c(Cl)cc(Cl)cc1Cl)c1ccc2c(c1)nc(O)n2CC1CC1 1351728779 KEDCCFDKYCCHFR-UHFFFAOYSA-N 425.703 4.869 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2ccc(-n3ccc(O)n3)cc2)c(C)n1-c1ccccc1F 1470668930 BBEPEVRBDAAHTP-RGEXLXHISA-N 441.466 4.670 50 10 IJGE O=C(Cc1cccc2ccccc12)N/N=C/c1c[nH]nc1-c1cccc(Br)c1 1548338146 JPYOIZIAUPSYLF-ZMOGYAJESA-N 433.309 4.685 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1cc(OC)c(OC)cc1OC 1915098334 FXYPTKMZTDHONJ-INIZCTEOSA-N 436.346 4.528 50 10 IJGE CN(Cc1cccc(Br)c1)C[C@@H](Br)COCc1ccccc1 1916355177 RADGIIURIQMIAK-GOSISDBHSA-N 427.180 4.861 50 10 IJGE CCN(C(=O)c1csc(Br)c1Br)C(C)(C)CBr 1945190670 RFYJVICPXUJCBJ-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@H](CI)O2)C[C@@H]1C1CCC1 1990242576 UJKSWCHSZXJMSD-IIDMSEBBSA-N 435.346 4.539 50 10 IJGE O=C(NC[C@H]1CC[C@@H](Br)C1)c1c(Br)cccc1Br 2033093807 KNILKWLWOKKOQH-DTWKUNHWSA-N 439.973 4.505 50 10 IJGE O=C(CBr)c1ccc(C(F)F)c(I)c1C(F)(F)F 2060394630 OXHCOQDPQKBGEE-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE ClCC[C@H]1CCCN(c2ncc(I)cc2Br)CC1 2069532113 RBXNDLOTRHLJQO-SNVBAGLBSA-N 443.554 4.684 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CN(C[C@@H](CBr)CC2CC2)C2CC2)CC1 2112869366 SHPKIHYOZBKYTL-GOSISDBHSA-N 429.443 4.909 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CC[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1 2148929719 OMUBGKGQPOLVSN-UNMCSNQZSA-N 427.386 4.566 50 10 IJGE O=C(c1ccc(Cl)c(Br)c1)N1CCC([C@@H](F)CBr)CC1 2163247348 WSSSEZCGBXMANU-ZDUSSCGKSA-N 427.539 4.688 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C[C@@H](C)O[C@H]2C)cc1I 2257373263 LZXFYQULCYYOLE-GRLOZPDXSA-N 425.104 4.549 50 10 IJGE CC1(C)[C@@H](Cl)C[C@@H]1OCc1ccc(I)c(Br)c1 2306296870 CAJXNKOBFVLVBL-RYUDHWBXSA-N 429.523 4.976 50 10 IJGE C[P@]1(=O)C[C@@H](Br)[C@H](Cc2cc(I)ccc2Cl)C1 2307330004 IVAUZWUGPHYRHC-CINOJJQCSA-N 447.478 4.873 50 10 IJGE CN(Cc1ccc(Cl)cc1I)[C@@H](CBr)CC1CC1 2318521321 HCGHXTXDHGCLRR-CYBMUJFWSA-N 442.566 4.940 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)cc1OC 2321244540 OUOZSLNNGRSVSJ-UHFFFAOYSA-N 439.462 4.897 50 10 IJGE C[C@H]1CN(Cc2ccccc2)CCN1c1nc(C(F)(F)F)ccc1CBr 2343783971 NMMGSIOUKBTBLQ-AWEZNQCLSA-N 428.296 4.706 50 10 IJGE Cc1ccc(Sc2ccc([N+](=O)[O-])cc2/C=N/NC(=O)CNc2ccc(F)cc2)cc1 2570962 DABDISQADIMVAV-DHRITJCHSA-N 438.484 4.756 50 10 IJGE CCC(CC)CO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 300755489 UGEXOIJYTXLVDG-KRWDZBQOSA-N 425.351 4.644 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)O[C@H]1CCCc2ccccc21 303741353 LERCXQWWWNOFCV-QFBILLFUSA-N 445.341 4.799 50 10 IJGE Oc1ccc(Cl)cc1[C@H]1CN(Cc2ccccc2)C[C@H]1CI 382700395 NXPKONZKPJYNDU-PBHICJAKSA-N 427.713 4.696 50 10 IJGE CC[C@@H](C)N(CCCl)C(=O)c1cc(I)ccc1Br 385176310 ZOCLCXQRCFPLCZ-SECBINFHSA-N 444.538 4.533 50 10 IJGE CC[C@@H]1[C@H](CBr)CCN1c1ncc(Br)cc1Br 385841485 VXSLLNCODAHWFY-GZMMTYOYSA-N 426.978 4.606 50 10 IJGE C[C@@H](CCCCBr)NC(=O)c1cc(Br)cc(Br)c1 398554199 YOSFZUXZSSCAEV-VIFPVBQESA-N 441.989 4.895 50 10 IJGE Clc1ccc(I)c(CN2CCC[C@@H](CCBr)C2)c1 405317505 XFGJWVANTSPVFD-NSHDSACASA-N 442.566 4.942 50 10 IJGE C[C@@H]1CN(Cc2cc(Cl)ccc2I)C[C@@]1(C)CBr 694632305 LCOZJIGOVRVBRW-QMTHXVAHSA-N 442.566 4.798 50 10 IJGE C[C@]1(CBr)CCCN1C(=O)c1cc(Br)ccc1Br 723025783 GGCHSHOFDNAPTB-CYBMUJFWSA-N 439.973 4.601 50 10 IJGE O=C(CC[C@H](O)c1ccccc1)NN=Cc1cn(Cc2ccccc2F)c2ccccc12 1084354936 SMSUJBIEKMEMQS-VWLOTQADSA-N 429.495 4.793 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@@H]1CCN(C(=O)c2ccc3nc(O)n(CC(F)(F)F)c3c2)C1 1301523043 ADQAYGISIKPGAS-CQSZACIVSA-N 443.542 4.541 50 10 IJGE O=C(NN(Cc1ccccc1)c1ccccc1)c1ccc2c(c1)nc(O)n2CC(F)(F)F 1540548868 STYPVSUGKWILQJ-UHFFFAOYSA-N 440.425 4.656 50 10 IJGE O=C(NNc1cc(C(F)(F)F)ccc1Br)c1cc(O)nc2cc(F)ccc12 1570386433 ZKADWIDPXODIBL-UHFFFAOYSA-N 444.182 4.618 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1ccccc1C(=O)c1ccc(F)c(F)c1 1629912522 YHILRVFBBCOYHJ-UHFFFAOYSA-N 436.443 4.558 50 10 IJGE C=CCn1ncc2ccc(NC(=O)NNC(=O)c3sc4ccccc4c3Cl)cc21 1675095747 OVOAAFDTMKDSPL-UHFFFAOYSA-N 425.901 4.557 50 10 IJGE CN(CC1CC(Br)C1)C(=O)CCc1ccccc1NC(=O)OC(C)(C)C 1887829655 MEGMCWZQLXAMOO-UHFFFAOYSA-N 425.367 4.598 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)C(=O)Cc1ccc(Br)cc1 1914215274 HYRTZKCCHYQIEJ-AWEZNQCLSA-N 425.164 4.804 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1ccc(Br)cc1 1916375355 UIJHOUOOOXTROG-QGZVFWFLSA-N 441.163 4.501 50 10 IJGE Fc1cc2nc(CCl)n(Cc3csnc3Br)c2cc1Br 1926873035 OVJACNADWKPLOK-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE CCOC(=O)[C@H](Cl)Cc1cc(Br)c(Br)c(Br)c1 1946435328 VATMLYYPAGAQDZ-SECBINFHSA-N 449.364 4.687 50 10 IJGE CC1(C)C[C@H](Br)CN1C(=O)c1cc(Br)c(Br)s1 1949216408 RXBDQGCWNLKPRZ-LURJTMIESA-N 446.002 4.661 50 10 IJGE CN[C@H](c1c(C)c(Br)cc(C)c1Br)[C@H]1C[C@H]1Br 2022971194 BLLCRPUVCUQDSC-PLMOITTCSA-N 425.990 4.872 50 10 IJGE CN(C(=O)c1c(Br)cccc1Br)[C@H](CCCl)C(F)(F)F 2178514015 YOPWXPQGLCCNLL-SECBINFHSA-N 437.481 4.843 50 10 IJGE CC(C)(C)[C@@H]1[C@@H](Cl)CCN1C(=O)c1ccc(I)c(Cl)c1 2185112935 GBBJPUXADIONGQ-GWCFXTLKSA-N 426.125 4.813 50 10 IJGE CCCN(CCCCCI)C1CCN(C(=O)OC(C)(C)C)CC1 2211187665 WBRQNSOTDIJLGM-UHFFFAOYSA-N 438.394 4.703 50 10 IJGE F[C@]1(COc2c(Br)cc(Br)cc2CBr)CCOC1 2222397399 VBWDSMFEHUFEAV-GFCCVEGCSA-N 446.936 4.614 50 10 IJGE Cc1ccc([C@@H](Br)c2ccc3c(c2)OCCO3)cc1I 2232834935 XMPPVZJOLMVYFL-MRXNPFEDSA-N 445.094 4.855 50 10 IJGE ClCc1nc2cc(Br)c(Br)cc2n1CCc1cncs1 2234065160 HOTCYXKAEQVXGA-UHFFFAOYSA-N 435.572 4.999 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@H]2C[C@H]3C[C@H]3CO2)c1 2263514870 HPPYRCWSNICRBG-OAACRXHESA-N 438.985 4.943 50 10 IJGE C[C@@H](COC(F)F)O[C@](C)(CI)c1ccccc1Br 2265058184 VRMQZDDBIXSOPV-TVQRCGJNSA-N 449.073 4.744 50 10 IJGE Cc1c(Cl)cc(CN2CCOC(C)(C)[C@@H]2CBr)cc1Br 2282820852 WKXYGQBGSKGBBX-AWEZNQCLSA-N 425.592 4.785 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@H]2C[C@@H](Br)C[C@H]1C2 2282974228 GCDDMSLKLLKZMI-DJLDLDEBSA-N 425.523 4.630 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)N[C@H](C)c2ccccc2)cc(Br)c1OC 2293665327 JUMVUXNYZGUZIF-CQSZACIVSA-N 429.314 4.641 50 10 IJGE COc1cc(C=C(C#N)c2nc3ccccc3[nH]2)ccc1OCC(=O)Nc1ccc(C)cc1 2297367924 ULGQIIJCZZDFGM-UHFFFAOYSA-N 438.487 4.962 50 10 IJGE ClC[C@@H](NCc1ccc(I)c(Br)c1)C1CCC1 2306222121 QEDGSVJYFMLRFQ-CYBMUJFWSA-N 428.539 4.551 50 10 IJGE C=CCOc1ccc(C=C2C(=O)N([C@@H](C)c3ccccc3)C(=O)C(C#N)=C2C)cc1OC 2314617887 CMTAYPOMKLLXSE-SFHVURJKSA-N 428.488 4.613 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@@H]1CCCCN1C[C@@]1(CBr)CC1(F)F 2326918164 ZHDZDRXNBIGDSZ-GUYCJALGSA-N 425.358 4.565 50 10 IJGE N#CC(=C(O)CNC(=O)c1ccc(Cl)cc1)c1nc(-c2cccc([N+](=O)[O-])c2)cs1 2331232398 LVOPOJQKMOFLHL-UHFFFAOYSA-N 440.868 4.594 50 10 IJGE C[C@@H](C(O)=C(C#N)c1nc(-c2ccc(Cl)cc2)cs1)N1C(=O)c2ccccc2C1=O 2331295952 YNSALCSKHXKXSQ-LBPRGKRZSA-N 435.892 4.941 50 10 IJGE COc1cc(C=C(C#N)c2nc(-c3ccc4c(c3)OCCO4)cs2)cc(OC)c1OC 2331451398 ZKENOPSJHFIDSF-UHFFFAOYSA-N 436.489 4.671 50 10 IJGE CC1(C)CC(CBr)(CN2[C@H]3CC[C@H]2CC(CNC(=O)OC(C)(C)C)C3)C1 2345007475 BJMRJZKLENBPCC-IRXDYDNUSA-N 429.443 4.955 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)C1CC2(C1)C(F)(F)C21CCC1 2369433205 LHGMBCFBSLKNIX-OHTSDLOESA-N 442.344 4.689 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccccc4C)ccc32)cc1 38676957 ZTHRZEZSZKHBGP-AREMUKBSSA-N 440.499 4.760 50 10 IJGE Cc1ccc(Cl)c2c1NC(=O)/C2=N\NC(=O)COc1ccc(C2CCCCC2)cc1 59147417 KHKNTXPSYIKRHL-UHFFFAOYSA-N 425.916 4.548 50 10 IJGE CC1=C(C#N)C(=O)N(C2CCCCC2)C(=O)/C1=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1 101339029 ZYINPWINKLJSMN-DEDYPNTBSA-N 431.448 4.780 50 10 IJGE CCOC(=O)c1ccc(NC(=O)/C(C#N)=C\c2ccc(-c3ccc(C)cc3[N+](=O)[O-])o2)cc1 209396692 KRDKZECKVVJDCW-LGMDPLHJSA-N 445.431 4.886 50 10 IJGE CCCOc1ccc(/C=C2\C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)cc1OCC 214381651 CCDPENMHHOJJGO-HMAPJEAMSA-N 444.531 4.975 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CBr)OCc1ccc(Br)cc1 231319254 OVZFMRSUDAEGHL-INIZCTEOSA-N 437.172 4.644 50 10 IJGE COc1ccc(-c2cc(C(=O)NN=C/C=C/c3ccco3)c3ccccc3n2)c(OC)c1 252593988 BOARPFLFGYMSOK-FONYWYSESA-N 427.460 4.941 50 10 IJGE CCCCc1ccc([C@H](Br)c2cnn(C)c2I)cc1 381900695 LLOWANSQAKFRSQ-AWEZNQCLSA-N 433.131 4.852 50 10 IJGE Cn1ncc([C@@H](Br)c2ccc(C(C)(C)C)cc2)c1I 393630592 CEUKCOBDKRHOJF-ZDUSSCGKSA-N 433.131 4.807 50 10 IJGE C[C@@H]1CC[C@H](CBr)CN1Cc1cc(Cl)ccc1I 688745351 GYBYZONDDKJOIC-GHMZBOCLSA-N 442.566 4.940 50 10 IJGE COc1ccc(C=NNC(=O)c2ccccc2)cc1OCc1ccc(Br)cc1 725426508 KCRZCDAPFWHPDF-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE COc1ccc(-c2cc3[nH]c(/C(Cl)=C/c4cnn(CCCl)c4)nc(=O)c3s2)cc1 728698380 IRFWNZLBEXAFKG-NVNXTCNLSA-N 447.347 4.832 50 10 IJGE O=C(Nc1ccc(S(F)(F)(F)(F)F)cc1)C(=O)N1CCC(C2CCOCC2)CC1 773438343 DVFICFQTSHYNPY-UHFFFAOYSA-N 442.450 4.948 50 10 IJGE COC(=O)C(C)(C)[C@H](NCCP(=O)(c1ccccc1)c1ccccc1)c1ccccc1 775552676 IUVZSICDSNDSAF-XMMPIXPASA-N 435.504 4.531 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2cc(Cl)c(OCC)c(Cl)c2)cc1 1084005583 JZVLPUSJSLFWGN-IBGZPJMESA-N 439.339 4.755 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)Nc2cccc(OC)c2)cc(Br)c1OCC 1084605098 WQUJULXBLWAPFK-DHDCSXOGSA-N 445.313 4.801 50 10 IJGE Cc1ccc(-c2nc(C)c(C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)s2)cc1 1472514783 ZPWWWLBYCDVHND-UHFFFAOYSA-N 430.537 4.653 50 10 IJGE C/C(=C\c1ccccn1)C(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12 1540694113 GGKDPCLKMKLZFC-JQIJEIRASA-N 442.906 4.815 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)[C@@H](Oc2ccc(Cl)cc2C)c2ccccc2)c1 1644011715 NEDFNEDUUSXPNN-QFIPXVFZSA-N 449.963 4.768 50 10 IJGE C#CC[C@@H](NC(=O)NNc1ccc(Br)cc1C(F)(F)F)c1ccccc1 1680515214 KUVWJTJVPGJBDP-OAHLLOKOSA-N 426.236 4.859 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccn2)[C@H]1c1cc(Cl)ccc1O 1865689622 UPEAPPLOUGXQOB-FQEVSTJZSA-N 441.878 4.511 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1cccc(Cl)c1 1865691193 LXJPWOSYLOAIDH-QFIPXVFZSA-N 446.938 4.930 50 10 IJGE COc1cccc(-c2ccc(C(=O)N/N=C\c3ccc(F)c(Br)c3)c(C)n2)c1 1865760983 ZUWOCVSKCJMZPP-MSXFZWOLSA-N 442.288 4.731 50 10 IJGE Cc1cc([C@@H](CC(=O)N[C@@H](C)C(=O)Nc2ccc(SC#N)cc2)C(C)C)ccc1F 1866758417 VYUBCPGQGNXGLZ-JXFKEZNVSA-N 427.545 4.980 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](Br)[C@@H](OCc2cccc(Cl)c2Cl)C1 1901218496 MRVYWXMIXDUAKW-AAEUAGOBSA-N 425.150 4.893 50 10 IJGE COc1cc(C(=O)N(Cc2ccccc2)[C@@H](CBr)C2CC2)cc(OC)c1C 1915262725 CNQGMOUKBYADMF-IBGZPJMESA-N 432.358 4.828 50 10 IJGE CC1(C)C[C@@H](N(Cc2ccccc2)S(=O)(=O)c2ccc(CCl)cc2Cl)CO1 1915483411 ZVSQYTSENXPQMQ-QGZVFWFLSA-N 428.381 4.837 50 10 IJGE CC[C@H](NC(=O)c1cccc(Br)c1Br)[C@H](C)Br 1943907978 XVZKVUHZRNZZDD-XVKPBYJWSA-N 427.962 4.503 50 10 IJGE CC[C@H]1CN(C(=O)OCc2ccccc2)[C@@H](CC)CN1C(=O)CCCCBr 1999432080 YREMTLYKPOXNQY-OALUTQOASA-N 439.394 4.590 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OCc2ccc(F)cc2)CC1 2024643044 ADJYGTLIEKMHJE-UHFFFAOYSA-N 449.304 4.547 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1C(=O)c1c(Br)cccc1Br 2033085493 FBIUINUJUYVCIR-BDAKNGLRSA-N 439.973 4.600 50 10 IJGE CCC[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)CC[C@@H]1C(F)(F)F 2044698488 CAOIQAALQZCWAO-UONOGXRCSA-N 431.337 4.671 50 10 IJGE CCc1ccc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)CC(F)F 2059314999 STHFBPXDVHNLTB-UHFFFAOYSA-N 432.330 4.600 50 10 IJGE C[C@H](CC1CCN(C[C@@H](Br)C(F)(F)F)CC1)N(C)C(=O)OC(C)(C)C 2083282381 LYZHBSBWNMBBRT-TZMCWYRMSA-N 431.337 4.670 50 10 IJGE Clc1cc(CN2CCC[C@H](CCBr)C2)ccc1I 2086659844 ZHWKWTHINQTJHR-LLVKDONJSA-N 442.566 4.942 50 10 IJGE CC(C)(C)OC(=O)N1CCCCN(C[C@@H](CBr)C2CCC2)CC(F)(F)C1 2108601613 GRDCYPOPJSUXCE-MRXNPFEDSA-N 439.385 4.766 50 10 IJGE CC(C)(C)OC(=O)NCCc1ccc(NC(=O)[C@@H](Br)C2CCCC2)cc1 2110715253 LQPQNZQPEBLWKN-KRWDZBQOSA-N 425.367 4.646 50 10 IJGE NNC(=O)c1ccc(CN(Cc2ccccc2)CC2CCCCC2)c(Br)c1 2152160775 FALGQWHBSVLNGN-UHFFFAOYSA-N 430.390 4.635 50 10 IJGE ClCCc1nc2cc(Br)c(Br)cc2n1Cc1cnsc1 2234067421 ODYAYMHZJJRWMB-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)C[C@H]2CCOC2)c1 2252840558 YRTCDZHDWDZQMD-KOLCDFICSA-N 426.974 4.944 50 10 IJGE CC1(C)C[C@@H](CBr)N(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282986113 MOXKFVOPCLPOLX-QMMMGPOBSA-N 427.539 4.877 50 10 IJGE C[C@H]1CN(Cc2sccc2I)CC[C@@H]1CCBr 2301072459 YCFSCHLCGMDEKD-QWRGUYRKSA-N 428.177 4.596 50 10 IJGE CC(C)c1cccc(CO[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2I)c1 2303761753 GXXWBWKMBGIANK-DLBZAZTESA-N 445.341 4.750 50 10 IJGE N#CC(=Cc1cn(Cc2c(F)cccc2Cl)c2ccccc12)C(=O)NC[C@@H]1CCCO1 2313624432 SDEGVJNTPRAFIH-SFHVURJKSA-N 437.902 4.684 50 10 IJGE Clc1ccc(CN2C[C@H]3CC[C@@]2(CBr)C3)c(I)c1 2318537997 GZTHHRJPMISNJY-HZMBPMFUSA-N 440.550 4.694 50 10 IJGE Cn1cc(I)c(C[C@@H]2CCC(C)(C)CC[C@@H]2Br)n1 2319208499 VYPWXDJOYNXMHQ-QWRGUYRKSA-N 425.152 4.547 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc3nc(-c4ccccc4Cl)[nH]c3c2)ccc1O 2323744380 YDDCYCKCWBFHLX-UHFFFAOYSA-N 434.883 4.752 50 10 IJGE CCOc1ccc2ccccc2c1C=NNC(=O)c1nc(Cl)c(Cl)c(N)c1Cl 2323766947 VQQMWRILBAVZLK-UHFFFAOYSA-N 437.714 4.940 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@](C)(CBr)C(C)(C)C)CC1(F)F 2327109889 OGQAGEVKJUSRTE-CXAGYDPISA-N 427.374 4.668 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@](C)(CBr)C(C)(C)C)C[C@@H]1C(F)(F)F 2352071514 HSNINTRTXGWNRS-DYVFJYSZSA-N 445.364 4.917 50 10 IJGE Cc1sc(C(=O)N2CC[C@@H](Br)C[C@H]2C(F)(F)F)cc1Br 2361463695 BPTBVQGNXPOPIA-XCBNKYQSSA-N 435.103 4.749 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1CCCl)c1ccc(Cl)cc1I 2365600238 ZTHHENDPKPBMLB-IINYFYTJSA-N 426.125 4.862 50 10 IJGE CC(C)[C@@H]1C[C@H](Br)CN1C(=O)c1cc(F)c(Br)cc1Cl 2370880534 WUHQBDOZULQYNP-SDBXPKJASA-N 427.539 4.876 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2ccc(Br)o2)sc2c1CCCC2 33339660 NTDNCCASRBWDDV-LUAWRHEFSA-N 449.326 4.705 50 10 IJGE Cc1c(C(=O)N2c3ccc(F)cc3CC[C@H]2C)oc2c1/C(=N/NC(=O)c1ccco1)CCC2 40814412 YCTJNCHJPDTTJT-DFCFRIHASA-N 449.482 4.772 50 10 IJGE CCOc1ccccc1/C=N/NC(=O)CCCOc1ccc(CC)cc1Br 40959367 SFYIKVILPCENLV-HZHRSRAPSA-N 433.346 4.720 50 10 IJGE CC[C@H](CCBr)NC(=O)c1cc(Br)c(Br)s1 218369784 IWOYDYFBBZNEAX-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE Clc1ccccc1C(CBr)(CBr)COC1CCOCC1 312930984 FLXSSOMHJJAICG-UHFFFAOYSA-N 426.576 4.563 50 10 IJGE CN(CCCOCc1ccccc1)S(=O)(=O)c1cc(CCl)c(Cl)cc1Cl 383992586 JMEMLWBVNOXQGZ-UHFFFAOYSA-N 436.788 4.960 50 10 IJGE Cc1sc(Br)cc1[C@@H](Br)c1nn(C)cc1Br 693101977 QHGULFZHELKTDN-SECBINFHSA-N 428.975 4.799 50 10 IJGE O=S1(=O)CCCC[C@H]1CC(CBr)(CBr)C1CCCCC1 696843869 IPYZMTFEHCNJPP-AWEZNQCLSA-N 430.246 4.700 50 10 IJGE Cc1csc(Sc2ccc(NC(=O)NNC(=O)c3cn(C)c4ccccc34)cc2)n1 756176774 ZSMGEMULGWRHQT-UHFFFAOYSA-N 437.550 4.561 50 10 IJGE COc1ccc(Nc2ccc(C(=O)NNc3nc4ccccc4[nH]c3=S)cc2)c(OC)c1 1148231358 PIXJWRBNXYTHCN-UHFFFAOYSA-N 447.520 4.810 50 10 IJGE CN1C[C@@H](CI)[C@@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 1614615004 LJSXDRZKHBVHIS-BXKDBHETSA-N 437.165 4.804 50 10 IJGE C#C[C@@H](NC(=O)NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1)C(C)C 1681724432 LXJKOMXFILVCBZ-XMMPIXPASA-N 441.531 4.534 50 10 IJGE CCn1c2ccccc2c2cc(NC(=O)c3oc4c(c3C)C(=NNC(N)=O)CCC4)ccc21 1772750704 HKGIAGCTMKNJER-UHFFFAOYSA-N 443.507 4.677 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@@H]1c1ccc(O)cc1 1865684420 QCZWHQQXJARDKR-MRXNPFEDSA-N 446.816 4.527 50 10 IJGE Cc1ccccc1COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3CC(C)C)cc1 1865703237 QYEZOAVZTXDRBX-XMMPIXPASA-N 428.536 4.953 50 10 IJGE CC(C)(C)OC(=O)NC1CCC([C@@]2(C)CC[C@](C)(CI)O2)CC1 1936000430 WAQQOMDDQRBYFY-VKYMVXLJSA-N 437.362 4.833 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@]21CCC[C@H](CI)O1 1987456554 TZAZXPOUEBRHGV-RDTXWAMCSA-N 435.346 4.540 50 10 IJGE BrC[C@@H](NCc1cc(Br)ccc1Br)C1CCC1 2006502323 ZSYZBANOYXHJSD-CYBMUJFWSA-N 425.990 4.865 50 10 IJGE CC1(CBr)CC(NC(=O)c2cc(Br)sc2Br)C1 2006992647 KVGSDDBBQSSXER-UHFFFAOYSA-N 446.002 4.567 50 10 IJGE CCOc1ccc(C)cc1[C@@H](Br)c1cc(I)sn1 2056487182 IMEDIEBOKLYJSL-CYBMUJFWSA-N 438.128 4.939 50 10 IJGE ClCCc1nc2cc(I)ccc2n1C1CC(Br)C1 2063149748 PKYBUNHBECTBOJ-UHFFFAOYSA-N 439.522 4.521 50 10 IJGE C[C@H](Cl)c1nc2cc(I)ccc2n1C[C@@H]1C[C@H]1Br 2076170243 HAQXLAJKUBZBSB-OYNCUSHFSA-N 439.522 4.724 50 10 IJGE FC(F)(F)c1c(I)c(CCl)nn1-c1ccncc1C1CC1 2078890771 YPMALHSZUWCKBI-UHFFFAOYSA-N 427.595 4.507 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)[C@H](Br)C2CCCC2)n1 2082968119 SGBYXMVSNYXTQT-GXFFZTMASA-N 432.384 4.621 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](C1)CN(CC1(CBr)CCCCC1)C2(C)C 2106788559 QORJNTCSGYLHNS-DLBZAZTESA-N 429.443 4.909 50 10 IJGE Brc1ccc([C@@H](CI)OC[C@H]2[C@H]3C[C@@H]4[C@H]2[C@@H]4C3)cc1 2134537921 KAVAGYWYUXTZBU-ULZMNHICSA-N 433.127 4.844 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)[C@@H]1[C@H]2COC[C@H]21 2213488780 ICCPIPVVMUGZFA-QEPVFIOASA-N 428.921 4.679 50 10 IJGE O=[N+]([O-])c1ccc(CBr)c(N2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)c1 2234718682 AKXQWACJKVSSMA-BGYRXZFFSA-N 430.346 4.733 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@H](CBr)C2(CCC2)C1 2264508447 BMBAVSZEHOLTTJ-QMMMGPOBSA-N 427.589 4.801 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H]1CN(CCCCCCCBr)C[C@H]21 2277440985 YMLZUEUECLRIMU-YRXWBPOGSA-N 429.443 4.909 50 10 IJGE CP(C)(=O)[C@H]1CN(c2c(CBr)ccc(Br)c2Cl)CCO1 2289318813 FJLDABRBZUXJGV-NSHDSACASA-N 445.519 4.783 50 10 IJGE COc1ccc(Br)cc1C=C(C#N)C(=O)Nc1ccccc1Br 2297400008 MIDVVIMGGQUANU-UHFFFAOYSA-N 436.103 4.766 50 10 IJGE C[C@@H]1C[C@@H](Br)CN(Cc2ccc(Cl)c(I)c2)C1 2300237882 DJKXQCNOGPSMFO-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE ClCC[C@H]1CCCN1Cc1ccc(I)c(Br)c1 2306231093 GAYPPZIBNPVIQH-LLVKDONJSA-N 428.539 4.647 50 10 IJGE C[C@@H]1[C@H](CBr)CCN1Cc1cc(I)ccc1Cl 2307327541 BTQMMOLYAIEKEE-ZJUUUORDSA-N 428.539 4.550 50 10 IJGE BrC[C@H]1C[C@@H]2CCC[C@@H]2N1c1ncc(Br)cc1Br 2309024598 LVOBCBPYPZIUAW-XRNSZHNASA-N 438.989 4.749 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2cc(OC)c(OCC)cc2Br)cc1 2313670547 FFTLICKRXZFJQP-UHFFFAOYSA-N 445.313 4.801 50 10 IJGE CC(=O)c1ccc(-c2ccc(C=C3C(=O)N(CCCOC(C)C)C(=O)C(C#N)=C3C)o2)cc1 2314618737 SPLDBXBCZUDIMG-UHFFFAOYSA-N 446.503 4.557 50 10 IJGE ClCc1ncccc1OCc1cc(I)ccc1Br 2319167425 RFCYYTCNUHSQEB-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE O=C(NNC(=O)C(c1ccccc1)c1ccccc1)c1ccc(OCc2ccccc2)cc1 12030039 DNPJNSMORULBSL-UHFFFAOYSA-N 436.511 4.859 50 10 IJGE CCCCOc1ccc(/C=C(\C#N)C(=O)Nc2sc(C(=O)OCC)c(C)c2C#N)cc1 33346425 SWVJEYFYNIOCQE-SFQUDFHCSA-N 437.521 4.829 50 10 IJGE Cc1c(C(=O)Nc2cccc3ncccc23)oc2c1/C(=N/NC(=O)c1cccs1)CCC2 40823766 OYUQCDFSSHYGGB-OVVQPSECSA-N 444.516 4.920 50 10 IJGE COc1cc(/C=N/NC(=O)COc2cc(C)cc(C)c2)ccc1OCc1ccc(C)cc1 40911155 IEJSVLQJZBMKMA-JFLMPSFJSA-N 432.520 4.729 50 10 IJGE O=C(COc1cccc(Br)c1)N/N=C/c1ccccc1OCc1ccccc1 40911719 FAGGZRSOOLSKLG-ZVHZXABRSA-N 439.309 4.557 50 10 IJGE Cc1cc(OCC(=O)NN=Cc2ccc(COc3ccc(C#N)cc3)o2)cc(C)c1Cl 252624961 PZINTUVMKFFWBF-UHFFFAOYSA-N 437.883 4.530 50 10 IJGE CCOC(=O)c1ccc(N=Cc2cc3c(cc2O)OC(N)=C(C#N)[C@@H]3c2ccccc2)cc1 254838995 ZAYFZQOCNPVBDL-XMMPIXPASA-N 439.471 4.538 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CI)[C@H](c2ccc(F)c(Cl)c2)C1 394705497 DVVOWMNCNFMPFC-RYUDHWBXSA-N 439.696 4.865 50 10 IJGE C[C@@H](CCCCCl)NC(=O)c1cc(Br)ccc1I 398597385 SFHRSYQZUIGTSF-VIFPVBQESA-N 444.538 4.581 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccc([C@@H]2CNCCN2S(=O)(=O)c2ccccc2)cc1 616638824 LQUUOQILSLNWGJ-QFIPXVFZSA-N 446.689 4.544 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccc([C@@H]2Cc3ccccc3N(S(N)(=O)=O)C2)cc1 616670090 TUYUMONXXOBCCX-HXUWFJFHSA-N 432.662 4.558 50 10 IJGE CC(C)S(=O)(=O)CCCOc1c(Br)cc(Br)cc1CCl 697085255 BVIYUBOKJSWHFP-UHFFFAOYSA-N 448.604 4.543 50 10 IJGE CC[C@H](C[C@H](C)Br)NC(=O)c1cc(Br)ccc1Br 716936357 FUVMWKNILQOHNI-WCBMZHEXSA-N 441.989 4.894 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OC1CCCCCCC1 721100587 LQVKSBCVUYJPRJ-QGZVFWFLSA-N 425.351 4.834 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCc2ncc(-c3ccccc3Cl)o2)c1C 736696621 JQSJFMDARDYVID-UHFFFAOYSA-N 448.914 4.540 50 10 IJGE O=C(NNc1cccc(F)c1F)c1cc2cc(Br)cc(Br)c2o1 743721619 HNXVGKGAPOIJLK-UHFFFAOYSA-N 446.045 4.993 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 784813796 AZZCYGNJIIRBHI-UHFFFAOYSA-N 437.780 4.645 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(OCc3ccncc3)cc2)c(C(F)(F)F)c1 799397729 OGWVCKNVEFPCGO-UHFFFAOYSA-N 427.386 4.700 50 10 IJGE COc1cc(C=NNC(=O)Nc2cccc(C)c2C)ccc1OCc1cccc(C(=O)O)c1 1083962221 KNLLGDIFDKCWKS-UHFFFAOYSA-N 447.491 4.745 50 10 IJGE Cc1cc(/C=C(/C#N)c2nnc(-c3cccc4cccnc34)o2)c(C)n1C[C@H]1CCCO1 1345866145 BGUFHXCWSKKYKX-DMMSUNFISA-N 425.492 4.946 50 10 IJGE CCOc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3CC(C)C)ccc1O 1865681181 HBAFRMNWAHQWDD-OAQYLSRUSA-N 430.508 4.529 50 10 IJGE Cc1ccc(C)c(Cn2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2ccc(Cl)c([N+](=O)[O-])c2)c1 1865705991 LHVUHDFSBYUGQD-OAQYLSRUSA-N 449.898 4.636 50 10 IJGE CC[C@@H](NC(=O)Cc1nc(-c2ccccc2C)oc1C)C(=O)Nc1ccc(SC#N)cc1 1866647334 ZILRZKKAKACRCO-HXUWFJFHSA-N 448.548 4.608 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C/c3cc(OC)c(OC)cc3OC)n2)c(OC)c1 1872793633 KUDYIPNTIVMSMA-OVCLIPMQSA-N 438.505 4.917 50 10 IJGE CCC[C@@H](CC)N(C)S(=O)(=O)c1cc(CBr)sc1Br 1879157274 YHBHTLNFOBIZJP-SECBINFHSA-N 433.231 4.605 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCC[C@]12CCN(C(=O)OC(C)(C)C)C2 1882088169 PAAMOTDITXEQDP-STXHMFSFSA-N 447.414 4.702 50 10 IJGE CCCCOCCOCCOCCN(Cc1ccccc1)C(C)(C)CBr 1915765744 OUPIUAZMNMXDQD-UHFFFAOYSA-N 430.427 4.512 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]2(CCC[C@@H](CI)O2)CCC12CCC2 1983724625 KTDLLRUQHWDDSS-KBXCAEBGSA-N 435.346 4.683 50 10 IJGE O=C(NC1CC2(C1)CN(CC1(CBr)CCCCC1)C2)OCc1ccccc1 1999504016 OOCWCGXSBIBKLE-UHFFFAOYSA-N 435.406 4.723 50 10 IJGE Cc1cc(NCCSSCCNC(=O)OC(C)(C)C)c(Br)cc1N 2010829384 VPPGEISFAYCYGU-UHFFFAOYSA-N 436.441 4.658 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1Cc1cc(Br)ccc1Br 2018104515 HYDKIZVOCKAIQU-RNCFNFMXSA-N 425.990 4.959 50 10 IJGE CC[C@H](Br)CN(CC)C(=O)c1c(Br)cccc1Br 2044542775 CHVZHWOKMALSCK-VIFPVBQESA-N 441.989 4.847 50 10 IJGE CC1(C)C[C@@H](O[C@@H](CI)c2cccc(Br)c2)CO1 2052239724 HTRJEFGOMDLOKB-OLZOCXBDSA-N 425.104 4.509 50 10 IJGE CC(C)(C)[C@@H]1[C@H](Cl)CCN1c1ncc(I)cc1Br 2069532815 XIJZSLUCILQLIF-MNOVXSKESA-N 443.554 4.681 50 10 IJGE CCCN1CC[C@H]([C@H](Br)c2ccc(OCc3ccccc3)cc2)S1(=O)=O 2089516365 WQSZKZDIZAVCEQ-WOJBJXKFSA-N 438.387 4.516 50 10 IJGE CS(=O)(=O)c1csc([C@H](Cl)c2cc(Cl)ccc2I)c1 2093077825 WSKNTBQZPBRAJH-GFCCVEGCSA-N 447.146 4.738 50 10 IJGE CN(Cc1ccccc1NC(=O)OC(C)(C)C)CC1(CBr)CCOCC1 2106783543 AWFNFBJUGMCYAG-UHFFFAOYSA-N 427.383 4.657 50 10 IJGE CO[C@]1(C(F)(F)F)C[C@H](C(=O)N(Cc2ccccc2)[C@H](CBr)C(C)C)C1 2125556953 XTYAOFRFOYKOHT-NUJGCVRESA-N 436.312 4.792 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2CN(C[C@H](CBr)c3ccccc3)C(C)(C)[C@@H]2C1 2163064458 UPUHKFAIPGFONE-IPMKNSEASA-N 437.422 4.742 50 10 IJGE CC[C@H](Br)C(=O)N[C@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1 2179674257 JRZZSAOXGCEXHH-ZWKOTPCHSA-N 435.362 4.695 50 10 IJGE CCN(CCCl)CCC[C@@H](C)Nc1ncc(Br)cc1Br 2204134015 ZADJTDSUZIJPDN-LLVKDONJSA-N 427.612 4.748 50 10 IJGE BrC[C@@H]1C[C@@H]2CCCC[C@H]2N1C[C@@H]1CC1(Br)Br 2217338226 YYDKWYSELVQDMD-FIQHERPVSA-N 430.022 4.520 50 10 IJGE Cc1ccc(C(=O)NC[C@H](Br)CC(C)(C)C)cc1I 2224619836 YSQVXCOTAHXHDD-GFCCVEGCSA-N 438.147 4.529 50 10 IJGE COc1ccc([C@H](Cl)c2cc(Br)sn2)cc1I 2248881714 ANHTYYGNDCUGTF-NSHDSACASA-N 444.519 4.847 50 10 IJGE O=C(N[C@@H]1C[C@H]2C[C@H]1C[C@H]2Br)c1cc(Br)c(F)cc1Cl 2285846740 RNXRPZWAXXDHIE-NDORMNELSA-N 425.523 4.533 50 10 IJGE COc1ccc(Br)c2c1nc(CCCl)n2CC1CN(Cc2ccccc2)C1 2286082845 BSDFTNJSJNWSDC-UHFFFAOYSA-N 448.792 4.721 50 10 IJGE CC(C)[C@@H](CBr)N(C)C(=O)c1scc(Br)c1Br 2302531058 ORARDBGYGAXBGC-MRVPVSSYSA-N 448.018 4.765 50 10 IJGE Cl[C@H]1CCC[C@H](NCc2ccc(I)c(Br)c2)C1 2306223120 AUBGWXCYEIFJDD-QWRGUYRKSA-N 428.539 4.693 50 10 IJGE Cc1ccc(COc2ccccc2C=C(C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1 2313568324 URYUBJLFTSCEIY-UHFFFAOYSA-N 437.543 4.830 50 10 IJGE COc1cc(Cl)c(CBr)c(OCCOCCOCc2ccccc2)c1 2317927857 DQUBUTRMCRUMKK-UHFFFAOYSA-N 429.738 4.856 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCN(c2ccnc(Cl)c2CBr)C1 2321459249 QMNLVJFETWINLO-UHFFFAOYSA-N 430.724 4.587 50 10 IJGE CCCCC(=O)Nc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2[C@H](C)CC)cc1 9873999 NWCMILZYRUSGCF-MSOLQXFVSA-N 439.556 4.557 50 10 IJGE COc1cc(OC)c([C@@H]2C(C#N)=C(N)C(C#N)(C#N)C3=CC[C@@H](C(C)(C)C)C[C@@H]32)cc1OC 35168896 XPUFJDNCDUJFAM-VBURHUQHSA-N 446.551 4.578 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(C)cc4)ccc32)cc1 38685586 UXRYAFFYANVCHP-XMMPIXPASA-N 426.472 4.831 50 10 IJGE Cc1c(C(=O)N2CCCC[C@H]2C)oc2c1/C(=N/NC(=O)c1ccccc1Cl)CCC2 40812552 SCZAAMASHUQROM-HUEFVVPSSA-N 427.932 4.726 50 10 IJGE COc1cc([N+](=O)[O-])ccc1N/C=C(/C#N)c1nc(-c2cc3ccccc3oc2=O)cs1 100296501 WPRPZINVPNGQJH-KAMYIIQDSA-N 446.444 4.810 50 10 IJGE N#CSc1ccc(NC(=O)C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1 170395547 VPPOEWGUEOLVPG-UHFFFAOYSA-N 433.333 4.875 50 10 IJGE CCc1nnc(COc2c(Br)cc(CCl)cc2Br)s1 702725402 MBEKIRYMXURUJU-UHFFFAOYSA-N 426.561 4.943 50 10 IJGE CCS[C@@H]1CC[C@H](N(C)C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)C1 742908417 AYHNZJINOYGQME-MFMLGWBHSA-N 433.581 4.503 50 10 IJGE O=C(CCCCl)Nc1cc(Cl)ccc1N1CCN(C(=O)/C=C/c2ccccc2)CC1 953055321 ARDLMLMYLPTHSF-DHZHZOJOSA-N 446.378 4.660 50 10 IJGE C#CCCOc1ccc(C(=O)NNc2c(Cl)cc(Br)cc2Cl)cc1 1354533734 OWRONZRFUSJMAW-UHFFFAOYSA-N 428.113 4.915 50 10 IJGE CCCc1nn(-c2ccc(OC)cc2)c2c1[C@@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865699356 RPAKLCAHULGWPU-JOCHJYFZSA-N 425.492 4.533 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2Cl)[C@H]1c1cccnc1 1865700416 SMSHALPOBSIOFB-NRFANRHFSA-N 439.906 4.865 50 10 IJGE C[C@H](/C(O)=C(\C#N)c1nc(-c2cccc(Cl)c2)cs1)N1C(=O)c2ccccc2C1=O 1872818005 IAGFYIVYSDJBTF-JFLJVCDGSA-N 435.892 4.941 50 10 IJGE CN(C)CC(C)(C)CO[C@H](CI)c1cccc(Br)c1 1899009846 INOHYXPXUAQBPI-CQSZACIVSA-N 440.163 4.530 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)c1ccc(S(=O)(=O)C(F)(F)F)cc1 1914354143 XCGCDQHSSUHDOA-CYBMUJFWSA-N 436.293 4.770 50 10 IJGE O=C(N[C@H]1CCC[C@H]1CBr)c1csc(Br)c1Br 1945189137 JVGNCHJBFAVNFX-XPUUQOCRSA-N 446.002 4.567 50 10 IJGE C[C@@H]1CO[C@@](CBr)(Cc2c(Br)cccc2Br)C1 1945328216 ZUPKTDPCKNBPBE-TVQRCGJNSA-N 426.974 4.944 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@]23CC[C@](C)(CI)O3)C1 1950282316 ZOIIRDQSXDTGBV-QRVBRYPASA-N 449.373 4.931 50 10 IJGE C[C@H](Br)[C@H]1CCCN1Cc1cccc(Br)c1Br 2018116072 YGUPTMGOIDUOBR-JOYOIKCWSA-N 425.990 4.959 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)C[C@@H](Br)C1CC1 2026564570 UWOGKAGBCQJCNV-LLVKDONJSA-N 428.539 4.550 50 10 IJGE Cc1ccnc(CN[C@@H](C)CCCCCI)c1Br 2054166105 YNZLCPRQWLSRAQ-LBPRGKRZSA-N 425.152 4.626 50 10 IJGE BrC[C@H]1C[C@@H]2CC[C@H](C1)N2c1ncc(Br)cc1Br 2064848937 WXRLOHHQUVULAD-UIKWRGBMSA-N 438.989 4.749 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1C(=O)c1c(Br)cccc1Br 2073326330 IXFHXGSGFHUOLK-KWQFWETISA-N 439.973 4.600 50 10 IJGE FCCC1([C@@H](Br)c2cc(I)cc3c2OCC3)CC1 2074482246 YZFYGQULSGNHRX-ZDUSSCGKSA-N 425.079 4.802 50 10 IJGE CCOc1cc(CBr)cc(Br)c1OC[C@@H]1C[C@@H]1Br 2076263756 ZJWGJPCFUAKSGV-UWVGGRQHSA-N 442.973 4.905 50 10 IJGE C[C@@H]1CC[C@@H](CNC(=O)C(F)(F)F)N(CC2(CBr)CCCCCC2)C1 2106783844 CZEUHANRWHKHQT-CABCVRRESA-N 427.349 4.501 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@H]1CCCN(C[C@@H](Br)C(F)(F)F)C1 2106789424 YKAXEOQZXXIDGF-RRFJBIMHSA-N 443.348 4.814 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@@H](Br)C1(S(C)(=O)=O)CCC1 2137637132 LGEGEFSUHSYBEX-GFCCVEGCSA-N 430.589 4.814 50 10 IJGE O=C(NC[C@@]12CCC[C@H]1CCN2Cc1ccccc1)c1ccc(CBr)cc1 2197370472 QSKHWXXYIBNLBJ-GMAHTHKFSA-N 427.386 4.756 50 10 IJGE COc1cc(Cl)c([C@H](Br)C2(S(C)(=O)=O)CCC2)cc1Br 2202367893 SXNNYJLVYMUKLR-LBPRGKRZSA-N 446.588 4.514 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Cl)c2ccc(Cl)c(I)c2)c1 2268288260 YKSIVFBWTRABJW-LBPRGKRZSA-N 447.146 4.738 50 10 IJGE CC[C@H](CCCl)CNCc1ccc(I)c(Br)c1 2306216131 CEAGAQVZOADEBN-SNVBAGLBSA-N 430.555 4.798 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1cc(Br)c(OCc2ccccc2)c(OC)c1 2314740172 ZCHKLHHZWLKYLA-UHFFFAOYSA-N 443.341 4.860 50 10 IJGE Clc1ccc(CN2C[C@@H](Br)CC23CCC3)c(I)c1 2318536473 ADPHQNYTAWNWLT-NSHDSACASA-N 440.550 4.837 50 10 IJGE CC(=NNC(=O)c1ccc(-c2ccc(Cl)c(Cl)c2)nc1C)c1ccc(O)c(O)c1 2321281245 UTFFXOSBFGHVQR-UHFFFAOYSA-N 430.291 4.929 50 10 IJGE N#CC(=CN1CCN(c2ccc(F)cc2)CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1 2325129965 QMXQSSJZVDFEMI-UHFFFAOYSA-N 442.494 4.786 50 10 IJGE Cc1ccc(COc2ccc(C=NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc2)cc1 2328799844 ADCNWYNNALCSPI-QFIPXVFZSA-N 439.556 4.573 50 10 IJGE CCc1ccc(-c2csc(C(C#N)=C(O)c3ccc(NS(C)(=O)=O)cc3)n2)cc1 2331245413 IZBRVNQTZIWIHW-UHFFFAOYSA-N 425.535 4.694 50 10 IJGE Cc1cc(C)c(-c2csc(C(C#N)=C(O)CN3C(=O)c4ccccc4C3=O)n2)c(C)c1 2331393002 DMKVTODFPGTWHZ-UHFFFAOYSA-N 429.501 4.824 50 10 IJGE Cn1c(-c2ccc(C(=O)NNC(=O)c3cccc4ccccc34)s2)nc2ccccc21 35553886 FSGPGJRISGDBSE-UHFFFAOYSA-N 426.501 4.530 50 10 IJGE CCc1ccc(O[C@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccs2)cc1 38656614 DKBYOKLZGYEOAF-CMJOXMDJSA-N 446.528 4.902 50 10 IJGE Cc1ccc(/C=C(\C#N)C(=O)Nc2ccc(NC(=O)/C(C#N)=C/c3ccc(C)o3)cc2)o1 103492374 LOTIUWJADRPXEQ-JYFOCSDGSA-N 426.432 4.581 50 10 IJGE CCSC[C@@H](C)n1c(CCCl)nc2cc(I)c(F)cc21 135429232 FPGQHKRYVQXFCM-SECBINFHSA-N 426.726 4.875 50 10 IJGE Cc1ccc(COc2ccccc2/C=N\NC(=O)CSc2nc3ccccc3n2C)cc1 169876285 YNYMEOJDBJMHIS-YSMPRRRNSA-N 444.560 4.703 50 10 IJGE COc1cc(/C=N/NC(=O)c2ccccc2)cc([N+](=O)[O-])c1OCc1cc(C)ccc1C 169881265 WRLHGUWXAGHEHA-AFUMVMLFSA-N 433.464 4.563 50 10 IJGE Cc1cc(C)c(NC(=O)/C(C#N)=C\Nc2ccc(I)cc2)c(C)c1 217223692 CJOPUKPYCYWMIZ-PTNGSMBKSA-N 431.277 4.675 50 10 IJGE CN(CCCCCBr)C(=O)c1ccc(I)c(Cl)c1 227141613 JCCDAONIYYIOQJ-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE Cc1cccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)c2ccc([N+](=O)[O-])cc2)c1 254291910 BTLLSYBVYHJRIM-UHFFFAOYSA-N 425.448 4.520 50 10 IJGE COc1ccc(C=NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)c(OC)c1OC 254832679 GWBVDAABPWWHOG-UHFFFAOYSA-N 441.487 4.692 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OCc2ccccc2F)CC1 303741089 FVUJCDRRQVOXLH-UHFFFAOYSA-N 449.304 4.547 50 10 IJGE O=S(=O)(Nc1ccc(Br)cc1Br)c1ccc(CCl)cc1 380042407 ZBFGKKXMCMCKTJ-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE CN([C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(Cl)cc(CCl)c1Cl 383398994 WVJRAEQJRFHTGN-KRWDZBQOSA-N 447.815 4.627 50 10 IJGE C[C@H](CCCBr)CNC(=O)c1ccc(Br)cc1Br 384288805 CZXPLLGNAJMFBM-SECBINFHSA-N 441.989 4.753 50 10 IJGE Cn1ncc(Br)c1[C@H](Br)c1ccc(F)c(Br)c1F 691561647 PEXIAAMWGGHYSE-MRVPVSSYSA-N 444.899 4.708 50 10 IJGE CN(Cc1ccccc1)CC1CCN(c2ccc(CBr)cc2[N+](=O)[O-])CC1 717578869 HPXLCFWVPKLNLN-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2c(-c3ccccc3Cl)noc2C)c1C 743463547 YNYYVHYBEHRCCT-UHFFFAOYSA-N 434.887 4.529 50 10 IJGE CC(C)Oc1ccc(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cc1 918595867 DCSQXZYNKUDDNJ-HMMYKYKNSA-N 425.492 4.797 50 10 IJGE Cc1cc(Br)cc(Br)c1OCC(=O)NN=C1CCC[C@H](C)C1 1084216081 LNEJYPQQINUPKD-JTQLQIEISA-N 432.156 4.581 50 10 IJGE Cc1c(C(=O)Nc2ccc(C(C)C)cc2)oc2c1C(=NNC(=O)c1ccccn1)CCC2 1772748199 ZILRKOBPCYDUME-UHFFFAOYSA-N 430.508 4.829 50 10 IJGE CCCc1nn(-c2cccc(Cl)c2)c2c1[C@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865713313 WIYAVSZJPHGLTJ-LJQANCHMSA-N 435.871 4.605 50 10 IJGE O=C(N[C@@H](CCl)[C@@H]1CC=CCC1)c1scc(Br)c1Br 1885059518 AYUNOEWCKJQSKB-SCZZXKLOSA-N 427.589 4.967 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC2(CCC2)[C@]12CCC[C@@H](CI)O2 1924959148 SVPNNTYFVSSVFT-DOXZYTNZSA-N 449.373 4.834 50 10 IJGE FC(F)C[C@H](CBr)NCc1cccc(Br)c1Br 1943904772 ANBZSGOHKSKNJI-MRVPVSSYSA-N 435.932 4.720 50 10 IJGE COc1ccc(Br)cc1[C@H](Cl)c1cc(I)sn1 2007645457 RTORSMPTHSVKIG-NSHDSACASA-N 444.519 4.847 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1cccc(Br)c1F 2010827963 ZHXMRNUVQSQGGY-UHFFFAOYSA-N 439.416 4.584 50 10 IJGE C[C@]1(F)C[C@H]([C@@H](Br)c2cc(I)cc3c2OCC3)C1 2077791649 AEBPHEGTBBOPQL-GAJTVXKRSA-N 425.079 4.800 50 10 IJGE BrC[C@]12CC[C@H]1CN(Cc1cc(Br)ccc1Br)C2 2078148054 QYLSFTMWRGIKJP-FZMZJTMJSA-N 438.001 4.819 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@@H]2C[C@H](Cl)CC[C@H]21 2087665447 WBXIGAGWDQPYFX-NQMVMOMDSA-N 427.589 4.895 50 10 IJGE Fc1ccc(I)cc1[C@H](Br)c1ccc2c(c1)COC2 2113357855 KKIIGUGWRSJJLB-OAHLLOKOSA-N 433.058 4.945 50 10 IJGE Brc1cccc([C@H](CI)OC[C@@H]2C3C[C@@H]4C2[C@@H]4C3)c1 2134516181 FKOJSISRKQDBLI-XRWMESCXSA-N 433.127 4.844 50 10 IJGE O=[N+]([O-])c1cc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)ccc1CBr 2188576985 KRMZGCXCKRBTIV-OAQYLSRUSA-N 430.346 4.592 50 10 IJGE F[C@@H]1C[C@@H](Br)CN(Cc2cc(Br)ccc2Br)C1 2213905860 FXTOXDYWYKSJGK-GHMZBOCLSA-N 429.953 4.519 50 10 IJGE Fc1cccc(I)c1[C@@H](Br)c1ccc2c(c1)CCO2 2267658923 JILFZBJUFLXYTQ-HNNXBMFYSA-N 433.058 4.850 50 10 IJGE O=C(NCC1(CBr)CC(F)(F)C1)c1ccc(Cl)c(Br)c1 2281663819 QPWFTRAAYZPHFO-UHFFFAOYSA-N 431.502 4.643 50 10 IJGE CC(C)(C)[C@@H](CBr)NCc1ccc(Cl)c(I)c1 2300239221 VKYVYGZAUJXYRO-GFCCVEGCSA-N 430.555 4.844 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](O)[C@H]1C[C@@H](Br)C1 2301501034 CFGPTMKCKVGBTD-KJNMHVQDSA-N 430.937 4.866 50 10 IJGE BrC[C@@H]1C[C@@H]2CCCC[C@H]2N1Cc1sccc1I 2316760797 YGOJSMAHYKGBKT-GMXVVIOVSA-N 440.188 4.881 50 10 IJGE CCc1nn(C[C@@H](CBr)CC(C)C)c(CC)c1I 2328540910 WFWHLVAUSBXYKF-LLVKDONJSA-N 427.168 4.670 50 10 IJGE BrC[C@H](COCc1cccc(I)c1)c1ccccc1 2341702703 YQDIBFITFYGIKL-OAHLLOKOSA-N 431.111 4.987 50 10 IJGE N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@@H]1c1ccc(OC(=O)c2ccccc2)cc1 9861000 DMZGCXBWVICBCO-OAQYLSRUSA-N 434.455 4.514 50 10 IJGE COc1ccc(Br)cc1/C=N/NC(=O)c1ccccc1OCc1ccccc1 13920968 POHLXOPVSNHHLY-ZVHZXABRSA-N 439.309 4.801 50 10 IJGE CCCCCOc1ccccc1C(=O)NNC(=O)c1ccccc1OCc1ccccc1 14035858 XYIDTFFQYKHLEL-UHFFFAOYSA-N 432.520 4.909 50 10 IJGE COc1ccc(/C(C#N)=C\c2cccc(OC(=O)c3ccc([N+](=O)[O-])cc3)c2)cc1OC 31902969 RWKFCFILIXNLEU-UNOMPAQXSA-N 430.416 4.895 50 10 IJGE COc1cccc(-c2nn(-c3ccccc3)cc2/C=C(\C#N)C(=O)NCc2ccccc2)c1 35446346 IVLCIWCWHZUHPR-PXLXIMEGSA-N 434.499 4.771 50 10 IJGE C=CCNC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1cccc(OCCCC)c1 35446762 MEAARBTXTPFBCA-PGMHBOJBSA-N 426.520 4.927 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(C)c4)ccc32)cc1 38685595 GAZKANZXCRLKRW-DEOSSOPVSA-N 426.472 4.831 50 10 IJGE C=CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(C)cc4)ccc32)c1 40529772 HBZBOGMKEQTURZ-VWLOTQADSA-N 438.483 4.997 50 10 IJGE Cc1c(C(=O)Nc2cccc3cccnc23)oc2c1/C(=N/NC(=O)c1cccs1)CCC2 40823765 NSYFXCUPVFTFAS-JVWAILMASA-N 444.516 4.920 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)CCCOc2cc(C)ccc2C)cc1 40990564 BGZZINYJLMKENF-OQKWZONESA-N 434.536 4.891 50 10 IJGE O=C(CSCc1ccccc1)N/N=C1\C(=O)N(C/C=C/c2ccccc2)c2ccccc21 59165098 DGJLTZVDEHXVQX-LQOYIJOKSA-N 441.556 4.500 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Br)Cc3ccccc3Cl)cc2[nH]1 109884248 BTAVDTYQZIKMBX-JTQLQIEISA-N 430.527 4.951 50 10 IJGE Brc1ccccc1[C@@H](CI)OC[C@@H]1CCCCO1 161968051 NVTFFMVTKMWZFF-SMDDNHRTSA-N 425.104 4.511 50 10 IJGE C[C@H](Br)c1cnnn1-c1c(Br)cc(Cl)cc1Br 310434624 NZZLMYZKFPOSDS-YFKPBYRVSA-N 444.352 4.902 50 10 IJGE COc1ccc(CCNC(=O)c2cccc(NC(=O)Nc3ccc(SC#N)cc3)c2)cc1 586699863 AFXUEHZCNJTQHN-UHFFFAOYSA-N 446.532 4.885 50 10 IJGE Clc1cc2c(cc1[C@@H](Br)c1ncsc1Br)OCCO2 698653549 KLUARNKLQREOFH-SNVBAGLBSA-N 425.529 4.815 50 10 IJGE CC(=O)N(c1nc(C=NNC(=O)CCCc2cccs2)cs1)c1ccc(F)cc1F 732528840 AMYGNAIOVXCDFI-UHFFFAOYSA-N 448.520 4.640 50 10 IJGE O=C(NNc1ccc(Br)c(F)c1)C1CCN(c2nc3ccccc3s2)CC1 771681382 JZWGMWLOYOIBCW-UHFFFAOYSA-N 449.349 4.558 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccc(-c3ccc4c(c3)OCCO4)s2)c(C(F)(F)F)c1 799753886 WWRSGOAXVRQULC-UHFFFAOYSA-N 445.422 4.834 50 10 IJGE CC(=O)N1CCCN(c2ccc(F)cc2NCc2ccc(OCCCCl)cc2)CC1 811498323 RFFIWIVJPURMSK-UHFFFAOYSA-N 433.955 4.504 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)Nc2cccc(Br)c2)c(-c2ccccc2)n1 914458187 FNBICBMFFMMDLE-ATVHPVEESA-N 446.308 4.772 50 10 IJGE CCOc1ccc(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cc1F 918669662 FKRPFMGFPRWPRL-QGOAFFKASA-N 429.455 4.547 50 10 IJGE C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NN(Cc1ccccc1)c1ccccc1 1290343096 LLOGWUDYPDBXAT-HXUWFJFHSA-N 429.948 4.760 50 10 IJGE C=CC[C@@H](C(=O)NNC(=O)c1ccc(COc2ccc(OCC)cc2)cc1)c1ccccc1 1349593804 VFEYLBDGUQUTFR-RUZDIDTESA-N 444.531 4.785 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C)[C@@H]1CCCO1 1435967820 WSWAIRCFZDPXID-FWGHFIIFSA-N 442.346 4.605 50 10 IJGE Cc1ccnc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccc(Cl)c2)CCC3)c1 1772748678 SKYOXILRJAQCFB-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE Cc1ccc(OCCCOc2cccnc2NC(=O)Oc2ccc([N+](=O)[O-])cc2F)cc1 1858692559 SXHRZALYQQHPQK-UHFFFAOYSA-N 441.415 4.896 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccc(C)cc2)cc1 1865694565 XCXJATCZLQPTHE-SFHVURJKSA-N 440.425 4.816 50 10 IJGE Cc1ccc(-c2nc3cc(C(=O)NCC(=O)Nc4ccc(SC#N)cc4)ccc3o2)cc1 1868141388 SAJJNKBVUNBXIT-UHFFFAOYSA-N 442.500 4.745 50 10 IJGE CCc1nc(Nc2ccc(SC#N)cc2)cc(N2CCN(C)[C@H](c3ccccc3)C2)n1 1868278112 SIGSKKTZMTWZMN-NRFANRHFSA-N 430.581 4.849 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C1(C)C 1882086272 AARLRZZRWDBISQ-XGUBFFRZSA-N 447.414 4.556 50 10 IJGE CC(C)[C@@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1cccc(Br)c1 1915276805 UQCAJMMXLYURGM-GOSISDBHSA-N 430.795 4.903 50 10 IJGE C[C@H]1OCC[C@]1(CBr)Cc1ccc(Br)cc1Br 1943843256 IBDQAOHCVKIUQI-NOZJJQNGSA-N 426.974 4.944 50 10 IJGE Cc1nn(-c2cccc(Br)c2CCl)c(C)c1I 1945162775 VVHZEISZOFZRKH-UHFFFAOYSA-N 425.495 4.595 50 10 IJGE CN(Cc1c(Br)cccc1Br)[C@@H]1CCC[C@@H]1Br 1945324157 WIEPYOBDPDZSLA-QWHCGFSZSA-N 425.990 4.959 50 10 IJGE CC[C@H](Br)CN(C)C(=O)c1scc(Br)c1Br 1977857331 WJSFGGHCUCCUTL-LURJTMIESA-N 433.991 4.519 50 10 IJGE COc1ccc(Br)cc1[C@@H](Cl)c1cc(I)sn1 2007645456 RTORSMPTHSVKIG-LLVKDONJSA-N 444.519 4.847 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCc1cnns1 2016177469 CTRZSHNJLIGMHS-UHFFFAOYSA-N 442.958 4.537 50 10 IJGE CCC[C@](C)(CBr)NC(=O)c1cc(Br)ccc1Br 2029942939 AQQCVMLKOJMXRP-CYBMUJFWSA-N 441.989 4.895 50 10 IJGE CC(N)=C(C#N)C(=O)CSc1nc2cc(C(F)(F)F)ccc2n1Cc1ccccc1 2040417067 QIVNFERHOOLCHQ-UHFFFAOYSA-N 430.455 4.521 50 10 IJGE Clc1ccc(I)c(CN2CC[C@H](Br)CC23CC3)c1 2050620307 CZLDKKBDRWWZNG-NSHDSACASA-N 440.550 4.837 50 10 IJGE CC(C)(C)OC(=O)NCCCC[S@@](C)(=O)=NC[C@H](CBr)c1ccccc1 2110302293 IBTSWBJYBMNEKD-MRDQGFSESA-N 447.439 4.568 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CCCCCBr)C[C@H]1c1ccccc1 2129066301 CTASBZUSJMRIFU-MOPGFXCFSA-N 425.411 4.792 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@H](Br)[C@H]1CCCS(=O)(=O)C1 2137655362 LTMSBUORCPEWDW-TVQRCGJNSA-N 430.589 4.672 50 10 IJGE Cc1sc(C)c(S(=O)(=O)Nc2ccc(CBr)cc2)c1Br 2143910865 PGTCFIVWMHMYAH-UHFFFAOYSA-N 439.194 4.823 50 10 IJGE CCN(CC1CCN(C(=O)c2ccc(CBr)cc2)CC1)C(=O)OC(C)(C)C 2162910808 AQMAZGLBXMWGHZ-UHFFFAOYSA-N 439.394 4.691 50 10 IJGE CC[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1N(C)CCCCCI 2211184369 CXMBCAOMRAVNKL-JKSUJKDBSA-N 438.394 4.559 50 10 IJGE ClCCc1nc2cc(Br)c(Br)cc2n1Cc1cncs1 2234058647 QTBFSJLZILPCDB-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CCC[C@H](CCBr)CNC(=O)Cc1ccc(Br)cc1Cl 2237435575 AEOOUYQZUWGRCZ-LLVKDONJSA-N 425.592 4.963 50 10 IJGE C[C@]1(CI)CCC2(CCC(NC(=O)OCc3ccccc3)CC2)O1 2241903168 GQNVNUKPCKICPD-CUYAVPTFSA-N 443.325 4.598 50 10 IJGE Cc1sc([C@@H](Cl)c2cnn(C)c2I)c(Br)c1C 2246426102 QJESNCCBTTVDRI-VIFPVBQESA-N 445.551 4.794 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1Cc1cc(Br)ccc1Br 2251042878 VGDHPHOUPFCVSI-STQMWFEESA-N 425.990 4.959 50 10 IJGE COCCCCCO[C@@H](CI)c1cccc(Br)c1 2258909984 UEURLNXYAGREQC-AWEZNQCLSA-N 427.120 4.759 50 10 IJGE O=S1(=O)CC[C@H]([C@@H](Br)c2cc3sc(Br)cc3s2)C1 2263618590 RFOPNPIWPRTROZ-UPONEAKYSA-N 430.208 4.596 50 10 IJGE CN(C(=O)c1ccc(Cl)c(I)c1)C1(CCl)CCCCC1 2283654892 QHCNKVPQSZCRAW-UHFFFAOYSA-N 426.125 4.958 50 10 IJGE CCCC(CBr)(CCC)CN1CCC[C@](O)(CN(C)C(=O)OC(C)(C)C)C1 2286343979 CBKUFNKCLBSVGB-NRFANRHFSA-N 449.474 4.662 50 10 IJGE CCOc1ccccc1NC(=O)[C@H](OC(=O)C(C#N)=Cc1ccccc1)c1ccccc1 2297400550 RBHLVBJLARAEPT-XMMPIXPASA-N 426.472 4.915 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Cl)c(I)c2)[C@@H]1CBr 2300238632 NFLGGKCUEDNVQC-NOZJJQNGSA-N 428.539 4.550 50 10 IJGE COc1ccccc1C=C(C#N)C(=O)N(c1cc(C)ccc1C)S(=O)(=O)c1ccccc1 2314777843 XSMDZWZAURJLLZ-UHFFFAOYSA-N 446.528 4.641 50 10 IJGE CCCOc1ccccc1C=C(C#N)C(=O)Nc1cc(OC)c(C(=O)OCC)cc1Cl 2314796014 NOXZJTRGOOSDBE-UHFFFAOYSA-N 442.899 4.860 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)c(I)c2)CC[C@H]1CBr 2315554089 AXEIHBZFBOURSO-PWSUYJOCSA-N 442.566 4.798 50 10 IJGE Cc1cc(C)c(NC(=O)C(C#N)=CNc2ccc(I)cc2)c(C)c1 2325182633 CJOPUKPYCYWMIZ-UHFFFAOYSA-N 431.277 4.675 50 10 IJGE CC(C)C[C@H](CBr)CN1CCC[C@@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2353830368 CLFOCWYLXVGZPG-RHSMWYFYSA-N 445.364 4.965 50 10 IJGE BrCc1ccc(N2C[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)cc1C1CC1 2364567956 HUKKGLSCIPLMKD-DHIUTWEWSA-N 427.386 4.549 50 10 IJGE COc1ccc(Cl)c2sc(NNC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)nc12 9447630 MGPNITWDZCXPLD-UHFFFAOYSA-N 434.886 4.838 50 10 IJGE CCCCCN1C(=O)/C(=N/NC(=O)COc2ccc(Cl)cc2Cl)c2cc(C)ccc21 33959317 YBBNMPZWSKXTFD-YYADALCUSA-N 448.350 4.738 50 10 IJGE CCOC(=O)N/N=C1\CCCc2oc(C(=O)NN(c3ccccc3)c3ccccc3)c(C)c21 40825563 CEEZLIPFKULNOJ-LHLOQNFPSA-N 446.507 4.858 50 10 IJGE COc1cc(/C=N\NC(=O)CC[C@@H](O)c2ccccc2)ccc1OCc1cccc(C)c1 58887884 SDDPKHZRGHVMMJ-MFSPXNBESA-N 432.520 4.547 50 10 IJGE COc1ccc(/C(C)=N\NC(=O)CCCSc2nc3ccc([N+](=O)[O-])cc3s2)cc1 58991852 PXDIGSNMOHOWMM-XKZIYDEJSA-N 444.538 4.626 50 10 IJGE O=C(Cc1ccc(F)cc1)N/N=C/c1ccc(OCc2ccc(Br)cc2)cc1 59447395 PYLKPLMLGXNAJH-AFUMVMLFSA-N 441.300 4.860 50 10 IJGE CO[C@@H]1CCC[C@@H](O[C@@H](CI)c2cccc(Br)c2)C1 162370542 GJJVZRINFUIIAB-KFWWJZLASA-N 439.131 4.899 50 10 IJGE CC(C)([C@@H](Br)c1csc2c(Br)cccc12)S(C)(=O)=O 163387245 ICSOZVVPTNDRKF-LBPRGKRZSA-N 426.195 4.923 50 10 IJGE O=C(CNc1cccc2ccccc12)NN=Cc1cccc(OC(=O)/C=C/c2ccco2)c1 263629783 HPNFVZTULBCABC-IFIWHPPKSA-N 439.471 4.614 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CCC[C@H]1CCBr 302615960 OMRZKZGEOMDMIZ-JTQLQIEISA-N 439.973 4.601 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CCC(F)(F)[C@@H](CCl)C1 404025521 RGEVIMRQYKMRFQ-QMMMGPOBSA-N 431.502 4.548 50 10 IJGE FC(F)Oc1cc(I)c(CBr)cc1Br 575682285 NXMOWSWSFSHAHN-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE CC(C)c1nc(C#N)c(NNC(=O)c2cc(-c3ccc(F)cc3)nc3onc(C4CC4)c23)o1 727736146 JFJMRQZWGQRCOS-UHFFFAOYSA-N 446.442 4.646 50 10 IJGE Cc1cc(NNC(=O)c2cc(-c3ccccc3)nc3cc(Br)ccc23)nc(C)n1 736718519 LEKXCUCZIANQNE-UHFFFAOYSA-N 448.324 4.828 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2CCC(C3CC3)CC2)c(-c2ccc(Cl)cc2)n1 816904254 FPOVJRQMELWJRV-XSFVSMFZSA-N 433.943 4.673 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2CCC(Cc3ccccc3)CC2)c(-c2ccccc2)n1 914456421 HKTBSWPTIGEHKQ-NCELDCMTSA-N 449.558 4.852 50 10 IJGE O=C(Cc1cccc2ccccc12)NN=Cc1ccccc1OCc1ccc(C(=O)O)cc1 1084303164 BTQMJKGGBWIUMU-UHFFFAOYSA-N 438.483 4.810 50 10 IJGE Cc1ccc(C)c(-n2c(C)cc(C=NNC(=O)C(=O)Nc3cc(Cl)ccc3C)c2C)c1 1084544588 COBYKMPAQXFDCB-UHFFFAOYSA-N 436.943 4.762 50 10 IJGE C/C=N/NC(=O)CC[C@@H](C)[C@@H]1CC[C@@H]2[C@H]3[C@H](O)C[C@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@@]12C 1085895345 JACKUUJOKIRMRC-NIXXSJDGSA-N 432.649 4.515 50 10 IJGE CCOc1cc(Br)ccc1[C@@H](O)P(=O)(c1ccccc1)c1ccccc1 1088727088 LIJXCGPEUNIJIR-NRFANRHFSA-N 431.266 4.853 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CSCc2ccc(C(C)(C)C)cc2)c1C 1182768157 DCNATLFAMLLTFL-UHFFFAOYSA-N 435.597 4.829 50 10 IJGE C#CC[C@H](CCOC)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc3ccccc23)c1C 1438147445 LSDHNWHBCJDONM-YLXJWSIRSA-N 425.532 4.699 50 10 IJGE Cc1ccc(Cn2nc(C)c(CCC(=O)NNc3nc4ccccc4[nH]c3=S)c2C)cc1 1453769216 KWVNFLWIFHFQIG-UHFFFAOYSA-N 446.580 4.538 50 10 IJGE Cc1c(C(=O)N(C)Cc2ccccc2)oc2c1C(=NNC(=O)c1cccc(Cl)c1)CCC2 1772745617 DBISGPDVTUWCHE-UHFFFAOYSA-N 449.938 4.984 50 10 IJGE O=C(CCBr)c1cc(SC(F)(F)F)ccc1I 1848425926 TZPGRWGZZRLGPB-UHFFFAOYSA-N 439.034 4.871 50 10 IJGE CCc1nn(Cc2ccccc2Cl)c2c1[C@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689175 LNPQECHYYTYXRA-LJQANCHMSA-N 441.318 4.724 50 10 IJGE NC(=O)N/N=C/c1cn(-c2ccccc2)nc1-c1ccc(OCc2ccc(Cl)cc2)cc1 1873496134 FIHTVHDDSFDWHD-MZJWZYIUSA-N 445.910 4.774 50 10 IJGE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1ccc(-c2ccc(C(C)=O)cc2)o1 1873793291 HLXUJJYFYBTRBF-DEMPXQDTSA-N 441.528 4.539 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2cccnc12 1915322955 HIHGNWNKTVUUJI-LJQANCHMSA-N 447.398 4.845 50 10 IJGE CC(C)[C@@H](Br)[C@H](C)NC(=O)c1cc(Br)cc(Br)c1 2041309211 YKUSESNSTMLMFM-QPUJVOFHSA-N 441.989 4.749 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CCCCCBr)CC[C@H]1C(F)(F)F 2044695172 AZTAPTWWOCFQBJ-UONOGXRCSA-N 431.337 4.577 50 10 IJGE C[C@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)c1c[nH]c(CBr)c1 2059323868 OSTMOWGMMOKJLX-CQSZACIVSA-N 439.400 4.923 50 10 IJGE C[C@H]1[C@H](n2c(CCCl)nc3cncc(Br)c32)CCN1Cc1ccccc1 2095446704 ZMLYCNKIFIDWBX-KBXCAEBGSA-N 433.781 4.811 50 10 IJGE CC(C)[C@H](CBr)CN1CC[C@H](C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)C1 2106786448 UZOSVHJWNGWUKU-KFWWJZLASA-N 445.364 4.679 50 10 IJGE C[C@]1(C(F)F)C[C@@H]1[C@@H](Br)c1cc(I)cc2c1OCC2 2120824406 KBRQBUPPZFBHAA-SUNKGSAMSA-N 443.069 4.953 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@H]1CCCC[C@H]1N(C)C(=O)[C@@H](Br)C1CCCC1 2138777484 JTKFULLKKWWNJU-ZACQAIPSSA-N 431.415 4.577 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CCC([C@H](F)CCl)CC1 2163237930 HSXIJRBVVQKUDS-CYBMUJFWSA-N 427.539 4.641 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)CN1c1cc([N+](=O)[O-])ccc1CBr 2176909025 PXHQLBZJHGIPSX-SJORKVTESA-N 432.362 4.837 50 10 IJGE O=C(c1scc(Br)c1Cl)N1[C@H](CBr)C[C@H]2CCC[C@@H]21 2264505431 YSOIHRJSRJQHKC-WEDXCCLWSA-N 427.589 4.942 50 10 IJGE Cc1c(N(C)Cc2ccc(I)cc2)ccnc1CBr 2265601763 BQMWXPZGRJWHJG-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE Fc1cccc(I)c1[C@H](Br)c1ccc2c(c1)COC2 2267740810 WVOUZTBDOIJSNC-OAHLLOKOSA-N 433.058 4.945 50 10 IJGE N#CC(=Cc1ccc(-c2ccccc2C(=O)O)o1)C(=O)Nc1cccc(Br)c1 2294193064 MSMGBUUHYQRDHR-UHFFFAOYSA-N 437.249 4.953 50 10 IJGE C[C@H]1CCN(Cc2ccc(Cl)c(I)c2)C[C@@H]1Br 2300237951 FBCKFNFWEPWEGG-ONGXEEELSA-N 428.539 4.550 50 10 IJGE Clc1ccc(C[C@@]2(CBr)CCCOC2)cc1I 2300240818 QSEKNHRENXCFNW-CYBMUJFWSA-N 429.523 4.679 50 10 IJGE C[C@@H]1C[C@H](CBr)CN1Cc1ccc(Cl)cc1I 2302306591 FVMVFUODBUZFLF-NXEZZACHSA-N 428.539 4.550 50 10 IJGE C[C@@H](Br)[C@@H]1CCN(Cc2ccc(Cl)cc2I)C1 2302325404 HFCPFWNLQZUTMN-NXEZZACHSA-N 428.539 4.550 50 10 IJGE C[C@@H](Br)CCCN(C)C(=O)c1cccc(Br)c1Br 2314573431 DZSDDQZKXISANW-SECBINFHSA-N 441.989 4.847 50 10 IJGE CC(C)Oc1ccc(C=NNC(=O)c2cccn(Cc3ccc(C(C)(C)C)cc3)c2=O)cc1 2323662141 ALLNHMSFKRGZJM-UHFFFAOYSA-N 445.563 4.745 50 10 IJGE ClC[C@]12C[C@@H]1CC[C@@H]2NCc1ccc(I)c(Br)c1 2325209031 KVRNKEGNJZKJAN-LEWSCRJBSA-N 440.550 4.551 50 10 IJGE CC(C)[C@@H]1[C@@H](Cl)CCN1Cc1ccc(I)c(Br)c1 2325210068 VBKPYQXIKBEIDX-GXTWGEPZSA-N 442.566 4.891 50 10 IJGE CCN(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2326919586 OPCUADYXTRPFGG-YOEHRIQHSA-N 425.358 4.518 50 10 IJGE N#CC(=C(O)CCN1C(=O)c2ccccc2C1=O)c1nc(-c2ccc(F)c(F)c2)cs1 2331351755 WEJYYPBRZBAIGT-UHFFFAOYSA-N 437.427 4.567 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@@H]2CC(F)(F)CC[C@@]2(NC(=O)OC(C)(C)C)C1 2344076742 KYEWAMXMLVSLHE-RVKKMQEKSA-N 439.385 4.668 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C[C@]2(CBr)CC2(F)F)c2ccccc21 2351889296 SZYIIDYOYGRWBU-KBXCAEBGSA-N 431.321 4.883 50 10 IJGE ClCc1cc(Cl)cc(Cl)c1OCc1ncc(I)cn1 2353071930 PJSQPNLEZCVKLV-UHFFFAOYSA-N 429.472 4.706 50 10 IJGE CC(C)[C@H](C)[C@@H](C)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2365436394 JZSKAWOUVQFOGO-VHSXEESVSA-N 447.258 4.707 50 10 IJGE COC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1cccc(OCc2ccc(C)cc2)c1 3260817 JBNVHLUMNVFIPF-STZFKDTASA-N 426.472 4.906 50 10 IJGE CC(C)COc1ccccc1C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl 14034971 LDCALVGVVQMWMN-UHFFFAOYSA-N 439.339 4.648 50 10 IJGE N#C/C(=C/c1ccc(-c2cccc(C(=O)O)c2)o1)c1nc2ncc(Br)cc2[nH]1 33248190 LXMWWSMGNHKVET-QPEQYQDCSA-N 435.237 4.743 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)N/N=C2/CCCc3ccccc32)c(Br)c1 33561820 KUUQDSJPYIEALE-CLCOLTQESA-N 429.358 4.982 50 10 IJGE COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccc(Cl)cc3)ccc21 38649941 IBILHXJDVNLKNF-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)Cc3ccc(Cl)cc3)ccc2[C@H]1c1ccccc1F 38652320 BBUJPYIHEMQRTI-HSZRJFAPSA-N 434.854 4.845 50 10 IJGE CCc1ccc(OCC(=O)N/N=C/c2ccc(OCc3ccccc3C)c(OC)c2)cc1 40911519 CYUJAWMLCAGSGY-JVWAILMASA-N 432.520 4.674 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)CCCOc2ccc(CC)cc2)cc1 40990335 HAQXVIZIELSIDT-RELWKKBWSA-N 434.536 4.837 50 10 IJGE Cc1ccccc1C(=O)N/N=C1\C(=O)N(Cc2c(Cl)cccc2Cl)c2ccccc21 59471804 PWJNNIKUWWVKPN-QLYXXIJNSA-N 438.314 4.983 50 10 IJGE N#C/C(=C/Nc1cc([N+](=O)[O-])ccc1F)c1nc(-c2cc3ccccc3oc2=O)cs1 102902179 BLSUKNYETMTYHZ-RAXLEYEMSA-N 434.408 4.940 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Br)c3cccc(Cl)c3F)cc2[nH]1 124913303 AOMBLXZYPBNKIB-GFCCVEGCSA-N 434.490 4.896 50 10 IJGE Cc1c(C(=O)Nc2ccc(SC#N)cc2)sc2ncn(Cc3ccccc3)c(=O)c12 169865122 PDCWEIWTIGYTDI-UHFFFAOYSA-N 432.530 4.640 50 10 IJGE C[C@H](N/C=C(/C#N)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C12CC3CC(CC(C3)C1)C2 217228542 BJWQFQZBVZEQRZ-UORUSPLLSA-N 428.920 4.789 50 10 IJGE O=C(CNc1cccc(C(F)(F)F)c1)NN=C/C(Br)=C\c1ccccc1 254842581 ORIODVFGPXVZSX-AFGVYOGRSA-N 426.236 4.655 50 10 IJGE COc1cc(Br)c([C@@H]2CC[C@@](C)(CI)O2)cc1OC 311903449 BIPXIZNYPSXVRL-FZMZJTMJSA-N 441.103 4.512 50 10 IJGE C[C@@H](Br)[C@H]1CCCN(Cc2cc(Cl)ccc2I)C1 689037943 PMSMULUVYXYBFY-MNOVXSKESA-N 442.566 4.940 50 10 IJGE CC(C)[C@H]1CN(c2nc3sccn3c2CBr)CCN1Cc1ccccc1 704739080 NCSJMTZSAUZKCT-GOSISDBHSA-N 433.419 4.638 50 10 IJGE Cc1sc([C@@H](Cl)c2cnn(C)c2I)c(C)c1Br 724915466 QGPHQNZHZXWAIF-VIFPVBQESA-N 445.551 4.794 50 10 IJGE CCCCOc1ccc(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)c(Cl)c1 771734478 FMOAIINOUIGPPP-UHFFFAOYSA-N 425.920 4.745 50 10 IJGE N#Cc1ccc(NNC(=O)c2cccc(OCc3ccccc3C#N)c2)c(C(F)(F)F)c1 799748393 PLWSAVYVDWSYRW-UHFFFAOYSA-N 436.393 4.785 50 10 IJGE Cc1ccc(Sc2ccc(/C=C(\C#N)C(=O)N3CCN(c4ccccc4)CC3)o2)cc1 1083940536 LBERFORDWLITHM-LVZFUZTISA-N 429.545 4.995 50 10 IJGE Cc1cc(C(=O)NNc2nc3ccccc3[nH]c2=S)c2cc(Br)ccc2n1 1167430584 JRIVFKSWJXDWJZ-UHFFFAOYSA-N 440.326 4.668 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1ccc(Br)c(Cl)c1F 1453767115 DTVFOUAOGBNWGU-UHFFFAOYSA-N 427.686 4.604 50 10 IJGE C=CC[C@@]1(C(=O)N2CC[C@H](O[Si](C)(C)C(C)(C)C)C2)CCCN1C(=O)OC(C)(C)C 1470550375 BKSMIKMDNHQVGQ-MBSDFSHPSA-N 438.685 4.955 50 10 IJGE Cc1cc(OCc2ccccc2)c(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)s1 1610925276 URZMGBIZQKYXAE-UHFFFAOYSA-N 445.548 4.861 50 10 IJGE CCCSc1ccccc1C(=O)NNC(=O)c1ccc(-c2cccc(OC)c2)nc1C 1865758638 KKWXPYSENBZFIV-UHFFFAOYSA-N 435.549 4.643 50 10 IJGE COc1ccc(/C(C)=N/NC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)cc1OC 1865762773 BRPWQHATEQMOAJ-UVHMKAGCSA-N 425.435 4.506 50 10 IJGE N#C/C(=C(/O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 1872747294 WJOXIXHZMPHCSZ-LLWUOSFCSA-N 446.488 4.560 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)C(=O)c1ccccc1I 1915090584 MRIHGHPBLRTXQR-OAHLLOKOSA-N 427.713 4.951 50 10 IJGE Cc1nn(C)c(Br)c1CN(Cc1ccccc1)C1(CBr)CCC1 1986914483 GWZWQWMXLOCUQB-UHFFFAOYSA-N 441.211 4.811 50 10 IJGE Cc1cc(I)cc(-n2c(Cl)nc(Cl)c2CBr)c1 2006640233 YXNPVVDXPJPMMS-UHFFFAOYSA-N 445.913 4.987 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1ccccc1OCc1ccccc1 2023033773 KVARUVYCFIFZEP-YJBOKZPZSA-N 437.321 4.845 50 10 IJGE CC(C)N1C[C@H](Cc2cc(Cl)ccc2I)[C@@H](Br)C1 2039249205 ASEBIKGXJUMKGQ-AAEUAGOBSA-N 442.566 4.591 50 10 IJGE CCn1nnc(Br)c1C[C@H](Br)c1ccccc1Br 2050534518 BDGACDOEZXFIQT-JTQLQIEISA-N 437.961 4.502 50 10 IJGE Cc1cc(Br)c([C@H](Cl)[C@@H]2CCCS(=O)(=O)C2)cc1Br 2089861662 UBIZKCAFKHMJTC-NOZJJQNGSA-N 430.589 4.625 50 10 IJGE CSCC[C@H](Cl)CCNC(=O)c1cc(Br)cc(Br)c1 2090381436 FHZZADRHMLHMFR-GFCCVEGCSA-N 429.605 4.692 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2Cc1cnn(Cc2ccccc2)c1 2096811387 JXEUAKOEDFUGBW-UHFFFAOYSA-N 430.737 4.534 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1[C@@]12C[C@@H]1CN(Cc1ccccc1)C2 2099678710 KZRSSKLEQKXOPV-XBHMSOGKSA-N 431.765 4.725 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Cl)c1cc(Br)n(C)n1 2138246657 CUAXANVUHAWCMV-LLVKDONJSA-N 428.939 4.935 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(C)CN(C[C@@H](CBr)c3ccccc3)C[C@]2(C)C1 2163065289 ZBAYZFROZZFFBT-QIJUGHKUSA-N 437.422 4.744 50 10 IJGE CC(C)N(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)[C@H](Br)C1CCCC1 2167031231 HWHBUGXAYOYZSU-SJLPKXTDSA-N 445.442 4.824 50 10 IJGE COCC(CCOc1c(Br)cc(CCl)cc1Br)COC 2187546625 ISAAPKREIKMOSN-UHFFFAOYSA-N 430.564 4.628 50 10 IJGE CCn1ncc(Br)c1[C@@H](Br)c1cc(Cl)c(F)cc1OC 2207358899 ZJQHSYFFBVLFSY-LBPRGKRZSA-N 426.511 4.951 50 10 IJGE CN[C@H](c1c(Br)cc(C)c(Br)c1C)[C@H]1C[C@@H]1Br 2214654177 ZGQHTYQVBPUNJZ-RVBZMBCESA-N 425.990 4.872 50 10 IJGE Cc1cc(Br)cnc1C(=O)N(Cc1ccccc1)[C@H](C)CCBr 2243966446 MDJGZYXORHFUBG-CQSZACIVSA-N 440.179 4.968 50 10 IJGE C[C@@H](Br)CN(CC(C)(C)C)C(=O)c1ccccc1I 2272459371 HALBZYSEQKTJDF-LLVKDONJSA-N 438.147 4.563 50 10 IJGE Cc1cc(F)c(CBr)c(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@H]32)c1 2283391097 ASJYBKSHWFITJE-FGZHOGPDSA-N 433.365 4.509 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@@H](Br)C2(CCC2)C1 2285846768 RXGUZOPPXKUSMD-GFCCVEGCSA-N 425.523 4.631 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@@H]1Cc1ccc(Cl)c(I)c1 2300267036 FGDRHODQSCGQMA-OPQQBVKSSA-N 429.523 4.676 50 10 IJGE C[C@@]1(CCBr)CCN1Cc1ccc(Cl)cc1I 2302327273 XLULSHAVVZGEOZ-CYBMUJFWSA-N 428.539 4.694 50 10 IJGE COc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)cc1 2314634183 XQKQWRWDERWRKR-RUZDIDTESA-N 442.446 4.671 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)c(I)c2)[C@H](C)C[C@@H]1Br 2315552324 CSDXDQCUWYWFNR-FOGDFJRCSA-N 442.566 4.938 50 10 IJGE Cc1nn(C)c(Oc2cc(Br)cc(I)c2)c1CCl 2316846763 FFYCVHMRKNTJNH-UHFFFAOYSA-N 441.494 4.627 50 10 IJGE CCCOc1ccccc1C=CC(=O)NNC(=O)c1ccc(-c2ccc(CC)cc2)nc1C 2321139536 XOAKYGWUFVFRCF-UHFFFAOYSA-N 443.547 4.883 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Br)c2)CC[C@H]1CCl 2325223199 WMLVMGAQWWHDNG-PWSUYJOCSA-N 442.566 4.751 50 10 IJGE COc1cc(C=C(C#N)c2ccccc2[N+](=O)[O-])ccc1OC(=O)c1cccc([N+](=O)[O-])c1 2331066166 STOXSMWOHCUWAT-UHFFFAOYSA-N 445.387 4.795 50 10 IJGE COCCOc1ccc(C=C(C#N)C(=O)Nc2ccc(-c3ccc(N(C)C)cc3)cc2)cc1 2331123179 NRKUEYFUZTXAFA-UHFFFAOYSA-N 441.531 4.990 50 10 IJGE CC1(C)C[C@H](CCl)CN(C(=O)c2ccc(Cl)cc2I)C1 2365581935 LDBVVEYRDPGQMZ-SNVBAGLBSA-N 426.125 4.672 50 10 IJGE CC1(C)C[C@H](NC(=O)c2ccc(Cl)cc2I)C[C@H](Cl)C1 2365587816 BNVIHRNMAREKCZ-WDEREUQCSA-N 426.125 4.861 50 10 IJGE Cc1nn(C)c(COc2cc(F)c(CBr)c(Cl)c2)c1Br 2379780399 XUIOAAOOJITTFT-UHFFFAOYSA-N 426.511 4.757 50 10 IJGE Cc1cnc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)cc1CBr 2380364279 CPSZGYWDTUQFFN-GBAJDQEWSA-N 426.402 4.632 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccccc3)ccc21 38681232 VHBCOQYJRCIBAE-XMMPIXPASA-N 426.472 4.913 50 10 IJGE Cc1cc(Oc2ncnc(NNC(=O)c3ccccc3Cl)c2[N+](=O)[O-])ccc1Cl 40658300 TZNSXNIMIQMTQP-UHFFFAOYSA-N 434.239 4.549 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 58894358 JBPUETPDNZAQML-YMCFUUGVSA-N 437.515 4.596 50 10 IJGE Cc1ccccc1SCC(=O)N/N=C/c1ccccc1OCc1ccc(C(=O)O)cc1 59148014 WFNZXTIPCBLLNO-AFUMVMLFSA-N 434.517 4.515 50 10 IJGE O=C(c1cc(C(F)(F)F)ccc1Br)N1CCCC[C@H]1CBr 159884019 RVPPHGSDCQJZHT-JTQLQIEISA-N 429.074 4.858 50 10 IJGE CCOc1cc(/C=N\NC(=O)Cc2ccc(OC)cc2)ccc1OCc1cc(C)ccc1C 169901202 TUORNBOOYQQJAL-QRQIAZFYSA-N 446.547 4.983 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)/C(C#N)=C\NCc1cccc(Br)c1 217187565 YBGCIOWNBRAJJF-IYWFSZBXSA-N 442.357 4.531 50 10 IJGE COc1ccc(CC(=O)NN=C(C)c2cccc(NC(=O)c3ccc(Cl)cc3)c2)cc1 254287033 GBZBFMLQHNHZDG-UHFFFAOYSA-N 435.911 4.684 50 10 IJGE Clc1cc(CBr)ccc1N1CC[C@H](N2CCN(Cc3ccccc3)CC2)C1 380098479 MOQNXRDUMQQDIF-FQEVSTJZSA-N 448.836 4.631 50 10 IJGE COc1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CBr)cc1Br 394588095 YOWHHPMIHKVXNZ-QWHCGFSZSA-N 449.183 4.803 50 10 IJGE CC1(C)[C@@H](Br)CCN1C(=O)c1scc(Br)c1Br 705518220 QUSXPWCYEDSIIH-ZETCQYMHSA-N 446.002 4.661 50 10 IJGE CC[C@H](C[C@@H](C)Cl)NC(=O)c1ccc(I)c(Br)c1 721601910 IOKXWJJQTXSYCZ-PSASIEDQSA-N 444.538 4.580 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1C 736691339 OEZCYRURWBWNOR-UHFFFAOYSA-N 436.475 4.576 50 10 IJGE COc1ccc([C@@H](C)COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cc1 768822232 GFTYUVCPHRPMRH-OMNSNBSWSA-N 440.503 4.726 50 10 IJGE COc1ccc(NC(=O)[C@@H](NNC(=O)c2ccc(C(C)(C)C)cc2)c2ccccc2)cc1 797358628 ODEDVKMIZREDBL-QHCPKHFHSA-N 431.536 4.607 50 10 IJGE N#Cc1ccc(NNC(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)c(C(F)(F)F)c1 799564939 KEOVPHHPZNOZSS-UHFFFAOYSA-N 445.376 4.730 50 10 IJGE Cc1cccc(NC(=O)/C(C#N)=C/c2cc(Br)cc(Br)c2O)c1 1084471491 HPIQNXVPENXGPP-WUXMJOGZSA-N 436.103 4.771 50 10 IJGE O=C(CSc1nnc(Nc2ccc(Cl)cc2)s1)N/N=C/c1ccc(Cl)cc1 1615216641 GPDYLPLCTGSAPV-AWQFTUOYSA-N 438.365 4.831 50 10 IJGE CC(=O)c1ccc(NC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)cc1C 1669982407 CJAKYRFJELVNIS-INIZCTEOSA-N 427.570 4.877 50 10 IJGE CCCc1nn(-c2cccc3ccccc23)c2c1[C@H](c1ccc(O)c(O)c1)C(C#N)=C(N)O2 1865680543 NXLPQQOYKJGKQS-HSZRJFAPSA-N 438.487 4.607 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)cc1OCC 1865687033 HUUZVTZNLPYRKF-XMMPIXPASA-N 444.535 4.977 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2cccc(F)c2)cc1 1865709194 QUYGSIOGFHUQLR-GOSISDBHSA-N 442.416 4.870 50 10 IJGE CC[C@@](C)(NC(=O)CCC(=O)c1ccc(C)cc1C)C(=O)Nc1ccc(SC#N)cc1 1867092267 RASWRJZTOSLLOJ-XMMPIXPASA-N 437.565 4.763 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCCN(C(=O)OC(C)(C)C)C12CCC2 1883670722 QRCQUKAFHSBSDD-HUUCEWRRSA-N 447.414 4.844 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@@H](C(F)(F)CBr)C1 1892726124 KHWKFBODYXGVRG-ZCFIWIBFSA-N 437.531 4.656 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1csc(Br)c1 1916369639 ICGABJLUXMWENY-AWEZNQCLSA-N 447.192 4.563 50 10 IJGE C[C@H]1C[C@H](C)CC[C@@H]1O[C@@](C)(CI)CNC(=O)OC(C)(C)C 1932262662 XHINTQMTUNXDMU-FHIRATQRSA-N 425.351 4.546 50 10 IJGE C[C@@H](Br)C(C)(C)NC(=O)c1cccc(Br)c1Br 1943887328 OQMAQQXFRXDFNJ-SSDOTTSWSA-N 427.962 4.503 50 10 IJGE C[C@@H]1C[C@H](CBr)CN1C(=O)c1scc(Br)c1Br 1950513268 QUCNSSFWMUSNDW-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE C[C@H]1C[C@H]1N(CCBr)Cc1cccc(Br)c1Br 2002027623 VHJIVPKVHRNLDM-JOYOIKCWSA-N 425.990 4.817 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CCC(F)(F)[C@H](CBr)C1 2038680207 SSBGQAVTTBGQRX-CQSZACIVSA-N 430.314 4.819 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H](N(CCCCCBr)C1CC1)C(F)(F)F 2044704749 GFFBEIBRYHXZGH-CQSZACIVSA-N 431.337 4.862 50 10 IJGE FC(F)Oc1c(OC(F)(F)F)ccc(I)c1CBr 2060222482 RGEBQVJUGQQILW-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE FC(F)(F)c1cc(Br)cc(-n2nc(CBr)c3c2C[C@H]2C[C@@H]32)n1 2080742927 WZIFRFNZSCOREU-HTRCEHHLSA-N 437.057 4.603 50 10 IJGE Clc1cc(CN2C[C@H](CBr)C3(CC3)C2)ccc1I 2086661794 PIAKGWMLVADFDG-NSHDSACASA-N 440.550 4.552 50 10 IJGE Clc1ccc(CBr)c(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1 2129053631 NSBLYIFLBWEXJK-RTWAWAEBSA-N 435.793 4.715 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2cc([N+](=O)[O-])ccc2CBr)C1 2176909022 PXHQLBZJHGIPSX-DLBZAZTESA-N 432.362 4.837 50 10 IJGE CCc1cc(Br)c([C@H](Br)[C@]23CCC[C@H]2CS(=O)(=O)C3)s1 2201878815 MOIRTONFJHDVJC-HERUPUMHSA-N 442.238 4.724 50 10 IJGE CC1(C)[C@H]2CC[C@@H](C2)[C@]1(CI)O[C@@H]1CCN(Cc2ccccc2)C1 2250384993 DZWXRQWHWBSEQY-HUUJSLGLSA-N 439.381 4.907 50 10 IJGE Cc1nc(N(C)Cc2ccccc2I)sc1CBr 2254353538 RFPNXFTVZGAAAX-UHFFFAOYSA-N 437.144 4.587 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(OC[C@@H]2CC(F)(F)C23CCC3)CC1 2266140204 GIKAWGCECLCGNE-AWEZNQCLSA-N 438.353 4.993 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Br)c1cc(Cl)n(C)n1 2277975028 OUJABFKPXPLZHI-NSHDSACASA-N 428.939 4.982 50 10 IJGE CCCn1c(C)cc(C=C(C#N)C(=O)OCC(=O)Nc2ccc(OC(F)(F)F)cc2)c1C 2297356618 OUQKIKLRZLYMEQ-UHFFFAOYSA-N 449.429 4.502 50 10 IJGE C[C@@H](Br)[C@H]1CCCN(Cc2ccc(Cl)cc2I)C1 2318539095 LBEBAAXUWKSKQD-MNOVXSKESA-N 442.566 4.940 50 10 IJGE Cc1nn(Cc2ccccc2)c2c1[C@@H](NC(=O)C(C#N)=Cc1ccc(Cl)cc1)CCC2 2329645188 LYOSXRCAQYDPBH-QFIPXVFZSA-N 430.939 4.994 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3)n2)cc1 2331276631 YNDDHFOJCVNVMD-UHFFFAOYSA-N 438.421 4.893 50 10 IJGE Cn1cc(I)c(C[C@@]2(CBr)CCCC(C)(C)CC2)n1 2341760654 NTUVBXBBGUIKOP-OAHLLOKOSA-N 439.179 4.939 50 10 IJGE CC1(C)CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)C[C@@H]2C(F)(F)F)C1 2345008931 WJHRGHRONOKWFX-CYBMUJFWSA-N 443.348 4.671 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)[C@H]1CCCS(=O)(=O)C1 2365226430 UTFWCBFFXUTRRX-QPUJVOFHSA-N 448.579 4.764 50 10 IJGE Cc1nc(C(=O)N(C)CC(C)(C)[C@H](Br)C(C)C)c(Br)s1 2365908621 PVTUFUXOFCZDSH-LLVKDONJSA-N 426.218 4.732 50 10 IJGE COc1ccc2ccccc2c1/C=N/NC(=O)COc1ccc(Cl)cc1Br 13986070 VOFIJWDXVFEVMQ-FOKLQQMPSA-N 447.716 4.793 50 10 IJGE CCCOc1ccc([C@@H](Br)[C@H]2CCCCS2(=O)=O)cc1Br 229005220 XZYPMQNCKIMGJB-HUUCEWRRSA-N 440.197 4.641 50 10 IJGE CO[C@H](CO[C@@H](CI)c1cccc(Br)c1)C(C)C 386715843 WRZBIAFXWXDCEV-UONOGXRCSA-N 427.120 4.613 50 10 IJGE ClCCc1nc2cc(I)ccc2n1CCC1SCCS1 693832559 WTCHLKKRKKULJP-UHFFFAOYSA-N 438.787 4.618 50 10 IJGE Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1C=NNC(=O)c1cccc(C#N)c1 766707109 VNCPVOOSDPNGPZ-UHFFFAOYSA-N 439.450 4.748 50 10 IJGE C=CCN(CCc1ccco1)C(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(OC)cc2)c1C 1458361700 ZBWSHBVTMMCIQW-OQKWZONESA-N 429.520 4.860 50 10 IJGE Cc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)N3CCc4ccccc4C3)c(C)c21 1772743504 DMIWSJUIIUWECW-UHFFFAOYSA-N 441.531 4.565 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)OCc1ccccc1 1865759937 ZGSOTJAMULPYEQ-UHFFFAOYSA-N 430.291 4.935 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)C1 1880762269 UNFPNLMCTYVUDK-ILXRZTDVSA-N 435.403 4.606 50 10 IJGE CCN(C[C@](C)(CI)OC[C@@H]1C[C@H]1C(C)C)C(=O)OC(C)(C)C 1897631455 GJOZYVZXWZYBPC-MPGHIAIKSA-N 439.378 4.746 50 10 IJGE Brc1cc(OCc2ccccc2)ccc1[C@@H](Br)[C@@H]1COCCO1 1899860544 ONRFXHPGDMHXDX-ZWKOTPCHSA-N 442.147 4.880 50 10 IJGE Cc1csc(CBr)c1S(=O)(=O)N(Cc1ccccc1)CC1CCC1 2009646035 MEPPJRCAFNQAJK-UHFFFAOYSA-N 428.417 4.942 50 10 IJGE CC(C)[C@@H](CCBr)NC(=O)c1cccc(Br)c1Br 2031486184 LUDCJLUYVJJDLV-LLVKDONJSA-N 441.989 4.751 50 10 IJGE Cc1cc(C(=O)N[C@@H](C)CCCCCI)sc1Br 2054162159 PPMBLAVSJGLIII-JTQLQIEISA-N 444.176 4.933 50 10 IJGE O=C(CBr)c1ccc(C(F)(F)F)c(I)c1C(F)F 2060393465 FUJQGUNAOLMXAZ-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE C=CCC[C@@H](CBr)NC(=O)c1cccc(Br)c1Br 2075345066 YCEZKYKQEGLJCO-VIFPVBQESA-N 439.973 4.671 50 10 IJGE C[C@H]1[C@H](NC(=O)C(F)(F)F)[C@H](C)CCN1CCCCCCCCCBr 2106781289 GRBYZIQDTRJVBD-OWCLPIDISA-N 429.365 4.889 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](CN(C[C@H](CBr)C2CCC2)C2CC2)C1 2106784034 FKKBNJFMZZZTPF-WMZOPIPTSA-N 429.443 4.909 50 10 IJGE C[C@H]1C[C@@H](C)N(C[C@@H](CBr)c2ccccc2)CCN1C(=O)OC(C)(C)C 2108184602 DUVXXECVPAMGHM-ZIFCJYIRSA-N 425.411 4.885 50 10 IJGE O=S1(=O)CCC[C@H]1[C@@H](Br)c1cc2sc(Br)cc2s1 2263560384 PZMFJFCOQINVHI-ONGXEEELSA-N 430.208 4.739 50 10 IJGE O=C(COc1ccc2ccccc2c1)NN=Cc1ccc(OC(=O)C=Cc2ccco2)cc1 2294217772 OARMTRCPUDWCOS-UHFFFAOYSA-N 440.455 4.581 50 10 IJGE CC(C)(CCCl)C(=O)Nc1ccc(Br)c(I)c1 2300170555 NVFMDFYEPPFPCQ-UHFFFAOYSA-N 430.511 4.647 50 10 IJGE CCOc1cc(Br)c(C=C(C#N)C(=O)N[C@H](C)c2ccccc2)cc1OC 2313738665 NMEHSHXJXOJACN-CQSZACIVSA-N 429.314 4.641 50 10 IJGE CN(Cc1ccc(Cl)cc1I)[C@H](CBr)CC1CC1 2318521322 HCGHXTXDHGCLRR-ZDUSSCGKSA-N 442.566 4.940 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)NNC(=O)C=Cc1ccc(C(C)C)cc1 2321152226 FSFPEQPZWAIBTN-UHFFFAOYSA-N 435.474 4.933 50 10 IJGE COc1cccc(-c2csc(C(C#N)=C(O)CNC(=O)c3ccc(Cl)cc3)n2)c1 2331246349 FFPSJIGDIKJCCL-UHFFFAOYSA-N 425.897 4.695 50 10 IJGE FC(F)(CCl)C(F)(F)CNCc1ccc(I)c(Cl)c1 2336542869 CCJITNDAXDWHEL-UHFFFAOYSA-N 430.010 4.544 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cc(F)ccc1C(F)F 2338322211 BQWGIRNEKNHYAC-CQSZACIVSA-N 430.264 4.816 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C)CN(CC2(CBr)CCCCC2)CC1(F)F 2351582342 QITREANWCIHFTL-QGZVFWFLSA-N 439.385 4.814 50 10 IJGE C/C(=N/NC(=O)c1ccccc1OCc1ccc(Cl)cc1)c1ccc2c(c1)OCCO2 35074571 PCKIBYQBDWKXRO-QQXSKIMKSA-N 436.895 4.844 50 10 IJGE O=C(NNC(=O)c1ccccc1SCc1cscn1)c1cc2c(s1)CCCCC2 36703970 QFHJHOQFYWSLJY-UHFFFAOYSA-N 443.619 4.841 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(Cl)cc4)ccc32)cc1 38650277 VIVNJCZZMQWTGB-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2cc(Cl)c(OCC)c(OCC)c2)cc1 58894872 WFMYZGBQHVPXRZ-UQEONJGVSA-N 448.947 4.500 50 10 IJGE Fc1cc2c(cc1I)nc(CCCl)n2CCCC(F)(F)F 130911171 PPWNVHLOMCEVTI-UHFFFAOYSA-N 434.602 4.904 50 10 IJGE O=S(=O)(c1cc(Cl)sc1Cl)N(CCBr)Cc1ccccc1 147582707 VRDDDCFVTHKFNO-UHFFFAOYSA-N 429.188 4.641 50 10 IJGE CC(=NNC(=O)c1cccc(F)c1)c1cccc(NC(=O)COc2ccc(Cl)cc2)c1 252622984 OHEVBKPAGOHIDO-UHFFFAOYSA-N 439.874 4.651 50 10 IJGE CCn1c(SCC(=O)NN=C/C(Cl)=C\c2ccccc2)nnc1-c1ccc(C)cc1 254476072 ZXQAORULRONPBA-XRCBOCMQSA-N 439.972 4.747 50 10 IJGE CCn1c(SCC(=O)NN=Cc2cccc(F)c2)nnc1-c1ccc(C(C)(C)C)cc1 254483613 JHVBNCLJIBLUDV-UHFFFAOYSA-N 439.560 4.644 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)NN=Cc2cccc(OC(=O)/C=C\c3ccco3)c2)cc1 254866351 HAVLQWQTBKFWRZ-PQDPSWMUSA-N 446.503 4.725 50 10 IJGE Nc1ccc([C@H]2CN(Cc3ccccc3)C[C@@H]2CI)c(Cl)c1 382684243 GJFYNIOGWBHEJY-YOEHRIQHSA-N 426.729 4.573 50 10 IJGE CCN(C(C)(C)CCl)S(=O)(=O)c1cc(Br)c(C)cc1Br 688355396 NKEVLTZYFBZTSD-UHFFFAOYSA-N 447.620 4.548 50 10 IJGE CC(C)(C)N(CCCl)C(=O)c1cc(Br)ccc1I 690964444 BFIUZDLLYABHSS-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE ClCc1cc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)ncc1Br 705846037 OMARHRHVHIUOLZ-SAJDGTNDSA-N 446.820 4.930 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc(-c3ccc(F)cc3)cc2F)c1C 736696618 JMPUMPBYYKHOLC-UHFFFAOYSA-N 431.446 4.858 50 10 IJGE CCCc1ccc(-c2ccc(NC(=O)C(=O)NNc3nc(C(F)(F)F)cs3)cc2)cc1 785147741 QRTFOEIPSVDVJT-UHFFFAOYSA-N 448.470 4.863 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)N(C)C)c(Br)cc1OCc1ccc(F)cc1 1084100266 TVLLIPNEEUQAOI-CXUHLZMHSA-N 447.304 4.561 50 10 IJGE C#C[C@@H]1CCCCN1C(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Br)cc2)c1C 1134915945 QQHJBIHASHIUMU-LUDQZLGDSA-N 436.353 4.778 50 10 IJGE C=CCCC(C)(C)CNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1 1683260996 SSUAGGFRJMXVKG-UHFFFAOYSA-N 429.948 4.855 50 10 IJGE CCOc1ccc(OCC(=O)NN=Cc2ccc(OCc3ccccc3C)c(OC)c2)cc1 1772754593 ZKPRCLYIFGTRRZ-UHFFFAOYSA-N 448.519 4.510 50 10 IJGE O=C(c1ccc(C(F)(F)F)cn1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915311729 HIAVKEIJFNQSGA-KRWDZBQOSA-N 427.264 4.916 50 10 IJGE CC(C)(C)OC(=O)NC1CCC(C(=O)NN(Cc2ccccc2)Cc2ccccc2)CC1 1923615904 WXUXJOYBJSAWLG-UHFFFAOYSA-N 437.584 4.804 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2-c1csnc1Br 1926861728 IQBDWCXCOPLAAN-UHFFFAOYSA-N 425.508 4.885 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1ccc(Br)c2cccnc12 1984040995 UZGRXAPMQAVNPF-LBPRGKRZSA-N 444.167 4.828 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]3(CCC[C@H](CI)O3)C[C@@H]21 2001949849 IHTRXGZPLWAVEL-OAFZBRQQSA-N 449.373 4.929 50 10 IJGE CC[C@H](C)N(CCBr)Cc1ccc(I)c(Cl)c1 2026559516 BAIDJZOXZNNBFW-JTQLQIEISA-N 430.555 4.940 50 10 IJGE COc1cc(Br)c(C(=O)N(Cc2ccccc2)C[C@H](C)Cl)cc1OC 2068785424 WVVINOXIUQLUKA-ZDUSSCGKSA-N 426.738 4.736 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1ccc(Br)cc1Cl 2081235316 DPVQUBDOYLXXES-UFBFGSQYSA-N 444.538 4.682 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)[C@@H](Br)C2CCCC2)cc1 2167044254 WKKAYVBJIKQBRR-KSSFIOAISA-N 439.394 4.842 50 10 IJGE CCC[C@]1(CNC(=O)[C@@H](Br)C2CCCC2)CCCN(C(=O)OC(C)(C)C)C1 2167048145 OTDPGGYTNJKRNW-LAUBAEHRSA-N 445.442 4.874 50 10 IJGE Cc1c(Cl)cc(CN2CCOC[C@H]2C[C@@H](C)Br)cc1Br 2185304724 FCRYVWBLNDLEFR-ZWNOBZJWSA-N 425.592 4.785 50 10 IJGE COCc1nnc(COc2c(Br)cc(CCl)cc2Br)s1 2186555457 SYSHQHQMYBGZHA-UHFFFAOYSA-N 442.560 4.527 50 10 IJGE O=C(c1cccc(Br)c1Cl)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Br)C2 2190679406 QFGRPSVJZHPYPZ-HKDSHFDBSA-N 425.523 4.581 50 10 IJGE CN(CC[C@H](O)c1ccc(Br)cc1Cl)CC1CC(Br)C1 2196945376 SPADZOUKYRKVOP-QHAMSDLMSA-N 425.592 4.631 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N1CCCC[C@@H]1CCCBr 2206669570 SYJHJFPNJPGONZ-LLVKDONJSA-N 445.242 4.537 50 10 IJGE C[C@H]1[C@@H](Br)C[C@@H](C)CN1c1ncc(Br)cc1Br 2214807605 FDMZOJXFODIOKS-WEDXCCLWSA-N 426.978 4.605 50 10 IJGE CCCN(C[C@H](C)Br)C(=O)c1ccc(Cl)c(I)c1 2259781091 ZPZXCZODWDEXSW-VIFPVBQESA-N 444.538 4.580 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccccc2)ccc1OCc1cccc(C(=O)O)c1 2294175211 BAAQORNHBIMQCH-UHFFFAOYSA-N 428.444 4.518 50 10 IJGE C[P@@]1(=O)C[C@H](Cc2ccc(Cl)cc2I)[C@@H](Br)C1 2302317563 ITUPSIVKAOXVAK-LTHLMHMASA-N 447.478 4.873 50 10 IJGE CN(Cc1ccc(Cl)cc1I)[C@@H]1CCC[C@@H]1Br 2302326664 RMIVGSBIMLAOMC-WCQYABFASA-N 428.539 4.692 50 10 IJGE CCCN1C(=O)C(=Cc2ccc(OCc3ccccc3F)c(OCC)c2)C(C)=C(C#N)C1=O 2314610659 KQMUDGQVOYRQRW-UHFFFAOYSA-N 448.494 4.806 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@]1(C)CBr 2315552008 YIPGVBJMQYURRQ-HZMBPMFUSA-N 442.566 4.798 50 10 IJGE CCOc1ccc(CCNC=C(C#N)C(=O)Nc2cc(Cl)ccc2Cl)cc1OCC 2324388733 VVGZYQDSGWSXCL-UHFFFAOYSA-N 448.350 4.969 50 10 IJGE CC(C)C[C@H](CBr)CN(CCN(C)C(=O)OC(C)(C)C)CC(F)(F)F 2328529435 VAISYJPQZWKOKA-CQSZACIVSA-N 433.353 4.775 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@@]1(C)CN(c1ccnc(Cl)c1CBr)C2 2344739235 BXQMKDXBTMVDPN-SFTDATJTSA-N 434.809 4.978 50 10 IJGE CCC(CBr)(CBr)NC(=O)c1cc(F)c(Cl)cc1Cl 2351673390 DTDSQCUFENRJLA-UHFFFAOYSA-N 435.946 4.801 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1CN(CC1CC1)C[C@]1(CBr)CC1(F)F 2351888903 LTFHGVBNERIYBK-CRAIPNDOSA-N 437.369 4.518 50 10 IJGE CCN(CCCBr)C(=O)c1cc(Br)c(Br)s1 124907438 KMYJDGIOIMJZMZ-UHFFFAOYSA-N 433.991 4.520 50 10 IJGE O=S(=O)(Nc1ccc(CBr)cc1)c1ccc(Br)cc1Cl 136883475 WRPZNYIYNBXSFK-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE O=C(CCCC[C@@H]1CCSS1)N1CC[C@@H](Oc2ccc(Br)cn2)C1 238880068 PAKFIFACLCZADJ-HUUCEWRRSA-N 431.421 4.538 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1C(=O)c1ccc(Br)cc1Br 399433202 SJOGBINNPLDCJK-PSASIEDQSA-N 439.973 4.600 50 10 IJGE C[C@@H]1[C@@H](C)N(Cc2ccccc2)[C@H](C)CN1c1ccc([N+](=O)[O-])cc1CBr 404258184 BYONFXINWGIMBX-BRWVUGGUSA-N 432.362 4.977 50 10 IJGE C[C@@H](Br)[C@H]1CCCN(c2ncc(Br)cc2Br)C1 688974822 BMVOAMRPBHLTIQ-BDAKNGLRSA-N 426.978 4.606 50 10 IJGE CN(C(=O)c1scc(Br)c1Br)[C@@H]1CCC[C@@H]1Br 709228352 OGYKKGKTTIPRFC-POYBYMJQSA-N 446.002 4.661 50 10 IJGE CC[C@@H](C[C@H](C)Br)NC(=O)c1ccc(I)c(Cl)c1 716942143 XHHKFUBLMSHSKH-WPRPVWTQSA-N 444.538 4.627 50 10 IJGE CN(Cc1ccccc1)[C@H](Cn1c(CCCl)nc2cc(Br)cnc21)C1CC1 717993792 DEHRLYKQXHEOQT-LJQANCHMSA-N 447.808 4.886 50 10 IJGE O=C(NC1(CCCl)CCSCC1)c1cc(Br)c(Br)s1 719718460 AOYFZUWZVGUKRR-UHFFFAOYSA-N 447.645 4.898 50 10 IJGE O=C(NN=Cc1ccc(F)cc1)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 1083967238 OUPHZNKGPKZKAE-UHFFFAOYSA-N 440.272 4.604 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)C(F)(F)c2ccc(C(C)(C)C)cc2)c1C 1160812610 KQBRQXNFLAKNQJ-UHFFFAOYSA-N 425.483 4.688 50 10 IJGE C#CCn1ccc(CN(CC)C(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(Cl)c3)c2C)n1 1297349907 JSTCDORVBJJRNE-KGENOOAVSA-N 445.954 4.533 50 10 IJGE CC(=O)c1cccc(OCc2cc(C(=O)NNc3ccccc3Cc3ccccc3)no2)c1 1583748344 QBCPBKTXSVXBBO-UHFFFAOYSA-N 441.487 4.804 50 10 IJGE Cc1cccc(C(=O)NN=C2CCCc3oc(C(=O)N4CCCc5ccccc54)c(C)c32)c1 1772744892 NCUHBGIWPHUMHZ-UHFFFAOYSA-N 441.531 4.960 50 10 IJGE CCOC(=O)c1oc2c(c1C)C(=NNC(=O)C(c1ccccc1)c1ccccc1)CCC2 1772747677 FLUTUVWEWKQXLX-UHFFFAOYSA-N 430.504 4.753 50 10 IJGE CCCc1nn(-c2cccc(Cl)c2)c2c1[C@@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865702114 MXYSIXZBCDQBHL-IBGZPJMESA-N 426.854 4.975 50 10 IJGE CC(C)(C)OC(=O)NCCCCc1ccc(NC(=O)[C@H]2C[C@H](Br)C2)cc1 1887758137 DPUTXVMWYDGZDA-WKILWMFISA-N 425.367 4.646 50 10 IJGE Cc1nsc(Br)c1C(=O)N(Cc1ccccc1)C[C@H](C)Br 1914609576 VFLDSDZUQMWFAJ-JTQLQIEISA-N 432.181 4.640 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Cl)c(Cl)nc(CC(=O)CBr)c1Cl 1952867176 PCGOICFKKLVLQO-UHFFFAOYSA-N 432.529 4.895 50 10 IJGE BrC[C@@H]1C[C@H]2CN(Cc3ccc(Br)cc3Br)C[C@@H]12 2053979284 DMDHFDYIXMUSMU-GVXVVHGQSA-N 438.001 4.674 50 10 IJGE COc1ccc(C[C@@H](Br)c2cc(I)sn2)cc1F 2056486643 CMLLPWCJGKXGBB-MRVPVSSYSA-N 442.091 4.574 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@H](CBr)C(C)(C)C)CC[C@H]1C(F)(F)F 2106781644 JVENBZGPLGFLAL-MGPQQGTHSA-N 445.364 4.821 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(C)CN(CC3(CBr)CCCCC3)C[C@@]2(C)C1 2106788393 PGZMIOOXWQHKQE-PMACEKPBSA-N 429.443 4.911 50 10 IJGE O=C(c1scc(Br)c1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Cl)C2 2134133507 SXZOFFRWFSMDSM-WXKLWKFWSA-N 431.552 4.596 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N(CCCBr)C(C)(C)C)c1Br 2143912070 CPZJNFJZKBTVIF-UHFFFAOYSA-N 447.258 4.702 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@H]1CC2(CCC2)CO1 2166445577 XLKHHUZSVINTRD-KGLIPLIRSA-N 449.126 4.621 50 10 IJGE O=C(NC[C@@]1(CBr)C[C@H]1C(F)(F)F)c1ccccc1OCc1ccccc1 2192585220 ZJBONZFOVPSMRZ-MJGOQNOKSA-N 442.275 4.959 50 10 IJGE COc1cc(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)ccc1CBr 2204559500 PRSPMYNNOSXZPC-PZJWPPBQSA-N 429.402 4.939 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)c(Br)cc2n1CCC[S@](C)=O 2234059633 JUORIODICOXGTH-SQFXPLBJSA-N 442.604 4.630 50 10 IJGE Cc1sc(C(=O)N2[C@H]3CC[C@H]2[C@H](F)[C@@H](Br)C3)c(Br)c1C 2237632902 DVHHHNZRHUCPEZ-QFOLPQNPSA-N 425.161 4.606 50 10 IJGE COc1ccc([C@H](Br)C[C@@H]2CC[C@H]2OC)cc1I 2257365213 PQCYGYOTVLFXAG-DMDPSCGWSA-N 425.104 4.551 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2CC23CCOCC3)cc1I 2269540757 HFFIXRUVMIOMLI-SMDDNHRTSA-N 437.115 4.553 50 10 IJGE CC(CC(=O)Nc1ccc(Cl)c(Cl)c1)=NNC(=O)c1ccccc1Br 2297710578 VPDHTSPDWBYHTL-UHFFFAOYSA-N 443.128 4.890 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccccc2)C(=O)C1=CNc1ccccc1C(=O)c1ccccc1 2314585732 PVXNCDISQUGYQD-UHFFFAOYSA-N 447.494 4.622 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@@H](Cc2ccc(C)c(C)c2)C(=O)N1c1ccc(CC)cc1 2314593110 HQPFPKPDKGOTIJ-QHCPKHFHSA-N 445.588 4.594 50 10 IJGE Cc1onc(OCc2cc(I)ccc2Br)c1CCl 2318982685 PGWGVYNFPFOMPJ-UHFFFAOYSA-N 442.478 4.668 50 10 IJGE CC(C)COc1cccc(C=NNC(=O)c2ccc3nc(-c4ccccc4O)[nH]c3c2)c1 2323743812 ZLYMLSKAWWZHIQ-UHFFFAOYSA-N 428.492 4.734 50 10 IJGE COc1cc(NC=C(C#N)C(=O)N[C@@H](C)C23CC4CC(CC(C4)C2)C3)c(OC)cc1Cl 2324904476 QPVQJCGVYALJMA-IOAHRDFVSA-N 443.975 4.898 50 10 IJGE ClCC[C@H]1CCC[C@@H]1NCc1ccc(I)c(Br)c1 2325207170 OOBRSQLJMMCWEH-RISCZKNCSA-N 442.566 4.941 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2cc(I)ccc2Cl)C[C@H]1CCl 2380521643 IYIOLAHOXYXDEP-MWLCHTKSSA-N 438.058 4.794 50 10 IJGE CCc1ccc(OCC(=O)N/N=C/c2ccccc2C(F)(F)F)c(Br)c1 14018300 SMHHJYPCSWVGBY-AUEPDCJTSA-N 429.236 4.559 50 10 IJGE O=C(NCc1ccc(Cl)cc1)c1cn(-c2ccccc2)c2oc(CCl)cc2c1=O 39127119 RVEJSGLORPDZMU-UHFFFAOYSA-N 427.287 4.906 50 10 IJGE Cc1c(C(=O)N(C)Cc2ccccc2)oc2c1/C(=N/NC(=O)c1ccc(Cl)cc1)CCC2 40811694 IEKGGXTYLMHXHL-NHFJDJAPSA-N 449.938 4.984 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H]1Br)c1ccc(Br)cc1Br 232464220 DTCNKDCCAWKDNG-KWQFWETISA-N 439.973 4.505 50 10 IJGE Nc1ccc([C@H]2CN(Cc3ccccc3)C[C@H]2CI)c(Cl)c1 382683663 GJFYNIOGWBHEJY-PBHICJAKSA-N 426.729 4.573 50 10 IJGE CCN(CC)CCCCNC(=O)Nc1cccc(C(=O)Nc2ccc(SC#N)cc2)c1 586630117 XKBTZAILSJZVPS-UHFFFAOYSA-N 439.585 4.756 50 10 IJGE C[C@H]1[C@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1cc(Br)sc1Br 686186472 QXTWWMNNCNRVLN-MVHNUAHISA-N 427.589 4.894 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2CC[C@]3(CC[C@](C)(CI)O3)[C@H]1C2 721762709 RPBPCLVVQGMRFY-DTDBQYNISA-N 435.346 4.539 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)C(C)(C)c1ccccc1 764975355 BSVWVUBJBWTNLG-OZNYCYRCSA-N 437.547 4.853 50 10 IJGE O=C(NNc1cccc(F)c1F)C(=O)Nc1cc(Cl)ccc1Sc1ccccc1 785016978 KMZFLNDNOYOHLN-UHFFFAOYSA-N 433.867 4.851 50 10 IJGE CCN(Cc1c[nH]c2ccccc12)C(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C 785803673 YJHNLSNLYHAMSC-VZIOXZNFSA-N 430.552 4.721 50 10 IJGE O=C(NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)[C@@H]1C[C@@H]1c1cc(F)ccc1F 804206081 BWMUNKPPGMZQCG-GDBMZVCRSA-N 434.368 4.687 50 10 IJGE CC(CC(=O)Nc1cccc(C(F)(F)F)c1)=NNC(=O)c1ccccc1Br 1084121532 UENULOAJZKSHSW-UHFFFAOYSA-N 442.235 4.602 50 10 IJGE Cc1ccc([N+](=O)[O-])cc1[C@@H]1CN(C(=O)OCc2ccccc2)C[C@@H]1CBr 1614639738 TVRWHKOEACMCCP-QFBILLFUSA-N 433.302 4.650 50 10 IJGE Cc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865684485 ZDVGDUOKOKUDTD-FQEVSTJZSA-N 440.334 4.772 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3CC)cc1OC 1865697482 ULTNRXRIWSBCGI-JOCHJYFZSA-N 444.535 4.976 50 10 IJGE Cc1nn(-c2cccc(Cl)c2)c2c1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865705975 KZQRLIZZHGZFFV-SFHVURJKSA-N 442.262 4.614 50 10 IJGE Cc1ccc(C)c(-c2csc(/C(C#N)=C(\O)[C@H](C)N3C(=O)c4ccccc4C3=O)n2)c1 1872749829 JZEDQAPRYZJTIF-AYAKEVCGSA-N 429.501 4.904 50 10 IJGE Cc1c(Br)sc([C@H](Br)C2[C@H]3COC[C@H]23)c1Br 1922895747 YSULNWHTEVGMOS-ATVXKPNKSA-N 430.987 4.910 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC[C@](C)(CI)O2)[C@@H]2CCCC[C@@H]21 1984441677 MTIUHMJLFWCYBJ-LTCOOKNTSA-N 435.346 4.539 50 10 IJGE Cl[C@@H](c1cc(I)cc2c1OCC2)C1(Br)CCC1 2002788147 PYFSGLVTGQARMP-LBPRGKRZSA-N 427.507 4.824 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1Cc1cc(Br)ccc1Br 2006508117 OUOHOCDLVXDSAR-BXKDBHETSA-N 425.990 4.959 50 10 IJGE O=C(N[C@H]1CCC[C@@H](Br)C1)c1cccc(Br)c1Br 2031478815 TZEWZOUQKSEKQR-BDAKNGLRSA-N 439.973 4.648 50 10 IJGE CC(C)(C)[C@H](CBr)NC(=O)c1c(Br)cccc1Br 2033086772 PPILQEKBNPIJDL-JTQLQIEISA-N 441.989 4.751 50 10 IJGE BrC[C@H]1CC2(CC2)CN1Cc1ccc(Br)cc1Br 2037825671 RNRIMNUSARRZNG-GFCCVEGCSA-N 438.001 4.961 50 10 IJGE C[C@H](c1ccncc1Br)[C@@H](Br)c1cn(C)nc1Br 2052974898 CHKBIXLBGAAGPY-RDDDGLTNSA-N 437.961 4.580 50 10 IJGE CC1(F)CC([C@H](Br)c2cc(I)cc3c2OCC3)C1 2065847802 AEBPHEGTBBOPQL-PEUVISTOSA-N 425.079 4.800 50 10 IJGE C[C@@]1(CCBr)CCN1C(=O)c1ccc(Br)cc1Br 2084698819 AIQITGYOFYHQJZ-CYBMUJFWSA-N 439.973 4.601 50 10 IJGE CCCN1CC[C@@H]([C@H](Br)c2ccc(OCc3ccccc3)cc2)S1(=O)=O 2089516364 WQSZKZDIZAVCEQ-VQTJNVASSA-N 438.387 4.516 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)CCCCBr)CC12CCCCC2 2106203805 MWGTWJVUEJYVQQ-INIZCTEOSA-N 431.415 4.770 50 10 IJGE CN(CCCCCCNC(=O)OC(C)(C)C)C(=O)c1ccc(CBr)cc1 2106777106 PJIRAAGYDUTNID-UHFFFAOYSA-N 427.383 4.739 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1ccnn1[C@@H]1CC1(F)F 2121752962 AXXXXWHHGLIWHP-DLBZAZTESA-N 426.305 4.525 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@@H](Cl)c2cc(Br)c(Br)s2)C1 2137228871 QKXJNNFMNWUTHX-VIRWGQHYSA-N 448.629 4.768 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N[C@H]2CCCCC[C@@H]2Br)c1Br 2143909773 CRLHSXHNQPXRLS-QWRGUYRKSA-N 445.242 4.502 50 10 IJGE CCN(CC)CCN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(CCl)c1 2152215342 RLKFLDKQCJBFGY-UHFFFAOYSA-N 429.413 4.612 50 10 IJGE CCCC(CBr)(CCC)CN(CCO)C[C@@H]1CCCN1C(=O)OC(C)(C)C 2163059352 SFOBVTRNIWVZDP-SFHVURJKSA-N 449.474 4.662 50 10 IJGE C[C@@H](CC1CCN(CC2(CBr)CCOCC2)CC1)N(C)C(=O)OC(C)(C)C 2203640490 QOJSGRKDACFEIW-KRWDZBQOSA-N 447.458 4.536 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)S(=O)(=O)Cc1ccsc1Br 2210633373 ZWTKRQNSFGYLJK-OAHLLOKOSA-N 436.824 4.860 50 10 IJGE CCC[C@H](Cl)c1cn(-c2ccc(Br)cc2I)nn1 2223528097 BJTXURSXBIYVLF-VIFPVBQESA-N 440.510 4.714 50 10 IJGE ClCCc1nc2ccc(Cl)cc2n1C[C@H]1CC1(Br)Br 2224807502 STJCSKSTKPDKLB-MRVPVSSYSA-N 426.967 4.977 50 10 IJGE CC[C@@H](C)N(CCBr)C(=O)c1ccc(Cl)c(I)c1 2256389467 LKEOJCXYFXERGW-SECBINFHSA-N 444.538 4.580 50 10 IJGE CC(C)c1cc(Br)cc(C(=O)N[C@H](CI)C(C)C)c1 2265984067 SORORXRGWKYKIR-CQSZACIVSA-N 438.147 4.762 50 10 IJGE O=C(N[C@H](CBr)c1cccs1)c1cc(F)c(Br)cc1F 2282148110 WUXYJRICWSTTQV-LLVKDONJSA-N 425.092 4.655 50 10 IJGE CC[C@@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@@H]1Br 2300237887 DKCPJRLZGAKZQI-MNOVXSKESA-N 428.539 4.550 50 10 IJGE CC[C@@H](CCCl)CNCc1ccc(I)c(Br)c1 2306216130 CEAGAQVZOADEBN-JTQLQIEISA-N 430.555 4.798 50 10 IJGE CC[C@H](NC(=O)C(C#N)=CN[C@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 2318467226 CCDOGXUQFZICQM-KOSHJBKYSA-N 447.579 4.908 50 10 IJGE Cc1ccccc1NC(=O)C(C#N)=CN1CCN(C(c2ccccc2)c2ccccc2)CC1 2324261121 FHFKKEJSOGYWNM-UHFFFAOYSA-N 436.559 4.748 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)c3ccc(Cl)nc3)n2)c(OC)c1OC 2331412921 UHLGTCDERNAEBL-UHFFFAOYSA-N 429.885 4.834 50 10 IJGE COc1c(C)cc(C(=O)N[C@H](CCBr)COCc2ccccc2)cc1Cl 2343411436 FPLKYZHCDOKASW-QGZVFWFLSA-N 440.765 4.757 50 10 IJGE Nc1c(NNC(=O)c2ccc(Cl)cc2Cl)ncnc1Nc1ccc(F)c(Cl)c1 40793445 SINZVGJVEHCZTB-UHFFFAOYSA-N 441.681 4.659 50 10 IJGE CC(C)c1cc(Br)ccc1OCC(=O)N/N=C/c1c(F)cccc1Cl 40950900 YQEOMSGXKAJTGX-LSFURLLWSA-N 427.701 4.894 50 10 IJGE O=C(N/N=C1/C(=O)N(Cc2c(Cl)cccc2Cl)c2ccccc21)c1ccc(F)cc1 59154228 YJPKQBOEAYGBQZ-LHLOQNFPSA-N 442.277 4.813 50 10 IJGE CCCC(CBr)(CBr)Cc1c(Br)c(C)nn1C 118670186 JOPKWDXIMFLYRE-UHFFFAOYSA-N 431.010 4.610 50 10 IJGE CCCNC(=O)c1cc2ccc(OC(=O)/C(C#N)=C\c3ccc(C(C)C)cc3)cc2oc1=O 206543127 PWONUUMLMJCPSA-NDENLUEZSA-N 444.487 4.569 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)NCc2ccco2)ccc1OC(=O)/C=C\c1ccccc1 206681359 AGHMINXCIRTTDA-PIFYNPJRSA-N 442.471 4.520 50 10 IJGE N#C/C(=C/NC1CCCCCCCCCCC1)C(=O)Nc1cccc(S(=O)(=O)O)c1 216955247 IUYJHXBOJWYWRK-ZCXUNETKSA-N 433.574 4.542 50 10 IJGE C[C@H](CCCCBr)NCc1cc(Cl)ccc1I 405301586 NYXRNDAILBUUEQ-SNVBAGLBSA-N 430.555 4.988 50 10 IJGE COC1CCC(O[C@H](CI)c2ccccc2Br)CC1 686231781 ODHPKXLFORRJTL-KOHJWAIASA-N 439.131 4.899 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2nc3ccc(Cl)cc3s2)cc1)[C@@H]1C[C@H]1C 1218458658 LFBJHEGYILWMBD-PIGZYNQJSA-N 429.933 4.860 50 10 IJGE C=Cc1ccc(CCNC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)cc1 1312740743 WEVFLSYJXGSAGP-LJQANCHMSA-N 425.598 4.729 50 10 IJGE Cc1c(Cl)cccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1cccnc1)CCC2 1772746226 SOPBBGLHYFRYAB-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccc(Cl)cc1 1865691253 NTRVQWRNOIPNOD-QFIPXVFZSA-N 432.911 4.676 50 10 IJGE Cc1ccc(C)c(Cn2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2ccccn2)c1 1865699857 DXKZHRMOHYEKOU-QHCPKHFHSA-N 433.515 4.828 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccc(Cl)cc2)[C@H]1c1ccc[nH]1 1865709399 BJOWNWCGMHMJME-HXUWFJFHSA-N 427.895 4.798 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865710047 NEVOCJTVCOSZGC-HXUWFJFHSA-N 449.898 4.664 50 10 IJGE Cc1ccc(C(=O)CCC(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3)nc2C)c(C)c1 1865755486 AUOVTVWJOYVTFH-UHFFFAOYSA-N 449.938 4.751 50 10 IJGE CCN[C@H](c1cc(Br)c(C)cc1Br)[C@@H]1C[C@H]1Br 1910133675 VPDFRFIIYFKBSQ-OASPWFOLSA-N 425.990 4.954 50 10 IJGE O=C(c1coc(Br)c1)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915313858 PCZVKERZVDFHLQ-OAHLLOKOSA-N 427.136 4.858 50 10 IJGE C[C@@H](c1ccncc1Br)[C@H](Br)c1nn(C)cc1Br 1924058239 VJCJQSZQIIOGAG-CPCISQLKSA-N 437.961 4.580 50 10 IJGE CN(C[C@]1(C(C)(C)C)CC[C@](C)(CI)O1)C(=O)OC(C)(C)C 1929974651 KJBZKPUYMUXCCM-SJORKVTESA-N 425.351 4.642 50 10 IJGE C[C@@H]1CN(Cc2ccc(Br)cc2Br)C[C@H]1CBr 1943857498 DMFWXCKZWAHMRO-MWLCHTKSSA-N 425.990 4.674 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(Cc2ccccc2)C[C@H](CBr)CC2CC2)C1 1953971065 WHJYDRNJZUEOAT-IBGZPJMESA-N 437.422 4.919 50 10 IJGE CC(C)[C@H](Br)CCNC(=O)c1cccc(Br)c1Br 2031482435 RWZKEODRKUVOPZ-SNVBAGLBSA-N 441.989 4.751 50 10 IJGE BrC[C@]12CCC[C@@H]1CN(c1ncc(Br)cc1Br)C2 2041465950 ZVXPXOPHSVNZGI-RNCFNFMXSA-N 438.989 4.608 50 10 IJGE CCc1ccc(Cn2nc(CCl)c(I)c2C(F)(F)F)cc1 2079210111 IPYBKXTWKDQUCO-UHFFFAOYSA-N 428.623 4.856 50 10 IJGE ClCc1cc(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)ncc1Br 2092524711 SNTHLABIAOLOCR-PKOBYXMFSA-N 434.809 4.931 50 10 IJGE CCC[C@@H](CBr)CN1CCC(c2n[nH]cc2NC(=O)OC(C)(C)C)CC1 2129052811 BAOLYBBBOZUKKB-AWEZNQCLSA-N 429.403 4.747 50 10 IJGE O=C(c1ccc(Cl)cc1Br)N1CC[C@@H](Br)C(F)(F)CC1 2150019895 WBQQJMOCAIHYPD-LLVKDONJSA-N 431.502 4.737 50 10 IJGE Cc1c(Br)csc1C[C@H](Br)c1ccc(S(C)(=O)=O)cc1 2169231872 MWQBGZWWYWDDBG-LBPRGKRZSA-N 438.206 4.901 50 10 IJGE Cc1sc(Br)cc1C(=O)N1C[C@]2(F)CCC[C@]2(CBr)C1 2176631194 WJWSBZXJNAOLMQ-UONOGXRCSA-N 425.161 4.548 50 10 IJGE Cc1sc(C(=O)NC[C@@]2(CBr)C[C@@H]2C(F)(F)F)cc1Br 2234474720 MMCTYTJYRIYZLE-ONGXEEELSA-N 435.103 4.512 50 10 IJGE COc1ccc([C@H](Br)C[C@H]2COC(C)(C)C2)cc1I 2269542354 JUQXSZFHLRKEML-ZYHUDNBSSA-N 439.131 4.941 50 10 IJGE COc1ccnc(N(C)[C@@H]2C[C@@H]3C[C@@H](OCc4ccccc4)C[C@H]32)c1CBr 2281103773 SCIZSCMHJYXPHP-JRBPQWBISA-N 431.374 4.805 50 10 IJGE C=CC[C@]1(CBr)CCCCN1Cc1nn(C)c(Cl)c1Br 2287725081 JKYYZSIBJUYCNI-CQSZACIVSA-N 425.596 4.532 50 10 IJGE COC(=O)c1c(NC=C(C#N)c2nc(-c3ccc4c(c3)OCO4)cs2)sc(C)c1C 2296266023 JROLANPZIVWJHM-UHFFFAOYSA-N 439.518 4.980 50 10 IJGE ClCC[C@@H]1CCN(Cc2ccc(I)c(Br)c2)C1 2306222430 UJRLVFLFBUQPGM-SNVBAGLBSA-N 428.539 4.505 50 10 IJGE CCCCCCOc1ccc(C=C(C#N)C(=O)Nc2nnc(C3CC3)s2)cc1OC 2314793712 YDZZWOHMICHUGW-UHFFFAOYSA-N 426.542 4.929 50 10 IJGE COc1cc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)cc(Cl)c1OC 2323166623 JTBPTXBGZVVKCO-CYBMUJFWSA-N 425.916 4.727 50 10 IJGE Cl[C@@H]1CN(Cc2ccc(I)c(Br)c2)CC2(CC2)C1 2325225174 DAAOSERXUQVKEA-NSHDSACASA-N 440.550 4.647 50 10 IJGE COc1ccc([C@@H](Br)[C@]23COC[C@H]2C3(F)F)c(Br)c1Cl 2359378492 ZNQNQFURMGQYDA-FXAINCCUSA-N 432.486 4.829 50 10 IJGE COc1cc(F)c(Cl)cc1[C@H](Br)c1c(Br)nc(C)n1C 2362485008 ASUCPEBEYABABL-NSHDSACASA-N 426.511 4.776 50 10 IJGE CCCCOc1ccccc1C(=O)NNC(=O)c1ccc(NC(=O)c2ccccc2C)cc1 14032091 HSOINZVFQSFPCT-UHFFFAOYSA-N 445.519 4.501 50 10 IJGE COc1ccccc1NC(=S)NNC(=O)c1ccc(-c2cccc(C(F)(F)F)c2)o1 39892604 KIGXXVHQABEODY-UHFFFAOYSA-N 435.427 4.605 50 10 IJGE Cc1c(C(=O)N2CCCCCC2)oc2c1/C(=N/NC(=O)c1ccccc1Cl)CCC2 40812659 YKIUALLZIIXXTC-XIEYBQDHSA-N 427.932 4.728 50 10 IJGE C/C(CC(C)C)=N\NC(=O)CSc1nnc(CNc2ccccc2)n1-c1ccccc1 59915654 DPYVFARSVKZYKN-XIEYBQDHSA-N 436.585 4.510 50 10 IJGE C[C@H](Br)[C@@](Br)(CBr)C(=O)Oc1ccc(Cl)cc1 205782764 KTCDUXGRNCZTMN-CPCISQLKSA-N 449.364 4.557 50 10 IJGE O=C(NC[C@@H]1CC[C@@H](Br)C1)c1cc(Br)ccc1Br 227672419 SMNWVWINOSMCHL-RKDXNWHRSA-N 439.973 4.505 50 10 IJGE Cc1ccccc1C(=O)Oc1ccc(C=NNC(=O)COc2ccc(C(C)C)cc2)cc1 254307589 LMEREWJYKQRJLW-UHFFFAOYSA-N 430.504 4.867 50 10 IJGE Clc1cc(Br)c(-n2cnc(CBr)c2)c(Br)c1 300882737 SCHQMUMUGFQVNH-UHFFFAOYSA-N 429.337 4.946 50 10 IJGE C[C@@]1(CBr)CCCN(Cc2cc(Cl)ccc2I)C1 688793716 QQFXWXUUFGVDGQ-AWEZNQCLSA-N 442.566 4.942 50 10 IJGE O=C(NC[C@H]1CCC[C@@H]1Br)c1scc(Br)c1Br 705396990 BEJQEJVFJCBFNP-RQJHMYQMSA-N 446.002 4.567 50 10 IJGE CC[C@H](NC(=O)c1scc(Br)c1Br)[C@H](C)Br 705423749 FQBUJUVMNBVAJE-FSPLSTOPSA-N 433.991 4.565 50 10 IJGE CC(=O)N(Cc1ccc(NC(=O)NNc2ccc(OCc3ccccc3)cc2)cc1)C1CC1 1476177089 ORXQTINYJPJHAS-UHFFFAOYSA-N 444.535 4.925 50 10 IJGE C[C@@H](SCc1nc(O)c2ccccc2n1)C(=O)NNc1ccccc1Oc1ccccc1 1557374420 DYVYNOZCEASGKR-MRXNPFEDSA-N 446.532 4.893 50 10 IJGE Cc1ccc(C(=O)NN=C2CCCc3oc(C(=O)N4c5ccccc5C[C@H]4C)c(C)c32)cc1 1772744694 GORWIEYORMIFTF-QGZVFWFLSA-N 441.531 4.958 50 10 IJGE Cc1cc(C)c2c(CC(=O)NN=C3CCCc4oc(C(=O)OC(C)C)c(C)c43)coc2c1 1772751927 IGXXWCKCSVQTFO-UHFFFAOYSA-N 436.508 4.916 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(O[C@H]2COC3(CCCCC3)C2)CC1 1879028414 CKZBAZHXQMMWOH-MRXNPFEDSA-N 432.399 4.659 50 10 IJGE C[C@@H]1CCN(C(=O)c2csc(Br)c2Br)[C@H]1CBr 1945189694 XSIWVBALLQIKIK-SVRRBLITSA-N 446.002 4.519 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CC12CCC1(CCC[C@H](CI)O1)CC2 1996430048 GOYKHCZFNCGYRS-WINGESFGSA-N 449.373 4.834 50 10 IJGE CCN(C[C@](C)(CI)OCc1ccc(C)cc1)C(=O)OC(C)(C)C 2024642382 PTNUBUGYWHRYOR-IBGZPJMESA-N 447.357 4.962 50 10 IJGE CC[C@H](CCCCl)NC(=O)c1ccc(I)c(Br)c1 2036516620 VBYHZFKIWYYVTB-SNVBAGLBSA-N 444.538 4.581 50 10 IJGE Cc1cc(Br)sc1[C@@H](Br)c1ccsc1S(C)(=O)=O 2038512639 YZVCWGKXUIKZNA-VIFPVBQESA-N 430.208 4.768 50 10 IJGE COc1cc(Br)c(C(=O)N(Cc2ccccc2)C[C@@H](C)Cl)cc1OC 2068785423 WVVINOXIUQLUKA-CYBMUJFWSA-N 426.738 4.736 50 10 IJGE Cn1nc(COc2ccc(Br)c(CCl)c2)c(Br)c1Cl 2096689271 WYVHQAWPDJHUJI-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE C[C@]1(C(F)F)C[C@H]1[C@H](Br)c1cc(I)cc2c1OCC2 2120824407 KBRQBUPPZFBHAA-WDMOLILDSA-N 443.069 4.953 50 10 IJGE O=C(c1scc(Br)c1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Cl)C2 2134133499 SXZOFFRWFSMDSM-LHGNLISDSA-N 431.552 4.596 50 10 IJGE O=C(N[C@H]1C[C@H]2CC[C@H]1[C@@H](Cl)C2)c1csc(Br)c1Br 2139711438 BKFLMBXOZPBNMT-YIKMNZTOSA-N 427.589 4.799 50 10 IJGE C[C@](CI)(OC1[C@@H]2C[C@@H]2[C@H]2C[C@@H]12)c1ccccc1Br 2143311166 LGJJUUYJYDHIPJ-JXOGKFFTSA-N 433.127 4.770 50 10 IJGE CC1(C)COC[C@H](COc2c(Br)cc(Cl)cc2CBr)O1 2145715232 VGLYRCAXSMVHSN-LLVKDONJSA-N 428.548 4.570 50 10 IJGE CCCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)CC1(CBr)CCOCC1 2163061971 JHVQCMVROOJXJU-SFHVURJKSA-N 447.458 4.680 50 10 IJGE Cc1cc(Br)c(CCl)c(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@@H]32)c1 2173452556 GEIAQGCFVVYLRB-VXKWHMMOSA-N 449.820 4.976 50 10 IJGE C[C@H](Cl)c1nc2c(Br)cccc2n1C[C@@H]1COCCN1Cc1ccccc1 2194648517 IRUARCJDTADRCI-DOTOQJQBSA-N 448.792 5.000 50 10 IJGE Cc1cc(Br)c([C@H](Cl)C(C)(C)S(C)(=O)=O)c(C)c1Br 2227347547 JEQZBMNSJUXNEC-LBPRGKRZSA-N 432.605 4.932 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1C[C@@H](C)[S@](C)=O 2234060238 MEYXQLWPMRXLJQ-RDLWGGRYSA-N 442.604 4.628 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@@H]1CC2(CCCC2)CCN1C(=O)OC(C)(C)C 2237000485 DFMUNNQMUSCUJB-JCYILVPMSA-N 443.426 4.578 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ncc(Br)cc1C 2243964015 ALJAPKIIFXQBRC-OAHLLOKOSA-N 440.179 4.968 50 10 IJGE O=C(NCC1(CBr)CCCC1)c1cc(F)c(Br)cc1Cl 2282982172 IKUYHQDGKCUPFJ-UHFFFAOYSA-N 427.539 4.927 50 10 IJGE C[C@@H]1CN(CCCCCCCCCBr)CC2(CN(C(=O)OC(C)(C)C)C2)O1 2288581182 ZWJQCIZIUVCTFJ-GOSISDBHSA-N 447.458 4.822 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCc2ccccc2)ccc1OC(=O)c1ccccc1Cl 2293665638 ULEJBBNEBRKREE-UHFFFAOYSA-N 446.890 4.791 50 10 IJGE CC1=C(C#N)C(=O)N(CCc2ccccc2)C(=O)C1=CNc1ccc(Cl)c(Cl)c1 2314585863 YCFPIJLXSAGYKI-UHFFFAOYSA-N 426.303 4.741 50 10 IJGE Clc1ccc(CN2CCCC[C@H](CBr)C2)cc1I 2315551209 NZJPUMYMYHTPBB-GFCCVEGCSA-N 442.566 4.942 50 10 IJGE N#CC(=CNCc1ccccc1Br)C(=O)Nc1ccc(Cl)c(Cl)c1 2324269508 KHHABOAODDEYAT-UHFFFAOYSA-N 425.113 4.892 50 10 IJGE Clc1ccc(I)cc1CN1CCC2(CC(Br)C2)C1 2327390848 RSORBXXNYBQICZ-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@H]2CC[C@H]1C[C@@H]2Br 2362297557 GRDFCPVHMLQZEY-WEDXCCLWSA-N 425.523 4.630 50 10 IJGE C[C@H]1CN(c2c(CBr)c(C(F)F)nn2C)[C@H](C)[C@H](C)N1Cc1ccccc1 2365337343 KCWWXWALZFGBKM-SOUVJXGZSA-N 441.364 4.740 50 10 IJGE O=C(/C=C/c1ccccc1Cl)NNC(=O)CCCOc1ccc(Cl)cc1Cl 13981267 JGWWLKUGILQLNN-JXMROGBWSA-N 427.715 4.667 50 10 IJGE CC(C)c1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccccc2OCc2ccccc2)cc1 14040297 DZYHZPMLKADAJW-IBGZPJMESA-N 432.520 4.618 50 10 IJGE O=C(NNC(=O)c1ccco1)c1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1 33809167 VGVGUBVMLPUXBZ-UHFFFAOYSA-N 434.455 4.632 50 10 IJGE CCOc1cc(CBr)cc(Br)c1OCCOCC(F)(F)F 49311421 VWFNQSSXBVWKGV-UHFFFAOYSA-N 436.062 4.700 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2cc(C)n(-c3cccc(F)c3)c2C)cc1 58894353 CQJRNGOBYMLQRL-YMCFUUGVSA-N 437.515 4.596 50 10 IJGE CC(C)(C)OCCO[C@@H](CI)c1ccc(Br)cc1 162574657 RKXQXDFUWYWNLO-ZDUSSCGKSA-N 427.120 4.757 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(COc3ccc(Cl)cc3Cl)o2)ccc1O 254739969 GSRLIRVTZTYCPB-UHFFFAOYSA-N 435.263 4.644 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCOCC1CC1 383374105 ZCZRGJJJCSLWMS-UHFFFAOYSA-N 428.946 4.869 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1C(=O)c1cc(Br)cc(Br)c1 384230785 GGEGAYJCWAYGQL-PELKAZGASA-N 439.973 4.600 50 10 IJGE Cc1ccc(F)c(NC(=S)NNC(=O)[C@@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)c1 732576991 IESQSNXYRKNRBJ-LEWJYISDSA-N 449.551 4.834 50 10 IJGE O=C(NNc1cccc(F)c1F)N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1 745500183 BOJQQONRYGMZEP-LJQANCHMSA-N 425.414 4.521 50 10 IJGE CC(C)[C@@H](NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1ccc(C(F)(F)F)cc1 747938251 NJKYWPUNTCXEOJ-LJQANCHMSA-N 432.446 4.538 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)OCc2nc(C(C)(C)C)cs2)c(C)n1C[C@H]1CCCO1 756353582 UXUWWDNFDZYHSU-XLYVWGIVSA-N 427.570 4.688 50 10 IJGE CSc1cc(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)c(Cl)cc1Cl 761568415 RJSNNSNTOYAGPI-UHFFFAOYSA-N 434.352 4.941 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c(C(F)(F)F)c1 799410010 CTVLDRYEOJGTJV-UHFFFAOYSA-N 433.268 4.653 50 10 IJGE Cc1n[nH]cc1C1CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 803636801 GGVZDPYKFRZDPB-FYJGNVAPSA-N 431.515 4.578 50 10 IJGE O=C(NNc1nccc2sccc12)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1 810392644 CTYPSDXDYICWPB-UHFFFAOYSA-N 438.896 4.824 50 10 IJGE C=Cc1ccc(CCNC(=O)NNc2ccc(Br)cc2C(F)(F)F)cc1 1470260953 CBZRNTGPULCNBB-UHFFFAOYSA-N 428.252 4.980 50 10 IJGE CCOc1ccc(C=NNC(=O)COc2ccc(Br)cc2C(C)(C)C)cc1 1772754701 QHLGOODCOLHHEK-UHFFFAOYSA-N 433.346 4.674 50 10 IJGE CCCC[C@@H](NC(=O)c1cccc(-n2cccc2)c1)C(=O)Nc1ccc(SC#N)cc1 1866614832 ZZSHIPNTVUMLSF-JOCHJYFZSA-N 432.549 4.978 50 10 IJGE Cc1ccccc1COc1ccccc1/C=N/NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C 1873795654 VXPACLFFAUYMCQ-WGLQLPMYSA-N 439.556 4.573 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1C(=O)c1csc(Br)c1Br 2018124041 WCMQEPFWOCKSAM-SVRRBLITSA-N 446.002 4.661 50 10 IJGE Brc1cccc(CN2C[C@H](C3CC3)[C@@H](Br)C2)c1Br 2031479585 YFNSZBIRKUXRCJ-YPMHNXCESA-N 438.001 4.817 50 10 IJGE CC[C@@H](Br)CN(CC)C(=O)c1c(Br)cccc1Br 2044542774 CHVZHWOKMALSCK-SECBINFHSA-N 441.989 4.847 50 10 IJGE COCc1nc(-c2ccc(Br)cc2I)oc1CCl 2086149337 MRYJKMOGQNMFHY-UHFFFAOYSA-N 442.478 4.594 50 10 IJGE C[C@H](CCBr)CCN1CCOc2ccc(CNC(=O)OC(C)(C)C)cc21 2106786994 XADPQKOHKJAFEO-OAHLLOKOSA-N 427.383 4.721 50 10 IJGE O=C1COc2ccc([C@H](Cl)c3csc(Br)c3Br)cc2N1 2150342728 YUHOLMXGXVCNKB-LBPRGKRZSA-N 437.540 4.932 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc(CNC(=O)c2ccc(CBr)cc2)cc1 2162480380 JNRBLNYRLLHYMI-UHFFFAOYSA-N 433.346 4.536 50 10 IJGE Brc1ccc([C@H](CI)OC2CC(n3cccn3)C2)cc1 2183662426 JCPWYXUSTDHFDR-NRXISQOPSA-N 447.114 4.542 50 10 IJGE CCC1(CC)[C@H](Br)C[C@H]1OCCOCCOCCOCc1ccccc1 2227781652 ZRGPUVUKJWVPLW-WOJBJXKFSA-N 429.395 4.595 50 10 IJGE Cc1c(Br)csc1C(=O)NC[C@]1(CBr)C[C@@H]1C(F)(F)F 2234513999 HDLKOEXBSVOUDS-GZMMTYOYSA-N 435.103 4.512 50 10 IJGE O=C(NC[C@@H](Br)CC(F)(F)F)c1scc(Br)c1Cl 2253547568 KZEGYFAXMUUYDG-BYPYZUCNSA-N 429.483 4.610 50 10 IJGE COc1ccc([C@H](Br)C[C@H]2CC[C@H](C)O2)cc1I 2257353794 IWANRXZLKQXHHW-MVWJERBFSA-N 425.104 4.693 50 10 IJGE Cc1cc(CBr)cnc1N(C)Cc1ccc(I)cc1 2265602034 FBORHZWDMCLWIJ-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@H](CBr)C2CCC2)[C@H](C(F)(F)F)C1 2266310593 QRPKYRVZWKAWNO-KFWWJZLASA-N 443.348 4.718 50 10 IJGE COc1cccc(N(C)Cc2ccccc2I)c1CBr 2280258513 UBUBYIKSJDKOKU-UHFFFAOYSA-N 446.126 4.831 50 10 IJGE CCN(C[C@@](C)(CBr)OCc1cc(OC)cc(OC)c1)C(=O)OC(C)(C)C 2283529149 OCLZOVLWZWZRQH-HXUWFJFHSA-N 446.382 4.631 50 10 IJGE COC[C@@H]1C[C@H](Br)[C@@H](Cc2ccc(Cl)c(I)c2)C1 2315549932 XTRQMJAAJHLVDG-SRVKXCTJSA-N 443.550 4.923 50 10 IJGE ClC[C@]12C[C@H]1CC[C@@H]2NCc1ccc(I)c(Br)c1 2325209029 KVRNKEGNJZKJAN-DDTOSNHZSA-N 440.550 4.551 50 10 IJGE CC1(C)CC(CCl)(NCc2ccc(I)c(Br)c2)C1 2325220826 JZOQBEBSXHUCLF-UHFFFAOYSA-N 442.566 4.941 50 10 IJGE COc1ccc(OCCNC=C(C#N)C(=O)Nc2ccccc2Sc2ccccc2)cc1 2325339439 GAWFAZFRTDUYGY-UHFFFAOYSA-N 445.544 4.861 50 10 IJGE Cc1cc(C)cc(Oc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2[N+](=O)[O-])c1 40582782 URTNQHSTVSSRBX-UHFFFAOYSA-N 448.266 4.858 50 10 IJGE COc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3ccc(C)cc3)c(C)c21 40813206 GBYLAZGENOYQPV-ZXVVBBHZSA-N 431.492 4.628 50 10 IJGE Cc1ccnc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccc(Cl)c2)CCC3)c1 40813379 SKYOXILRJAQCFB-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE COc1cc2ccccc2cc1C(=O)N/N=C1/C(=O)N(Cc2ccccc2)c2ccccc21 59166648 RVVWDWROQIBWLE-AZPGRJICSA-N 435.483 4.529 50 10 IJGE CC(C)c1ccc(NC(=O)/C(C#N)=C\Nc2ccc(I)cc2)cc1 216986345 QYMKLAGIARVPPU-QINSGFPZSA-N 431.277 4.873 50 10 IJGE CC[C@@H](Cl)c1noc(-c2cc(Br)ccc2I)n1 233884634 BRZRYJUBWCGDFP-MRVPVSSYSA-N 427.467 4.794 50 10 IJGE Cc1ccccc1OCCCN1C(=O)C(=NNC(=O)c2ccccc2Cl)c2ccccc21 252475368 ZCFVCVFBOFEGQQ-UHFFFAOYSA-N 447.922 4.598 50 10 IJGE COc1cccc([C@H]2CN(Cc3ccccc3)C[C@H]2CI)c1Cl 382721747 NUIORNMZHPJLSV-WBVHZDCISA-N 441.740 4.999 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1C(=O)c1ccc(Br)cc1Br 399433207 SJOGBINNPLDCJK-WCBMZHEXSA-N 439.973 4.600 50 10 IJGE CC(C)C[C@@H](CBr)NC(=O)c1scc(Br)c1Br 705396970 AVRXFFQTHLTXBI-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N(C)[C@H](C)Cc2ccc(Cl)cc2)c(C)n1C[C@@H]1CCCO1 736516466 GHKDFPPEXUHRKZ-PZVOSYHJSA-N 439.987 4.934 50 10 IJGE O=C(C[C@H](NC(=O)c1ccccc1)c1ccccc1)Oc1ccc([N+](=O)[O-])c2ncccc12 770128275 YSUAHPKOXVOGAI-FQEVSTJZSA-N 441.443 4.610 50 10 IJGE CCc1noc(-c2ccc(C)c(NC(=O)NNc3ccc(C#N)cc3C(F)(F)F)c2)n1 799403450 BJHAPSREFXRXDL-UHFFFAOYSA-N 430.390 4.647 50 10 IJGE Cc1ccc(C)c(NC(=O)CCC(=O)NN=Cc2ccccc2OCc2ccccc2)c1 1084046295 JFFLSRIGKXSJSX-UHFFFAOYSA-N 429.520 4.751 50 10 IJGE Cc1ccc([N+](=O)[O-])cc1-c1ccc(C=NNC(=O)c2cccc(Br)c2)o1 1084499329 FHVRIZNSFPHXFY-UHFFFAOYSA-N 428.242 4.690 50 10 IJGE C#CC[C@H]1CCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1 1461812168 ILZPDVHGWPGIGF-HRVJUDJTSA-N 425.454 4.892 50 10 IJGE CCN(CC)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2cccc(Cl)c2)cc1 1865701691 BWVJZMVRRMTDAI-QHCPKHFHSA-N 447.970 4.958 50 10 IJGE COc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2Cl)c1 1865712432 YDOYGYVPZWHOHW-INIZCTEOSA-N 446.816 4.771 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C1C[C@@H]2CCC[C@H](C1)N2C(=O)OC(C)(C)C 1882086510 CCEUABYPDQVYPW-WTXIUTQJSA-N 447.414 4.843 50 10 IJGE CC(C)[C@@H](C)[C@@H](C)OC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1901489474 BLMDYCRCFHTXKS-HUUCEWRRSA-N 439.378 4.888 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1C[C@@]1(C)CC[C@@](C)(CI)O1 1979567070 NFDHHZWZTFGRIY-OLMNPRSZSA-N 437.362 4.929 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@@](C)(CI)O2)[C@H]1C(C)(C)C 1987727473 NJCTUSFVHJYWTR-JEBQAFNWSA-N 437.362 4.785 50 10 IJGE CC(C)(C)OC(=O)NCCCN(C(=O)CCCCl)c1cccc(Br)c1 2044694067 QWBWXNFMXMETEO-UHFFFAOYSA-N 433.774 4.716 50 10 IJGE COC[C@H](C)CCO[C@H](CI)c1ccc(Br)cc1 2067236905 CLEZVPUHIJYECS-BXUZGUMPSA-N 427.120 4.614 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@H](Cl)c2ccc(Br)cc2Br)C1 2203682407 HRKXWPFYRPOADW-FZZIBODNSA-N 442.600 4.706 50 10 IJGE COc1ccc([C@H](Br)C2(C)CCOCC2)cc1I 2257373961 PEAFJQLLMNIEBV-ZDUSSCGKSA-N 425.104 4.553 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Cl)c1cc(Br)n(C)n1 2277988789 CIBXBCBMIDGECQ-LLVKDONJSA-N 428.939 4.935 50 10 IJGE Clc1ccc(I)cc1C[C@@H]1CCOCC[C@@H]1Br 2307338570 SMKNBKUHSWFLLC-CABZTGNLSA-N 429.523 4.677 50 10 IJGE Clc1ccc(CN2C[C@H]3CC[C@H]2C[C@@H]3Br)cc1I 2315551282 PBBVSDYPIQYGNX-WOPDTQHZSA-N 440.550 4.692 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCN(CC2(CBr)CC2)[C@@H](C(F)(F)F)C1 2337585166 JLNJOAQTNHFDTI-UONOGXRCSA-N 443.348 4.719 50 10 IJGE C[C@@H]1CCC[C@@H](CO[C@H](CI)c2ccc(Br)cc2)O1 2338705041 JSHATHXYXXUHIB-BYCMXARLSA-N 439.131 4.899 50 10 IJGE COc1ccc([C@H](CBr)OCc2cccc(I)c2)cc1 2367344118 MQLOVRBJIRQFAE-INIZCTEOSA-N 447.110 4.953 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@](C)(CBr)C(C)(C)C)[C@]2(CCCOC2)C1 2380168325 MBRVCBGCXZECLQ-ZLGUVYLKSA-N 447.458 4.582 50 10 IJGE CCCCCCOc1ccc(Br)cc1C(=O)NNC(=O)c1cccc(C)c1 14648249 MSMLCUADOHTMSZ-UHFFFAOYSA-N 433.346 4.791 50 10 IJGE C/C(N)=C(/C#N)c1csc(NC(=O)c2cc(-c3ccccc3)nc3c2cnn3C(C)C)n1 24528731 RECSZLBHXZLMJQ-SAPNQHFASA-N 443.536 4.601 50 10 IJGE COc1ccc(/C(C#N)=C\c2ccc(OC(=O)c3ccc([N+](=O)[O-])cc3)cc2)cc1OC 31901130 FAFBGXAFFIRUID-UYRXBGFRSA-N 430.416 4.895 50 10 IJGE Cc1ccc(OCCCC(=O)Oc2ccc(C=C(C#N)C#N)cc2)c(Br)c1 40992713 CVHHUYBWYWWAFD-UHFFFAOYSA-N 425.282 4.953 50 10 IJGE COc1ccc(/C=N/NC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)c(Br)c1OC 169889658 IXSAZAOBQXWQJE-HHQKKNRLSA-N 449.389 4.913 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CCCC[C@@H]1CBr 232460012 MYTCUMZCLNGQBH-GFCCVEGCSA-N 439.973 4.601 50 10 IJGE CCOc1cc(C=NNC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)ccc1O 256017246 XTUUOBZXNZUWGI-UHFFFAOYSA-N 432.520 4.646 50 10 IJGE O=C(NC[C@@H](Br)C1CCC1)c1cc(Br)ccc1Br 315926730 WQHHFMOPBCHBJX-GFCCVEGCSA-N 439.973 4.505 50 10 IJGE CN(C[C@@H]1CCC[C@H]1Br)c1ncc(Br)cc1Br 689282540 UZSWPJLQFAHQTE-WCBMZHEXSA-N 426.978 4.606 50 10 IJGE Cc1csc(COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)n1 748800477 CQQFBHFIGMJIHI-SXGWCWSVSA-N 437.912 4.532 50 10 IJGE CCN(Cc1c[nH]c2ccccc12)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 785792027 GOQHUYXHZRCSOC-RCCKNPSSSA-N 448.530 4.901 50 10 IJGE CC(C)[C@H](NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1)C(F)(F)F 787702834 GGFCHZPYVDRSLI-XZGNNNQISA-N 449.864 4.727 50 10 IJGE O=C(COc1ccc2ccccc2c1)NN=Cc1ccc(OC(=O)c2cccc(F)c2)cc1 1565517530 KDKOOLGMQQWWGP-UHFFFAOYSA-N 442.446 4.727 50 10 IJGE C=CC[C@H](C(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(C)c1C)c1ccccc1 1628001297 WLSMZARSCMWFCI-NRFANRHFSA-N 438.531 4.806 50 10 IJGE CC[C@@H](Oc1cccnc1NC(=O)Oc1ccc([N+](=O)[O-])cc1)C(=O)OC1CCCCC1 1858689752 XXPFOTZPVGMKRR-GOSISDBHSA-N 443.456 4.634 50 10 IJGE CCCc1nn(Cc2ccccc2)c2c1[C@@H](c1cccc(OC)c1OCC)C(C#N)=C(N)O2 1865693898 RQLRHDZDZKCTQX-QFIPXVFZSA-N 444.535 4.509 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)C(=O)c1cc(F)c(Br)cc1O 1901229646 DVAAQNBMQJRMDZ-NSHDSACASA-N 445.126 4.720 50 10 IJGE Cc1c(Br)sc([C@H](Br)[C@@H]2OCCO[C@H]2C)c1Br 1922921422 QPBZUYFAPBEDSW-NBEYISGCSA-N 449.002 4.821 50 10 IJGE CN(CCN(Cc1ccccc1)S(=O)(=O)c1csc(CCl)c1)Cc1ccccc1 1931969311 PYASRYMJVJAFIH-UHFFFAOYSA-N 449.041 4.810 50 10 IJGE O=C(NC1(CCCBr)CC1)c1cc(Br)c(Br)s1 1942461599 MWPPRBPINWFFEA-UHFFFAOYSA-N 446.002 4.711 50 10 IJGE O=S(=O)(c1cc(CCl)oc1Br)N(Cc1ccccc1)CC1CCC1 1946858022 JHACJELXDHQBOK-UHFFFAOYSA-N 432.767 4.772 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H]1Br)c1c(Br)cccc1Br 2033094261 NPFIZTUVWUXGSO-IUCAKERBSA-N 439.973 4.505 50 10 IJGE C[C@@H](N(Cc1ccccc1)S(=O)(=O)c1ccc(CBr)cn1)C(C)(C)C 2059276490 COIUKBMELLCCPQ-OAHLLOKOSA-N 425.392 4.602 50 10 IJGE COc1cccc(OC(C)=O)c1[C@H](C)n1nc(-c2ccccc2)cc1CBr 2070047941 ACAZKYZRUMZEIO-AWEZNQCLSA-N 429.314 4.988 50 10 IJGE CCN(C(=O)[C@H](Br)C1CCCC1)C1CCC(NC(=O)OC(C)(C)C)CC1 2110716597 ZGRHQQFWNLFAEE-OFLPRAFFSA-N 431.415 4.625 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@@H]1CCCCN1C[C@@H](CBr)CC1CC1 2128727779 ZDMFFFOIEASYIU-CVEARBPZSA-N 439.385 4.812 50 10 IJGE ClCc1ccc(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)cc1Br 2129055641 RSNYEAPEDALTIK-RTWAWAEBSA-N 435.793 4.668 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@@H](Cl)c2cc(Br)sc2Br)C1 2137227279 LSWFRBGWIZVEQK-JWYUURKGSA-N 448.629 4.768 50 10 IJGE O=S1(=O)C[C@H]2C([C@@H](Cl)c3c(Br)cc(Cl)c(Cl)c3Cl)[C@@H]2C1 2232511384 JSQHBMGVQHJOFY-RDSNPXOSSA-N 438.985 4.980 50 10 IJGE CC[C@H]1[C@H](Br)CCN1C(=O)c1ccc(Br)cc1Br 2260376565 AMLHQKQNQCYLPW-PWSUYJOCSA-N 439.973 4.600 50 10 IJGE C[C@H]1[C@H](CBr)CCN1Cc1ccc(Cl)c(I)c1 2300240295 KIFFXXABILPAQL-ONGXEEELSA-N 428.539 4.550 50 10 IJGE C[C@H]1OCC[C@]1(CBr)Cc1ccc(Cl)c(I)c1 2300242376 JVBHTJSWJRSGKM-NOZJJQNGSA-N 429.523 4.677 50 10 IJGE Fc1cc(CBr)ccc1OCc1sccc1I 2301072186 VZXMWKYCNZGMAJ-UHFFFAOYSA-N 427.076 4.966 50 10 IJGE ClC[C@]1(Cc2ccc(I)c(Br)c2)CCCOC1 2306222281 SBSSMCDGIGIOFP-CYBMUJFWSA-N 429.523 4.632 50 10 IJGE CC[C@@H](CCCCl)NCc1ccc(I)c(Br)c1 2306222574 WBXWIJZCMLFZNZ-NSHDSACASA-N 430.555 4.941 50 10 IJGE CC(C)c1ncccc1COC1(CBr)CCN(C(=O)OC(C)(C)C)CC1 2342161269 WUCKRMXAKFGJCG-UHFFFAOYSA-N 427.383 4.886 50 10 IJGE CC/C(=N\NC(=O)COc1ccc(Br)cc1Br)c1ccccc1 12584019 OPZYJLNOCPRIJX-HMMYKYKNSA-N 440.135 4.521 50 10 IJGE CCN(CC)c1ccc(/C=N\NC(=O)c2cc(-c3ccc4c5c(cccc35)CC4)n[nH]2)cc1 33147651 CMQRGUKBYVRUBT-QRQIAZFYSA-N 437.547 4.939 50 10 IJGE Cc1sc2nc(C3CC3)nc(N3CCN(C(=O)[C@@H](Cl)c4ccccc4)CC3)c2c1C 35866671 AQDRSWVXQSQKPV-IBGZPJMESA-N 441.000 4.814 50 10 IJGE Cc1cc(C)cc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)Cc2ccccc2)CCC3)c1 40815686 HNMNACMIRQQXGT-SZXQPVLSSA-N 430.504 4.823 50 10 IJGE COc1cc(/C=N/NC(=O)CSc2nc(-c3ccccc3)cs2)ccc1OC(C)C 40924460 WMWHNIHNNPADIV-FSJBWODESA-N 441.578 4.848 50 10 IJGE CCc1ccc(OCCCC(=O)N/N=C/c2c[nH]c3ccccc23)c(Br)c1 40959467 MJWGXRFLWOAXTM-ZVHZXABRSA-N 428.330 4.802 50 10 IJGE CC1CCC(NC(=O)[C@H](c2ccc(F)cc2)N(Cc2ccc(F)cc2)C(=O)CCl)CC1 97914710 BMWFKAHLEADFSU-WWRGRJRASA-N 448.941 4.968 50 10 IJGE CCCC[C@H](CC)CC(CBr)(CBr)[C@@H]1CCS(=O)(=O)C1 118875325 VRHAHKUEDKMAGX-UONOGXRCSA-N 432.262 4.804 50 10 IJGE CCOc1ccc(/C=C2\C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)cc1OCC 214382116 KGXSXTDLGMMZPW-BKUYFWCQSA-N 430.504 4.585 50 10 IJGE COc1ccc(OC)c(NC(=O)/C(C#N)=C\N(Cc2ccccc2)Cc2ccccc2)c1 217216983 SDLZKZRHESTNFE-QOCHGBHMSA-N 427.504 4.752 50 10 IJGE Cl[C@@H](c1ccoc1Br)c1cc(I)cc2c1OCC2 381115573 WGAONBOBZPZESH-NSHDSACASA-N 439.474 4.910 50 10 IJGE Fc1ccc(I)cc1[C@H]1CN(Cc2ccccc2)C[C@@H]1CCl 382733972 VZMGPBSLTNNRCJ-YOEHRIQHSA-N 429.704 4.885 50 10 IJGE CC[C@@H](OC1(CI)CCN(C(=O)OC(C)(C)C)CC1)C1CCC1 719656438 HDWJBZWVBDCICQ-OAHLLOKOSA-N 437.362 4.786 50 10 IJGE C[C@@H]1CC[C@H](NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)[C@H](C)C1 733113883 HIFUKWCPAUMOOU-AWFYRQRBSA-N 435.959 4.965 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc3c(s2)-c2ccccc2CC3)c1C 736697398 XCOSVEDFPKOGIM-UHFFFAOYSA-N 427.533 4.739 50 10 IJGE COc1ccc(C(=O)NN=Cc2cc(Br)ccc2OCc2ccccc2)cc1 1083930914 LWGCYKZSGFOECO-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE Cc1cccc(C)c1NC(=O)C(=O)NN=Cc1cccc(OCc2ccc(Cl)cc2)c1 1083994927 VNGUJBABXQVLMN-UHFFFAOYSA-N 435.911 4.625 50 10 IJGE O=C(NN=C1C(=O)N(Cc2c(Cl)cccc2Cl)c2ccccc21)C1CCCCC1 1084284989 UZCHIGOHICRCAJ-UHFFFAOYSA-N 430.335 4.941 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNc2nc3c(C)cccc3s2)s1 1587911759 MWYVVJZMZXUBHG-UHFFFAOYSA-N 425.004 4.900 50 10 IJGE CCCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@@H]2c1cn(C)c2ccccc12 1865699300 PYEVNHGJQSSEJE-JOCHJYFZSA-N 439.519 4.679 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccccc2Cl)[C@H]1c1cccc(F)c1 1865711262 UKGPQPHWNMDIII-HNNXBMFYSA-N 434.780 4.902 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1 1882089193 XUOBEDDVDLTEKH-HNNXBMFYSA-N 447.414 4.702 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)CCc1ccc(NC(=O)OC(C)(C)C)cc1 1887833075 NORISVHXKIXGNX-WKILWMFISA-N 425.367 4.598 50 10 IJGE CN(N[C@H]1CCN(C(=O)OC(C)(C)C)C2(CCCCC2)C1)C(=O)OCc1ccccc1 1891720732 JEWXZTGRTNMCNO-FQEVSTJZSA-N 431.577 4.862 50 10 IJGE CC(C)(C)OC(=O)NC1(C2CCN(C[C@@H](CBr)C3CCC3)CC2)CCC1 1966520744 WUHBJHURXOCSPD-QGZVFWFLSA-N 429.443 4.957 50 10 IJGE C[C@@H]1C[C@@H]1N(CCBr)Cc1cc(Cl)ccc1I 2002044341 ZXFVOQWYJZZNOO-RNCFNFMXSA-N 428.539 4.550 50 10 IJGE BrC[C@H]1CN(Cc2c(Br)cccc2Br)CC12CC2 2033086416 LUZCHSZNQZDECI-JTQLQIEISA-N 438.001 4.819 50 10 IJGE BrC[C@@]12CCC[C@H]1CN(c1ncc(Br)cc1Br)C2 2041465951 ZVXPXOPHSVNZGI-TVQRCGJNSA-N 438.989 4.608 50 10 IJGE CC[C@@H](CCCCl)NC(=O)c1ccc(Br)cc1I 2086145019 HWYZCHIHPUTRAA-JTQLQIEISA-N 444.538 4.581 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@H](CBr)C(C)(C)C)C[C@@H]1C(F)(F)F 2106786463 VAGFLZDHLMWPPF-RDBSUJKOSA-N 445.364 4.679 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](C(C)(C)C)CN(C[C@H](Br)C(F)(F)F)C1 2108377575 SPLYYQYWCMPPSH-MJBXVCDLSA-N 445.364 4.821 50 10 IJGE Brc1ccc([C@@H](CI)OC[C@H]2C3C[C@@H]4C2[C@@H]4C3)cc1 2134517750 KAVAGYWYUXTZBU-IRQMMQKESA-N 433.127 4.844 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2[C@@H]1CCN(Cc2ccccc2)C1 2137609357 YDHXKQHMXFNMSE-OAHLLOKOSA-N 434.765 4.993 50 10 IJGE Fc1cccc(N2CCOCC23CCN(Cc2ccccc2)CC3)c1CBr 2163148682 ZZJBIDJAYLCXRU-UHFFFAOYSA-N 433.365 4.592 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@H](CBr)CC2CC2)C[C@H]1c1ccccc1 2169173701 LNYCDXGVVVEQEZ-YZGWKJHDSA-N 437.422 4.790 50 10 IJGE CCC[C@@H](CC)N(C)S(=O)(=O)c1ccc(CBr)c(Br)c1 2193556799 AQURXNHVSVFQRC-GFCCVEGCSA-N 427.202 4.543 50 10 IJGE F[C@@H]1C[C@@H](Br)CN(Cc2cccc(Br)c2Br)C1 2213900117 KBZABLSBPGAPDF-NXEZZACHSA-N 429.953 4.519 50 10 IJGE CC[C@@H](Br)[C@@H]1CCCCN1Cc1sccc1I 2301072127 VJXFBYOQNNKJDA-PWSUYJOCSA-N 428.177 4.881 50 10 IJGE C[C@@]1(CBr)CCCN1Cc1ccc(Cl)cc1I 2302316927 BCUYUMGYSIVHTE-ZDUSSCGKSA-N 428.539 4.694 50 10 IJGE CC(C)[C@@H](CBr)N(C)Cc1cc(Cl)ccc1I 2302494955 NIVNFGUDFSMGAH-CYBMUJFWSA-N 430.555 4.796 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@H]1Cc1cc(I)ccc1Cl 2307339149 BNZVADWBUOPDAC-GIPNMCIBSA-N 429.523 4.676 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccccc2OC)sc2c1CC[C@@H](CC)C2 2314572172 VGABVXACWBFVRZ-OAHLLOKOSA-N 438.549 4.994 50 10 IJGE COc1ccccc1C(C#N)=Cc1cccc(OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1 2320510953 GPPLTFAUCWPVBM-UHFFFAOYSA-N 445.387 4.795 50 10 IJGE Cc1ccccc1NC=C(C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 2324598934 JNCULSUAIPTSSS-UHFFFAOYSA-N 436.559 4.748 50 10 IJGE Clc1ccc(CN2C[C@H]3CC[C@H]2[C@@H](Br)C3)cc1I 2325462053 AZODBUPWUVIWGS-CHIMOYNISA-N 440.550 4.692 50 10 IJGE O=C(N/N=C/c1ccc(OCc2ccccc2Cl)cc1)C(=O)Nc1cccc(Cl)c1 13923346 UNOTVTACFGYUSA-DHRITJCHSA-N 442.302 4.661 50 10 IJGE Cc1ccccc1COc1ccc(/C=N/NC(=O)CSc2nc3ccccc3[nH]2)cc1 32520603 XBEGPLMKVPVBKP-AFUMVMLFSA-N 430.533 4.693 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(-c3ccc(Br)cc3)o2)C1=O 33155144 GXCLSZRWZVVPOF-GZTJUZNOSA-N 425.282 4.711 50 10 IJGE CC1=C(C#N)C(=O)N(CCCOC(C)C)C(=O)/C1=C/c1ccc(OCc2ccccc2)cc1 101336290 MMVIDMIBDNFVKY-LFVJCYFKSA-N 444.531 4.673 50 10 IJGE COc1cc(/C=N\NC(=O)Nc2ccccc2C)cc([N+](=O)[O-])c1OCc1ccccc1 169942044 AFCFYLYZPFXYOM-OYKKKHCWSA-N 434.452 4.646 50 10 IJGE CC(=NNC(=O)c1ccccn1)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1 254481786 MGKXCLQXBQOKCY-UHFFFAOYSA-N 427.291 4.795 50 10 IJGE Cc1ccc(C(=O)Oc2ccc3ccccc3c2C=NNC(=O)c2ccc(O)cc2O)cc1 254750259 JXSBNQKQUARNAV-UHFFFAOYSA-N 440.455 4.543 50 10 IJGE CC(C)(C)[C@@H](CBr)NC(=O)c1cc(Br)cc(Br)c1 393965852 ZSQNYJPBHCFBJQ-LLVKDONJSA-N 441.989 4.751 50 10 IJGE FC(F)(F)c1ccc(I)c(Br)c1CBr 575696852 XYTMYVYHVSBOSM-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE CCN(C[C@@](C)(CI)OC1CCCCC1)C(=O)OC(C)(C)C 685993139 BZKFOFCIGPDXGW-QGZVFWFLSA-N 425.351 4.786 50 10 IJGE CC[C@@H](Cl)CCCNC(=O)c1ccc(I)c(Br)c1 721615078 QVDPMGKQXOTCPC-SNVBAGLBSA-N 444.538 4.581 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2ccc3c(c2F)CCNC3=O)c(C)n1C1CCCCC1 791356289 ISBJSVVMNFHJGU-AQTBWJFISA-N 434.515 4.581 50 10 IJGE Cc1ccc(C)c(-n2c(C)c(Br)c(C=NNC(=O)c3cccnc3)c2C)c1 1083967995 WZQYBRTYOJKSBU-UHFFFAOYSA-N 425.330 4.632 50 10 IJGE CC(C)c1ccc(NNC(=O)CSCc2nc(O)c3c4c(sc3n2)CCCC4)cc1 1468054940 CEMSCJSTXXPRMT-UHFFFAOYSA-N 442.610 4.776 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(OCc3ccccc3)cs2)c1C 1472514250 AUYLUZNHLMVAPA-UHFFFAOYSA-N 431.521 4.553 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@@H]1c1cccc(F)c1 1865710951 MEYXPKWIQWXJNR-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE CCOC(=O)c1cnn(-c2ccc(C)cc2)c1NC(=O)/C(C#N)=C/c1ccc(Cl)cc1 1866128360 MPXSGISNBOABFV-SFQUDFHCSA-N 434.883 4.557 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2cccc(Br)c2)sc(C)c1C 1866131764 MIJAZBPOHJZDJR-RIYZIHGNSA-N 433.327 4.850 50 10 IJGE CCC[C@H](NC(=O)[C@@H](c1ccc(OC)cc1)C(C)C)C(=O)Nc1ccc(SC#N)cc1 1866981849 YZKHKPSNNKPEGN-FCHUYYIVSA-N 439.581 4.932 50 10 IJGE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1cccc(Oc2ccccc2)c1 1873794306 CNTMJZAOOBXROJ-CNQUNWPHSA-N 425.529 4.868 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C(=O)NC[C@H]2C[C@@H]2Br)cc1C(F)(F)F 1887785010 XUDQMKGSKSUMMQ-PWSUYJOCSA-N 437.256 4.566 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1ccccc1C(F)(F)F 1916349257 TWEGETYADDGTBI-OAHLLOKOSA-N 430.264 4.758 50 10 IJGE CCC(CC)(CBr)CN=[S@@](C)(=O)CCCCNC(=O)OC(C)(C)C 2001769950 SZRNYQODZINZOO-DEOSSOPVSA-N 427.449 4.590 50 10 IJGE O=C(NC1(CCCBr)CC1)c1cc(Br)ccc1Br 2029622108 QQRKKFUDNUTIJV-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE Cc1cc([C@H](Br)c2ccsc2S(C)(=O)=O)sc1Br 2033133948 AJOFCXZJESEUJQ-SECBINFHSA-N 430.208 4.768 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)C1(CNC(=O)OC(C)(C)C)CCCC1 2106789535 ZCYVUPYZFUIBET-GOSISDBHSA-N 425.411 4.934 50 10 IJGE C[C@H]1C[C@@H](C)[C@H](CNC(=O)OC(C)(C)C)CN1Cc1ccc(CBr)cc1 2126464445 AWBYEQPUWLYJBV-JTDSTZFVSA-N 425.411 4.953 50 10 IJGE Brc1ccccc1[C@@H](CI)OCCOCCC1CC1 2127763895 MUHDBGYAVRMWCS-OAHLLOKOSA-N 439.131 4.759 50 10 IJGE C[C@@H]1[C@@H](C)N(Cc2ccccc2)[C@H](C)CN1c1cc([N+](=O)[O-])ccc1CBr 2176905494 XPTQDWDJIQBONV-BRWVUGGUSA-N 432.362 4.977 50 10 IJGE COCC(COC)CC(CBr)(CBr)c1cccc(Cl)c1 2199390927 YWMNEAINBVROHR-UHFFFAOYSA-N 428.592 4.667 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCCCC12CN(C(=O)OC(C)(C)C)C2 2209328651 UFCODQNACMGEIA-GJZGRUSLSA-N 447.414 4.702 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]12CC[S@@](=O)(=NCCCCCCBr)C2 2223291836 WIXPJRXSSXDCAJ-BVZFJXPGSA-N 437.444 4.583 50 10 IJGE Cc1cc(I)ccc1-n1c(Cl)nc(Cl)c1CBr 2248216409 SHQDDBAWCJIXSL-UHFFFAOYSA-N 445.913 4.987 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CCCOC2(C)C)cc1I 2269551549 ABLLCMYCZVMHMD-RISCZKNCSA-N 439.131 4.941 50 10 IJGE CC1(C)[C@H](Br)CC[C@H]1NC(=O)c1cc(F)c(Br)cc1Cl 2282971891 ITDQYJFLQBBMBC-VXGBXAGGSA-N 427.539 4.924 50 10 IJGE O=C(N[C@H](CBr)C1CCCC1)c1cc(Br)c(F)cc1Cl 2285844420 MLGNLLYYCNXUNC-CYBMUJFWSA-N 427.539 4.925 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccccc2F)ccc1OC(=O)c1ccc(C)cc1 2295459780 XRRBTUJCNKVROO-UHFFFAOYSA-N 430.435 4.908 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2cn(Cc3ccccc3)nc2-c2cccnc2)cc1 2297382020 NSFOULHTDYWSHT-UHFFFAOYSA-N 449.514 4.938 50 10 IJGE COC(=O)c1ccc(COc2ccccc2C=C(C#N)C(=O)N[C@H](C)c2ccccc2)cc1 2297388050 UNUPSWMEELXTGR-LJQANCHMSA-N 440.499 4.837 50 10 IJGE CC[C@H](C)[C@@H](CBr)NCc1cc(I)ccc1Cl 2307330058 JJTFRSHPEZBXJQ-TVQRCGJNSA-N 430.555 4.844 50 10 IJGE Clc1nc(Cl)n(CCC23CC(I)(C2)C3)c1CBr 2307635565 ATSZPSGTHOXVJI-UHFFFAOYSA-N 449.945 4.833 50 10 IJGE CCOc1cc(C=NNC(=O)c2nc(-c3ccccc3)sc2C)cc(Cl)c1OC 2318417948 LAKOKOUMHICLAK-UHFFFAOYSA-N 429.929 4.943 50 10 IJGE C[C@@]1(CBr)CCCN(Cc2ccc(Cl)cc2I)C1 2318540250 PJWHUPLWICVAGB-AWEZNQCLSA-N 442.566 4.942 50 10 IJGE CCOC(=O)c1ccccc1NC=C(C#N)C(=O)N[C@H](CC)c1ccc2c(c1)CCCC2 2325079491 GLISEPXPHOWBKK-HSZRJFAPSA-N 431.536 4.829 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc(Br)cc2)sc2c1CCC2 2329663830 ZCKAUEWRDJXRGX-UHFFFAOYSA-N 445.338 4.722 50 10 IJGE Cn1nc(C(F)F)c(CBr)c1N(Cc1ccccc1)CC1CCOCC1 2339727637 RPJIWUFECBOHPP-UHFFFAOYSA-N 428.321 4.686 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@](C)(CBr)C(C)(C)C)C[C@H]1C(F)(F)F 2352071515 HSNINTRTXGWNRS-GUYCJALGSA-N 445.364 4.917 50 10 IJGE COc1ccc(-c2n[nH]cc2/C=C(\C#N)C(=O)Nc2cccc(C(F)(F)F)c2)cc1OC 20259232 YPXOTAXLHCMHOG-RIYZIHGNSA-N 442.397 4.658 50 10 IJGE COc1cc(/C=C(/C#N)c2ccccc2)ccc1OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 31901903 ZYFBYUGFWMKSGA-NVMNQCDNSA-N 445.387 4.795 50 10 IJGE CN(C)c1ccc(N2C(=O)CS[C@@H]2c2cccc(NC(=O)C(C)(C)CCl)c2)cc1 35928496 PTAMUMAAUMXEFH-HXUWFJFHSA-N 431.989 4.735 50 10 IJGE O=C(c1ccc(Br)c(C(F)(F)F)c1)N1CCC[C@H](CBr)C1 124688026 HCKDWOKBIPFYPG-SECBINFHSA-N 429.074 4.715 50 10 IJGE CCSC[C@H](C)n1c(CCCl)nc2cc(I)c(F)cc21 135429254 FPGQHKRYVQXFCM-VIFPVBQESA-N 426.726 4.875 50 10 IJGE CCCCOCCO[C@@](C)(CI)c1ccccc1Br 162118711 NUPQZQSFCLCPSN-HNNXBMFYSA-N 441.147 4.933 50 10 IJGE COc1cc(-n2c(CCl)nc3cc(Br)cnc32)ccc1Br 169244038 RKRXXLBYUGMPGC-UHFFFAOYSA-N 431.515 4.693 50 10 IJGE CCCCCCOc1ccccc1C(=O)/C=N\NC(=O)CSc1nc2ccccc2[nH]1 169886252 QHFUOFPLUQPBAY-IWIPYMOSSA-N 438.553 4.599 50 10 IJGE CCOc1ccc(-c2cc(C(=O)NN=Cc3ccccc3[N+](=O)[O-])c3ccccc3n2)cc1 252623918 PCFYHAWSVURNHE-UHFFFAOYSA-N 440.459 4.973 50 10 IJGE O=C(NC[C@@H](Br)C1CCC1)c1ccc(Br)cc1Br 315915881 VHGZUZFRPDTOBV-GFCCVEGCSA-N 439.973 4.505 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCCOCC1CC1 690411879 WXTUPBWZKMKNRI-UHFFFAOYSA-N 442.973 4.912 50 10 IJGE COc1cc(Cl)c([C@H](Br)c2c(Br)cnn2C)cc1Cl 693070495 KRFCJRLCRQCCNX-NSHDSACASA-N 428.939 4.982 50 10 IJGE C[C@@H](CC(CBr)(CBr)C1CCCCCC1)CS(C)(=O)=O 706456871 YGDXTYMKBRCWKQ-ZDUSSCGKSA-N 432.262 4.804 50 10 IJGE Cc1ccc([C@@H](Cl)c2cnn(C)c2I)c(C)c1Br 719617398 QEXIBCAQIBEQNW-GFCCVEGCSA-N 439.522 4.732 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)c(C(F)(F)F)c1 800564078 YJJIRFPBMYFRPB-UHFFFAOYSA-N 443.351 4.604 50 10 IJGE CN(Cc1ccccc1)Cc1cccc(C(=O)NNc2nc3ccccc3[nH]c2=S)c1 1301148533 QXAXFVLWENJYGL-UHFFFAOYSA-N 429.549 4.681 50 10 IJGE C=CCCC[C@@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2)c1C)C(=O)OC 1558384502 ZTAUSRFNYRIUSJ-DUBROFONSA-N 439.943 4.669 50 10 IJGE CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)NNc2nc3ccccc3[nH]c2=S)c1 1640943246 KDVALXSHNIBQAF-UHFFFAOYSA-N 429.933 4.687 50 10 IJGE Cc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2cc(Br)ccc2F)cc1 1865702536 WQOCZSRXPRTHBH-LJQANCHMSA-N 439.288 4.609 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@@H]1c1ccc(F)cc1 1865708615 ZGVUQUWQOSSLKP-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)n2)cc1F 1872752602 KROODCTUJGEUFS-USMQXWLVSA-N 449.507 4.799 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]1CC1(CCC[C@H](CI)O1)C2 1922294339 XONKGJSLBAGDSM-SOUVJXGZSA-N 435.346 4.681 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1Cc1ccc(Br)cc1Br 1943855100 ZUFQYOXOFLPYOA-BXKDBHETSA-N 425.990 4.959 50 10 IJGE Cn1nc(CC(CBr)(CBr)C2CC2)c(Br)c1Cl 1947503147 APWOMZJLAOJNGT-UHFFFAOYSA-N 449.412 4.565 50 10 IJGE COc1ccc([C@H](CI)OCCCOCc2ccccc2)cc1 1983389674 IKNDHFUQGOVNER-IBGZPJMESA-N 426.294 4.795 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)C1(C(F)(F)F)CCOCC1 2116579758 KPAWAOOLTWAOSF-MRXNPFEDSA-N 436.312 4.794 50 10 IJGE Clc1cccc(CBr)c1N1CC[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2129050436 DGVJHUSIRJJOJQ-UXHICEINSA-N 435.793 4.715 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(NC(=O)c3ccc(CBr)cc3)CCC[C@H]12 2162588706 IYSMJZXKHJLYMQ-UWJYYQICSA-N 437.378 4.634 50 10 IJGE Cn1nc([C@@H](Br)c2ccc([C@@H]3CCOC3)s2)c(Br)c1Cl 2240422640 XAHOGNIXSJDURH-XCBNKYQSSA-N 440.588 4.886 50 10 IJGE O=C(NCC1(CCl)CC(F)(F)C1)c1ccc(Br)cc1Br 2281665593 QWNYFZAGYLAWHQ-UHFFFAOYSA-N 431.502 4.596 50 10 IJGE CN(CCCCCBr)Cc1ccc(Cl)c(I)c1 2300238159 HLWYEHOYPDWPMU-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE Brc1cnc(N2CC[C@H]3C[C@H](Br)CC[C@H]32)c(Br)c1 2308116777 OQEINYHFWQOWIS-YGOYTEALSA-N 438.989 4.749 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)[C@@H]2[C@H]3COCC[C@H]32)c1 2313495709 OVIPCZRMKQZRID-RQJABVFESA-N 438.985 4.800 50 10 IJGE O=C(N[C@H](CCCl)COCc1ccccc1)c1cc(F)c(Br)cc1F 2320602024 HDKZQZUKNCPICU-CYBMUJFWSA-N 432.692 4.671 50 10 IJGE COc1cc(C=NNC(=O)Nc2ccccc2C)cc([N+](=O)[O-])c1OCc1ccc(C)cc1 2323840078 HXZKKOWDBLQXPX-UHFFFAOYSA-N 448.479 4.955 50 10 IJGE CN(CC[C@@H]1CCCCN1C[C@]1(CBr)CC1(F)F)C(=O)OC(C)(C)C 2326919540 OHORWPHVPMRCIV-WMLDXEAASA-N 425.358 4.518 50 10 IJGE COc1ccccc1CN(C(=O)CCl)[C@H](C(=O)NC1CCCCC1)c1ccccc1F 3033927 CKDUXZYZMOJNHW-QHCPKHFHSA-N 446.950 4.592 50 10 IJGE CCCCC(=O)Nc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2[C@@H](C)CC)cc1 9873982 NWCMILZYRUSGCF-ROUUACIJSA-N 439.556 4.557 50 10 IJGE COc1cccc(-c2csc(/C(C#N)=C/c3cc(OC)c(OC(C)=O)c(OC)c3)n2)c1 33772084 ZYFFOEYVYOKKIY-CAOOACKPSA-N 436.489 4.825 50 10 IJGE N#C/C(=C/c1cc2c(cc1Br)OCO2)C(=O)Nc1cccc(C(F)(F)F)c1 33826186 OSFFUFNKKURLIA-WCIBSUBMSA-N 439.187 4.742 50 10 IJGE C=CCN1C(=O)C(C#N)=C(C)/C(=C\c2cn(-c3ccccc3)nc2-c2ccc(C)cc2)C1=O 38607594 XIUCXMNGCFGQTP-HZHRSRAPSA-N 434.499 4.626 50 10 IJGE CCOC(=O)COc1c(Cl)cc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)cc1OCC 59335590 VEGYRPGTNARLAW-YVLHZVERSA-N 442.899 4.535 50 10 IJGE CC[C@H](C)N1C(=O)C(C#N)=C(C)/C(=C\c2cn(-c3ccccc3)nc2-c2ccccc2)C1=O 101334081 HINKOWOJWQJQDD-FSTGKYBXSA-N 436.515 4.930 50 10 IJGE CCOc1cc(/C=C2\C(=O)N(Cc3ccccc3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 214281552 UWVUOTVAEFBLAR-XKZIYDEJSA-N 444.531 4.913 50 10 IJGE CCCCCCCCOc1ccc(OCC(=O)NN=Cc2ccc(OC)c(OC)c2)cc1 252607886 HGBDYEWHWAZWKA-UHFFFAOYSA-N 442.556 4.972 50 10 IJGE CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1 741660312 KTIWVTCYWARCOJ-UHFFFAOYSA-N 444.963 4.632 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1)C(C)(C)C 1587242875 DDBRBWZQTPLSOD-BMRADRMJSA-N 441.531 4.754 50 10 IJGE CCOc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)Nc3cccc4nc(O)[nH]c34)c2C)cc1 1625536340 FHUZWPVUJOPFCE-QGOAFFKASA-N 441.491 4.620 50 10 IJGE CCc1ccc(OCC(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)cc1 1860391961 ZTSPHHOMOIERLW-UHFFFAOYSA-N 430.529 4.971 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3CC(C)C)cc1OCC 1865687148 KMKHTYLSTLJULJ-JOCHJYFZSA-N 438.572 4.897 50 10 IJGE Cc1ccc(COc2ccc([C@H]3C(C#N)=C(N)Oc4c3c(C(F)(F)F)nn4C)cc2)cc1 1865692518 GREYGIRZCFOPPU-SFHVURJKSA-N 440.425 4.545 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706326 TXEGVYOZYXAWOU-JOCHJYFZSA-N 437.459 4.714 50 10 IJGE C[C@@H](CC(=O)NC[C@H]1C[C@H](Br)C1)c1ccc(NC(=O)OC(C)(C)C)cc1 1887783538 GFWSISWEUYWEGR-DZKIICNBSA-N 425.367 4.817 50 10 IJGE C[C@@H](Cl)CN(Cc1ccccc1)C(=O)c1ccc(F)cc1I 1914639955 VRXUSNWQCGOIMW-GFCCVEGCSA-N 431.676 4.700 50 10 IJGE CN(Cc1ccccc1Br)C[C@H](Br)COCc1ccccc1 1916353066 DATUCOKUVCOCDW-KRWDZBQOSA-N 427.180 4.861 50 10 IJGE C[C@H](Br)[C@H]1CCN(Cc2cccc(Br)c2Br)C1 1943905257 FPWOBAFPUZLJKM-UWVGGRQHSA-N 425.990 4.817 50 10 IJGE C[C@@H](Br)[C@H]1CCN(C(=O)c2csc(Br)c2Br)C1 1945183594 JDVJYDWGLGKTFX-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE C[C@H](Br)CCOc1c(Br)cc([N+](=O)[O-])cc1Br 2006333676 UTJMLFYTXLOBRL-LURJTMIESA-N 431.906 4.672 50 10 IJGE FC1(F)[C@@H]2COC[C@]21[C@@H](Br)c1ccc(Br)cc1Br 2083331238 XDUYFOWUOBZVPV-OUAUKWLOSA-N 446.911 4.929 50 10 IJGE FC1(C[C@@H](Br)c2cc(I)cc3c2OCC3)CCC1 2084687764 UIWPQYDJHBWINX-GFCCVEGCSA-N 425.079 4.944 50 10 IJGE ClCc1cc(Br)c(OCCS[C@H]2CCOC2)c(Br)c1 2092690088 RICNVVFVVDRMHZ-JTQLQIEISA-N 430.589 4.851 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Br)c2n1[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 2095438854 BFHGMGGXEBZGMH-TXPWEPMLSA-N 431.765 4.797 50 10 IJGE O=C(NC[C@@]1(CCl)CC12CCC2)c1cc(Br)c(Br)s1 2097910432 LIDPBCBHILABEM-ZDUSSCGKSA-N 427.589 4.802 50 10 IJGE Cc1cc(Br)c(C)c([C@@H](Cl)C(C)(C)S(C)(=O)=O)c1Br 2136372293 SSJBOTFEGVUWBA-GFCCVEGCSA-N 432.605 4.932 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CCCCCCCCCBr)[C@@]2(CCOC2)C1 2163065083 XHFKGESHXVHHSC-RXVVDRJESA-N 447.458 4.870 50 10 IJGE O=C(c1ccc(OCc2ccccc2)cc1)N1C[C@@H](CBr)[C@@H](C(F)(F)F)C1 2163358118 HVKACYFSUASTLF-AEFFLSMTSA-N 442.275 4.911 50 10 IJGE C[C@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)N1CCC[C@H](CCCl)C1 2166885548 BKCKVGMKMHKVAY-IEBWSBKVSA-N 427.035 4.897 50 10 IJGE O=C(NC[C@@H]1CN(CCCCCCCCCBr)CC12CCC2)C(F)(F)F 2174055009 ZRKFWYBSNUFYES-MRXNPFEDSA-N 441.376 4.893 50 10 IJGE CC(C)N(CCCCI)C[C@@H]1CCCCN1C(=O)OC(C)(C)C 2243586375 PASDPNMEFQMWOU-INIZCTEOSA-N 438.394 4.702 50 10 IJGE COc1ccc([C@@H](Br)C23CC(C)(C2)O[C@H]3C)cc1I 2269545173 MTMJSYUUCKRUFP-VXWAXNFESA-N 437.115 4.693 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@H](Br)[C@H]1CC2 2282971607 FLVOLRIAWVRCES-DXVIDONBSA-N 425.523 4.772 50 10 IJGE C[C@H]1C[C@@H](Br)[C@H](C)CN1C(=O)c1cc(Br)c(F)cc1Cl 2285845164 WPJDMBCJAAMDDX-KHQFGBGNSA-N 427.539 4.876 50 10 IJGE Cc1ccc(C)c([C@H](C)NC(=O)C(C#N)=Cc2cc3c(cc2Br)OCO3)c1 2295551719 IZHZCYWYKVMDHM-AWEZNQCLSA-N 427.298 4.579 50 10 IJGE Cc1ccc(C(=O)Oc2ccc(C=C(C#N)C(=O)Nc3ccccc3[N+](=O)[O-])cc2)cc1 2296655599 HLQGSEBMJCHPEL-UHFFFAOYSA-N 427.416 4.668 50 10 IJGE CCOc1cc(C=C2C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(C)cc1 2314611275 RZUFARYHROEHSF-UHFFFAOYSA-N 444.531 4.973 50 10 IJGE CCCCN1C(=O)C(=Cc2ccc(OCc3ccc(F)cc3)c(OC)c2)C(C)=C(C#N)C1=O 2314611743 ZPEPWYJAJDUEAC-UHFFFAOYSA-N 448.494 4.806 50 10 IJGE C[C@@]1(CCBr)CCN(Cc2ccc(Cl)cc2I)C1 2318537704 GJCUODQNBBIJFF-CQSZACIVSA-N 442.566 4.942 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@H]1CC12CCC(F)(F)CC2 2343414820 TYOWYFCIKUAPQX-IAGOWNOFSA-N 430.333 4.689 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](Br)[C@H](OCc2cccc(CC(F)(F)F)c2)C1 2353123182 FKYFKNFUFINMNN-LSDHHAIUSA-N 438.284 4.691 50 10 IJGE O=C(NC[C@@H]1CCCC[C@@H](Cl)C1)c1ccc(Cl)cc1I 2365597257 FBQXHBVWTAMWOW-GHMZBOCLSA-N 426.125 4.862 50 10 IJGE COC(=O)c1c(NC(=O)CCl)sc(C(=O)Nc2cc(Cl)ccc2Cl)c1C 21239284 FREKZTNUAUXSBJ-UHFFFAOYSA-N 435.716 4.580 50 10 IJGE O=C(NNc1ncnc(Sc2ccc(Cl)cc2)c1[N+](=O)[O-])c1ccc(Cl)cc1 40607710 YMFWCMPZLYCCBM-UHFFFAOYSA-N 436.280 4.600 50 10 IJGE Cc1ccc(-n2c(N(C)C)nc(/C=C(/C#N)C(=O)N[C@H](C)c3ccccc3)c2Cl)cc1 96998148 XRXQZZMFLQKTIZ-SQFNAUOLSA-N 433.943 4.685 50 10 IJGE CC(C)C[C@@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)c1cccs1 108883830 FCOUKVUTICHSQH-GOSISDBHSA-N 436.581 4.622 50 10 IJGE O=[N+]([O-])c1ccc(Oc2cccc(I)c2)cc1CBr 232485223 JBGZWULNVBXJOK-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE CC(=NNC(=O)COc1ccc(Cl)cc1)c1cccc(NC(=O)c2cccs2)c1 254386676 LDMGVTUXCRNRPY-UHFFFAOYSA-N 427.913 4.573 50 10 IJGE C[C@H](CCCBr)CNC(=O)c1cc(Br)sc1Br 384710938 MDZCIOUDDGCIIM-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE Cl[C@H](c1cc2c(cc1Br)OCCO2)c1nscc1Br 404804320 MCHKBOJGSLVHSK-LLVKDONJSA-N 425.529 4.768 50 10 IJGE BrCC(CBr)(c1ccc(Br)cc1)[C@H]1CCCO1 686741619 ZGDFISIBQFFSPC-GFCCVEGCSA-N 426.974 4.656 50 10 IJGE C[C@H](Br)CN(C(=O)c1cc(Br)cc(Br)c1)C1CC1 691364617 JOXRKJXUJQVSOL-QMMMGPOBSA-N 439.973 4.600 50 10 IJGE CC[C@]1(C)[C@H](Br)C[C@H]1Oc1ccc(OC)c(I)c1 712929958 KDVYAEVJZWEBSF-MGPQQGTHSA-N 425.104 4.631 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C(Cc2ccccc2)Cc2ccccc2)c1C 799099608 ASUUIBREXMDRLC-UHFFFAOYSA-N 437.547 4.700 50 10 IJGE Cc1cccc(NC(=O)C(=O)NN=Cc2ccccc2OCc2ccc(Cl)cc2)c1C 1084285203 ZFIIDQRPKVBWHM-UHFFFAOYSA-N 435.911 4.625 50 10 IJGE C/C(=C\C(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(C)c1C)c1cccc(F)c1 1629181448 OXRNCPZFOXFPTF-SAPNQHFASA-N 442.494 4.688 50 10 IJGE O=C(NNC(=O)c1ccc2c(c1)nc(O)n2C1CCCC1)Nc1ccc(Cl)cc1Cl 1633831163 WJWMTFZHRUYKCS-UHFFFAOYSA-N 448.310 4.630 50 10 IJGE COc1ccc(-c2nn(C)c3c2[C@H](c2ccc(Cl)c(Cl)c2)C(C#N)=C(N)O3)cc1 1865685267 HJUDXYVXRWLWRK-QGZVFWFLSA-N 427.291 4.621 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccccc2Cl)[C@@H]1c1cccc(F)c1 1865711263 UKGPQPHWNMDIII-OAHLLOKOSA-N 434.780 4.902 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(Cl)cc1Cl 1873794880 GVCNBMFUUBALNU-VQXFCIMOSA-N 436.339 4.580 50 10 IJGE C[C@H](CS(=O)(=O)N(Cc1ccccc1)[C@H](CBr)C1CC1)c1ccccc1 1915171229 CTWUTORIPFDLIJ-DYESRHJHSA-N 436.415 4.796 50 10 IJGE CC[C@@](C)(CBr)NC(=O)c1cccc(Br)c1Br 1943886924 LNBYXECVRXRDSN-LBPRGKRZSA-N 427.962 4.505 50 10 IJGE CCc1nc(C(=O)N(Cc2ccccc2)C[C@@H](C)Br)c(Br)s1 1961182754 UWBJAQUKNZKBRB-LLVKDONJSA-N 446.208 4.894 50 10 IJGE CN(Cc1c(Br)cccc1Br)C[C@H]1C[C@H](Br)C1 2020194342 NINGGHKKOWDOGP-MGCOHNPYSA-N 425.990 4.817 50 10 IJGE CN(Cc1cccc(Br)c1Br)C[C@H]1C[C@@H](Br)C1 2020194789 QFMBITWRIOBVTL-JGZJWPJOSA-N 425.990 4.817 50 10 IJGE CCC[C@@](C)(CCl)NC(=O)c1ccc(I)c(Br)c1 2029946319 UAPUYTKQONDZRC-ZDUSSCGKSA-N 444.538 4.581 50 10 IJGE Cc1cc(C)c2c(=O)c(C=C(C#N)S(=O)(=O)c3ccc(Br)cc3)coc2c1 2040751277 XVDJCQAJHUGEES-UHFFFAOYSA-N 444.306 4.511 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[S@](=O)(=NCCCCCCCCCBr)C1 2044700203 PODMSVFBHAQTLD-IVCQMTBJSA-N 439.460 4.877 50 10 IJGE CC(F)(F)C[C@H](CCl)NC(=O)c1cc(Br)c(Br)s1 2050368214 WIDACNXFKUQORT-RXMQYKEDSA-N 425.520 4.656 50 10 IJGE F[C@H]1CCO[C@@H]1COc1c(Br)cc(Br)cc1CBr 2058656549 SGSHKLRRVUKHCC-WDEREUQCSA-N 446.936 4.612 50 10 IJGE Cc1cc(Br)c(C)c([C@H](Br)[C@@H]2COCCO2)c1Br 2081072678 XAGCOUZLOHJPBK-GXFFZTMASA-N 442.973 4.680 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1ccc(Br)cc1Br 2081242584 NPBOCIFIHFJWON-QPUJVOFHSA-N 441.989 4.751 50 10 IJGE Clc1cc(CN2CC[C@@H](Br)[C@H]2C2CC2)ccc1I 2086654523 HESNMNBSSCAIJP-BXUZGUMPSA-N 440.550 4.692 50 10 IJGE C[C@@H](CCBr)CCN1CCC[C@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2129042648 JSIMLGGIKOCERZ-GJZGRUSLSA-N 429.403 4.747 50 10 IJGE COCCO[C@@H]1[C@@H](Br)C[C@@H]1Oc1ccc(Cl)c(Cl)c1Br 2206355618 AOMCPXSSFOUFKG-LCWDIZFYSA-N 448.966 4.702 50 10 IJGE Cc1sc(C(=O)N2C[C@@]3(F)CCC[C@@]3(CBr)C2)cc1Br 2234472768 YFJKFHYNYIYUHI-KGLIPLIRSA-N 425.161 4.548 50 10 IJGE O=C(c1cccc(I)c1)N1C[C@H](Br)CC12CCCCC2 2241030854 MAFJQWJALOPLMX-CYBMUJFWSA-N 448.142 4.604 50 10 IJGE CC(C)(C)CCN(CCBr)C(=O)c1ccccc1I 2274153382 XDACEGITDDDVDU-UHFFFAOYSA-N 438.147 4.565 50 10 IJGE COc1ccc([C@H](Br)[C@]23COC[C@@H]2C3(F)F)c(Br)c1Cl 2283563636 ZNQNQFURMGQYDA-UWJYBYFXSA-N 432.486 4.829 50 10 IJGE Cc1ccc(-n2c(SCC(=O)NN=CC=Cc3ccco3)nnc2-c2ccccc2)cc1 2296679470 SRUPAXPXBQFDKB-UHFFFAOYSA-N 443.532 4.743 50 10 IJGE CC(CC(=O)Nc1ccc(Cl)c(Cl)c1)=NNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 2297635513 GSNAVPGEVQJDLF-UHFFFAOYSA-N 443.674 4.690 50 10 IJGE Cn1cnc(Br)c1[C@H](Br)c1ccc(F)c(Br)c1 2300296445 MCXUCWHPDANBIK-SECBINFHSA-N 426.909 4.569 50 10 IJGE C=CCOc1c(Br)cc(C=C(C#N)C(=O)Nc2cccc(C)c2)cc1OC 2313518920 ZMSHYFPSDRBJOP-UHFFFAOYSA-N 427.298 4.877 50 10 IJGE CCOC(=O)COc1ccc(C=C(C#N)c2nc(-c3ccc(F)cc3)cs2)cc1OC 2314489148 OTFZFYFGTRHAHE-UHFFFAOYSA-N 438.480 4.964 50 10 IJGE CCN(CC)C[C@H](Br)CCc1ccc(Cl)c(I)c1 2315548879 LZAABUVLDOTJDU-GFCCVEGCSA-N 444.582 4.983 50 10 IJGE CCN1C(=O)Cc2cc(-c3nc(NC(=O)C(C#N)=Cc4ccccc4)sc3C)ccc21 2320934058 DMMIDMYNFYISNX-UHFFFAOYSA-N 428.517 4.573 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=CN(Cc2ccccc2)Cc2ccccc2)cc1 2324335625 UCJROJZHNNOQAE-UHFFFAOYSA-N 439.515 4.912 50 10 IJGE Clc1ccc(I)cc1CN1CC2(CC2)C[C@H]1CBr 2327388872 KCLYKSDSOPDECM-LBPRGKRZSA-N 440.550 4.694 50 10 IJGE CC(C)(C)OC(=O)NC1(C2CCN(C[C@@]3(CBr)CC3(F)F)CC2)CCC1 2351887079 IZVWCJLKDAPSOU-KRWDZBQOSA-N 437.369 4.566 50 10 IJGE C[C@@H]1C[C@H]2C[C@]([C@@H](Br)c3cc(I)cc4c3OCC4)(C2)O1 2368505243 MNKXMJGYGGRWMH-DEQYAXRXSA-N 449.126 4.620 50 10 IJGE Cc1cc(Br)ccc1S(=O)(=O)C[C@](C)(CBr)C(C)(C)C 2380199612 NFIOVCMZZMPGOI-HNNXBMFYSA-N 426.214 4.979 50 10 IJGE CCCCCCOc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2C(=O)OC)cc1OC 40853589 WWQVGLMHLYIMDW-XDJHFCHBSA-N 436.508 4.987 50 10 IJGE COc1cc(Br)c(OCC2(CBr)CC2)cc1Br 118642139 BLZJUIVQVPOICR-UHFFFAOYSA-N 428.946 4.774 50 10 IJGE C[C@H]1CC[C@H](Br)CN1C(=O)c1cc(Br)cc(Br)c1 399422267 NXMHRTWTIIXULN-WPRPVWTQSA-N 439.973 4.600 50 10 IJGE CC[C@H](O[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1I)c1ccccc1 403286800 RWYRVQQSCYKYQD-HRCADAONSA-N 431.314 4.577 50 10 IJGE O=C(c1cc(Cl)ccc1Br)N1CCC(F)(F)[C@H](CBr)C1 403952940 HIAWMYUCZFDQJK-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE C[C@@H](CCl)[C@H]1CCCCN1C(=O)c1cc(Cl)ccc1I 696709566 BIHOPWFHQDBCTB-IINYFYTJSA-N 426.125 4.814 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)NCc2cc(O)nc3ccccc23)c1C 754317348 HMKGTDCNQCXVLN-BKUYFWCQSA-N 436.515 4.880 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cnc(-c2ccc(F)c(F)c2)s1 780334882 SNWYDZGJMMFFSL-UHFFFAOYSA-N 444.341 4.772 50 10 IJGE C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1 799389179 ZGUVVROZZBCDOW-AWEZNQCLSA-N 445.445 4.740 50 10 IJGE CC(C)c1noc(-c2ccc(NC(=O)NNc3ccc(C#N)cc3C(F)(F)F)cc2)n1 799396607 ZPQCTIVHDNKGIH-UHFFFAOYSA-N 430.390 4.899 50 10 IJGE COc1ccc(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)cc1-c1ccccc1 1318625000 PUQPZWGONGYGKD-UHFFFAOYSA-N 425.492 4.588 50 10 IJGE CCCOc1c(OC)cccc1[C@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2-c1ccccc1 1865694419 YAKDQDXHHRGTQK-QFIPXVFZSA-N 444.535 4.840 50 10 IJGE CCN(CC)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(Cl)cc2)cc1 1865701955 JGOABTAZVDGKMS-QFIPXVFZSA-N 433.943 4.899 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1cc(Br)ccc1Cl 1882086132 ZCRPLFPQSWBWMT-LLVKDONJSA-N 427.564 4.933 50 10 IJGE O=C(N[C@@H](CCl)[C@@H]1CC=CCC1)c1csc(Br)c1Br 1885065445 UDRAHLSLBHXJMV-SCZZXKLOSA-N 427.589 4.967 50 10 IJGE Cc1cnc2c(S(=O)(=O)N(Cc3ccccc3)[C@@H](C)CBr)cccc2c1 1914346992 BWHKXRFJOCJDND-INIZCTEOSA-N 433.371 4.518 50 10 IJGE C[C@H](Br)[C@H]1CCN(Cc2ccc(I)c(Cl)c2)C1 2026567409 RPIIJLQGTNTHLM-ONGXEEELSA-N 428.539 4.550 50 10 IJGE CC(C)N(Cc1ccc(I)c(Cl)c1)C[C@@H](C)Br 2026567863 WCAUVAMAIBUKLK-SNVBAGLBSA-N 430.555 4.938 50 10 IJGE CC1(C)CO[C@@H]1COc1c(Br)cc(CBr)cc1Br 2043109249 QTLPKFSDPYMOJC-LLVKDONJSA-N 442.973 4.910 50 10 IJGE CCC[C@@H](Br)c1cn(-c2ccc(I)cc2Cl)nn1 2057428154 YJQLNLUJDJAUPB-SECBINFHSA-N 440.510 4.761 50 10 IJGE CCC[C@@H]1CN(c2ncc(I)cc2Br)C[C@H]1CCl 2084893740 NICSRKFNTFWTDE-NXEZZACHSA-N 443.554 4.540 50 10 IJGE COc1ccc([C@H](Cl)c2cnn(C)c2I)c(Cl)c1Cl 2138638249 YLDGBFRQRZBQHO-VIFPVBQESA-N 431.488 4.668 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N[C@H](C)CCCCCBr)c1Br 2174530911 VWRWPLVSSJNJBI-SECBINFHSA-N 447.258 4.750 50 10 IJGE CC(C)(C)OC(=O)NC[C@H](NC(=O)c1ccc(CBr)cc1)c1ccccc1 2179674551 OCSMAQQAYCKQHL-SFHVURJKSA-N 433.346 4.577 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@H](CNC(=O)OC(C)(C)C)CC1CCCCC1 2196914588 OWCWBHWREAIJEH-ADKAHSJRSA-N 445.442 4.730 50 10 IJGE CC[S@](=O)CCn1c([C@H](C)Cl)nc2cc(Br)c(Br)cc21 2234059309 IJTSIKHNFHEYQM-FHZGZLOMSA-N 442.604 4.630 50 10 IJGE Br[C@@H]1CCC2(CCN(Cc3ccc(I)cc3)CC2)C1 2272374934 SZJQLSRKFBGUOI-CQSZACIVSA-N 434.159 4.821 50 10 IJGE Cc1cccc(O[C@@H]2C[C@@H](Br)[C@@H]2OCC(C)C)c1I 2277946469 CGCURKNDODTQLK-KYOSRNDESA-N 439.131 4.555 50 10 IJGE O=C(N[C@@H](CBr)C1CCCC1)c1cc(F)c(Br)cc1Cl 2282973111 YLINLVQQWKWFAX-ZDUSSCGKSA-N 427.539 4.925 50 10 IJGE C[C@@]1(CCBr)CCN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282989800 KFXRKFJYDHJCTA-CQSZACIVSA-N 427.539 4.879 50 10 IJGE CC1(C)C[C@@H](CBr)CN1C(=O)c1cc(Br)c(F)cc1Cl 2285846082 JPJXEBPEZRBIFG-QMMMGPOBSA-N 427.539 4.877 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@@H]2CCCC[C@H]3C[C@H]32)C1 2302671914 NZXLAHCKYVTIQQ-WFXMFSGNSA-N 449.373 4.786 50 10 IJGE Clc1ccc(CN2C[C@H]3C[C@@H](Br)C[C@H]2C3)cc1I 2315553177 OLTMBXHWTAVPSO-QJPTWQEYSA-N 440.550 4.692 50 10 IJGE COc1ccc(C(C#N)=Cc2cccc(OC(=O)c3ccc4c(c3)OCO4)c2)cc1OC 2320511011 JLIINDITTVFQKM-UHFFFAOYSA-N 429.428 4.716 50 10 IJGE CCSc1ccc(Cl)cc1CC(=O)NN=Cc1cc(Cl)c(O)c(Cl)c1O 2323681343 PQSTUBSOIVSVAQ-UHFFFAOYSA-N 433.744 4.863 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)CCN1c1nc(C(F)(F)F)ccc1CBr 2343783972 NMMGSIOUKBTBLQ-CQSZACIVSA-N 428.296 4.706 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1I)C1(CCl)CCCCC1 2365581356 FAKZQCJOUDSTMY-UHFFFAOYSA-N 426.125 4.958 50 10 IJGE CC(=O)C1=C(C)NC(SCC(=O)c2ccc([N+](=O)[O-])cc2)=C(C#N)[C@H]1c1cccc(C)c1 1199310 ISBKFNBPNVRRGD-HSZRJFAPSA-N 447.516 4.804 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=O)c2ccc(OCCOc3ccccc3)cc2)cc1 14039516 BQXHKPGHDPACHG-UHFFFAOYSA-N 432.520 4.517 50 10 IJGE CCc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2F)cc1 38652238 JAXSRTSXHOVSKF-VWLOTQADSA-N 444.462 4.591 50 10 IJGE Cc1c(C(=O)Nc2ccc(C(C)C)cc2)oc2c1/C(=N/NC(=O)c1ccncc1)CCC2 40813977 FEKUUBGZTWFFHX-VFCFBJKWSA-N 430.508 4.829 50 10 IJGE CCOc1cc(/C=N/NC(=O)COc2ccc(C(C)C)c(C)c2)cc(Br)c1O 40911883 LJZYYHSSTBPEFH-FOKLQQMPSA-N 449.345 4.514 50 10 IJGE C[C@@H](CBr)COc1c(I)cc(Cl)c2cccnc12 96869849 OBOIIQHHDGZELI-QMMMGPOBSA-N 440.506 4.903 50 10 IJGE C[Si](C)(C)OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H](C=O)O[Si](C)(C)C 195787983 DWTGGLMCGFIELV-IXDOHACOSA-N 438.862 4.697 50 10 IJGE C[C@@H]1CCC[C@@](CCl)(NC(=O)c2cc(Cl)ccc2I)C1 235297331 POAJXRIDRIZFPK-MEBBXXQBSA-N 426.125 4.862 50 10 IJGE Nc1c(Cl)cccc1[C@H]1CN(Cc2ccccc2)C[C@H]1CI 394531079 XZLPRFLEYRUURX-ZBFHGGJFSA-N 426.729 4.573 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNc1ccc(C#N)cc1C(F)(F)F)O[C@@H](C)C2 799746459 LSRPWNHGOFZLJF-NUTKFTJISA-N 445.441 4.546 50 10 IJGE Cc1ccccc1NC(=O)C(=O)NN=Cc1cc(C)n(-c2ccc(Cl)c(Cl)c2)c1C 1084158518 JLBIRRKPWYOTCP-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE Cc1nc(COc2ccc(F)cc2)sc1C(=O)NNc1nc2ccccc2[nH]c1=S 1301148539 RHKZHNXTGUOPCR-UHFFFAOYSA-N 441.513 4.532 50 10 IJGE O=C(COc1c(Cl)cc(Cl)cc1Cl)NNc1nc2ccccc2[nH]c1=S 1646017035 FAFCFQCNGRFQLW-UHFFFAOYSA-N 429.716 4.775 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNc2ccc(Cl)cc2Br)c(O)n1 1647735301 AABTZZFXKFNGFA-UHFFFAOYSA-N 448.704 4.636 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865683720 NTQZMMKCQGGASN-DEOSSOPVSA-N 441.579 4.785 50 10 IJGE CCCn1nc(C(F)(F)F)c2c1OC(N)=C(C#N)[C@H]2c1c(OC)ccc2ccccc12 1865687944 DRPLOEGHXDKMIM-KRWDZBQOSA-N 428.414 4.692 50 10 IJGE N#C/C(=C\c1ccc(Br)cc1)C(=O)NCCc1ccc(-c2cccnc2)cc1 1866128700 HHBXILWYVSOFTB-KGENOOAVSA-N 432.321 4.777 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)Cc1cnn(Cc2ccccc2)c1 1915128956 UPERPUZJJRUIAN-LJQANCHMSA-N 440.385 4.676 50 10 IJGE CN(Cc1cccc(Br)c1Br)C[C@H](Br)C1CC1 1943885510 WKMGEMBEOICBLY-LBPRGKRZSA-N 425.990 4.817 50 10 IJGE C[C@@H]1CN(c2ncc(Br)cc2Br)[C@H](C)C[C@@H]1Br 1944576313 PTSZRRRDHGQCMU-MRTMQBJTSA-N 426.978 4.605 50 10 IJGE CC(C)(C)OC(=O)N1CCCC2(C1)CC1(CCC[C@H](CI)O1)C2 1986987488 XASYZUQLXVEFHK-RWBZWWBESA-N 435.346 4.540 50 10 IJGE O=C(N[C@@H](CCl)CC(F)(F)F)c1csc(Br)c1Br 2032958526 GAUKXYQPVKHOEQ-SCSAIBSYSA-N 429.483 4.563 50 10 IJGE CC[C@H]1CCCCN1CC(=O)C(C#N)=C1NC(c2ccc(Br)cc2)=CS1 2042453701 ZBWVVYZDMFSRIM-INIZCTEOSA-N 432.387 4.653 50 10 IJGE C[C@@H]1CCCN(C[C@H](Br)C(F)(F)F)[C@@H]1CCCNC(=O)OC(C)(C)C 2044704974 HXTCPTGLCSJPJA-MCIONIFRSA-N 431.337 4.718 50 10 IJGE CC1(F)CC([C@@H](Br)c2cc(I)cc3c2OCC3)C1 2065847803 AEBPHEGTBBOPQL-VTGPFMDVSA-N 425.079 4.800 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)N(C[C@@H](CBr)C(C)(C)C)CCO2 2163057992 GVRFOQKWNDYMIN-MRXNPFEDSA-N 441.410 4.967 50 10 IJGE O=C(NC[C@H]1CCCC[C@H](Cl)C1)c1ccc(I)c(Cl)c1 2163752855 COMJBYHWXWTTAT-JQWIXIFHSA-N 426.125 4.862 50 10 IJGE CC(C)(C)C[C@@H]1CCN1S(=O)(=O)c1cc(CBr)sc1Br 2179786398 ZYNZNLSKVOILNV-VIFPVBQESA-N 445.242 4.605 50 10 IJGE CCC12COC([C@H](Br)c3cc(I)cc4c3OCC4)(C1)C2 2205185632 GDBVVRLMARAQTR-QQFBHYJXSA-N 449.126 4.621 50 10 IJGE CC(C)N(CCCCCI)C[C@@H]1CCCN1C(=O)OC(C)(C)C 2211185541 KDNNZFLMZBBRLC-INIZCTEOSA-N 438.394 4.702 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(OC2(C3CCCCC3)COC2)C1 2272934509 DOPHYLIRMLCNNB-LJQANCHMSA-N 432.399 4.517 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCC[C@@H](CBr)CC1 2285845377 ZJHQWGVGYRZODE-SECBINFHSA-N 427.539 4.879 50 10 IJGE CCSc1ccc(-c2nn(-c3ccccc3)cc2C=C(C#N)C(=O)NCCCOC)cc1 2296732192 GTHXRXNHYDLIIA-UHFFFAOYSA-N 446.576 4.711 50 10 IJGE COc1ccc2c(c1)N(C)C(=C1SC(=NCCCl)N(Cc3ccccc3)C1=O)S2 2297312337 RUHBMOZIONLIOK-UHFFFAOYSA-N 445.997 4.777 50 10 IJGE O=S1(=O)CC[C@@H]([C@H](Cl)c2ccc(OCc3ccccc3)cc2Br)C1 2299501336 NIIVFQWCZAKTSR-KDOFPFPSSA-N 429.763 4.743 50 10 IJGE COc1cc(C=C2C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(C)cc1 2314611326 TXROESRRJGCYSE-UHFFFAOYSA-N 430.504 4.583 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc3nc(Cc4ccccc4)[nH]c3c2)cc1OCC 2323721400 QNDKWMPATDMYBG-UHFFFAOYSA-N 442.519 4.715 50 10 IJGE CCOc1ccc(-c2csc(C(C#N)=C(O)c3ccc(NS(C)(=O)=O)cc3)n2)cc1 2331305292 NDTMUVXUFKURRE-UHFFFAOYSA-N 441.534 4.530 50 10 IJGE CN(CC1(CBr)CC(C)(C)C1)[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 2345004360 JPLBVBFTPALDCZ-ULQDDVLXSA-N 429.443 4.908 50 10 IJGE C/C(=N\NC(=O)c1cc(-c2ccc(OCc3ccccc3)cc2)n[nH]1)c1ccccc1O 27527959 WTLUMLBOOXLPNO-YZSQISJMSA-N 426.476 4.515 50 10 IJGE Cc1cc(C)cc(-n2c(SCC(=O)NN)nc(-c3ccccc3)c2-c2ccccc2)c1 35666743 JNGIRCOEKHSJTQ-UHFFFAOYSA-N 428.561 4.905 50 10 IJGE CCCCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(-c3ccc(C(=O)OCC)cc3)o2)C1=O 38603866 RYFGIQWFIOGYCZ-RCCKNPSSSA-N 446.503 4.906 50 10 IJGE Cc1ccc(Nc2ncnc(NNC(=O)c3cccc4ccccc34)c2[N+](=O)[O-])cc1C 40590173 WTSSHTLRLVTQHU-UHFFFAOYSA-N 428.452 4.655 50 10 IJGE O=C(N/N=C\c1cccc(Cl)c1Cl)c1cccn(Cc2ccccc2Cl)c1=O 169920853 XPDXQVJWOOQWIF-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE CC[C@@H](N/C=C(/C#N)C(=O)N1CCN(c2ccc(F)cc2)CC1)c1ccc2c(c1)CCCC2 217237049 WWNIVMOYADZTTF-ZVUBZYFMSA-N 446.570 4.501 50 10 IJGE CC(C)c1ccc(C=NNC(=O)c2ccc(N(Cc3ccccc3)S(C)(=O)=O)cc2)cc1 254307724 GGYIDAUJXKFTPS-UHFFFAOYSA-N 449.576 4.540 50 10 IJGE Cc1cc(C=NNC(=O)OC(C)(C)C)c(C)n1-c1ccc(I)cc1 254487317 CEMBFJZGUVLAKP-UHFFFAOYSA-N 439.297 4.557 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CI)[C@H](c2ccc(Cl)cc2F)C1 382682286 CKLMSHNOHAGMEP-GXFFZTMASA-N 439.696 4.865 50 10 IJGE ClCc1cnc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)c(Br)c1 705845049 KRDYCYLQTHAVJB-HDAAZOAOSA-N 446.820 4.930 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)C1C2(CC2)C12CC2 720237280 IMRXBEKGZGEPJT-GFCCVEGCSA-N 431.111 4.852 50 10 IJGE O=C(NNc1cc(Cl)ccc1Cl)c1cc(O)nc2ccc(Br)cc12 752811197 XSITZQHTCLCWJX-UHFFFAOYSA-N 427.085 4.767 50 10 IJGE Cc1cc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)ccc1NC(=O)OC(C)(C)C 799751362 NNQXAEVTJNHPJN-UHFFFAOYSA-N 434.418 4.989 50 10 IJGE CC(=O)C1(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Cl)c(C(F)(F)F)c3)c2C)CC1 1141858071 YORSLPKQEZSAPO-CXUHLZMHSA-N 449.860 4.911 50 10 IJGE C/C(=C/C(=O)NNc1c(Br)cccc1Br)c1ccc(F)cc1 1568130998 OAFZVKLZFRTXGL-KTKRTIGZSA-N 428.099 4.897 50 10 IJGE CCOc1ccc(OCC(=O)NN=Cc2cn(Cc3ccccc3)c3ccccc23)cc1 1772753980 KCDDKJMEQDNJMM-UHFFFAOYSA-N 427.504 4.617 50 10 IJGE CCc1ccc(-c2csc(/C(C#N)=C(\O)c3ccc(NS(C)(=O)=O)cc3)n2)cc1 1872744211 IZBRVNQTZIWIHW-ZZEZOPTASA-N 425.535 4.694 50 10 IJGE C[C@H](C[C@H]1CCCN1C(=O)OC(C)(C)C)[C@@H](CBr)NC(=O)OC(C)(C)C 1880762730 YFBXGXYOJVXWDT-RBSFLKMASA-N 435.403 4.700 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)Cc1nn(C)c(Cl)c1Br 1914614432 WATXPIXCWHKOSI-NSHDSACASA-N 435.591 4.622 50 10 IJGE CC(C)(CCS(=O)(=O)N(Cc1ccccc1)[C@H](CBr)C1CC1)C1CC1 1915177495 VPUVYGBBXOWFLF-LJQANCHMSA-N 428.436 4.818 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1csnc1Br 1925209742 BNQQZEWXNORZHG-GFCCVEGCSA-N 432.181 4.722 50 10 IJGE Brc1ccc(Br)c(C[C@@H]2CCOCC[C@@H]2Br)c1 2006499066 HWGYORZNZLLSPA-ZANVPECISA-N 426.974 4.944 50 10 IJGE C[C@H]1CN(Cc2cc(Br)ccc2Br)CC[C@H]1Br 2006503419 NZONEXWRTVNIRS-JOYOIKCWSA-N 425.990 4.817 50 10 IJGE Cc1ccc(CNCCSSCCNC(=O)OC(C)(C)C)cc1Br 2010825709 PEAZUXHXBFRNBF-UHFFFAOYSA-N 435.453 4.753 50 10 IJGE CC(C)N(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@@H](Br)C(F)(F)F 2044699485 LTEWFXDPNKSUIN-UONOGXRCSA-N 431.337 4.670 50 10 IJGE CCCn1cc(S(=O)(=O)N(Cc2ccccc2)C(C)(C)C)cc1CBr 2059312532 MOJLYEJRBXMOCI-UHFFFAOYSA-N 427.408 4.782 50 10 IJGE FC(F)c1cc(I)c(CCl)cc1I 2060236637 VZZLBOHFYUDPTH-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE C[C@H]1CCN(Cc2ccc(I)c(Cl)c2)C[C@H]1CBr 2086659009 SFHKLFZPQITKES-CMPLNLGQSA-N 442.566 4.798 50 10 IJGE Brc1ccc([C@H](CI)OC[C@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)cc1 2134539237 KAVAGYWYUXTZBU-PRLTYNAASA-N 433.127 4.844 50 10 IJGE Fc1cc2c(cc1Br)nc(CCCl)n2[C@@]12C[C@@H]1CN(Cc1ccccc1)C2 2155862865 KJUBBHIHJQHHNZ-QVKFZJNVSA-N 448.767 4.950 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(CBr)cc2)c2ccccc21 2163059568 UPZSJGCQLVWFGW-UHFFFAOYSA-N 431.330 4.983 50 10 IJGE ICCCCCN1CCC[C@@]2(CCN(Cc3ccccc3)C2)C1 2211184586 DZVKDZGSGWOJFL-HXUWFJFHSA-N 426.386 4.580 50 10 IJGE CN(CC[C@@H](Br)c1ccccc1)C[C@@H]1CC1(Br)Br 2218005888 KVMKHGPHKUTYSY-QWHCGFSZSA-N 440.017 4.951 50 10 IJGE Cc1sc(C(=O)N2CCC(F)(F)[C@@H](CBr)C2)c(C)c1Br 2234473964 IQLKAKBRCJHCFN-VIFPVBQESA-N 431.140 4.620 50 10 IJGE CC(C)[C@H](CBr)CN1CC[C@@H](NC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2255002365 WMUCXYUNCDUUBN-MGPQQGTHSA-N 431.337 4.574 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCc2ccccc2N(CC2(CBr)CC(F)C2)C1 2280358851 IFOCWNGRKBWAMQ-BQIYRTECSA-N 441.385 4.846 50 10 IJGE O=C(NC[C@@H]1CCCC[C@H]1CCl)c1ccc(Cl)c(I)c1 2283655072 GLDAZJWKUGUOSB-RYUDHWBXSA-N 426.125 4.720 50 10 IJGE Clc1ccc(C[C@]2(CBr)CC=CCO2)cc1I 2300241481 ZYBDRTZGANGWMP-ZDUSSCGKSA-N 427.507 4.597 50 10 IJGE CC(C)N(Cc1ccc(Cl)cc1I)C[C@@H](C)Br 2302325687 JNOMLKFRJVEGFY-SNVBAGLBSA-N 430.555 4.938 50 10 IJGE N#CC(=Cc1ccccc1OCC(=O)Nc1nccs1)c1nc(-c2ccco2)cs1 2314519620 VOOPSRDBTQXYAT-UHFFFAOYSA-N 434.502 4.941 50 10 IJGE C[C@@H]([C@@H](Cl)c1c(Cl)cc(Br)c(F)c1Br)S(C)(=O)=O 2315454145 UICPXRPRMPXYPY-AJAUBTJJSA-N 442.959 4.717 50 10 IJGE CN(C[C@H](Br)CCc1ccc(Cl)c(I)c1)C1CC1 2315549074 NZARUAPSZPKMDX-LLVKDONJSA-N 442.566 4.735 50 10 IJGE Cc1cc(Br)ccc1NC=C(C#N)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 2325216397 WTECREHJASRDQN-UHFFFAOYSA-N 435.665 4.777 50 10 IJGE COc1ccc([C@@H](Br)c2c(Br)ncn2C)c(Cl)c1Cl 2337273345 ADJXZXJWBNMJMO-MRVPVSSYSA-N 428.939 4.982 50 10 IJGE CCN(C[C@](C)(CBr)O[C@@H]1CCOc2ccccc21)C(=O)OC(C)(C)C 2340299604 QEIXXLVMTZJJNP-XLIONFOSSA-N 428.367 4.937 50 10 IJGE O=[N+]([O-])c1ccc(CBr)c(N2CC[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c1 2355586220 XGROVDCOSMDYAL-AZUAARDMSA-N 430.346 4.733 50 10 IJGE ClCCCOC1CCN(Cc2ccc(Cl)cc2I)CC1 2366713927 DEGOZPKCVYZMAB-UHFFFAOYSA-N 428.141 4.555 50 10 IJGE O=C(c1ccccc1OCc1ccccc1)N(CCCBr)C1CCOCC1 2381011404 JJSOYIQPAWCJNX-UHFFFAOYSA-N 432.358 4.672 50 10 IJGE CC(C)C[C@@H](CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)CCC12CCOCC2 2382175009 XVFLMFDWCXRXHA-ROUUACIJSA-N 447.458 4.582 50 10 IJGE CCOc1ccc(NC(=O)COc2ccc(/C=C(/C#N)C(=O)Nc3ccccc3)cc2)cc1 33305463 AXXDPYYAQIEYCA-SILNSSARSA-N 441.487 4.648 50 10 IJGE Cc1c(/C=C(C#N)\C(O)=N\c2ccc(Cl)cc2Cl)c(=O)n(-c2ccccc2)n1C 97002974 WIHIFFXHJOPEDE-UVTDQMKNSA-N 427.291 4.986 50 10 IJGE COCCc1ccc([C@H](Br)c2ccccc2I)cc1 104050996 KQONXABWAXCVOP-INIZCTEOSA-N 431.111 4.964 50 10 IJGE CCOc1cc(C(=O)NN=C(C)c2cccc(Br)c2)cc(OCC)c1OCC 254818486 NQVOVWIABXPGBF-UHFFFAOYSA-N 449.345 4.799 50 10 IJGE Cc1c(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)oc2c1/C(=N/NC(N)=O)CCC2 256018318 BDHQAEKVPAYSCY-CYZUSBSJSA-N 430.468 4.964 50 10 IJGE ClCCCc1ncc(-c2ccc(I)c(Br)c2)o1 721576261 DQGXTFPNOYPBJJ-UHFFFAOYSA-N 426.479 4.880 50 10 IJGE Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CC/C=C\c3ccccc3)cc2)n1 737468580 KCDHTHKWQCPNCF-POHAHGRESA-N 446.576 4.640 50 10 IJGE O=C(NN=Cc1cc(Cc2ccccc2Cl)cc(Br)c1O)c1ccncc1 1083972565 YSLUOXKYWGDJPS-UHFFFAOYSA-N 444.716 4.558 50 10 IJGE C#CCOCCC(=O)Nc1cc(Br)ccc1CO[Si](C)(C)C(C)(C)C 1128149351 VQATVFBMYRSETL-UHFFFAOYSA-N 426.427 4.949 50 10 IJGE C=Cc1ccc(CCNC(=O)NNc2cccc(OC(F)F)c2Br)cc1 1686554795 LHZQLHCWZFYFSW-UHFFFAOYSA-N 426.261 4.562 50 10 IJGE Cc1c(C(=O)N2CCC(C)CC2)oc2c1C(=NNC(=O)c1ccccc1Cl)CCC2 1772743619 DRRKSODBYXYSOW-UHFFFAOYSA-N 427.932 4.584 50 10 IJGE CCOc1ccccc1OCC(=O)NN=Cc1ccc(OCc2ccc(C)cc2)c(OC)c1 1772754839 XZEFMJVRKIXKEV-UHFFFAOYSA-N 448.519 4.510 50 10 IJGE CCc1nn(Cc2ccccc2)c2c1[C@H](c1ccc(OC(C)C)c(OC)c1)C(C#N)=C(N)O2 1865696706 JERLQYBLOYURND-HSZRJFAPSA-N 444.535 4.508 50 10 IJGE CCN(c1ccccc1)S(=O)(=O)c1ccccc1NC(=O)/C(C#N)=C/c1cccc(F)c1 1866131459 WIAPTSPBEOQVDL-XDJHFCHBSA-N 449.507 4.587 50 10 IJGE O[C@H](c1c(Br)sc(Br)c1Cl)[C@@H]1C[C@@H]1Br 1877337145 UWZVKAPYZTWNHI-KMYHCQSRSA-N 425.367 4.743 50 10 IJGE CC1(C)CN(c2nc3sccn3c2CBr)CCCN1Cc1ccccc1 1879328763 QGFZSTAUCMQSKU-UHFFFAOYSA-N 433.419 4.782 50 10 IJGE C[C@@H]1CN(Cc2ccc(Br)cc2Br)C[C@@H]1CBr 1943857497 DMFWXCKZWAHMRO-KOLCDFICSA-N 425.990 4.674 50 10 IJGE O=C(NCCCCCBr)c1cccc(Br)c1Br 1943888265 YETXLROZCDVDST-UHFFFAOYSA-N 427.962 4.507 50 10 IJGE CCC[C@@H]1C[C@@H]1COC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1993096497 DQEUQNPNHABYPM-HUUCEWRRSA-N 437.362 4.644 50 10 IJGE Cc1cc([C@H](Br)c2cc(I)sn2)c(F)cc1F 2007644661 MYMQVWLPNMAMPW-NSHDSACASA-N 430.055 4.819 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[S@@](=O)(=NCCCCCCCCCBr)C1 2044700204 PODMSVFBHAQTLD-LMKMVOKYSA-N 439.460 4.877 50 10 IJGE COc1ccc(F)cc1Cn1nc(CBr)c(Br)c1C(F)(F)F 2079233261 RCBULLGDHWKRJC-UHFFFAOYSA-N 446.036 4.755 50 10 IJGE O=C(NC1(CCCl)CCSCC1)c1csc(Br)c1Br 2093942434 RYOMEKCOGRJJSI-UHFFFAOYSA-N 447.645 4.898 50 10 IJGE C[C@@]1(CCl)CC(F)(F)CN1C(=O)c1scc(Br)c1Br 2102794643 KFGSPGTWUNDSRE-JTQLQIEISA-N 437.531 4.752 50 10 IJGE CCC[C@@]1(NC(=O)[C@@H](Br)C2CCCC2)CCCN(C(=O)OC(C)(C)C)C1 2110714158 ARDDTTZZTQUUPW-OXJNMPFZSA-N 431.415 4.626 50 10 IJGE O=C(c1scc(Br)c1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Cl)C2 2134133503 SXZOFFRWFSMDSM-RXHUMLQZSA-N 431.552 4.596 50 10 IJGE CN(C(=O)[C@@H](Br)C1CCCC1)[C@H]1CCCC[C@H]1N(C)C(=O)OC(C)(C)C 2138777481 JTKFULLKKWWNJU-BBWFWOEESA-N 431.415 4.577 50 10 IJGE CCOCCOCCC(CBr)(CBr)c1ccc(Cl)cc1 2143826646 WZEWHYCMUFUARX-UHFFFAOYSA-N 428.592 4.811 50 10 IJGE CN(C[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(CBr)c([N+](=O)[O-])c1 2188571236 BTXGMWMXPFQUCD-GOSISDBHSA-N 432.362 4.838 50 10 IJGE O=C(N[C@@H](CBr)CC1CCOCC1)c1ccccc1OCc1ccccc1 2195483646 QSCGUKIFRIUIAW-LJQANCHMSA-N 432.358 4.576 50 10 IJGE BrCCCC1CN(Cc2ccc(Br)cc2Br)C1 2216705482 JSUCNKNTWLSOJB-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE Cc1ccc(I)c(C(=O)N[C@@H](CBr)CC(C)(C)C)c1 2232158078 JZHLXTUUBPHXGL-LLVKDONJSA-N 438.147 4.529 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2C1CSCCSC1 2237062079 YDKCAHVKJLANFM-UHFFFAOYSA-N 442.750 4.540 50 10 IJGE Fc1cc(Br)cc(F)c1CO[C@@H]1CCCC[C@H]1I 2259042307 PKVDLXVVLCXXQD-CHWSQXEVSA-N 431.058 4.990 50 10 IJGE CCn1c(SCC(=O)NN=CC(Br)=Cc2ccccc2)nc2ccccc21 2296679460 KTYVWTHNWAAPIG-UHFFFAOYSA-N 443.370 4.686 50 10 IJGE C=CCNC(=O)C(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc(OCCC)c(C)c1 2296729527 VUSPGMLRWBYKLC-UHFFFAOYSA-N 426.520 4.846 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)c(I)c2)CC[C@H]1Br 2300239167 UWCIQDMFXDEIHU-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE CC(C)N(CCCBr)Cc1ccc(Cl)c(I)c1 2300239534 ZMXDEWXMIPHPPQ-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Br)c2)[C@H]1CCl 2306226142 YEYMPMSJFWFVRH-LBPRGKRZSA-N 428.539 4.503 50 10 IJGE BrCC1(OCc2cc(Br)cc(Br)c2)CCOCC1 2315458354 LTKBPYOHRDJOJW-UHFFFAOYSA-N 442.973 4.672 50 10 IJGE Br[C@@H]1CC[C@H]2CCCN(Cc3sccc3I)[C@H]2C1 2316761325 CWGINHWQIKSRJZ-WZRBSPASSA-N 440.188 4.881 50 10 IJGE N#CC(=CNc1ccc(N2CCCCC2)cc1)C(=O)Nc1ccc(Br)cc1 2324087636 KWWKSACPPIPQBV-UHFFFAOYSA-N 425.330 4.897 50 10 IJGE ClC[C@@]12CC[C@@H](CN1Cc1ccc(I)c(Br)c1)C2 2325207699 QZMXSTSANHRGIM-RISCZKNCSA-N 440.550 4.647 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Br)c2)C[C@@H](C)C1Cl 2325215304 XSYGLMVSVHTLML-NXEZZACHSA-N 442.566 4.749 50 10 IJGE Cc1ccc(COc2ccccc2C=NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc1 2328833145 KXICDEVHPRFREU-QFIPXVFZSA-N 439.556 4.573 50 10 IJGE CCOC(=O)c1sc(NC(=O)C(C#N)=Cc2ccc(OC)cc2)nc1-c1ccccc1 2329622426 IONTUTGXLBAVBD-UHFFFAOYSA-N 433.489 4.541 50 10 IJGE ClCc1c(Cl)ncnc1OCc1cc(Br)cc(Br)c1 2337069239 MJPOHMCVLNKVAD-UHFFFAOYSA-N 426.923 4.973 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3CC2)C1 2345011742 VOTVADXNGKHWKZ-IRXDYDNUSA-N 429.443 4.767 50 10 IJGE Cc1ccc(NC(=O)CCC(=O)N/N=C/c2ccccc2OCc2ccccc2)cc1C 12581166 HCSBOMVQPDZLOB-WPWMEQJKSA-N 429.520 4.751 50 10 IJGE O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)c1ccc(NC(=O)c2ccccc2)cc1 13982137 PQQQUKDYRYRLHH-WYMPLXKRSA-N 428.275 4.715 50 10 IJGE CCc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccs2)cc1 38656589 MUGHIIMQAANKCP-QHCPKHFHSA-N 432.501 4.513 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc([N+](=O)[O-])c4)ccc32)cc1 38677666 GWJWCEJUILXFBI-HSZRJFAPSA-N 441.443 4.595 50 10 IJGE CCOc1ccc(/C=N/NC(=O)CCCSc2nc3ccc([N+](=O)[O-])cc3s2)cc1 58989095 VXJHOKJLZRGDJV-FYJGNVAPSA-N 444.538 4.626 50 10 IJGE N#C/C(=C/NC[C@@H]1COc2ccccc2O1)C(=O)NC1CCCCCCCCCCC1 217260096 ZYHBMZODJOQESY-XPUAKXTGSA-N 425.573 4.613 50 10 IJGE C[C@H]1CCN(C(=O)c2cc(Br)sc2Br)[C@@H]1CBr 235617402 GMWDNJCIFSZZJE-POYBYMJQSA-N 446.002 4.519 50 10 IJGE CCCOc1ccc(Br)cc1C=NNC(=O)COc1ccc(C(C)C)cc1 252620599 MHOKGVIJPPIBJO-UHFFFAOYSA-N 433.346 4.890 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3ccccc3F)n2-c2ccccc2)cc1 254868653 PJACONGZUZNPLW-UHFFFAOYSA-N 445.523 4.624 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1C[C@H]1CCCN(Cc2ccccc2)C1 380258483 PDCXKGVEOCXRIW-KRWDZBQOSA-N 447.808 4.887 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@@H]1C(C)(C)[C@@]21CCC[C@@H](CI)O1 686236031 GMRUYJCMOIJXDX-NRTGNBEESA-N 449.373 4.785 50 10 IJGE O=C(N[C@@H]1CCC[C@@H]1CBr)c1scc(Br)c1Br 705515157 HXZUHVCTIQMIOD-HTRCEHHLSA-N 446.002 4.567 50 10 IJGE CCC[C@@H](CCBr)NC(=O)c1cc(Br)c(Br)s1 716963765 YDHQOEMQUFFILT-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)[C@H](Sc2ccccc2Cl)c2ccccc2)cc1 748131560 OUKOREIGDRIIOV-HXUWFJFHSA-N 446.981 4.720 50 10 IJGE C[C@H](OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)c1ccccc1[N+](=O)[O-] 764596243 HRHMWOWKXAVBDQ-FJSNCCPHSA-N 441.447 4.583 50 10 IJGE CC(C)(c1ccccc1)c1nnc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)s1 799397977 WZZVDTSEMMJWKC-UHFFFAOYSA-N 446.458 4.903 50 10 IJGE C[C@H](Oc1ccc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cn1)c1ccccc1 799750504 CYLUMEMAVFLSHA-AWEZNQCLSA-N 426.398 4.869 50 10 IJGE CCCCOc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)c2ccncc2)cc1 1081080160 URCXWVMHXRBWIS-UHFFFAOYSA-N 439.519 4.877 50 10 IJGE CCc1ccc(OCC(=O)NN=Cc2cccc(Cl)c2Cl)c(Br)c1 1084445379 CKSSREKQLHOBNA-UHFFFAOYSA-N 430.129 4.847 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCCCCC[C@@H]1C(=O)NNc1nc2ccccc2[nH]c1=S 1148222608 FBFLHXISDJXOJX-GJZGRUSLSA-N 445.589 4.599 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2c(F)ccc(SCC3CC3)c2F)c1C 1306590189 GJVWSHGTAXXNEA-UHFFFAOYSA-N 441.507 4.693 50 10 IJGE O=C(NN=Cc1ccccc1OCc1ccc(F)cc1)C(F)(F)C(F)(F)C(F)(F)F 1565518972 VTHXNSFESJTMKX-UHFFFAOYSA-N 440.290 4.688 50 10 IJGE CCc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)COc2ccccc2)CCC3)cc1 1772748725 DCDZFOUDHQJLMN-UHFFFAOYSA-N 445.519 4.638 50 10 IJGE C[C@@H]1COC[C@@H](C)N1c1cc(Nc2ccc(SC#N)cc2)nc(Cc2ccccc2)n1 1868207854 QOJABEJUYRGMFC-QZTJIDSGSA-N 431.565 4.998 50 10 IJGE COc1ccc(OC)c(-c2csc(/C(C#N)=C/c3cc(OC)c(OC)cc3OC)n2)c1 1872791360 GOTIXYHPWOLVIG-OVCLIPMQSA-N 438.505 4.917 50 10 IJGE O=C(N[C@H](CCl)[C@H]1CC=CCC1)c1csc(Br)c1Br 1885065446 UDRAHLSLBHXJMV-WCBMZHEXSA-N 427.589 4.967 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)O[C@H]1CCC2(CCCC2)C1 1902880708 GDICXGNSWHNPBK-YOEHRIQHSA-N 437.362 4.834 50 10 IJGE O=S(=O)(c1ccc2c(c1)CCC2)N(Cc1ccccc1)C1(CBr)CCC1 1915754758 CIZWNAJORGRZRW-UHFFFAOYSA-N 434.399 4.684 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H](C)N(c2ccc(CBr)cc2[N+](=O)[O-])C1 1921468089 CIHUVVWKXQZUSQ-IRXDYDNUSA-N 432.362 4.837 50 10 IJGE COCCOC[C@H](Br)CCc1c(Br)cccc1Br 2038178174 MSPNMYBQPCIMSV-SNVBAGLBSA-N 444.989 4.571 50 10 IJGE COc1cc(C=CC(=O)c2ccc(O)c(CCCl)c2)c([N+](=O)[O-])cc1OC(F)F 2053575537 WHLFZRYPXZUHDJ-UHFFFAOYSA-N 427.787 4.588 50 10 IJGE Cc1nn(C)c(C[C@H](Br)c2ccccc2Br)c1Br 2072279676 LIFKOFWFPNNPPX-NSHDSACASA-N 436.973 4.932 50 10 IJGE COc1cc([C@@H]2C(C#N)=C(N)Oc3cc4c(cc32)[C@@H](C)CC(C)(C)N4C)cc(OC)c1OC 2087934213 ZAHNTKBQPBRGBI-PSLXWICFSA-N 449.551 4.653 50 10 IJGE CC(C)(C)OC(=O)NCC1(NC(=O)c2ccc(CBr)cc2)CCCCC1 2106202129 QUKCDKAFXBQISM-UHFFFAOYSA-N 425.367 4.539 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1CN(CC1CC1)C[C@@H](CBr)C1CCC1 2106785552 PKKZTIGBQNSNCK-RTBURBONSA-N 429.443 4.909 50 10 IJGE O=C(NC[C@@]12CCC[C@]1(CCl)C2)c1cc(Br)c(Br)s1 2142939675 IRBWKIJOYSFCFP-OLZOCXBDSA-N 427.589 4.802 50 10 IJGE Cc1cc(Br)c(C(=O)N2CCC[C@@](F)(CBr)C2)cc1Cl 2157508467 CQZVYLWWGUXIPM-CQSZACIVSA-N 427.539 4.750 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@]12CCCC[C@@H]1N(C(=O)OC(C)(C)C)CCC2 2196908439 XNCUVYRKTWJXTN-DLRJPAPCSA-N 443.426 4.578 50 10 IJGE COc1ccc([C@H](Br)[C@@]23CC[C@@H](C2)[C@H](C)O3)cc1I 2269545122 MGEKIJPYWVIBRG-LHAJWOIZSA-N 437.115 4.693 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@@H](Br)CC12CC2 2285834990 HKJGYTWTDYNKBY-MRVPVSSYSA-N 425.523 4.774 50 10 IJGE COc1ccc(Br)c2c1nc(CCCl)n2C[C@@H]1CCN1Cc1ccccc1 2286081593 VJEFHCPCOZUVKL-INIZCTEOSA-N 448.792 4.863 50 10 IJGE N#CC(=Cc1ccc(OCc2ccccc2)c(Br)c1)C(=O)N1CCCCC1 2293806431 UTQJYIVOMQHLAM-UHFFFAOYSA-N 425.326 4.948 50 10 IJGE CN(Cc1ccc(Cl)cc1I)CC1(CBr)CC1 2302319667 HHORHMMGZQQCKT-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE CCC[C@H](CCCl)NCc1ccc(I)c(Br)c1 2306224497 QWYRTTUAKLVQIS-LLVKDONJSA-N 430.555 4.941 50 10 IJGE N#CC(=Cc1cn(Cc2ccccc2)c2ccccc12)C(=O)NCc1ccc2c(c1)OCO2 2313730191 CEYDQPGHDYZXPV-UHFFFAOYSA-N 435.483 4.642 50 10 IJGE CCCOc1ccccc1C=C(C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1Br 2314773858 GLRDWEPKTZBCJP-UHFFFAOYSA-N 430.258 4.692 50 10 IJGE BrC[C@H]1CCC2(CCC2)CN1Cc1sccc1I 2316754504 JDAGDJUCSXJRBR-LLVKDONJSA-N 440.188 4.882 50 10 IJGE C[C@H]1[C@H](Br)C[C@@H](C)CN1Cc1ccc(Cl)cc1I 2318545803 MMFBEARLSUFTAA-GBIKHYSHSA-N 442.566 4.938 50 10 IJGE Clc1ccc(CN2C[C@H](Br)C3(CCC3)C2)c(I)c1 2318557832 OUUDHWHJGGRGKZ-ZDUSSCGKSA-N 440.550 4.694 50 10 IJGE CCCN1C[C@@H](Br)[C@H](Cc2ccc(Cl)cc2I)C1 2318558446 VEJRDBPQKYKOHX-DGCLKSJQSA-N 442.566 4.592 50 10 IJGE COc1ccc([C@H](C)NC=C(C#N)C(=O)NC(c2ccccc2)c2ccccc2)cc1OC 2324825723 RTUWNWOMXHTZJU-IBGZPJMESA-N 441.531 4.668 50 10 IJGE C=CC[C@H](Br)[C@@H]1CCN1Cc1cc(I)ccc1Cl 2327397191 MSVWNNXDIJAGPV-JSGCOSHPSA-N 440.550 4.859 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2CC[C@H]1C[C@H]2Br 2327398840 JHGQVNGHEXKPEN-JIMOISOXSA-N 440.550 4.692 50 10 IJGE CC(C)[C@@H](CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2331632784 FQQSYFHSRMWOEQ-GBESFXJTSA-N 425.411 4.646 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](CC(F)(F)F)C1 2353826450 MTFXUUCGOBTUPY-HUUCEWRRSA-N 445.364 4.917 50 10 IJGE O=C(NNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(-c2nc3ccccc3s2)s1 35553789 IALGTEITXSUOGE-UHFFFAOYSA-N 441.450 4.598 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1Cc1ccc(Br)cc1 98039963 ORGONDAQJDRVMO-UHFFFAOYSA-N 429.543 4.786 50 10 IJGE CC(C)n1c(CBr)nnc1-c1cc(Br)cc(Br)c1 232761535 NEWYSVAOQBMZOV-UHFFFAOYSA-N 437.961 4.946 50 10 IJGE CCCCCCCCCCCCCC(=O)NCC(=O)NN=Cc1ccc(OC)c(OC)c1 254623894 VGUNWBZHLSYYEQ-UHFFFAOYSA-N 447.620 4.971 50 10 IJGE C[C@@H](Cl)c1nc(N)nc(Nc2c(Br)cc(Cl)cc2Br)n1 313570989 VVZPZWWYVPNZPP-SCSAIBSYSA-N 441.942 4.676 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@@H](c2ccc(Br)s2)C1 382732874 VKHWLBMXXXEZRE-ZJUUUORDSA-N 425.186 4.856 50 10 IJGE O=C(NN=Cc1c(Cl)cccc1OCc1ccccc1Cl)c1ccc(O)c(O)c1 794558539 BEWQDTKTPWOMAM-UHFFFAOYSA-N 431.275 4.748 50 10 IJGE O=C(CCC(=O)Nc1ccccc1Cl)NN=Cc1ccc(OCc2ccccc2)cc1 1084564759 YKKLBWNFZVHODV-UHFFFAOYSA-N 435.911 4.788 50 10 IJGE C=CC[C@H](CO)CNC(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1152930142 LNSUGFSSXAFGKL-ZJTXRKTBSA-N 432.351 4.609 50 10 IJGE C#C[C@H]1CCCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1 1643854232 JYUHHIVAJVCTGH-TYJAPOHBSA-N 425.454 4.892 50 10 IJGE COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2-c1cccc(Cl)c1 1865710031 MXIZAORJMPRPQK-MRXNPFEDSA-N 446.816 4.771 50 10 IJGE CCN(c1ccccc1)S(=O)(=O)c1ccccc1NC(=O)/C(C#N)=C/c1ccc(F)cc1 1866127376 BLVKSHNXWWEPRF-KNTRCKAVSA-N 449.507 4.587 50 10 IJGE CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 1873794910 IMIMEZZKMHXJMT-SYOQMXFQSA-N 439.556 4.655 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C(C)(C)C 1882801453 WGQDYHJAJJVWCG-RRFJBIMHSA-N 449.430 4.946 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@H](C(F)(F)CBr)C1 1892726123 KHWKFBODYXGVRG-LURJTMIESA-N 437.531 4.656 50 10 IJGE O=S(=O)(c1sccc1Br)N(Cc1ccccc1)[C@H](CCl)C1CC1 1915208940 OQAKKUZHSIIPIP-OAHLLOKOSA-N 434.808 4.719 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cscc1Br 1916363601 BRROKRLQEFDGGI-CYBMUJFWSA-N 447.192 4.563 50 10 IJGE ClCc1ccc(Br)c(Cl)c1-n1cc(I)cn1 1939331184 VOUALHXWRIZGPR-UHFFFAOYSA-N 431.886 4.632 50 10 IJGE O=C(Nc1c(Br)cc(Cl)cc1Br)[C@H]1C[C@@H]1Br 1991402809 ABXSVQVHHDREPG-WDSKDSINSA-N 432.337 4.587 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H](CBr)C3(CC3)C2)c1 2027536174 NXUMZPWGIGFUFB-LLVKDONJSA-N 440.550 4.552 50 10 IJGE CSCC[C@@H](Cl)CCNC(=O)c1scc(Br)c1Br 2029925979 UQSKCFAIQOLEJR-ZETCQYMHSA-N 435.634 4.754 50 10 IJGE Cc1sc(Br)cc1[C@H](Br)c1cc(S(C)(=O)=O)cs1 2034557419 RTEMPUCLOJTWLO-NSHDSACASA-N 430.208 4.768 50 10 IJGE Cc1oc(C)c(S(=O)(=O)N(Cc2ccccc2)C2CCCC2)c1CBr 2059265139 QARJUTNCTBXQLR-UHFFFAOYSA-N 426.376 4.925 50 10 IJGE Oc1nc2cc([C@H](Br)[C@H]3C[C@H](Br)C3)c(Br)cc2[nH]1 2076182532 SWRYNLQBSYOWIN-WHHMAUIRSA-N 438.945 4.641 50 10 IJGE Brc1ccccc1[C@@H](CI)OC[C@@H]1CCCCCO1 2096321536 FMIGFOHUSVWALX-SWLSCSKDSA-N 439.131 4.901 50 10 IJGE F[C@]12CCC[C@@]1(CBr)CN(Cc1ncc(Br)cc1Cl)C2 2183581815 QAPHTMKURLSGRF-KGLIPLIRSA-N 426.555 4.587 50 10 IJGE Brc1cccc([C@H](CI)OC2CC(n3cccn3)C2)c1 2183661842 BCGWNUDVGGRIAS-NRXISQOPSA-N 447.114 4.542 50 10 IJGE CC(C)C[C@H](CBr)CNC(=O)Cc1ccc(Br)cc1Cl 2237439532 IGDQNNPSJOWVCW-LLVKDONJSA-N 425.592 4.818 50 10 IJGE COc1cc(F)c([C@H](Br)c2c(Cl)c(C)nn2C)cc1Br 2240929615 IHYSALNAEKQZJM-NSHDSACASA-N 426.511 4.776 50 10 IJGE COC[C@]1([C@@H](Br)c2cc(Cl)cc(Br)c2OC)CCCO1 2295360600 SBIIRXMUILLILN-KBPBESRZSA-N 428.548 4.743 50 10 IJGE CN(Cc1ccc(Cl)cc1I)C[C@H](Br)C1CC1 2302325475 HXPCIFIFZOQHDX-LBPRGKRZSA-N 428.539 4.550 50 10 IJGE CCO[C@@H]1[C@@H](Br)C[C@H]1Oc1cc(Cl)c(C)cc1I 2314953546 LQWIOVMCDQCOEB-ZEGGKSINSA-N 445.522 4.573 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H](C3)[C@@H]2CBr)cc1I 2315546157 DIDHXYCCMBPUHU-MJVIPROJSA-N 440.550 4.692 50 10 IJGE Clc1ccc(CN2C[C@H]3C[C@@H](Br)C[C@H]3C2)c(I)c1 2318521069 DQRJZZMTNDHLSL-ZSBIGDGJSA-N 440.550 4.550 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H](Br)CCC12CC2 2327398098 ZSHBJMFTEIANQZ-LLVKDONJSA-N 440.550 4.837 50 10 IJGE N#CC(=C(O)CCc1nc2ccccc2[nH]c1=O)c1nc(-c2ccc(F)c(F)c2)cs1 2331352428 UJMHRZDCZSHNMV-UHFFFAOYSA-N 436.443 4.750 50 10 IJGE CN(c1ncc(Br)c(CCl)n1)[C@H]1C[C@@H]2C[C@H](OCc3ccccc3)C[C@H]12 2332005717 WAOQWTYQAWOLND-FPXQBCRKSA-N 436.781 4.798 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2CC[C@@H]3C[C@H]2CO3)cc1I 2334463530 LAECCBRCWYEDSK-OZTPJHRESA-N 437.115 4.551 50 10 IJGE CN(Cc1cnn(C)c1Br)c1cc(Cl)c(F)cc1CBr 2362382932 KNMLDILKXXYOMD-UHFFFAOYSA-N 425.527 4.506 50 10 IJGE C[C@H]1CC2CC([C@H](Br)c3cc(I)cc4c3OCC4)(C2)O1 2368035742 MNKXMJGYGGRWMH-PPUQKNHRSA-N 449.126 4.620 50 10 IJGE CCC(C)(C)c1ccc(OCC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1 14784151 ADIMCVPXYPIUOP-SFHVURJKSA-N 434.536 4.521 50 10 IJGE CCCOC(=O)c1cccc(-c2ccc(/C=C3/C(=O)N(CCC)C(=O)C(C#N)=C3C)o2)c1 33155140 NWTIWKLFTHWLQS-XSFVSMFZSA-N 432.476 4.516 50 10 IJGE Cc1ccc2[nH]c(-c3ccccn3)c(CCCC(=O)NNC(=O)c3ccc(Cl)cc3)c2c1 39852552 GPLVIDKWVNJZQC-UHFFFAOYSA-N 446.938 4.976 50 10 IJGE CC(C)c1ccc(Oc2ncnc(NNC(=O)c3cccc(Cl)c3)c2[N+](=O)[O-])cc1 40611046 CRZXXJKPQJUGQT-UHFFFAOYSA-N 427.848 4.711 50 10 IJGE C[C@H](CCl)C(=O)Nc1c(Br)cc(Br)cc1Br 54711721 BOKJBHKWGLIVTH-RXMQYKEDSA-N 434.353 4.788 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)cc(Br)c1OCC#N 59335609 NIVAMHKYTZNUAH-YBEGLDIGSA-N 440.297 4.604 50 10 IJGE O=C(c1ccc(Br)c(C(F)(F)F)c1)N1CCCC[C@H]1CBr 124687072 XQBCQEXZVGOEDI-JTQLQIEISA-N 429.074 4.858 50 10 IJGE COc1cc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)ccc1OCc1cc(C)ccc1C 169879992 BPOHXOGIMDFCRC-AFUMVMLFSA-N 433.464 4.563 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\Nc1ccc(Cl)cc1C(F)(F)F 217157089 VGCCNFFODYQPNF-QXMHVHEDSA-N 437.805 4.994 50 10 IJGE CC(=NNC(=O)c1cccc(NC(=O)c2cccc(Cl)c2)c1)c1ccc([N+](=O)[O-])cc1 252585718 KNEZBECJLQWSDE-UHFFFAOYSA-N 436.855 4.655 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1C(=O)c1ccc(Br)cc1Br 384217159 CPKJCZRNDFNPJV-KWQFWETISA-N 439.973 4.600 50 10 IJGE C[C@@H](CCCCBr)NC(=O)c1cc(Br)sc1Br 398427762 ITBIZKYDZJIRTF-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE Cc1cc(I)c(SC(F)(F)F)cc1C(=O)CBr 575710156 VFVCCPOEMUSKSB-UHFFFAOYSA-N 439.034 4.789 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@H](CBr)CC(F)(F)F)cc1Cl 717775488 GFIDBNHWCUIGJI-ZETCQYMHSA-N 437.481 4.857 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2cc(C(N)=O)ccc2Cl)c(C)n1-c1ccc(F)cc1 732121549 CQBBEXVDVFWBKD-LICLKQGHSA-N 436.874 4.531 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)N[C@@H](c1cccc(F)c1)c1cccc(Cl)c1 758860665 AUMFUSXAEJGBNS-OAQYLSRUSA-N 448.885 4.761 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)c(C)n1-c1ccc(F)cc1 778218196 DLEJIXNOSRNDMI-ZDLGFXPLSA-N 446.457 4.803 50 10 IJGE CC(C)Cn1c(SCC(=O)N/N=C2\C[C@H]3CC[C@@]2(C)C3(C)C)nnc1-c1ccco1 1087755657 VIZDUOGPCDTESK-NKQXXAGFSA-N 429.590 4.605 50 10 IJGE CC(=O)N(c1cccc(Cl)c1)c1nc(CNC[C@@]2(C)C[C@@H]2Br)cs1 1474640807 NTQHVQRZBTUKAF-DOTOQJQBSA-N 428.783 4.744 50 10 IJGE O=C(Nc1ncccc1OCC(=O)c1ccc(Cl)cc1)Oc1ccc([N+](=O)[O-])cc1 1858695307 UQKVYPFWXWOGFN-UHFFFAOYSA-N 427.800 4.516 50 10 IJGE CCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccccc1O)C(C#N)=C(N)O2 1865708619 ZILPHOVLNJEOBB-LJQANCHMSA-N 441.318 4.724 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@H](C)[C@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1880760801 JCYSGKREHMCBQD-OGWHTMIXSA-N 425.411 4.679 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)cc1F 1915295752 NGWIVLCHYFWEJQ-KRWDZBQOSA-N 432.330 4.575 50 10 IJGE C[C@@H]1CO[C@](CBr)(Cc2c(Br)cccc2Br)C1 1945328217 ZUPKTDPCKNBPBE-ZANVPECISA-N 426.974 4.944 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCOc2ccc(Br)cc21 1975074181 WUGRLALXPVPEJQ-WCQYABFASA-N 435.156 4.603 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@H]([C@]2(C)CCC[C@@H](CI)O2)CC1 1993734193 BAOHDOCTKBLTHA-XSWJXKHESA-N 437.362 4.833 50 10 IJGE Cc1c([C@@H](Br)c2ccc(F)c(Br)c2)nn(C)c1Br 2049257641 FGOSGSRSXLUSBY-JTQLQIEISA-N 440.936 4.877 50 10 IJGE Brc1cnc(N2CC[C@H](Br)CC23CCC3)c(Br)c1 2050626389 QLRDLGKNSQGFJY-VIFPVBQESA-N 438.989 4.893 50 10 IJGE Brc1cccc(Br)c1CN1CC[C@H](Br)[C@@H]2CC[C@@H]21 2069996688 OIXIQOWSAGMFCH-HERUPUMHSA-N 438.001 4.959 50 10 IJGE Cc1c(Br)ccc([C@@H](Cl)C2(S(C)(=O)=O)CCC2)c1Br 2138852944 UWSDTFLSSYCRAE-GFCCVEGCSA-N 430.589 4.767 50 10 IJGE ClCc1ccc(N2CC[C@H]3COC[C@@H](C2)N3Cc2ccccc2)c(Br)c1 2139651839 HPFMLLJEVNLVTR-RBUKOAKNSA-N 435.793 4.668 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCCN2C(=O)c2ccc(CBr)cc2)CC1 2163052589 FSWLDQMRYWSFEL-UHFFFAOYSA-N 437.378 4.587 50 10 IJGE Cc1nc([C@@H](Cl)c2cc3nc(O)[nH]c3cc2Br)c(Br)s1 2169495474 MAHPWLALKNAMMB-VIFPVBQESA-N 437.544 4.887 50 10 IJGE Cc1ccc(I)c([C@@H](Br)c2ccc3c(c2)OCCO3)c1 2240997926 WJJDUJRQVISQBN-INIZCTEOSA-N 445.094 4.855 50 10 IJGE O=C(N[C@H]1C[C@H]2CC[C@H]1[C@H](Br)C2)c1scc(Br)c1Cl 2264503454 GHDIENPPGPHGBW-OORONAJNSA-N 427.589 4.846 50 10 IJGE C=CC[C@]1(CCl)CCN(C(=O)c2scc(Br)c2Br)C1 2272152937 FKPBVYGXEBHOKY-CYBMUJFWSA-N 427.589 4.920 50 10 IJGE CN(CC[C@@H](NC(=O)[C@@H](Br)C1CCCC1)C(C)(C)C)C(=O)OC(C)(C)C 2278545744 JXDFYJDCFMZTKE-CVEARBPZSA-N 433.431 4.728 50 10 IJGE Cc1cc(Br)c([C@@H](Br)[C@@H]2CCCCS2(=O)=O)c(C)c1F 2279145130 VDNJECLKUPSOQJ-AAEUAGOBSA-N 428.161 4.608 50 10 IJGE C[C@@H]1CCCN(C(=O)c2cc(F)c(Br)cc2Cl)[C@@H]1CBr 2282978958 SXYYBBLOGSNUBB-AMIZOPFISA-N 427.539 4.877 50 10 IJGE O=C(c1cccc(Cl)c1Br)N1CCC([C@H](F)CBr)CC1 2283198645 VTUNZXFHRPOURT-GFCCVEGCSA-N 427.539 4.688 50 10 IJGE CC(C)(CCl)[C@H]1CCCN1C(=O)c1ccc(Cl)c(I)c1 2283662818 KSERXCUJASZHBN-CYBMUJFWSA-N 426.125 4.814 50 10 IJGE N#CC(=CNCc1ccccc1Br)C(=O)Nc1ccc(Cl)cc1Cl 2318454935 JLGQNCASQWMSOX-UHFFFAOYSA-N 425.113 4.892 50 10 IJGE CCN(C[C@](C)(CBr)OC[C@@H]1C[C@H]2[C@@H](C1)C2(F)F)C(=O)OC(C)(C)C 2320759187 FSNRJDNRNMGJKP-LOUJCGABSA-N 426.342 4.705 50 10 IJGE CC(C)c1nc2c(Cl)cc(C(F)(F)F)cn2c1C=NNC(=O)COc1ccccc1 2321257135 NKURTYNSZWNESH-UHFFFAOYSA-N 438.837 4.659 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H](CNC(=O)OC(C)(C)C)CC23CCC3)C1 2345010903 OUYSMGXLDNXNAW-MRXNPFEDSA-N 429.443 4.957 50 10 IJGE COc1ccc2ccccc2c1/C=N/NC(=O)COc1ccc(Br)cc1Cl 13977879 IDTUDPWMCUHSIS-FOKLQQMPSA-N 447.716 4.793 50 10 IJGE CCCOC(=O)c1ccc(OCC(=O)N/N=C(\C)c2ccc(-c3ccccc3)cc2)cc1 14021225 UTZBBSIXFPOSLZ-ZXVVBBHZSA-N 430.504 4.840 50 10 IJGE COc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4ccc(C)cc4C)c(C)c32)cc1 40813796 IJDGHIPJRTYVRL-SGWCAAJKSA-N 445.519 4.936 50 10 IJGE CC[C@@H](CCBr)CNC(=O)c1cc(Br)c(Br)s1 127047951 HSUVQFIGWSMFEF-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE C[C@@](CBr)(NS(=O)(=O)c1cc(Cl)sc1Cl)c1ccccc1 134455510 FCLNWWJRQRMXCD-ZDUSSCGKSA-N 429.188 4.644 50 10 IJGE Cc1ccc2c(c1)N/C(=C(/C#N)C=C1C=C(Br)C(=O)C(Br)=C1)N2 137058894 CKJZNERKQZKXBE-GZTJUZNOSA-N 433.103 4.634 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)ccc1OC(=O)/C=C\c1ccccc1 206395404 IITXKELITKHLJZ-GARQVCOHSA-N 438.483 4.537 50 10 IJGE CCCCCCOc1ccc(/C=C(/C#N)C(=O)Nc2nnc(SC)s2)cc1OC 207201137 VXGGPJVWXFVKBG-PTNGSMBKSA-N 432.571 4.773 50 10 IJGE N#C/C(=C/Nc1ncc(Br)cn1)C(=O)NC1CCCCCCCCCCC1 217260192 FOMFTWLBHSFCOR-SSZFMOIBSA-N 434.382 4.848 50 10 IJGE C[C@@H]1CCC[C@](CCl)(NC(=O)c2cc(Cl)ccc2I)C1 235340493 POAJXRIDRIZFPK-BMIGLBTASA-N 426.125 4.862 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCC[C@@H]1CCBr 304540809 KPFPSFYNGZHQSF-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE Cc1ccc([C@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CI)cc1 382710624 HAXPYIGQDNGGMF-RBUKOAKNSA-N 435.305 4.782 50 10 IJGE CC(C)(C)OC(=O)NCCN1CCN[C@@H](c2ccccc2CO[Si](C)(C)C(C)(C)C)C1 616652380 FJBVTUUONSNRMV-OAQYLSRUSA-N 449.712 4.679 50 10 IJGE CCN(C(=O)c1cc(I)ccc1Br)C(C)(C)CCl 688344616 BYRHQJTWPPLHSE-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2nc3c(s2)C(=O)CCC3)c(C)n1-c1ccccc1F 727713479 CVTCNZKUKLGQEK-LFIBNONCSA-N 434.496 4.754 50 10 IJGE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NNc1ccnc2cc(Cl)ccc12 743297107 KUYISCJCTQBAGG-UHFFFAOYSA-N 448.939 4.813 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(OC(F)F)c3ncccc23)c(C(F)(F)F)c1 799390237 MYSKLOKTICNJIQ-UHFFFAOYSA-N 437.328 4.875 50 10 IJGE CC(=O)c1cccc(C(=O)NNC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)c1 1124227363 KMONZSPODWIRKZ-UHFFFAOYSA-N 438.936 4.910 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2ccc(-c3cc(O)n[nH]3)cc2)c(C)n1-c1ccc(F)cc1 1441187679 PEDZBJFOYRWCMJ-UNOMPAQXSA-N 441.466 4.875 50 10 IJGE C#CCCCC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)C[C@H](C)C2 1597394170 QHZSTOIQJYRAOF-PMIVHWTLSA-N 437.543 4.922 50 10 IJGE CCN1CCN(c2cc(Nc3ccc(SC#N)cc3)nc(-c3ccc(OC)cc3)n2)CC1 1859833903 QQKMAJYTPBVCNW-UHFFFAOYSA-N 446.580 4.611 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3CC)cc1OCC 1865689329 PWEVHALBIQEZNJ-OAQYLSRUSA-N 430.508 4.586 50 10 IJGE Cc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2Cc1ccccc1F 1865713155 SAHBXQFUCYJHRO-QGZVFWFLSA-N 428.389 4.616 50 10 IJGE CCOc1ccc(OCC)c(-c2csc(/C(C#N)=C(\O)CNC(=O)c3ccccc3)n2)c1 1872754653 CNBODSGUZOYORY-VZCXRCSSSA-N 449.532 4.830 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CN(C(=O)OC(C)(C)C)[C@H]1C(C)(C)C 1881339342 KHJRFKRVDQLGRZ-BFHYXJOUSA-N 435.403 4.556 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1ccc(Cl)c(Br)c1 1882087143 HTYHUTGEFRMMEV-SNVBAGLBSA-N 427.564 4.933 50 10 IJGE CN(C[C@@H]1C[C@@H]1Br)C(=O)CC[C@H](CCNC(=O)OC(C)(C)C)C(C)(C)C 1887829442 JOEQOEDYMCONGE-XHSDSOJGSA-N 433.431 4.586 50 10 IJGE C[C@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)c(Br)s1 1914661878 QMHKVSKPYWPURD-JTQLQIEISA-N 443.215 4.982 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)Cc1cccc2ccccc12 1916346629 DMDFJRPMRURTJT-OAQYLSRUSA-N 426.354 4.821 50 10 IJGE CCC(CC)(CBr)CN1C[C@H](C)N(C(=O)OCc2ccccc2)[C@H](C)C1 1977952868 SLMIKYOGKNYSFG-HDICACEKSA-N 425.411 4.919 50 10 IJGE Clc1ncn(-c2c(Br)cccc2Br)c1CBr 1982516800 NHRNUEUTDWFLKR-UHFFFAOYSA-N 429.337 4.946 50 10 IJGE O=C(N[C@H]1CC[C@H](CBr)C1)c1cc(Br)ccc1Br 2029535593 NTDNDXHVGUIROH-WPRPVWTQSA-N 439.973 4.505 50 10 IJGE Brc1cccc(CN2C[C@@H](Br)[C@@H](C3CC3)C2)c1Br 2031479583 YFNSZBIRKUXRCJ-DGCLKSJQSA-N 438.001 4.817 50 10 IJGE C[C@H]1C[C@@H](Br)CCN(Cc2cc(Cl)ccc2I)C1 2041568468 XWJOWIMJPPXAKK-JQWIXIFHSA-N 442.566 4.940 50 10 IJGE O=C(CCl)c1c(C(F)(F)F)ccc(I)c1OC(F)(F)F 2055163903 XGQZXSIKHQVRNG-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE C[C@]1(CBr)C[C@H](NC(=O)c2c(Br)cccc2Br)C1 2059453919 ACMSTRFTLBABFO-XCSCGOTBSA-N 439.973 4.505 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@H]2[C@@H](Cl)CCC[C@H]2C1 2094592419 VXXHBTGOQSJNEW-XKSSXDPKSA-N 427.589 4.753 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C(F)(F)F)CCCN1C[C@H](CBr)C1CCC1 2106789159 WRJNUZXRVPJTFN-WMLDXEAASA-N 443.348 4.719 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](C(F)(F)F)CCN1CC1(CBr)CCC1 2107584183 MQPOQPMSTKBFCT-UONOGXRCSA-N 443.348 4.719 50 10 IJGE Cc1cc(C(=O)N[C@@H](CCBr)C(C)(C)C)ccc1I 2142106342 JIPCWCZIKQCKOW-ZDUSSCGKSA-N 438.147 4.529 50 10 IJGE CCCC1(NC(=O)OC(C)(C)C)CCN(C(=O)c2ccc(CBr)cc2)CC1 2162871756 LVINQIVPTJCBGE-UHFFFAOYSA-N 439.394 4.881 50 10 IJGE CS(=O)(=O)c1ccc([C@@H](Cl)c2ccc(Br)cc2Br)cc1 2203683149 KHGGGXCQGXBHSO-CQSZACIVSA-N 438.568 4.943 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)[C@H](CBr)CC1CC1 2219033867 KJLXKWNAQAOCTD-LBPRGKRZSA-N 442.566 4.940 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1cc(C)c(Br)c(C)c1 2227416706 GRVOGNGSFIRSFW-RNCFNFMXSA-N 438.147 4.645 50 10 IJGE CC[S@@](=O)CCn1c([C@@H](C)Cl)nc2cc(Br)c(Br)cc21 2234059311 IJTSIKHNFHEYQM-ZPWHCFADSA-N 442.604 4.630 50 10 IJGE COc1ccc([C@@H](Br)C23CC(C)(C2)O[C@@H]3C)cc1I 2269545171 MTMJSYUUCKRUFP-JKIGLROPSA-N 437.115 4.693 50 10 IJGE Cc1ccc(C(=O)Oc2ccc(C=C(C#N)C(=O)Nc3cccc([N+](=O)[O-])c3)cc2)cc1 2293038531 JIYPZAVSQUPJIL-UHFFFAOYSA-N 427.416 4.668 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)ccc1O 2296819165 IQFAADTWDDWXNR-UHFFFAOYSA-N 439.924 4.956 50 10 IJGE CC(C)[C@H](CBr)N(C)C(=O)c1scc(Br)c1Br 2302553652 ORARDBGYGAXBGC-QMMMGPOBSA-N 448.018 4.765 50 10 IJGE C[C@H](NC(=O)C(C#N)=CNc1cccc(Br)c1)C12CC3CC(CC(C3)C1)C2 2324904392 VEPOWYNJPYNKGU-HIGJEIRPSA-N 428.374 4.990 50 10 IJGE Cc1nn(Cc2ccccc2)c2c1[C@H](NC(=O)C(C#N)=Cc1cccc(Cl)c1)CCC2 2329676810 WSXABTDNDSNEEF-JOCHJYFZSA-N 430.939 4.994 50 10 IJGE O=S(=O)(N[C@H](CCCl)COCc1ccccc1)c1ccc(Cl)c(F)c1Cl 2343789974 WXFHSKKBEZBLCD-CYBMUJFWSA-N 440.751 4.625 50 10 IJGE CCCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2351888867 LNSDIWQJRGFPMM-YJBOKZPZSA-N 439.385 4.908 50 10 IJGE FC1(F)C[C@]12C[C@H]2CO[C@@H](CI)c1ccccc1Br 2352505661 BOWCPUHVJBNJGG-XDTLVQLUSA-N 443.069 4.987 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc([N+](=O)[O-])cc4)ccc32)cc1 38677026 VOKMOKWHBBBVFZ-QHCPKHFHSA-N 441.443 4.595 50 10 IJGE Cc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1cccc([N+](=O)[O-])c1)CCC2 40813052 OOJMMHHZURGVKV-LGUFXXKBSA-N 446.463 4.527 50 10 IJGE Cc1occc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3cccc(Cl)c3)c(C)c21 40823532 NXLCUJHOUWGAJX-KOEQRZSOSA-N 425.872 4.866 50 10 IJGE O=C(N/N=C/c1ccc(O)cc1O)c1ccc(OCc2ccc(Cl)cc2Cl)cc1 48573885 YOHDWBRZJAFYRO-BHGWPJFGSA-N 431.275 4.748 50 10 IJGE CCN(CC)c1ccc(/C=N/NC(=O)CCCSc2nc3ccccc3n2CC)cc1 58988632 KQBGPILBPDQQSV-XIEYBQDHSA-N 437.613 4.925 50 10 IJGE COc1ccc(CN(C(=O)CCl)[C@H](C(=O)NC2CCCCC2)c2ccc(C)cc2)cc1 97914437 IMRZQQGGPZSBIZ-DEOSSOPVSA-N 442.987 4.761 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2nc(-c3ccccc3)sc2C)cc(Cl)c1OC 169927220 LAKOKOUMHICLAK-FMCGGJTJSA-N 429.929 4.943 50 10 IJGE COc1ccc([C@@H](C)N/C=C(/C#N)C(=O)NC(c2ccccc2)c2ccccc2)cc1OC 216974197 RTUWNWOMXHTZJU-UPHPNCSHSA-N 441.531 4.668 50 10 IJGE COc1ccc([C@H](C)NC(=O)/C(C#N)=C\N[C@@H](C)c2ccc3c(c2)CCCC3)cc1OC 217171639 OPCXVARRIOFILS-KHQGJTGOSA-N 433.552 4.518 50 10 IJGE COCC[C@@H](C)Oc1c(Br)cc(CBr)cc1Br 234667023 VLTHHZOELKKMNN-MRVPVSSYSA-N 430.962 4.910 50 10 IJGE COc1ccc(CNCCCCCCI)cc1Br 234870549 MGPNWCXAJBYKKE-UHFFFAOYSA-N 426.136 4.543 50 10 IJGE CC[C@H](C)c1ccc(OCC(=O)NNC(=O)[C@H](C)Oc2ccccc2[C@H](C)CC)cc1 251372926 RCXUKSVJHCWPPQ-OTWHNJEPSA-N 426.557 4.707 50 10 IJGE CCn1cc([C@@H](Br)c2sccc2Br)nc1Br 698483126 UHXVJWNIHYSHBV-MRVPVSSYSA-N 428.975 4.974 50 10 IJGE O=C(Nc1ccc(CBr)cc1)c1cccc(F)c1I 721656898 CCJGOEMLQDVLBR-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE Cn1cc(C(=O)NNC(=O)[C@H](Sc2ccc(F)cc2)c2ccccc2)c2ccccc21 730207289 NGHAKVUPCUKKGD-JOCHJYFZSA-N 433.508 4.612 50 10 IJGE Cc1ccccc1CC(=O)NNC(=O)N[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 764351674 AXKBIBCGPRMICR-OAHLLOKOSA-N 442.972 4.714 50 10 IJGE O=C(NNc1ccc([N+](=O)[O-])cc1)Nc1ccc(C(=O)N2CCC[C@H]2c2ccccc2)cc1 775613020 JUCZYWWFSYGQEP-QFIPXVFZSA-N 445.479 4.721 50 10 IJGE N#Cc1ccc(NC(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)c(Cl)c1 806357482 FQDZRJUOCFRVGQ-UHFFFAOYSA-N 432.793 4.836 50 10 IJGE Cc1ccccc1NC(=O)C(=O)NN=Cc1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1084205604 XRRKQXJEHOCKOZ-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE Cc1cc(C=NNC(=O)c2ccccc2Cl)c(C)n1-c1ccc(C(=O)O)c(Cl)c1 1084410638 VBZSSTJBAGVIFO-UHFFFAOYSA-N 430.291 4.863 50 10 IJGE C=C[C@@H](CC(=O)NNC(=O)c1ccc(COc2ccc(OCC)cc2)cc1)c1ccccc1 1264174769 NDUJJVCYRFGXGB-NRFANRHFSA-N 444.531 4.785 50 10 IJGE C=CCO[C@@H]1CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3cccc4ccccc34)c2C)C1 1435663541 CRNSWMFSEJZJBQ-VOGGAGISSA-N 425.532 4.958 50 10 IJGE C=CC[C@H]1CCCC[C@@H]1NC(=O)NNC(=O)Nc1ccc(Br)cc1Cl 1682683256 KOOXSOXCDGOBHT-FZMZJTMJSA-N 429.746 4.573 50 10 IJGE CCCCCCOc1ccc(C=NNC(=O)COc2ccc(OCC)cc2)cc1OC 1772754714 QYFZMZLDXWKESP-UHFFFAOYSA-N 428.529 4.582 50 10 IJGE C[C@H](c1cc(Br)ccc1F)[C@@H](CBr)NC(=O)OC(C)(C)C 1885098288 XMVBMBNWKYPSIK-NOZJJQNGSA-N 425.136 4.980 50 10 IJGE C[C@H](CC(=O)N(C)C[C@@H]1C[C@@H]1Br)c1ccc(NC(=O)OC(C)(C)C)cc1 1887829864 OYYBWYZIWMKNAN-KMFMINBZSA-N 425.367 4.769 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)c1nccn2nc(C(F)(F)F)cc12 1915083216 OJZZUNSBWVJUNP-CQSZACIVSA-N 427.268 4.928 50 10 IJGE CC[C@H]1CN(C(=O)c2csc(Br)c2Br)C[C@H]1Br 1945187632 YOJHLHXJDVCKAP-POYBYMJQSA-N 446.002 4.519 50 10 IJGE CCc1nc(C(=O)N(Cc2ccccc2)[C@@H](C)CBr)c(Br)s1 1961181544 BQCKVBSTKFLFNG-NSHDSACASA-N 446.208 4.894 50 10 IJGE COc1cc(NCC2CC(Br)C2)c(Br)cc1Br 2020209076 WGYQNQOYQNDOIE-UHFFFAOYSA-N 427.962 4.806 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1ccc(OCc2ccccc2)cc1 2023034393 SHNZBVDDBAFESQ-BEFAXECRSA-N 437.321 4.845 50 10 IJGE CC1(C)C[C@@H](O[C@H](CI)c2cccc(Br)c2)CO1 2052239723 HTRJEFGOMDLOKB-CHWSQXEVSA-N 425.104 4.509 50 10 IJGE Cc1ccc(Cn2nc(CCl)c(I)c2C(F)(F)F)cc1F 2079211009 GSXGIZJVWHVAMC-UHFFFAOYSA-N 432.586 4.741 50 10 IJGE Cc1c(Br)ccc([C@@H](Br)[C@@]2(C)COCCO2)c1Br 2083319178 WJAJOUYPBKDAMF-CHWSQXEVSA-N 442.973 4.762 50 10 IJGE C[C@H]1CN(C[C@H](CBr)c2ccccc2)C[C@@H](C)[C@@H]1NC(=O)OC(C)(C)C 2106789132 WLSLYOKAWVMGPU-OGWHTMIXSA-N 425.411 4.646 50 10 IJGE CC[C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CN1CC1(CBr)CCCCC1 2106789564 ZHVSBBYSKXKFAV-KZNAEPCWSA-N 429.443 4.909 50 10 IJGE Cc1cc(Br)c(C)c([C@H](Cl)[C@@H]2CCS(=O)(=O)C2)c1Br 2136372511 UNBMQSWQUJFOII-NOZJJQNGSA-N 430.589 4.543 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@H](Cl)c2sc(Br)cc2Br)C1 2137239065 PHEZFEIXNJBHNQ-UPZJHPNMSA-N 448.629 4.768 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@H](CBr)c2ccccc2)CCC1(F)F 2163057414 BFYKMUHCLXSXAV-IAGOWNOFSA-N 447.364 4.790 50 10 IJGE F[C@]12CCC[C@]1(CBr)CN(Cc1ncc(Br)cc1Cl)C2 2183581814 QAPHTMKURLSGRF-KBPBESRZSA-N 426.555 4.587 50 10 IJGE O=C(c1ccsc1Br)N1CCC(CBr)(CC(F)F)CC1 2188337401 MXJBOMFZCXONQQ-UHFFFAOYSA-N 431.140 4.783 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1scc(Br)c1Cl 2253552438 QLQYRAJKBSPNGQ-SSDOTTSWSA-N 435.634 4.801 50 10 IJGE ClCc1nc(OCc2cc(Br)ccc2Cl)ncc1Br 2277790030 FKCLHVZQJKQJNM-UHFFFAOYSA-N 426.923 4.973 50 10 IJGE O=C(N[C@@H](CCl)C1CCCCC1)c1ccc(Cl)c(I)c1 2283665568 NSVMKTIKHZSPCO-AWEZNQCLSA-N 426.125 4.862 50 10 IJGE CC[C@@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@H]1CBr 2285961189 XPUPATWTXPDDQO-RKDXNWHRSA-N 427.539 4.735 50 10 IJGE N#CC(=Cc1cn(CC(=O)Nc2ccccc2)c2ccccc12)C(=O)Nc1ccc(F)cc1 2294168469 MTQLFDCSTHIUGN-UHFFFAOYSA-N 438.462 4.965 50 10 IJGE COc1cccc(C=C(C#N)c2nn(-c3ccccc3)c(N)c2C#N)c1OCc1ccccc1 2296648901 BWYAGEKERVFOQB-UHFFFAOYSA-N 447.498 4.978 50 10 IJGE COc1ccc(-c2csc(C(C#N)=Cc3ccc(OC(C)=O)c(OC)c3)n2)cc1OC 2296763975 QEXFVVJPRKDTCR-UHFFFAOYSA-N 436.489 4.825 50 10 IJGE C[C@H](Br)CCCN(C)Cc1cc(Cl)ccc1I 2299546395 ZXRABNDCBSANSH-JTQLQIEISA-N 430.555 4.940 50 10 IJGE CC[C@@H](Br)C(=O)c1c(C)cc(Br)c(OC)c1Br 2301503276 SDNXSRXWKUCKPH-SSDOTTSWSA-N 428.946 4.885 50 10 IJGE C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)C=Cc1cccc2ccccc12 2313540945 FHTAAYZPVAKHHC-CQSZACIVSA-N 429.303 4.775 50 10 IJGE BrC[C@H]1CN(Cc2sccc2I)CCC12CCC2 2316765636 ZDDKDSBCFZCQFH-NSHDSACASA-N 440.188 4.740 50 10 IJGE COc1ccc(Cl)c(CC(=O)NN=Cc2ccc(OC(C)C)c(Br)c2)c1 2323676322 JSZBCVUKHZGLON-UHFFFAOYSA-N 439.737 4.591 50 10 IJGE C[C@H]1CCC[C@@H](C)N1C=C(C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 2324605999 IPDGRCWTWVYUKB-ZRZAMGCNSA-N 442.607 4.591 50 10 IJGE ClCc1nc(OCc2c(Br)cccc2Br)ncc1Cl 2340579773 FSXJHCHXBAGJNB-UHFFFAOYSA-N 426.923 4.973 50 10 IJGE Cc1cccc(CO[C@H](CI)c2cccc(Br)c2)n1 2341710873 XIEZFZHLONPDOT-OAHLLOKOSA-N 432.099 4.845 50 10 IJGE Cc1ccc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)c2nc3ccccc3n2C)cc1 35549682 WCUIHHJDPUWSEM-OBGWFSINSA-N 433.471 4.746 50 10 IJGE COc1cccc(/C=N/NC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)c1OC 40866538 AERSMISWYQMUAI-WPWMEQJKSA-N 432.520 4.559 50 10 IJGE O=S1(=O)CCCC[C@H]1[C@H](Br)c1cc(Cl)c(Br)cc1F 97896032 MCFLMJRDBHERGU-NWDGAFQWSA-N 434.552 4.645 50 10 IJGE Fc1ccc([C@H](Br)c2ccc3c(c2)OCCO3)c(I)c1 236224023 HGQBLAJZUQDRBX-OAHLLOKOSA-N 449.057 4.686 50 10 IJGE Cc1nnc(SCC(=O)NN=Cc2cccc(OCc3cccc4ccccc34)c2)s1 254288529 DEPDCFLDUVKPQK-UHFFFAOYSA-N 448.573 4.821 50 10 IJGE ClCc1cc(Br)ccc1N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21 404217739 ZZKJOLZJFHESES-NHCUHLMSSA-N 435.793 4.668 50 10 IJGE CC1(C)CN(C(=O)c2scc(Br)c2Br)C[C@H]1Br 705429120 WBIVNFQIGUGHHC-SSDOTTSWSA-N 446.002 4.519 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3C[C@@H](Br)C[C@H]2C3)c1 709787223 JKDIZSOWOWMXSR-UFGOTCBOSA-N 440.550 4.692 50 10 IJGE C[C@@H](Cl)c1nnc(-c2ccc(I)c(Br)c2)s1 721581072 WWRNUVMDPNRAKB-RXMQYKEDSA-N 429.508 4.872 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)c1ccc(Oc2ccc(Br)cc2)nc1 727759897 GXYMAGBSIYFODS-UHFFFAOYSA-N 438.203 4.811 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cccc(-c3nc[nH]n3)c2)c(C)n1-c1ccccc1F 733980178 NRGNMRCFYKEWTE-ODLFYWEKSA-N 426.455 4.564 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2nnc(-c3cccc(Cl)c3)s2)c(C(F)(F)F)c1 799413098 LVBSTZWWDLPZMK-UHFFFAOYSA-N 438.822 4.898 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2C[C@H]3CCC[C@@H](C3)C2)c(-c2ccc(Cl)cc2)n1 804342464 HJWRFOABDRDZKO-XENGFHBVSA-N 433.943 4.673 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cccc(Oc3cccc(C)c3)c2)cc1 1208493909 XHJDXXUFICYVPT-GOSISDBHSA-N 447.491 4.610 50 10 IJGE CCOc1ccc(CCCC(=O)NNc2nc3ccccc3[nH]c2=S)cc1OCC 1557584646 YRHGUFBSNRNQNV-UHFFFAOYSA-N 426.542 4.556 50 10 IJGE C=CC[C@H]1CCCC[C@@H]1NC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl 1636883804 VXPTXFICJXMMBB-YOEHRIQHSA-N 428.360 4.618 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865684290 VYHQNIHLQNZRHW-JOCHJYFZSA-N 447.970 4.821 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)[C@H]1CCCN(C(=O)OC(C)(C)C)CCC1(F)F 1893342228 NKGMJHFLZZQWEZ-ZIAGYGMSSA-N 426.932 4.791 50 10 IJGE CN(N[C@@H]1CCCN(C(=O)OC(C)(C)C)C12CCCCC2)C(=O)OCc1ccccc1 1903413985 VSWPHNCJJYGIFU-HXUWFJFHSA-N 431.577 4.862 50 10 IJGE O=C(c1csnc1Br)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1925217302 SIQALDJEOLQOBM-AWEZNQCLSA-N 444.192 4.722 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C2CCN(C[C@@H](CBr)C3CCC3)CC2)C1 1966288538 QYPWQSPSDJLHCQ-RTBURBONSA-N 429.443 4.767 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@H]1CCCN(C[C@@H](CBr)C2CC2)C1 1966339757 SWKPNBWNWFVFSJ-IPMKNSEASA-N 429.443 4.909 50 10 IJGE C[C@]1(CCBr)CCN1C(=O)c1cc(Br)c(Br)s1 2025216708 QDBKPWZMSUIZEC-NSHDSACASA-N 446.002 4.663 50 10 IJGE Clc1cc(CN2CCCC[C@H]2CBr)ccc1I 2026564981 XZDSFNUFJNIAQA-NSHDSACASA-N 428.539 4.694 50 10 IJGE Clc1ccc(I)c(C[C@]2(CBr)C[C@@]23CCOC3)c1 2039014789 GOOJZDNRAMCKSY-ZIAGYGMSSA-N 441.534 4.679 50 10 IJGE COC[C@@H]1C[C@@H]1COc1c(Br)cc(Br)cc1CBr 2069753869 PHKNEVKWFXTYLI-VHSXEESVSA-N 442.973 4.768 50 10 IJGE COc1cc(F)ccc1Cn1nc(CBr)c(Br)c1C(F)(F)F 2079234415 WBDDQKWPUJOJAM-UHFFFAOYSA-N 446.036 4.755 50 10 IJGE CN(C(=O)c1cccc(OCc2ccccc2)c1)C1(CBr)CCSCC1 2114723374 SGXDTEYRPYIPCG-UHFFFAOYSA-N 434.399 4.998 50 10 IJGE C[C@@]1(CBr)CC(F)(F)CN1C(=O)c1cc(Br)ccc1Cl 2159048680 GWOWUZKIWVGROG-LBPRGKRZSA-N 431.502 4.737 50 10 IJGE Cc1sc(C(=O)N2[C@H]3CC[C@H]2[C@@H](F)[C@H](Br)C3)c(Br)c1C 2237632903 DVHHHNZRHUCPEZ-WYFGTUCQSA-N 425.161 4.606 50 10 IJGE Fc1cccc(I)c1[C@@H](Br)c1ncn2ccsc12 2255963354 IXQWDJWANXDLII-SNVBAGLBSA-N 437.075 4.624 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1cccc(Cl)c1Br 2267941910 XECFAOPXKJBYED-VIFPVBQESA-N 429.605 4.739 50 10 IJGE Brc1ccccc1[C@@H](CI)OC1(C2CCC2)COC1 2272932590 ZPIGNFKDJKEKGS-CQSZACIVSA-N 437.115 4.511 50 10 IJGE CN(CC[C@@H](NC(=O)c1ccc(CBr)cc1)C(C)(C)C)C(=O)OC(C)(C)C 2296006013 LKHUZFOUSGNSRF-QGZVFWFLSA-N 441.410 4.983 50 10 IJGE N#CC(=Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(=O)Nc1ccccc1C(=O)O 2297306965 NDXDZAFTXXGXJF-UHFFFAOYSA-N 437.795 4.752 50 10 IJGE C[P@]1(=O)C[C@@H](Br)[C@H](Cc2ccc(Cl)c(I)c2)C1 2300238426 KSGOKAWHNQIJSU-VHCOLVSPSA-N 447.478 4.873 50 10 IJGE CCCN(Cc1ccc(I)c(Br)c1)C[C@H](C)Cl 2306218930 GQJOORISLWAYGK-JTQLQIEISA-N 430.555 4.893 50 10 IJGE CCCOc1cccc(C=NNC(=O)c2ccc(Nc3nc(O)c4ccccc4n3)cc2)c1 2323766481 FHXLYSOBLJJRBS-UHFFFAOYSA-N 441.491 4.632 50 10 IJGE C[C@](CI)(OC[C@H]1C[C@@H](F)C1)c1ccccc1Br 2327340110 FMUMOMSVGCVQMP-UHIISALHSA-N 427.095 4.864 50 10 IJGE Clc1ccc(I)cc1CN[C@H](CBr)C1CCCC1 2327397754 UXVSPUJENYZHLG-CQSZACIVSA-N 442.566 4.988 50 10 IJGE COc1ccc(C=C(C#N)C(=O)NC2(c3ccc(Br)cc3)CCC2)cc1OC 2329700976 GFVYBGRZGYUUSW-UHFFFAOYSA-N 441.325 4.569 50 10 IJGE C[C@@H]1CCC[C@@H](CO[C@H](CI)c2cccc(Br)c2)O1 2338704610 FLBQMECFUHCNDM-BYCMXARLSA-N 439.131 4.899 50 10 IJGE Cc1csc(C(=O)N2CCC[C@@H](Br)[C@H]2C(F)(F)F)c1Br 2370253288 VSGILXMSDYXOJB-XCBNKYQSSA-N 435.103 4.749 50 10 IJGE COc1ccc2nc(/C(C#N)=C/c3ccccc3OCc3ccc(C(=O)O)cc3)[nH]c2c1 33476937 WQJBGWYYHQZNKU-XDHOZWIPSA-N 425.444 4.913 50 10 IJGE Cc1ccc(SCC(=O)Oc2ccc(/C=C(\C#N)C(=O)NCc3ccco3)cc2)cc1 40947018 WVVRPCDZONKOBM-CPNJWEJPSA-N 432.501 4.509 50 10 IJGE COc1cccc(/C(CSc2nc3ccccc3s2)=N\NC(=O)c2cccnc2)c1 59460753 ABRIBOKGBLYWHO-PLRJNAJWSA-N 434.546 4.626 50 10 IJGE CCCCCCCCOc1ccc(/C=N/NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 103738171 MMUJPUONSSFFIM-JJIBRWJFSA-N 427.501 4.863 50 10 IJGE CCOC(=O)c1ccc(CN/C=C(/C#N)C(=O)N[C@H](CC)c2ccc3c(c2)CCCC3)cc1 217193037 BFJXXEBYJRUMKG-IURUZKCNSA-N 445.563 4.507 50 10 IJGE O=C(NC1(CBr)CCCC1)c1cc(Br)cc(Br)c1 232475792 FNSUJADVQCYLJS-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE COc1ccc([C@H](Br)c2ccc(F)cc2I)s1 383674031 OXIBDLHMSBJAGC-GFCCVEGCSA-N 427.076 4.985 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CCC[C@H](Br)CC1 386100180 QYHXMZJYSIZCDX-JTQLQIEISA-N 439.973 4.601 50 10 IJGE C[C@H]1[C@@H](CBr)CCN1C(=O)c1cc(Br)c(Br)s1 395201794 MLKKOBSIQFLDOL-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE CC[C@H](NC(=O)c1cc(Br)c(Br)s1)[C@@H](C)Br 395706516 OHVGGBFPKZXDTG-VDTYLAMSSA-N 433.991 4.565 50 10 IJGE O=c1sccn1CCC(CBr)(CBr)c1cccc(Cl)c1 700205966 ADDRUHGMVOTDBF-UHFFFAOYSA-N 439.600 4.681 50 10 IJGE CN(CC1CCN(Cc2ccccc2)CC1)c1nc2ccccn2c1CBr 720015661 CHXINUGPBTVRGL-UHFFFAOYSA-N 427.390 4.578 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)n2ccc(=NCC(F)(F)F)cc2)c(C)n1-c1ccccc1F 775493081 GNJBBBXACUGDRF-PDGQHHTCSA-N 442.416 4.745 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccnc(Sc3ccccn3)c2)c(C(F)(F)F)c1 799395805 BMVJICGAMYVNBE-UHFFFAOYSA-N 430.415 4.667 50 10 IJGE COc1ccc2cc([C@@H](C)C(=O)NN=Cc3ccc(O)c(Br)c3)ccc2c1 1083895531 KZDFDBKZWKCQAV-CYBMUJFWSA-N 427.298 4.570 50 10 IJGE COc1cccc(C(=O)NN=C2C(=O)N(Cc3cccc4ccccc34)c3ccccc32)c1 1083971174 KJOCSMKOXWPKCD-UHFFFAOYSA-N 435.483 4.529 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C)[C@@H]1CCCO1 1459223772 JFDCTZXBHAXILF-RTIZDZOHSA-N 442.346 4.605 50 10 IJGE C=CCN(CCC#N)C(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1468405970 SFTNCWAHJFDIIJ-UYRXBGFRSA-N 426.442 4.948 50 10 IJGE CC(=O)c1c(C)[nH]c(C(=O)NNc2cccc(OC(F)F)c2Br)c1C(C)C 1595245969 YAGGMVOMHDSPMC-UHFFFAOYSA-N 444.276 4.770 50 10 IJGE CCOc1ccc(C=NNC(=O)COc2ccc(Br)cc2C(C)C)cc1OC 1772756078 YPAMJMCQGITLSV-UHFFFAOYSA-N 449.345 4.509 50 10 IJGE CCCOc1c(OC)cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccc(C)cc1 1865694492 YOPFSPFFJIGCKK-HSZRJFAPSA-N 444.535 4.564 50 10 IJGE COc1cc(/C=N/NC(=O)c2ccc(SCC(C)C)cc2)cc(Br)c1O 1865760784 OOSAWVLUPCSKGD-UFFVCSGVSA-N 437.359 4.675 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 1880762980 ZZPUHVIUKCZAAS-KGLIPLIRSA-N 435.403 4.558 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)CCc1cccc(NC(=O)OC(C)(C)C)c1 1887832994 MHDAGLMWXSPROR-WKILWMFISA-N 425.367 4.598 50 10 IJGE CC(C)[C@H](C)[C@H](C)O[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1901527240 SMRFVCWQMLUNEX-RLFYNMQTSA-N 439.378 4.888 50 10 IJGE O=C1c2ccccc2C(=O)N1CCCc1nccn1-c1ccc(F)c(Cl)c1CCl 1912989522 MACGQNKVDQIOKF-UHFFFAOYSA-N 432.282 4.632 50 10 IJGE CC(C)(C)OC(=O)NC1CCC2(CC1)CC1(CC[C@@](C)(CI)O1)C2 2007717306 PRKMCTNSHVJTSE-MGILIZQQSA-N 449.373 4.977 50 10 IJGE BrC[C@@H]1[C@H]2CC[C@H](C2)N1Cc1ccc(Br)cc1Br 2058375205 YWDCFVZHITUXKP-MRCXROJRSA-N 438.001 4.959 50 10 IJGE CCC(CC)(CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2066603909 YIOMCELWPZIAOM-ZDUSSCGKSA-N 431.337 4.671 50 10 IJGE FC1(C[C@H](Br)c2cc(I)cc3c2OCC3)CCC1 2084687765 UIWPQYDJHBWINX-LBPRGKRZSA-N 425.079 4.944 50 10 IJGE CC[C@@H]1CN(C[C@@H](CBr)c2ccccc2)CC[C@@H]1NC(=O)OC(C)(C)C 2106789514 YYOBWZFDBJYRKL-QRQLOZEOSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)NC1(c2ccc(NC(=O)N3CCC(Br)CC3)cc2)CC1 2206254038 CZRJSDSLPINISG-UHFFFAOYSA-N 438.366 4.592 50 10 IJGE O=C(O)C[C@H](Br)C(=O)c1c(Br)cc(Cl)c(Cl)c1Cl 2217608908 SVPHACYHRORSIU-BYPYZUCNSA-N 439.314 4.830 50 10 IJGE CCN(C[C@](C)(CI)OC[C@H]1CC[C@H](C)C1)C(=O)OC(C)(C)C 2243467585 OQUXXRPDKHEUMC-MPGHIAIKSA-N 439.378 4.890 50 10 IJGE Cc1cc(Br)c([C@H](Br)c2cscc2S(C)(=O)=O)s1 2260093614 ZMBHDIHKZRULGJ-SNVBAGLBSA-N 430.208 4.768 50 10 IJGE CC1CC(CBr)(CN2CCC(c3n[nH]cc3NC(=O)OC(C)(C)C)CC2)C1 2280053812 BZSXNTQLPKQDPK-UHFFFAOYSA-N 441.414 4.747 50 10 IJGE O=C(NCC[C@@H]1CCC[C@H]1Br)c1cc(F)c(Br)cc1Cl 2282984145 VNAITKKBAAANLX-WCBMZHEXSA-N 427.539 4.925 50 10 IJGE Cc1ccc(-c2ccc(C=C(C#N)C(=O)Nc3c(C)n(C)n(-c4ccccc4)c3=O)o2)cc1 2297228937 HLGMSXUEFZHPAQ-UHFFFAOYSA-N 438.487 4.599 50 10 IJGE Clc1ccc(I)cc1C[C@@]1(CBr)CCCCO1 2307275671 RYZPJGLUGJDKEH-CYBMUJFWSA-N 429.523 4.821 50 10 IJGE CCOc1cc(C=C2C(=O)N(CC)C(=O)C(C#N)=C2C)ccc1OCc1ccc(C)cc1 2314610614 KEQRZZDGBKRKTB-UHFFFAOYSA-N 430.504 4.585 50 10 IJGE Cc1ccc(NC(=O)C(C#N)=CNc2ccc(I)cc2)cc1Cl 2324281527 NUKFBLCANVSPOQ-UHFFFAOYSA-N 437.668 4.711 50 10 IJGE CCCCOc1ccc(C=NNC(=O)CCCCCNC(=O)OC(C)(C)C)cc1OCC 2328835214 HXVLNESENXBYRG-UHFFFAOYSA-N 449.592 4.799 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@@H]2CC[C@@H](Br)[C@H]1C2 2333996280 JSXVTJCSKWCFMF-QXFUBDJGSA-N 427.589 4.942 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@@]1(F)CN(C[C@](C)(CBr)C(C)(C)C)C2 2352078128 OIRAZTMCNKNQME-ZCNNSNEGSA-N 435.422 4.905 50 10 IJGE C[C@H](CCl)[C@@H]1CCCCN1C(=O)c1ccc(Cl)cc1I 2365594117 XPUWRFVHCZAVOW-YGRLFVJLSA-N 426.125 4.814 50 10 IJGE CCCOc1ccc(/C=N/NC(=O)COc2cccc(Br)c2)c(OCCC)c1 3174913 JMXHRSHYXAJITQ-OEAKJJBVSA-N 449.345 4.556 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](CC)C(=O)NNC(=O)COc1cc(C)c(Cl)c(C)c1 10682260 PESIEJVUYRUEBC-MGPUTAFESA-N 446.975 4.854 50 10 IJGE CC(C)(C)c1ccc(C(=O)NC(=S)NNC(=O)c2sc3ccccc3c2Cl)cc1 12573725 NCZYZSDFJQAFEI-UHFFFAOYSA-N 445.997 4.802 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(C)c1/C=N/NC(=O)c1ccc(Br)cc1 59166122 LVWWHOLSEVQXPI-FOKLQQMPSA-N 445.748 4.728 50 10 IJGE Cc1ccc(-n2c(N(C)C)nc(/C=C(/C#N)C(=O)N[C@@H](C)c3ccccc3)c2Cl)cc1 96998146 XRXQZZMFLQKTIZ-FJSNCCPHSA-N 433.943 4.685 50 10 IJGE CC(C)[C@@H](CCBr)NC(=O)c1cc(Br)c(Br)s1 231123420 MBUKHWUASCOPQJ-MRVPVSSYSA-N 448.018 4.813 50 10 IJGE COc1ccc(C=NNC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)cc1OC 256017223 QNPXGYVEYLJIKH-UHFFFAOYSA-N 432.520 4.559 50 10 IJGE Cc1sc(Br)cc1[C@@H](Br)c1cnn(C)c1Br 379198674 GYFYJSMGHZXPRM-SECBINFHSA-N 428.975 4.799 50 10 IJGE C[C@H](CCCBr)CNCc1cc(Cl)ccc1I 405352944 WCNZEOLLSIZDFY-SNVBAGLBSA-N 430.555 4.845 50 10 IJGE FC(F)c1c(Br)ccc(I)c1CBr 575683515 BECWDVDWBOMBQW-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE O=C(NCC1(c2c(Cl)cccc2Cl)CCC1)NNC(=O)c1cccc2cccnc12 772360169 NVMJDPVYPKSYOF-UHFFFAOYSA-N 443.334 4.608 50 10 IJGE N#CCCn1cc(/C=C(\C#N)c2ncc(C(F)(F)F)cc2Cl)c(-c2ccncc2)n1 788349359 KDOFWYBBPHHWAI-RIYZIHGNSA-N 428.805 4.990 50 10 IJGE COc1cc(C=NNC(=O)c2cc3ccccc3o2)ccc1OCc1cccc([N+](=O)[O-])c1 1084478495 BOMMHXQOEXZLGJ-UHFFFAOYSA-N 445.431 4.693 50 10 IJGE C#Cc1ccc(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)c(Cl)c1 1558644162 XXGOHWOQPIIRHV-RGEXLXHISA-N 425.879 4.644 50 10 IJGE C=CCOc1ccc(CC(=O)NNc2ccc(Br)cc2C(F)(F)F)cc1 1565585914 ZINNJLOWLDRXTF-UHFFFAOYSA-N 429.236 4.719 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CC[C@@H]2[C@H](CCN2C(=O)OC(C)(C)C)C1 1882086691 DKDNOIRHHSBGMX-KLHDSHLOSA-N 447.414 4.700 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCC[C@]12CCN(C(=O)OC(C)(C)C)C2 1882088167 PAAMOTDITXEQDP-BXTJHSDWSA-N 447.414 4.702 50 10 IJGE Clc1ccc(I)c(CN2C[C@H](Br)CC3(CC3)C2)c1 1926002641 IFARWULEIOVPQR-LLVKDONJSA-N 440.550 4.694 50 10 IJGE Cc1cc(Br)c(CBr)c(N2CC(N(C)Cc3ccccc3)C2)c1 1981765199 KGKJYRMZAZXPGL-UHFFFAOYSA-N 438.207 4.973 50 10 IJGE Brc1cc2c(cc1[C@H](Br)C1(Br)CC1)OCCO2 2002807849 WYPADDHGIPQAAC-NSHDSACASA-N 426.930 4.584 50 10 IJGE CSCC[C@@H](Cl)CCNC(=O)c1cc(Br)sc1Br 2029925903 ZNLVGHOQBKFBOX-ZETCQYMHSA-N 435.634 4.754 50 10 IJGE CCC[C@H](CBr)CN=[S@@](C)(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C 2044706540 VCXXDWVGGNPTLD-XESHVACXSA-N 441.476 4.835 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2C1CC(Br)C1 2063149337 JUUPCICSVIQFDM-UHFFFAOYSA-N 443.485 4.617 50 10 IJGE Fc1ccc(Cn2nc(CCl)c(I)c2C(F)(F)F)c(F)c1 2079210608 WAHUDNIPPXMOKP-UHFFFAOYSA-N 436.549 4.572 50 10 IJGE C[C@H]1C[C@@H](C)[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)c1ccc(CBr)cc1 2163055165 DTDVORDKJNXTJX-RVKKMQEKSA-N 439.394 4.593 50 10 IJGE CC(C)N(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2167033298 QLHRXIWRFWWMNI-ZWKOTPCHSA-N 445.442 4.967 50 10 IJGE CN(CCCCCI)[C@@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2211188420 ZIVLWOFUJXFYCT-JKSUJKDBSA-N 438.394 4.607 50 10 IJGE CC1(CO[C@](C)(CBr)CNC(=O)OC(C)(C)C)CC2(CC(F)(F)C2)C1 2222928846 ZISCLMVPMWIQSA-MRXNPFEDSA-N 426.342 4.897 50 10 IJGE CO[C@H]1C[C@@H](CO[C@@](C)(CI)c2ccccc2Br)C1 2230050661 UHOXTQKETWMMDK-ZOWXZIJZSA-N 439.131 4.541 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCCC[C@@H](CBr)C1 2282975062 MBOGGBFKOGEXJD-VIFPVBQESA-N 427.539 4.879 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2cn(-c3ccccc3)nc2-c2ccncc2)cc1 2314457947 WDNSJAJECMLWQH-UHFFFAOYSA-N 435.487 4.879 50 10 IJGE Cc1cccc(NC(=O)C(C#N)=Cc2c(Oc3ccccc3)nc3c(C)cccn3c2=O)c1 2314531533 CAMOBSARGCSFBG-UHFFFAOYSA-N 436.471 4.649 50 10 IJGE Clc1cc(CN2CC[C@H]3C[C@]2(CBr)C3)ccc1I 2314969257 GSUSIWAYEXWYIX-VDISTLRHSA-N 440.550 4.694 50 10 IJGE C[C@H]1CCCN(Cc2ccc(Cl)c(I)c2)[C@@H]1CBr 2315551758 VTJJWNVPRASOKG-IINYFYTJSA-N 442.566 4.940 50 10 IJGE Clc1ccc(CN2C[C@@H](Br)[C@H](C3CC3)C2)cc1I 2315552671 HNKIYQIDIGJKJV-NWDGAFQWSA-N 440.550 4.550 50 10 IJGE Cc1cc([C@H](Br)c2c(Br)c(Br)nn2C)ccc1F 2316724167 ITARGYSAICLZHI-VIFPVBQESA-N 440.936 4.877 50 10 IJGE Clc1ccc(C[C@@]2(CBr)C[C@]23CCOC3)c(I)c1 2318528323 DMSZMGKQBKUVAD-KBPBESRZSA-N 441.534 4.679 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Cl)C1CCS(=O)(=O)CC1 2365190015 AHPGSAPZPWBZCW-LBPRGKRZSA-N 448.579 4.764 50 10 IJGE CC(C)(C)OC(=O)NCCCOC1CCN(C[C@](C)(CBr)C(C)(C)C)CC1 2380198099 YCLOBZOYWCPFBV-NRFANRHFSA-N 449.474 4.830 50 10 IJGE O=C(N/N=C/c1ccc(OCc2ccccc2)cc1)[C@@H]1COc2cc3ccccc3cc2O1 1207659 YGUPPHNVAZHTDW-YYKYCJCRSA-N 438.483 4.709 50 10 IJGE CCOc1ccc(Oc2c(/C=N/NC(=O)c3cccnc3)c(C)nn2-c2ccccc2)cc1 3335352 ZHJBHVRBUYIDAB-WPWMEQJKSA-N 441.491 4.531 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(C)cc2)cc1 38649202 OFKVPPZGHQKZPU-XMMPIXPASA-N 426.472 4.831 50 10 IJGE N#C/C(=C/c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1)C(=O)Nc1ccc(C(=O)O)cc1 96501167 NYGVJFGPSDSDGX-LCYFTJDESA-N 437.795 4.752 50 10 IJGE CCn1nc(C)c(/C=C(/C#N)C(=O)Nc2sc(-c3ccccc3)cc2C(=O)OC)c1C 98063410 AYUJDNSOQQXWPS-BOPFTXTBSA-N 434.521 4.581 50 10 IJGE CCCOc1ccc(/C=N/NC(=O)Cc2cc(OC)ccc2Cl)cc1Br 169922061 UWOCGWMCGKLOSV-WSDLNYQXSA-N 439.737 4.593 50 10 IJGE CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)NN=Cc1cccc(Oc2ccccc2)c1 252618581 LHTDVZYQGDZNQS-NTKDMRAZSA-N 429.520 4.774 50 10 IJGE O=S1(=O)CC[C@@H](C(CBr)(CBr)CCC2CCCCC2)C1 312217262 WXOAKDVLTGHJPO-CQSZACIVSA-N 430.246 4.558 50 10 IJGE COc1cc([C@H]2CN(Cc3ccccc3)C[C@@H]2CI)ccc1Cl 382683375 CNGNDUZHGULHOV-DLBZAZTESA-N 441.740 4.999 50 10 IJGE ClCc1cc(Br)ccc1N1CCO[C@H]2CCN(Cc3ccccc3)C[C@@H]21 404217742 ZZKJOLZJFHESES-SFTDATJTSA-N 435.793 4.668 50 10 IJGE N#CSc1ccc(NC(=O)Nc2cccc(C(=O)N(CCO)Cc3ccccc3)c2)cc1 586718448 UJJYEAXHMWXYGX-UHFFFAOYSA-N 446.532 4.538 50 10 IJGE CN(C(=O)c1cc(Br)ccc1Br)[C@H]1CCC[C@H]1Br 709269742 YLJLGIWXDBZCRK-NEPJUHHUSA-N 439.973 4.600 50 10 IJGE O=[N+]([O-])c1ccc(-n2nc(-c3ccc(Cl)c([N+](=O)[O-])c3)cc2CCl)c([N+](=O)[O-])c1 725428292 BPNZOXQHJNIJKT-UHFFFAOYSA-N 438.183 4.656 50 10 IJGE CC(C)c1nn(Cc2ccccc2)c(Cl)c1C=NNC(=O)c1cn(C)c2ccccc12 754713822 NYDUWIJZSOUDOB-UHFFFAOYSA-N 433.943 4.964 50 10 IJGE CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)[C@@H](Br)C(C)(C)C 767958298 DFDODLQRNYGIIW-OAHLLOKOSA-N 437.300 4.691 50 10 IJGE CCOc1ccc(C=NNC(=O)COc2ccc3ccccc3c2Br)cc1 1084258061 JHGGCULEUKPNRP-UHFFFAOYSA-N 427.298 4.530 50 10 IJGE C/C(=C\C(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(C)c1C)c1ccc(F)cc1 1543608326 UCIZGMKXTHPOES-BMRADRMJSA-N 442.494 4.688 50 10 IJGE CCCCCCOc1ccc([C@@H]2CN(C(C)=O)C[C@H]2CI)cc1 1614613634 ANFSMNPFVMKKKV-MJGOQNOKSA-N 429.342 4.643 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccc(C)cc2)c1 1865690071 ICJNFBXQGCYDGK-SFHVURJKSA-N 440.425 4.816 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2Cl)cc1 1865712996 NYHFIICZYDKQRJ-INIZCTEOSA-N 446.816 4.771 50 10 IJGE Cc1nc(-c2ccc(F)cc2)ccc1C(=O)NNC(=O)C(c1ccccc1)c1ccccc1 1865759722 PBDNJDDTIVCBPI-UHFFFAOYSA-N 439.490 4.789 50 10 IJGE CO[C@@H]1C[C@]2([C@H](Br)c3sc(Cl)cc3I)C[C@H]12 1900924530 MSVJMGTXPBZUKF-YRKGHMEHSA-N 433.536 4.867 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)C(=O)Cc1ccc(Br)cc1 1914608009 OALDLFVAOZRSJG-AWEZNQCLSA-N 425.164 4.804 50 10 IJGE Brc1ccc([C@H](CI)O[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1 1917452363 FHBJDBGZROQISR-QKRFXLAJSA-N 433.127 4.986 50 10 IJGE Cc1c(Br)sc([C@H](Br)[C@@H]2OCCO[C@@H]2C)c1Br 1922921421 QPBZUYFAPBEDSW-FTLITQJKSA-N 449.002 4.821 50 10 IJGE CC[C@H](CBr)N(C)C(=O)c1csc(Br)c1Br 1937737135 FMVQGXURJQCYEJ-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCC3(CC2)CC[C@@](C)(CI)O3)C1 1950142078 YOVIDPUNETZGAW-VIQWUECVSA-N 449.373 4.931 50 10 IJGE Clc1cc(C[C@@]2(CBr)CCCCO2)ccc1I 2026570688 UEAYYOIYRSXEKP-CYBMUJFWSA-N 429.523 4.821 50 10 IJGE C[C@H](CCCCBr)NC(=O)c1cccc(Br)c1Br 2031478250 QLQOZAQPOPXUQP-SECBINFHSA-N 441.989 4.895 50 10 IJGE FC(F)c1c(I)ccc(I)c1CCl 2060238425 JBVNNRWIWMSWBM-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE Cc1c([C@@H](Br)c2ccc(F)c(Br)c2)c(Br)nn1C 2067860533 NRJARCNCGSTAJB-NSHDSACASA-N 440.936 4.877 50 10 IJGE Clc1cc(C[C@@]2(CBr)C[C@@]23CCOC3)ccc1I 2086651616 JRGUJFADHIGCTG-KGLIPLIRSA-N 441.534 4.679 50 10 IJGE CC(C)[C@@H](Br)C(=O)N1C[C@H](C)N(C(=O)OC(C)(C)C)Cc2ccccc21 2106773346 RQKJUKQHGWUIRX-WMLDXEAASA-N 425.367 4.578 50 10 IJGE ClCc1nc2ncccc2n1-c1cc(Br)ccc1I 2119397187 JJRDELKGWZILQE-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE COCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)CC1(CBr)CCCCC1 2163058637 MCXGBYWUANWTNW-SFHVURJKSA-N 447.458 4.680 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CCCCI)C2(CCCCC2)C1 2243588681 FKTLURLRFUVXAS-OAHLLOKOSA-N 436.378 4.504 50 10 IJGE COC(=O)c1ccc(COc2ccc(C=C(C#N)c3nc4ccccc4[nH]3)cc2OC)o1 2297369812 XUGLAAOALNPRSY-UHFFFAOYSA-N 429.432 4.594 50 10 IJGE COc1ccc(N(CCC#N)C(=O)C(C#N)=Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)cc1 2297456626 HAMFFPVEHAHRQT-UHFFFAOYSA-N 442.431 4.717 50 10 IJGE Cc1nc(Br)c([C@H](Br)Cc2cccc(Br)c2)n1C 2315633187 KDLOXNFDPPNGDK-LLVKDONJSA-N 436.973 4.932 50 10 IJGE CCCCCCOc1ccc(C=NNC(=O)c2ccc3nc(S)[nH]c3c2)cc1OC 2323603976 UGOMQRHLFZYWGQ-UHFFFAOYSA-N 426.542 4.583 50 10 IJGE O=C(NN=Cc1ccc(Cl)c(Cl)c1)c1cccn(Cc2ccccc2Cl)c1=O 2323653156 MLNCGZKHSDOYOL-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE CN(C[C@](C)(CBr)C(C)(C)C)[C@H](CNC(=O)OC(C)(C)C)C(F)(F)F 2327107418 VUUFRUMPLIXEDM-WBMJQRKESA-N 433.353 4.821 50 10 IJGE COc1ccc(-c2csc(C(C#N)=Cc3cc4c(cc3[N+](=O)[O-])OCCO4)n2)cc1F 2331456519 YENBPRPKUFXCPF-UHFFFAOYSA-N 439.424 4.701 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1C[C@@H]2C[C@H]1CN(CC1(CBr)CCCCCC1)C2 2333675297 ZSZQENBRCAIMLN-BZSNNMDCSA-N 429.443 4.957 50 10 IJGE CC1(C)CC(CBr)(CN2[C@H](CNC(=O)OC(C)(C)C)C[C@H]3CCC[C@@H]32)C1 2345010519 MGDVSLBNKIRCOG-IKGGRYGDSA-N 429.443 4.955 50 10 IJGE CC(C)c1ccc(OCC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)cc1 13981041 SQSHNSASCHSNCZ-UHFFFAOYSA-N 439.339 4.502 50 10 IJGE CS(=O)(=O)c1ccc([C@@H](Cl)c2cc(Br)ccc2Br)cc1 40269146 XFCJOSCNFWXNIY-CQSZACIVSA-N 438.568 4.943 50 10 IJGE O=C(N/N=C1\C(=O)N(Cc2c(Cl)cccc2Cl)c2ccccc21)C1CCCCC1 59165872 UZCHIGOHICRCAJ-QQTULTPQSA-N 430.335 4.941 50 10 IJGE Cc1cccc(C(CBr)(CBr)Cc2c(Cl)c(C)nn2C)c1 118877630 PRYZMFIIKXGPPJ-UHFFFAOYSA-N 434.603 4.961 50 10 IJGE CC(C)C[C@H](Br)CNC(=O)c1ccc(Br)cc1Br 232639868 TVAMCHNVOFZJLR-JTQLQIEISA-N 441.989 4.751 50 10 IJGE Cc1cc(OCC(=O)NN=Cc2cc(Br)ccc2O)c(C(C)C)cc1Cl 252630998 VGOWEZRVJVNEAN-UHFFFAOYSA-N 439.737 4.769 50 10 IJGE O=C(NN=Cc1c(OCc2ccccc2)ccc2ccccc12)C(=O)Nc1cccc(F)c1 254291538 DVSAVSNBAOETGE-UHFFFAOYSA-N 441.462 4.647 50 10 IJGE C=CCOc1cccc(C=NNC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)c1 254487543 CSCOHSFUYYRDHM-UHFFFAOYSA-N 425.532 4.574 50 10 IJGE Cc1nn(-c2ccccc2)c(N2CCCCC2)c1C=NNC(=O)C12CC3CC(CC(C3)C1)C2 254744077 NQDCTLNHOSXYLJ-UHFFFAOYSA-N 445.611 4.838 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(OC[C@@H]2C[C@H]3CCCC[C@H]3O2)C1 393257655 AKAUOIZGPIFTER-AXVVYFOYSA-N 432.399 4.515 50 10 IJGE COC(=O)[C@@]1(CCF)C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 688653526 FEABJMIWUVCDET-XMSQKQJNSA-N 439.600 4.691 50 10 IJGE Cc1ccc(-n2nc(C)c(CC(=O)NNc3ccc(OC(F)F)cc3)c2C)cc1Cl 748661519 TZIBLWJMKOVLJG-UHFFFAOYSA-N 434.874 4.738 50 10 IJGE CCCc1nc(C(=O)Oc2ccc([N+](=O)[O-])c3ncccc23)nn1-c1ccccc1Cl 770127925 UOTRYSPHNRSRNQ-UHFFFAOYSA-N 437.843 4.549 50 10 IJGE COc1ccc(Oc2ccc(Cl)cc2NC(=O)C(=O)NNc2cccc(F)c2F)cc1 785015044 AFGNXNJWNQBVSJ-UHFFFAOYSA-N 447.825 4.501 50 10 IJGE N#Cc1ccc(NNC(=O)c2cnn(-c3ccc(Cl)cc3Cl)c2)c(C(F)(F)F)c1 799753431 CDAQHTQHSVRZFF-UHFFFAOYSA-N 440.212 4.826 50 10 IJGE Cn1cc(C(=O)NNc2c(Br)cccc2Br)c2cc(F)ccc21 801506233 AXLIOEVWNYCHJG-UHFFFAOYSA-N 441.098 4.599 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCCCc2nc3ccccc3s2)c(C)n1C[C@H]1CCCO1 1087661253 TYVLARLRIBOMGC-OKPNHQCWSA-N 448.592 4.550 50 10 IJGE CC(=O)C1CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3cccc4ccccc34)c2C)CC1 1177212088 RKAVMFDLMYNOSA-LFVJCYFKSA-N 425.532 4.982 50 10 IJGE CC(=O)c1c(C)cc(NC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)cc1C 1477048231 QFIXEXYYQXBDHE-UHFFFAOYSA-N 449.482 4.691 50 10 IJGE CCN(CC)c1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CBr)c(O)c1 1614704396 LMDXZGCFYRBLCI-PBHICJAKSA-N 427.383 4.584 50 10 IJGE C=CCC[C@@H](CO)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1627412993 XWXFZCHYINUUSR-DMVFFGLYSA-N 432.351 4.751 50 10 IJGE CCc1nn(Cc2ccccc2Cl)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699175 MYRRELHNDAFHME-QFIPXVFZSA-N 443.938 4.857 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699674 ZVLMJZRIMRQRNQ-JOCHJYFZSA-N 429.911 4.603 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@H](C(F)(F)CCl)C1 1892721090 XAVZBEGCBIRTQR-LURJTMIESA-N 437.531 4.609 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)c1ccccc1S(=O)(=O)C(F)(F)F 1914651000 KYXMLQMAHXPGTH-ZDUSSCGKSA-N 436.293 4.770 50 10 IJGE CN(Cc1c(Br)cccc1Br)CC1(CBr)CC1 1915521091 IBDLOIOJCQTXAH-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE C[C@@H](Br)c1cnnn1-c1ccc(Cl)c(I)c1Cl 1945188377 IEFFBNXHCFXOFB-RXMQYKEDSA-N 446.901 4.635 50 10 IJGE Cc1c([C@@H](Br)c2ccc(Br)s2)c(Br)nn1C 1987720468 BXPUWQSCXINNPB-VIFPVBQESA-N 428.975 4.799 50 10 IJGE C=CCC(CBr)(CBr)Cc1nn(CC)cc1Br 2010553322 PFSOPDOUXIBNQB-UHFFFAOYSA-N 428.994 4.560 50 10 IJGE C[C@H]1CC[C@H](Br)CN1C(=O)c1cccc(Br)c1Br 2031477831 OEEBEQUDMXUNEM-IUCAKERBSA-N 439.973 4.600 50 10 IJGE CC[C@H](C)[C@H](Br)CNC(=O)c1cccc(Br)c1Br 2031482202 PPIWXCDBGPYUPS-GZMMTYOYSA-N 441.989 4.751 50 10 IJGE O=C(NC[C@H]1CCC[C@H]1Br)c1cccc(Br)c1Br 2031487517 VMCDYFOMZHTKHW-PSASIEDQSA-N 439.973 4.505 50 10 IJGE CCn1cc(S(=O)(=O)N(Cc2ccccc2)C2CCCC2)cc1CBr 2059265896 AYLXXGBHKJJEDO-UHFFFAOYSA-N 425.392 4.536 50 10 IJGE CS(=O)(=O)c1csc([C@H](Br)c2cccc(Br)c2F)c1 2093074755 PLBOFHFABZCTGI-LLVKDONJSA-N 428.142 4.538 50 10 IJGE COc1cc(Cl)c([C@@H](Cl)c2cn(C)nc2Br)cc1Br 2137656504 PPBHBHASFOQAGC-LLVKDONJSA-N 428.939 4.935 50 10 IJGE O=[N+]([O-])c1cc(CBr)ccc1N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1 2163333409 HFTLCPXUGSGPTB-OAQYLSRUSA-N 430.346 4.592 50 10 IJGE Fc1ccc([C@H](Br)c2cc(I)sn2)c(F)c1F 2213678987 RWUQLRPAGZKCCQ-QMMMGPOBSA-N 434.018 4.649 50 10 IJGE Cc1ccc([C@H](Br)c2ncn3ccsc23)cc1I 2217865147 TZHUZYGLVZGQRB-NSHDSACASA-N 433.112 4.793 50 10 IJGE Cc1c(Cl)cc(CC23COC(CI)(C2)C3)cc1Br 2222262006 RBHQMIKGDHXYJZ-UHFFFAOYSA-N 441.534 4.938 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC[C@H](CI)O2)C[C@@H]2CCCC[C@H]21 2242741017 QIYIKIPVQLAEOV-BORJPKMPSA-N 435.346 4.539 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@]12CCC[C@H](CI)O2 2243432842 FDBKYQRENDSWII-RVKKMQEKSA-N 437.362 4.642 50 10 IJGE O=S1(=O)C[C@@H]2[C@H]([C@@H](Cl)c3cc(Br)ccc3OCc3ccccc3)[C@@H]2C1 2314488985 GKAQSVDDISJPDZ-NBMJBFSESA-N 441.774 4.599 50 10 IJGE Cc1cccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)c1C 38678213 WIPSHVQDCRQJAR-RUZDIDTESA-N 444.462 4.645 50 10 IJGE Cc1ccc2cccc(Nc3ncnc(NNC(=O)c4cccc5ccccc45)c3N)c2n1 40758670 PXIXRCNIAFDZHZ-UHFFFAOYSA-N 435.491 4.569 50 10 IJGE O=C(c1c(F)cc(Br)cc1F)N(CCBr)C1CCCCC1 160155743 QDUMDAISPCPGIM-UHFFFAOYSA-N 425.111 4.897 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@@H]1Cl)c1cc(Br)ccc1Br 161208108 OECALZHSZRPIBV-LSDHHAIUSA-N 429.539 4.846 50 10 IJGE C[C@H](Br)C(C)(C)NC(=O)c1cc(Br)ccc1Br 161245269 NDHOSDXFDLAAIF-ZETCQYMHSA-N 427.962 4.503 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C3\C(=O)N([C@H](C)CC)C(=O)C(C#N)=C3C)o2)cc1 214263879 ISWGCTDWMRYHAF-CTFRJJSNSA-N 432.476 4.514 50 10 IJGE C[C@H](NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1ccc(Oc2ccccc2)cc1 303179639 WYZBTZGAVTXADB-KRWDZBQOSA-N 428.492 4.676 50 10 IJGE C[C@@H](CCCBr)CNC(=O)c1cc(Br)c(Br)s1 384667618 CJULFCFRDDGOQX-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE COc1cc(CCl)cc(Br)c1OCc1sncc1Br 719814307 BRQZOKZGOJOBCJ-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)Oc1ccc([N+](=O)[O-])c3ncccc13)O[C@@H](C)C2 770137149 UFLRLNZUNPJZCH-OWQGQXMQSA-N 434.448 4.574 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2ccn(CC(F)(F)F)n2)c(C)n1-c1ccc(F)cc1 773108690 DETXKSVZPJMTGT-MHWRWJLKSA-N 431.393 4.538 50 10 IJGE C[C@@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)NNc2cccc(F)c2F)cc1 785019828 KLQFTSJJVWBXSC-CQSZACIVSA-N 427.476 4.900 50 10 IJGE O=C(CCC(=O)Nc1ccccc1Cl)NN=Cc1ccccc1OCc1ccccc1 1083986770 MCHHLHQWTKORPI-UHFFFAOYSA-N 435.911 4.788 50 10 IJGE CCOc1cc(C=NNC(=O)CC[C@H](O)c2ccccc2)ccc1OCc1cccc(C)c1 1084459170 GMDRFAQCMYQOHP-DEOSSOPVSA-N 446.547 4.937 50 10 IJGE C/C(=C/C(=O)NNC(=O)Nc1ccc(Br)cc1)c1ccccc1C(F)(F)F 1138899543 NODSIQYEGICQTC-KHPPLWFESA-N 442.235 4.724 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNC(=O)CSc1ccc(Cl)cc1 1624319575 JTEHCXHNMDLJSZ-LUAWRHEFSA-N 429.756 4.990 50 10 IJGE COc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3CC(C)C)ccc1OCc1ccccc1 1865687679 XTFZJCVKGJRZOE-XMMPIXPASA-N 444.535 4.653 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccc(F)cc2)cc1 1865694700 ZLRXTEDJDJPJNT-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccc(Cl)cc2)[C@@H]1c1cccnc1 1865699689 ABXJHTYLCCVIEM-HXUWFJFHSA-N 425.879 4.806 50 10 IJGE Cc1nc(-c2ccc(F)cc2)ccc1C(=O)NNC(=O)Cc1ccc(Cl)c(Cl)c1 1865758090 ITJKCYACXVNNAU-UHFFFAOYSA-N 432.282 4.507 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC(C)(C)N(C[C@@H](CBr)c2ccccc2)C1 1879062628 RSKYACLAEBTSGH-QZTJIDSGSA-N 425.411 4.933 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1[C@H](CBr)NC(=O)OC(C)(C)C 1880760800 JCYSGKREHMCBQD-NUJGCVRESA-N 425.411 4.679 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCCN(C(=O)OC(C)(C)C)C1(C)C 1881088356 GGQAAGDOEQVKEX-ZIAGYGMSSA-N 435.403 4.700 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1csnc1Br 1925212189 SEXXURPYGKHKFM-CQSZACIVSA-N 446.208 4.968 50 10 IJGE CCC(CC)(CBr)CN1C[C@H](C)N(C(=O)OCc2ccccc2)[C@@H](C)C1 1977952870 SLMIKYOGKNYSFG-ROUUACIJSA-N 425.411 4.919 50 10 IJGE Cc1ccccc1CO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 2024649251 QHWXYVHVAGLLHM-LJQANCHMSA-N 445.341 4.716 50 10 IJGE CCOCCCO[C@@](C)(CI)c1ccccc1Br 2031753955 FOLWJUOAVPQUMM-AWEZNQCLSA-N 427.120 4.543 50 10 IJGE FC1(F)CCN(c2ncc(Br)cc2Br)CC[C@H]1Br 2032656060 FLJQMPRLVZSEJD-SECBINFHSA-N 448.931 4.606 50 10 IJGE C[C@@H](C[C@H](Br)c1cc(I)cc2c1OCC2)C(F)F 2036589970 CWPYRQSEFHZLDJ-CPCISQLKSA-N 431.058 4.953 50 10 IJGE Clc1ccc(I)c(CN2C[C@H](Br)C3(CCC3)C2)c1 2046457969 MEVHULROVXUPHZ-ZDUSSCGKSA-N 440.550 4.694 50 10 IJGE Cn1ncc(C[C@H](CBr)c2cccc(Br)c2)c1Br 2053030190 MZLXCKBBCKVXSX-SNVBAGLBSA-N 436.973 4.666 50 10 IJGE Fc1ccc(I)cc1[C@H](Br)c1ncn2ccsc12 2083983971 GTFINLHXIAPGFX-JTQLQIEISA-N 437.075 4.624 50 10 IJGE CC(C)N(C[C@H](C)Cl)C(=O)c1ccc(Br)cc1I 2086150822 GMSFOLWIOOFXRF-VIFPVBQESA-N 444.538 4.532 50 10 IJGE CC(C)N1C[C@@H](Br)[C@H](Cc2ccc(I)c(Cl)c2)C1 2086651953 LZGNKCYBQWKHET-VXGBXAGGSA-N 442.566 4.591 50 10 IJGE ClCc1ccc(Br)cc1N1CC[C@H]2COC[C@@H](C1)N2Cc1ccccc1 2139652664 QLZHKPMORHUZQP-VQTJNVASSA-N 435.793 4.668 50 10 IJGE CCCC1(CNC(=O)[C@H](Br)C2CCCC2)CCN(C(=O)OC(C)(C)C)CC1 2167049609 XLRFUCLKFRRLGN-QGZVFWFLSA-N 445.442 4.874 50 10 IJGE Clc1ccc(Br)c(CN2CCC(OCCCBr)CC2)c1 2207533549 SWEMMRJPBRJWER-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE FC1(F)[C@@H]2CC[C@H](O[C@H](CI)c3ccccc3Br)[C@@H]21 2230421599 RWLXKDHHXQQTCH-GWNIPJSYSA-N 443.069 4.986 50 10 IJGE FC(F)(F)[C@@H](Br)COc1cc(I)ccc1Cl 2244975299 ALPXWYLSFQSZNP-QMMMGPOBSA-N 429.401 4.649 50 10 IJGE C[C@@H](CCCCBr)NCc1ccc(Cl)c(I)c1 2300238521 LYQYSISPOHPJDZ-JTQLQIEISA-N 430.555 4.988 50 10 IJGE C[C@H]1C[C@@H](Br)CN(Cc2ccc(Cl)cc2I)C1 2302326534 QCHHYVFWQAHTFM-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE CC1(C)OC[C@@H](Cc2cc(I)ccc2Cl)[C@@H]1Br 2307330028 IZNSLEQRAUIDIC-SKDRFNHKSA-N 429.523 4.676 50 10 IJGE COc1c(Br)cc(C)c([C@H](Br)[C@H]2C[C@H]2OC)c1Br 2317429498 RXHBLHAUFMJJNK-JVUFJMBOSA-N 442.973 5.000 50 10 IJGE C[C@@H]1CCC[C@@](CBr)(Cc2nn(C)cc2I)CC1 2319152681 VPDDBDZPIHTMEE-RISCZKNCSA-N 425.152 4.549 50 10 IJGE N#CC(=CNCCc1ccc(Br)cc1)C(=O)Nc1ccc(Cl)cc1Cl 2324495628 NLENWOMVAFLSLZ-UHFFFAOYSA-N 439.140 4.934 50 10 IJGE CCCCCOc1ccccc1C(=O)NNC(=O)COc1ccc(-c2ccccc2)cc1 14035839 AUGPPAUDVVPODU-UHFFFAOYSA-N 432.520 4.763 50 10 IJGE Cc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)NCc4ccccc4Cl)c(C)c32)c1 40811299 MVGWRIGQBQBCSS-VFCFBJKWSA-N 449.938 4.950 50 10 IJGE COc1ccc(OC)c(NC(=O)/C(C#N)=C\Nc2ccc(Cl)c(C(F)(F)F)c2)c1 217216475 FHVAKSQTKDGYFG-KHPPLWFESA-N 425.794 4.834 50 10 IJGE CCCCCC[C@H](C)O[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1I 231313936 XFMALKGUUOGLDL-KKUMJFAQSA-N 425.351 4.785 50 10 IJGE CCC[C@@H](C)CO[C@@](C)(CI)CN(CC)C(=O)OC(C)(C)C 233278330 HVYMGRFPMYJIDS-PBHICJAKSA-N 427.367 4.890 50 10 IJGE Cc1ccc(OCC(=O)NN=Cc2cc(N=Nc3ccc([N+](=O)[O-])cc3)ccc2O)c(C)c1 254749943 JLMFCTXOGHEQMK-UHFFFAOYSA-N 447.451 4.862 50 10 IJGE C[C@@H]1CCC[C@H](CO[C@](C)(CI)CNC(=O)OC(C)(C)C)C1 300795842 VKVFUHHVOWKRAF-JKIFEVAISA-N 425.351 4.548 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CBr)[C@H](c2cc(Br)ccc2O)C1 382691387 ABKDIRUOSKOTAS-GXFFZTMASA-N 435.156 4.500 50 10 IJGE CC1(C)CC[C@@H](CCl)N(C(=O)c2ccc(I)c(Cl)c2)C1 701597406 UTRCYUQJOAECID-NSHDSACASA-N 426.125 4.814 50 10 IJGE CC(=O)N(C)c1cccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccccc3F)c2C)c1 744776538 QXIOIMXKFXNHSL-DEDYPNTBSA-N 430.483 4.762 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)CSc1nnc(-c2ccc(Cl)cc2)o1 746180167 BEPASYCSGJRTDA-UHFFFAOYSA-N 431.857 4.724 50 10 IJGE O=C(Nc1cccc(S(F)(F)(F)(F)F)c1)C(=O)N1CCN(c2ccccc2)CC1 762637358 QNZFGUVPLGXRMH-UHFFFAOYSA-N 435.418 4.631 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CC(=O)Oc1ccc([N+](=O)[O-])c2ncccc12)c1ccccc1 770126618 BZDSUENNNUGPGR-KRWDZBQOSA-N 437.452 4.705 50 10 IJGE COc1cc(C=NNC(=O)CSCc2ccc(C)cc2)ccc1OCc1ccccc1 1084297363 PVIVSAHFQDCVRV-UHFFFAOYSA-N 434.561 4.966 50 10 IJGE C=CCn1c(SCC(=O)NNc2ccc(CC)cc2)nnc1-c1ccc(Cl)cc1 1298022494 JUGWPRQPZQKBRO-UHFFFAOYSA-N 427.961 4.582 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2O)CCC3)cc1 1772751741 LGRXYLSILXPCTQ-UHFFFAOYSA-N 432.476 4.546 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@H](c1ccc(OC)c(O)c1)C(C#N)=C(N)O2 1865682754 XBZPRCJTVQOKHB-HSZRJFAPSA-N 438.487 4.520 50 10 IJGE CCc1nn(Cc2ccc(C)cc2)c2c1[C@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865701671 BFAIAILMDOMLLG-XMMPIXPASA-N 441.579 4.867 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)c3ccc(OCC(C)C)cc3)c(C)n2)cc1 1865759043 ZQSSDQIUDPGFBX-UHFFFAOYSA-N 431.536 4.729 50 10 IJGE CC[C@](C)(NC(=O)C[C@@H](C)c1cccc(OC)c1)C(=O)Nc1ccc(SC#N)cc1 1867109976 GBHMBBYQPGVEJN-MWTRTKDXSA-N 425.554 4.686 50 10 IJGE Cc1cccc(C(=O)N(Cc2ccccc2)[C@H](C)CCl)c1I 1914224063 SLVUWQHNKNGOCV-CQSZACIVSA-N 427.713 4.869 50 10 IJGE Cc1cc(Br)cnc1N(C)C[C@H](Br)COCc1ccccc1 1916348487 OGLPKZDILQIJOO-INIZCTEOSA-N 428.168 4.569 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC2(CCC2)[C@]12CCC[C@H](CI)O2 1924959151 SVPNNTYFVSSVFT-KHYOSLBOSA-N 449.373 4.834 50 10 IJGE Brc1ccc(CNCCCCI)c(Br)c1 1929520827 ZKGFTHNAGWJBSQ-UHFFFAOYSA-N 446.952 4.516 50 10 IJGE C[C@H](NC(=O)c1cc(Br)c(Br)s1)C(C)(C)CBr 1942907019 KOEHIVFRHHZFEI-LURJTMIESA-N 448.018 4.813 50 10 IJGE Cn1ncc(CN(Cc2ccccc2)C2(CBr)CCC2)c1Br 1961869043 PQSLVFIRVQWMMO-UHFFFAOYSA-N 427.184 4.502 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@H](CI)O2)CC12CCC2 1986112747 SSZRSNPAETYZOM-KBXCAEBGSA-N 435.346 4.683 50 10 IJGE CC[C@@H](C[C@H](C)Br)NCc1ccc(I)c(Cl)c1 2026565565 CDWVQTGXEAVOKU-ONGXEEELSA-N 430.555 4.986 50 10 IJGE Brc1ccc(CN2C[C@H]3C[C@H]2CC[C@H]3Br)c(Br)c1 2031403834 UFODGMVPZLGSTP-RAIGVLPGSA-N 438.001 4.959 50 10 IJGE CC(C)(C)[C@@H](CBr)NC(=O)c1cccc(Br)c1Br 2031479072 KNWPJWMUWHHEGE-SNVBAGLBSA-N 441.989 4.751 50 10 IJGE O=C(CBr)c1ccc(Br)c(Br)c1Br 2054975239 NWKSIEVMHGYHLD-UHFFFAOYSA-N 435.735 4.552 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1N(C)C[C@@H](CBr)c1ccccc1 2106780609 AHWUYWIMJAOCIK-BHIYHBOVSA-N 425.411 4.742 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C(F)(F)F)N(CC2(CBr)CCCC2)CC1 2106784803 LESRNAKKTJQQLN-CQSZACIVSA-N 443.348 4.815 50 10 IJGE CCC[C@H](CBr)CN1CC[C@H](C(F)(F)F)C[C@@H]1CNC(=O)OC(C)(C)C 2107588411 XNSHMICMHMUASF-QLFBSQMISA-N 445.364 4.965 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@H](CCNC(=O)OC(C)(C)C)C1 2119488827 ZZWQPXPJARLVNL-QGZVFWFLSA-N 435.447 4.584 50 10 IJGE COc1cc(Cl)c([C@@H](Br)c2nn(C)cc2Cl)cc1Br 2137652736 BAMFMDJTHPAJJC-LLVKDONJSA-N 428.939 4.982 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CC[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1 2148929717 OMUBGKGQPOLVSN-RBBKRZOGSA-N 427.386 4.566 50 10 IJGE CO[C@H]1CC(Oc2c(Br)cc(Br)cc2CCl)C[C@@H]1OC 2187175887 BPIZFQJYYOXSFQ-STQMWFEESA-N 428.548 4.522 50 10 IJGE O=C(c1ccc(Br)c(Cl)c1)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Br)C2 2190677967 JRAVLIIZDFPSHO-JBSCMGISSA-N 425.523 4.581 50 10 IJGE C[C@@H]1OCCO[C@@H]1[C@@H](Br)c1cc(Br)c(Br)cc1F 2218606582 SEYMZHFHFUTAGO-QNRPFLCFSA-N 446.936 4.591 50 10 IJGE COc1ccc([C@@H](Cl)c2coc(Br)c2)cc1I 2248890345 BDULFWQSPWXDFA-GFCCVEGCSA-N 427.463 4.984 50 10 IJGE COc1ccc([C@H](Br)[C@]2(C)CCCOC2)cc1I 2257365979 WXPXCAILQQVOGB-UONOGXRCSA-N 425.104 4.553 50 10 IJGE COc1ccc([C@H](Br)c2c(Cl)cnn2C)c(Br)c1Cl 2268267482 FOTMGQOBTIZESG-JTQLQIEISA-N 428.939 4.982 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CC(F)(F)CN1CC1(CBr)CCCCCC1 2278906681 GOQYEHFFQUMZTQ-OAHLLOKOSA-N 439.385 4.956 50 10 IJGE O=C(c1cccc(Cl)c1Br)N1CC[C@@H](CBr)C(F)(F)C1 2283140862 NABZBDNXCCZITH-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE Cc1cc(F)c(Br)cc1[C@H](Br)c1cc(S(C)(=O)=O)cs1 2285939834 RWWRNHZFRXXXSY-ZDUSSCGKSA-N 442.169 4.846 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN1Cc1ccc(Cl)c(I)c1 2300239997 GSHMPFZTHBTPSU-KOLCDFICSA-N 428.539 4.550 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2CC[C@]2(CBr)C1 2327396087 ZLUBBQPNPHXYOF-RISCZKNCSA-N 440.550 4.552 50 10 IJGE Cc1cccc(Oc2nccc(N(C)C)c2CBr)c1I 2377525758 BFFXLPIGXDANGK-UHFFFAOYSA-N 447.114 4.748 50 10 IJGE CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc(COc2ccc(F)cc2)c(C)cc1C 2727807 UQVZWMVFFLVKKP-QHCPKHFHSA-N 436.483 4.666 50 10 IJGE CCOC(=O)/C(C#N)=C1/S[C@@H](Cc2ccc(Cl)cc2)C(=O)N1c1ccc(C)cc1 2888294 QCLWHINDQOVTGA-PMIVHWTLSA-N 426.925 4.638 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H]1Br)c1cc(C(F)(F)F)ccc1Br 124440321 GWKWHZDWAWHFIP-KWQFWETISA-N 429.074 4.761 50 10 IJGE CCCOc1c(Cl)cc(/C=N\NC(=O)Cc2ccc3nc(N)sc3c2)cc1Cl 169917217 MLZBKPBGAYVFEI-RMORIDSASA-N 437.352 4.667 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC(=O)/C(C#N)=C\N(Cc1ccccc1)c1ccccc1 217230842 OVVPLDYNHNDVRF-ZPHPHTNESA-N 428.448 4.656 50 10 IJGE C[C@H](CO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1)C1CCC1 398340415 CYBJLGOSXPASNF-KDOFPFPSSA-N 437.362 4.644 50 10 IJGE BrCCC1CCN(c2ncc(Br)cc2Br)CC1 401055096 VHXUFGUUVBMYHU-UHFFFAOYSA-N 426.978 4.608 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1C(=O)c1scc(Br)c1Br 705491321 SGKBZXFKJBBUSB-RQJHMYQMSA-N 446.002 4.661 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NNc2cccc(C(F)(F)F)n2)c(C)n1-c1ccc(F)cc1 740127632 FFVWUCKGPGJELT-LFIBNONCSA-N 443.404 4.697 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OC[C@H]2CCC3(CCCCC3)O2)c(-c2ccccc2)n1 786266835 DRBOUOKVHXVYML-LHBRDVBXSA-N 444.535 4.796 50 10 IJGE C=CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1nc2cc(Cl)ccc2cc1C 1546169302 QHBHDNHGXJIPDZ-QGZVFWFLSA-N 432.952 4.889 50 10 IJGE CN(C)C(=O)C(C#N)=Cc1ccc(-c2nc3cnc4c(ccn4C)c3n2C2CCCCC2)o1 1857752686 RPIGHLXKDWUGDT-UHFFFAOYSA-N 442.523 4.683 50 10 IJGE Cc1ccc(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2ccccc2F)cc1 1865684329 WPBSJDTWXSNSBT-QGZVFWFLSA-N 428.389 4.616 50 10 IJGE CCc1nn(-c2ccc(OC)cc2)c2c1[C@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2 1865710537 BIBLTFQUONRYTQ-LJQANCHMSA-N 440.425 4.680 50 10 IJGE CCCC[C@H](NC(=O)[C@H](C)Cc1ccc(F)cc1)C(=O)Nc1ccc(SC#N)cc1 1866840964 RDELNJJTEOSFEP-IERDGZPVSA-N 427.545 4.891 50 10 IJGE C[C@@H]1CN(c2cc(Nc3ccc(SC#N)cc3)nc(-c3cccnc3)n2)C(C)(C)CO1 1868564794 FHAZABBHLINEOP-MRXNPFEDSA-N 432.553 4.859 50 10 IJGE COc1cc(OC)c(-c2csc(/C(C#N)=C(\O)[C@H]3CC(=O)N(C(C)C)C3)n2)cc1Cl 1872756700 WEVQLPGTYREAFY-SXPRPLFSSA-N 447.944 4.530 50 10 IJGE CN(C[C@@H]([C@H](CBr)NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)OC(C)(C)C 1880766270 GHKSRDNVBMCJQR-KBPBESRZSA-N 437.419 4.804 50 10 IJGE O[C@H](c1c(Br)sc(Br)c1Br)[C@@H]1C[C@H]1Cl 1893453264 LVNZMIRTJIAHCU-SAMGZKJBSA-N 425.367 4.696 50 10 IJGE CN(CC(C)(C)CI)c1ccc(CNC(=O)OC(C)(C)C)cc1 1904651769 UCTLKGFTKKJJGP-UHFFFAOYSA-N 432.346 4.609 50 10 IJGE Brc1cccc([C@H](CI)O[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1 1917453378 MIDPWRSDKJKCFZ-PVSUWSIZSA-N 433.127 4.986 50 10 IJGE C[C@@]1(CI)CC[C@]2(CN(Cc3ccccc3)C3(CCCC3)C2)O1 1939538443 YHARXRWKDYGNCM-ICSRJNTNSA-N 425.354 4.948 50 10 IJGE ClC1CC([C@H](Br)c2cc(I)cc3c2OCC3)C1 2020462267 ACIICTGKZJNIKC-KWPJZBAWSA-N 427.507 4.680 50 10 IJGE Clc1cc(C[C@@]2(CBr)CC=CCO2)ccc1I 2026562411 ASQFWGIFLQNWKW-CYBMUJFWSA-N 427.507 4.597 50 10 IJGE CC[C@@H](C)[C@H](Br)CNC(=O)c1cc(Br)ccc1Br 2029977738 OSZJBYROQHTUCE-PRHODGIISA-N 441.989 4.751 50 10 IJGE CCCN1CC[C@@H]([C@@H](Br)c2cscc2OCc2ccccc2)S1(=O)=O 2038675867 BMAQRCBDIYNFJO-ROUUACIJSA-N 444.416 4.577 50 10 IJGE Brc1ccc([C@@H](CI)OC[C@H]2CCCCCO2)cc1 2096323527 ZJQSQJMKKXDYLJ-HUUCEWRRSA-N 439.131 4.901 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1[C@@]12C[C@H]1CN(Cc1ccccc1)C2 2099678711 KZRSSKLEQKXOPV-ZQGRQUNCSA-N 431.765 4.725 50 10 IJGE CC1(C)C[C@H](NC(=O)c2ccc(CBr)cc2)CCN(C(=O)OC(C)(C)C)C1 2162494025 DCCIUAOPAANDRC-QGZVFWFLSA-N 439.394 4.737 50 10 IJGE BrCc1c(N2[C@H]3CCC[C@H]2CN(Cc2ccccc2)CC3)nc2sccn12 2166619724 ABJHKCXSJVAIIP-ROUUACIJSA-N 445.430 4.924 50 10 IJGE COC[C@@](C)(CC(CBr)(CBr)c1ccccc1Cl)OC 2198253315 PSRJOEQELCYGTJ-CQSZACIVSA-N 428.592 4.809 50 10 IJGE Cc1ccc(C(=O)NCC(C)(C)CCCBr)cc1I 2224618046 DACZROYNICOGIU-UHFFFAOYSA-N 438.147 4.531 50 10 IJGE COc1ccc([C@@H](Cl)c2ncsc2Br)cc1I 2248891410 FAADHHIVFSDWAM-SECBINFHSA-N 444.519 4.847 50 10 IJGE O=C(N[C@@H]1C[C@H]2CC[C@H]1[C@H](Br)C2)c1scc(Br)c1Cl 2264503455 GHDIENPPGPHGBW-QHOPCYEYSA-N 427.589 4.846 50 10 IJGE Cc1cccc(Oc2nc3ccccn3c2CBr)c1I 2295274612 MMOQCFVCCFOJCQ-UHFFFAOYSA-N 443.082 4.935 50 10 IJGE Clc1ccc(I)cc1C[C@H]1CCOCC[C@H]1Br 2307338569 SMKNBKUHSWFLLC-BXKDBHETSA-N 429.523 4.677 50 10 IJGE CC(C)C[C@H](CBr)CN1CC=CCC12CN(C(=O)OCc1ccccc1)C2 2308058513 VRPGDMWGUIIVLL-HXUWFJFHSA-N 435.406 4.697 50 10 IJGE CC1(C)C[C@@H](Br)CN(Cc2ccc(Cl)cc2I)C1 2318537212 DQOJINYPJLXSIK-LLVKDONJSA-N 442.566 4.940 50 10 IJGE CCCOc1cc(C=NNC(=O)c2ccc3nc(Cc4ccccc4)[nH]c3c2)ccc1OC 2323723918 HEMRHHHKRJEVIA-UHFFFAOYSA-N 442.519 4.715 50 10 IJGE C[C@]1(CNCc2ccc(I)c(Br)c2)CCC[C@H]1Cl 2325228416 HSQRPGSIEWRLIT-ZIAGYGMSSA-N 442.566 4.941 50 10 IJGE COc1ccc(/C=N/NC(=O)c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2)cc1O 12491736 GYQOJUAGJLLVTD-JVWAILMASA-N 445.519 4.715 50 10 IJGE C=CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4C)ccc32)cc1 38657997 VTTYTTGYJQBDEV-VWLOTQADSA-N 438.483 4.997 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(F)c2)cc1C 38678208 FCSQBFVAMZNSBY-VWLOTQADSA-N 444.462 4.645 50 10 IJGE CC(C)(CCCCl)CNS(=O)(=O)c1cc(Br)ccc1Br 227942706 AGRSPPJTCVZUGQ-UHFFFAOYSA-N 447.620 4.535 50 10 IJGE C=C(C)c1cccc(C(C)(C)NC(=O)NN=Cc2cc(Br)c(O)c(OC)c2)c1 256017138 CBEHOPMWKNOQEB-UHFFFAOYSA-N 446.345 4.765 50 10 IJGE CC1(C)[C@H](Br)CCN1C(=O)c1cc(Br)ccc1Br 311225406 QRGHQYYESRWPTF-LLVKDONJSA-N 439.973 4.600 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@@H](c2cc(Br)ccc2O)C1 382691389 ABKDIRUOSKOTAS-MFKMUULPSA-N 435.156 4.500 50 10 IJGE C[C@@H]1CCCN(c2ncc(Br)cc2Br)[C@H]1CBr 688692179 GRNFRGCEBPAZGE-KCJUWKMLSA-N 426.978 4.606 50 10 IJGE CC(C)C[C@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1cccc(C(F)(F)F)c1 726799264 NBNWAIVZKVKBCW-IBGZPJMESA-N 444.457 4.985 50 10 IJGE Cc1ccc(F)cc1-c1nnc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)s1 799426465 HAJWNWROXQYXCQ-UHFFFAOYSA-N 436.394 4.692 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1)/C(=C/C=C/c1ccccc1)NC(=O)c1ccccc1 1082989099 MGXWQTWUORMQEL-HYRAFREOSA-N 429.907 4.817 50 10 IJGE C=CCCO[C@@H](C)C(=O)NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1 1124339892 IBWDDUGMCFJIAQ-FQEVSTJZSA-N 444.531 4.675 50 10 IJGE CC(=O)c1cc(NC(=O)NNc2c(Br)cccc2Br)ccc1C 1678796510 CYSRJBUWBKENBQ-UHFFFAOYSA-N 441.123 4.871 50 10 IJGE CCCc1nn(Cc2ccc(F)cc2)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865698892 FTUZMPZEFXQQSU-HSZRJFAPSA-N 441.510 4.733 50 10 IJGE CCc1nn(Cc2ccc(C)cc2)c2c1[C@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865704760 DBROXOLZYDDGNK-HSZRJFAPSA-N 428.536 4.808 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccc(Cl)cc2)[C@H]1c1ccc(F)cc1 1865708418 WNOKXFCFIQOGMD-HNNXBMFYSA-N 434.780 4.902 50 10 IJGE CCCC[C@H](NC(=O)c1cc(C)n(-c2ccccc2)n1)C(=O)Nc1ccc(SC#N)cc1 1866837869 ITSGFYBBIRGASG-NRFANRHFSA-N 447.564 4.681 50 10 IJGE Brc1cc([C@H](Br)[C@H]2[C@H]3COCC[C@H]32)sc1Br 1895905928 AKHMXLFZNNIWPR-FXUQCPSJSA-N 430.987 4.992 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1 1915290988 KGMOUJJGXDKZNF-SFHVURJKSA-N 430.795 4.950 50 10 IJGE Clc1ccc(I)c(CN2CC[C@@H](Br)C3(CC3)C2)c1 2032259940 MRIZRQZFZBTBSW-CYBMUJFWSA-N 440.550 4.694 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H]3C[C@H](C[C@H]3Br)C2)c1 2045149434 OLFDEUJCOABOJX-GBIKHYSHSA-N 440.550 4.550 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Cl)c2)CC[C@H]1Br 2086657832 IOJXDPDFPBLABS-CYBMUJFWSA-N 442.566 4.940 50 10 IJGE Clc1cc(CN2[C@H]3CC[C@@H](C3)[C@@H]2CBr)ccc1I 2086662107 ROZBHFLWOJEIQS-MJVIPROJSA-N 440.550 4.692 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CCCN(C[C@H](CBr)C3CCC3)C2)C1 2106784707 KPPHQYQFAOHADQ-GHTZIAJQSA-N 429.443 4.911 50 10 IJGE O=C(NCC1CC2(CC(Cl)C2)C1)c1csc(Br)c1Br 2108261712 TWHBWIZQSPMNIL-UHFFFAOYSA-N 427.589 4.801 50 10 IJGE CCCC1(NC(=O)OC(C)(C)C)CCN(C(=O)[C@H](Br)C2CCCC2)CC1 2110716533 YFJVLSNEQQOOHP-MRXNPFEDSA-N 431.415 4.626 50 10 IJGE O=C(NC[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(CBr)cc1 2159218219 UTFSODJGKDOSLI-QQFNCUIESA-N 427.386 4.755 50 10 IJGE C[C@@H](Cl)c1nc2c(Br)cccc2n1C[C@H]1COCCN1Cc1ccccc1 2194648520 IRUARCJDTADRCI-WBVHZDCISA-N 448.792 5.000 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CN(CCCCCI)CC2 2214705187 OGRWPFFXSBHFJP-UHFFFAOYSA-N 444.357 4.997 50 10 IJGE O=C(N[C@H]1CCC[C@H](CBr)C1)c1cc(Br)c(F)cc1Cl 2285843992 GZYYYFCUXZLUAQ-IUCAKERBSA-N 427.539 4.925 50 10 IJGE C[C@@H](Br)CN(C(C)(C)C)S(=O)(=O)c1ccc(Cl)c(Br)c1 2288076899 ZQHPFPNDJHECIN-SECBINFHSA-N 447.620 4.675 50 10 IJGE N#CC(=Cc1ccc(Br)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 2297551641 WMEFTMAELRMUDX-UHFFFAOYSA-N 440.175 4.922 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2CC[C@@H](Br)[C@H]2C1 2308265169 HQIVPTFJPBEFGY-ISTVAULSSA-N 438.001 4.817 50 10 IJGE C[C@H](Br)CCCN(C)C(=O)c1cc(Br)ccc1Br 2314600017 ZNQBIKHRDANCLS-VIFPVBQESA-N 441.989 4.847 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NC(=O)c1ccc(Cl)cc1I 2317767723 AJQMSJCMGSYUJJ-SCZZXKLOSA-N 444.538 4.627 50 10 IJGE CC(C)[C@H](CBr)N(C)C(=O)c1cc(Br)cc(Br)c1 2318852992 ZJQYNHHQYOEZKP-LBPRGKRZSA-N 441.989 4.703 50 10 IJGE O=C(Nc1ccc(CBr)c(F)c1)c1sccc1I 2319297196 UVJZRUZVEGGUCS-UHFFFAOYSA-N 440.075 4.639 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C=C(C#N)C(=O)NC2CCCCCCCCCCC2)CC1 2325489349 PCJZIUSSBZSPLY-UHFFFAOYSA-N 446.636 4.736 50 10 IJGE CCN(C[C@]1(CBr)CC1(F)F)C1CCC(NC(=O)OC(C)(C)C)CC1 2326914228 IIOSGGKKRKADMH-MQBCKMQZSA-N 425.358 4.565 50 10 IJGE CCOc1cc(C=C(C#N)c2nc(O)c3cc(OC)c(OC)cc3n2)ccc1OC(C)C 2331039485 HVQZEDIOQUVMIO-UHFFFAOYSA-N 435.480 4.603 50 10 IJGE COc1ccc(C=C(C#N)c2nc(-c3ccc(OC)c(OC)c3OC)cs2)cc1OC 2331492899 ZESPDSGOIDVPDE-UHFFFAOYSA-N 438.505 4.917 50 10 IJGE C[C@@H](Br)CC1C[C@@H]2CC[C@H](C1)N2c1ccc(I)cn1 2341259107 YZDGVGMYPDYASU-WDFAYWTNSA-N 435.147 4.607 50 10 IJGE Cn1cc(I)c(C[C@]2(CBr)CCCC(C)(C)CC2)n1 2341760653 NTUVBXBBGUIKOP-HNNXBMFYSA-N 439.179 4.939 50 10 IJGE FC1(F)C[C@]12C[C@H]2CO[C@@H](CI)c1cccc(Br)c1 2352458048 AMORPLRLLIOZDW-DRZSPHRISA-N 443.069 4.987 50 10 IJGE Fc1cc(Cl)c(Br)c(Cl)c1[C@H](Br)[C@@H]1CO[C@H]2COC[C@H]12 2360416735 BKIQVVPAIGSDQH-GMVJNNPSSA-N 448.941 4.992 50 10 IJGE CN1/C(=C(/C#N)C(=O)CSc2nc(C3CC3)n(-c3ccccc3)n2)Sc2ccccc21 9980693 WZBVRNNXFFHKPH-OQKWZONESA-N 445.573 4.783 50 10 IJGE CC[C@@H]1CCC/C1=N\NC(=O)COc1c(C)cc(Br)cc1Br 12486928 OBBZSPMYKYLWLU-NUSFMGPTSA-N 432.156 4.581 50 10 IJGE CCOC(=O)c1c(NC(=O)N/N=C/c2c(F)cccc2Cl)sc2c1CC[C@H](C)C2 40851483 CRHOUMWPZOOICV-MOSLJXCSSA-N 437.924 4.998 50 10 IJGE BrCC[C@@H]1CCCCN1c1ncc(Br)cc1Br 129134983 LZFQJNNQTQGFLX-JTQLQIEISA-N 426.978 4.751 50 10 IJGE C[C@@H](Br)C[C@@H](C)NC(=O)c1cc(Br)ccc1Br 161233850 HIEDZMJJSGYNAK-HTQZYQBOSA-N 427.962 4.503 50 10 IJGE CCCCCCOc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2C(=O)OC)cc1OC 206237200 WWQVGLMHLYIMDW-CYVLTUHYSA-N 436.508 4.987 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2cccc([N+](=O)[O-])c2)sc2c1CC[C@H](C)C2 209405571 MAWXBNSRRRVNLD-OJNRTJSBSA-N 439.493 4.503 50 10 IJGE Cc1cccc(N/C=C(/C#N)C(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c1 216493811 PVAQPTBVPGPMCN-DAFNUICNSA-N 436.559 4.748 50 10 IJGE COc1ccccc1NCC(=O)NN=Cc1c(C)n(Cc2ccccc2)c2ccccc12 254491189 NTDHIVQQXNTHLV-UHFFFAOYSA-N 426.520 4.569 50 10 IJGE FC(F)Oc1ccc(Br)c(CBr)c1I 575682010 GHZLFIOTIWLBQG-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1cccc([C@H]2CCc3ccccc3N2S(N)(=O)=O)c1 616594908 PMPFBIHEYGOVQC-JOCHJYFZSA-N 446.689 4.948 50 10 IJGE Fc1cc2nc(CCl)n(Cc3ncc(Br)s3)c2cc1Br 714924916 DWZONKZNMAGNLC-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N(C)[C@H](c2ccccc2)C(F)(F)F)c(C)n1C[C@@H]1CCCO1 728499867 YMHXZYZQWPLQDR-KSUOCTFZSA-N 445.485 4.953 50 10 IJGE CC(C)(C)c1csc(COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)n1 756332766 VDPDQVDBVVHKTR-PDGQHHTCSA-N 445.548 4.868 50 10 IJGE O=S(=O)(Nc1cccc(-c2nc[nH]n2)c1)c1cccc(S(F)(F)(F)(F)F)c1 777629858 JGTIHGUWMSUNAG-UHFFFAOYSA-N 426.392 4.930 50 10 IJGE Cc1cc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)ccc1NC(=O)c1cccs1 799747611 CSSMVANJRHRAMZ-UHFFFAOYSA-N 444.438 4.956 50 10 IJGE CC(=O)CC(C)(C)CC(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12 1463941280 OEYJOQGCEWAJLM-UHFFFAOYSA-N 437.927 4.712 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(Oc3ccccc3)cc2C)cc1 1623043533 AWXJPFHDANIJLU-SFHVURJKSA-N 447.491 4.610 50 10 IJGE CC(=O)c1c(C)cc(NC(=O)NNC(=O)c2sc3cc(F)ccc3c2Cl)cc1C 1627270471 NRHPTPNUOXDBIO-UHFFFAOYSA-N 433.892 4.980 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@H](c1cccc(OC)c1O)C(C#N)=C(N)O2 1865684042 LPDXZXRQYDYEHO-JOCHJYFZSA-N 438.487 4.520 50 10 IJGE COc1ccc2ccccc2c1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccccc1F 1865688188 MTFSQSHXMXYAIN-DEOSSOPVSA-N 440.478 4.759 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2-c1ccccn1 1865691199 MHFRPRJNWPULJE-QHCPKHFHSA-N 447.498 4.717 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)/C=C/c1cccc(OC(C)C)c1 1865755848 SYZFVQHFXFSWLA-VGOFMYFVSA-N 449.938 4.972 50 10 IJGE O=C(NCCNC(=O)c1ccc(CCl)cc1)OCC1c2ccccc2-c2ccccc21 1956261923 JSCBAMHLPPWJCF-UHFFFAOYSA-N 434.923 4.694 50 10 IJGE Cc1cc(Br)sc1CNCCSSCCNC(=O)OC(C)(C)C 1985346337 AHOHLKGJDITKOK-UHFFFAOYSA-N 441.482 4.815 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CCC[C@H]2C[C@@H]21)C(=O)OC(C)(C)C 1995175609 JFQMFADOBGXJSJ-AFIMGQEJSA-N 437.362 4.642 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)c1ccc(Br)cc1CBr 2020228596 OIVILPYWWAYHNT-OTCDBFHCSA-N 425.990 4.954 50 10 IJGE CC(C)(C)OC(=O)NCC[S@](=O)(=NCCCCCBr)c1ccccc1 2045261728 VIFMXGBJAILBIZ-RUZDIDTESA-N 433.412 4.603 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@@H]2C[C@H](Cl)CC[C@@H]21 2087666438 CBMSRTQSYNZESJ-MRTMQBJTSA-N 427.589 4.895 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CCC[C@H]1CN(CC1(CBr)CCCCC1)C2 2106786676 VSUAVBMQAKZYHA-LAUBAEHRSA-N 429.443 4.959 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C(F)(F)F)CCCN1C[C@@H](CBr)C(C)(C)C 2106789112 WGNMSRBDYOSJAV-DYVFJYSZSA-N 445.364 4.965 50 10 IJGE C[C@H](c1cnn(Cc2ccccc2)c1)n1c(CCCl)nc2cc(Br)cnc21 2146218641 ZXJADTDUYNWJTA-CQSZACIVSA-N 444.764 4.829 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@@H](C)CCCCCI)s1 2221839830 YBXJCWSREMEWKL-VIFPVBQESA-N 444.176 4.933 50 10 IJGE C[C@@H](Br)COCc1cn(-c2ccc(Br)c(Cl)c2Cl)nn1 2295834516 CCYDQOSLUIVRLP-SSDOTTSWSA-N 443.954 4.637 50 10 IJGE Clc1ccc(C[C@]2(CBr)CCCOC2)c(I)c1 2302329070 PABOVTNRCLUUDF-ZDUSSCGKSA-N 429.523 4.679 50 10 IJGE CC[C@@H](C[C@@H](C)Cl)NCc1ccc(I)c(Br)c1 2306222398 UBIHKQGFNAWQKY-KOLCDFICSA-N 430.555 4.939 50 10 IJGE ClCC1(Cc2ccc(I)c(Br)c2)CCOCC1 2306231205 HCIKJWZTPZBVLY-UHFFFAOYSA-N 429.523 4.632 50 10 IJGE CN(Cc1cc(I)ccc1Cl)[C@H]1CCC[C@@H]1Br 2307315184 DXUDDZVEDNOTDI-AAEUAGOBSA-N 428.539 4.692 50 10 IJGE C[C@H](Br)CCCN(C)C(=O)c1cc(Br)cc(Br)c1 2314466927 TYFKVJOVCVDOTG-VIFPVBQESA-N 441.989 4.847 50 10 IJGE CCS(=O)(=O)C[C@@H](Cl)c1c(Cl)cc(Br)c(F)c1Br 2315443533 JQIFVOPXDZYKKB-SSDOTTSWSA-N 442.959 4.719 50 10 IJGE Clc1ccc(CN2CCC[C@@H](CCBr)C2)c(I)c1 2318543119 YZSXZXBOHVHCKU-NSHDSACASA-N 442.566 4.942 50 10 IJGE Cc1cc(C)c(NC(=O)C(C#N)=CNc2ccc(I)cc2C)c(C)c1 2325176983 YAVSPRGNYNLGQY-UHFFFAOYSA-N 445.304 4.983 50 10 IJGE CN(C[C@]1(CBr)CC1(F)F)[C@H]1CCCC[C@@H]1N(C)C(=O)OC(C)(C)C 2326920465 ZZUJMAASZYKGFT-GRDNDAEWSA-N 425.358 4.517 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)[C@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1C 2331259060 FUJSQJAIUGODSE-AWEZNQCLSA-N 445.500 4.605 50 10 IJGE COc1ccc(OC)c(-c2csc(C(C#N)=Cc3cc(OC)c(OC)cc3OC)n2)c1 2331450618 GOTIXYHPWOLVIG-UHFFFAOYSA-N 438.505 4.917 50 10 IJGE O=C(NCC(F)(F)C(F)(F)CBr)c1ccccc1OCc1ccccc1 2336537376 WCMXTOHECXDYCF-UHFFFAOYSA-N 434.227 4.661 50 10 IJGE CN(c1c(CBr)c(C(F)(F)F)nn1C)[C@H]1CC[C@H]1OCc1ccccc1 2339772985 CRVQBWWJRUOHIC-LSDHHAIUSA-N 432.284 4.518 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@@H]1CCCC[C@@H]1C(F)(F)F 2343417125 VPBLMEYKWDLHQP-BBWFWOEESA-N 436.312 4.842 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@]12CCC[C@H](CN(C[C@@]3(CBr)CC3(F)F)C1)C2 2351893725 HSWMQASPWRITLO-WBAXXEDZSA-N 437.369 4.518 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]2CN(C[C@H](CBr)c3ccccc3)C[C@@H]2C1 2358235044 DBGXSTWZSRQNFE-FYQPLNBISA-N 437.422 4.790 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCC2CC1(CBr)C2 2361694734 SYLNATLNWCVBKJ-UHFFFAOYSA-N 425.523 4.631 50 10 IJGE CCOC(=O)c1c(-c2ccc(F)cc2)csc1NC(=O)/C(C#N)=C/c1ccc(O)cc1 2277150 ZXVRKASKVVOLGR-LFIBNONCSA-N 436.464 4.982 50 10 IJGE CCCOc1ccccc1/C=C(\C#N)C(=O)Nc1sc(C(C)=O)c(C)c1C(=O)OCC 40948914 WKCQCPMSQXSGHM-SFQUDFHCSA-N 440.521 4.770 50 10 IJGE CC(C)N(Cc1cccs1)S(=O)(=O)c1cc(CCl)sc1Br 91271808 AXJWLMBGAJQJAL-UHFFFAOYSA-N 428.826 4.910 50 10 IJGE CC(C)(C)[C@H](CCBr)NS(=O)(=O)c1ccc(Br)cc1Cl 231188209 XPGKRQYKLKDZKZ-LBPRGKRZSA-N 447.620 4.581 50 10 IJGE CC[C@H](Br)[C@H](CC)NC(=O)c1cc(Br)cc(Br)c1 313095283 WAPKEZUIWZEDRQ-RYUDHWBXSA-N 441.989 4.894 50 10 IJGE CC(C)(C)OC(=O)NCCN1CCNC[C@H]1c1cccc(CO[Si](C)(C)C(C)(C)C)c1 616635611 ILPJKVTZZADHJZ-NRFANRHFSA-N 449.712 4.679 50 10 IJGE COc1ccc(Cl)cc1COC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 729344239 DDNPSRSALHHNRS-PDGQHHTCSA-N 446.894 4.776 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N(C)Cc2cnccn2)c(C)n1-c1cccc(Cl)c1Cl 735482889 MOMXKBLSIIMIFF-LICLKQGHSA-N 440.334 4.757 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N[C@@H](Cc2nccn2C)c2ccccc2)c(C)n1CC(C)C 744376267 WIGGYMOQEQVAAF-BJYRUZDYSA-N 429.568 4.502 50 10 IJGE CC(=O)N(c1nc(/C=C(/C#N)C(=O)c2cccc(C#N)c2)cs1)c1ccc(F)cc1F 771535707 ZGOLLLBARLOBBM-PXNMLYILSA-N 434.427 4.767 50 10 IJGE COc1ccc(C(=O)NN=Cc2ccc(OCc3ccccc3)cc2)cc1Br 1084106545 UUPKOYRQVGIRTA-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE CC(C)(C)N(NC(=O)Nc1cc(F)ccc1F)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1 1088681169 QJCLVFULSBUJER-UHFFFAOYSA-N 426.807 4.504 50 10 IJGE C=CCC[C@@H](C(=O)NNC(=S)Nc1cc(OCC)ccc1OCC)c1ccccc1 1303280664 JCEOOUIXBXSCGG-LJQANCHMSA-N 427.570 4.552 50 10 IJGE CN(C)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3Cc2ccccc2)cc1 1865684116 UBAFZNLDDSPCAM-DEOSSOPVSA-N 447.542 4.883 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccccc2F)c1 1865693868 MHBMBLMGVKDTQD-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc3ccccc23)[C@H]1c1ccccn1 1865699756 BRYYYQIIVQKFPY-GOSISDBHSA-N 433.393 4.657 50 10 IJGE CCCC[C@H](NC(=O)C[C@@H]1CC(=O)c2ccccc21)C(=O)Nc1ccc(SC#N)cc1 1867243862 VNPBHMIDBMAGAN-KKSFZXQISA-N 435.549 4.634 50 10 IJGE N#CSc1ccc(NC(=O)CNC(=O)C[C@H](c2ccccc2)c2cccc(F)c2)cc1 1868142451 IFPTZFDBRUECNY-JOCHJYFZSA-N 433.508 4.676 50 10 IJGE N#C/C(=C(/O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1nc(-c2ccc(F)cc2F)cs1 1872817854 AGBYQBJUIBPVBD-VKAVYKQESA-N 430.348 4.855 50 10 IJGE COc1ccc(C/C(O)=C(\C#N)c2nc(-c3cc(OC)ccc3OC)cs2)c(OC)c1 1873920239 AQCLITYSSLQTCE-ZZEZOPTASA-N 438.505 4.880 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)CCc1ccc(C(F)(F)F)cc1 1994838671 YJUZICCCZDSOGV-AWEZNQCLSA-N 426.232 4.698 50 10 IJGE O=S(=O)(c1csc(CBr)c1)N(CCC(F)(F)F)Cc1ccccc1 2009640500 RPORAVZZDXRGKY-UHFFFAOYSA-N 442.322 4.786 50 10 IJGE Brc1cnc(N2C[C@H]3[C@@H](Br)CCC[C@H]3C2)c(Br)c1 2033547412 SILUMFLRJOFODQ-GDPRMGEGSA-N 438.989 4.606 50 10 IJGE CCC[C@H](CBr)CN1CCCCN(C(=O)OC(C)(C)C)CC(F)(F)C1 2046340055 UOUVUOUYMQTVNN-OAHLLOKOSA-N 427.374 4.766 50 10 IJGE ClCc1cc(Br)ccc1N1CCCN(Cc2ccccc2)CCOCC1 2088629437 ZGJZAHDPXDHEJE-UHFFFAOYSA-N 437.809 4.917 50 10 IJGE Brc1cccc([C@H](CI)OC[C@@H]2[C@H]3C[C@@H]4[C@H]2[C@@H]4C3)c1 2134536529 FKOJSISRKQDBLI-IYOGYMKFSA-N 433.127 4.844 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2[C@H]3CC[C@@H]([C@H]2C1)N(CC1(CBr)CCCCC1)C3 2163061871 IMOUUZJZAOEFKI-VJANTYMQSA-N 441.454 4.909 50 10 IJGE CN(C(=O)c1ccc(I)c(Cl)c1)C1CCC(CCl)CC1 2171093797 ILCIFVSTTOKLRC-UHFFFAOYSA-N 426.125 4.814 50 10 IJGE C[C@@H](Br)C[C@@H]1COCCN1Cc1ccc(Cl)c(Br)c1F 2185314784 TUYVEZRMYBANTE-MWLCHTKSSA-N 429.555 4.616 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Cl)C2 2190671247 QXOTZWVJYQGPAK-MHNYQROPSA-N 425.523 4.534 50 10 IJGE COc1ccc(C(C)C)cc1[C@H](Br)c1cnn(C)c1I 2203872928 HWYNMRNRDXHJDA-AWEZNQCLSA-N 449.130 4.641 50 10 IJGE Fc1c(CC23COC(CI)(C2)C3)ccc(Cl)c1Br 2222262003 QZJIFQWSQQMBKH-UHFFFAOYSA-N 445.497 4.768 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@@H]2CCS(=O)(=O)C2)c(C)c1Cl 2224317816 QZNMHPPAMIPGML-BXKDBHETSA-N 430.589 4.590 50 10 IJGE Br[C@@H]1CCCCCC[C@H]1OCCOCCOCCOCc1ccccc1 2227779673 OQCBGBOPWXMBET-NHCUHLMSSA-N 429.395 4.739 50 10 IJGE O=C(c1ccc(I)cc1)N1C[C@@H](Br)CC12CCCCC2 2241032268 SAIVDBFTGNDPHS-ZDUSSCGKSA-N 448.142 4.604 50 10 IJGE C=CC[C@]1(CBr)CCCN(C[C@H]2CC2(Br)Br)C1 2250410375 WSSUSXKYVZZMIH-VXGBXAGGSA-N 430.022 4.546 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCc1ncco1 2251303003 URVARNULNYKGQY-UHFFFAOYSA-N 425.902 4.674 50 10 IJGE Cn1ncc(Br)c1COc1c(Cl)cc(CBr)cc1Cl 2278819703 JEWOGNLIYITFNG-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE Cl[C@@H]1CCC[C@H]1CNCc1ccc(I)c(Br)c1 2306221348 GZNHOCBHXFDTAY-CMPLNLGQSA-N 428.539 4.551 50 10 IJGE Clc1ccc(CN2C[C@@H]3C[C@H](C[C@H]3Br)C2)cc1I 2315555319 PMIAILLNIQKOIL-GRYCIOLGSA-N 440.550 4.550 50 10 IJGE Cc1ccc(COc2ccccc2C=NNC(=O)c2cc(-c3ccccc3)nc(O)n2)cc1 2318418129 QJMKIEWTNBBEQN-UHFFFAOYSA-N 438.487 4.501 50 10 IJGE COc1ccc(C(C)=NNC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)c(OC)c1 2321266291 CNZYSDOOEUXJIK-UHFFFAOYSA-N 425.435 4.506 50 10 IJGE CN(C[C@]1(CBr)CC1(F)F)C1CCC(N(C)C(=O)OC(C)(C)C)CC1 2326916293 ZZMKSVXBZPECDA-MQBCKMQZSA-N 425.358 4.517 50 10 IJGE C[C@H]1CC[C@H](CBr)CN1Cc1cc(I)ccc1Cl 2327402300 GQUHSIKFDYTHJW-WDEREUQCSA-N 442.566 4.940 50 10 IJGE CCCN(CCC)c1ccc(/C=N/NC(=O)[C@@H]2COc3cc4ccccc4cc3O2)cc1 2935973 OQQPIKJTFYEBIY-YYYGAUAXSA-N 431.536 4.756 50 10 IJGE O=C(NNC(=O)c1ccccc1NC(=O)c1cccs1)OCc1ccc2ccccc2c1 20534105 WQFSOVFIFKDCHH-UHFFFAOYSA-N 445.500 4.725 50 10 IJGE C/C(N)=C(/C#N)c1csc(NC(=O)c2cccc3c(=O)c(C)c(-c4ccccc4)oc23)n1 24528338 CDEMVDDEAZYNTO-NBVRZTHBSA-N 442.500 4.691 50 10 IJGE Cc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc([N+](=O)[O-])cc1)CCC2 40812227 FGJIGRVUPKHFAC-LGUFXXKBSA-N 446.463 4.527 50 10 IJGE C[C@](CCl)(NS(=O)(=O)c1cc(Cl)c(Br)s1)c1ccccc1 134459570 ZKTPZKCAZVFATE-CYBMUJFWSA-N 429.188 4.597 50 10 IJGE ClC[C@H](I)[C@@H](CCl)OCc1ccc(Br)cc1 158540120 ARSJONRFLKEQKM-WDEREUQCSA-N 437.930 4.616 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)ccc1OC(=O)/C=C\c1ccccc1 206395442 IITXKELITKHLJZ-HXEQRSJYSA-N 438.483 4.537 50 10 IJGE N#C/C(=C/NC[C@@H]1COc2ccccc2O1)C(=O)Nc1ccccc1Sc1ccccc1 217243934 XRNSNNVJNZVIJF-NZCCEVMUSA-N 443.528 4.613 50 10 IJGE BrCc1cc(Br)c(OC[C@H]2CCOC2)c(Br)c1 232484698 KJPQYVDREUXITB-QMMMGPOBSA-N 428.946 4.522 50 10 IJGE COc1cc(OC)c(C=NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)c(OC)c1 254396841 YNQOIGKDEWJSRQ-UHFFFAOYSA-N 441.487 4.692 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccc(OC(F)(F)F)cc1)[C@@H](Br)C2=O 256023406 NLJRATGURPTVHS-VUCTXSBTSA-N 434.252 4.683 50 10 IJGE CCN(C(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C)[C@H](C)Cc1ccc(OC)cc1 303382101 WHIJPROQWZZJSO-MOVONWLUSA-N 449.595 4.679 50 10 IJGE O=C(OCC1c2ccccc2-c2ccccc21)N1CCC[C@H](I)C1 306441586 JEPZWBKDDHHWQB-AWEZNQCLSA-N 433.289 4.835 50 10 IJGE CN(CCCCBr)C(=O)c1cc(Br)c(Br)s1 385006151 FXUOLOJFPGKINR-UHFFFAOYSA-N 433.991 4.520 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@@H]2CC[C@H](Cl)C[C@H]2C1 398668291 GWHNQCVGIYFIOW-CIUDSAMLSA-N 427.589 4.753 50 10 IJGE O=C(CBr)c1ccc(F)c(SC(F)(F)F)c1I 575703763 IXDPDQKLZOINSZ-UHFFFAOYSA-N 442.997 4.620 50 10 IJGE C[C@@H]1CCN(Cc2cc(Cl)ccc2I)C[C@H]1CBr 700418766 NLUJKPKURYOOAX-ZYHUDNBSSA-N 442.566 4.798 50 10 IJGE CC[C@@H](C[C@@H](C)Cl)NC(=O)c1ccc(I)c(Br)c1 721601912 IOKXWJJQTXSYCZ-SCZZXKLOSA-N 444.538 4.580 50 10 IJGE C=CCOc1ccccc1C=NNC(=O)COc1ccc(C(C)(C)C)cc1Br 1084272624 PSAKSUYQXQPGPA-UHFFFAOYSA-N 445.357 4.841 50 10 IJGE C/C(=C/C(=O)C(F)(F)C(F)(F)C(F)(F)F)NNC(=O)c1ccc(-c2ccccc2)cc1 1084635113 RVGIOAPVAWJGLS-QXMHVHEDSA-N 448.338 4.894 50 10 IJGE C=CCOc1ccc(/C=C/C(=O)NNc2ccc(Cl)c(Br)c2)cc1OC 1156739912 BXQJMCZFDSBQTC-WEVVVXLNSA-N 437.721 4.832 50 10 IJGE CC(=O)N1CCc2c(NC(=O)/C(C#N)=C/c3cc(C)n(-c4ccccc4C)c3C)cccc21 1269899763 LDAMKKODOHZFPO-PXLXIMEGSA-N 438.531 4.857 50 10 IJGE C=CCN(CCC#N)C(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Br)cc2)c1C 1298465751 BTWGIDVXEJSFLJ-XMHGGMMESA-N 437.341 4.692 50 10 IJGE Cc1cc(Nc2ccc3c(c2)CCCC3)c(C(=O)NNc2ccc([N+](=O)[O-])cc2C)c(O)n1 1568794857 IASSSLIXASRZCX-UHFFFAOYSA-N 447.495 4.692 50 10 IJGE FC(F)Oc1ccccc1[C@H]1CN(Cc2ccccc2)C[C@@H]1CI 1614623379 CVEIPZQVFJEYQT-RDJZCZTQSA-N 443.275 4.939 50 10 IJGE Cc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)NCc3ccccc3Cl)c(C)c21 1772743657 IBUKFUBHTPLELJ-UHFFFAOYSA-N 449.938 4.950 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccn2)CCC3)cc1Cl 1772747751 TZGJXKRSPBRAQX-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE CCOc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc3ccccc23)ccc1O 1865681431 NDYBGFKLGWMPOV-XMMPIXPASA-N 438.487 4.656 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)/C=C/c1ccccc1 1865759515 DYLNGGRARXKIOS-KPKJPENVSA-N 426.303 4.838 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)Cc1cc(Cl)c(C(F)F)s1 1892928758 DHHFBTYYCPKPJH-QMMMGPOBSA-N 434.689 4.941 50 10 IJGE CCCn1nc(Br)nc1N(Cc1ccccc1)[C@H](CBr)C(C)C 1905466195 LZSQSQKKGFAWRC-OAHLLOKOSA-N 444.215 4.877 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@]23CC[C@](C)(CI)O3)C1 1918347496 SZKPMRIZUITEKJ-KZNAEPCWSA-N 435.346 4.540 50 10 IJGE C[C@]1(CI)CC[C@@]2(CN(Cc3ccccc3)C3(CCCC3)C2)O1 1939538445 YHARXRWKDYGNCM-UYAOXDASSA-N 425.354 4.948 50 10 IJGE BrC[C@H]1CN(Cc2ccc(Br)cc2Br)CCS1 1943858829 KOLDKDSAGISMPN-NSHDSACASA-N 444.030 4.524 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1csc(Br)c1Br 1945188880 DESDGVPYAFEMPJ-UHFFFAOYSA-N 446.002 4.519 50 10 IJGE Cn1ncc(Br)c1C[C@H](CBr)c1ccc(Br)cc1 2027121544 FYBQOZBXSLBSHJ-SNVBAGLBSA-N 436.973 4.666 50 10 IJGE FC1(F)CC(CO[C@H](CI)c2cccc(Br)c2)C1 2035120137 KDGCZQXCIVDOER-GFCCVEGCSA-N 431.058 4.987 50 10 IJGE CC[C@@H](CCCBr)NC(=O)c1cccc(Br)c1Br 2036512182 ZMTGMZSNMZNIKD-VIFPVBQESA-N 441.989 4.895 50 10 IJGE O=S(=O)(c1ccc(CBr)cc1F)N(Cc1ccccc1)CC1CCC1 2059265512 WOKAOJFSIFVPDS-UHFFFAOYSA-N 426.351 4.712 50 10 IJGE COc1ccc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)C(C)(C)C 2059312973 RQRZRVXRISZMPR-UHFFFAOYSA-N 426.376 4.580 50 10 IJGE Cc1nn(C)c([C@@H](Br)Cc2cccc(Br)c2)c1Br 2072306337 HJLISYOBJYTUDQ-NSHDSACASA-N 436.973 4.932 50 10 IJGE O=C1Cc2cc([C@@H](Br)[C@H]3C[C@H](Br)C3)c(Br)cc2N1 2076181766 IULSZLBEDARHRU-UPFKWVMWSA-N 437.957 4.553 50 10 IJGE C[C@H](CCCN(C)C(=O)OC(C)(C)C)N(C)C(=O)c1ccc(CBr)cc1 2111836575 ZWZVYYNASBVMGF-OAHLLOKOSA-N 427.383 4.689 50 10 IJGE O=C(NC[C@]12CCC[C@]1(CCl)C2)c1csc(Br)c1Br 2142942533 DTQGSNLVTZRKEL-CHWSQXEVSA-N 427.589 4.802 50 10 IJGE FC(F)(F)c1csc([C@H](Br)[C@@H]2CO[C@H]3COC[C@H]23)c1Br 2158066003 CZSAEAQZRZANAI-MTSNSDSCSA-N 436.087 4.627 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C(=O)[C@@H](Br)C2CCCC2)C2(CCCCC2)C1 2167035003 ZMNZFBVDZKSSHH-IRXDYDNUSA-N 443.426 4.769 50 10 IJGE Cc1sc(Br)cc1C(=O)N1CC[C@](CBr)(C(F)(F)F)C1 2167679784 PUAHGMBSOXDMCC-LLVKDONJSA-N 435.103 4.609 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 2185510336 ICOHREUTANNDLF-VXKWHMMOSA-N 437.466 4.943 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)c(Br)cc2n1Cc1nncs1 2234069148 QVFSTHYNVORTDH-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE Cc1sc(C(=O)N2CC(F)(F)C[C@@]2(C)CBr)c(C)c1Br 2234476879 YOVXYSVYOAHFTH-LBPRGKRZSA-N 431.140 4.762 50 10 IJGE CC[C@H](C)N(CCBr)C(=O)c1ccc(Cl)c(I)c1 2256389468 LKEOJCXYFXERGW-VIFPVBQESA-N 444.538 4.580 50 10 IJGE BrCc1nnc(Cc2cc(Br)cc(Br)c2)n1C1CC1 2277933231 QGKADMUALGOLKX-UHFFFAOYSA-N 449.972 4.624 50 10 IJGE C[C@@H]1CCN(Cc2cc(I)ccc2Cl)C[C@H]1Br 2307329347 ZROVBZXEQGGDDB-BXKDBHETSA-N 428.539 4.550 50 10 IJGE Clc1ccc(I)c(CN2[C@H]3CC[C@@H]2C[C@@H]3CBr)c1 2308522960 RGBDXNHZQHLZEL-IUPBHXKESA-N 440.550 4.692 50 10 IJGE CC(C)(C)OC(=O)N(CC1CC1)C1CCN(C[C@]2(CBr)CC2(F)F)CC1 2351889414 VLWUNVDRETVPNL-GOSISDBHSA-N 437.369 4.518 50 10 IJGE Cn1cc(I)c(C[C@H]2CCCc3ccccc3[C@H]2Br)n1 2367611723 RDPKIVBQZSTVBR-WBMJQRKESA-N 445.142 4.656 50 10 IJGE Cc1scc(C(=O)NC[C@@]2(CBr)C[C@H]2C(F)(F)F)c1Br 2369606940 URXLQGWMEIUWQS-KCJUWKMLSA-N 435.103 4.512 50 10 IJGE CC(C)c1ccc(OCC(=O)NNC(=O)c2ccc(C(C)(C)C)c(Br)c2)cc1 13981059 XIWYYMWQQKJMHJ-UHFFFAOYSA-N 447.373 4.710 50 10 IJGE COc1ccc(CC(=O)Oc2cccc(/C=C(/C#N)c3ccccc3OC)c2)cc1OC 31902759 KYPJEQBEBSUPAF-MOSHPQCFSA-N 429.472 4.925 50 10 IJGE Cc1nc2ccccc2n1CC(=O)N/N=C/c1ccccc1OCc1ccccc1Cl 59181271 ZZVGPWFAHKSWKT-VULFUBBASA-N 432.911 4.727 50 10 IJGE Cc1ccc(COc2ccccc2/C=N/NC(=O)c2cc(-c3ccccc3)nc(O)n2)cc1 169923099 QJMKIEWTNBBEQN-JVWAILMASA-N 438.487 4.501 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC(=O)/C(C#N)=C\Nc1ccc(Cl)c(C(F)(F)F)c1 217230414 ULMMWPCFIHCTDW-KTKRTIGZSA-N 440.765 4.734 50 10 IJGE Clc1ccc(N2CC[C@@H](N3CCN(Cc4ccccc4)CC3)C2)c(CBr)c1 312597803 FJUVIVAZEDKYFW-OAQYLSRUSA-N 448.836 4.631 50 10 IJGE FC(F)Oc1c(CBr)ccc(C(F)(F)F)c1I 575722377 AMGKCIODQMVYOW-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE ClCCc1nc2cc(Br)ccc2n1Cc1ncc(Br)s1 714926128 KNBSWFCLGAINTO-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE Cc1cccc([C@H]2CN(Cc3ccccc3)C[C@@H]2CI)c1[N+](=O)[O-] 725427262 JOIAJLUHFWJDSS-WMZOPIPTSA-N 436.293 4.554 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C[C@H](C)c2ccccc2C(F)(F)F)c1C 743462257 GPAWUGGSJFULOM-ZDUSSCGKSA-N 429.446 4.811 50 10 IJGE N#Cc1ccc(NNC(=O)C2(c3cc(F)cc(C(F)(F)F)c3)CC2)c(C(F)(F)F)c1 799752669 CKUFPXFADDAIFL-UHFFFAOYSA-N 431.311 4.910 50 10 IJGE CC(C)[C@@H](C(=O)N1CC=C(C#N)CC1)N(C)C(=O)OCC1c2ccccc2-c2ccccc21 1630798677 DFAGIIFUKNVUBD-VWLOTQADSA-N 443.547 4.574 50 10 IJGE C=CCc1ccc(OCC(=O)NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(OC)c1 1637502739 RMJPMBVHYNCHCG-UHFFFAOYSA-N 448.363 4.983 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(Br)ccc2C2CC2)c1C 1641297637 LLUHIIMULGDUPQ-UHFFFAOYSA-N 438.329 4.552 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]2CCCN(CC3(CBr)CCC3)C2)C1 1879198673 OTMDECZOXHWFDD-QZTJIDSGSA-N 429.443 4.911 50 10 IJGE Cc1ncc(Br)c(N(Cc2ccccc2)C2(CBr)CCC2)n1 1915765523 LIHKVGCLVNLJOP-UHFFFAOYSA-N 425.168 4.872 50 10 IJGE CC[C@@](C)(CCBr)NC(=O)c1csc(Br)c1Br 1945189221 LZVUBNBPIZXERN-NSHDSACASA-N 448.018 4.957 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@H]2CC[C@@H]3CC[C@H]2C3)C1 1947121233 RLGDHLKHQCFEJR-FPXQBCRKSA-N 449.373 4.786 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Cl)cc(C(=O)N[C@H]2C[C@@H](Br)C2)cc1Cl 2011824407 MTRZCSWVJYRLMO-AOOOYVTPSA-N 438.149 4.996 50 10 IJGE C[C@@](CBr)(NC(=O)c1cccc(Br)c1Br)C1CC1 2031482785 WULKPCRZETXCMO-ZDUSSCGKSA-N 439.973 4.505 50 10 IJGE CC(C)[C@H](Br)[C@H](C)NC(=O)c1ccc(Br)cc1Br 2041305813 ASCMVHWEQBLZAJ-UFBFGSQYSA-N 441.989 4.749 50 10 IJGE CC(C)(C)CN(Cc1ccccc1)S(=O)(=O)c1cc(F)ccc1CBr 2059266729 IPFLJSLZMSIOFV-UHFFFAOYSA-N 428.367 4.958 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1cc(Cl)cc(Br)c1 2081235038 AJIJJVVBLBTFPH-PELKAZGASA-N 444.538 4.682 50 10 IJGE C[C@]1(COc2c(Br)cc(Cl)cc2CBr)CSCCO1 2136552804 GBUJOLMOZNTTSZ-ZDUSSCGKSA-N 430.589 4.898 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CC[C@@H]1CN(CC1(CBr)CCCCCC1)C2 2136690956 FTHDTAXNCUEGDP-UTKZUKDTSA-N 429.443 4.959 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CCC([C@@H](F)CCl)CC1 2163238353 MQWTXUBOVVJJDB-ZDUSSCGKSA-N 427.539 4.641 50 10 IJGE C[C@H](CCCCCBr)NS(=O)(=O)c1c(Cl)cccc1Br 2174531262 YSAFIQPUQKRVDU-SNVBAGLBSA-N 447.620 4.725 50 10 IJGE O=C(N[C@H](CBr)c1cccs1)c1c(F)cc(Br)cc1F 2175668947 LMEODIHLOWOPCD-SNVBAGLBSA-N 425.092 4.655 50 10 IJGE C[C@H](CN(C)S(=O)(=O)c1cc(CBr)sc1Br)C(C)(C)C 2179784607 BJGZHJKTMXHUAS-SECBINFHSA-N 447.258 4.708 50 10 IJGE COCc1nnc(COc2c(Br)cc(Cl)cc2CBr)s1 2186554724 NDGRPPIFCOFRES-UHFFFAOYSA-N 442.560 4.574 50 10 IJGE COc1ccc(Br)c(CBr)c1OCC1CC(Br)C1 2220453906 HCEAXCGTNNZFPW-UHFFFAOYSA-N 442.973 4.905 50 10 IJGE Cc1ccc(I)c(C(=O)N2C[C@H](Br)CCC23CCC3)c1 2240921774 KZLGEOMPWQSTAW-GFCCVEGCSA-N 448.142 4.522 50 10 IJGE Cc1cc(Br)cnc1C(=O)N(Cc1ccccc1)C(C)(C)CBr 2243964093 BUISSAJTHQPAAI-UHFFFAOYSA-N 440.179 4.968 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC[C@H]2CCC23CCC3)C1 2247331176 ZXAZVBSVAWNOCY-BEFAXECRSA-N 449.373 4.788 50 10 IJGE O=C(N[C@H](CBr)CC(F)(F)F)c1scc(Br)c1Cl 2253545678 LDHRLIZYMUYOBW-BYPYZUCNSA-N 429.483 4.610 50 10 IJGE COc1ccc(CCNC(=O)C(C#N)=Cc2ccc(-c3cccc(Cl)c3)o2)cc1OC 2297616727 ITTDYYGAXVTATJ-UHFFFAOYSA-N 436.895 4.883 50 10 IJGE O=C(NN=Cc1cccs1)c1scc2c1NC(=O)C2(c1ccccc1)c1ccccc1 2297677899 CTIIUWFEVPZVSP-UHFFFAOYSA-N 443.553 4.860 50 10 IJGE C[C@H]1CO[C@](CBr)(Cc2ccc(Cl)c(I)c2)C1 2300240131 ILIUPKJSRPCFHJ-RNCFNFMXSA-N 429.523 4.677 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)N(C)C)cc(Br)c1OCc1ccccc1F 2313568634 VLMZEQWAZXSSLQ-UHFFFAOYSA-N 447.304 4.561 50 10 IJGE COc1ccc(C(C#N)=Cc2ccc(OC(=O)COc3cccc(OC)c3)c(OC)c2)cc1 2318356281 LBYGJUUCSIQPAA-UHFFFAOYSA-N 445.471 4.761 50 10 IJGE COc1ccc(C2CCN(C(=O)C(C#N)=Cc3ccc(Br)cc3)CC2)cc1 2324505729 TYPXTMWOVXDFBC-UHFFFAOYSA-N 425.326 4.771 50 10 IJGE C[C@@H]1CCN(Cc2ccc(I)c(Br)c2)C[C@H]1CCl 2325223362 OTQMEWKCPBMHTP-ZYHUDNBSSA-N 442.566 4.751 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](CC(F)(F)F)C1 2353826451 MTFXUUCGOBTUPY-LSDHHAIUSA-N 445.364 4.917 50 10 IJGE CC(C)(C)[C@@](C)(CBr)CN1CCC[C@]2(CN(Cc3ccccc3)CCO2)C1 2380175696 LZXADVYEONFSLJ-GOTSBHOMSA-N 437.466 4.801 50 10 IJGE Cn1nc(-c2ccccc2)c(-c2ccccc2)c(C(=O)Nc2ccc(SC#N)cc2)c1=O 9004796 QOOREOBUCCUZSD-UHFFFAOYSA-N 438.512 4.940 50 10 IJGE CC(C)CCOc1ccccc1C(=O)NNC(=O)COc1ccc(-c2ccccc2)cc1 14033746 QQZCJYFPTMGEIA-UHFFFAOYSA-N 432.520 4.619 50 10 IJGE Cc1ccc(CNC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2Cl)CCC3)cc1 40812568 PJXRPIFOPTYRIK-VFCFBJKWSA-N 449.938 4.950 50 10 IJGE C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@@H]3[C@@H]1CC/C2=N\NC(=O)c1ccc([N+](=O)[O-])cc1 59502061 KEQULFQWPVKPAT-JPZBDXLQSA-N 433.508 4.943 50 10 IJGE CC[C@H](Br)C(=O)Nc1nc2scc(-c3ccc(Cl)cc3Cl)n2n1 170486892 OZWZHDCPGQJLCW-VIFPVBQESA-N 434.146 4.877 50 10 IJGE CC(=NNC(=O)C(c1ccccc1)c1ccccc1)c1cccc(NC(=O)C(F)(F)F)c1 254505504 GUEFBCTVAXVWRK-UHFFFAOYSA-N 439.437 4.860 50 10 IJGE O=S(=O)(Nc1ccc(Br)cc1Br)c1ccccc1CCl 312537564 HXBSAVBTQZDPAS-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE O=S(=O)(Nc1cc(Br)cc(Br)c1)c1ccc(CCl)cc1 690357823 KYRBDOWEWQNOKP-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE O=C(NNC(=S)Nc1cccc(Br)c1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 731232094 FPPBPAZUJFTOKP-RTBURBONSA-N 440.366 4.724 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(COC4CCCC4)cc3)n[nH]2)cc1C 756684933 MAJRRKBQDKYTAO-UHFFFAOYSA-N 447.539 4.619 50 10 IJGE COC(=O)C(C)(C)[C@@H](NCCP(=O)(c1ccccc1)c1ccccc1)c1ccccc1 775552675 IUVZSICDSNDSAF-DEOSSOPVSA-N 435.504 4.531 50 10 IJGE O=C(NN=Cc1ccc(OCc2ccccc2)cc1)C(=O)Nc1cc(Cl)cc(Cl)c1 1083980082 RPCCFUXMXHMTTQ-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cc(F)c(Br)c(Cl)c1 1585173783 OQLMGTGWDHUGJK-UHFFFAOYSA-N 427.686 4.604 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(N=Nc3ccccc3)cc2)cc1 1672393065 PZIIHKAUFNZULQ-KRWDZBQOSA-N 445.479 4.925 50 10 IJGE Cc1c(C(=O)Nc2cccc3ncccc23)oc2c1C(=NNC(=O)c1cccs1)CCC2 1772749667 OYUQCDFSSHYGGB-UHFFFAOYSA-N 444.516 4.920 50 10 IJGE Cc1c(Br)sc([C@H](Cl)[C@@H]2CCCCS2(=O)=O)c1Br 1922942220 QXYAAPUSYHAEKF-IONNQARKSA-N 436.618 4.829 50 10 IJGE CCN(C[C@@H](C)Br)C(=O)c1csc(Br)c1Br 1937734558 LNDOMGAOKQEHMD-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OC1CC2(CCCCC2)C1 1989968440 UTRBGFKZGNUMBB-QGZVFWFLSA-N 437.362 4.834 50 10 IJGE C[C@@H]1CCN(Cc2ccc(I)c(Cl)c2)[C@H]1CBr 2026561967 WWPKRCZCWARDEC-RNCFNFMXSA-N 428.539 4.550 50 10 IJGE C[C@@H]1CO[C@](CBr)(Cc2ccc(I)c(Cl)c2)C1 2026563466 KIDUIYOPAFYDLC-ZANVPECISA-N 429.523 4.677 50 10 IJGE C[C@]1(CBr)CCCN1C(=O)c1cccc(Br)c1Br 2031489139 JRWJBVCISMXTAY-CYBMUJFWSA-N 439.973 4.601 50 10 IJGE CC[C@@H](CCBr)CNC(=O)c1c(Br)cccc1Br 2033092399 BCMVROULXDCLMB-VIFPVBQESA-N 441.989 4.753 50 10 IJGE BrCC1CC2(CCN2Cc2cc(Br)ccc2Br)C1 2054716806 FPFUSELTOWUTKU-UHFFFAOYSA-N 438.001 4.961 50 10 IJGE CC(C)[C@H](CBr)CN=[S@@](=O)(C(C)C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2063273393 MHDGDVSDYCKBCW-ITNZAGEZSA-N 439.460 4.539 50 10 IJGE COc1cccc(C)c1-n1nc(CCl)c(I)c1C(F)(F)F 2079211925 FLVGPLQALAKVFT-UHFFFAOYSA-N 430.595 4.552 50 10 IJGE C[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)N(C[C@@H](CBr)c2ccccc2)C1 2106787546 ZTURUBRGGVOLQK-QRQLOZEOSA-N 425.411 4.790 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC2(CCC2)C[C@@H]1CBr 2115922311 BUKCZIOOVOUFNF-MRVPVSSYSA-N 427.589 4.944 50 10 IJGE O=S(=O)(c1ccc(CBr)cn1)N(Cc1ccccc1)CC1CCCCC1 2123233205 AZRIAPFBGHGJPD-UHFFFAOYSA-N 437.403 4.748 50 10 IJGE C[C@@H]1C[C@@H](C)N(Cc2ccc(CBr)cc2)C[C@H]1CNC(=O)OC(C)(C)C 2126464444 AWBYEQPUWLYJBV-GPMSIDNRSA-N 425.411 4.953 50 10 IJGE CC(C)(C)OC(=O)N1CCN(Cc2ccc(CBr)cc2)C[C@@H]1CC(F)F 2126472467 VEBCKXHHMNZLLP-INIZCTEOSA-N 433.337 4.658 50 10 IJGE Fc1ccc2nc(CCCl)n([C@@]34C[C@@H]3CN(Cc3ccccc3)C4)c2c1Br 2155870768 BYDMDNUPGNTXIO-QVKFZJNVSA-N 448.767 4.950 50 10 IJGE CO[C@]1(CBr)CCCN(Cc2ccc(Cl)c(Br)c2F)C1 2166823376 FDYSVQHIQMPRGE-AWEZNQCLSA-N 429.555 4.618 50 10 IJGE O=C(Nc1cccc(CCBr)c1)c1cc(I)ccc1F 2169668614 SAJQQUIUPDHYGO-UHFFFAOYSA-N 448.073 4.620 50 10 IJGE CC[C@@H]1CC[C@H](C)N(S(=O)(=O)c2cc(CBr)sc2Br)C1 2179788148 YOPMJMHMOPRVLL-VHSXEESVSA-N 445.242 4.605 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@H]1C[C@@H](C(C)(C)C)CN(C(=O)OC(C)(C)C)C1 2196908356 XFGRECCYHAZLPH-VUROTCPHSA-N 445.442 4.538 50 10 IJGE BrC1CCC2(CC1)CCN(C[C@H]1CC1(Br)Br)C2 2213089141 VHNSBSNIOPUADR-VOMCLLRMSA-N 430.022 4.522 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)C1(C)CC2(CC(F)(F)C2)C1 2230582951 POHWOFXBXGFSOI-MRXNPFEDSA-N 430.333 4.641 50 10 IJGE CC[S@](=O)CCn1c([C@@H](C)Cl)nc2cc(Br)c(Br)cc21 2234059310 IJTSIKHNFHEYQM-SQFXPLBJSA-N 442.604 4.630 50 10 IJGE COC[C@@H]1CC[C@@H]([C@H](Br)c2ccc(OC)c(I)c2)C1 2269541302 DHRKCFQFJPTZHR-HFAKWTLXSA-N 439.131 4.799 50 10 IJGE C[C@H]1C[C@H](CBr)CCN1C(=O)c1cc(Br)c(F)cc1Cl 2285846752 RRIKBDTWMAZQBA-DTWKUNHWSA-N 427.539 4.877 50 10 IJGE COc1ccc([C@@H](Cl)c2cnsc2Br)cc1I 2300281999 HMCTYDFPBYPIQF-SNVBAGLBSA-N 444.519 4.847 50 10 IJGE N#CC(=Cc1cccc(Br)c1)C(=O)Nc1ccccc1C(=O)NC1CCCC1 2329698904 DSXXSKGXSKZINE-UHFFFAOYSA-N 438.325 4.667 50 10 IJGE CN(C[C@@H]1CN(CC2(CBr)CC(C)(C)C2)CC12CC2)C(=O)OC(C)(C)C 2345005608 AZRHLNGUDZQNQL-MRXNPFEDSA-N 429.443 4.767 50 10 IJGE CN(C[C@]1(CBr)CC1(F)F)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 2351892389 OQZVVZFMXHEACQ-MAUKXSAKSA-N 433.337 4.605 50 10 IJGE CN(C[C@H]1CCCCN1Cc1ccccc1)c1c(CBr)c(C(F)F)nn1C 2365330919 VZUTYJNWCPQCAG-MRXNPFEDSA-N 441.364 4.744 50 10 IJGE CCCOc1ccc(/C=N/NC(=O)CSc2nc(-c3ccccc3)cs2)cc1OC 40924385 LFKNBJDDLBSYKN-YDZHTSKRSA-N 441.578 4.850 50 10 IJGE CCCCCOc1ccc(/C=C2\C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)cc1OC 214319171 KZLXRKGWQCUCPK-MOSHPQCFSA-N 434.492 4.650 50 10 IJGE N#C/C(=C/N1CCN(c2cccc(Cl)c2)CC1)C(=O)Nc1cccc(C(F)(F)F)c1 217147020 VCISFSQXQCCTPI-PFONDFGASA-N 434.849 4.527 50 10 IJGE N#C/C(=C/Nc1ccc(Br)cn1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 217250822 WJNPGQKDBKKKLW-CLFYSBASSA-N 445.626 4.974 50 10 IJGE CCc1ccc(C=NNC(=O)CSc2nc3ccccc3n2Cc2ccccc2)cc1 263627277 PWXXOHHHFVOHBZ-UHFFFAOYSA-N 428.561 4.889 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCC[C@H]1CCBr 304540811 KPFPSFYNGZHQSF-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE BrCc1cc(Br)cc(Br)c1OC[C@@H]1CCCO1 310369991 NJCAMLGXLITEIP-JTQLQIEISA-N 428.946 4.664 50 10 IJGE ClCc1nc2ccncc2n1-c1ccc(I)c(Br)c1 312001988 UUCPIELIPSVXBL-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE O=[N+]([O-])c1cc(CBr)ccc1N1CC[C@@H]2CC[C@H](C1)N2Cc1ccccc1 717413071 RCRWGCRLHHWLRH-RBUKOAKNSA-N 430.346 4.733 50 10 IJGE O=C(NC[C@H](c1c(F)cccc1Cl)N1CCCC1)NNc1ccc(OC(F)F)cc1 726705212 DNWQWPRCUVLZIM-QGZVFWFLSA-N 442.869 4.544 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)c1C 726766097 LFZADOHQPNNBQO-NBZOHKLQSA-N 444.539 4.521 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OCCOc2ccccc2)c(-c2ccc(Cl)cc2)n1 782086878 HGNJIKMTOHFYOV-CYVLTUHYSA-N 446.894 4.646 50 10 IJGE CC(C)(C)OC(=O)N1CCc2ccc(C(=O)NNc3ccc(Cl)c(F)c3)cc2CC1 789819045 VCRPWWAJUXYWDY-UHFFFAOYSA-N 433.911 4.572 50 10 IJGE C[C@@H](CBr)[C@@H]1CCCCN1c1ncc(Br)cc1Br 829246398 LJNHJXNVENQVLV-CABZTGNLSA-N 441.005 4.997 50 10 IJGE COc1ccccc1CN(C[C@H](CBr)C1CC1)c1ccc2nc(O)[nH]c2c1 1167788631 CHTWCEPADQXMSH-INIZCTEOSA-N 430.346 4.705 50 10 IJGE Cc1ccc(Oc2ccccc2CC(=O)NNc2nc(-c3ccccn3)nc(C)c2C)cc1 1558934737 KXOXDTHJYQBUDF-UHFFFAOYSA-N 439.519 4.942 50 10 IJGE Cc1c(C(=O)N2CCCC[C@H]2C)oc2c1C(=NNC(=O)c1ccc3ccccc3n1)CCC2 1772751535 SZJVKIPQKABCPH-MRXNPFEDSA-N 444.535 4.621 50 10 IJGE Cc1ccc(-n2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2c[nH]c3ccccc23)cc1 1865700566 XMHDLTXTEHARQQ-GOSISDBHSA-N 435.409 4.899 50 10 IJGE CCN(C[C@@](C)(CI)OC1CC(C)(C)C1)C(=O)OC(C)(C)C 1932710246 LLMQLIOEQSZEQY-QGZVFWFLSA-N 425.351 4.642 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Br)cc2Br)C[C@@H]1Br 1943851827 TWJYGIRAXKRUMB-RNCFNFMXSA-N 425.990 4.817 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1ccc(O)c(Br)c1 1980634364 JXQOCUMMRDEGMN-CYBMUJFWSA-N 441.163 4.971 50 10 IJGE C[C@]1(NC(=O)c2scc(Br)c2Br)CCC[C@@H]1Br 2011556650 SUCOHRFOCVHNQS-CPCISQLKSA-N 446.002 4.709 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OCC[C@@]23CCC[C@H]2C3)CC1 2011684860 IOUKTDSNIBEOBY-MAUKXSAKSA-N 449.373 4.788 50 10 IJGE CC(C)[C@H](Br)CN(C)Cc1ccc(I)c(Cl)c1 2026567858 WBKNDIKWPUDPCR-LLVKDONJSA-N 430.555 4.796 50 10 IJGE C[C@@H](Cl)[C@H](NC(=O)c1csc(Br)c1Br)C(F)(F)F 2074720877 PUWRTPRCGUCFPN-CVYQJGLWSA-N 429.483 4.561 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Cl)c2)CC[C@@H]1CBr 2086661470 MRAFYMYFESKFHE-ZYHUDNBSSA-N 442.566 4.798 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C[C@@H](CBr)c2ccccc2)CC12CCC2 2163059307 RYUJAABKUJYQMK-MOPGFXCFSA-N 437.422 4.934 50 10 IJGE C[C@@]1(CC(CBr)(CBr)c2ccccc2Cl)COCCO1 2174171465 MTQZGLHKQMOSQV-CQSZACIVSA-N 426.576 4.563 50 10 IJGE CN(C(=O)c1ccc(Cl)c(Br)c1)[C@@H](CCBr)C(F)(F)F 2178515165 JQJAXZWZJBRQJH-JTQLQIEISA-N 437.481 4.890 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(Cc2ccc(CBr)cc2)C1 2182845567 RRZPJQGSWUSJKA-HAGHYFMRSA-N 435.406 4.659 50 10 IJGE C[C@H](c1nscc1Br)N(C)c1cc(CBr)sc1[N+](=O)[O-] 2186580484 JUBKXACYEXYEAY-ZCFIWIBFSA-N 441.170 4.968 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC1C2CC3CC(C2)CC1C3 2216643323 GDUQGUNMDUULIH-HJCGZBHYSA-N 449.373 4.546 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)C2(S(C)(=O)=O)CC2)c(C)c1Br 2227350867 IYUYCSFFDQYJMY-GFCCVEGCSA-N 430.589 4.686 50 10 IJGE Cc1ccc(C(=O)N2C[C@@H](Br)CCC23CCC3)cc1I 2232833856 POUYAOSEBFCDDH-ZDUSSCGKSA-N 448.142 4.522 50 10 IJGE Cc1sc(C(=O)NC[C@]2(F)CC[C@@H](CBr)CC2)cc1Br 2234475061 MQMBVFOLERDCNL-WJONMLJTSA-N 427.177 4.842 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CCC2(CC1)C[C@H]2CBr 2264512886 FDCPVYKIYZBWPZ-QMMMGPOBSA-N 427.589 4.801 50 10 IJGE O=C(c1scc(Br)c1Cl)N1[C@H]2CC[C@@H]1C[C@@H](CBr)C2 2264514243 LRCLMHRBJZDFLT-PSVAKVPMSA-N 427.589 4.942 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2CCCOC2(C)C)cc1I 2269551550 ABLLCMYCZVMHMD-SMDDNHRTSA-N 439.131 4.941 50 10 IJGE CC1(C)[C@@H](NC(=O)c2cc(Br)c(F)cc2Cl)CC[C@H]1Br 2285836940 IEKMRMBFMJIWFE-NEPJUHHUSA-N 427.539 4.924 50 10 IJGE BrCCC[C@@H]1CCCN(Cc2sccc2I)C1 2301075149 ZNJZEIAINQNXPE-LLVKDONJSA-N 428.177 4.740 50 10 IJGE CC(C)(CCl)CCNCc1ccc(I)c(Br)c1 2306218796 DUEPCKOPXUBNHW-UHFFFAOYSA-N 430.555 4.798 50 10 IJGE Clc1ccc(CN2C[C@H](CBr)C3(CC3)C2)cc1I 2315553497 SZJZJMKJJYGUJX-NSHDSACASA-N 440.550 4.552 50 10 IJGE COc1ccc(C)cc1-c1csc(C(C#N)=C(O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)n1 2331324330 KOGFNLLIWKOXDW-UHFFFAOYSA-N 438.421 4.893 50 10 IJGE CN(Cc1ccc(Cl)cc1I)C1(CCl)CCSCC1 2341052714 USDOQSBBHSAEDN-UHFFFAOYSA-N 430.182 4.881 50 10 IJGE CC(C)N(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@]1(CBr)CC1(F)F 2351886835 FGBGYQJSTZBWNR-MAUKXSAKSA-N 439.385 4.764 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)Cc1nccc(OCCCOC)c1C 2364654737 GEKWLKWEJCBXPR-HXUWFJFHSA-N 435.406 4.981 50 10 IJGE O=C(Cc1cccc2ccccc12)N[C@H](CCBr)COCc1ccccc1 2369431369 QDMWJLVMUIWDME-OAQYLSRUSA-N 426.354 4.869 50 10 IJGE COc1cccc(-c2nn(-c3ccccc3)cc2/C=C(\C#N)C(=O)NC2CCCCC2)c1 35446333 AUCWHRRWDBFMND-HMMYKYKNSA-N 426.520 4.904 50 10 IJGE C=CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(F)cc4)ccc32)cc1 38658029 SKCSUOJIGLZLRD-DEOSSOPVSA-N 442.446 4.828 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccc(OC)cc4)ccc32)cc1 38677631 YLLRJOQIGQEJNH-SANMLTNESA-N 440.499 4.624 50 10 IJGE CCN1C(=O)C(C#N)=C(C)/C(=C\c2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)C1=O 101332461 VNHHMJMDLDLMSW-FYJGNVAPSA-N 442.906 4.805 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Br)c3cc(Cl)ccc3F)cc2[nH]1 109884269 YOACKFPBLISOIB-ZDUSSCGKSA-N 434.490 4.896 50 10 IJGE COc1cc(/C=N/NC(=O)Nc2ccccc2)cc([N+](=O)[O-])c1OCc1cc(C)ccc1C 169885143 AEQOKRVJJPNFPA-AFUMVMLFSA-N 448.479 4.955 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)CSc2ccc(C)cc2)c(OC)c1 207161793 MPABDJUMLYXQEA-UYRXBGFRSA-N 438.549 4.525 50 10 IJGE N#C/C(=C/c1ccccc1OCC(=O)Nc1nccs1)c1nc(-c2ccco2)cs1 214015468 VOOPSRDBTQXYAT-GDNBJRDFSA-N 434.502 4.941 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C\Nc2ccc(I)cc2C)c(C)c1 217245207 KCJOZLCNLOZIJW-PTNGSMBKSA-N 431.277 4.675 50 10 IJGE O=C(NC[C@H]1CCCC[C@@H]1CCl)c1ccc(I)c(Cl)c1 232348874 PMYCYKORHVUEBR-VXGBXAGGSA-N 426.125 4.720 50 10 IJGE COc1cc(NC(=O)[C@@H](Br)C(C)C)c(Br)cc1Br 234878729 PFHCVUZTIFSGQE-NSHDSACASA-N 443.961 4.578 50 10 IJGE C[C@@H](C[C@@H](C)Br)NC(=O)c1cc(Br)cc(Br)c1 235187971 YEOLVBNHBIJVCA-SFYZADRCSA-N 427.962 4.503 50 10 IJGE O=C(Nc1ccccc1C(=O)NN=Cc1ccccc1Br)c1ccc(F)cc1 252637808 XWOSMCSDMGCUBC-UHFFFAOYSA-N 440.272 4.604 50 10 IJGE ClCCc1nc2cc(Br)ccc2n1C1[C@H]2CN(Cc3ccccc3)C[C@H]12 398475424 YSPDUNMBHMWYGK-IRXDYDNUSA-N 430.777 4.883 50 10 IJGE COC(=O)[C@]1(CCF)C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 688653210 FEABJMIWUVCDET-GCJKJVERSA-N 439.600 4.691 50 10 IJGE COC(=O)[C@]1(C2CC2)C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 688654891 SKCMDIFLVOEBIE-AUSIDOKSSA-N 433.621 4.741 50 10 IJGE C[C@H]1CN(Cc2cc(Cl)ccc2I)C[C@]1(C)CBr 694632281 LCOZJIGOVRVBRW-HZMBPMFUSA-N 442.566 4.798 50 10 IJGE O=C(NC1(CCBr)CCSCC1)c1ccc(Br)cc1Cl 719665415 LAQHAIBHVPKDBT-UHFFFAOYSA-N 441.616 4.883 50 10 IJGE CC(C)(C)n1cc(C(=O)NNC(=O)c2ccc(Cl)cc2)c(-c2ccccc2Cl)n1 730955783 ZOJSEHBQUCCRTG-UHFFFAOYSA-N 431.323 4.687 50 10 IJGE COc1cc(C=NNC(=O)CC[C@@H](O)c2ccccc2)ccc1OCc1ccc(C)cc1 1083892631 UEZYKXUSOLAUGK-HSZRJFAPSA-N 432.520 4.547 50 10 IJGE CCn1c(SCC(=O)NN=Cc2ccccc2OCc2ccccc2)nc2ccccc21 1084272474 GZNSHBBYPVPRGC-UHFFFAOYSA-N 444.560 4.878 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)c1cc2c(s1)CCC2)c1ccc(C(F)(F)F)cc1 1224643856 VZQVYOTWRGHTLT-MRXNPFEDSA-N 437.487 4.907 50 10 IJGE O=C(NNc1ccc(F)cc1Br)c1cc2ccc(C(F)(F)F)cc2nc1O 1545949000 AYDHOKLURIGWSO-UHFFFAOYSA-N 444.182 4.618 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3-c2ccc(OC)cc2)cc1 1865690642 XUAVCDZPRWPDFD-HSZRJFAPSA-N 444.535 4.840 50 10 IJGE Cc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865698687 AIXHYSKCYBHDRF-OAQYLSRUSA-N 433.874 4.732 50 10 IJGE COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2-c1ccccc1Cl 1865709981 LSSXXLWQTLHRKG-MRXNPFEDSA-N 446.816 4.771 50 10 IJGE CC[C@@H](NC(=O)[C@H](c1ccc(OC)cc1)C(C)C)C(=O)Nc1ccc(SC#N)cc1 1866980738 RFAYLYKQRSGWGG-RTWAWAEBSA-N 425.554 4.541 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C2CCN(C[C@@H](CBr)CC3CC3)CC2)C1 1879198037 HVXIRLVUDPOZQW-MJGOQNOKSA-N 429.443 4.767 50 10 IJGE Cc1cc(Br)c(F)c(C[C@@H](CBr)NC(=O)OC(C)(C)C)c1 1885098338 XWGYPPVRCBXFSN-NSHDSACASA-N 425.136 4.727 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2[C@H](Br)CC[C@H]2C1 2033086015 HQIVPTFJPBEFGY-IMSIIYSGSA-N 438.001 4.817 50 10 IJGE C[C@@H]1CCc2nn(-c3cc(Br)cc(C(F)(F)F)n3)c(CBr)c21 2080520348 SPTVCJOIIZMWDX-SSDOTTSWSA-N 439.073 4.993 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@@H](Cl)C(F)(F)CC1 2093616395 FIMIVAVEDSZEHP-SSDOTTSWSA-N 437.531 4.752 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CCC[C@@H](CN(C[C@@H](CBr)C3CCC3)C1)C2 2135001990 RCTOKZZPHRPEPT-BLIXFSHQSA-N 429.443 4.815 50 10 IJGE BrCc1c(N2CCC[C@]3(CCN(Cc4ccccc4)C3)C2)nc2sccn12 2163315282 YSWLPCHLJQGJOE-OAQYLSRUSA-N 445.430 4.783 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CCCN(C(=O)[C@@H](Br)C3CCCC3)C2)C1 2167034526 XDCANFZFEXNHCN-LAUBAEHRSA-N 443.426 4.580 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@H](CBr)CC(C)(F)F)cc1Cl 2169545718 ZQYPIEJKGXTJAW-QMMMGPOBSA-N 433.518 4.950 50 10 IJGE CN(C(=O)c1ccc(I)c(Cl)c1)[C@@H]1CCCCC[C@@H]1Cl 2172547480 NZPMHTCECQXPBP-SMDDNHRTSA-N 426.125 4.957 50 10 IJGE Brc1cccc([C@@H](CI)O[C@H]2C[C@H](n3ccnc3)C2)c1 2183661408 WHQWPWXATVDYFS-RBSFLKMASA-N 447.114 4.542 50 10 IJGE C[C@@H](Br)CCc1cn(Cc2ccc(Cl)c(Br)c2F)nn1 2189278722 QENGXQCUBGDGFI-MRVPVSSYSA-N 425.527 4.597 50 10 IJGE ClC[C@H](CC1CCOCC1)NCc1cc(Br)ccc1Br 2195484775 BQIXRSNTPBHXNV-AWEZNQCLSA-N 425.592 4.725 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1cccc(Cl)c1Br 2256123938 SHCUIXKSAAPZOD-KWQFWETISA-N 444.538 4.682 50 10 IJGE Clc1ccc(Br)cc1COC1(CI)CCOCC1 2263389389 MWCHXMOIFXDTEZ-UHFFFAOYSA-N 445.522 4.603 50 10 IJGE C[C@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@]1(C)CBr 2282977513 CVGZIXGHFZLYDW-RMLUDKJBSA-N 427.539 4.735 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CCCCS2(=O)=O)c(Br)c1Cl 2283561113 FKCKLBJFSNYCMC-QWRGUYRKSA-N 446.588 4.514 50 10 IJGE Cc1ccc(NC(=O)C(C#N)=Cc2ccc(OS(=O)(=O)c3ccc(C)cc3)cc2)cc1 2295172575 CIKFKJJXYYFQPZ-UHFFFAOYSA-N 432.501 4.617 50 10 IJGE Cc1ccc(CBr)cc1NC(=O)c1ccc(F)cc1I 2296126486 NCXQPUJVGXFUBO-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1Cc1ccc(Cl)c(I)c1 2300239137 UNVUTUTXRDVMOE-KOLCDFICSA-N 428.539 4.692 50 10 IJGE CC(C)C[C@H](Cl)CNCc1ccc(I)c(Br)c1 2306219972 RUJVQUQTNHNGPC-NSHDSACASA-N 430.555 4.797 50 10 IJGE C[C@@]1(CBr)C=CCCN1Cc1ccc(Cl)c(I)c1 2315548872 LWLUURIBKJTPNL-AWEZNQCLSA-N 440.550 4.860 50 10 IJGE Cc1nn(C)c(Oc2cc(Br)cc(Br)c2)c1CBr 2316757896 NVVZKGAIDRAEHE-UHFFFAOYSA-N 438.945 4.941 50 10 IJGE COc1c(Br)cc(C)c([C@H](N)C2CC(Br)C2)c1Br 2317427353 VGXSATWAFHCOBJ-WZQIAMPNSA-N 441.989 4.702 50 10 IJGE CC(C)[C@@H](CBr)N(C)C(=O)c1cc(Br)ccc1Br 2318852873 XIBZHMDYFXOMSL-GFCCVEGCSA-N 441.989 4.703 50 10 IJGE C[C@H](CCl)CC1CN(Cc2ccc(I)c(Br)c2)C1 2325211730 KSOUVCZWOFJLEV-JTQLQIEISA-N 442.566 4.751 50 10 IJGE N#CC(=C(O)CNC(=O)c1ccc(Cl)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 2331279488 FMYNSAGALWWQMA-UHFFFAOYSA-N 440.868 4.594 50 10 IJGE COc1ccc([C@H](Br)[C@]23C[C@H](CO2)C3(C)C)cc1I 2334828710 RCIQHGULUXMZDW-DGFSRKRXSA-N 437.115 4.551 50 10 IJGE COc1ccc(CCO[C@@H]2CCCC[C@@H]2I)c(Br)c1 2339257670 LUNGRQBYXCNSQA-LSDHHAIUSA-N 439.131 4.763 50 10 IJGE FC1(F)C[C@]12C[C@H]2CO[C@H](CI)c1ccc(Br)cc1 2352459481 QRHZDLJSLKNEGN-UHTWSYAYSA-N 443.069 4.987 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CNC(=O)[C@@H](Br)C3CCCC3)CCC[C@@H]12 2354959020 PLWMOSNPGRCHEP-LLGFUMIMSA-N 443.426 4.626 50 10 IJGE O=C(N[C@@H](CCl)CC1CCCC1)c1ccc(Cl)cc1I 2365598208 OYMYDQQAEKEMNH-GFCCVEGCSA-N 426.125 4.862 50 10 IJGE N#C/C(=C\c1cc(Cl)cc(I)c1O)c1ccc([N+](=O)[O-])cc1 33307041 QZPGYQTUKXYZTQ-VZUCSPMQSA-N 426.597 4.623 50 10 IJGE O=C(N/N=C/c1ccccc1COc1ccccc1)c1nn(-c2ccccc2)c2c1CCC2 169927620 WDWJAHWMWXGTMA-MTDXEUNCSA-N 436.515 4.704 50 10 IJGE O=C(NC[C@H]1CCC[C@H]1Br)c1cc(Br)cc(Br)c1 232451356 HEUBIBGWOGJFFU-PRHODGIISA-N 439.973 4.505 50 10 IJGE CCO[C@@H]1[C@@H](Cl)C[C@H]1Oc1c(I)cc(Cl)c2cccnc12 252869824 SWSYEWXVAGUEPK-ZKYQVNSYSA-N 438.092 4.656 50 10 IJGE CCn1c2ccccc2c2cc(C=NNC(=O)CSc3nc4ccccc4[nH]3)ccc21 254289721 IEARNQZOADEDSL-UHFFFAOYSA-N 427.533 4.933 50 10 IJGE O=C(OCc1ccccc1)N1C[C@H](CI)[C@H](c2cccc(F)c2)C1 382737612 XXSPAZHQRBHNGR-WMZOPIPTSA-N 439.268 4.613 50 10 IJGE C[C@H](Cl)CC(C)(C)CNS(=O)(=O)c1cc(Br)ccc1Br 393580296 GOPZIVPILYSGGA-VIFPVBQESA-N 447.620 4.534 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1C(=O)c1cc(Br)c(Br)s1 395261218 RBMDCMAHXNYWGQ-RNFRBKRXSA-N 446.002 4.661 50 10 IJGE Clc1ccc(I)c(C[C@]2(CBr)CCCCO2)c1 405328496 FBZWXXVWNNOEAF-ZDUSSCGKSA-N 429.523 4.821 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccccc1[C@@H]1CCN(S(N)(=O)=O)c2ccccc21 616677172 URCMYWAKJPEQPL-IBGZPJMESA-N 432.662 4.754 50 10 IJGE CC1(C)[C@H](Br)CCN1C(=O)c1scc(Br)c1Br 705518217 QUSXPWCYEDSIIH-SSDOTTSWSA-N 446.002 4.661 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc(Oc3ccc(Cl)cn3)cc2)c1C 1318626092 ZAEVJAMROZZKJU-UHFFFAOYSA-N 446.898 4.753 50 10 IJGE COc1ccc(CC(=O)Oc2ccc(/C=C(\C#N)c3ccccc3OC)cc2OC)cc1 1615066454 AELHSJBEKJIAKD-XSFVSMFZSA-N 429.472 4.925 50 10 IJGE COc1cc(C=NNC(=O)COc2ccc(C)cc2C)ccc1OCc1ccccc1C 1772754196 QILDOXYWYOOCGM-UHFFFAOYSA-N 432.520 4.729 50 10 IJGE Cc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865702310 SEGFUPDDJODLOD-IBGZPJMESA-N 430.817 4.529 50 10 IJGE Cc1ccc(CCCC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)c(C)c1 1865761571 WKVRYAGOIFQZNJ-UHFFFAOYSA-N 437.367 4.940 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)C(=O)c1cc(Cl)cc(Br)c1 1916354784 LSZKDSLVXZBNFU-KRWDZBQOSA-N 431.157 4.999 50 10 IJGE O=C(N[C@H](CCCl)C(F)(F)F)c1cc(Br)c(Br)s1 1918557425 YQSCPPXNWVXQHF-ZCFIWIBFSA-N 429.483 4.563 50 10 IJGE C[C@H]([C@@H](Cl)c1c(Br)sc(Br)c1Cl)S(C)(=O)=O 1923049784 NQSJLHXMNFCFER-NQXXGFSBSA-N 430.998 4.640 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1csnc1Br 1925210755 IOHJGQNSBDQZBG-NSHDSACASA-N 432.181 4.722 50 10 IJGE Brc1ccc(Br)c([C@@H]2CC[C@@H](CI)O2)c1 1927790709 WSGSECUVBBXXIF-KWQFWETISA-N 445.920 4.867 50 10 IJGE CC[C@H](CCCBr)NC(=O)c1cc(Br)sc1Br 1948445560 RLPZPYQLQBWQMU-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]2(CC[C@@](C)(CI)O2)C12CCCCC2 1989553209 SEPMXSCCPPPNKU-WMZOPIPTSA-N 435.346 4.683 50 10 IJGE C[C@@H]1C[C@@H]1N(CCBr)Cc1c(Br)cccc1Br 2002028815 GFQXYEOGDWDHNZ-RNCFNFMXSA-N 425.990 4.817 50 10 IJGE C[C@@]1(NC(=O)c2scc(Br)c2Br)CCC[C@H]1Br 2011556652 SUCOHRFOCVHNQS-RDDDGLTNSA-N 446.002 4.709 50 10 IJGE Cl[C@H]1CCCC[C@@H]1CNc1ncc(I)cc1Br 2015756616 INIFFQQLKQNPJB-KCJUWKMLSA-N 429.527 4.658 50 10 IJGE Clc1ccc(I)c(CC[C@H](Br)CN2CCCC2)c1 2038107052 CJMBAVVUKRLUGP-LBPRGKRZSA-N 442.566 4.737 50 10 IJGE CC(C)(CCl)[C@@H]1CCCN1c1ncc(I)cc1Br 2069536061 PFQQXWWLZLAUQS-NSHDSACASA-N 443.554 4.683 50 10 IJGE Clc1ccc(I)c(CN2CC[C@H](CBr)C23CC3)c1 2070147439 TTXAWUJYTUDHNG-LLVKDONJSA-N 440.550 4.694 50 10 IJGE Cn1nc(COc2c(Cl)cccc2CBr)c(Br)c1Cl 2096689283 XBYKMJVKTSZDLN-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE C[C@@H]1CC[C@@H](C[C@@H](Br)c2cc(I)cc3c2OCC3)O1 2104815145 YVRLCVAGBQTZEA-LJWDBELGSA-N 437.115 4.620 50 10 IJGE C[C@@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)n(C2CC2)c1 2123267134 DGRWQIBVHRXQPC-HNNXBMFYSA-N 437.403 4.707 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@H]1CN(C[C@H](CBr)c1ccccc1)C2 2163058629 MBXOZQKWQCICOG-IPJJNNNSSA-N 437.422 4.792 50 10 IJGE O=C(c1cccc(Br)c1Cl)N1CCC([C@@H](F)CBr)CC1 2163245695 MXOYELQHVPFDAC-LBPRGKRZSA-N 427.539 4.688 50 10 IJGE CN(C(=O)c1cccc(Br)c1Br)[C@@H](CCCl)C(F)(F)F 2178513612 VAIJAFZUZRWNME-VIFPVBQESA-N 437.481 4.843 50 10 IJGE C[C@@H](CC(C)(C)C)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2179776453 UJORGXCGNSAANJ-VIFPVBQESA-N 447.258 4.851 50 10 IJGE C[C@@H](Cl)c1nc2cc(I)c(F)cc2n1CCP(C)(C)=O 2194061158 FIXVRHLLXFQHOK-MRVPVSSYSA-N 428.613 4.703 50 10 IJGE COc1cc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)ccc1CBr 2204548727 GFCGODRJSMNANT-LJQANCHMSA-N 443.307 4.843 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@H]1CCCC[C@H]1N(C)CCCCCI 2211186339 OYXPVZMTCQIPET-CVEARBPZSA-N 438.394 4.702 50 10 IJGE CC(C)(C)OC(=O)NC1(c2csc(NC(=O)[C@H](Br)C3CCCC3)n2)CC1 2224309899 IJUCNZAZZDMAPF-CYBMUJFWSA-N 444.395 4.549 50 10 IJGE CCOCc1cc(Br)c([C@@H](Br)[C@]2(COC)CCCO2)s1 2233033831 RTXRUHFHVVEGFY-ZIAGYGMSSA-N 428.186 4.679 50 10 IJGE CC[C@H](CCCBr)NC(=O)c1ccc(Cl)c(I)c1 2256398146 LIBQYDVFMRWPLH-SNVBAGLBSA-N 444.538 4.628 50 10 IJGE COc1ccc([C@@H](Br)c2nn(C)cc2Cl)c(Br)c1Cl 2268268662 SUMLYVFBMPLQDW-SNVBAGLBSA-N 428.939 4.982 50 10 IJGE CN(Cc1ccccc1I)c1ccc(CBr)cc1C#N 2280257711 NZDCAXZJUGISIE-UHFFFAOYSA-N 441.110 4.694 50 10 IJGE CN(CC1(O)CCN(Cc2ccccc2)CC1)CC1(CBr)CCCCCC1 2286414572 AWGZFMKQKODWAR-UHFFFAOYSA-N 437.466 4.681 50 10 IJGE CCOC(=O)C(C#N)=C1S[C@@H](Cc2ccccc2Cl)C(=O)N1c1ccc(C)cc1 2293039297 ZSSVYGAVFFLVSW-IBGZPJMESA-N 426.925 4.638 50 10 IJGE CC[C@@H](C)[C@H](CBr)NCc1cc(I)ccc1Cl 2307330057 JJTFRSHPEZBXJQ-RNCFNFMXSA-N 430.555 4.844 50 10 IJGE Brc1ccc(CN2C[C@H]3CC[C@@H](Br)[C@H]3C2)c(Br)c1 2308237524 LVAIOBHNIRAOHB-JIMOISOXSA-N 438.001 4.817 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@H]2[C@H]3COCC[C@H]32)c1 2313495708 OVIPCZRMKQZRID-RFGFWPKPSA-N 438.985 4.800 50 10 IJGE CCOc1cc(C=C2C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1F 2314610404 HUDITSWQRPWONI-UHFFFAOYSA-N 448.494 4.804 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)[C@H]2C2CC2)c(I)c1 2318539137 LHSMEAARDJRKHA-GXTWGEPZSA-N 440.550 4.692 50 10 IJGE COc1c(F)cc([C@@H](Br)c2cc(I)sn2)cc1F 2321067362 MTJBMPRYFWZMJL-SNVBAGLBSA-N 446.054 4.519 50 10 IJGE CCCOc1ccccc1C=NNC(=O)c1ccc(Nc2nc(O)c3ccccc3n2)cc1 2323766104 MQTNBKPQWXVSPT-UHFFFAOYSA-N 441.491 4.632 50 10 IJGE CN(CC[C@@H](Cl)c1cccs1)C(=O)c1sccc1I 2340428995 BUKCCHYMGZYWLW-SECBINFHSA-N 425.744 4.856 50 10 IJGE CC(C)(C)OC(=O)N[C@@]12CCC(F)(F)C[C@@H]1CN(CCCCCCBr)C2 2344057610 XBCPHWWWMKFEEB-CRAIPNDOSA-N 439.385 4.956 50 10 IJGE COc1cc(/C=N/NC(=O)c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2)ccc1O 12491746 PTGYILQUIOTJMG-JVWAILMASA-N 445.519 4.715 50 10 IJGE Cc1c(Cl)cccc1Nc1ncnc(NNC(=O)c2ccc(Cl)cc2)c1[N+](=O)[O-] 40588508 ZPLLTZVRHRYSBI-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE N#C/C(=C/c1cn(CC(=O)NCCc2ccccc2)c2ccccc12)c1nc2ccccc2[nH]1 50568399 CYUSCBWANYOQGX-PGMHBOJBSA-N 445.526 4.941 50 10 IJGE COc1cc(CC(=O)NCCCc2ccc(C)c(C)c2)ccc1OCCCBr 96034771 BAQKQHYNIXZXFE-UHFFFAOYSA-N 448.401 4.767 50 10 IJGE O=S1(=O)CCCC[C@H]1[C@@H](Br)c1cc(Cl)c(Br)cc1F 97896031 MCFLMJRDBHERGU-RYUDHWBXSA-N 434.552 4.645 50 10 IJGE CCCOc1cccc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccc(OC)cc4)nc3c2)c1 169925531 NDHKBZQFARBKRH-PKAZHMFMSA-N 442.519 4.715 50 10 IJGE Cc1ccc(I)cc1NC(=O)c1ccc(CBr)cc1 311601399 BCRIRSMQIKQHEI-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE ClCc1nc2ccncc2n1-c1ccc(I)cc1Br 311918579 GGDSGVXKWZMHTG-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE Cn1ncc([C@@H](Br)Cc2cccc3ccccc23)c1I 379230431 ZAUCRCBNVADJTE-HNNXBMFYSA-N 441.110 4.857 50 10 IJGE BrC[C@H](Nc1ncc(Br)cc1Br)C1CCCC1 386221623 INCQVQNNSWCGOX-NSHDSACASA-N 426.978 4.972 50 10 IJGE ClCc1nc2c(Br)cccc2n1C[C@H]1CN(Cc2ccccc2)CCCO1 390602777 JZTMRIGUJJIJCZ-QGZVFWFLSA-N 448.792 4.829 50 10 IJGE CO[C@](C)(COCc1ccccc1)Cn1c(CCl)nc2cc(Br)cnc21 702773784 QURRVUFGAGXPJO-IBGZPJMESA-N 438.753 4.555 50 10 IJGE CC(=O)CCc1ccc(OCCC(=O)NNc2ccc(Cl)c(Br)c2)cc1 1304018353 DAQGRFFYNDGBQW-UHFFFAOYSA-N 439.737 4.536 50 10 IJGE C/C(=C/c1cccnc1)C(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12 1540614001 QWTFWOGZYJXNHD-SSZFMOIBSA-N 442.906 4.815 50 10 IJGE COc1ccc2ccccc2c1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccccc1F 1865688189 MTFSQSHXMXYAIN-XMMPIXPASA-N 440.478 4.759 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865709855 IPXTYPYDDGETJP-QFIPXVFZSA-N 443.507 4.627 50 10 IJGE ClCC[C@@H](COCc1ccccc1)NCc1sccc1I 1892524524 TUDWYFOKMDOTJV-AWEZNQCLSA-N 435.758 4.657 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1ccccc1Br 1916374460 KCCQEFHTUJKMFZ-HNNXBMFYSA-N 441.163 4.501 50 10 IJGE F[C@]1(CBr)CCN(Cc2c(Br)cccc2Br)C1 1917118798 XXCWJHBLTJLTNG-LBPRGKRZSA-N 429.953 4.521 50 10 IJGE C[C@H]1CO[C@](CBr)(Cc2ccc(Br)cc2Br)C1 1943840874 DUMBPKKZVPEOJK-RNCFNFMXSA-N 426.974 4.944 50 10 IJGE CC[C@@H](CCCBr)NC(=O)c1scc(Br)c1Br 1948449665 NWQGJWRLBUUYOJ-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE C[C@@]1(CBr)CCCN1C(=O)c1c(Br)cccc1Br 2033085060 VAWLYZWESOGTGE-ZDUSSCGKSA-N 439.973 4.601 50 10 IJGE CCC[C@H](CBr)CN1CC[C@@H](C(F)(F)F)[C@@H](CNC(=O)OC(C)(C)C)C1 2106787495 ZHXDUCPPUTVMSM-QLFBSQMISA-N 445.364 4.823 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1CCc1nccn1Cc1ccccc1 2146217977 SMMYBZLTYMKFPU-AWEZNQCLSA-N 444.764 4.981 50 10 IJGE Clc1nc(Cl)n(-c2ccc3nccnc3c2Br)c1CBr 2175469803 HJRANFGUWYNAMG-UHFFFAOYSA-N 436.922 4.780 50 10 IJGE CC1(C)OCCO[C@@H]1COc1c(Br)cc(CCl)cc1Br 2186967414 KNPCWAIIPDJIKL-GFCCVEGCSA-N 428.548 4.523 50 10 IJGE CC[C@H](N)Cc1cc(Cl)cc(Br)c1OC[C@H]1C[C@@H](Br)C1 2196937898 MJRXZYMFDDKESM-NDMJEZRESA-N 425.592 4.935 50 10 IJGE FC(F)(F)[C@@]1(CCl)CCN(Cc2ccc(I)c(Cl)c2)C1 2208035123 BZGXHLZCVYWPFO-GFCCVEGCSA-N 438.058 4.938 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2CC(C)(C)CO2)cc1I 2257354094 JQRFIDSNDGQKRN-QWHCGFSZSA-N 425.104 4.551 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Cl)c1nn(C)cc1Br 2264356178 JALQOCKDCVMQDD-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE CC(C)(C)OC(=O)NCCOC1CCN(CC2(CBr)CCCCCC2)CC1 2281545573 CEGIWDFJBVMTDH-UHFFFAOYSA-N 447.458 4.728 50 10 IJGE CS(=O)(=O)c1cscc1C[C@H](CBr)c1ccc(Br)cc1 2288495325 RTWLNTYGPZTTPR-LLVKDONJSA-N 438.206 4.635 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCc2ccco2)ccc1OCCOc1c(C)cccc1C 2293582635 YQGYGNFAYOKJSO-UHFFFAOYSA-N 446.503 4.586 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@H](Br)[C@@H]1OCCO[C@H]1C 2295264776 JYCRNQWSJQJXQU-AQUOVQTQSA-N 428.548 4.659 50 10 IJGE O=S(=O)(N[C@H](CCCl)COCc1ccccc1)c1cc(Cl)sc1Cl 2303761868 IYQJQXNXUFAPRA-GFCCVEGCSA-N 428.790 4.548 50 10 IJGE COc1ccc(C(C#N)=Cc2ccc(OC(=O)c3cccc(NC(C)=O)c3)cc2)cc1OC 2320506474 KJLHWYBIWUPJCE-UHFFFAOYSA-N 442.471 4.946 50 10 IJGE Cc1ccc(-n2ccnc2CCCN2C(=O)c3ccccc3C2=O)c(CCl)c1Cl 2335423760 JJNZRXXHAUZZTR-UHFFFAOYSA-N 428.319 4.802 50 10 IJGE O=C(NCC(F)(F)C(F)(F)CBr)c1cccc(OCc2ccccc2)c1 2336535568 BFJYUKGWCJNPQO-UHFFFAOYSA-N 434.227 4.661 50 10 IJGE C[C@H](CCBr)CCN1C[C@@H]2CC(F)(F)CC[C@]2(NC(=O)OC(C)(C)C)C1 2344056676 DTQJMSBJTXYQFU-VKJFTORMSA-N 439.385 4.812 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@H]2CC[C@H]1C[C@H]2Br 2362297556 GRDFCPVHMLQZEY-KHQFGBGNSA-N 425.523 4.630 50 10 IJGE O=C(NC1(CCCl)CCSCC1)c1ccc(Cl)cc1I 2365594221 YODDGACJWRBRQB-UHFFFAOYSA-N 444.165 4.569 50 10 IJGE CCOc1cccc(N2CC[C@H]3CN(Cc4ccccc4)C[C@H]3C2)c1CBr 2367555676 OKMQNBODBVOHEF-PMACEKPBSA-N 429.402 4.939 50 10 IJGE C/C(=N\NC(=O)Cc1ccc(Br)c2ccccc12)c1ccc([N+](=O)[O-])cc1 20074913 NGOVFQXGANJIBH-LPYMAVHISA-N 426.270 4.593 50 10 IJGE N#CC1=C(N)Oc2c(c(=O)n(-c3ccccc3)c3ccccc23)[C@H]1c1ccc(Cl)cc1 20428291 RMLJMALYFPHECC-NRFANRHFSA-N 425.875 4.862 50 10 IJGE CCOC(=O)C1=C(c2ccc(OC)cc2)OC(N)=C(C#N)[C@H]1c1ccc(Cl)c(Cl)c1 35576452 OXYIGKPVMSCGTP-GOSISDBHSA-N 445.302 4.784 50 10 IJGE O=S(=O)(NC[C@H]1CCC[C@@H]1CCl)c1c(Cl)cc(Br)cc1Cl 91375705 CHHSZQZZUULLBC-RKDXNWHRSA-N 435.598 4.689 50 10 IJGE C[C@H]1C[C@H](O[C@@H](CI)c2cccc(Br)c2)C[C@@H](C)O1 253123722 KCMDHBIQMFYPCF-JLUCKKNBSA-N 439.131 4.898 50 10 IJGE COC(=O)NN=Cc1ccc(OCCOc2ccc(C3CCCCC3)cc2)c(OC)c1 254387424 POVMSAZMSZHANH-UHFFFAOYSA-N 426.513 4.891 50 10 IJGE CCCc1cc(=O)oc2cc(O[C@H](C)C(=O)NN=Cc3c(Cl)cccc3Cl)ccc12 254739379 CSZXCJDXOWLCJS-CYBMUJFWSA-N 447.318 4.970 50 10 IJGE ClCc1cc2scc(I)c2cc1I 307120633 IZKQIAIKDUPPJJ-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE O=C(NC[C@H]1CCC[C@@H](CCl)C1)c1ccc(I)c(Cl)c1 312858102 YZQBOTHKQQTUKJ-MNOVXSKESA-N 426.125 4.720 50 10 IJGE ClCCc1nc2c(Br)cccc2n1Cc1ccn(Cc2ccccc2)n1 389666207 DZSFCLZDVSNAHV-UHFFFAOYSA-N 429.749 4.873 50 10 IJGE Clc1cccc(CBr)c1N1CCO[C@H]2CCN(Cc3ccccc3)C[C@@H]21 404182626 KRTPCJIPJXHQGM-PMACEKPBSA-N 435.793 4.715 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccccc1[C@@H]1CNCCN1S(=O)(=O)c1ccccc1 616604686 MJZJATDURHVDIE-QFIPXVFZSA-N 446.689 4.544 50 10 IJGE CC(C)[C@H]1CN(c2ccc(CBr)cc2[N+](=O)[O-])CCN1Cc1ccccc1 704736086 DOQFQXWBBVCQOZ-OAQYLSRUSA-N 432.362 4.837 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCC[C@H](Br)CC1 705426885 PFFPAWPKCRCOCJ-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE Fc1cc2nc(CCCl)n(C[C@H]3CCN3Cc3ccccc3)c2cc1Br 716229265 NAXNVYHXAUYJIX-OAHLLOKOSA-N 436.756 4.994 50 10 IJGE Fc1cc2c(cc1Br)nc(CCCl)n2C[C@H]1CCN1Cc1ccccc1 716230433 QUKUAPLKASJXSS-OAHLLOKOSA-N 436.756 4.994 50 10 IJGE CCCc1nc(COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cs1 728312931 AEMYANSXCYHDNN-LDADJPATSA-N 431.521 4.523 50 10 IJGE CN(CCc1ccc(Cl)cc1)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 733280212 BFNLMKJJKRWUCX-LTGZKZEYSA-N 443.938 4.725 50 10 IJGE CC(=NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)[C@H](C)C1CCCCC1 747626056 RBUGYPNRJPDPEG-HNNXBMFYSA-N 433.599 4.871 50 10 IJGE Cc1ccc(S[C@H](C(=O)NNc2ccc(S(C)(=O)=O)cc2)c2ccccc2)c(C)c1 748147039 KCMAWUCFTWLSLZ-QFIPXVFZSA-N 440.590 4.684 50 10 IJGE CCCc1ccc(-c2ccc(NC(=O)C(=O)NNc3nc4ccccc4s3)cc2)cc1 782812626 QICQJNUSNKCLTL-UHFFFAOYSA-N 430.533 4.998 50 10 IJGE CC1CCN(C(=O)c2ccc(NC(=O)NNc3ccc(C#N)cc3C(F)(F)F)cc2)CC1 799387648 HHKSSWNUVFGCIC-UHFFFAOYSA-N 445.445 4.598 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NC[C@H]2CCCc3ccccc32)c(-c2ccccc2)n1 914469769 GWVQJMSMFSLULK-LEYFIJQKSA-N 435.531 4.607 50 10 IJGE COc1ccc(Br)cc1C=NNC(=O)[C@@H](C)Sc1ccc(Cl)cc1 1084229173 KEQWXTOXMWQJDZ-LLVKDONJSA-N 427.751 4.742 50 10 IJGE C=CC[C@]1(C(=O)NN=C(c2ccccc2)c2ccccc2)CCCN1C(=O)OC(C)(C)C 1355156103 KJNVLQGVZCCDPV-AREMUKBSSA-N 433.552 4.901 50 10 IJGE C=CCCC[C@@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(=O)OC 1455839152 YFSLOKHHQOZZAF-PZNLSKEWSA-N 439.943 4.669 50 10 IJGE C=CCCCCCCCNC(=O)NNC(=O)Nc1ccc(Br)cc1Cl 1564883103 BDPIAYWOODWBEZ-UHFFFAOYSA-N 431.762 4.965 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3ccc4nc(O)n(C)c4c3)c2C)c1 1567943142 RDDQADIQKMOBEX-UNOMPAQXSA-N 425.492 4.541 50 10 IJGE C=C(C)C[C@@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(=O)OCC 1625184366 POEGJYCTJGDKFU-DUBROFONSA-N 439.943 4.669 50 10 IJGE Cc1ccc(COc2ccc([C@H]3C(C#N)=C(N)Oc4c3c(C)nn4CC(C)C)cc2)cc1 1865694204 VQOBHPXOJGEPPA-DEOSSOPVSA-N 428.536 4.953 50 10 IJGE Cn1cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2-c1ccccc1Cl 1865698874 FJUKCWXOKHWPJG-FQEVSTJZSA-N 427.895 4.749 50 10 IJGE CC[C@](C)(NC(=O)CCC(=O)c1ccc(C)cc1C)C(=O)Nc1ccc(SC#N)cc1 1867092266 RASWRJZTOSLLOJ-DEOSSOPVSA-N 437.565 4.763 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1scc(Br)c1Br 2023027245 ACYKXZXZZUBRBT-HTRCEHHLSA-N 448.018 4.813 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1Br)c1cccc(Br)c1Br 2031486283 MGLKXGMFYIXLSH-ONGXEEELSA-N 439.973 4.648 50 10 IJGE CC[C@H](Cl)CN(CC)C(=O)c1ccc(I)c(Br)c1 2044547276 AJDRNXOBNWWNFR-JTQLQIEISA-N 444.538 4.533 50 10 IJGE CN(CC1(CBr)CCCCC1)[C@@H](CNC(=O)OC(C)(C)C)C(F)(F)F 2044696815 OUQRJUDOXIHVFZ-ZDUSSCGKSA-N 431.337 4.719 50 10 IJGE CC[C@H](CBr)CN(C1CC1)[C@@H](CCNC(=O)OC(C)(C)C)C(F)(F)F 2044706440 UGSYAVODDZPSOI-OCCSQVGLSA-N 431.337 4.718 50 10 IJGE CC[C@@H](Br)[C@H]1CCCCN1C(=O)c1csc(I)c1 2051077542 FRBBJSFJCSPMTK-GHMZBOCLSA-N 442.160 4.521 50 10 IJGE COc1ccc(-n2nc(CCl)c(I)c2C(F)(F)F)cc1C 2079210163 KDEBDNSEDJXYHZ-UHFFFAOYSA-N 430.595 4.552 50 10 IJGE CS(=O)(=O)c1csc([C@H](Br)c2cc(F)cc(Br)c2)c1 2093075603 YPPDOIDXKIMDGR-GFCCVEGCSA-N 428.142 4.538 50 10 IJGE CC(F)(F)[C@@H]1C[C@@H]1[C@@H](Br)c1cc(I)cc2c1OCC2 2108180925 FRKVWIIOCBGLKO-MVWJERBFSA-N 443.069 4.953 50 10 IJGE CN(Cc1ccccc1)[C@@H]1CCN(S(=O)(=O)c2ccc(Cl)c(CCl)c2Cl)C1 2152157783 DVJYULIPTCCYQR-OAHLLOKOSA-N 447.815 4.627 50 10 IJGE ClCc1ccc(Br)c(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)n1 2177043966 JQQFTKAOBJVFSQ-VELGLUOQSA-N 446.820 4.930 50 10 IJGE O=C(c1c(Cl)cccc1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Br)C2 2190671296 RDZJFVJFFRRGEV-ZVJCDOFWSA-N 425.523 4.581 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Br)[C@H]1CCCCS1(=O)=O 2203005684 XAJHNOFWQZXOAH-VXGBXAGGSA-N 446.588 4.514 50 10 IJGE CC(C)(C)CN(CCCCCI)C1CN(C(=O)OC(C)(C)C)C1 2211192433 WKPSYMZTUKTEES-UHFFFAOYSA-N 438.394 4.559 50 10 IJGE CC[C@@H](COC)Oc1c(Br)cc(CBr)cc1Br 2217085604 FZNSNAPNXKAFKC-VIFPVBQESA-N 430.962 4.910 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1Cc1ccc(Br)cc1Br 2251034411 VQAQUSIQPUBQTO-DGCLKSJQSA-N 425.990 4.959 50 10 IJGE O=C(NC[C@H](Br)CC(F)(F)F)c1scc(Br)c1Cl 2253547571 KZEGYFAXMUUYDG-SCSAIBSYSA-N 429.483 4.610 50 10 IJGE C=CC[C@@]1(CCl)CCCN1c1ncc(I)cc1Br 2259480951 NURWPQXCSJLIBI-ZDUSSCGKSA-N 441.538 4.603 50 10 IJGE CC1CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]2C(F)(F)F)C1 2265307682 JHXYSBWUZZVTIN-YRTQGLMCSA-N 443.348 4.670 50 10 IJGE Cc1c(N(C)Cc2cccc(I)c2)ccnc1CBr 2265532788 NJJZCORPJRTBSJ-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1CCCl)c1ccc(Cl)c(I)c1 2283653813 KFIHRQHVXBSGPM-QMTHXVAHSA-N 426.125 4.862 50 10 IJGE COc1cccc(C[C@@H](Br)c2ccc(OC)c(I)c2)c1 2285012469 RYPHFUDRWDBLMZ-CQSZACIVSA-N 447.110 4.987 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H]2CC[C@@H](C2)[C@@H]1CBr 2285846618 QALOAQLFQPJNSJ-UPFKWVMWSA-N 425.523 4.630 50 10 IJGE CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)C(C#N)=Cc1ccc(O)c(OC)c1 2296818944 CZYYREQPVVSTNX-UHFFFAOYSA-N 448.500 4.852 50 10 IJGE Cn1ccnc1COc1ccc(C=C(C#N)C(=O)Nc2cc(Cl)ccc2Cl)cc1 2297441058 HTVFAUYCCXMLCK-UHFFFAOYSA-N 427.291 4.852 50 10 IJGE CCOC(=O)C(C#N)=Cc1cc(Cl)c(OCCOc2ccc(C)cc2)c(OCC)c1 2297500038 GTKVNJKSNGHKDZ-UHFFFAOYSA-N 429.900 4.975 50 10 IJGE N#CC(=Cc1ccc(OCc2ccc(F)cc2)cc1)C(=O)N1CCN(c2ccccc2)CC1 2313565264 AVWTWMYBTBVBRB-UHFFFAOYSA-N 441.506 4.660 50 10 IJGE C[C@@H](c1ccncc1)[C@H](Br)c1c(Br)c(Br)nn1C 2316837512 IFNMLWUHUZHLKY-CBAPKCEASA-N 437.961 4.580 50 10 IJGE COc1ccc(C)cc1-c1csc(C(C#N)=Cc2cc3c(cc2[N+](=O)[O-])OCCO3)n1 2331449252 FGTLVDAYXLFWPG-UHFFFAOYSA-N 435.461 4.871 50 10 IJGE CCOC(=O)[C@@H]1[C@@H](c2cccs2)C(C#N)=C(SCc2ccc(Cl)cc2)N[C@]1(C)O 19943536 NYJQMNSVNRMIKW-LVCYWYKZSA-N 448.997 4.645 50 10 IJGE CCOc1ccc(Br)cc1/C=N/NC(=O)[C@@H](C)Oc1ccc2ccccc2c1 20177046 VUTNBURGIXNQAK-LZCVXGSNSA-N 441.325 4.919 50 10 IJGE Oc1nc2ccc([C@@H](Br)c3cccc(I)c3)cc2o1 40285804 RSZIMVMVEHNTID-ZDUSSCGKSA-N 430.039 4.622 50 10 IJGE Cc1c(C(=O)NCc2ccccc2)oc2c1/C(=N/NC(=O)c1cccc(Cl)c1)CCC2 40813314 OBIRHVROTMZEAR-ZXVVBBHZSA-N 435.911 4.642 50 10 IJGE C[C@H](Br)[C@H](Br)[C@@H]1CC[C@H](Br)[C@H](Br)C1 148842991 GBWKXPCFLWAUOQ-ULHDWMFZSA-N 441.827 4.860 50 10 IJGE Cc1cccc(C(=O)Nc2cccc(CBr)c2)c1I 235914055 MLEDLBOGDXYSHN-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE COc1ccc(C(=O)Nc2ccc(C(C)=NNC(=O)c3c[nH]c4ccccc34)cc2)cc1 254492528 IQHVCFXEBJUZMQ-UHFFFAOYSA-N 426.476 4.583 50 10 IJGE CCOc1cc(C=NNC(=O)c2cc(-c3ccc(-c4ccccc4)cc3)n[nH]2)ccc1O 254611465 XABBARHQEONGLX-UHFFFAOYSA-N 426.476 4.612 50 10 IJGE CC(C)(C)[C@H]1CCc2[nH]nc(C(=O)NN=C/C(Br)=C/c3ccccc3)c2C1 254835785 AGJBWSPGTINURG-BGICFVDCSA-N 429.362 4.712 50 10 IJGE CC[C@H](NC(=O)c1cc(Cl)ccc1I)[C@H](Br)CC 313086929 PNDWTOJUKHSSAQ-PWSUYJOCSA-N 444.538 4.627 50 10 IJGE Cc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CCl)cc1I 382702425 PKJFIBOOAWTCCL-KGLIPLIRSA-N 435.733 4.789 50 10 IJGE CCCC[C@H](Cl)CC[C@H](COC(=O)CCc1ccccc1)C(=O)CCCNC(C)=O 585667014 NMCYRDUXKPNNTK-YADHBBJMSA-N 438.008 4.842 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OCCCc2ccncc2)c(-c2ccc(Cl)cc2)n1 818022267 ASFKMXKYQXMGBI-HMMYKYKNSA-N 445.910 4.595 50 10 IJGE C/C(=C\c1ccc(F)cc1)C(=O)NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl 1463680181 FPBGRCQHUWNSLW-CSKARUKUSA-N 431.842 4.919 50 10 IJGE C#CCCCC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(Cl)cc1)CC2 1558512904 LEJMUBDUESZEOJ-FBMGVBCBSA-N 443.934 4.940 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccnc2)CCC3)cc1Cl 1772746499 VXMHLNYAVUWXLE-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE CCc1nn(CC)c2c1[C@@H](c1ccc(OCc3ccccc3Cl)cc1)C(C#N)=C(N)O2 1865703574 BPGVQNLZFHONLS-NRFANRHFSA-N 434.927 4.916 50 10 IJGE COc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3Cc2ccccc2)c1 1865711646 DLOCYLCAOUFCGY-HSZRJFAPSA-N 434.499 4.825 50 10 IJGE COc1cccc(-c2ccc(C(=O)NNC(=O)/C=C/c3ccc(C(C)C)cc3)c(C)n2)c1 1865759056 ZZGOAQJHUQPCGE-XNTDXEJSSA-N 429.520 4.663 50 10 IJGE COc1cc(/C(O)=C(\C#N)c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)cc(OC)c1OC 1872746978 ISLWLXIEEBIYFR-CYVLTUHYSA-N 439.449 4.694 50 10 IJGE C[C@@H](NCc1cccc(Br)c1Br)c1nnc(CCl)s1 1877572766 BXMZKBIVZXUDFT-SSDOTTSWSA-N 425.577 4.653 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C1CCC2(CC1)C[C@@H]2NC(=O)OC(C)(C)C 1882086483 BYNTVTULGGYWAK-LTWWHTJUSA-N 447.414 4.748 50 10 IJGE CC[C@@H]1C[C@@H]1CCO[C@@](C)(CI)CN(CC)C(=O)OC(C)(C)C 1902818017 RUYMNUCLRFUJRS-VKJFTORMSA-N 439.378 4.890 50 10 IJGE Fc1cc(Br)c2nc(CCl)n(Cc3cnn(Cc4ccccc4)c3)c2c1 1912673641 DRRKEXZBVMTPLD-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE CC(C)(C)[C@@H](CCCl)Nc1ncc(I)cc1Br 2015756230 BNRXNZXEBDLLPO-SNVBAGLBSA-N 431.543 4.904 50 10 IJGE CC1(C)[C@@H](Cl)CC[C@H]1Nc1ncc(I)cc1Br 2026157988 WOYFDOSYXCMOAD-VHSXEESVSA-N 429.527 4.657 50 10 IJGE CC1(C)C[C@H](Br)CN1C(=O)c1ccc(Br)cc1Br 2037330006 XQSOTHCDFARHPG-VIFPVBQESA-N 439.973 4.600 50 10 IJGE C[C@H](Cl)[C@H](NC(=O)c1scc(Br)c1Br)C(F)(F)F 2074713951 VMDUWBLRIGKQLS-NOWQDGDBSA-N 429.483 4.561 50 10 IJGE FC(F)(F)c1c(I)c(CBr)nn1C1CCCCC1 2079260429 CZVBXGKTXFFUSX-UHFFFAOYSA-N 437.041 4.907 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1ccc(Cl)cc1Br 2081235061 ATRXWCZYADUYRH-UFBFGSQYSA-N 444.538 4.682 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@@H](OCCNC(=O)OC(C)(C)C)C1 2112695715 IJFSXNUASMDOBA-QGZVFWFLSA-N 435.447 4.584 50 10 IJGE O=[N+]([O-])c1cc(Oc2cccc(I)c2)ccc1CBr 2132052318 GKDJXLISYAWLIR-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE O=C([C@@H](Br)C1CCCC1)N1CCC[C@]2(CCCN(Cc3ccccc3)C2)C1 2167030848 AWWSIQXCRLJFKY-GMAHTHKFSA-N 433.434 4.845 50 10 IJGE Cc1csc(C(=O)N2C[C@@]3(F)CCC[C@@]3(CBr)C2)c1Br 2176637688 WHNKPDOWRGEJPB-KGLIPLIRSA-N 425.161 4.548 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2CCc1cnn(Cc2ccccc2)c1 2184922950 SFYVFIVJRHITDJ-UHFFFAOYSA-N 444.764 4.729 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)c1ccc2c(c1)CCCN2C(=O)OC(C)(C)C 2196914623 PDLAVJXHUAFBPY-KDYLLFBJSA-N 437.378 4.620 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@]12CCC[C@@H](CN(C[C@H](CBr)C3CCC3)C1)C2 2226555563 YDKZNQCGEMIZBI-PLMTUMEDSA-N 429.443 4.909 50 10 IJGE CCCN(C[C@H](C)Br)C(=O)c1scc(Br)c1Br 2250584013 ZJRVLXFFMBUWOT-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2C[C@@H]3CC[C@H](C2)O3)cc1I 2269533526 FUKZHWOIOAJRRK-NWJSVONSSA-N 437.115 4.693 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCC2(CCOCC2)N(CCCCCCCBr)C1 2294698378 HZHHROYJBMXVIU-SFHVURJKSA-N 447.458 4.870 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Cl)cc2I)[C@H]1CBr 2302314874 BWSPETBNJMONGD-RNCFNFMXSA-N 428.539 4.550 50 10 IJGE Clc1ccc(CC2(CBr)CCOCC2)c(I)c1 2302329087 PEAIMFCCJPXKSM-UHFFFAOYSA-N 429.523 4.679 50 10 IJGE C[C@@H]1C[C@H](Cl)CN(Cc2ccc(I)c(Br)c2)C1 2306220155 UQYMSSZWACLUAJ-KOLCDFICSA-N 428.539 4.503 50 10 IJGE CC(C)N(Cc1ccc(I)c(Br)c1)C[C@@H](C)Cl 2306220509 YHIIFNVTEWUWKT-SNVBAGLBSA-N 430.555 4.891 50 10 IJGE CC[C@H](C)N1C(=O)C(=Cc2ccc(OCc3ccc(C)cc3)c(OC)c2)C(C)=C(C#N)C1=O 2314611566 XHSWDMZBMSMRBQ-SFHVURJKSA-N 444.531 4.973 50 10 IJGE CC1(C)COC[C@@]1(CBr)Cc1ccc(Cl)cc1I 2318528655 IAPLGZYRGKDGEB-AWEZNQCLSA-N 443.550 4.925 50 10 IJGE COc1ccc(Cc2nc3ccc(C(=O)NN=Cc4cccc(Cl)c4)cc3[nH]2)cc1OC 2323720629 QCVSULSTXOGXCR-UHFFFAOYSA-N 448.910 4.588 50 10 IJGE Clc1ccc(C[C@]2(CBr)O[C@H]3CC[C@H]2C3)cc1I 2327570036 YPHHXHFGCVOOPQ-COPLHBTASA-N 441.534 4.820 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@H](CN(C[C@H](CBr)C3CCC3)C1)C2 2332629899 RCTOKZZPHRPEPT-DJPFJPOOSA-N 429.443 4.815 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@]2(CBr)CC2(F)F)c2ccccc21 2351889297 SZYIIDYOYGRWBU-KDOFPFPSSA-N 431.321 4.883 50 10 IJGE CC1CCC(CCl)(NC(=O)c2ccc(Cl)cc2I)CC1 2365585811 FQYBFJNVOMIGIL-UHFFFAOYSA-N 426.125 4.862 50 10 IJGE N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)C(=O)Nc1ccccc1Oc1ccccc1 9507664 OGXIMKABRYMKFL-MHWRWJLKSA-N 429.388 4.661 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(F)cc4)ccc32)cc1 38685661 AEHXDUDSIIIETA-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE Cc1ccccc1[C@@H](C)NC(=O)/C(C#N)=C\c1c[nH]nc1-c1ccc(Br)cc1 96993767 DHOWSVPAUOLUNY-QJISPJEISA-N 435.325 4.932 50 10 IJGE COCCOCCCC(CBr)(CBr)c1cccc(Cl)c1 234749856 PMSJADOPDBJHIW-UHFFFAOYSA-N 428.592 4.811 50 10 IJGE O=C(NN=C/C=C\c1ccccc1)/C(=C\c1cccs1)NC(=O)c1ccccc1Cl 252607629 HDEGMMMKAFSUJO-RMNBNOEHSA-N 435.936 4.988 50 10 IJGE Cc1cc(Br)c(C(=O)NCCCCCI)cc1Cl 310779952 OQQUYCZVDQRONG-UHFFFAOYSA-N 444.538 4.746 50 10 IJGE O=C(NCCCCCCI)c1ccccc1OCc1ccccc1 383935494 GEBNOPFZJCOOHO-UHFFFAOYSA-N 437.321 4.991 50 10 IJGE O=C(CBr)c1c(Br)ccc(OC(F)F)c1OC(F)(F)F 575685704 KMCAUAYHUDDTCI-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE Fc1cc2nc(CCCl)n(C[C@@H]3CCN3Cc3ccccc3)c2cc1Br 716229262 NAXNVYHXAUYJIX-HNNXBMFYSA-N 436.756 4.994 50 10 IJGE Cc1cc(C(=O)NNc2nc3ccccc3[nH]c2=S)c2ccc(Br)cc2n1 1148223150 KIHKNLGADIPCLH-UHFFFAOYSA-N 440.326 4.668 50 10 IJGE C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)C(=O)NN(Cc1ccccc1)c1ccccc1 1290343095 LLOGWUDYPDBXAT-FQEVSTJZSA-N 429.948 4.760 50 10 IJGE C#CCOc1ccc(COC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 1521612432 QDQZIVBGZHBXIV-XQNSMLJCSA-N 440.499 4.765 50 10 IJGE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)c1c(Cl)cccc1Cl 1528035684 HMDYFYWCWBXMMS-MDZDMXLPSA-N 433.213 4.757 50 10 IJGE C=C(C)[C@@H](CC(=O)NNC(=O)c1cc(-c2ccccc2Cl)nc2ccccc12)OCC 1608431972 JENSRFYSFWYYCU-JOCHJYFZSA-N 437.927 4.688 50 10 IJGE Cc1ccc2c(c1)C(=NNC(=O)CCCOc1ccc(Cl)cc1Cl)C(=O)N2C(C)C 1772720644 UWPZRYSNBPWNDC-UHFFFAOYSA-N 448.350 4.736 50 10 IJGE CCCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1cccnc1)C(C#N)=C(N)O2 1865700176 MKFVCDAXCPQEBW-IBGZPJMESA-N 440.334 4.804 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)Cc3ccc(Cl)c(Cl)c3)c(C)n2)cc1C 1865756140 IMKMYRUCVHUHMO-UHFFFAOYSA-N 442.346 4.984 50 10 IJGE COc1cc(Cl)c(C)cc1-c1csc(/C(C#N)=C(\O)[C@@H]2CC(=O)N(C(C)C)C2)n1 1872756972 KSFQYNPKFNJPIU-LKCUONQHSA-N 431.945 4.830 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H](Br)CC2(CC2)C1 1925993677 PDYSISJKVPQOLW-SNVBAGLBSA-N 438.001 4.961 50 10 IJGE CC(C)[C@@H](CCl)N(Cc1ccccc1)S(=O)(=O)[C@H]1C[C@H](OCc2ccccc2)C1 1958927923 GQJXZEABLDLRNJ-DNVJHFABSA-N 436.017 4.830 50 10 IJGE CCC[C@H](Br)CCNC(=O)c1ccc(Br)cc1Br 2029925092 WWFWUTRSKZEURQ-VIFPVBQESA-N 441.989 4.895 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H]1Br)c1cccc(Br)c1Br 2031487520 VMCDYFOMZHTKHW-WPRPVWTQSA-N 439.973 4.505 50 10 IJGE CC(C)(C)OC(=O)NCC(C)(C)C1CCN(C[C@@H](Br)C(F)(F)F)CC1 2044706806 XIBBFSPVXWJTTD-CYBMUJFWSA-N 431.337 4.575 50 10 IJGE Cc1c(O)cccc1Cn1nc(CBr)c(Br)c1C(F)(F)F 2079232378 UOEDZTZPJYEJTD-UHFFFAOYSA-N 428.046 4.622 50 10 IJGE CN(c1nc2sccn2c1CBr)[C@@H]1CN(Cc2ccccc2)C(C)(C)C1 2098605710 NESRANJESHQCPV-INIZCTEOSA-N 433.419 4.780 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CN(CCCCCCCCCBr)CCO1 2106780702 AYCIJRGGWGPXON-MSOLQXFVSA-N 435.447 4.726 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C[C@H](CBr)c2ccccc2)C1 2106783967 DZAIFUQVHXZPOU-UHOSZYNNSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)NCCN(C[C@H](CBr)c1ccccc1)C1CCCC1 2130068712 XSIWTBNHYAGCHY-SFHVURJKSA-N 425.411 4.934 50 10 IJGE Cc1cc(Br)c(C)c([C@@H](Cl)C2(S(C)(=O)=O)CC2)c1Br 2136371154 RMECSXUQOXYBSL-GFCCVEGCSA-N 430.589 4.686 50 10 IJGE C[C@@]1(COc2c(Br)cc(CCl)cc2Br)CSCCO1 2136553301 HGGVXWFIZRKTQK-CYBMUJFWSA-N 430.589 4.851 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)C1(CCl)CCSCC1 2142942547 DUXIFCKHRDDRCX-UHFFFAOYSA-N 430.182 4.881 50 10 IJGE CN(c1nc2sccn2c1CBr)C1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2151248405 ZTILMNKKUMMDPD-JWTNVVGKSA-N 445.430 4.923 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCC(NC(=O)[C@@H](Br)C3CCCC3)CC2)C1 2167033816 SZNUVIXABWKISG-BATSVXPKSA-N 443.426 4.626 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)[C@H](Br)C2CCCC2)CC12CCCCC2 2167034739 YATJRCIJLBNTKL-DLBZAZTESA-N 443.426 4.769 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)[C@H](Br)C2CCCC2)c2ccccc21 2167035465 YZUDAVMROBUMOF-FUHWJXTLSA-N 437.378 4.943 50 10 IJGE ClCc1nc2cncc(Br)c2n1CCc1csc(Br)c1 2185152222 UYRZDKKHJSGBIN-UHFFFAOYSA-N 435.572 4.999 50 10 IJGE O=S(=O)(CCCOCc1ccccc1)Nc1ccc(Cl)cc1CBr 2216994193 JOUJESYAKJRRFW-UHFFFAOYSA-N 432.767 4.584 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCCBr)C[C@H]1CC(F)(F)F 2223286802 RUDCYHWCTWMIEG-CQSZACIVSA-N 431.337 4.815 50 10 IJGE Cc1ccc(C(=O)N[C@H](CBr)CC(C)(C)C)cc1I 2224620038 HPSRZBUNKZZFEU-LBPRGKRZSA-N 438.147 4.529 50 10 IJGE Cc1ccc(C(=O)N2C3CCC2([C@H](C)Br)CC3)cc1I 2232844407 WURFXPUZPBDANJ-XOMBGVMMSA-N 448.142 4.520 50 10 IJGE C[C@@H](COC(F)F)O[C@H](CI)c1cccc(Br)c1 2253922838 HIMGEKNIHNLMJF-GZMMTYOYSA-N 435.046 4.570 50 10 IJGE O=C(NC12CCC(CBr)(CC1)C2)c1scc(Br)c1Cl 2264502417 WFBINCHTMSLLKU-UHFFFAOYSA-N 427.589 4.992 50 10 IJGE CC(C)C1(O[C@@](C)(CI)c2ccccc2Br)COC1 2272857766 NZEWIGIWPTUWQP-AWEZNQCLSA-N 439.131 4.541 50 10 IJGE C[C@@H]1CN(Cc2cc(I)ccc2Cl)CC[C@@H]1Br 2307335025 XZQCJFPHIZSFEA-SKDRFNHKSA-N 428.539 4.550 50 10 IJGE BrC[C@@H]1C[C@H]2CCCC[C@H]2N1Cc1sccc1I 2316760801 YGOJSMAHYKGBKT-NTZNESFSSA-N 440.188 4.881 50 10 IJGE Clc1ccc(CN2C[C@@H]3CC[C@H](C2)C3Br)c(I)c1 2318540845 RPLKSLXNVAEXFG-BVUQATHDSA-N 440.550 4.550 50 10 IJGE CN(Cc1ccc(Cl)cc1I)[C@@H](CCCl)C(F)(F)F 2341042880 OYYKHLNMGRLVQH-NSHDSACASA-N 426.047 4.936 50 10 IJGE FC1(F)C[C@]1(CBr)CN1CCC[C@]2(CCCN(Cc3ccccc3)C2)C1 2351892430 PAFQFSNMWWBAIL-PMACEKPBSA-N 427.377 4.785 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@]12CCC[C@H](CN(C(=O)[C@H](Br)C3CCCC3)C1)C2 2358644638 KYLMLHFQWHDZRH-XPIZARPCSA-N 443.426 4.578 50 10 IJGE CN(C)c1ccnc(N(C)[C@H]2CC(C)(C)[C@H]2OCc2ccccc2)c1CBr 2377476686 GXOMDTLKMWIXQY-PMACEKPBSA-N 432.406 4.863 50 10 IJGE COC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc(COc2ccccc2Cl)c(C)cc1C 1010411 XGPQJBBOGZNMPW-JOCHJYFZSA-N 438.911 4.791 50 10 IJGE COc1ccc(CN(C(=O)CCl)[C@@H](C(=O)NC2CCCCC2)c2ccc(C)cc2)cc1 97914438 IMRZQQGGPZSBIZ-XMMPIXPASA-N 442.987 4.761 50 10 IJGE COC(=O)c1c(N/C=C(\C#N)c2nc(-c3ccc4c(c3)OCO4)cs2)sc(C)c1C 102598699 JROLANPZIVWJHM-RIYZIHGNSA-N 439.518 4.980 50 10 IJGE O=S(=O)(c1c(Cl)cc(Br)cc1Cl)N1CCCCC[C@H]1CCl 157747084 DJSHOWGMHOQLHR-JTQLQIEISA-N 435.598 4.928 50 10 IJGE ClC[C@@H](I)[C@@H](CCl)OCc1ccc(Br)cc1 158539864 ARSJONRFLKEQKM-GHMZBOCLSA-N 437.930 4.616 50 10 IJGE Cc1cccc(OCCCC(=O)Oc2ccc(/C=C(/C#N)C(=O)NCc3ccco3)cc2)c1 206739763 JMWFLFMFQCNRHZ-PGMHBOJBSA-N 444.487 4.576 50 10 IJGE CC(C)(C)C[C@@H](Br)CNS(=O)(=O)c1ccc(Cl)c(Br)c1 226267134 QWMPOLDTTVKWKD-SECBINFHSA-N 447.620 4.581 50 10 IJGE CO[C@@H]1CCC[C@@H](O[C@H](CI)c2ccccc2Br)C1 253136593 SMCBBEKNHLOQGJ-LALPHHSUSA-N 439.131 4.899 50 10 IJGE CCn1c2ccccc2c2cc(NC(=O)CC(C)=NNC(=O)c3cccc(O)c3)ccc21 254792803 HOVMDUTVSUNZJG-UHFFFAOYSA-N 428.492 4.655 50 10 IJGE CCOC(=O)c1c(NC(=O)NN=Cc2ccc(N(CC)CC)cc2)sc2c1CCCC2 256018323 BJTKQNYXTCIHKR-UHFFFAOYSA-N 442.585 4.805 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CI)[C@H](c2ccc(Cl)c(F)c2)C1 382738642 YLGBHXMTISRGIP-NEPJUHHUSA-N 439.696 4.865 50 10 IJGE CC[C@@H](Br)[C@@H](C)NC(=O)c1cc(Br)ccc1Br 386799693 PWDOOPOTVDQXPK-GMSGAONNSA-N 427.962 4.503 50 10 IJGE FC(F)Oc1ccc(CBr)c(Br)c1I 575682235 LLVRITPYIOJKEI-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1cccc([C@H]2CCN(S(N)(=O)=O)c3ccccc32)c1 616676055 PXJNLEKSGHSNRL-HXUWFJFHSA-N 446.689 4.796 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)C[C@H](C)c2ccc(Br)cc2)c1C 771014656 BJJXYXUZWLQHFA-ZDUSSCGKSA-N 440.345 4.555 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccc(NC(=O)c3cccs3)cc2)c(C(F)(F)F)c1 799752973 YJNPRYCHCWYHRE-UHFFFAOYSA-N 430.411 4.648 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2cc3ccccc3nc2O)c(C)n1-c1ccccc1F 1135099623 KNRFZWJSJMFGLO-DEDYPNTBSA-N 440.478 4.710 50 10 IJGE C/C(=C\c1ccncc1)C(=O)NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1 1350047459 KWIUAIUJZKGCCQ-FBMGVBCBSA-N 435.549 4.584 50 10 IJGE CC(C)C[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)NNc1nc2ccccc2[nH]c1=S 1633443330 HSEDIGLEBBOMRZ-RTBURBONSA-N 435.597 4.530 50 10 IJGE CC1=C(C#N)C(=O)N(C[C@@H]2CCCO2)C(=O)/C1=C/Nc1ccc(N=Nc2ccccc2)cc1 1772742742 AANCYKFPSMORQE-IAEVWSOTSA-N 441.491 4.786 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2cccc(Cl)c2)cc1 1865695106 KEPSPYFOVBKFKI-NRFANRHFSA-N 434.927 4.764 50 10 IJGE CCc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865701895 HMBXVVIEKPJYEH-LJQANCHMSA-N 426.854 4.644 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865702543 WRESJAUBQFBCAT-IBGZPJMESA-N 444.844 4.783 50 10 IJGE N#C/C(=C(O)\C=C/c1ccc2c(c1)OCCO2)c1nc(-c2cccc([N+](=O)[O-])c2)cs1 1873941117 XDRPVWFLUVFISL-HQXVDDKPSA-N 433.445 4.996 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1cnsc1Br 1887458479 QLVXIEHZXBLMPH-LLVKDONJSA-N 432.181 4.722 50 10 IJGE CC(C)(C)[C@](C)(CBr)CN1CCC[C@H](NC(=O)OCc2ccccc2)C1 1904840503 IWVMIEFTEOFUAC-GHTZIAJQSA-N 425.411 4.825 50 10 IJGE C[C@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)c(Br)s1 1914350440 JRHSQUVZZKYOQS-SNVBAGLBSA-N 443.215 4.982 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1C(=O)c1csc(Br)c1Br 1945183712 LYTHREHKWBPOGR-BQBZGAKWSA-N 446.002 4.661 50 10 IJGE CC[C@](C)(CCBr)NC(=O)c1csc(Br)c1Br 1945189220 LZVUBNBPIZXERN-LLVKDONJSA-N 448.018 4.957 50 10 IJGE C[C@@]1(CCl)CN(c2c(Br)cc(Br)cc2Br)C1=O 1946549962 OJTWQHFIFWMJAI-LLVKDONJSA-N 446.364 4.566 50 10 IJGE Clc1ccc(I)c(-n2cnc(Cl)c2CBr)c1 1982516256 FLHPZPLCVJGOKZ-UHFFFAOYSA-N 431.886 4.679 50 10 IJGE CN(C(=O)c1scc(Br)c1Br)C1CC(CBr)C1 2018085249 MIIDFMSPJDQYMQ-UHFFFAOYSA-N 446.002 4.519 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([S@@](C)(=O)=NC[C@@H](CBr)C(C)(C)C)C1 2044695419 CZOADLLRLHHNFH-OKXMYEFYSA-N 439.460 4.541 50 10 IJGE Cn1nc(C[C@H](CBr)c2ccc(Br)cc2)cc1Br 2049248234 BLGZZZJIJGZJOY-SNVBAGLBSA-N 436.973 4.666 50 10 IJGE Cn1ncc(C[C@@H](CBr)c2ccc(Br)cc2)c1Br 2053032340 YNGQXRGRIMAJEU-JTQLQIEISA-N 436.973 4.666 50 10 IJGE ClCc1nc2cncc(Br)c2n1-c1cccc(I)c1 2095437315 NDOSVASGVWCBML-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@H]2CCC[C@@]2(CCl)C1 2103175387 IWVNXWSKGWXPBK-AMIZOPFISA-N 427.589 4.754 50 10 IJGE C[C@@H]1CCN(C[C@@H](CBr)c2ccccc2)C[C@H]1CNC(=O)OC(C)(C)C 2106781273 GMWNAHXLIDOQOZ-BHIYHBOVSA-N 425.411 4.648 50 10 IJGE CN(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@@H](CBr)c1ccccc1 2106787146 YCMBKVIFNOTWIF-PKOBYXMFSA-N 425.411 4.744 50 10 IJGE O=C(NCC1CC2(CC(Cl)C2)C1)c1cc(Br)c(Br)s1 2108260154 AQMOTXCMTISLMG-UHFFFAOYSA-N 427.589 4.801 50 10 IJGE Brc1ccc([C@@H](CI)OC[C@@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)cc1 2134539235 KAVAGYWYUXTZBU-LIADABEKSA-N 433.127 4.844 50 10 IJGE FC1(F)CN(c2ncc(Br)c3ccsc23)CC[C@@H]1CBr 2146377446 NDBSJDRSVYLZDA-MRVPVSSYSA-N 426.124 4.915 50 10 IJGE CC(C)(C)OC(=O)NCCN(CC1(CBr)CCCCCC1)C1CCOCC1 2186615651 GMGFMBZDSLVMQR-UHFFFAOYSA-N 447.458 4.728 50 10 IJGE Cc1sc(Br)c(C)c1[C@H](Cl)c1cnn(C)c1I 2213641222 LEUGFGQSJBUCHP-SECBINFHSA-N 445.551 4.794 50 10 IJGE C[C@@H](Cl)c1nc2cc(Cl)cnc2n1C[C@H]1CC1(Br)Br 2224805407 MZXRHZAWRKTRTA-RNFRBKRXSA-N 427.955 4.891 50 10 IJGE Cc1c(Br)csc1C(=O)NC[C@]1(F)CC[C@H](CBr)CC1 2234505935 HPKAZABEOIETBL-YPFXGUDJSA-N 427.177 4.842 50 10 IJGE CCN[C@H](Cc1cc(Br)cc(Br)c1)[C@H]1C[C@H]1Br 2252833813 ZETWPHLJUMJUKF-YNEHKIRRSA-N 425.990 4.516 50 10 IJGE C[C@@H]1C[C@H](Br)CN(Cc2ccc(Cl)c(I)c2)C1 2300237881 DJKXQCNOGPSMFO-KOLCDFICSA-N 428.539 4.550 50 10 IJGE N#CC(=Cc1cn(-c2ccccc2)nc1-c1ccc2c(c1)OCO2)C(=O)NC1CCCCC1 2314522318 DITDNXYFCYRIDT-UHFFFAOYSA-N 440.503 4.624 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(O[C@@H]2CCOc3ccc(F)cc32)C1 2364439041 VYDLKFGZDIYUOK-YLJYHZDGSA-N 444.341 4.831 50 10 IJGE COc1cccc([C@H](C(=O)NC2CCCCC2)N(Cc2cccs2)C(=O)CCl)c1 3039803 ACNNEPOCCHRVKH-OAQYLSRUSA-N 434.989 4.514 50 10 IJGE C[C@@H](Oc1ccc(F)cc1)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccccc1F 38652089 QPUXZJUMBALCMO-QKFKETGDSA-N 448.425 4.556 50 10 IJGE O=C(NNc1ncnc(Sc2ccc(Cl)cc2)c1[N+](=O)[O-])c1cccc(Cl)c1 40607730 JSOJBGRJFQJNEQ-UHFFFAOYSA-N 436.280 4.600 50 10 IJGE O=C(c1cc(C(F)(F)F)ccc1Br)N1CC[C@@H](CCBr)C1 125080720 LZJQKOCYHDWHSG-SECBINFHSA-N 429.074 4.715 50 10 IJGE CC[C@H](Br)CCNC(=O)c1ccc(Br)cc1Br 233977069 BGVNIAMQDPJYGO-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE CCc1ccc(OCC(=O)NN=Cc2cn(-c3ccccc3)nc2-c2ccc(C)cc2)cc1 252606373 GSIAQDUYXCNQOF-UHFFFAOYSA-N 438.531 4.939 50 10 IJGE CO[C@@H]1CCC[C@@H](O[C@H](CI)c2cccc(Br)c2)C1 253117144 GJJVZRINFUIIAB-RBSFLKMASA-N 439.131 4.899 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1C1[C@H]2C[C@H]1CN(Cc1ccccc1)C2 399639688 GSGRVFNTQNYXET-HOTGVXAUSA-N 445.792 4.668 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@H]1Cl)c1scc(Br)c1Br 705419660 ORLRPIIJKOTBTM-ZYHUDNBSSA-N 435.568 4.908 50 10 IJGE O=C(NNC(=O)c1ccccc1OCc1ccc(F)cc1)N[C@H](c1ccccc1)C1CCC1 729614800 OWCWODGVIYHDHQ-XMMPIXPASA-N 447.510 4.890 50 10 IJGE CC[C@@H](C(=O)NNc1nc(-c2cccnc2)nc(C)c1C)c1cccc(C(F)(F)F)c1 752805233 DGEJKBODMYNNBU-GOSISDBHSA-N 429.446 4.811 50 10 IJGE Cc1cccc2c1[C@H](OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)CCO2 814033067 HBWSTVGEZKALBO-QFXGEWDLSA-N 438.487 4.746 50 10 IJGE CC(C)C=NNC(=O)COc1ccc2cc(Br)ccc2c1Br 1083988492 KMZMMKMVYNKINF-UHFFFAOYSA-N 428.124 4.502 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 1087457734 UNBOXUFZONZSJQ-NEPJUHHUSA-N 433.308 4.879 50 10 IJGE C#CCOc1ccc(COC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 1521612429 QDQZIVBGZHBXIV-KQWNVCNZSA-N 440.499 4.765 50 10 IJGE C=CC[C@H]1CCCC[C@H]1NC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl 1636883803 VXPTXFICJXMMBB-WMLDXEAASA-N 428.360 4.618 50 10 IJGE CC(=O)CCCCCCC(=O)NNC(=O)c1cc(-c2ccc(C)cc2)nc2ccccc12 1638072113 KSHMBHNJFJKAMN-UHFFFAOYSA-N 431.536 4.901 50 10 IJGE CC(=O)c1ccc(NC(=O)[C@@H](Br)Cc2ccccc2Br)cc1 1858181186 HGPVGIYDCNVMLI-INIZCTEOSA-N 425.120 4.596 50 10 IJGE N#CSc1ccc(NC(=O)C2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)cc1 1860601957 HULSCAPPPTTXCA-UHFFFAOYSA-N 433.455 4.769 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccccc2)cc1OC 1865697211 PQKNLDFWQXUKHE-XMMPIXPASA-N 444.535 4.646 50 10 IJGE CCc1nn(-c2ccc(OC)cc2)c2c1[C@@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2 1865710536 BIBLTFQUONRYTQ-IBGZPJMESA-N 440.425 4.680 50 10 IJGE CC[C@H](NC(=O)Cc1nc(-c2cccc(C)c2)oc1C)C(=O)Nc1ccc(SC#N)cc1 1866647255 HUEDEWMEWSXCQJ-FQEVSTJZSA-N 448.548 4.608 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Cl)CCc1ccc(Br)cc1Cl 1905341912 FRUKGOBHTSLCOP-CYBMUJFWSA-N 427.125 4.939 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(I)cc1CCBr 1951503715 RSDCLQSJJLLZPR-UHFFFAOYSA-N 426.092 4.576 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1ccc(Br)cc1C#N 2010826595 DZGTYZRUWNSMJQ-UHFFFAOYSA-N 432.409 4.639 50 10 IJGE Cn1cc([C@@H](Br)c2ccc(F)c(Br)c2F)c(Br)n1 2052975108 DUZGDQOCEMHMBS-QMMMGPOBSA-N 444.899 4.708 50 10 IJGE FC(F)c1c(I)ccc(CBr)c1Br 2054779913 PDSVUJIHMYBWEF-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1c(Cl)cccc1Br 2081246892 RGAPWSCIGDPMHQ-KCJUWKMLSA-N 444.538 4.682 50 10 IJGE O=[N+]([O-])c1cc(Oc2ccc(I)cc2)ccc1CBr 2132054293 UDALEPHTGYXCRA-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE O=C(c1cc(Br)ccc1Cl)N1CC[C@@H](CBr)C(F)(F)C1 2146374386 BWIVKBLGFUEHCY-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@@H](OC)C[C@@H]1CNC(=O)OC(C)(C)C 2163060296 AOOVJLYMIUDKGM-QZTJIDSGSA-N 449.474 4.972 50 10 IJGE CCC(C)(C)[C@@H](C)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2193155366 HHWKBGIINSMERK-SECBINFHSA-N 447.258 4.851 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)C[C@@H]1CC1(Br)Br 2208937063 KDNDXGRVDONJFT-AAEUAGOBSA-N 440.017 4.778 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)S(=O)(=O)Cc1cccc(Br)c1 2213761274 TVXBIGOBJHAUKK-SFHVURJKSA-N 430.795 4.799 50 10 IJGE Cc1ccccc1COc1ccc(C=C(C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2O)cc1 2297399988 KYMXBBPVLOHMTG-UHFFFAOYSA-N 429.432 4.734 50 10 IJGE CC(C)(CBr)[C@H]1CCCN1Cc1sccc1I 2301067851 FUYBPRSDWGONOZ-GFCCVEGCSA-N 428.177 4.738 50 10 IJGE COc1ccc(CN2C(=O)C(=Cc3ccc(-c4ccc(F)cc4)o3)C(C)=C(C#N)C2=O)cc1 2314617081 QJJFVZPKMUUCKG-UHFFFAOYSA-N 442.446 4.887 50 10 IJGE CCOc1ccc(C=C2C(=O)N([C@@H](C)c3ccccc3)C(=O)C(C#N)=C2C)cc1OCC 2314618575 PWFNEKQMDYEJSF-SFHVURJKSA-N 430.504 4.837 50 10 IJGE CC1(C)C[C@H](Cl)CN(Cc2ccc(I)c(Br)c2)C1 2325218508 PLRLWGWPHAGEFO-NSHDSACASA-N 442.566 4.893 50 10 IJGE CCCCCOc1ccc(C=NNC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)cc1OC 2328821141 OOVWLPSCLGNVBB-UWJYYQICSA-N 449.592 4.654 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2cccc(Br)c2)sc(C)c1C 2329699374 MIJAZBPOHJZDJR-UHFFFAOYSA-N 433.327 4.850 50 10 IJGE COc1cc(OC)c(-c2csc(C(C#N)=C(O)[C@@H]3CC(=O)N(C(C)C)C3)n2)cc1Cl 2331378734 WEVQLPGTYREAFY-GFCCVEGCSA-N 447.944 4.530 50 10 IJGE C/C(=N/NC(=O)COc1ccc(C(C)(C)C)cc1Br)c1ccc([N+](=O)[O-])cc1 5909895 UEENQLFQMSTQRC-XKZIYDEJSA-N 448.317 4.574 50 10 IJGE O=C1CCc2cc([C@H](Br)c3ccc(I)cc3)ccc2N1 40283391 ABPLEKNUFHJKLC-MRXNPFEDSA-N 442.094 4.660 50 10 IJGE CC(C)c1cccc(OCC(=O)Oc2ccc(/C=C(\C#N)C(=O)NCc3ccco3)cc2)c1 40934853 RVNAJJOZQGZMNU-FYJGNVAPSA-N 444.487 4.611 50 10 IJGE CC(C)C[C@H](CBr)NC(=O)c1cc(Br)ccc1Br 161220305 HEROEXZOZCQUDN-SNVBAGLBSA-N 441.989 4.751 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccccc2Cl)cc(Br)c1OC(C)C 169886203 XQIRQKJLXGXGOK-FBHDLOMBSA-N 425.710 4.662 50 10 IJGE C[C@@H]1CCc2[nH]c3ccc(C(=O)N/N=C\c4ccc(O)c(Br)c4)cc3c2C1 169891298 MULCBXDFOJQCOS-RMJYUUNHSA-N 426.314 4.525 50 10 IJGE CCCOc1cc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4)nc3c2)ccc1OC 169926979 CSQDSDYPNQMZIV-WGOQTCKBSA-N 428.492 4.791 50 10 IJGE COc1ccc([N+](=O)[O-])cc1N/C=C(/C#N)C(=O)Nc1ccc(Oc2ccccc2)cc1 217211970 DNYFCTLYECIPPL-NXVVXOECSA-N 430.420 4.854 50 10 IJGE CC1=CC(=NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(C)cc3C)c2)CC(C)(C)C1 252511378 GCZZHPUBFHQODV-UHFFFAOYSA-N 439.581 4.956 50 10 IJGE CC(=NNC(=O)CSc1nnc(-c2ccc(C)cc2)n1-c1ccc(C)cc1)c1ccco1 254519686 JTVCVYJAENTBFA-UHFFFAOYSA-N 445.548 4.777 50 10 IJGE CC[C@H]1CN(Cc2cc(Cl)ccc2I)C[C@H]1Br 405321877 ZPSYZVRQMPFXRZ-JOYOIKCWSA-N 428.539 4.550 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccccc1[C@@H]1CN(S(=O)(=O)c2ccccc2)CCO1 616644290 VEGFMDKZZBHMPP-QFIPXVFZSA-N 447.673 4.971 50 10 IJGE CC1(C)C[C@@H](Cl)C[C@H](NC(=O)c2cc(Cl)ccc2I)C1 693879471 UBCKBUDEUYODDJ-QWRGUYRKSA-N 426.125 4.861 50 10 IJGE O=C(c1scc(Br)c1Br)N(CCCBr)C1CC1 705462060 DIWUWAVEEJPXAQ-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE Clc1ccc(I)c(CN2C3CCC2(CBr)CC3)c1 723002862 ACFKOKOBWITFIE-UHFFFAOYSA-N 440.550 4.837 50 10 IJGE Cc1cc(C)cc([C@H](C)NC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)c1 730674137 FVLPBTKNXNPOKN-SFHVURJKSA-N 435.499 4.727 50 10 IJGE Cc1cc(C(=O)NNc2ccc(F)cc2Br)ccc1NC(=O)c1cccs1 759659164 LRQXBSFWKVARET-UHFFFAOYSA-N 448.317 4.967 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OCc2c(F)cccc2Cl)c(-c2ccccc2)n1 761409105 BBLKHMRVNZIMBD-ATVHPVEESA-N 434.858 4.907 50 10 IJGE CCOc1ccc(Br)cc1C=NNC(=O)COc1ccccc1C(C)(C)C 1772753687 BSHNHGRKKWJCQL-UHFFFAOYSA-N 433.346 4.674 50 10 IJGE COc1ccc(-c2nn(-c3ccc(Cl)cc3)c3c2[C@H](c2ccc[nH]2)C(C#N)=C(N)O3)cc1 1865710002 MBLNOVTZTGDMHA-FQEVSTJZSA-N 443.894 4.748 50 10 IJGE C[C@@H]1[C@@H]([C@H](CBr)NC(=O)OC(C)(C)C)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 1882087941 NGMLOKVVBLHXRC-RBGFHDKUSA-N 447.414 4.699 50 10 IJGE CC(C)CNCC1(C[C@@H]2C[C@H]2Br)C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 1887901875 SUHAIIUCIPODDX-PERVXXQJSA-N 429.443 4.954 50 10 IJGE C[C@H](Br)CCCNC(=O)c1cccc(Br)c1Br 1943888245 XXLZNHXTATYOEU-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE C[C@@H]1CN(Cc2c(Br)cccc2Br)C[C@@H]1CBr 1945321889 JFELGMGYBNZCBT-ZJUUUORDSA-N 425.990 4.674 50 10 IJGE CC1(C)CC(CO[C@@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)C1 1989576263 ULOCAHCGHWOWKQ-GOSISDBHSA-N 437.362 4.644 50 10 IJGE CCN(C[C@@](C)(CI)O[C@H]1CCC2CC1C2)C(=O)OC(C)(C)C 1992237255 GECLQWOQRQVTTH-ZUBZBLCWSA-N 437.362 4.642 50 10 IJGE Cc1ccc(C(F)(F)F)cc1C[C@@H](Br)CN1C(=O)c2ccccc2C1=O 1994847563 BSERTJCFCUNRHR-CQSZACIVSA-N 426.232 4.616 50 10 IJGE CN(CC[S@](C)(=O)=NCC1(CBr)CCCCCC1)C(=O)OC(C)(C)C 2044706889 YAVWJXSVCKYGIX-VWLOTQADSA-N 439.460 4.687 50 10 IJGE C[C@]12CN(Cc3ccc(Br)cc3Br)C[C@]1(CBr)C2 2046797244 IIVVJVFMMMLZKH-UONOGXRCSA-N 438.001 4.819 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CCCC[C@@H](Br)C1 2050107143 BPEBMIIPGHCGNA-SNVBAGLBSA-N 439.973 4.601 50 10 IJGE Fc1ccc(F)c(Cn2nc(CCl)c(I)c2C(F)(F)F)c1 2079210872 COBFNVLAXVRMEQ-UHFFFAOYSA-N 436.549 4.572 50 10 IJGE CC[C@@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@@H]1CBr 2086660218 CEHVJVQBQXHLBL-NEPJUHHUSA-N 442.566 4.798 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCC2(CC1)C[C@@H]2CCl 2092487230 IYWXCGQBJBTAJO-MRVPVSSYSA-N 427.589 4.754 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1C[C@@H](CBr)[C@@H](C(F)(F)F)C1 2107044734 ITKVKSUHBRBQGD-HIFRSBDPSA-N 448.304 4.973 50 10 IJGE Cc1sc(C)c(S(=O)(=O)NC2(CBr)CCCCC2)c1Br 2143917243 ZPDHZRCUEBUXLH-UHFFFAOYSA-N 445.242 4.504 50 10 IJGE CCCN(C(=O)N1CCC(Br)CC1)C1CCC(NC(=O)OC(C)(C)C)CC1 2163053848 RESKWQHIDIHHJC-UHFFFAOYSA-N 446.430 4.514 50 10 IJGE C[C@@H]1CCC[C@H](N(C)S(=O)(=O)c2cc(CBr)sc2Br)C1 2179786923 HSBNXKSHAHNEJJ-ZJUUUORDSA-N 445.242 4.605 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1C1CCN(C[C@H](CBr)C(C)(C)C)CC1 2185504418 XLHVUXGHGJYEHN-HNNXBMFYSA-N 443.430 4.993 50 10 IJGE CC(C)(C)OC(=O)N1[C@H](CNC(=O)[C@H](Br)C2CCCC2)C[C@@H]2CCCC[C@H]21 2240968529 RHCOGNIATMOWMG-WNRNVDISSA-N 443.426 4.625 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)[C@]23COC[C@H](C2)C3)c1 2263513629 PZMBYTFYPQUJSN-LERXQTSPSA-N 438.985 4.944 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](CN(CC2(CBr)CC(F)C2)C2CC2)C1 2265639758 VDCANJQLPZTXAB-SHPPYHEDSA-N 433.406 4.611 50 10 IJGE COc1ccc([C@@H](Cl)c2nn(C)cc2Br)c(Br)c1Cl 2268259738 NWFCYVVYKCDDNO-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)ccc1Oc1nc(Cl)ncc1F 2297456301 YQYYIJSXCBGEJU-UHFFFAOYSA-N 438.846 4.924 50 10 IJGE Clc1ccc(CN2CCC(CBr)CC2)c(I)c1 2302324914 BPDTVUZPPRYEJX-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Br)c1cc(F)ccc1F 2316723839 FJISTKOBRLRQJG-QMMMGPOBSA-N 444.899 4.708 50 10 IJGE COc1ccc(Cc2nc3ccc(C(=O)NN=Cc4ccc(OC(C)C)cc4)cc3[nH]2)cc1 2323720557 JIIXCMMMMOOVCU-UHFFFAOYSA-N 442.519 4.713 50 10 IJGE N#CC(=CNc1cc(Br)ccn1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 2325385100 PQXQJCDDLPBLHY-UHFFFAOYSA-N 445.626 4.974 50 10 IJGE COC(=O)c1ccc(C(C#N)=Cc2cc(Br)cc(Br)c2OC)o1 2331048464 IYHKAGICXOAKOF-UHFFFAOYSA-N 441.075 4.664 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)c2ccc(NC(=O)CC(C)C)cc2)cc1 14028424 RQCJRCWRODQUFX-UHFFFAOYSA-N 439.556 4.705 50 10 IJGE CCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccccc1OC 38650086 UUNWCQAPWYCCKL-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE CC1CCC(NC(=O)[C@@H](c2ccc(F)cc2)N(Cc2cccs2)C(=O)CCl)CC1 97914703 MUEYXYDVYZVOHF-ZYKWQNGHSA-N 436.980 4.891 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C\Nc1cc([N+](=O)[O-])ccc1Cl)C12CC3CC(CC(C3)C1)C2 217036406 CHIWXBDOEPKOKS-UORUSPLLSA-N 428.920 4.789 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C\N1CCN(c2cccc(Cl)c2)CC1)c1ccc2c(c1)CCCC2 217203666 SGGHRRGAKKWKQJ-UPHPNCSHSA-N 448.998 4.626 50 10 IJGE C=CCc1cccc(C=NNC(=O)c2ccccc2NC(=O)c2ccccc2Cl)c1O 252620857 MNRKJYAUKRDUPK-UHFFFAOYSA-N 433.895 4.790 50 10 IJGE CCn1c(SCC(=O)NN=C(C)/C=C\c2ccccc2)nnc1-c1ccc(Cl)cc1 254289360 CFFMAYJJRRCNMH-YDFCQHBUSA-N 439.972 4.916 50 10 IJGE CC(=O)[C@@H](Br)[C@H](C)c1ccc(Br)c(I)c1 300904553 NERALXQNAKNEJQ-KBUNVGBDSA-N 445.920 4.510 50 10 IJGE CC[C@@H]1CN(C(=O)c2cc(Br)sc2Br)C[C@H]1Br 400008741 MVSDFKKDXUOHRT-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2cnn(Cc3ccc(Cl)cc3)c2)c(C(F)(F)F)c1 799403587 NBHQYXOZTQIZJT-UHFFFAOYSA-N 434.809 4.624 50 10 IJGE O=C(NN=Cc1cccc(OCc2ccc(Cl)cc2)c1)C(=O)Nc1cccc(Cl)c1 1083967943 ZJDUJPHIKYRWGK-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE C[C@H](SCc1ccccc1)C(=O)NN=C1C(=O)N(Cc2ccccc2F)c2ccccc21 1083998175 QPSFJZWZCDPGLV-KRWDZBQOSA-N 447.535 4.515 50 10 IJGE COc1ccc(C)cc1NC(=O)C(=O)NN=Cc1ccc(-c2ccc(Cl)c(Cl)c2)o1 1084404368 SQHDHAWRFCWDEX-UHFFFAOYSA-N 446.290 4.659 50 10 IJGE C=C(C)C[C@@H](CO)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1633175922 VNQYSPCVQATLMK-VZZQTLFRSA-N 432.351 4.751 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2cccc(Cl)c2)[C@@H]1c1ccc[nH]1 1865710036 MYQHMAIPZLPCFO-FQEVSTJZSA-N 427.895 4.798 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865712580 CBMPPDLBNOJVHU-JOCHJYFZSA-N 443.507 4.627 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCN(Cc2ccccc2)CC12CCC2 1882089161 XQBQRENXRXFAPO-RTBURBONSA-N 437.422 4.967 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCC12CCN(C(=O)OC(C)(C)C)CC2 1882757001 ZWLVBCHVDJJWKU-CABCVRRESA-N 447.414 4.702 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)c1ccc(S(=O)(=O)C(F)F)cc1 1915081195 FXSZULBQZBNGTC-HNNXBMFYSA-N 432.330 4.863 50 10 IJGE CCCCOc1ccc(C(=O)N(C)C[C@H](Br)COCc2ccccc2)cc1 1916354912 NIVWDNDQWPUXDJ-FQEVSTJZSA-N 434.374 4.918 50 10 IJGE O=S1(=O)CCC[C@@H]1[C@H](Br)c1c(Cl)sc(Br)c1Cl 1925619146 YDUFVKMGFHJSPW-XINAWCOVSA-N 443.009 4.831 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC12CCC1(CCC[C@H](CI)O1)CC2 1937362663 ZINODGJPXGHBKU-LHVTWPBJSA-N 435.346 4.587 50 10 IJGE CC[C@H](CCBr)NC(=O)c1csc(Br)c1Br 1937738349 QTTHTDVROLCUTM-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE IC[C@@H]1CC[C@]2(CN(Cc3ccccc3)C3(CCCCC3)C2)O1 1939537576 SXYNHPANIMVVSI-ICSRJNTNSA-N 425.354 4.948 50 10 IJGE O=C(N[C@@H]1CC[C@H](CBr)C1)c1cc(Br)c(Br)s1 1942368284 QVEOXVSVVDYRSD-NKWVEPMBSA-N 446.002 4.567 50 10 IJGE Clc1ncn(-c2cc(Br)ccc2Br)c1CBr 1982515987 AULMHVGPZMTIIL-UHFFFAOYSA-N 429.337 4.946 50 10 IJGE CCN(C[C@](C)(CI)OCc1ccccc1C)C(=O)OC(C)(C)C 2024649206 PNVZRKHJSYODJP-IBGZPJMESA-N 447.357 4.962 50 10 IJGE C[C@H]1C[C@H](CBr)CN1Cc1ccc(I)c(Cl)c1 2026565473 BNODJRLATPDSNQ-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE C[C@H](CCBr)CCN1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]1C(F)(F)F 2052477558 GTKBSBWDVQJPJV-RDBSUJKOSA-N 431.337 4.670 50 10 IJGE COc1cc2c(cc1OC)[C@H](c1cccc(F)c1)N(C(=O)C(C#N)=Cc1ccccc1)CC2 2077614708 GJCHHFIJSFBNPA-SANMLTNESA-N 442.490 4.924 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1c(Cl)cccc1Br 2081246891 RGAPWSCIGDPMHQ-GZMMTYOYSA-N 444.538 4.682 50 10 IJGE C[C@@H]1CCN(CCCCCCCCCBr)[C@H](C)[C@@H]1NC(=O)C(F)(F)F 2106781287 GRBYZIQDTRJVBD-BZUAXINKSA-N 429.365 4.889 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@@H]1CCN(Cc2ccccc2)C1 2128513719 QDQUOABKMPJFJF-MRXNPFEDSA-N 433.781 4.731 50 10 IJGE Clc1cc(N2CC[C@H]3COC[C@@H](C2)N3Cc2ccccc2)ccc1CBr 2139653449 WIXKOGUPHKANKN-VQTJNVASSA-N 435.793 4.715 50 10 IJGE Fc1cc(Br)cc(N2CCS[C@@H](C(F)(F)F)C2)c1CBr 2170700072 XHSSFACZLKZRSV-LLVKDONJSA-N 437.094 4.967 50 10 IJGE Sc1nc2cc(Br)c(Br)cc2n1C[C@@H]1C[C@H]1Br 2213495310 CJTDMPIOFZYFIX-NTSWFWBYSA-N 440.986 4.633 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1C[C@H]2C[C@H]1CN(CC1(CBr)CCCCCC1)C2 2226527390 ZSZQENBRCAIMLN-SQNIBIBYSA-N 429.443 4.957 50 10 IJGE C[C@@H](Cl)CN(c1ncc(I)cc1Br)C(C)(C)C 2250600768 JZIUQZOQJWGNIU-MRVPVSSYSA-N 431.543 4.681 50 10 IJGE COc1ccc([C@H](Cl)c2cn(C)c(Br)n2)c(Br)c1Cl 2268263465 HZZJPTIMZSBORM-JTQLQIEISA-N 428.939 4.935 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1Cc1ccc(Cl)c(I)c1 2300241384 YKPOEIGGHVDZJG-KOLCDFICSA-N 428.539 4.692 50 10 IJGE CC(C)(C)[C@H](CBr)NCc1cc(I)ccc1Cl 2307328818 RNFNVAXDAIFMLZ-LBPRGKRZSA-N 430.555 4.844 50 10 IJGE C#CCOc1cc(Br)c(C=C(C#N)C(=O)Nc2ccc(C)cc2)cc1OCC 2313568249 QLRHZOZUNOUOTG-UHFFFAOYSA-N 439.309 4.714 50 10 IJGE Cc1cc(NC=C(C#N)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)ccc1Br 2325216366 QCYDHQOUSQVEKF-UHFFFAOYSA-N 435.665 4.777 50 10 IJGE CC1(C)CC(CBr)(CN2[C@H](CNC(=O)OC(C)(C)C)C[C@@H]3CCC[C@@H]32)C1 2345008233 MGDVSLBNKIRCOG-ULQDDVLXSA-N 429.443 4.955 50 10 IJGE CC[C@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)COc1cc(C)ccc1C(C)C 9873201 OPVLTUSEAJRSTO-OALUTQOASA-N 426.557 4.626 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)/C=C\c3ccccc3)cc2)cc1 33499047 NZMGACZNBYDZPB-NVMNQCDNSA-N 441.531 4.711 50 10 IJGE Cc1c(C(=O)N2CCCC2)oc2c1/C(=N/NC(=O)c1ccc(-c3ccccc3)cc1)CCC2 40822672 FMONWGIYHNCURI-XAYXJRQQSA-N 441.531 4.961 50 10 IJGE N#Cc1ccccc1Cn1cc(/C=N\NC(=O)CC[C@H](O)c2ccccc2)c2ccccc21 58888495 VZYZSQOAZRATFV-AZFAFLPTSA-N 436.515 4.525 50 10 IJGE O=C(CC[C@@H](O)c1ccccc1)N/N=C\c1cn(Cc2ccccc2F)c2ccccc12 58891076 SMSUJBIEKMEMQS-NNVPUZBJSA-N 429.495 4.793 50 10 IJGE C[C@H]1CCc2c(sc(NC(=O)/C(C#N)=C\c3ccc(-c4ccc(F)cc4)o3)c2C(N)=O)C1 102668833 JUCIVKITMPHUNX-WZMONFQBSA-N 449.507 4.917 50 10 IJGE O=S(=O)(c1c(Cl)cc(Br)cc1Cl)N1[C@@H]2CC[C@@H]1CC(Cl)C2 111391013 NTWLKPQRWUHXJG-NXEZZACHSA-N 433.582 4.679 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccncc2)ccc1OCc1c(Cl)cccc1Cl 169899702 GHEAZOHBOCKKOW-ROTLSHHCSA-N 430.291 4.740 50 10 IJGE CC(=NNC(=O)c1ccncc1)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1 254908074 NCBZUDYZXANIEP-UHFFFAOYSA-N 427.291 4.795 50 10 IJGE O=C1Cc2cc([C@H](Br)c3ccoc3Br)c(Br)cc2N1 306047952 UEGXCUCMAADTPC-GFCCVEGCSA-N 449.924 4.784 50 10 IJGE C[C@@H](Br)CN(C(=O)c1scc(Br)c1Br)C1CC1 705447725 LNRBLRDMAFFWKU-ZCFIWIBFSA-N 446.002 4.661 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc3nc(-c4ccccc4)oc3c2)c1C 795113306 MFQGVZSKQATONF-UHFFFAOYSA-N 436.475 4.721 50 10 IJGE CCCN(CCC)C(=O)c1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1 799388791 WWMWFSDLHOMYEG-UHFFFAOYSA-N 447.461 4.988 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccc(C(F)(F)F)cc2N2CCCC2)c(C(F)(F)F)c1 803360892 NVVKFFWKTSUYRX-UHFFFAOYSA-N 442.363 4.953 50 10 IJGE CC(=NNC(=O)CCCSc1nc2ccc([N+](=O)[O-])cc2s1)c1ccc(F)cc1 1084141205 ZCERSXFLBMIRBC-UHFFFAOYSA-N 432.502 4.756 50 10 IJGE CC(=O)CC1(C(=O)NNC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)CCC1 1135582002 LXFZARDCNVUCCK-UHFFFAOYSA-N 430.957 4.543 50 10 IJGE C=C(C)CN1CCC(NC(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(Cl)c3)c2C)CC1 1443514973 HNKTWVXDLRUYIO-BKUYFWCQSA-N 436.987 4.811 50 10 IJGE C=CCCC[C@H](NC(=O)NNC(=O)Nc1cc(OC)c(Cl)cc1OC)c1ccccc1 1471203204 JAZDEJXYZQTAPR-KRWDZBQOSA-N 446.935 4.791 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@@H]2C)oc2c1C(=NNC(=O)c1cccs1)CCC2 1772748923 HILMBUSTZOFXBC-AWEZNQCLSA-N 433.533 4.711 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](NC(=O)CCc2ccccc2F)c2ccccc2)cc1 1866594999 CXCMZERKLJXHLD-HSZRJFAPSA-N 433.508 4.828 50 10 IJGE O=C(N[C@H](C[C@H]1C[C@@H](Br)C1)C(=O)O)OCC1c2ccccc2-c2ccccc21 1877472987 OECLZONWYNIENY-LAPQFRIASA-N 444.325 4.542 50 10 IJGE CC[C@@H]1C[C@H]1CCO[C@@](C)(CI)CN(CC)C(=O)OC(C)(C)C 1902803927 RUYMNUCLRFUJRS-RKVPGOIHSA-N 439.378 4.890 50 10 IJGE CCc1nn(C)c(CN(CCCBr)Cc2ccccc2)c1Br 1914648883 DGZOCWJXMHWFBH-UHFFFAOYSA-N 429.200 4.532 50 10 IJGE Cc1ncc(Br)c(N(Cc2ccccc2)[C@H](CBr)C2CC2)n1 1915193294 LVCUPURGCHZHDN-MRXNPFEDSA-N 425.168 4.728 50 10 IJGE O=S(=O)(c1cc(CCl)c(Cl)cc1Cl)N(Cc1ccccc1)[C@H]1CCOC1 1915472812 VYEOYOAJMWXBIA-HNNXBMFYSA-N 434.772 4.712 50 10 IJGE C[C@@H](Br)C(C)(C)NC(=O)c1csc(Br)c1Br 1937737518 JVYHACJKCRRYEO-RXMQYKEDSA-N 433.991 4.565 50 10 IJGE CCC[C@](C)(CBr)NC(=O)c1cc(Br)c(Br)s1 1942785536 NMPKYSPQFKDEME-LLVKDONJSA-N 448.018 4.957 50 10 IJGE Cn1nc(CN(Cc2ccccc2)C2(CBr)CCC2)cc1Br 1960910601 QOXVQFZVLQKVIX-UHFFFAOYSA-N 427.184 4.502 50 10 IJGE CCCC1CC(O[C@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)C1 1987758432 CNAGAKPZLLFZEO-JMLCCBQJSA-N 437.362 4.786 50 10 IJGE C[C@@H]1C[C@H]1N(CCBr)Cc1cc(Cl)ccc1I 2002044340 ZXFVOQWYJZZNOO-NOZJJQNGSA-N 428.539 4.550 50 10 IJGE O=C(c1c(Br)cccc1Br)N(CCCBr)C1CC1 2033089835 YAICGKLAQYQYOI-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE C[C@H](Br)[C@H](NC(=O)c1cc(Br)c(Cl)s1)C(F)(F)F 2074719967 KDXCLAURBWOSEI-DZSWIPIPSA-N 429.483 4.608 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1cccc(Br)c1Cl 2081237489 YDGRBGJBGJYOCS-KCJUWKMLSA-N 444.538 4.682 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@@H]2CCC[C@]2(CCl)C1 2103175390 IWVNXWSKGWXPBK-SDBXPKJASA-N 427.589 4.754 50 10 IJGE Cn1cc(Br)c(CC(CCl)(CCl)c2ccc(Br)cc2)n1 2143632239 AGUDVNIVBUOKII-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE Cc1cc(CBr)ccc1N1CCC[C@@]2(CN(Cc3ccccc3)CCO2)C1 2151742056 ZCTNBEILSCWKLQ-HSZRJFAPSA-N 429.402 4.761 50 10 IJGE O=C(c1ncc(Br)cc1Cl)N(CCBr)Cc1cccs1 2177056165 GPPBQGXIWFLLGV-UHFFFAOYSA-N 438.572 4.596 50 10 IJGE Clc1ccc(I)c(CN2[C@H]3CC[C@@H](Br)[C@H]2CC3)c1 2222301909 NHRWTQBBVARLLU-OUCADQQQSA-N 440.550 4.835 50 10 IJGE FC(F)(F)C(F)(F)CCCO[C@H](CCl)[C@@H](I)CCl 2223707395 MKQGGCCZWSDLFN-NKWVEPMBSA-N 428.994 4.631 50 10 IJGE C[C@@](CI)(O[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1F 2250387491 PNDLOEOIRGLOPF-XLIONFOSSA-N 439.312 4.767 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285844569 OPECOIJNVRMNFH-BDAKNGLRSA-N 427.539 4.735 50 10 IJGE Clc1ccc(COC[C@@H](CBr)C2CC2)c(I)c1 2301810365 KQNPVSMJQZEUFY-LLVKDONJSA-N 429.523 4.882 50 10 IJGE CCCOc1ccc(Br)cc1C=C(C#N)C(=O)Nc1cccc([N+](=O)[O-])c1 2313738867 UXWVBBBLICWVQE-UHFFFAOYSA-N 430.258 4.692 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl 2314332561 ZCXSBFOQXCCYTF-HAQNSBGRSA-N 431.758 4.933 50 10 IJGE CCCOc1ccc(C=CC(=O)N2CCC(C(=O)Nc3ccc(SC#N)cc3)CC2)cc1 2322057426 GTMVJBJMPKKUMQ-UHFFFAOYSA-N 449.576 4.939 50 10 IJGE CC(C)[C@@H]1C[C@@H](Cl)CN1Cc1ccc(I)c(Br)c1 2325206177 BWAINYNBTBIPNO-RISCZKNCSA-N 442.566 4.891 50 10 IJGE Clc1ccc(I)cc1COc1ccncc1CBr 2327237787 LWDKPKAIBCFZER-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE Cn1nc(C(F)(F)F)c(CBr)c1N(Cc1ccccc1)C[C@H]1CCCO1 2339775343 JQJQTJJAIUCVJR-CQSZACIVSA-N 432.284 4.519 50 10 IJGE C/C(=N/NC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1)c1ccc(-n2ccnc2)cc1 33562845 YOTQXUVXEYGYGP-QQXSKIMKSA-N 440.532 4.735 50 10 IJGE C=CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4F)ccc32)cc1 38658225 YMHIKDHALDZYEY-XMMPIXPASA-N 442.446 4.828 50 10 IJGE Cc1ccc(-n2nc(C)c(/C=N/NC(=O)c3ccc(Br)cc3)c2C)cc1C 59151605 UTWIPNZHMMZMEU-FSJBWODESA-N 425.330 4.632 50 10 IJGE CCCOc1ccccc1/C=C\C(=O)Oc1ccc(/C=C(/C#N)C(=O)OCC)cc1OC 207002691 DUMYQQCULOEPIX-NWGMBANDSA-N 435.476 4.573 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C/c2ccc(OCCC)cc2)cc1 207118548 SZSACGNWJAQWLZ-IDYZTLMOSA-N 432.520 4.917 50 10 IJGE CC[C@@H](C)c1ccccc1OCCOc1ccc(C=NNC(=O)c2ccncc2)cc1OC 252622234 NRCCGLWIWBCICC-LJQANCHMSA-N 447.535 4.825 50 10 IJGE C[C@H](Cl)c1nc2ccc(Br)cc2n1C[C@H]1CN(Cc2ccccc2)CCO1 312616729 HFEDOQMFEIFQOU-MAUKXSAKSA-N 448.792 5.000 50 10 IJGE Cn1cc(Br)c([C@@H](Br)c2cc(F)c(Br)cc2F)n1 693105727 DHGNYZPAGMSAQC-JTQLQIEISA-N 444.899 4.708 50 10 IJGE COc1cccc(-c2ccc(CNC(=O)NNC(=O)c3ccc(Cl)cc3Cl)cc2)c1 745874644 ATHNNUXYWNIRRJ-UHFFFAOYSA-N 444.318 4.813 50 10 IJGE CC(C)(C)c1ccc(COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cn1 797302773 DZOMCRSMOARLCP-STZFKDTASA-N 439.519 4.807 50 10 IJGE COc1ccc(Br)cc1C=NNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 1083894241 PGMZQKWOXBFBIT-SNVBAGLBSA-N 446.128 4.682 50 10 IJGE CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N1CCC[C@@H](O[Si](C)(C)C(C)(C)C)C1 1275312946 BZBRXLNCZNYHAP-IFMALSPDSA-N 430.665 4.535 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)Cc2coc3c(Cl)c(Cl)ccc23)c1C 1306591402 VDTCVGSOEACKMD-UHFFFAOYSA-N 442.306 4.894 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2cccc(-n3ccnc3O)c2)c(C)n1-c1ccc(F)cc1 1527763438 HSPPHVRNHZHKBF-CPNJWEJPSA-N 441.466 4.670 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C)c1ccccc1OC(F)F 1538746666 ZBLSFXUIYYZTTE-OUKQBFOZSA-N 443.475 4.584 50 10 IJGE N#CSc1c(C#N)c(-c2cccs2)nn1CNC(=O)Nc1ccccc1C(F)(F)F 1615714170 OSNQPUDBASTBHE-UHFFFAOYSA-N 448.455 4.854 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc(F)cc1)CCC2 1772744898 MDRZDOYZWVHMTE-UHFFFAOYSA-N 449.482 4.767 50 10 IJGE C[C@@H](Oc1cccnc1NC(=O)Nc1ccc(SC#N)cc1)C(=O)OCc1ccccc1 1858848823 PBYDQNGBVLAYQI-MRXNPFEDSA-N 448.504 4.809 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccn2)c1 1865690622 XDSRPOATHCMGDU-JOCHJYFZSA-N 435.487 4.551 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1cccc(Cl)c1 1865704580 ZEFWEQACVJWJRN-JOCHJYFZSA-N 434.927 4.900 50 10 IJGE CC(C)Cn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@H]2c1ccc(Cl)c([N+](=O)[O-])c1 1865706109 NUOLVJYZYHCEHJ-LJQANCHMSA-N 449.898 4.986 50 10 IJGE Cc1cc(-c2csc(/C(C#N)=C(\O)c3ccc(NS(C)(=O)=O)cc3)n2)ccc1F 1872749932 OFRSZAPXSYHJTB-MNDPQUGUSA-N 429.498 4.579 50 10 IJGE Cc1nsc(Br)c1[C@H](Cl)c1cc2c(cc1Br)NC(=O)C2 1912982187 JMUQCYXKHHHNJE-GFCCVEGCSA-N 436.556 4.799 50 10 IJGE COc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1ccccc1)C1(CBr)CCC1 1915749581 MRSRCGSZZAPERD-UHFFFAOYSA-N 433.302 4.563 50 10 IJGE CC[C@@H]1CN(Cc2cccc(Br)c2Br)C[C@@H]1Br 1943885747 WSXPHAIGBBXYNR-SKDRFNHKSA-N 425.990 4.817 50 10 IJGE C[C@H](Cl)c1cnnn1-c1cc(Br)c(Br)c(Br)c1 1946434845 OQBUOUBTECTOKY-YFKPBYRVSA-N 444.352 4.855 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@]23CC[C@@](C)(CI)O3)C1 1950282315 ZOIIRDQSXDTGBV-OTWHNJEPSA-N 449.373 4.931 50 10 IJGE Clc1cc(CN[C@H](CBr)C2CCC2)ccc1I 2026565469 BMHYCIRNKPCULO-CYBMUJFWSA-N 428.539 4.598 50 10 IJGE Clc1sc(Br)c(Cl)c1[C@H](Br)[C@@H]1CO[C@@H]2COC[C@H]21 2040325158 JSJHUUGFHXUNJW-LENIQADQSA-N 436.980 4.915 50 10 IJGE O=C(NCC1CCN(C[C@@H](CBr)c2ccccc2)CC1)OCc1ccccc1 2044706604 VNPLQRMMLLDIFZ-JOCHJYFZSA-N 445.401 4.804 50 10 IJGE CC(F)(F)C[C@@H](CCl)NC(=O)c1csc(Br)c1Br 2050369290 MKGBABYYJZDFHL-YFKPBYRVSA-N 425.520 4.656 50 10 IJGE CC(C)c1ccnc(-n2nc(CCl)c(I)c2C(F)(F)F)c1 2078881096 PUEYXJWRIJRDFJ-UHFFFAOYSA-N 429.611 4.753 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(CC3(CBr)CCCC3)C[C@H]21 2106786964 WPVIEJYMYSKPIB-TVFCKZIOSA-N 427.427 4.519 50 10 IJGE Cc1sc(C)c(S(=O)(=O)NC[C@@H](Br)CC(C)(C)C)c1Br 2143914180 NQYVUHSFNWLYOA-JTQLQIEISA-N 447.258 4.605 50 10 IJGE CN([C@@H]1CC[C@@H]1OCc1ccccc1)S(=O)(=O)c1cc(Cl)cc(CCl)c1F 2156443219 PYYDVSQGNWTJAX-SJORKVTESA-N 432.344 4.586 50 10 IJGE CCC[C@H](CCBr)CNC(=O)c1ccc(C)c(I)c1 2224619657 XVEPOWPGKHHKQD-GFCCVEGCSA-N 438.147 4.531 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)[C@@H]1C[C@@H]2CCC[C@H](C1)C2(F)F 2233637897 IYORMYVGIDFYTQ-FCGDIQPGSA-N 444.360 4.887 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1Cc2ccc(NC(=O)[C@@H](Br)C3CCCC3)cc2C1 2234141480 XMRWRKLSZIQUJO-MSOLQXFVSA-N 437.378 4.571 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)C[C@H](C)Br)c(Cl)c1OC 2256333799 SIBZZHIWEXVWPM-ZDUSSCGKSA-N 426.738 4.783 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCC(F)(CBr)CC1 2282966049 BRSRLWGKCPYHNN-UHFFFAOYSA-N 431.502 4.581 50 10 IJGE CC[C@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@H]1CBr 2282969696 GATBDUGRHWXHTG-IUCAKERBSA-N 427.539 4.735 50 10 IJGE CC1(C)OCCO[C@H]1[C@@H](Cl)c1c(F)cc(Br)c(F)c1Br 2288358248 NCROVOIRBGVSFS-JQWIXIFHSA-N 434.502 4.964 50 10 IJGE CC[C@H]1[C@H](Br)CCN1Cc1cc(I)ccc1Cl 2307325097 VNYPCLJJQVTTJS-YPMHNXCESA-N 428.539 4.692 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN(Cc2ccc(Cl)c(I)c2)C1 2315554279 CXLJDMYORJXLFQ-PWSUYJOCSA-N 442.566 4.940 50 10 IJGE Clc1ccc(CN2C[C@@H](CBr)C3(CC3)C2)c(I)c1 2318529308 OOMLKRGFXYQUAA-LLVKDONJSA-N 440.550 4.552 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCc1cc(C)ccc1C 2322974912 OLNFYKANPHCOBG-UHFFFAOYSA-N 447.491 4.953 50 10 IJGE ClCC[C@@H]1CCC[C@H]1NCc1ccc(I)c(Br)c1 2325207172 OOBRSQLJMMCWEH-SMDDNHRTSA-N 442.566 4.941 50 10 IJGE CC(C)(C)OC(=O)N1[C@@H](CNC(=O)[C@@H](Br)C2CCCC2)C[C@H]2CCCC[C@H]21 2358977201 RHCOGNIATMOWMG-TVFCKZIOSA-N 443.426 4.625 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@]2(CBr)CC2(F)F)[C@@H](c2ccccc2)C1 2379985465 ILNNBAJAMQEZJV-APWZRJJASA-N 445.348 4.701 50 10 IJGE Cc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)N4c5ccccc5C[C@H]4C)c(C)c32)c1 40811336 OLZHJANKNYKSGC-QPGLCGFSSA-N 441.531 4.958 50 10 IJGE CCc1ccc(N2C(=O)[C@H](Cc3ccc(C(C)C)cc3)S/C2=C(/C#N)C(=O)NC)cc1 101240397 DOKQAWUAZFGGMU-JSIHEXFSSA-N 433.577 4.545 50 10 IJGE CCOc1cc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)ccc1OCc1cc(C)ccc1C 169879990 WWLKRBKQWJPUSI-CVKSISIWSA-N 447.491 4.953 50 10 IJGE COC(=O)/C(C#N)=C/c1cccc(OC(=O)/C=C\c2ccc(OCCC(C)C)c(OC)c2)c1 206952811 BGHPJFVLRGHZNB-TYJLTJPWSA-N 449.503 4.819 50 10 IJGE CC[C@H](C)N(CCBr)C(=O)c1scc(Br)c1Br 707886967 UOIGODOLYXBJLM-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE CC[C@H](C)NC(=O)[C@@H](c1cccs1)N(C(=O)CCl)c1cccc(C(F)(F)F)c1 725238053 OZMIMVRGCJDLJJ-YVEFUNNKSA-N 432.895 4.995 50 10 IJGE O=C(COc1ccc2cc(Br)ccc2c1)NNc1ccc(F)c(F)c1F 727759807 ABDIGTWBGRBOGX-UHFFFAOYSA-N 425.204 4.542 50 10 IJGE CC(C)c1ccccc1NC(=S)NNC(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 741282257 HEVJXSLDTRDMNL-HOTGVXAUSA-N 437.487 4.830 50 10 IJGE COc1cccc([C@H](NC(=O)NNC(=O)c2ccc(Cl)cc2)c2ccccc2Cl)c1 745849980 UPUQCTUEVDYHPJ-FQEVSTJZSA-N 444.318 4.736 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2C[C@@H]3[C@H]4CC[C@@H](C4)[C@H]3C2)c(-c2ccc(Cl)cc2)n1 818447624 AUVZHJNHQNBHBI-LHJRVHIWSA-N 445.954 4.529 50 10 IJGE CC1(C)[C@H]2CC[C@]1(C)/C(=N\NC(=O)CSc1nnc(NCCc3cccs3)s1)C2 1086989419 SGUKAWARFPJWGQ-SDSMDREMSA-N 449.671 4.665 50 10 IJGE CC(C)(C(=O)NNc1nc2ccccc2[nH]c1=S)[C@@H](O)c1cc(Cl)cc(Cl)c1 1167430780 REQFGBHOWDFPGT-HNNXBMFYSA-N 437.352 4.802 50 10 IJGE C=CC(C)(C)CCCNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1 1254989771 KEEMMYXPCGXGJI-UHFFFAOYSA-N 429.948 4.855 50 10 IJGE C#CCOc1ccccc1CNC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Cl)cc2)c1C 1265222051 QUXPBAMLNXRJQZ-JCMHNJIXSA-N 443.934 4.983 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2nc(-c3ccccc3)oc2C(C)C)c1C 1318660620 GOXUMQBYMVKLCU-UHFFFAOYSA-N 428.496 4.691 50 10 IJGE Cc1cnc(O)c(CNC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc4ccccc34)c2C)c1 1538943937 OVWWUXXPZAKMIL-LPYMAVHISA-N 436.515 4.880 50 10 IJGE Cc1c(C(=O)Nc2ccccc2Cl)oc2c1C(=NNC(=O)c1ccccc1O)CCC2 1772751718 KTWAXEYAGYVLIY-UHFFFAOYSA-N 437.883 4.670 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)C12CC(C1)[C@@H](C(F)(F)F)O2 1878394606 CFGZFDNHIVGGOK-NDUQDZPOSA-N 434.296 4.545 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cccc(C(F)(F)F)c1 1914636239 AUYXXPVCNVIBDG-ZDUSSCGKSA-N 436.293 4.680 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2ncccc12 1915095017 QLLFXEBJPZTBER-INIZCTEOSA-N 433.371 4.599 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@@H]1Cc1ccc(I)c(Cl)c1 2026564484 UEUHSWOLXXQQHL-OUJBWJOFSA-N 429.523 4.676 50 10 IJGE O=C(N[C@@H](CBr)CC1CC1)c1ccc(Br)cc1Br 2029978136 RYANHHIENWVECT-SNVBAGLBSA-N 439.973 4.505 50 10 IJGE FC1(F)CC(CO[C@H](CI)c2ccc(Br)cc2)C1 2035120185 KMAHVKJDSWVMNG-GFCCVEGCSA-N 431.058 4.987 50 10 IJGE CC1(C)OCCO[C@@H]1[C@@H](Br)c1cc(Br)ccc1Br 2066691194 SYNQYXXINFVGGU-NWDGAFQWSA-N 442.973 4.842 50 10 IJGE COc1cc(-n2nc(CBr)c(Cl)c2C(F)(F)F)nc(C(F)(F)F)c1 2078912354 MTJMOOLKHDJUHC-UHFFFAOYSA-N 438.553 4.862 50 10 IJGE Clc1cc(CN2CC[C@H](Br)[C@@H]2C2CC2)ccc1I 2086654524 HESNMNBSSCAIJP-FZMZJTMJSA-N 440.550 4.692 50 10 IJGE CN(CCCCCCCCCBr)C[C@@H]1COCCN1C(=O)OC(C)(C)C 2106787804 KNEQXPRELVAVIK-GOSISDBHSA-N 435.447 4.680 50 10 IJGE O=C(c1cc(Br)sc1Br)N1[C@H](CCl)C[C@@H]2CCC[C@@H]21 2108400763 ZMAOCJZCAUCFQH-NRPADANISA-N 427.589 4.895 50 10 IJGE O=C(NC[C@@H]1C[C@@H](Cl)C12CCC2)c1scc(Br)c1Br 2115601366 GICVNAWBCNZDFV-IONNQARKSA-N 427.589 4.801 50 10 IJGE CCCOc1ccc(S(=O)(=O)N(CCC)Cc2ccccc2)cc1CBr 2123254762 PHSUDUCNAZUDAG-UHFFFAOYSA-N 440.403 4.971 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Cl)c1c(Br)cnn1C 2138240203 HGPCLYKNGQCJNH-JTQLQIEISA-N 428.939 4.935 50 10 IJGE Cc1csc(CCl)c1S(=O)(=O)N(C)[C@H]1CC(C)(C)[C@H]1OCc1ccccc1 2156446151 ZQIMLIDZMNTCBV-LPHOPBHVSA-N 428.019 4.800 50 10 IJGE Fc1cc(Br)cc2c1nc(CCCl)n2[C@]12C[C@H]1CN(Cc1ccccc1)C2 2232924913 WRDLDDHKWLETDT-BTYIYWSLSA-N 448.767 4.950 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1 2242382840 LUAMZZPUMTWXFA-UPJWGTAASA-N 430.895 4.697 50 10 IJGE Fc1cccc([C@H](CI)O[C@H]2CCN(Cc3ccccc3)C2)c1 2244798873 CVDBIPRHEZHKJQ-OALUTQOASA-N 425.285 4.593 50 10 IJGE CC[C@H]1[C@H](Br)CCN1Cc1ccc(I)c(Cl)c1 2251038677 IEJKFUSIVRQJDQ-MFKMUULPSA-N 428.539 4.692 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)[C@H]2C[C@H](S(C)(=O)=O)C2)c(C)c1Br 2285274647 OOPCGYOQZBRIFW-BHDSKKPTSA-N 444.616 4.932 50 10 IJGE O=C(NN=CC=Cc1ccccc1[N+](=O)[O-])c1cc(-c2ccc3c4c(cccc24)CC3)[nH]n1 2297304525 WIKZTVAFWGRJKR-UHFFFAOYSA-N 437.459 4.666 50 10 IJGE CC(C)Cc1ccc(-c2csc(C(C#N)=CNc3ccc4c(c3)C(=O)NC4=O)n2)cc1 2297463779 YJZDBOWOCURWNL-UHFFFAOYSA-N 428.517 4.869 50 10 IJGE BrC[C@@H]1C[C@H]2CC[C@@H]1N2Cc1c(Br)cccc1Br 2309693893 BZZZDRLABOYARP-RBZYPMLTSA-N 438.001 4.959 50 10 IJGE ClC[C@@H]1CCCCN(Cc2ccc(I)c(Br)c2)C1 2325212312 DKSXMTAIKWVXAE-LBPRGKRZSA-N 442.566 4.895 50 10 IJGE O=C(N[C@@H]1C[C@@H]2C[C@H]1C[C@H]2Br)c1cc(Br)c(F)cc1Cl 2359509200 RNXRPZWAXXDHIE-KNWYZZDGSA-N 425.523 4.533 50 10 IJGE Cc1csc(C(=O)N2CC[C@@H](Br)C[C@@H]2C(F)(F)F)c1Br 2361457895 GSUUIEPIFSMVHP-HTQZYQBOSA-N 435.103 4.749 50 10 IJGE CN(C[C@@H]1CN(C[C@@H](CBr)c2ccccc2)CC12CC2)C(=O)OC(C)(C)C 2366104161 MJSRUHJTVLYVRO-RTBURBONSA-N 437.422 4.744 50 10 IJGE COc1ccc(/C=N/NC(=O)COc2ccc(C(C)(C)C)cc2Br)cc1C 14014216 DKZYCWKEZBCNMS-FSJBWODESA-N 433.346 4.593 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccc([N+](=O)[O-])cc3)ccc2[C@@H]1c1ccc(Cl)cc1 38651330 GLQVMTSXAKGVQL-NRFANRHFSA-N 447.834 4.686 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4C)ccc32)c1 38684834 ZHFIPKKNDOVPOW-DEOSSOPVSA-N 426.472 4.831 50 10 IJGE Oc1nc2ccc([C@H](Br)c3cccc(I)c3)cc2o1 40285806 RSZIMVMVEHNTID-CYBMUJFWSA-N 430.039 4.622 50 10 IJGE Cc1ccc(-c2ccc(/C=N/NC(=O)CC[C@@H](O)c3ccccc3)o2)c(Br)c1 58886837 MZUNPSFAMXXKQA-LSCMLXDISA-N 441.325 4.981 50 10 IJGE Cc1ncsc1Cn1c([C@@H](C)Cl)nc2cc(I)c(F)cc21 97409204 MVHKYBMYOOPYPJ-SSDOTTSWSA-N 435.693 4.893 50 10 IJGE CN([C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(Cl)c(CCl)c1Cl 381109946 DSGNAVWJDLOLIS-HNNXBMFYSA-N 447.815 4.627 50 10 IJGE Brc1cccc([C@@H](CI)OCCOC2CCC2)c1 400782288 VIZFGEOLVCFVBP-CQSZACIVSA-N 425.104 4.511 50 10 IJGE C[C@H](Br)C(=O)c1cccc(I)c1SC(F)(F)F 514251037 COCODFBIPPGJCJ-YFKPBYRVSA-N 439.034 4.869 50 10 IJGE FC(F)Oc1ccc(Br)c(I)c1CBr 575682299 OSVWNRJXOIECMN-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE O=C(Cc1ccc(Br)cc1F)N(CCBr)Cc1ccccc1 692850875 KRPDOUQZNQFSRN-UHFFFAOYSA-N 429.127 4.554 50 10 IJGE CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNc1cccc(F)c1F 743724733 STGGVUCPSHROSF-INIZCTEOSA-N 430.282 4.559 50 10 IJGE CCCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@@H](Cc2nccn2C)c2ccccc2)c1C 744350337 SDILZCPRZUJOMU-DFOZZHOTSA-N 429.568 4.646 50 10 IJGE Cc1cccc(F)c1NNC(=O)c1cccnc1Oc1ccc(F)cc1Br 771707904 SWILMCQZGPCVGV-UHFFFAOYSA-N 434.240 4.980 50 10 IJGE C=CCOc1ccc(Br)cc1C=NNC(=O)COc1cc(C(C)C)ccc1C 1084072150 UJOVPWBTDMPKKV-UHFFFAOYSA-N 445.357 4.975 50 10 IJGE O=C(CNc1ccccc1)NN=Cc1ccccc1OCc1ccc(Br)cc1 1084609973 USMBPMBZPPOCMD-UHFFFAOYSA-N 438.325 4.590 50 10 IJGE O=C(NNc1ccccc1OC(F)(F)F)c1cc2ccc(C(F)(F)F)cc2nc1O 1296790074 YXIMKCWYBAGIRE-UHFFFAOYSA-N 431.292 4.615 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cc(Cl)cc(F)c1Br 1301148675 UXXVOATWRFFHJU-UHFFFAOYSA-N 427.686 4.604 50 10 IJGE C=C(C)C[C@@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc3ccccc23)c1C)C(=O)OC 1535097232 AESMHMVKRNQWGP-DLBLZJNESA-N 441.531 4.778 50 10 IJGE Cc1c(C(=O)Nc2cccc(C(F)(F)F)c2)oc2c1C(=NNC(=O)c1ccco1)CCC2 1772747258 NFJFYHKQTXCOPF-UHFFFAOYSA-N 445.397 4.923 50 10 IJGE Cc1occc1C(=O)NN=C1CCCc2oc(C(=O)Nc3ccc(Cl)cc3)c(C)c21 1772750041 VWOFKJQJCRFYFJ-UHFFFAOYSA-N 425.872 4.866 50 10 IJGE Cc1occc1C(=O)NN=C1CCCc2oc(C(=O)Nc3cccc4cccnc34)c(C)c21 1772750096 XLILQQBYIGYTIJ-UHFFFAOYSA-N 442.475 4.760 50 10 IJGE Cc1c(C(=O)Oc2ccccc2)oc2c1C(=NNC(=O)c1ccc3ccccc3n1)CCC2 1772751714 WYNUMYBXQDSIIK-UHFFFAOYSA-N 439.471 4.826 50 10 IJGE Cc1ccccc1COc1ccccc1C=NNC(=O)CSc1nc2ccccc2[nH]1 1772760388 IFRFHSCQHFXLEZ-UHFFFAOYSA-N 430.533 4.693 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c2c1[C@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 1865682092 FVPNCLYLQHUBNE-GOSISDBHSA-N 429.282 4.904 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2-c1ccc(C)cc1 1865691526 UVZVFCRJGPSFDZ-HSZRJFAPSA-N 426.520 4.916 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccccc2Cl)cc1 1865694042 OGYZCSMKNWXVSI-JOCHJYFZSA-N 434.927 4.900 50 10 IJGE COc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)cc1 1865707917 JJZCDYHHTLPXCY-QFIPXVFZSA-N 438.462 4.905 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CN(C(=O)OC(C)(C)C)[C@@H]1C(C)(C)C 1881339349 KHJRFKRVDQLGRZ-RDBSUJKOSA-N 435.403 4.556 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H](CCC(=O)NC[C@H]1C[C@H](Br)C1)C(C)(C)C 1887784982 XLCMQLSYKMWMEA-BZUAXINKSA-N 433.431 4.633 50 10 IJGE CCN[C@H](c1sc(Cl)cc1I)[C@H]1C[C@@H](Br)C1 1901028279 JOFBCJJODIZDTH-PJKMHFRUSA-N 434.568 4.830 50 10 IJGE O=S(=O)(N[C@H](CBr)CC1CCCCC1)c1cc(Br)cs1 1926747611 AQZIUPDEGBLBHT-LBPRGKRZSA-N 445.242 4.523 50 10 IJGE BrC[C@@H]1CN(Cc2ccc(Br)cc2Br)CCS1 1943858828 KOLDKDSAGISMPN-LLVKDONJSA-N 444.030 4.524 50 10 IJGE C[C@@H]1CO[C@](CBr)(Cc2cccc(Br)c2Br)C1 1943885434 FRIXRYSLOCFPBL-ZANVPECISA-N 426.974 4.944 50 10 IJGE CN[C@H](c1cc(Br)c(C)cc1Br)C1CC(Br)C1 2020154348 SEZKDDQZNHUKCM-RPTIHFLNSA-N 425.990 4.954 50 10 IJGE CC(Nc1nc(-c2cc(C)n(Cc3ccccc3Cl)c2C)cs1)=C(C#N)C(N)=O 2040482153 JEGLZOWSFDTUEU-UHFFFAOYSA-N 425.945 4.625 50 10 IJGE O=C(CBr)c1cc(OC(F)(F)F)c(Br)c(C(F)(F)F)c1 2054795894 JCDWPSGHTZSTKQ-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE CC(C)[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](CC(F)(F)F)C1 2055946994 CWYOJNLLQUEIIH-KGLIPLIRSA-N 431.337 4.527 50 10 IJGE CC(C)[C@@H](Br)c1cn(-c2ccc(I)cc2Cl)nn1 2057428471 BRUSKNFUDZZHGD-GFCCVEGCSA-N 440.510 4.617 50 10 IJGE FC(F)c1ccc(I)c(CCl)c1I 2060240939 UEDXFJXQTXAFLD-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CNC(=O)C(C#N)=Cc1ccccc1)c1cccc(Cl)c1 2077535902 KHGOINZXNYQTPW-FQEVSTJZSA-N 425.916 4.629 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@@H](CCl)C(F)(F)C1 2090181430 FAJVYJKSKVALBQ-LURJTMIESA-N 437.531 4.609 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2C[C@H]1CCN(Cc2ccccc2)C1 2096812098 CXNQSZRVIPGKEK-INIZCTEOSA-N 433.781 4.763 50 10 IJGE CC1(CNC(=O)OC(C)(C)C)CCN(C[C@@H](CBr)c2ccccc2)CC1 2106784174 GRWWVYMQNUNXJS-GOSISDBHSA-N 425.411 4.792 50 10 IJGE CCN(C(=O)[C@@H](Br)C1CCCC1)C1CCC(NC(=O)OC(C)(C)C)CC1 2110716596 ZGRHQQFWNLFAEE-JCYILVPMSA-N 431.415 4.625 50 10 IJGE COc1ccc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)[C@@H](C)C1CC1 2123271890 UYCYGEXZSYEHJR-HNNXBMFYSA-N 438.387 4.580 50 10 IJGE O=C(c1ccc(Cl)cc1Br)N1CCC([C@@H](F)CBr)CC1 2163246438 QDMFTUNPDJCPKR-ZDUSSCGKSA-N 427.539 4.688 50 10 IJGE CC(C)N(CC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)[C@H](Br)C1CCCC1 2167032043 LFPCRTJBDCRKQS-GOSISDBHSA-N 445.442 4.824 50 10 IJGE O=C(c1ccc(Br)cc1Cl)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Br)C2 2190679446 QKLDQWMMZMZPIF-JAAHAHCPSA-N 425.523 4.581 50 10 IJGE Cc1cc(Br)c([C@@H](Br)C2CCS(=O)(=O)CC2)c(C)c1Cl 2232510642 NHLHBLFUAZOOFN-ZDUSSCGKSA-N 444.616 4.980 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)Cc1cscc1S(C)(=O)=O 2250805205 XUJZCXKXQIUYHS-QGZVFWFLSA-N 430.433 4.573 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CC(F)(F)CN1CC1(CBr)CCCCC1 2264250709 NRJSAUQKOQIHOV-AWEZNQCLSA-N 425.358 4.566 50 10 IJGE CC(C)(C)OC(=O)NCCCCCCCCCC(=O)NC[C@H]1C[C@H](Br)C1 2269418486 LOSCUGGNXLWLCH-QAQDUYKDSA-N 433.431 4.922 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CCCCCCCBr)C[C@@H]1C(F)(F)F 2277448908 NJWUKGDKVQTNLB-CABCVRRESA-N 445.364 4.967 50 10 IJGE CN(C(=O)c1cccc(Cl)c1Br)[C@H](CCBr)C(F)(F)F 2283141542 XMRHBRYXZOYGTA-SECBINFHSA-N 437.481 4.890 50 10 IJGE N#CC(=CNc1ccccc1C(N)=O)c1nc(-c2ccc(Br)cc2)cs1 2295948632 ZKUWXUCOYBFLIX-UHFFFAOYSA-N 425.311 4.648 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1Br 2297551624 UZXDLVBBZFPQAB-UHFFFAOYSA-N 436.649 4.565 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Cl)cc2I)C[C@H]1Br 2302325124 DMRCMPIIVIZKGE-BXKDBHETSA-N 428.539 4.550 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)CN(C)c1ccc(I)cn1 2318075166 FJSZNDQTPPOPRE-CYBMUJFWSA-N 425.152 4.568 50 10 IJGE CC(C)[C@H]1[C@@H](Br)CCN1Cc1cc(I)ccc1Cl 2327407707 UQUIJPZTDUZAHE-JSGCOSHPSA-N 442.566 4.938 50 10 IJGE CC(C)C[C@H](CBr)CN(CCCNC(=O)OC(C)(C)C)CC(F)(F)F 2328528039 NLZAHNWZICOIDG-CQSZACIVSA-N 433.353 4.823 50 10 IJGE N#CC(=C(O)CCN1C(=O)c2ccccc2C1=O)c1nc(-c2c[nH]c3ccccc23)cs1 2331346898 LWTZNWZRHNXJPR-UHFFFAOYSA-N 440.484 4.770 50 10 IJGE Cc1c(Cl)cc(CN(CCBr)C2CCOCC2)cc1Br 2381971263 KIYDEWFQFSCNBE-UHFFFAOYSA-N 425.592 4.787 50 10 IJGE CC[C@H](C)c1ccc(OCC(=O)NNC(=O)c2ccc(OCCc3ccccc3)cc2)cc1 14041619 IKZLFWIOKFYDRO-FQEVSTJZSA-N 446.547 4.662 50 10 IJGE CCOc1cc(/C=C(/C#N)S(=O)(=O)c2ccccc2)ccc1OC(=O)c1cccc(C)c1 33470809 NYFJWHHEVBLWLD-JCMHNJIXSA-N 447.512 4.951 50 10 IJGE O=C(COc1ccc(-c2ccccc2)cc1Br)N/N=C/c1cccc(F)c1 40902825 AAZFLFBZOKAUEQ-ZMOGYAJESA-N 427.273 4.784 50 10 IJGE O=C(CC[C@@H](O)c1ccccc1)N/N=C\c1cn(Cc2ccc(F)cc2)c2ccccc12 58888499 AUJNVJCPJQGHAR-NNVPUZBJSA-N 429.495 4.793 50 10 IJGE CCOC(=O)c1sc(N/C=C(/C#N)c2nc3ccccc3o2)c(C(=O)OCC)c1C 106015810 CXBHCRVSWZCWOU-QBFSEMIESA-N 425.466 4.528 50 10 IJGE CC1(C)C[C@H](N=C=O)C[C@](C)(CNC(=O)NC[C@@]2(c3ccc(F)cc3F)CC2(C)C)C1 170290749 KVOAOFVALQDWEF-YRUKQIKQSA-N 433.543 4.853 50 10 IJGE CN(CCCCCBr)Cc1cc(Cl)ccc1I 405323346 ATCALKNQQDIGLH-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE C=CCc1cc(C=NNC(=O)Nc2ccc(Br)c(C)c2)cc(OCC)c1O 1084608493 MYGULKQLDPLZSQ-UHFFFAOYSA-N 432.318 4.746 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 1087457735 UNBOXUFZONZSJQ-NWDGAFQWSA-N 433.308 4.879 50 10 IJGE CN(C(=O)OC(C)(C)C)c1ccc(CNC(=O)[C@H](Br)C2CCCC2)cc1 1183404813 KIQFLISSNKNKAJ-QGZVFWFLSA-N 425.367 4.628 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1 1270896420 CZCLWFMADLAXPT-ZKQHCESOSA-N 427.715 4.665 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2ccc3nc(O)n(C)c3c2)c(C)n1-c1cccc(Cl)c1 1296832656 SHMULCDVXMPOEC-LICLKQGHSA-N 445.910 4.886 50 10 IJGE C=C(C)C[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(=O)OCC 1625184369 POEGJYCTJGDKFU-QUYTYNJFSA-N 439.943 4.669 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNc2ccc(C#N)cc2C(F)(F)F)s1 1633735283 YUCFZIVKVARJES-UHFFFAOYSA-N 446.907 4.872 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2cc(C)ccc2C)cc1 1865693991 NUKXUTNTHDRBPK-DEOSSOPVSA-N 428.536 4.864 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc3ccccc23)[C@H]1c1cccnc1 1865700061 JVYVXUJQUIBFGT-SFHVURJKSA-N 433.393 4.657 50 10 IJGE Cc1ccc(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2c[nH]c3ccccc23)cc1 1865700435 SSVHTXIVUFEQGG-LJQANCHMSA-N 449.436 4.958 50 10 IJGE COc1cc(/C=C(\C#N)c2ccccc2[N+](=O)[O-])ccc1OCC(=O)Nc1ccccc1 1872729653 XDPDTSVVNKMSOQ-QGOAFFKASA-N 429.432 4.685 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C/c3cc(OC)c(OC)c(OC)c3)n2)c(OC)c1 1872793483 CBQVIMVJABQOBY-OVCLIPMQSA-N 438.505 4.917 50 10 IJGE C[C@@H]1OCCO[C@H]1[C@@H](Br)c1sc(Br)cc1Br 1922880499 DRHRSWFAVPOAPQ-LQQYEPNUSA-N 434.975 4.513 50 10 IJGE ClC[C@@H](Nc1ncc(I)cc1Br)c1ccsc1 2015763024 STDBJYRYCNPAKC-SNVBAGLBSA-N 443.535 4.902 50 10 IJGE Cl[C@H](c1cc(I)cc2c1OCC2)[C@H]1C[C@H](Br)C1 2020157732 QFOXKCORBJSSKS-AUTRQRHGSA-N 427.507 4.680 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@H]2C[C@H]2C2CCC2)CC1 2022600436 ZASOGZGLUKTRAF-CVEARBPZSA-N 449.373 4.644 50 10 IJGE CC1([C@H](CBr)NC(=O)c2c(Br)cccc2Br)CC1 2033130751 UOOLNUHXDQVWMF-JTQLQIEISA-N 439.973 4.505 50 10 IJGE N#CC(=Cc1ccc(-n2cncn2)cc1)c1nc(C(c2ccccc2)c2ccccc2)no1 2040500437 FOVZHVRKPVPYRO-UHFFFAOYSA-N 430.471 4.895 50 10 IJGE C[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CN1CC1(CBr)CCCCCC1 2106787499 ZIIBZOARZZZJIQ-KZNAEPCWSA-N 429.443 4.909 50 10 IJGE CC(C)(C)[C@@H]1C[C@H](CBr)CN(c2ccc(I)cn2)C1 2108720063 PCBXGYVOKCRXKN-VXGBXAGGSA-N 437.163 4.570 50 10 IJGE O=C(NC[C@H]1C[C@@H](Cl)C12CCC2)c1cc(Br)sc1Br 2115598892 IOBFLUPCPMTHIG-VXNVDRBHSA-N 427.589 4.801 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@@H](Br)c2sc(Cl)cc2Br)C1 2137234603 BUFWUUUHJZEVSL-QILRFPOHSA-N 448.629 4.815 50 10 IJGE Fc1cc2nc(CCCl)n([C@]34C[C@@H]3CN(Cc3ccccc3)C4)c2cc1Br 2155866939 YUHHGSAIWRLQHD-VFNWGFHPSA-N 448.767 4.950 50 10 IJGE CC1(C)CO[C@@H](CBr)CN1Cc1ccc(Cl)c(Br)c1F 2167525078 SUYKOXFWGLYLDK-JTQLQIEISA-N 429.555 4.616 50 10 IJGE CC1(CO[C@@](C)(CI)CNC(=O)OC(C)(C)C)CC2(CCC2)C1 2211602305 QQLGWVMVASQZGB-KRWDZBQOSA-N 437.362 4.692 50 10 IJGE CCN[C@H](c1cc(Br)c(Br)cc1F)[C@@H]1C[C@@H]1Br 2213489379 LHNJTMBAEFZNFK-SVERMHFZSA-N 429.953 4.785 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1c(F)ccc(Cl)c1F 2219411363 RWZIUEHMYSFCGE-ZDUSSCGKSA-N 432.692 4.671 50 10 IJGE Fc1cccc([C@@H](CBr)OCCOCCOCCOCc2ccccc2)c1 2236088037 BLSVNYKJTTZZFT-OAQYLSRUSA-N 441.337 4.528 50 10 IJGE Cc1sc(C(=O)N2CC[C@@H](CBr)C(F)(F)C2)c(Br)c1C 2237629852 NVRLSCSGYGBDPY-VIFPVBQESA-N 431.140 4.620 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@H]2[C@@H]3CCCO[C@@H]32)c1 2263514351 AIMRLQXKYUXFEA-XUXIUFHCSA-N 438.985 4.943 50 10 IJGE C[C@H](Br)COCc1cn(-c2ccc(Br)c(Cl)c2Cl)nn1 2295834517 CCYDQOSLUIVRLP-ZETCQYMHSA-N 443.954 4.637 50 10 IJGE CC1(C)[C@@H](Cl)C[C@@H]1NCc1ccc(I)c(Br)c1 2306216933 LIGXDCGTZHIVFP-RYUDHWBXSA-N 428.539 4.549 50 10 IJGE CC(C)[C@@H](CBr)CN1CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2312817339 WMUCXYUNCDUUBN-MELADBBJSA-N 431.337 4.574 50 10 IJGE N#C/C(=C\c1ccc(-c2ccc(S(N)(=O)=O)cc2)o1)c1nc(-c2ccccc2)cs1 33568264 VZNNXOMXALTDNW-SFQUDFHCSA-N 433.514 4.782 50 10 IJGE Cc1ccccc1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cccc(Cl)c1 38651155 GLFQXQFOEGTLRG-XMMPIXPASA-N 446.890 4.851 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc(Cl)c1OC 169917872 XRGFAJBLVPXZII-KSEXSDGBSA-N 446.960 4.888 50 10 IJGE C=CCOc1c(Br)cc(/C=C(/C#N)C(=O)c2ccccc2OC)cc1OC 207539573 WFJXTECQGIRRSQ-GDNBJRDFSA-N 428.282 4.821 50 10 IJGE C[C@@H](Br)CCCNC(=O)c1ccc(Br)cc1Br 227712222 QNPOIVOTBXJFHR-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE CC[C@@](C)(CCBr)NC(=O)c1ccc(Br)cc1Br 228570276 WUWJKGXMUOTWFA-ZDUSSCGKSA-N 441.989 4.895 50 10 IJGE COc1ccc(CC(=O)NN=Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)cc1OC 254497023 GKQGSDYNNQEOFR-UHFFFAOYSA-N 432.398 4.675 50 10 IJGE Br[C@H](CC[C@@H]1CCCO1)c1cc(I)cc2c1OCC2 388617653 DZGBRUXYDROHIO-GXTWGEPZSA-N 437.115 4.621 50 10 IJGE COC[C@H](O[C@H](CI)c1cccc(Br)c1)C(C)C 404151068 RZOQENBHICYNIC-KGLIPLIRSA-N 427.120 4.613 50 10 IJGE Clc1ccc(I)c(C[C@H](CBr)C2CCOCC2)c1 696852923 MMJGKBGKTFNMQI-GFCCVEGCSA-N 443.550 4.925 50 10 IJGE C/C(=C\c1ccc(Br)o1)C(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1 1556338352 JNNMYZAUGHMIBK-BUHFOSPRSA-N 440.297 4.965 50 10 IJGE Cc1cc(Nc2ccc3c(c2)CCCC3)c(C(=O)NC[C@@]2(C)C[C@H]2Br)c(O)n1 1642130281 WEDPSADJCTUCHN-XMSQKQJNSA-N 444.373 4.621 50 10 IJGE O=C(NNc1ccc(OC(F)(F)F)cc1)c1cc2cccc(C(F)(F)F)c2nc1O 1643122852 UUPMDZNZILZPKV-UHFFFAOYSA-N 431.292 4.615 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccc(F)cc2)[C@H]1c1ccc(O)cc1 1865684785 YGPXKRPEDGXJBA-QFIPXVFZSA-N 438.462 4.661 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2F)[C@@H]1c1ccccc1O 1865708384 VTVBXJIZOQIOMR-JOCHJYFZSA-N 438.462 4.661 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C2CCN(C[C@H](CBr)CC3CC3)CC2)C1 1879198035 HVXIRLVUDPOZQW-HKUYNNGSSA-N 429.443 4.767 50 10 IJGE C[C@@H](c1ccc(Br)cc1F)[C@H](CBr)NC(=O)OC(C)(C)C 1885096353 IQFLLDCMYNNODM-ZANVPECISA-N 425.136 4.980 50 10 IJGE O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915265971 SQZIMAYLSZCCSD-SFHVURJKSA-N 439.256 4.689 50 10 IJGE Brc1cc([C@H](Br)[C@@H]2[C@H]3CCOC[C@H]32)sc1Br 1937556820 AKHMXLFZNNIWPR-ZRVLKLQWSA-N 430.987 4.992 50 10 IJGE CC[C@@H](Br)CCNC(=O)c1c(Br)cccc1Br 1945332879 IZHNYZSFUYZCIG-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1cccc(Br)c1C#N 2010826420 BJXYVAVKDPSMJK-UHFFFAOYSA-N 432.409 4.639 50 10 IJGE CCC[C@@H](CCBr)NC(=O)c1c(Br)cccc1Br 2033088031 YSOHEWRCELWOFA-VIFPVBQESA-N 441.989 4.895 50 10 IJGE Clc1ccc(I)c(CN2CC[C@@H](Br)CC23CC3)c1 2050620306 CZLDKKBDRWWZNG-LLVKDONJSA-N 440.550 4.837 50 10 IJGE CC(C)[C@H](Cl)c1cn(-c2ccc(I)c(Br)c2)nn1 2057426680 HTWOCQCZPBWFBL-LBPRGKRZSA-N 440.510 4.570 50 10 IJGE CC[C@H](C[C@@H](C)Cl)NC(=O)c1ccc(Br)cc1I 2086153556 LWMOJSVLACSKGQ-PSASIEDQSA-N 444.538 4.580 50 10 IJGE CSCC[C@H](Cl)CCNC(=O)c1cc(Br)ccc1Br 2090381684 HJMVHQNZPPNPMH-SNVBAGLBSA-N 429.605 4.692 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCCCC2)CC(F)(F)C1 2106784056 FPCUHAOYBWYTFA-UHFFFAOYSA-N 439.385 4.910 50 10 IJGE O=C(c1ccccc1OCc1ccccc1)N1C[C@]2(F)CCC[C@@]2(CBr)C1 2176638590 BUMZYLLFDSGLJQ-FGZHOGPDSA-N 432.333 4.995 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ccccc2)CCN1C[C@@H](CBr)c1ccccc1 2186713865 ZTKJZKVCJARYFS-WOJBJXKFSA-N 441.335 4.914 50 10 IJGE O=C(c1cc(Br)ccc1Cl)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Br)C2 2190678787 NNYURTWKDWDNHZ-YPWHJJHSSA-N 425.523 4.581 50 10 IJGE O=C(c1scc(Br)c1Cl)N1[C@H](CBr)C[C@@H]2CCC[C@H]21 2264505430 YSOIHRJSRJQHKC-OYNCUSHFSA-N 427.589 4.942 50 10 IJGE Cc1ccc2nc(C(C#N)=Cc3ccc(OS(=O)(=O)c4ccc(F)cc4)cc3)[nH]c2c1 2297506280 RKIHYCJEHSOYSJ-UHFFFAOYSA-N 433.464 4.842 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)NN=Cc2ccc(OC(=O)c3cccc(F)c3)cc2)cc1 2297708185 MFDGFFPPIAQNJB-UHFFFAOYSA-N 448.494 4.872 50 10 IJGE CCOC(=O)COc1c(Cl)cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)cc1OCC 2313568612 VEGYRPGTNARLAW-UHFFFAOYSA-N 442.899 4.535 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@@H]1CCCCN1C[C@]1(CBr)CC1(F)F 2326918165 ZHDZDRXNBIGDSZ-SUMWQHHRSA-N 425.358 4.565 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3cccc([N+](=O)[O-])c3)ccc2[C@@H]1c1ccc(Cl)cc1 38651436 UVKAJEPNXXWXDL-NRFANRHFSA-N 447.834 4.686 50 10 IJGE Cc1ccnc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2Cl)CCC3)c1 40812767 LQUUYHVZOQVQIB-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE Cc1c(C(=O)Nc2cccc3ccccc23)oc2c1/C(=N/NC(=O)c1ccncc1)CCC2 40813998 HYQPGSROJBCXMI-XHLNEMQHSA-N 438.487 4.859 50 10 IJGE COc1ccccc1C(=O)N/N=C/c1ccccc1OCc1cccc(Br)c1 96095885 AKFACTXZBAQARU-ZVHZXABRSA-N 439.309 4.801 50 10 IJGE CC1CCC(NC(=O)[C@@H](c2ccc(F)cc2)N(CCc2ccccc2)C(=O)CCl)CC1 97914695 BRYUWUCQLRHIFL-RSMZPQPPSA-N 444.978 4.872 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Cl)c3cc(Br)ccc3F)cc2[nH]1 109883913 RRRKGMIACPKZBT-CYBMUJFWSA-N 434.490 4.849 50 10 IJGE BrCC[C@@H]1CCCN(c2ncc(Br)cc2Br)C1 129137628 URSHGVWNAIMLHA-VIFPVBQESA-N 426.978 4.608 50 10 IJGE CCOc1cccc(-c2nn(-c3ccccc3)cc2/C=C(/C#N)C(=O)NC2CCCC2)c1 210033624 DOXAGLZUGWSAMD-HKWRFOASSA-N 426.520 4.904 50 10 IJGE COc1cc(N/C=C(/C#N)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)c(OC)cc1Cl 217203898 MLWIFTPHSSWOHK-ATPAHOSSSA-N 439.943 4.933 50 10 IJGE ClCCc1nc2cc(Br)ccc2n1Cc1cnn(Cc2ccccc2)c1 390370992 HCAQNCFGPHHRIQ-UHFFFAOYSA-N 429.749 4.873 50 10 IJGE CC[C@H](Br)CCNC(=O)c1scc(Br)c1Br 705517041 XIJSVWCFRXWMDA-LURJTMIESA-N 433.991 4.567 50 10 IJGE C/C(=C\c1ccc(Br)o1)C(=O)NNc1c(F)cc(F)cc1Br 1126540594 ZBQQYMGHXYSZFP-QPJJXVBHSA-N 436.050 4.629 50 10 IJGE Cc1cc(/C=C(\C#N)c2nnc(-c3cccc4cccnc34)o2)c(C)n1C[C@@H]1CCCO1 1345866150 BGUFHXCWSKKYKX-OABJIQBASA-N 425.492 4.946 50 10 IJGE Cc1cccc(OCC(=O)Nc2cc(C(=O)Nc3ccc(SC#N)cc3)ccn2)c1C 1860510499 BYAAWSZGZLSDHF-UHFFFAOYSA-N 432.505 4.541 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc3ccccc23)[C@@H]1c1cccc(O)c1 1865681161 GNEFOQUOOZMTTC-LJQANCHMSA-N 448.404 4.968 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Cl)Cc1cc(Cl)cc(Br)c1F 1887413842 BTQJHHWYFGZQQM-NSHDSACASA-N 431.088 4.688 50 10 IJGE O=C(c1c(Cl)cc(Br)c(F)c1Br)[C@@H]1C[C@H]1Br 1900377024 RDNWSSYTKVZBIF-QWWZWVQMSA-N 435.312 4.970 50 10 IJGE O=C(c1coc(Br)c1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915313734 PCZVKERZVDFHLQ-HNNXBMFYSA-N 427.136 4.858 50 10 IJGE O=C(N[C@H](CCCl)C(F)(F)F)c1scc(Br)c1Br 1918524849 ICXOHIUAOGVGQC-RXMQYKEDSA-N 429.483 4.563 50 10 IJGE CCC[C@@](C)(CBr)NC(=O)c1cc(Br)sc1Br 1942784615 DUQDOMWJJDASLH-NSHDSACASA-N 448.018 4.957 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@H](CBr)C2CCC2)CC[C@@H]1C(F)(F)F 1966375850 YVOBXVUMXPSYFC-SOUVJXGZSA-N 443.348 4.575 50 10 IJGE FC1(F)CC(CO[C@@H](CI)c2cccc(Br)c2)C1 2035120138 KDGCZQXCIVDOER-LBPRGKRZSA-N 431.058 4.987 50 10 IJGE C[C@@H](CCBr)CCN1CCC[C@H](N(CC(F)F)C(=O)OC(C)(C)C)C1 2044698707 DTVJQJQSLPGATF-GJZGRUSLSA-N 427.374 4.764 50 10 IJGE COc1cc(F)c([C@@H](Br)c2cc(I)sn2)c(F)c1 2056487277 JJPJFYRBZUELHQ-NSHDSACASA-N 446.054 4.519 50 10 IJGE CCOc1ccccc1-n1nc(CBr)c(Br)c1C(F)(F)F 2079239386 MXPVSXNAKHUFRN-UHFFFAOYSA-N 428.046 4.947 50 10 IJGE Br[C@@H]1CC[C@@H]2CCCN(Cc3ccc(I)cc3)[C@H]2C1 2110680849 XACHFHSISIPHHY-LZWOXQAQSA-N 434.159 4.819 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CCCN(Cc2ccccc2)CC(F)(F)C1 2152787641 AHGKFQLDQKSRQU-UHFFFAOYSA-N 437.328 4.565 50 10 IJGE FC(F)OCCn1c(CCCl)nc2cc(Br)c(Br)cc21 2234070061 SYXPKKCKEAFWBM-UHFFFAOYSA-N 432.490 4.582 50 10 IJGE COc1ccc(CBr)c(N(C)[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)n1 2239881416 CVUMIAPOELUUPC-ACDBMABISA-N 430.390 4.617 50 10 IJGE C=CC[C@@]1(CBr)CCCN(C[C@@H]2CC2(Br)Br)C1 2250410374 WSSUSXKYVZZMIH-RYUDHWBXSA-N 430.022 4.546 50 10 IJGE COc1ccc([C@H](Br)[C@@]2(C)CCCCO2)cc1I 2257364852 MBRBOBUCGHDPBH-UONOGXRCSA-N 425.104 4.695 50 10 IJGE CCn1nc(C)c(CBr)c1N1CCC[C@@H]1[C@@H]1CCN(Cc2ccccc2)C1 2281304826 BFXXYNGWRTULNL-TZIWHRDSSA-N 431.422 4.597 50 10 IJGE O=C(c1ccc(Cl)c(I)c1)N1CCCC[C@H]1CCCCl 2283652109 PXIRDWFQMMLEFU-LBPRGKRZSA-N 426.125 4.958 50 10 IJGE CC1(C)C[C@H](Cl)CCN(C(=O)c2ccc(Cl)c(I)c2)C1 2283671739 ZVASQRHEYDDBDA-LLVKDONJSA-N 426.125 4.814 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)C=Cc3cccs3)cc2)cc1 2296814979 VPQULKBGUJQUDD-UHFFFAOYSA-N 447.560 4.772 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@@H]2C[C@H]3CC[C@H](C3)C2)C1 2299587478 RFFHPKYENXLARC-PASDCYSWSA-N 449.373 4.786 50 10 IJGE CCOC1=NC(=C(C#N)N=Nc2ccc(OC)cc2)NC(=N)[C@H]1N=Nc1ccc(OC)cc1 2313585842 OZMQFSNQCOMIOT-LJQANCHMSA-N 446.471 4.648 50 10 IJGE CCN(CC)c1ccc(C=C2C(=O)N(Cc3ccccc3Cl)C(=O)C(C#N)=C2C)cc1 2314619837 GDEQCTQJHJXDKZ-UHFFFAOYSA-N 433.939 4.979 50 10 IJGE C[C@H](c1ccncc1)[C@@H](Br)c1c(Br)c(Br)nn1C 2316837514 IFNMLWUHUZHLKY-VXNVDRBHSA-N 437.961 4.580 50 10 IJGE C[C@@]1(CCCl)CCN(Cc2ccc(I)c(Br)c2)C1 2325209942 TVRVPHDNRXLJPD-CQSZACIVSA-N 442.566 4.895 50 10 IJGE C[C@@H]1CC[C@H](CCl)N(Cc2ccc(I)c(Br)c2)C1 2325226319 NHOUTCWKVCWZPN-ZYHUDNBSSA-N 442.566 4.893 50 10 IJGE COc1ccc(OCc2cccc(I)c2)c(CBr)c1 2341783723 UQBNCTKIWHPQLG-UHFFFAOYSA-N 433.083 4.774 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H]2CC[C@@H]1C[C@H]2CBr 2359508135 XHTZBSHMCJZART-DAROEXNTSA-N 425.523 4.630 50 10 IJGE CCCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2Br)cc1 33378335 BSEURSLCBMLTHM-UVTDQMKNSA-N 430.258 4.692 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)OCC(=O)NC2CCCCCCC2)c(C)n1CCC(C)C 96021667 RRQHJWMGDGMLOP-JCMHNJIXSA-N 427.589 4.830 50 10 IJGE CC1=C(C#N)C(=O)N([C@@H](C)c2ccccc2)C(=O)/C1=C/Nc1ccc([N+](=O)[O-])cc1Cl 101234880 QUNNLHFPRGXGTO-QCUKBLKESA-N 436.855 4.514 50 10 IJGE C[C@@H](Br)c1ccccc1NC(=O)c1ccc(I)cc1 125398951 XHGXZBCFZKBERA-SNVBAGLBSA-N 430.083 4.999 50 10 IJGE COc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(C)cc2)cc1 205640494 NFBLGNZWRPZJSE-XHASNHEZSA-N 438.483 4.841 50 10 IJGE CC[C@H](NC(=O)/C(C#N)=C\N1CCN(c2ccccc2F)CC1)c1ccc2c(c1)CCCC2 217192695 COMZEHRVBMDZEH-VQZNFWSPSA-N 446.570 4.501 50 10 IJGE CCOc1ccc(N/C=C(/C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1OCC 217234304 YHXGSBZGHBUVAE-SEYXRHQNSA-N 430.848 4.504 50 10 IJGE CC[C@](C)(CBr)NC(=O)c1cc(Br)cc(Br)c1 234115421 WOPPYJWTWHRAFZ-GFCCVEGCSA-N 427.962 4.505 50 10 IJGE C[C@H](CCCBr)CNC(=O)c1cc(Br)c(Br)s1 384667612 CJULFCFRDDGOQX-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE ClCc1nc2cc(Br)ccc2n1C[C@@H]1CN(Cc2ccccc2)CCCO1 390597209 IXYHXWJJHBDTLP-SFHVURJKSA-N 448.792 4.829 50 10 IJGE FC(F)(F)c1cc(CBr)c(I)cc1Br 575692520 VVTBDPWVPHTWOW-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE CC(C)(C)OC(=O)NCCN1CCN[C@H](c2cccc(CO[Si](C)(C)C(C)(C)C)c2)C1 616633561 CGKAICWEQNGACG-NRFANRHFSA-N 449.712 4.679 50 10 IJGE CCOc1ccc(C(=O)NNc2ccc(Br)cc2C(F)(F)F)cc1[N+](=O)[O-] 731479069 TZWRPTURHGTABN-UHFFFAOYSA-N 448.195 4.532 50 10 IJGE O=C(NNc1c(F)cc(F)cc1Br)c1cc2c(Br)cccc2[nH]1 742108202 JXHBNELFQSCFNP-UHFFFAOYSA-N 445.061 4.728 50 10 IJGE Cc1ccc2c(c1)N(C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1)CC2 746818159 AJFNUAJTLCAGJQ-XSFVSMFZSA-N 441.922 4.922 50 10 IJGE Cc1cc(C(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])ccc1NC(=O)c1cccs1 758463324 UTIKMGTYVMOILO-UHFFFAOYSA-N 430.873 4.627 50 10 IJGE CSc1ccccc1[C@@H](C)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 800578955 FYLBNGQDIUPSBP-CTBJKRMSSA-N 441.560 4.970 50 10 IJGE O=C(Nc1ccc(S(F)(F)(F)(F)F)cc1)C(=O)N1CCOc2cccc(F)c2C1 802600080 GJKBYEXVULTFRH-UHFFFAOYSA-N 440.365 4.843 50 10 IJGE C=CCC[C@H](C(=O)NNC(=S)Nc1cc(OCC)ccc1OCC)c1ccccc1 1303280663 JCEOOUIXBXSCGG-IBGZPJMESA-N 427.570 4.552 50 10 IJGE C=C(C)C[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc3ccccc23)c1C)C(=O)OC 1535097233 AESMHMVKRNQWGP-FCKOQQNDSA-N 441.531 4.778 50 10 IJGE C[C@H](SCc1nc(O)c2ccccc2n1)C(=O)NNc1ccccc1Oc1ccccc1 1557374419 DYVYNOZCEASGKR-INIZCTEOSA-N 446.532 4.893 50 10 IJGE Cc1cc(C)cc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2O)CCC3)c1 1772751495 DLTWYFWINPCNCQ-UHFFFAOYSA-N 431.492 4.633 50 10 IJGE CCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)CC(C)(C)CI 1904652764 FKBIZPFRIITQPW-OAHLLOKOSA-N 438.394 4.559 50 10 IJGE Clc1cccc(C(CBr)(CBr)CC[C@H]2COCCO2)c1 1916656937 GMFKFHKQQZYPBH-AWEZNQCLSA-N 426.576 4.563 50 10 IJGE Brc1cnccc1C[C@H](Br)c1ncsc1Br 1924070509 KYOAOHBJGZMXMC-ZETCQYMHSA-N 426.959 4.742 50 10 IJGE C[C@@H](CCCBr)NC(=O)c1cccc(Br)c1Br 1943885948 HSFFKXANNZOEFL-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE CC1([C@@H](CBr)NCc2c(Br)cccc2Br)CC1 1945370267 ZBQYPRNBYTYQBB-GFCCVEGCSA-N 425.990 4.865 50 10 IJGE C[C@H](NCCSSCCNC(=O)OC(C)(C)C)c1ccc(Br)o1 1985350236 NGFMSCZHSPGBNU-NSHDSACASA-N 425.414 4.599 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC[C@@H]2CC23CCCC3)C1 2021267939 SSBNDZIEGMSZMA-KXBFYZLASA-N 449.373 4.788 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1C(=O)c1c(Br)cccc1Br 2033089867 YKNNHRIVHXLXDX-DTWKUNHWSA-N 439.973 4.600 50 10 IJGE O=C(NC1CCC(Br)CC1)c1c(Br)cccc1Br 2033093631 JWJWURFFALCVIM-UHFFFAOYSA-N 439.973 4.648 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CC[C@H](Br)C(F)(F)CC1 2038684267 OZZKXYDDYCQNDC-INIZCTEOSA-N 430.314 4.962 50 10 IJGE CN(Cc1ccc(Br)c(F)c1F)C1(CBr)CCSCC1 2171186169 QXZDFZQHAVCUGV-UHFFFAOYSA-N 429.168 4.820 50 10 IJGE COc1cc(F)c(F)cc1[C@H](Br)c1nn(C)c(Cl)c1Br 2204485885 DZJXPZQMMZEZTF-VIFPVBQESA-N 430.474 4.607 50 10 IJGE Clc1c(Br)cccc1C[C@]12CO[C@](CI)(C1)C2 2216262591 RFQPJQDSBPBHAL-BETUJISGSA-N 427.507 4.629 50 10 IJGE Cc1nc(C(=O)N(CCC(C)(C)C)C[C@H](C)Br)c(Br)s1 2288072736 BZUPATPEBHRPLT-VIFPVBQESA-N 426.218 4.876 50 10 IJGE COc1cccc(C=C(C#N)C(=O)Nc2ccc3c(c2)OCO3)c1OCc1ccccc1 2295631747 VYLSETLQHQOXCL-UHFFFAOYSA-N 428.444 4.549 50 10 IJGE C[C@@H](Cl)[C@H]1CCN(Cc2ccc(I)c(Br)c2)C1 2306221849 MQZYPVMYADIOQN-KOLCDFICSA-N 428.539 4.503 50 10 IJGE BrC[C@H]1[C@@H]2CC[C@@H](C2)N1Cc1cccc(Br)c1Br 2310098625 BWBSJFBMEZZJTR-CDMKHQONSA-N 438.001 4.959 50 10 IJGE CN(C)C(=O)C(C#N)=Cc1cc(Cl)c(OCc2ccc(F)cc2)c(Br)c1 2313567154 HNLGEFQSBSCDCW-UHFFFAOYSA-N 437.696 4.816 50 10 IJGE CC(C)[C@H]1C[C@H](Br)CN1Cc1cc(I)ccc1Cl 2327398787 IRVJLRPHGPNTDT-SMDDNHRTSA-N 442.566 4.938 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)C(C#N)=Cc1cccc(Br)c1 2329696569 SOBRCPCLRFWVGX-UHFFFAOYSA-N 427.298 4.952 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)[C@]1(C(=O)O)CCC(C)(C)C[C@H]1OCc1ccccc1 2379102705 QPUWQBALYRUTLC-JPAWQOSXSA-N 438.406 4.711 50 10 IJGE O=C(Nc1ccc(N2CCN(C(=O)C3CCCCC3)CC2)cc1)[C@H](Cl)c1ccccc1 35744600 UJSGOWHEXOETSP-HSZRJFAPSA-N 439.987 4.834 50 10 IJGE COc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCc3cccc(F)c3)c(OC)c2)cc1 59281573 DFWWHMWBBJOWQJ-XDHOZWIPSA-N 432.451 4.968 50 10 IJGE O=S(=O)(Nc1cccc(CCl)c1)c1cc(Br)ccc1Br 96873081 RMNWWRVSETVVII-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)ccc1OCCOc1ccc(C)cc1 101379364 GPVLCVPQJHGXLG-KQWNVCNZSA-N 442.515 4.685 50 10 IJGE Cc1ccc(C(=O)NN=Cc2ccc(OS(=O)(=O)c3ccc4ccccc4c3)cc2)cc1 254379675 HSSHCCMNVXHIKS-UHFFFAOYSA-N 444.512 4.680 50 10 IJGE CCc1ccc(C=NNC(=O)CSc2nnc(SCc3ccccc3)s2)cc1 254525941 JHJXDEPKSYHHGZ-UHFFFAOYSA-N 428.608 4.635 50 10 IJGE Cn1ncc([C@H](Br)Cc2ccc3ccccc3c2)c1I 379228033 XTUQGSQZHAMFKH-OAHLLOKOSA-N 441.110 4.857 50 10 IJGE CCCOCCOc1c(Br)cc(Br)cc1CBr 383463800 NENJKBQVNWBIQI-UHFFFAOYSA-N 430.962 4.912 50 10 IJGE Cc1cccc(C(=O)N(CCCBr)C(C)(C)C)c1I 691004299 TXLVOLYUIDVRNX-UHFFFAOYSA-N 438.147 4.625 50 10 IJGE CC(C)[C@H]1CN(c2nc3ccccn3c2CBr)CCN1Cc1ccccc1 704736219 GABJUZOYAJHYDP-HXUWFJFHSA-N 427.390 4.576 50 10 IJGE CC[C@H](C[C@H](C)Br)NC(=O)c1scc(Br)c1Br 716903963 AAXZGNYPFSYGOQ-NKWVEPMBSA-N 448.018 4.955 50 10 IJGE O=C(NNc1ccc(Cl)cc1Cl)C(=O)Nc1nc2c3c(ccc2s1)CCCC3 733782373 TYPWWIAMATUSBQ-UHFFFAOYSA-N 435.336 4.564 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)c(C)n1 755638336 DLMQLIPPXHXOSG-LDADJPATSA-N 430.899 4.675 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2ccc(OCc3cccc(C)c3)cc2)cc1 1084348437 FEKFWOVNDGAJRF-AREMUKBSSA-N 446.547 4.937 50 10 IJGE CC(=O)CCc1ccc(O[C@@H](C)C(=O)NNc2ccc(Cl)c(C(F)(F)F)c2)cc1 1639947795 FBCCLAYSDIUDGI-ZDUSSCGKSA-N 428.838 4.791 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)CCc1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 1679305468 NCQIGGPKPHOUMS-FQEVSTJZSA-N 449.473 4.685 50 10 IJGE COc1cccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccc(C)c2)CCC3)c1 1772744386 CPBJNHJLMULJMQ-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1ccccc1Cl 1865690904 DTOXCBQNKOCXGV-JOCHJYFZSA-N 446.938 4.930 50 10 IJGE CCCc1nn(-c2ccc(C)cc2)c2c1[C@@H](c1ccc(OCC)c(OC)c1)C(C#N)=C(N)O2 1865695215 MXTNPKUHZOXOQE-QHCPKHFHSA-N 444.535 4.759 50 10 IJGE CCC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1882088525 RXMCAANCDIWADN-OWCLPIDISA-N 449.430 4.948 50 10 IJGE Brc1cccnc1C[C@@H](Br)c1csnc1Br 1925225725 LFEBRXRDXPCQEC-MRVPVSSYSA-N 426.959 4.742 50 10 IJGE CCC(CC)(CBr)CN1CCC(CNC(=O)OCc2ccccc2)CC1 1977961521 HIEKDUMUIQOEGN-UHFFFAOYSA-N 425.411 4.826 50 10 IJGE C[C@@H]1[C@@H](CBr)CCN1Cc1cc(Br)ccc1Br 2006507400 HUHGXKXWIABWAI-NXEZZACHSA-N 425.990 4.817 50 10 IJGE CCC[C@H](CBr)CN1CCC[C@@H](N(CC(F)F)C(=O)OC(C)(C)C)C1 2044699110 HYUNENMNPYNHKQ-HUUCEWRRSA-N 427.374 4.764 50 10 IJGE CCCN1CC[C@H]([C@@H](Br)c2ccc(OCc3ccccc3)cc2)S1(=O)=O 2089516363 WQSZKZDIZAVCEQ-UXHICEINSA-N 438.387 4.516 50 10 IJGE O=C(c1csc(Br)c1Br)N1[C@H](CCl)C[C@@H]2CCC[C@@H]21 2108399811 QYQGDXYXVCNLTI-NRPADANISA-N 427.589 4.895 50 10 IJGE COc1cc(CBr)ccc1S(=O)(=O)N(Cc1ccccc1)CC1CCC1 2123269149 HNGMAPROLVNDTO-UHFFFAOYSA-N 438.387 4.581 50 10 IJGE CO[C@]1(C(F)(F)F)C[C@H](C(=O)N(Cc2ccccc2)C2(CBr)CCC2)C1 2125555399 GBQISURUZPIBIC-RHNCMZPLSA-N 434.296 4.690 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(NC(=O)c3ccc(CBr)cc3)CCC[C@H]12 2162588704 IYSMJZXKHJLYMQ-LAUBAEHRSA-N 437.378 4.634 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@@H]([C@@H](C)Br)C(F)(F)F)cc1Cl 2195319734 CNZGQFARXQLKRN-LDWIPMOCSA-N 437.481 4.855 50 10 IJGE Cc1cc(Br)c(CCl)c(N2CC[C@H]3COC[C@@H](C2)N3Cc2ccccc2)c1 2204526811 OZIOUCHYUJDHEB-RBUKOAKNSA-N 449.820 4.976 50 10 IJGE O=S(=O)(Cc1cccc(Br)c1)N(Cc1ccccc1)[C@H](CCl)C1CC1 2218987476 LQXREENPMWABIN-LJQANCHMSA-N 442.806 4.799 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2CCC[C@H](C1)[C@]21CC[C@](C)(CI)O1 2249370459 VCNYSHGQBLHFEA-UJYOZEIHSA-N 449.373 4.833 50 10 IJGE Cc1ccc(C(=O)N(C[C@@H](C)Br)C(C)(C)C)cc1I 2272451839 KYJXLXYSOWSKPE-LLVKDONJSA-N 438.147 4.624 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2COc3ccccc32)cc1I 2285000179 SIQDDUQGJSRFIV-WBMJQRKESA-N 445.094 4.912 50 10 IJGE CC(C)CN(C[C@@H](C)Br)S(=O)(=O)c1ccc(Cl)c(Br)c1 2288061550 SHLGVQMGBDIXRO-SNVBAGLBSA-N 447.620 4.533 50 10 IJGE COC(=O)c1c(NC(=O)c2cc(=O)c3cc(C)c(C)cc3o2)sc(C(C)=CC#N)c1C 2296857828 YQTFNTHFXHWHHD-UHFFFAOYSA-N 436.489 4.746 50 10 IJGE C[C@H](CNCc1ccc(I)c(Br)c1)C[C@@H](C)Cl 2306219780 PZVIWGDNIWSFBA-VHSXEESVSA-N 430.555 4.797 50 10 IJGE Clc1ccc(I)c(CN2[C@H]3CC[C@@H]2C[C@H]3CBr)c1 2308522959 RGBDXNHZQHLZEL-BHYNMZESSA-N 440.550 4.692 50 10 IJGE CC(C)n1c(CBr)nnc1-c1ccc(Cl)cc1I 2317770642 JCSDFVPTWYTXOO-UHFFFAOYSA-N 440.510 4.679 50 10 IJGE ClCc1cccnc1OCc1cc(I)ccc1Br 2318982954 RUSCQZJFWILMIL-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE CCCOc1ccc(C=CC(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3)nc2C)cc1 2321060348 YKYUJQOIYVRIEN-UHFFFAOYSA-N 449.938 4.974 50 10 IJGE COc1cc(CBr)cc(N(C)[C@@H]2C[C@@H]3C[C@@H](OCc4ccccc4)C[C@@H]32)n1 2364761522 IGTIUADAMJVDFB-ZGXWSNOMSA-N 431.374 4.805 50 10 IJGE O=C(Cc1cccc2ccccc12)N[C@@H](CCBr)COCc1ccccc1 2369431368 QDMWJLVMUIWDME-NRFANRHFSA-N 426.354 4.869 50 10 IJGE Cc1scc(C(=O)N2CC[C@](CBr)(C(F)(F)F)C2)c1Br 2369602667 DVSVAKMVPFYLHF-LLVKDONJSA-N 435.103 4.609 50 10 IJGE COc1ccc(/C(C#N)=C\c2ccc(OC(=O)c3cccc([N+](=O)[O-])c3)c(OC)c2)cc1 31902322 FMMSKGACTRHLSS-UNOMPAQXSA-N 430.416 4.895 50 10 IJGE O=C(O)c1ccc(COc2ccccc2/C=N/NC(=O)C23CC4CC(CC(C4)C2)C3)cc1 59146448 URYVHUPTYJXWBA-JFLMPSFJSA-N 432.520 4.630 50 10 IJGE CC1=C(C#N)C(=O)N(C2CCCC2)C(=O)/C1=C/c1ccc(OCc2ccc(F)cc2)cc1 101338786 QFHVANHHEJNQEB-OEAKJJBVSA-N 430.479 4.940 50 10 IJGE CC[C@H](NC(=O)/C(C#N)=C\N1CCN(c2ccc(F)cc2)CC1)c1ccc2c(c1)CCCC2 217189786 BPGNWBAIFCEDEF-WHSZPFTHSA-N 446.570 4.501 50 10 IJGE CCOc1ccc(C=NNC(=O)c2sc3nc(C)cc(COC)c3c2-n2cccc2)cc1 254385126 SALWNCNKGOKVKQ-UHFFFAOYSA-N 448.548 4.704 50 10 IJGE C/C(C=NNC(=O)c1ccn(Cc2ccc([N+](=O)[O-])cc2)n1)=C\c1ccc(C(C)C)cc1 254409244 WQHJGMTXJRPERK-PKTFGXERSA-N 431.496 4.782 50 10 IJGE C[C@]1(CBr)CCCN1C(=O)c1cc(Br)cc(Br)c1 723026691 MXFXRGRQPLDJAD-CYBMUJFWSA-N 439.973 4.601 50 10 IJGE CCCn1c(C)cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N[C@H](C)c2cc3ccccc3o2)c1C 855635136 BWTXOSHWYVTJEP-AXFABFRBSA-N 447.535 4.977 50 10 IJGE C#C[C@H](NC(=O)NNc1ccc(Br)cc1C(F)(F)F)c1ccc(F)cc1 1636548174 MSBASSBUCLHVQP-AWEZNQCLSA-N 430.199 4.608 50 10 IJGE CCN(CC)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2cc(C)ccc2C)cc1 1865701826 GKVIJRMXJFXYMI-RUZDIDTESA-N 441.579 4.921 50 10 IJGE Cc1ccc(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2cccc(F)c2)cc1 1865710649 DHALSUKXXVEWJZ-QGZVFWFLSA-N 428.389 4.616 50 10 IJGE CCc1nn(-c2ccc(Br)cc2)c2c1[C@H](c1cccc(F)c1)C(C#N)=C(N)O2 1865711440 YPRYNLBJNAWVFE-GOSISDBHSA-N 439.288 4.554 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)c1cc2ccccc2[nH]1 1865759333 VAWCSSRJNXBLLZ-UHFFFAOYSA-N 439.302 4.920 50 10 IJGE CCN(C[C@](C)(CBr)O[C@@H]1COC2(CCCCC2)C1)C(=O)OC(C)(C)C 1879029293 KAPMDGJAKNWSSH-LPHOPBHVSA-N 434.415 4.905 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1880757525 YPWMAWCHGXYQFG-SOUVJXGZSA-N 435.403 4.606 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CC[C@]12CCCN(C(=O)OC(C)(C)C)C2 1882689741 FIIMAYPOMNZIEW-MDOVXXIYSA-N 447.414 4.702 50 10 IJGE CC(C)(C)OC(=O)N[C@@]12CCC[C@@]1(F)CN(CC1(CBr)CCCCC1)C2 1893716216 HGTIQYWWDJDLFB-WOJBJXKFSA-N 433.406 4.803 50 10 IJGE C[C@@]1([C@H](Br)c2cc(Br)c(Br)s2)COCCO1 1992637609 CKXIMGUCUDONQA-SCZZXKLOSA-N 434.975 4.515 50 10 IJGE O=S(=O)(c1ccc(CBr)c(Cl)c1)N(Cc1ccccc1)CC(F)F 2009621852 KQDRKFPHHZUZSW-UHFFFAOYSA-N 438.721 4.691 50 10 IJGE CC(C)(C)[C@H](CCCl)Nc1ncc(I)cc1Br 2015756229 BNRXNZXEBDLLPO-JTQLQIEISA-N 431.543 4.904 50 10 IJGE Cc1c(Br)sc([C@@H](Br)[C@@]2(C)COCCO2)c1Br 2021898317 XSGNABHENBQRAE-MWLCHTKSSA-N 449.002 4.823 50 10 IJGE CC1(C)C[C@@H](Br)CN1C(=O)c1cc(Br)ccc1Br 2037329995 XPEODNLCGDHFMI-SECBINFHSA-N 439.973 4.600 50 10 IJGE COCCn1c(S[C@H](C)C(=O)C(C#N)=C2Nc3ccccc3S2)nc2ccccc21 2041454764 VJXUAVNUIXYSLX-CQSZACIVSA-N 436.562 4.685 50 10 IJGE CCC[C@H](Br)c1cn(-c2ccc(I)cc2Cl)nn1 2057428155 YJQLNLUJDJAUPB-VIFPVBQESA-N 440.510 4.761 50 10 IJGE C[C@@H]1CCOC[C@H]1O[C@@](C)(CI)c1ccccc1Br 2096205180 YLIHSNZELNDMLJ-DFBGVHRSSA-N 439.131 4.541 50 10 IJGE Cc1coc(C)c1[C@H](Br)c1cc(I)cc2c1OCC2 2096741666 TYRLCMKSLWKYJB-CQSZACIVSA-N 433.083 4.920 50 10 IJGE FC(F)(F)[C@@H]1C[C@H]1[C@@H](Br)c1cc(I)cc2c1OCC2 2100660415 SAIOROCHQLZHKD-FBIMIBRVSA-N 447.032 4.861 50 10 IJGE O=C(N(Cc1ccccc1)[C@@H](CBr)C1CC1)C1(C(F)(F)F)CCOCC1 2116582129 YIZNIKYKKHODFS-INIZCTEOSA-N 434.296 4.548 50 10 IJGE Fc1cccc(CBr)c1N1CCN(Cc2ccccc2)C[C@@H]1C(F)(F)F 2130160445 VMXAUHODEHNNOH-QGZVFWFLSA-N 431.271 4.974 50 10 IJGE COC1(CBr)CCN(Cc2ccc(Cl)c(Br)c2F)CC1 2166827781 VIIYFWSJOFNVBG-UHFFFAOYSA-N 429.555 4.618 50 10 IJGE Cn1cc(CC(CBr)(CBr)c2ccccc2Cl)c(Cl)n1 2168230817 CRAGFLGDAHMOED-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@H]([C@H](C)Br)C(F)(F)F)cc1Cl 2195319744 CNZGQFARXQLKRN-QUBYGPBYSA-N 437.481 4.855 50 10 IJGE O=[N+]([O-])c1ccc(CBr)c(N2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)c1 2234713996 AKXQWACJKVSSMA-BGYRXZFFSA-N 430.346 4.733 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@@]2(CCC[C@@H]2Br)C1 2264510006 PJZQVHSZEGBGTI-ZANVPECISA-N 427.589 4.944 50 10 IJGE C[C@H]1C[C@H](CBr)CCN1C(=O)c1cc(F)c(Br)cc1Cl 2282982925 ICYOSBGABPQAMN-DTWKUNHWSA-N 427.539 4.877 50 10 IJGE COc1ccc(-c2nn(Cc3ccccc3)cc2C=C(C#N)C(=O)Nc2nccs2)cc1 2295672632 FGSQMPAOHUZXMF-UHFFFAOYSA-N 441.516 4.609 50 10 IJGE Cl[C@H]1CCC[C@@H]1CNCc1ccc(I)c(Br)c1 2306221350 GZNHOCBHXFDTAY-PWSUYJOCSA-N 428.539 4.551 50 10 IJGE Cc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2F)cc1 2314634125 OMBCEEXOFXSFPP-RUZDIDTESA-N 426.447 4.971 50 10 IJGE CC(C)(C)OC(=O)N[C@@]12CCC(F)(F)C[C@H]1CN(CCCCCBr)C2 2320884465 LAHBCSAYTNSNNW-WMLDXEAASA-N 425.358 4.566 50 10 IJGE CCCOc1ccccc1C=CC(=O)N1CCC(C(=O)Nc2ccc(SC#N)cc2)CC1 2322055248 DEYIZKPJVONAJO-UHFFFAOYSA-N 449.576 4.939 50 10 IJGE C[C@@H](Cl)C[C@@H]1CCCCN1C(=O)c1ccc(Cl)cc1I 2365589205 SKXPBLDKSISDDU-PWSUYJOCSA-N 426.125 4.957 50 10 IJGE COc1cccc(OCC(=O)Oc2ccc(/C=C(/C#N)c3ccccc3F)cc2OC)c1 31901757 XMYFZFQZZIKZSB-PDGQHHTCSA-N 433.435 4.891 50 10 IJGE COCCCC(CBr)(CBr)c1ccc(Br)cc1 118671819 HYEBKUJWRWJRDV-UHFFFAOYSA-N 428.990 4.903 50 10 IJGE CCOc1cc(/C=N\NC(=O)CSc2nc3ccccc3s2)cc(Cl)c1OC 169892962 IVEQAPWEYOUHCN-FBHDLOMBSA-N 435.958 4.599 50 10 IJGE N#C/C(=C/NCCc1cccc(Br)c1)C(=O)Nc1ccc(Cl)cc1Cl 217178369 KNIHCHBDOOEARG-QBFSEMIESA-N 439.140 4.934 50 10 IJGE O=C(CSCc1ccccc1Cl)NN=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 252613889 JEENOIYVJOGRPH-UHFFFAOYSA-N 429.885 4.892 50 10 IJGE Cc1cc(Br)c([C@@H](Br)c2cnn(C)c2Br)s1 393883645 XTHKFXMRZRMYJO-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE C[C@H]1C[C@@H](Br)CN(C(=O)c2scc(Br)c2Br)C1 705469071 VQVBLDPYASRIGB-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)N[C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F 768714060 JZOPRLHNKGIQQG-APWZRJJASA-N 442.441 4.534 50 10 IJGE N#Cc1ccc(NNC(=O)C(=O)Nc2ccc3c(c2)oc2ccccc23)c(C(F)(F)F)c1 799840232 GSHHKDRXNWTINJ-UHFFFAOYSA-N 438.365 4.558 50 10 IJGE C#CCCOc1ccc(C(=O)NNC(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1 1138923543 NDEREBNLCIRMSL-UHFFFAOYSA-N 426.687 4.515 50 10 IJGE C=CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccc(Br)cc1Cl 1450650692 HJRWONHKQSDPFW-HNNXBMFYSA-N 446.773 4.795 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1ccc(Br)cc1Cl)c1cccc(Cl)c1 1616414192 REIHXMNQPMVQJD-YFHOEESVSA-N 428.113 4.620 50 10 IJGE CC(=O)c1ccc(NC(=O)CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)cc1 1623446956 VBHUCHMJLWAHOS-UHFFFAOYSA-N 445.635 4.794 50 10 IJGE COc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)Nc3cc(C)ccc3C)c(C)c21 1772746029 OLAKZPTYLDVHPR-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE CC(C)(C)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccn2)cc1 1865682166 HSVPALPVALBULP-KRWDZBQOSA-N 439.441 4.802 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3C)cc1OCC 1865686981 GRRKYHYKCWRXFN-QFIPXVFZSA-N 444.535 4.883 50 10 IJGE Cc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2cccc(F)c2)c1 1865711371 WMTKXPHSPTYDNA-QGZVFWFLSA-N 428.389 4.616 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2C[C@H]3C[C@H]3CO2)s1 1900925237 XRQKIMVUFMBLRH-LIZYTCAWSA-N 433.536 4.867 50 10 IJGE Clc1nc(Cl)n(C[C@]23CC[C@H]2CN(Cc2ccccc2)C3)c1CBr 1911007475 VXEHIRXIQULDOA-KBXCAEBGSA-N 429.189 4.997 50 10 IJGE O=C(c1nscc1Br)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915265427 OZNBUOCWAXWJAI-AWEZNQCLSA-N 444.192 4.722 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1csc(C(F)(F)F)c1 1916375320 TWWHLZZVLOQSEW-CQSZACIVSA-N 436.293 4.819 50 10 IJGE O=S1(=O)CC[C@@H]([C@@H](Cl)c2c(Br)sc(Br)c2Cl)C1 1923037427 DCMDCFXWVHKFHK-INEUFUBQSA-N 443.009 4.641 50 10 IJGE CN(C)CCN(Cc1ccccc1)c1cccc(Br)c1CBr 1931934994 DYIWPSVNJGJVFB-UHFFFAOYSA-N 426.196 4.912 50 10 IJGE CC1(C)CN(Cc2cccc(Br)c2Br)C[C@H]1Br 1943883308 ZFBXQVXVKXEZJS-LLVKDONJSA-N 425.990 4.817 50 10 IJGE CC[C@](C)(CBr)NC(=O)c1cccc(Br)c1Br 1943886923 LNBYXECVRXRDSN-GFCCVEGCSA-N 427.962 4.505 50 10 IJGE C[C@H]1C[C@H](Br)CCN(c2ncc(Br)cc2Br)C1 1997236367 HZDZZTGZGNIAKZ-DTWKUNHWSA-N 426.978 4.606 50 10 IJGE CC(C)(C)[C@H](CBr)NCc1ccc(I)c(Cl)c1 2026562819 FESVIXVYHCOUNG-LBPRGKRZSA-N 430.555 4.844 50 10 IJGE Cc1ccnc(C2CC2)c1-n1nc(CCl)c(I)c1C(F)(F)F 2078890266 MCBTXAORNDNBJY-UHFFFAOYSA-N 441.622 4.815 50 10 IJGE Cn1nc(COc2ccc(CBr)c(Cl)c2)c(Br)c1Cl 2096974262 BRUXVZCODRKTPZ-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE CCCn1cc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)C2CC2)cc1CBr 2123267713 AZFGKAKWPGOASA-MRXNPFEDSA-N 439.419 4.782 50 10 IJGE CC(C)(C)OC(=O)NCCc1cccc(NC(=O)[C@H](Br)C2CCCC2)c1 2139240892 KZJXBNJZEUMINB-QGZVFWFLSA-N 425.367 4.646 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CNC(=O)[C@@H](Br)C3CCCC3)CCC[C@@H]12 2167033098 PLWMOSNPGRCHEP-WWMYMODYSA-N 443.426 4.626 50 10 IJGE O=C(Nc1cc(Br)cnc1Br)c1ccc(CBr)cc1 2228981719 SKOXWGKMGQCRSL-UHFFFAOYSA-N 448.940 4.754 50 10 IJGE Br[C@@H]1C[C@@H]2CCCC[C@H]2N(C[C@@H]2CC2(Br)Br)C1 2246599617 UNVDVMBKXZOGML-NNYUYHANSA-N 430.022 4.520 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2OC[C@H]3CCC[C@H]32)cc1I 2269552871 VLTZEJVSLMFACV-HKCMKHECSA-N 437.115 4.551 50 10 IJGE CCCC(CBr)(CCC)CN1CCC(OCCNC(=O)OC(C)(C)C)CC1 2281546381 IRUKGPDNRKBECB-UHFFFAOYSA-N 449.474 4.974 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C2CCC1(CBr)CC2 2282973365 AHLYRTMHXOHLKA-UHFFFAOYSA-N 425.523 4.774 50 10 IJGE COc1cc(NC=C(C#N)c2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc(OC)c1OC 2295945643 IFDJCOVYJLXXBS-UHFFFAOYSA-N 438.465 4.721 50 10 IJGE CC(=O)c1cc2c(cc1NC=C(C#N)c1nc(-c3cccc([N+](=O)[O-])c3)cs1)OCO2 2295956203 BCIYGAKXEKWCDB-UHFFFAOYSA-N 434.433 4.626 50 10 IJGE CC(C)Oc1ccc(Br)cc1C=C(C#N)c1nn(-c2ccccc2)c(N)c1C#N 2296737757 KUVURSUKPYAITP-UHFFFAOYSA-N 448.324 4.940 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1Cc1ccc(Cl)c(I)c1 2300238558 MFQBZVNXNGOEAH-ZWNOBZJWSA-N 428.539 4.692 50 10 IJGE Cl[C@H]1CCCC[C@H]1NCc1ccc(I)c(Br)c1 2306232487 VLBUJJBDQGXRJA-WCQYABFASA-N 428.539 4.693 50 10 IJGE CC1(C)CN(Cc2cc(I)ccc2Cl)[C@H]1CBr 2307315049 CQOPNRGPWQVBRG-LBPRGKRZSA-N 428.539 4.550 50 10 IJGE C[C@H]1C[C@H](Br)CCN1Cc1cc(I)ccc1Cl 2307328223 KJJKDGITJJKUTF-GXSJLCMTSA-N 428.539 4.692 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)c(Br)cc1OCC#N 2313567255 FJQMKUXEWQUDEP-UHFFFAOYSA-N 440.297 4.604 50 10 IJGE CCOc1cc(C=C(C#N)c2nc(O)c3ccccc3n2)cc(Br)c1OCC 2323854312 JKPCOCJKEHZGMA-UHFFFAOYSA-N 440.297 4.959 50 10 IJGE ClC[C@@H]1[C@@H]2CC[C@@H](C2)N1Cc1ccc(I)c(Br)c1 2325210271 WURHHUBKHQKXMV-UHIISALHSA-N 440.550 4.645 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@H](Br)C2(CC2)C1 2327406671 VMJAQPDTODNBDR-ZDUSSCGKSA-N 440.550 4.694 50 10 IJGE CN(CC1CC(Br)C1)[C@@]1(C(=O)O)CCC(C)(C)C[C@H]1OCc1ccccc1 2374314323 QPUWQBALYRUTLC-OKYOFGHESA-N 438.406 4.711 50 10 IJGE COc1ccc(NC(=O)[C@H](NNC(=O)c2ccc(Cl)cc2)c2ccccc2)cc1Cl 15462470 FVTNNYWZKVWSFO-HXUWFJFHSA-N 444.318 4.616 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 33339812 VODCVSGIRFKTQK-SSZFMOIBSA-N 431.404 4.577 50 10 IJGE COc1cccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccc(C)c2)CCC3)c1 40811330 CPBJNHJLMULJMQ-NHFJDJAPSA-N 431.492 4.628 50 10 IJGE COC(=O)/C(C#N)=C/c1ccc(OC(=O)CCCOc2ccc(C(C)C)cc2)c(OC)c1 40950060 GBCDXGJEFPIKNO-XSFVSMFZSA-N 437.492 4.663 50 10 IJGE Cc1ccc(-n2nc(C)c(/C=N/NC(=O)c3cccc(Br)c3)c2C)c(C)c1 59165399 WROCDISQLRKLOB-FSJBWODESA-N 425.330 4.632 50 10 IJGE CC1(C)O[C@H]2[C@H](O1)[C@@H](CO[Si](C)(C)C(C)(C)C)O[C@H]2n1ccc2c(Cl)ncnc21 198128672 PTFANUVYJLNMOM-ZXFNITATSA-N 440.016 4.524 50 10 IJGE in-vitro Cc1ccc(N/C=C(/C#N)C(=O)Nc2ccc(I)cc2C)cc1C 217254009 MFDYQYTVROTBOJ-PTNGSMBKSA-N 431.277 4.675 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc(C)cc2OC)ccc1OC(=O)c1ccc(C)cc1 252620044 LWIPKFCFJKWCSX-UHFFFAOYSA-N 446.503 4.694 50 10 IJGE C[C@H](CCBr)CCNC(=O)c1cc(Br)c(Br)s1 397693167 ANDHUQUBSXVBRV-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE Clc1ccc(CBr)c(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@H]32)c1 404140891 FRZMKWZBIOKUCK-NHCUHLMSSA-N 435.793 4.715 50 10 IJGE COc1ccccc1CNC(=O)Nc1ccc(C(=O)Nc2ccc(SC#N)cc2)cc1 586614309 SQTAFCYPKNNCJI-UHFFFAOYSA-N 432.505 4.842 50 10 IJGE CN(C[C@H](Br)C1CC1)C(=O)c1scc(Br)c1Br 690327481 LJGNUHKFHYKSJR-ZETCQYMHSA-N 446.002 4.519 50 10 IJGE COc1cc(Cl)c([C@@H](Br)c2c(Br)cnn2C)cc1Cl 693070486 KRFCJRLCRQCCNX-LLVKDONJSA-N 428.939 4.982 50 10 IJGE Cl[C@H](c1cc2c(cc1Br)OCCO2)c1ncsc1Br 698651109 DLPPPEQPCPAJFO-SNVBAGLBSA-N 425.529 4.768 50 10 IJGE CC(C)CC(CBr)(CBr)CCS(=O)(=O)C1CCCCC1 699987665 FVYZJMXEPCYEDE-UHFFFAOYSA-N 432.262 4.946 50 10 IJGE CN(CC1CCN(Cc2ccccc2)CC1)c1ccc([N+](=O)[O-])c(CBr)c1 720015652 CENFAMXQZHJHRJ-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2ccn(CC(F)(F)F)n2)c(C)n1-c1ccc(F)cc1 773108691 DETXKSVZPJMTGT-YBEGLDIGSA-N 431.393 4.538 50 10 IJGE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NNc1cc(C#N)ccc1Br 1453046727 RYKIZYDTLYSSKK-DHZHZOJOSA-N 440.219 4.766 50 10 IJGE CC(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)nc3ccccc23)cc1C 1529782693 PKMNLIZJCOGCNC-UHFFFAOYSA-N 437.499 4.796 50 10 IJGE C=C1CCC(CNC(=O)NNC(=O)c2cc(-c3ccc(C)cc3)nc3ccccc23)CC1 1685165695 AQXJWLVZQUTKNK-UHFFFAOYSA-N 428.536 4.901 50 10 IJGE CC(C)(C)c1ccc(OCCCC(=O)NN=Cc2ccc(O)cc2)c(Br)c1 1772756077 YOHUOSYPDRUSFG-UHFFFAOYSA-N 433.346 4.762 50 10 IJGE CCCCOc1ccc(/C=C(\C#N)c2nc(O)c3ccc(C(=O)OC)cc3n2)cc1OCC 1872727440 AXNAHTYFUMJPKJ-LDADJPATSA-N 447.491 4.764 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)C12CC(C1)[C@H](C(F)(F)F)O2 1878394604 CFGZFDNHIVGGOK-GARNVTTQSA-N 434.296 4.545 50 10 IJGE COc1ccc(Br)c(C(=O)N(CCCBr)Cc2ccccc2)c1 1914645269 FKNVVRYRZQNJLX-UHFFFAOYSA-N 441.163 4.885 50 10 IJGE Cc1ncnc(N(Cc2ccccc2)[C@@H](CBr)C2CC2)c1Br 1915198981 RVVXKYDUYFXHHV-HNNXBMFYSA-N 425.168 4.728 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1 1916346743 DOEZHSKLDYUHRI-ZACQAIPSSA-N 436.312 4.794 50 10 IJGE CC(C)C[C@H](CNC(=O)OC(C)(C)C)[C@@H]1CC[C@](C)(CI)O1 1931099597 QHFPIFAWHCJHEL-JKIFEVAISA-N 425.351 4.546 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CC[C@H](CI)O2)C12CCCC2 1994328392 TWSJNLIARTVSJR-RDTXWAMCSA-N 435.346 4.683 50 10 IJGE Cc1sc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)CC(F)(F)F 2009639535 CYRZPJWHYFASTG-UHFFFAOYSA-N 442.322 4.705 50 10 IJGE CC1([C@H](CBr)NC(=O)c2ccc(Br)cc2Br)CC1 2033130437 QSEQKOVKBHAPQO-NSHDSACASA-N 439.973 4.505 50 10 IJGE Cc1cc(Br)c([C@H](Br)c2ccsc2S(C)(=O)=O)s1 2033135021 JBBFXJQANSCTRP-SECBINFHSA-N 430.208 4.768 50 10 IJGE Clc1ccc(I)c(CN2C[C@H](Br)CC23CCC3)c1 2038052559 ZPHZPOVQDWVPJT-LLVKDONJSA-N 440.550 4.837 50 10 IJGE COc1ccc(Br)cc1[C@H](Br)c1nn(C)c(Cl)c1Cl 2094338962 KTIKHPPRVGWYCF-VIFPVBQESA-N 428.939 4.982 50 10 IJGE CN(C(=O)c1cc(Br)c(Cl)s1)C1(CBr)CCSCC1 2115943514 WSNQVLDFLQFIDF-UHFFFAOYSA-N 447.645 4.897 50 10 IJGE Brc1ccccc1[C@H](CI)OC[C@@H]1[C@H]2C[C@@H]3[C@H]1[C@@H]3C2 2134543348 ZOZPKGYYFDPBLG-AKTHBCDHSA-N 433.127 4.844 50 10 IJGE O=S1(=O)CC[C@H](CC(CBr)(CBr)C2CCCCCC2)C1 2148780549 YPMPEKWPODWUEP-CYBMUJFWSA-N 430.246 4.558 50 10 IJGE Fc1ccc(C(CBr)(CBr)CCS[C@@H]2CCOC2)cc1 2149123179 MNJFLOODJPJYTK-CQSZACIVSA-N 426.189 4.766 50 10 IJGE CN(Cc1c(Br)cnn1C)c1c(CCl)ccc(Br)c1Cl 2156479008 WUUBAYWHAKFEPP-UHFFFAOYSA-N 441.982 4.974 50 10 IJGE Cn1ncc(CC(CBr)(CBr)c2ccc(Cl)cc2)c1Cl 2168230691 BFEPZYFLGGSHBI-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE CN(C1(C)CCCCC1)S(=O)(=O)c1cc(CBr)sc1Br 2179792372 FIDQDKOVVJZLRS-UHFFFAOYSA-N 445.242 4.749 50 10 IJGE Cc1cc(NCCSSCCNC(=O)OC(C)(C)C)c(N)cc1C(F)(F)F 2181743152 LEOHXISTGBFUFZ-UHFFFAOYSA-N 425.542 4.914 50 10 IJGE COCC12CC([C@H](Br)c3cc(Br)c(Cl)cc3F)(CO1)C2 2206081838 JJMNFYZHLVBMAR-IYXRBSQSSA-N 428.523 4.873 50 10 IJGE Cc1cc(Br)cc([N+](=O)[O-])c1OCCCCCI 2220214382 IYEDJDRHKBWZDH-UHFFFAOYSA-N 428.064 4.650 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@]12CC[C@@](C)(CI)O2 2243452555 LXXYSWSOTVBIJC-WBAXXEDZSA-N 437.362 4.642 50 10 IJGE CCCN(C[C@H](C)Br)C(=O)c1cc(Br)c(Br)s1 2250570028 QVAKIPIZWGSIIW-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE O=C(NC[C@H](CBr)C(F)(F)F)c1cc(F)c(Br)cc1Cl 2282979059 UXCLODRZRKEGMF-YFKPBYRVSA-N 441.444 4.545 50 10 IJGE C[C@@H]1CCCN(C(=O)c2cc(Br)c(F)cc2Cl)[C@@H]1CBr 2285960158 TVSXBISDVVIQLD-AMIZOPFISA-N 427.539 4.877 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)c(I)c2)C[C@H]1Br 2300238227 IIXLXNVEDIYESZ-GFCCVEGCSA-N 428.539 4.550 50 10 IJGE Clc1ccc(CN2CC[C@H](CBr)C23CC3)cc1I 2315549857 XCWFOKXJMRLRQJ-LLVKDONJSA-N 440.550 4.694 50 10 IJGE C[C@]1(CCBr)CCN(Cc2ccc(Cl)cc2I)C1 2318537703 GJCUODQNBBIJFF-AWEZNQCLSA-N 442.566 4.942 50 10 IJGE CC(C)N1C[C@H](C(O)=C(C#N)c2nc(-c3cccc(Br)c3)cs2)CC1=O 2331278922 SNJZBQIUXRTFLY-CYBMUJFWSA-N 432.343 4.622 50 10 IJGE FC1(F)C[C@]12C[C@@H]2CO[C@H](CI)c1cccc(Br)c1 2352458049 AMORPLRLLIOZDW-RTXFEEFZSA-N 443.069 4.987 50 10 IJGE COc1cccc(O[C@@H](C)C(=O)N/N=C/c2cn(Cc3ccccc3)c3ccccc23)c1 40960943 MFMVEEPXWUDUTP-FQNOVECQSA-N 427.504 4.616 50 10 IJGE CCCc1ccc(OCC(=O)Oc2ccc(/C=C\C#N)cc2OC)c(Br)c1 41017325 FFRCNQJDWCGFRS-XQRVVYSFSA-N 430.298 4.931 50 10 IJGE C/C(=N/NC(=O)Cn1ccc(C(F)(F)F)n1)c1ccc2c(c1)Nc1ccccc1S2 89262506 XVFPFRFTRBXORV-ROTLSHHCSA-N 431.443 4.651 50 10 IJGE C[C@H]1CN(C(=O)c2ccc(Br)c(C(F)(F)F)c2)CC[C@@H]1Br 167753452 YXDZJCVAIVJALK-KWQFWETISA-N 429.074 4.713 50 10 IJGE CC(C)(C)c1cc(CCC(=O)NN=Cc2cc([N+](=O)[O-])ccc2O)cc(C(C)(C)C)c1O 254305046 JCCLEYGNGCKGJM-UHFFFAOYSA-N 441.528 4.684 50 10 IJGE C[C@H]1CN(S(=O)(=O)c2cc(Cl)cc(CCl)c2Cl)CCN1Cc1ccccc1 396359326 YOVJFUHVQCENHA-AWEZNQCLSA-N 447.815 4.627 50 10 IJGE FC(F)(F)c1cc(Br)c(CBr)cc1I 575696028 QVSYQPRXWYUEND-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE BrCc1c(N2CC[C@H]3[C@H](CCCN3Cc3ccccc3)C2)nc2sccn12 715014998 MYSHJBWHNYNPAQ-MSOLQXFVSA-N 445.430 4.782 50 10 IJGE COc1ccc(-c2cnc(CCC(=O)Oc3ccc([N+](=O)[O-])cc3Br)o2)cc1 739311883 TYNYHAJDZKCTIN-UHFFFAOYSA-N 447.241 4.559 50 10 IJGE Cc1ccc(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)cc1NC(=O)OC(C)(C)C 743462080 DHYXGPUMHGKUKR-UHFFFAOYSA-N 448.527 4.568 50 10 IJGE O=C(Nc1ccccc1C(=O)NNc1cccc(F)c1F)c1ccc([N+](=O)[O-])cc1Cl 748805839 XFMJAGXAPNTANU-UHFFFAOYSA-N 446.797 4.536 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N[C@@H]2CCSc3ccccc32)c(-c2ccccc2)n1 914463481 GRQKJCWSCHTMJQ-JXTFVVQCSA-N 439.544 4.724 50 10 IJGE COc1cc(-c2cc(C(=O)NN=Cc3ccccc3)c3ccccc3n2)cc(OC)c1OC 916273817 BUGILQFPHCAXTI-UHFFFAOYSA-N 441.487 4.692 50 10 IJGE CCOc1cccc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)c1O 1614624003 VOOLCAIJSHQBAD-SJLPKXTDSA-N 434.330 4.538 50 10 IJGE Cc1cc([C@H]2CN(Cc3ccccc3)C[C@H]2CI)ccc1[N+](=O)[O-] 1614640810 FYNWHKDXQZPYFG-QZTJIDSGSA-N 436.293 4.554 50 10 IJGE Cc1c(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)nc(O)c2ccccc12 1624162237 JKNZOGNEIHBWJB-HNNXBMFYSA-N 437.565 4.536 50 10 IJGE C=C(Cl)C[C@@H](NS(=O)(=O)c1cccc(S(F)(F)(F)(F)F)c1)C(=O)OCC 1664946864 DLLDCJRIAAUINS-GFCCVEGCSA-N 443.843 4.697 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2c(F)cccc2Cl)[C@H]1c1ccco1 1865697961 GWWBFHGLXQGVPZ-CQSZACIVSA-N 438.768 4.554 50 10 IJGE Cc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706140 ORSAPKOWRJYFFV-GOSISDBHSA-N 442.262 4.614 50 10 IJGE O=C(O)c1c(Cl)c(Cl)c(Cl)c(Cl)c1C(=O)Nc1nnc(CCl)s1 1865860453 BOEFIIZLZOWVDS-UHFFFAOYSA-N 435.503 4.841 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCC[C@@]12CCN(C(=O)OC(C)(C)C)C2 1882088168 PAAMOTDITXEQDP-MDOVXXIYSA-N 447.414 4.702 50 10 IJGE O=C(NC1(CCCBr)CC1)c1scc(Br)c1Br 1942472007 UZZBRECQZMXVAI-UHFFFAOYSA-N 446.002 4.711 50 10 IJGE BrC[C@@H]1CCCN(Cc2ccc(Br)cc2Br)C1 1943851888 UGQVFBZKLKFJOP-JTQLQIEISA-N 425.990 4.819 50 10 IJGE Cn1nc([C@H](Br)c2ccc(F)c(Br)c2)cc1Br 1945319832 LWFGWCFNTNTXBS-LLVKDONJSA-N 426.909 4.569 50 10 IJGE CC(C)(C)[C@@H](CBr)CN1CCC[C@@H](CNC(=O)OCc2ccccc2)C1 1977953682 VKKUOACSVRRYIP-OALUTQOASA-N 425.411 4.682 50 10 IJGE CC(C)(C)CC1CC(O[C@](C)(CI)CNC(=O)OC(C)(C)C)C1 1987833914 NZCURWIMUFFVST-WTNGLUPJSA-N 439.378 4.936 50 10 IJGE CC(C)[C@H](Br)CN(C)C(=O)c1cc(Br)sc1Br 2002410409 JTNQWSZHAHPQPP-MRVPVSSYSA-N 448.018 4.765 50 10 IJGE CC1(C)[C@H](Br)CCCN1c1ncc(Br)cc1Br 2020205853 KKFSGKKITUDWHN-SNVBAGLBSA-N 426.978 4.749 50 10 IJGE C[C@H](CCBr)CCN1CC[C@@H](C(F)(F)F)[C@H](NC(=O)OC(C)(C)C)C1 2044695752 GNTDZIBCFACSTL-MGPQQGTHSA-N 431.337 4.575 50 10 IJGE C[C@@H](N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)ccn1)C(C)(C)C 2059277912 QZTDLLXPBJAIIZ-OAHLLOKOSA-N 425.392 4.602 50 10 IJGE COC[C@@H]1C[C@H]1COc1c(Br)cc(CBr)cc1Br 2069753630 OSDMVPNAEHSFOH-UWVGGRQHSA-N 442.973 4.768 50 10 IJGE CC[C@@H]1CN(Cc2cc(Cl)ccc2I)C[C@H]1CBr 2084891293 YJJKMSOTMNSFGC-ZYHUDNBSSA-N 442.566 4.798 50 10 IJGE Cc1cc(NC(=O)OC(C)(C)C)ccc1NS(=O)(=O)CCC(CCl)CCl 2106299938 AXNOJULDOVDJCP-UHFFFAOYSA-N 425.378 4.568 50 10 IJGE CCN(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2110714096 AGQXGFCPZKMARN-IRXDYDNUSA-N 431.415 4.578 50 10 IJGE CC(C)(C)OC(=O)N1CCN(Cc2ccc(CBr)cc2)[C@H](CC(F)F)C1 2127048879 XHBJFKGYHQNFFL-MRXNPFEDSA-N 433.337 4.658 50 10 IJGE Cc1sc(C)c(S(=O)(=O)NCCCC(C)(C)CBr)c1Br 2143911383 VRSYJRZYDNWTTK-UHFFFAOYSA-N 447.258 4.607 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc(NC(=O)c2ccc(CBr)cc2)cc1F 2162494279 HBRGLVMFVZTKMN-UHFFFAOYSA-N 437.309 4.998 50 10 IJGE CCCN(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)[C@H](Br)C1CCCC1 2167031239 HXILNHVAKYYMSB-SJLPKXTDSA-N 445.442 4.826 50 10 IJGE O=C([C@@H](Br)C1CCCC1)N1CCC2(CCN(Cc3ccccc3)CC2)CC1 2167040078 NHVOKWQYXSHULN-NRFANRHFSA-N 433.434 4.845 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1C1CCN(C[C@H](CBr)CC2CC2)CC1 2185498997 ALVUPLFRVXMQJT-HNNXBMFYSA-N 441.414 4.747 50 10 IJGE COCC(CCOc1c(Br)cc(Cl)cc1CBr)COC 2187551420 OCUSYBLYCWVXEG-UHFFFAOYSA-N 430.564 4.675 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2[C@@]12C[C@@H]1CN(Cc1ccccc1)C2 2202302270 YDQGLZKXJFWAPY-QVKFZJNVSA-N 446.776 4.777 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)Cc1cc(Cl)cc(F)c1Cl 2210044945 UQTOYEOMJSREQK-JTQLQIEISA-N 431.088 4.735 50 10 IJGE COc1ccc(Br)c(CBr)c1OC[C@H]1C[C@@H](Br)C1 2220453904 HCEAXCGTNNZFPW-DTORHVGOSA-N 442.973 4.905 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1CCC[S@@](C)=O 2234059631 JUORIODICOXGTH-FFVOIRBGSA-N 442.604 4.630 50 10 IJGE CN(C[C@H](F)[C@@H]1CCOC1)c1c(CBr)ccc(Br)c1Cl 2238357295 IDGANBVHLAUUGT-PWSUYJOCSA-N 429.555 4.808 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCCCN(C(=O)OC(C)(C)C)CC1 2242080371 ODIDSQCRJOWPHZ-LSDHHAIUSA-N 435.403 4.702 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CC[C@H](OC)C2)cc1I 2257356075 RDQTWSOMVPSYSR-NURSFMCSSA-N 425.104 4.551 50 10 IJGE CC1CC(CBr)(CN2CC[C@@H](C(F)(F)F)[C@@H](NC(=O)OC(C)(C)C)C2)C1 2265313828 MMGOSCNIHOMWBI-DLOXAQCQSA-N 443.348 4.575 50 10 IJGE CC(C)N(CC1CCN(C(=O)OC(C)(C)C)CC1)CC1(CBr)CC(F)C1 2265639045 PPBSIBHCZVGMLR-UHFFFAOYSA-N 435.422 4.857 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc([N+](=O)[O-])cc2)sc2c1CC[C@@H](C)C2 2296819138 ZRMGYWLPGWARAM-CYBMUJFWSA-N 439.493 4.503 50 10 IJGE C[C@@]1(NCc2ccc(I)c(Br)c2)CCC[C@@H]1Cl 2306226705 HLCWOYUXGPRUMY-QWHCGFSZSA-N 428.539 4.693 50 10 IJGE CCOc1cc(C=C2C(=O)N(C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(Cl)cc1 2314617689 SINDULGOFAHLIR-UHFFFAOYSA-N 436.895 4.540 50 10 IJGE BrC[C@]12C[C@H](CCN1Cc1ccc(Br)cc1Br)C2 2315176333 FNJJWYJKMNRLIK-WJONMLJTSA-N 438.001 4.961 50 10 IJGE Clc1ccc(CN2C[C@H]3CC[C@H]2[C@H](Br)C3)cc1I 2325462054 AZODBUPWUVIWGS-PXWWUCIGSA-N 440.550 4.692 50 10 IJGE N#CC(=Cc1ccc(OC(=O)c2ccc(F)cc2)cc1)c1cc2c(cc1[N+](=O)[O-])OCCO2 2331051367 FCJHLLZFLAVXIM-UHFFFAOYSA-N 446.390 4.788 50 10 IJGE COc1ccc(OC)c(CC(O)=C(C#N)c2nc(-c3ccc(OC)c(OC)c3)cs2)c1 2331241486 OXMJIEYGNWEDCU-UHFFFAOYSA-N 438.505 4.880 50 10 IJGE CSCC[C@@H](C(O)=C(C#N)c1nc(C(C)(C)C)cs1)N1C(=O)c2ccccc2C1=O 2331308337 UDYZCHJAUGRWBX-INIZCTEOSA-N 441.578 4.651 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)c3ccccc3Cl)cc2)cc1 12492000 AOEXEPJENPIJCC-UHFFFAOYSA-N 449.938 4.965 50 10 IJGE N#CC1=C(N)N2C(=C(C#N)[C@H]1c1ccc(-c3ccc([N+](=O)[O-])cc3)o1)Sc1ccccc12 39794221 OTYLLCZGIRMPOL-NRFANRHFSA-N 439.456 4.993 50 10 IJGE CCCCCCOc1ccc(/C=C(\C#N)C(=O)Nc2nnc(C3CC3)s2)cc1OC 41013045 YDZZWOHMICHUGW-SFQUDFHCSA-N 426.542 4.929 50 10 IJGE C[C@]1(CI)CC[C@H](c2cc(Br)c(Br)o2)O1 307717106 JASXOPKOGXLLGE-GMSGAONNSA-N 449.908 4.850 50 10 IJGE Cn1cc(Br)c([C@@H](Br)c2ccc(F)c(Br)c2)n1 693100769 RQPRVIMOPGMPKA-JTQLQIEISA-N 426.909 4.569 50 10 IJGE CN(C[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])c(CBr)c1 720017386 UUHYVZISJPVVMQ-SFHVURJKSA-N 432.362 4.838 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCCSc2ccc(Cl)cc2)c1C 736693454 HSSWGJWLUDSFHC-UHFFFAOYSA-N 427.961 4.824 50 10 IJGE C=C(C)CN(Cc1ccc(CO)o1)C(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(F)cc2)c1C 1568889350 CXKWEGYEAIEVSZ-MTJSOVHGSA-N 447.510 4.830 50 10 IJGE C/C(=C/C(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1)c1ccc(C(F)(F)F)cc1 1641071636 OXIMROGKJUCJIC-KGAUPUERSA-N 442.437 4.877 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2cc3oc(O)nc3cc2F)c(C)n1-c1ccc(F)cc1 1645189340 DBHADYONWOLTGJ-OVCLIPMQSA-N 434.402 4.765 50 10 IJGE CCc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865688844 CJBGTOLYJVONJH-IBGZPJMESA-N 441.318 4.724 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1ccc(C)cc1 1865690980 GMHNEXVWFSBAJU-HSZRJFAPSA-N 426.520 4.585 50 10 IJGE CCc1nn(Cc2cccc(F)c2)c2c1[C@@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865704993 JUCNIOFMHXJZSS-QFIPXVFZSA-N 432.499 4.638 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@H]2c1cc(Cl)c(O)c(OC)c1 1865707464 XLVWFETVFSJJPM-GOSISDBHSA-N 436.899 4.546 50 10 IJGE COC(=O)c1ccc2c(O)nc(/C(C#N)=C/c3ccc(OCc4ccccc4)cc3)nc2c1 1872727551 JMEHQIVLMKLNNL-DEDYPNTBSA-N 437.455 4.765 50 10 IJGE CC(C)(C)c1csc(/C(C#N)=C(\O)c2ccc3c(c2)C(=O)N(Cc2ccccn2)C3=O)n1 1872747842 VYGIFSMHFYAIJE-ZZEZOPTASA-N 444.516 4.582 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cc(Cl)cc(F)c1F 1916365511 YCXFYTSEXCWOLD-ZDUSSCGKSA-N 432.692 4.671 50 10 IJGE CC[C@@H](CCBr)NC(=O)c1csc(Br)c1Br 1937738348 QTTHTDVROLCUTM-LURJTMIESA-N 433.991 4.567 50 10 IJGE CCC[C@H](Br)CCNC(=O)c1cc(Br)c(Br)s1 1942748943 TUNVFNMOJHQXRQ-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE C[C@]1(CBr)CCN(Cc2cccc(Br)c2Br)C1 1943883533 JUAMYILMUOHKKG-CYBMUJFWSA-N 425.990 4.819 50 10 IJGE CC(C)[C@@H](CCBr)NC(=O)c1csc(Br)c1Br 1945189306 NOXACLNVWMMARU-MRVPVSSYSA-N 448.018 4.813 50 10 IJGE CC1(C)CN(Cc2cc(Br)ccc2Br)C[C@H]1Br 2006496756 LXCYCHHPLGSAQW-GFCCVEGCSA-N 425.990 4.817 50 10 IJGE CC1(C)[C@@H](Cl)C[C@@H]1CNc1ncc(I)cc1Br 2015765351 NOMZLCNKCMRMQT-XCBNKYQSSA-N 429.527 4.514 50 10 IJGE Cc1nn(CCC#N)c2c1P(c1ccccc1)C(=C1N(C)c3ccccc3C1(C)C)C=N2 2040464776 BLHTZROTTGQJKU-UHFFFAOYSA-N 439.503 4.893 50 10 IJGE C[C@]12CN(Cc3cc(Br)ccc3Br)C[C@]1(CBr)C2 2054721106 BRDGWOJDGKKNIJ-UONOGXRCSA-N 438.001 4.819 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CC2(CBr)CCC2)CC[C@H]1C(F)(F)F 2106785313 OOXVHGMDJKWGTF-ZIAGYGMSSA-N 443.348 4.577 50 10 IJGE CC(C)(C)OC(=O)NCCC[C@H]1CCCCN1C(=O)[C@@H](Br)C1CCCC1 2110716720 AFFNDMVYBWBNIM-SJORKVTESA-N 431.415 4.626 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1CCCl)c1ccc(I)c(Cl)c1 2146741769 ZGTOTBDCYAJNTD-YGRLFVJLSA-N 426.125 4.862 50 10 IJGE BrCC1(CN2CCC[C@]3(CN(Cc4ccccc4)CCO3)C2)CCCCC1 2151740829 UBTRRNZXDTVJMG-QHCPKHFHSA-N 435.450 4.699 50 10 IJGE Cc1sc([C@H](Br)[C@@]23CCC[C@@H]2CS(=O)(=O)C3)c(C)c1Br 2201882910 QTONSBQCEUFFMI-DDTOSNHZSA-N 442.238 4.778 50 10 IJGE Cc1sc(C[C@@H](CBr)NC(=O)OC(C)(C)C)c(C)c1Br 2209174653 DPQYJUVOFNVSRM-JTQLQIEISA-N 427.202 4.958 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC(CCCBr)C1 2216758565 NLMGKUJDGSFJLV-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE O=[N+]([O-])c1cc(Br)cc(Cl)c1OCCCCCI 2220216062 QNAIUIIELIJNPH-UHFFFAOYSA-N 448.482 4.995 50 10 IJGE Fc1cc2nc(CCCl)n(C[C@@H]3CC3(Br)Br)c2cc1F 2233042038 VLECZOUYGZATNB-ZETCQYMHSA-N 428.502 4.602 50 10 IJGE O=C(c1ccc(I)c(Cl)c1)N1CCC[C@@H](CCCCl)C1 2234184406 VCVRHMXFJVROHO-LLVKDONJSA-N 426.125 4.816 50 10 IJGE CO[C@H]1C[C@H]([C@@H](Br)Cc2ccc(Br)cc2Cl)C[C@H]1OC 2237443317 INZPGAIWBBCWQU-HQRZJTNHSA-N 426.576 4.849 50 10 IJGE O[C@H](c1c(F)cc(Br)c(F)c1Br)C1CC(Br)C1 2250732969 SXXVMHVIYJSVOU-UTNXVAPVSA-N 434.900 4.697 50 10 IJGE Cc1cc(F)c(CBr)c(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@H]32)c1 2283391099 ASJYBKSHWFITJE-YADHBBJMSA-N 433.365 4.509 50 10 IJGE Cc1ccc(-n2c(N(C)C)nc(C=C(C#N)C(=O)N[C@H](C)c3ccccc3)c2Cl)cc1 2293046007 XRXQZZMFLQKTIZ-QGZVFWFLSA-N 433.943 4.685 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NCc1ccc(Cl)cc1I 2302329692 UYVFZIOPEWHCJA-NOZJJQNGSA-N 430.555 4.844 50 10 IJGE CC(C)(C)Oc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4O)[nH]c3c2)cc1 2323743687 QYFNJMUDACMPMX-UHFFFAOYSA-N 428.492 4.877 50 10 IJGE CCOCc1cc(Br)c([C@H](Cl)c2c(Br)ncn2C)s1 2337317666 QZGZYWRPGHZHMC-SECBINFHSA-N 428.577 4.871 50 10 IJGE C[C@@H]1CCC[C@H](CO[C@@H](CI)c2ccccc2Br)O1 2338810471 QUUSRXBUEHVIDO-JMSVASOKSA-N 439.131 4.899 50 10 IJGE CC(C)(C)OC(=O)NCCCN(C[C@]1(CBr)CC1(F)F)c1ccccc1 2351888695 YBARPBLMYRRLLS-GOSISDBHSA-N 433.337 4.828 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](CC)C(=O)NNC(=O)c1ccc(OCC(C)C)cc1 10683836 WFJDQBXDYQGDAO-PGRDOPGGSA-N 426.557 4.854 50 10 IJGE C=CCc1ccc(OCC(=O)N/N=C/c2ccccc2OCc2ccccc2)c(OC)c1 20228593 XERVNCQTQFAKEH-WPWMEQJKSA-N 430.504 4.532 50 10 IJGE CCCOc1ccc(/C=C\C(=O)Oc2ccc(/C=C(/C#N)C(=O)OCC)cc2OCC)cc1 33378281 CVUPJRIXYJAIRS-JPOGNWIISA-N 449.503 4.963 50 10 IJGE CCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3cccc(C)c3)cc2OC)cc1 254767215 YWFZCTCVLLMXPI-UHFFFAOYSA-N 446.503 4.776 50 10 IJGE CCOc1cc(C=NNC(=O)Nc2ccccc2)ccc1OCCOc1ccccc1OC 254791038 LLQSFIJSWDELRH-UHFFFAOYSA-N 449.507 4.707 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2cc3c(C)nn(-c4ccccc4)c3s2)c(O)c1 254833601 HKGNLTQYOLEGCT-UHFFFAOYSA-N 447.564 4.711 50 10 IJGE C[C@]1(n2c(CCCl)nc3cc(Br)cnc32)CCN(Cc2ccccc2)C1 405999664 YIRNDQVNJKRDGP-FQEVSTJZSA-N 433.781 4.596 50 10 IJGE CC(C)c1ccccc1NC(=S)NNC(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 741282256 HEVJXSLDTRDMNL-CVEARBPZSA-N 437.487 4.830 50 10 IJGE Cc1cccc(Oc2ncccc2NC(=O)NNC(=O)c2cccc3cccnc23)c1C 756126627 PHHMEPURXHAZNO-UHFFFAOYSA-N 427.464 4.505 50 10 IJGE Cc1cc(C(=O)NNc2ccc(OC(F)(F)F)cc2)ccc1NC(=O)c1cccs1 759657376 HZMBLVGUQAISKW-UHFFFAOYSA-N 435.427 4.964 50 10 IJGE C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799755042 XKKHQRGWTXEANF-CQSZACIVSA-N 440.425 4.878 50 10 IJGE CC(C)(C)c1nc(COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cs1 915364984 CMCUXNIMRBNUSC-LDADJPATSA-N 445.548 4.868 50 10 IJGE Cc1c(C(=O)Nc2ccc(C(C)C)cc2)oc2c1C(=NNC(=O)c1cccnc1)CCC2 1772746520 WBIUGHWUXSWONP-UHFFFAOYSA-N 430.508 4.829 50 10 IJGE C[C@@H](Br)C(=O)c1ccc(SC(F)(F)F)cc1I 1848425817 DDBQRQUMAVVJSV-RXMQYKEDSA-N 439.034 4.869 50 10 IJGE CCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccc(O)cc1)C(C#N)=C(N)O2 1865684667 VHJGHLVQMZBUMM-LJQANCHMSA-N 441.318 4.724 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@H]2c1ccc(Cl)c([N+](=O)[O-])c1 1865705778 FSCMDDMBAJAAOG-GOSISDBHSA-N 435.871 4.740 50 10 IJGE CCc1nc(Nc2ccc(SC#N)cc2)cc(N2CCN(C)[C@H](c3ccc(F)cc3)C2)n1 1868277885 LOSVHNWASOSQFB-NRFANRHFSA-N 448.571 4.988 50 10 IJGE CCOc1ccc(-c2csc(/C(C#N)=C(\O)CCc3nc4ccccc4[nH]c3=O)n2)cc1 1872747707 QZNNFHSEBNQLMZ-XLNRJJMWSA-N 444.516 4.871 50 10 IJGE CCN(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)CC(C)(C)CI 1904652763 FKBIZPFRIITQPW-HNNXBMFYSA-N 438.394 4.559 50 10 IJGE O=C(c1ccoc1Br)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915314248 RBVRERPYUUYJOP-OAHLLOKOSA-N 427.136 4.858 50 10 IJGE C[C@@H]([C@H](Br)c1c(Cl)sc(Br)c1Cl)S(C)(=O)=O 1925575455 XYQMSUGPLHULBH-UCORVYFPSA-N 430.998 4.687 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCC3(CCC[C@@H](CI)O3)CC2)C1 1950141619 SDZUVIAMDROOMR-MNNVXMFVSA-N 449.373 4.931 50 10 IJGE C[C@@H]1C[C@H]1N(CCBr)C(=O)c1csc(Br)c1Br 2002026022 IDELYSVBJLKJDC-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE C[C@H]1CCN(Cc2ccc(I)c(Cl)c2)[C@H]1CBr 2026561969 WWPKRCZCWARDEC-ZANVPECISA-N 428.539 4.550 50 10 IJGE COC[C@@H]1C[C@@H]1COc1c(Br)cc(CBr)cc1Br 2069753632 OSDMVPNAEHSFOH-VHSXEESVSA-N 442.973 4.768 50 10 IJGE CC(C)(C)OC(=O)NCc1nc2c(s1)CCN(C[C@@H](CBr)C(C)(C)C)C2 2106782559 RFQVACJACLYUNS-CYBMUJFWSA-N 446.455 4.583 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CCCCCBr)C[C@H]1c1ccccc1 2129066302 CTASBZUSJMRIFU-OALUTQOASA-N 425.411 4.792 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1CN(CCO)CCCCCCCCCBr 2163058022 HCADKCPGTGZDPM-LJQANCHMSA-N 449.474 4.806 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCC[C@@H]2NC(=O)[C@@H](Br)C2CCCC2)CC1 2167050733 NUUJFNUNSSFKGI-IRXDYDNUSA-N 443.426 4.626 50 10 IJGE COc1cc(Br)c([C@@H](Cl)[C@H]2C[C@@H](Br)C2)c(OC)c1OC 2196897058 UWHCBVJUXGVJPD-SXMVTHIZSA-N 428.548 4.928 50 10 IJGE ICCCCCN1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1 2211184364 CWXIYDCRBCBHLT-VQTJNVASSA-N 426.386 4.578 50 10 IJGE COc1ccc([C@H](Br)C[C@H]2OCC[C@H]2C)cc1I 2257368794 JQFGWWIVUJZPRR-GLXFQSAKSA-N 425.104 4.551 50 10 IJGE CN(C[C@H]1C[C@H]1Br)C(=O)CCCCCCCCCNC(=O)OC(C)(C)C 2269414615 GGLMPIVHSDTTFG-IAGOWNOFSA-N 433.431 4.874 50 10 IJGE C[C@@H]1CC[C@](CBr)(NC(=O)c2cc(F)c(Br)cc2Cl)C1 2282974083 FOEBIPUDKHBXNS-CLAHSXSESA-N 427.539 4.925 50 10 IJGE Cc1ccc(CBr)cc1NC(=O)c1c(F)cccc1I 2296121577 SDQDXKAKOVECMW-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE CCCCCCCC(=O)Nc1ccc(C(=O)NN=Cc2ccc(OC)c(OC)c2)cc1 2296646560 RLHIKBMECYXYCC-UHFFFAOYSA-N 425.529 4.767 50 10 IJGE CCOC(=O)c1ccc(NC=C(C#N)c2nc(-c3ccc(OC(C)=O)cc3)cs2)cc1 2296798484 ZIFLJYGKNKBMCB-UHFFFAOYSA-N 433.489 4.889 50 10 IJGE COc1cc(C=C(C#N)C(=O)NC2CCCCC2)ccc1OCc1ccc([N+](=O)[O-])cc1 2297533243 SVMXPFPCLZUMMA-UHFFFAOYSA-N 435.480 4.538 50 10 IJGE COc1cc(Br)cc(C=NNC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)c1OC 2323138775 SIKFMPFTDFKHBM-BGCCBAISSA-N 449.389 4.913 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)c(OCC)c1 2323608709 JKIQDQIGXSIKJO-UHFFFAOYSA-N 426.542 4.625 50 10 IJGE Clc1ccc(I)c(C[C@]2(CBr)O[C@H]3CC[C@H]2C3)c1 2327567734 MAJJSLUEFJSFLB-VHRBIJSZSA-N 441.534 4.820 50 10 IJGE CC(C)CO[C@@H]1[C@H](Cl)C[C@H]1OCc1ccc(Cl)cc1I 2365647025 GEIKBYVLAGFLBR-BPLDGKMQSA-N 429.125 4.882 50 10 IJGE C[C@H]1CCc2c(sc3nc(/C(C#N)=C/c4ccc(Cl)c([N+](=O)[O-])c4)[nH]c(=O)c23)C1 9539492 NHCVKLXKKQOAMP-QVIVLVACSA-N 426.885 4.735 50 10 IJGE Cc1ccc(/C=N/NC(=O)CSc2nc(=O)c3c(-c4ccccc4)c(C)sc3[nH]2)cc1 19645991 VLIYVBOZGHDERC-WYMPLXKRSA-N 448.573 4.511 50 10 IJGE CC(C)N(CCCBr)C(=O)c1cc(Br)sc1Br 232649258 TZRJAISZBFQUKU-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE CCc1ccc(C=NNC(=O)CSc2nnc(SCc3ccc(C)cc3)s2)cc1 254869542 KPKBMXWHWOMPCZ-UHFFFAOYSA-N 442.635 4.944 50 10 IJGE ClCc1cc(Br)ccc1N1CC[C@@H](N2CCN(Cc3ccccc3)CC2)C1 312717157 UJOVICQRUMZPAK-OAQYLSRUSA-N 448.836 4.584 50 10 IJGE CC[C@@](C)(CO[C@@H](CI)c1ccc(Br)cc1)OC 319151506 ZIKIKCPECWBZJM-KBPBESRZSA-N 427.120 4.757 50 10 IJGE Cc1cc(C)c(CNC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Cl)cc3)c2C)c(O)n1 728203040 PUBBVCKPVQVURW-ODLFYWEKSA-N 434.927 4.688 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2sc3cc(F)ccc3c2Cl)c1C 736693425 GMKDTVQRZXRVJL-UHFFFAOYSA-N 427.892 4.920 50 10 IJGE O=C(NNc1ccc(OC(F)F)cc1)c1cc(OCC(F)(F)F)c2ccccc2n1 772817203 CHPHGLQDKNIEBE-UHFFFAOYSA-N 427.329 4.534 50 10 IJGE COc1ccccc1NC(=S)NNC(=O)c1csc(-c2cccc3ccccc23)n1 777971132 HHVOLGIRJCDGND-UHFFFAOYSA-N 434.546 4.603 50 10 IJGE COc1ccc(-c2cc(C(=O)NN=C3CCC[C@H](OC)C3)c3ccccc3n2)cc1OC 794478948 BKJABHNNYUNUKX-SFHVURJKSA-N 433.508 4.594 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NC[C@H]2CCCCC(F)(F)C2)c(-c2ccccc2)n1 816789148 HTSXJYQMZPPGEL-YNGKYYQNSA-N 437.494 4.703 50 10 IJGE Cc1cc(C=NNC(=O)C(=O)Nc2ccccc2F)c(C)n1-c1cccc(Cl)c1Cl 1084009074 ZJGONMHXRHIBHN-UHFFFAOYSA-N 447.297 4.629 50 10 IJGE Cc1c(Br)ccc2[nH]c(C(=O)NNc3nc4ccccc4[nH]c3=S)cc12 1148231014 FIJVLXBGNVNDDQ-UHFFFAOYSA-N 428.315 4.602 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCc3cnc(O)c4ccccc34)c2C)c1 1155726830 PDNHNLGZGOYSCO-FYJGNVAPSA-N 436.515 4.880 50 10 IJGE C#CC[C@]1(C(=O)NNc2c(Cl)cc(Cl)cc2Cl)CCCN1C(=O)OC(C)(C)C 1350807115 ZEHLSYUIXMRRTA-LJQANCHMSA-N 446.762 4.883 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)NNc2nc3ccccc3[nH]c2=S)cc1 1629912505 XOHKCWHZYBGNMG-ZDUSSCGKSA-N 439.541 4.635 50 10 IJGE C=CC[C@H](CO)CNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1637571003 JSMWSOFPFMWGLR-HKJBKDEOSA-N 432.351 4.609 50 10 IJGE C=CC[C@@H](Cc1ccccc1)NC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1 1673577580 HUBHTDFADIISHR-QFIPXVFZSA-N 447.510 4.536 50 10 IJGE CCCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccc[nH]1)C(C#N)=C(N)O2 1865709375 ATZSOPFSFSLMAQ-SFHVURJKSA-N 428.323 4.737 50 10 IJGE O[C@H](c1c(Cl)cc(Br)c(F)c1Br)[C@@H]1C[C@@H]1Br 1900375753 GGWIZLHMYKUPFF-XTZAULBFSA-N 437.328 4.821 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC[C@H]1CC[C@@H]1C(C)(C)C 1902716554 UIPQDQRWHPXXDJ-GLJUWKHASA-N 439.378 4.794 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccc(Br)cc1 1902790695 NWWKZGMEHAVTAD-KRWDZBQOSA-N 441.163 4.549 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1csnc1Br 1925216279 FYVWJWQJMRBVKT-UHFFFAOYSA-N 432.181 4.722 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@@H]2CC[C@H]3CC[C@@H]2C3)C1 1947121238 RLGDHLKHQCFEJR-YKTARERQSA-N 449.373 4.786 50 10 IJGE C[C@@H](Cl)c1nnc(-c2ccc(Br)cc2I)s1 1995284437 DEFOXDVMRARRES-RXMQYKEDSA-N 429.508 4.872 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@H]1Cc1cc(Br)ccc1Br 2007127204 CVIZFQSHBGPERX-IRUJWGPZSA-N 426.974 4.943 50 10 IJGE CN(C(=O)c1cc(Br)sc1Br)C1CC(CBr)C1 2018082140 PNIKVSQEIHDDRZ-UHFFFAOYSA-N 446.002 4.519 50 10 IJGE Brc1cc2c(cc1[C@H](Br)C1(Br)CC1)OCCCO2 2049222975 KBCXXPAKYDHDPK-LBPRGKRZSA-N 440.957 4.974 50 10 IJGE Brc1ccc(Br)c(CN2CC[C@H](Br)C3(CC3)C2)c1 2054718300 MTANXULQMUAZSH-ZDUSSCGKSA-N 438.001 4.961 50 10 IJGE FC(F)c1cc(I)c(CCl)c(I)c1 2060236212 QGUPMZNZDJHQCZ-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@H](CBr)c2ccccc2)CC1(C)C 2106788170 NMXSHDHQLUOMHL-ZWKOTPCHSA-N 425.411 4.648 50 10 IJGE COc1ccc([C@@H](Br)c2nn(C)c(Cl)c2Br)cc1Cl 2110723555 OGYUEOFHFUCDEL-SECBINFHSA-N 428.939 4.982 50 10 IJGE CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(OCCCBr)cc1 2123245475 IIYJKWHJKFVSEQ-QGZVFWFLSA-N 440.403 4.840 50 10 IJGE CC[C@]1(CNC(=O)c2ccc(CBr)cc2)CCCN(C(=O)OC(C)(C)C)C1 2162494107 FBDFWBUYAZKPDJ-OAQYLSRUSA-N 439.394 4.739 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(C[C@@H](CBr)c3ccccc3)C[C@@H]21 2163062172 KFICIVNFKTUHGZ-YSTOQKLRSA-N 437.422 4.790 50 10 IJGE O=S(=O)(c1cc(CBr)sc1Br)N1CCCCCCCC1 2179775601 MZGOMIJVIWKKOI-UHFFFAOYSA-N 445.242 4.750 50 10 IJGE Cc1cc(C(=O)NC[C@@]2(CBr)C[C@H]2C(F)(F)F)sc1Br 2192584295 XCUJDRPXMQVMEO-KCJUWKMLSA-N 435.103 4.512 50 10 IJGE CN(CCCCCI)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 2214708450 KJFUUTDKGSWATD-KRWDZBQOSA-N 446.373 4.790 50 10 IJGE CCOCc1cc(Br)c([C@@H](Br)[C@H]2OCCOC2(C)C)s1 2233019566 PGDYGBOHWJYZBA-DGCLKSJQSA-N 428.186 4.677 50 10 IJGE COc1cc(F)c(CBr)c(N2C[C@@H]3CN(Cc4ccccc4)CC[C@H]3C2)c1 2283538786 DPLDLAUBTHBVPT-ROUUACIJSA-N 433.365 4.688 50 10 IJGE CN(C(=O)Cc1cc(Br)cc(Br)c1)[C@@H](CCl)C(C)(C)C 2295317348 LTRNFRWQWBZWNH-ZDUSSCGKSA-N 425.592 4.866 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Br)[C@]12COC[C@@H]1C2(F)F 2295366300 YSYGWCSDXCFOQD-DLOVCJGASA-N 432.486 4.829 50 10 IJGE CCOC(=O)c1ccc(NC=C(C#N)c2nc(-c3ccc(OC)c(OC)c3)cs2)cc1 2296798474 YJPMXWBHOAFREX-UHFFFAOYSA-N 435.505 4.981 50 10 IJGE C[C@H]1CO[C@](CBr)(Cc2cc(I)ccc2Cl)C1 2307276456 WSJMWYSYPFGPAJ-RNCFNFMXSA-N 429.523 4.677 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@@H](Cc2cccc(C)c2)C(=O)N1c1ccc(C(C)C)cc1 2314592736 ARJHFUCZLOQMEL-QHCPKHFHSA-N 445.588 4.847 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2CC[C@H]1C[C@H]2Br 2315499363 WCOCVFRMOJCBRC-ISTVAULSSA-N 438.001 4.959 50 10 IJGE CCCN1C[C@@H](Br)[C@H](Cc2ccc(Cl)c(I)c2)C1 2315548561 IIMLQPMNCQZRQI-VXGBXAGGSA-N 442.566 4.592 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Br)c1ccc(F)cc1F 2316717564 KEIFEEBERSASCI-MRVPVSSYSA-N 444.899 4.708 50 10 IJGE CCCc1sc(Br)cc1[C@@H](Br)C1CCS(=O)(=O)CC1 2338025922 AKKQBEJFCUFZNU-ZDUSSCGKSA-N 430.227 4.724 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@H]([C@@H]3CCCN3C(=O)OC(C)(C)C)C2)C1 2345009657 GEHYMNCPDVBZIJ-IRXDYDNUSA-N 429.443 4.909 50 10 IJGE C[C@@H](Oc1ccc(OCc2ccccc2)cc1)C(=O)N/N=C/c1cccc2cccnc12 20311510 LESHKFCNVQMWEY-WKTMJKCCSA-N 425.488 4.731 50 10 IJGE Cc1c(C(=O)Nc2nc3ccccc3s2)oc2c1/C(=N/NC(=O)c1ccccc1)CCC2 40804175 SIVKUAIUNZJNIQ-WPWMEQJKSA-N 444.516 4.920 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2cc(C)n(-c3ccccc3C)c2C)cc1 58893340 GYILDGDQNBHWHI-GKZBKZLQSA-N 433.552 4.765 50 10 IJGE CCCCCOc1c(OC)cc(/C=N\NC(=O)Nc2ccc(Cl)cc2)cc1[N+](=O)[O-] 169942006 FHKBKQMKWSHRKW-XKZIYDEJSA-N 434.880 4.981 50 10 IJGE C[C@@]1(CI)CC[C@@H](c2cc(Br)c(Br)o2)O1 307717112 JASXOPKOGXLLGE-XVKPBYJWSA-N 449.908 4.850 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@@H](c2ccc(O)c(Br)c2)C1 382703218 DJVFIPJSKKFZPK-VXGBXAGGSA-N 435.156 4.500 50 10 IJGE Cc1cc(C)cc(-n2c(C)c(Br)c(C=NNC(=O)c3ccncc3)c2C)c1 725440295 SDXWBQKLYGLOAY-UHFFFAOYSA-N 425.330 4.632 50 10 IJGE Cc1cc(C)cc([C@@H](C)NC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)c1 730674135 FVLPBTKNXNPOKN-GOSISDBHSA-N 435.499 4.727 50 10 IJGE COc1ccc(Nc2ccccc2C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)cc1 736693669 DQFMSYZNXWFOFT-UHFFFAOYSA-N 440.507 4.665 50 10 IJGE COc1ccc(C(=O)NNC(=O)Nc2cccc(S(F)(F)(F)(F)F)c2)c(OC)c1 762977613 FCRASGZGQDSVMP-UHFFFAOYSA-N 441.378 4.828 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OCc2cccc(F)c2Cl)c(-c2ccccc2)n1 771849543 FJULXYDGLMCHGF-PDGQHHTCSA-N 434.858 4.907 50 10 IJGE Cc1noc(C)c1CSc1ncccc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799752471 MGRWCTRIGNOPNU-UHFFFAOYSA-N 447.442 4.626 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OC[C@@H]2Cc3ccccc32)c(-c2ccc(Cl)cc2)n1 803218651 WCIKDLWQMIGDAM-YMFQVDJJSA-N 442.906 4.907 50 10 IJGE C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 1087433622 DORICNQCXRLSNI-KPOBHBOGSA-N 442.437 4.577 50 10 IJGE CSc1cc(Br)ccc1C=NNC(=O)c1ccc(Br)cc1 1323738687 KQOZLLHIJWZVSY-UHFFFAOYSA-N 428.149 4.697 50 10 IJGE CC(=O)c1ccc(NC(=O)NNc2cccc(OC(F)F)c2Br)cc1C 1669982418 COPQCKFCRLZBMQ-UHFFFAOYSA-N 428.233 4.710 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccccn2)[C@H]1c1cccc2ccccc12 1865681963 BXTHUBDBGPICQX-SFHVURJKSA-N 433.393 4.657 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(Cl)cc2)c1 1865694554 ZFHDCYYHHIIUDR-QFIPXVFZSA-N 434.927 4.900 50 10 IJGE Cc1ccc(SCCCC(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)cc1 1865755636 JGEGXIOAHWIEQN-AWEZNQCLSA-N 441.380 4.789 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1ncccc1Br 1915288356 IYDHQGDLOIDSOX-MRXNPFEDSA-N 440.179 4.906 50 10 IJGE O=C(c1cncc(Br)c1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915312466 KCYLCNLUBUFEHU-KRWDZBQOSA-N 438.163 4.660 50 10 IJGE CCN[C@H](c1cc(Br)c(C)cc1Br)[C@H]1C[C@H]1Br 2020191282 VPDFRFIIYFKBSQ-ZWKOPEQDSA-N 425.990 4.954 50 10 IJGE CCC[C@H](CBr)CN=[S@]1(=O)CC[C@@H](CNC(=O)OC(C)(C)C)C1(C)C 2044704296 BMWWOLRVRLWJND-XESHVACXSA-N 439.460 4.589 50 10 IJGE O=C(Nc1ccc(I)cc1Cl)[C@@H](Br)C1CCCC1 2048139361 JAYLGKLXCOODQX-LBPRGKRZSA-N 442.522 4.837 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(NC(=O)[C@H](Br)C3CCCC3)CCCCC[C@@H]12 2167031749 JSIWQPRITJAYMN-CBGDNZLLSA-N 443.426 4.769 50 10 IJGE CN(Cc1ccccc1)[C@H]1CCCCN(c2ccc(CBr)c([N+](=O)[O-])c2)C1 2188572003 LXVPJAHTAKHKHO-FQEVSTJZSA-N 432.362 4.981 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Cl)C2 2190671250 QXOTZWVJYQGPAK-ZBPZKIAKSA-N 425.523 4.534 50 10 IJGE O=C(Nc1ccc(I)cc1)O[C@@H]1CCCC[C@@H]1CBr 2227209277 MJYKZENZZQLPJX-ZWNOBZJWSA-N 438.103 4.793 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)[C@H]2[C@H](CBr)NC(=O)OC(C)(C)C 2241742120 VSTCTWNVWWBEOZ-OTJKEOIZSA-N 447.414 4.604 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1Cc1ccc(I)c(Cl)c1 2251038675 IEJKFUSIVRQJDQ-GWCFXTLKSA-N 428.539 4.692 50 10 IJGE COC[C@@H]1C[C@@H]1[C@H](Br)Cc1cc(Br)cc(Br)c1 2252830725 HTRDTUZITSPVHC-TVYUQYBPSA-N 426.974 4.800 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCCCBr)C[C@H]1C(F)(F)F 2263164218 FJAYLOJLHHFNLV-AWEZNQCLSA-N 431.337 4.815 50 10 IJGE Cc1cc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)cc(CBr)n1 2272810768 KSZTYJVTEAXGOA-GOSISDBHSA-N 428.296 4.538 50 10 IJGE CCc1c(C)sc(NC(=O)C(C#N)=Cc2cc(OC)c(O)cc2Br)c1C#N 2295670004 XOEULQPZOOBPJW-UHFFFAOYSA-N 446.326 4.513 50 10 IJGE BrC[C@@H]1CC2(CCCC2)CN1Cc1sccc1I 2316753796 BVXFZTLVTQZBTN-NSHDSACASA-N 440.188 4.882 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=Cc2ccc(Br)cc2)c(Cl)c1 2329662908 MQZMMBPUEGAOKV-UHFFFAOYSA-N 433.689 4.825 50 10 IJGE O=C(COc1ccc2cc(Br)ccc2c1Br)NN=C1CCCC1 12491440 MIDHFCVBROWXCS-UHFFFAOYSA-N 440.135 4.790 50 10 IJGE C[C@@H]1CCc2[nH]c3ccc(C(=O)N/N=C\c4cc(Br)ccc4O)cc3c2C1 169891192 SDBBTLYAJIEIFW-RMJYUUNHSA-N 426.314 4.525 50 10 IJGE CC(C)(C)C[C@@H](Br)CNS(=O)(=O)c1c(Cl)cccc1Br 312379322 QZRMGJGVKXUXFI-SECBINFHSA-N 447.620 4.581 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCC1CCOCC1 381201712 PHXYCKUIFQSOKN-UHFFFAOYSA-N 442.973 4.912 50 10 IJGE Brc1ccc([C@@H](CI)OCCOCC2CCC2)cc1 400708016 PSAGXSKQWHTSKB-OAHLLOKOSA-N 439.131 4.759 50 10 IJGE Brc1cnc(N2CC[C@H]3CC[C@H](Br)[C@H]2C3)c(Br)c1 687601474 QXOPQLBMMQPVIN-UBHAPETDSA-N 438.989 4.749 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N(C[C@H]2CCCO2)c2ccncc2)c(C)n1-c1ccc(F)cc1 733972695 WPHFKXNCEBALPB-BTUGVJQXSA-N 444.510 4.747 50 10 IJGE Cn1cc(C(=O)NNC(=O)N[C@@H](c2cccc3ccccc23)C(F)(F)F)c2ccccc21 776009043 QGFZUKVHJGJGMB-FQEVSTJZSA-N 440.425 4.579 50 10 IJGE O=C(NN=Cc1c(Cl)cccc1Cl)C(=O)Nc1ccc(OCc2ccccc2)cc1 1084426471 UQSJPRHCLYLGRQ-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE C/C(=C\C(=O)NNc1c(F)cc(F)cc1Br)c1ccccc1OC(F)F 1136982624 OQBSZDRNXGJIDW-RMKNXTFCSA-N 433.199 4.875 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2cccnc2O)c(C)n1-c1cc(Cl)ccc1Cl 1287497344 UTYZSVXOCKXGRZ-RQZCQDPDSA-N 441.318 4.725 50 10 IJGE C=C(C)[C@H](NC(=O)NNC(=O)c1cc2c(s1)CCCCCC2)c1ccc(F)c(F)c1 1478471286 SRVQAXDUODWICT-FQEVSTJZSA-N 433.524 4.947 50 10 IJGE CC(=O)C(=O)CCC[C@@H]1C[C@]2(C)C(=CC1=O)[C@H](Cl)C[C@H]1[C@H]2CC[C@@]2(C)[C@H](O)CC[C@H]12 1857787855 WFQUYBYCFZVLQH-HFOQUJQTSA-N 435.004 4.651 50 10 IJGE Cc1ccc(NC(=O)COc2cccnc2NC(=O)Nc2ccc(SC#N)cc2)cc1 1858823406 GNLUKRHUVJMHBU-UHFFFAOYSA-N 433.493 4.625 50 10 IJGE CCOc1ccc(-c2csc(/C(C#N)=C(\O)CNC(=O)c3ccccc3)n2)c(OCC)c1 1872755284 GXUBIRVTVMXELS-VZCXRCSSSA-N 449.532 4.830 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)CCl)c1Br 1914352236 DMIGUPYTODTJQG-NSHDSACASA-N 436.824 4.946 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@]23CC[C@](C)(CI)O3)C1 1918347495 SZKPMRIZUITEKJ-KURKYZTESA-N 435.346 4.540 50 10 IJGE Fc1ccc2nc(CCCl)n(-c3csnc3Br)c2c1Br 1926868849 XAGXXJBDKOEQAZ-UHFFFAOYSA-N 439.535 4.927 50 10 IJGE O=C(N[C@H](CCBr)C1CC1)c1scc(Br)c1Br 1942807785 KRVMNMXMINQTJA-MRVPVSSYSA-N 446.002 4.567 50 10 IJGE CN(Cc1ccc(Br)cc1Br)CC1CC(Br)C1 1943850650 RIMICJLDDYJPQR-UHFFFAOYSA-N 425.990 4.817 50 10 IJGE Cc1nn(C)c(Br)c1[C@@H](Br)c1sccc1Br 1986901643 RFLWPRDIAKBWSF-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE C[C@@H]1C[C@H]1N(CCBr)C(=O)c1cc(Br)c(Br)s1 2002024076 OMVMCIMOBKVPQU-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OCC[C@]23CCC[C@@H]2C3)C1 2011683786 ARRNLCHUGQTMJK-AYOQOUSVSA-N 449.373 4.788 50 10 IJGE C[C@H]1CO[C@@](CBr)(Cc2ccc(I)c(Cl)c2)C1 2026563463 KIDUIYOPAFYDLC-NOZJJQNGSA-N 429.523 4.677 50 10 IJGE CC(C)[C@H](Br)[C@H](C)NC(=O)c1cccc(Br)c1Br 2041302463 DAUBWEUMPFSPDO-KWQFWETISA-N 441.989 4.749 50 10 IJGE C[C@](CBr)(NC(=O)c1cc(Br)c(Cl)s1)C(F)(F)F 2052451515 QFLUCIWVAIJGBO-MRVPVSSYSA-N 429.483 4.610 50 10 IJGE COc1cc(F)c(F)cc1[C@H](Br)c1cc(I)sn1 2083949387 UHWWLBYIBNVRIS-NSHDSACASA-N 446.054 4.519 50 10 IJGE CSCC[C@H](Cl)CCNC(=O)c1c(Br)cccc1Br 2094100816 WEBSTORNRSTXGY-SECBINFHSA-N 429.605 4.692 50 10 IJGE C[C@H](c1nscc1Br)N(C)c1cc(CCl)c(Br)cn1 2130019891 WLWAOBSEXKBCMZ-SSDOTTSWSA-N 425.577 4.999 50 10 IJGE CCC(CC)[C@H](Br)CNS(=O)(=O)c1c(C)sc(C)c1Br 2143912528 GIAXOAVOGJSREV-LLVKDONJSA-N 447.258 4.605 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@]12CCCC[C@@H]1N(C(=O)OC(C)(C)C)CCC2 2196908441 XNCUVYRKTWJXTN-IAGYGMIVSA-N 443.426 4.578 50 10 IJGE CCN(C[C@@](C)(CI)O[C@H]1CCC(F)(F)C1)C(=O)OC(C)(C)C 2212200754 PPKNAUSOQDFYDV-SWLSCSKDSA-N 447.304 4.642 50 10 IJGE COc1ccc(Br)c(CBr)c1OC[C@@H]1C[C@@H]1Br 2214869743 IDCJDEYWXHCUGX-XVKPBYJWSA-N 428.946 4.515 50 10 IJGE CC1(CO[C@H](CCl)[C@H](I)CCl)CC2(CC(F)(F)C2)C1 2230633479 KHAGJNDVGJLWKD-NXEZZACHSA-N 427.100 4.868 50 10 IJGE CC(C)(C)OC(=O)NCC[S@@](=O)(=NCCCCCCBr)c1ccccc1 2231091360 IPEIUVMKZBDZEU-SANMLTNESA-N 447.439 4.994 50 10 IJGE COc1ccc([C@@H](Br)C2CC3(CCOC3)C2)cc1I 2269555067 ZNPZNJXJSZEGSC-XGTXGMFGSA-N 437.115 4.553 50 10 IJGE N#CC(=CC1=C(N2CCOCC2)C(=Cc2ccccc2)CC1)C(=O)Nc1ccccc1F 2293035092 CZELQGNDBKMVQU-UHFFFAOYSA-N 429.495 4.678 50 10 IJGE O=C(NN=Cc1c[nH]c2ccccc12)C(=CC=Cc1ccccc1)NC(=O)c1ccccc1 2297322137 HGMWTWDZWWPSEF-UHFFFAOYSA-N 434.499 4.645 50 10 IJGE C[C@H](Br)CCCN(C)Cc1ccc(Cl)c(I)c1 2300239194 VDEFGYXZEGYASV-JTQLQIEISA-N 430.555 4.940 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)N(C)C)c(Br)cc1OCc1ccc(C)cc1 2313567384 GONZHOFOLKBDRD-UHFFFAOYSA-N 443.341 4.730 50 10 IJGE C=CCOc1ccc(C=C(C#N)C(=O)Nc2ccc(C)cc2)cc1I 2313567993 NDCOLZJWYGQLQQ-UHFFFAOYSA-N 444.272 4.710 50 10 IJGE O=C(C=Cc1ccc(F)cc1)NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21 2326839955 DLXNNBKFAUPIBZ-UHFFFAOYSA-N 433.870 4.560 50 10 IJGE CCOc1ccc(C=CC(=O)Nc2sc(C(C)=CC#N)c(C)c2C(=O)OC)cc1OC 2331560135 ALVHSQVRHHEMDD-UHFFFAOYSA-N 440.521 4.829 50 10 IJGE CCN(C[C@@](C)(CBr)OC[C@H](OC)c1ccccc1)C(=O)OC(C)(C)C 2336254890 BFYBTXCIEJPDNX-FXAWDEMLSA-N 430.383 4.801 50 10 IJGE CC1(C)C[C@@H](CCl)CN(C(=O)c2ccc(Cl)cc2I)C1 2365581934 LDBVVEYRDPGQMZ-JTQLQIEISA-N 426.125 4.672 50 10 IJGE Cc1ccccc1C(=O)Nc1ccc(C(=O)NNC(=O)/C=C\c2cccc3ccccc23)cc1 33706060 YUMGREDMZCYMBV-SDXDJHTJSA-N 449.510 4.875 50 10 IJGE Cc1occc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3nc4ccccc4s3)c(C)c21 40823495 AAZXSHXVXWGBEW-WGOQTCKBSA-N 448.504 4.822 50 10 IJGE COc1ccc(-c2csc(-c3ccc(CNC(=O)OCCCl)cc3)n2)cc1OC 170483184 XFDRKLNOIJCFBB-UHFFFAOYSA-N 432.929 4.959 50 10 IJGE CC[C@@](C)(CCCl)NC(=O)c1cc(I)ccc1Br 228564881 XSNHMPMIXIHLDA-ZDUSSCGKSA-N 444.538 4.581 50 10 IJGE COc1cc([C@@H]2CN(Cc3ccccc3)C[C@H]2CI)ccc1Cl 382683379 CNGNDUZHGULHOV-SJORKVTESA-N 441.740 4.999 50 10 IJGE C[C@@H]1[C@@H](CBr)CCN1C(=O)c1cc(Br)c(Br)s1 395201795 MLKKOBSIQFLDOL-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE CC[C@H](Cl)CCCNS(=O)(=O)c1cc(Br)c(C)cc1Br 398537603 DSFYURZZFOHFKH-JTQLQIEISA-N 447.620 4.596 50 10 IJGE CC[C@H](C[C@@H](C)Br)NC(=O)c1cc(Cl)ccc1I 716938013 JOPRUCVTOYEFNJ-PSASIEDQSA-N 444.538 4.627 50 10 IJGE Clc1cccc(N2CC[C@]3(CN(Cc4ccccc4)CCO3)C2)c1CBr 717591585 IUPRZYFCCPRVQX-NRFANRHFSA-N 435.793 4.716 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@]3(CCC[C@H](CI)O3)[C@H]1C2 721763086 SNUUCJRAYQEFJU-ADAWSYLGSA-N 435.346 4.539 50 10 IJGE CC(C)c1nc(C(=O)NNc2ccc(F)c(F)c2F)nn1-c1c(Cl)cccc1Cl 728966719 CXNLEJIRYFMMKN-UHFFFAOYSA-N 444.244 4.872 50 10 IJGE CCOc1ccc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N[C@@H](C)c2cc3ccccc3o2)cc1 744569332 AEUJMKWDDRBQPL-CHXORGPNSA-N 432.476 4.548 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccccc2CSC2=NCCS2)c(C(F)(F)F)c1 799752895 WKJPKCCWAUIXEZ-UHFFFAOYSA-N 436.484 4.670 50 10 IJGE CCn1c(O)nnc1C1CCN(Cc2ccc(CO[Si](C)(C)C(C)(C)C)cc2)CC1 808739502 SWZHSKJCLJDVKV-UHFFFAOYSA-N 430.669 4.905 50 10 IJGE CCOC1=N/C(=C(/C#N)N=Nc2ccc(OC)cc2)NC(=N)[C@@H]1N=Nc1ccc(OC)cc1 1084251880 OZMQFSNQCOMIOT-BZUTUOQYSA-N 446.471 4.648 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)CCCNc2ccc(Br)cc2)cc1 1084508867 GNTMYRWZHCZYHN-UHFFFAOYSA-N 431.378 4.638 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCc2cnc(-c3ccccc3)s2)c1C 1339805119 VEIKORYMZHDIJV-LASGFXPTSA-N 434.565 4.659 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCc2cnc(-c3ccccc3)s2)c1C 1339805122 VEIKORYMZHDIJV-QREGZJMFSA-N 434.565 4.659 50 10 IJGE Cc1sc2nc(CCC(=O)NNc3ccc(OCc4ccccc4)cc3)nc(O)c2c1C 1470368218 UEBSUSQAHUMVNG-UHFFFAOYSA-N 448.548 4.669 50 10 IJGE C#C[C@@H](NC(=O)/C(C#N)=C\c1cc(C)n(CC(C)C)c1C)c1ccc(Br)cc1 1596979006 SEPGLBVBEWMAGA-ZRELAVNMSA-N 438.369 4.921 50 10 IJGE Cc1cc(Br)ccc1SCC(=O)NNc1nc2ccccc2[nH]c1=S 1633439160 DOHOSERGROZBAC-UHFFFAOYSA-N 435.372 4.599 50 10 IJGE C=C(CNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1)c1ccccc1 1682940851 KVXJTHUZNMYZLH-UHFFFAOYSA-N 449.938 4.885 50 10 IJGE Cc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 1865682337 MHFPFFLRNMYRQL-SFHVURJKSA-N 429.282 4.904 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccc(C)cc2)cc1 1865693656 LKDOBCAIRGUKIA-QHCPKHFHSA-N 428.536 4.809 50 10 IJGE CN(CC1(CBr)CC1)C(=O)c1cc(Br)sc1Br 1915533204 YMMLFFIZLRFKLV-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE O=C(Nc1ccc(F)c(CBr)c1)c1csc(I)c1 1924908930 BOFHEHPGHORMDP-UHFFFAOYSA-N 440.075 4.639 50 10 IJGE C[C@](CBr)(NC(=O)c1cc(Br)c(Br)s1)C1CC1 1942792274 OANRVSZGRLRFNN-LLVKDONJSA-N 446.002 4.567 50 10 IJGE CC[C@H](C[C@H](C)Br)NC(=O)c1c(Br)cccc1Br 2033085721 GGPBETQPBUQHPX-DTWKUNHWSA-N 441.989 4.894 50 10 IJGE CC[C@H](Br)c1cn(Cc2cc(Br)ccc2Br)nn1 2054711079 AYDJDTFWCSEHFX-JTQLQIEISA-N 437.961 4.697 50 10 IJGE Cl[C@H]1C[C@H]2CC[C@H]1[C@@H](Nc1ncc(I)cc1Br)C2 2084033127 AXHPTANUXYYODA-KSHNYCKESA-N 441.538 4.657 50 10 IJGE Clc1cc(CN2CC[C@@H](Br)[C@@H]2C2CC2)ccc1I 2086654525 HESNMNBSSCAIJP-RISCZKNCSA-N 440.550 4.692 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]23CCC[C@@]2(CN(C[C@H](CBr)C(C)(C)C)C3)C1 2106780903 COOVRUORVKGZKK-ORYQWCPZSA-N 429.443 4.767 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2CN(CC3(CBr)CCCCC3)C(C)(C)[C@H]2C1 2106788562 QORJNTCSGYLHNS-SJORKVTESA-N 429.443 4.909 50 10 IJGE CC(C)n1cc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)C2CC2)cc1CBr 2123272065 WAVQXECIUYIQBF-MRXNPFEDSA-N 439.419 4.953 50 10 IJGE O=S(=O)(N1CCC[C@@H](CCBr)C1)N(Cc1ccccc1)C1CCCCC1 2123362683 IOEIOCXRJIPVNZ-IBGZPJMESA-N 443.451 4.563 50 10 IJGE C[C@@]1(Cn2c(CCCl)nc3cncc(Br)c32)CCN(Cc2ccccc2)C1 2151782807 DYNRERQEULPCHT-OAQYLSRUSA-N 447.808 4.887 50 10 IJGE CC1(C)CO[C@H](COc2c(Br)cc(Br)cc2CCl)CO1 2176668120 QDYWYALQVWOXLA-LLVKDONJSA-N 428.548 4.523 50 10 IJGE CC[C@H](N)Cc1cc(Cl)cc(Br)c1OCC1CC(Br)C1 2196937899 MJRXZYMFDDKESM-OCTTZUBCSA-N 425.592 4.935 50 10 IJGE O=C(c1ccc(Cl)cc1Br)N1CC[C@@H](C(F)(F)CBr)C1 2197762605 JJEYUOVIJMWFMM-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE Cc1sc(Br)c([C@H](Br)[C@@]23CCC[C@@H]2CS(=O)(=O)C3)c1C 2203025058 USXATHPBMTVARZ-SCDSUCTJSA-N 442.238 4.778 50 10 IJGE Brc1cnc(N2C[C@@H](Br)CC23CCCC3)c(Br)c1 2224114638 ZBJNBLXRGDOPSF-JTQLQIEISA-N 438.989 4.893 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1Cc1csnn1 2234060718 YAXGXGPESWZNQS-LURJTMIESA-N 436.560 4.761 50 10 IJGE CC1CC(CBr)(CN2CCCC[C@H]2C(F)(F)CNC(=O)OC(C)(C)C)C1 2265313081 CMCKFWZKTNNSHW-CSLYMUCUSA-N 439.385 4.812 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(CC2(CBr)CCCC2)[C@H](C(F)(F)F)C1 2266311127 XCEBAJJPROLSPE-KBPBESRZSA-N 443.348 4.862 50 10 IJGE COc1ccc([C@H](Br)C(C)(C)[C@H]2CCCO2)cc1I 2269555011 ZEQOZRJXQRRLRE-KGLIPLIRSA-N 439.131 4.941 50 10 IJGE O=C(NCC1(CCl)CC(F)(F)C1)c1c(Br)cccc1Br 2281650938 IVOBBWUMIRZMKO-UHFFFAOYSA-N 431.502 4.596 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCSC[C@H]1CCBr 2285845267 YCRFPKBBLXBNGI-MRVPVSSYSA-N 445.579 4.584 50 10 IJGE Cc1cc(S(=O)(=O)N(C[C@H](C)Br)CC(C)(C)C)sc1Br 2288028428 UIBUDBGVCRZGCA-JTQLQIEISA-N 447.258 4.639 50 10 IJGE COc1cccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3ccc([N+](=O)[O-])cc3C)c2C)c1 2294147020 XIMAKFAHTXCSOS-UHFFFAOYSA-N 430.464 4.865 50 10 IJGE C[C@@H](Br)CCCN(C)Cc1ccc(Cl)c(I)c1 2300239195 VDEFGYXZEGYASV-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE CC(C)N(Cc1ccc(I)c(Br)c1)C[C@H](C)Cl 2306220508 YHIIFNVTEWUWKT-JTQLQIEISA-N 430.555 4.891 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@@H](Cc2ccc(CC)cc2)C(=O)N1c1ccc(C)c(C)c1 2314593591 PRMIMAHERHXKGI-QHCPKHFHSA-N 445.588 4.594 50 10 IJGE O=C(O)c1ccc(-c2ccc(C=NNC(=O)c3ccc4[nH]c5c(c4c3)CCCC5)o2)cc1 2321672368 ZQDXGDKJABHXLJ-UHFFFAOYSA-N 427.460 4.769 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@@H]1CCC[C@H](C(F)(F)F)C1 2343416439 QCAQKYUXQBNMKO-IKGGRYGDSA-N 436.312 4.842 50 10 IJGE COc1ccc([C@@H](Br)C2(C(C)(C)OC)CC2)cc1I 2343666882 JYLRVQGLWJXFBY-CYBMUJFWSA-N 439.131 4.941 50 10 IJGE COC[C@]1(C)C[C@@H](NC(=O)OC(C)(C)C)CN1CC1(CBr)CCCCCC1 2364207675 AOPJDAPRLIXQTJ-XLIONFOSSA-N 447.458 4.726 50 10 IJGE COc1ccc(C[C@@H](Cl)c2c(Br)c(Br)nn2C)cc1F 2364230749 QIXQDRXUXBPJKY-MRVPVSSYSA-N 426.511 4.615 50 10 IJGE COc1ccc(CCCCO[C@@H](CCl)[C@H](I)CCl)cc1 2370109837 CQZGPSUQERFXSR-CABCVRRESA-N 431.141 4.684 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(C(=O)NNC(=O)/C=C\c3cccc4ccccc34)cc2)c1 33458666 PRKOUTBOXSKHCP-VKAVYKQESA-N 449.510 4.875 50 10 IJGE Cc1cccc(C)c1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccccc1F 38652036 YKFAEDXXGSZCJI-XMMPIXPASA-N 444.462 4.645 50 10 IJGE Cc1ccccc1OCCCC(=O)Oc1ccc(/C=C(\C#N)C(=O)NCc2ccco2)cc1 40934993 XSYMDSWMCDUVQQ-LTGZKZEYSA-N 444.487 4.576 50 10 IJGE Fc1ccc(Br)cc1-n1c(CCCl)nc2cc(Br)cnc21 98040065 WIWDVLDHXHWLOE-UHFFFAOYSA-N 433.506 4.866 50 10 IJGE CCCn1c(CBr)nnc1-c1cc(Br)ccc1Br 161341974 QQCFTZMLSPSGTJ-UHFFFAOYSA-N 437.961 4.775 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)cc(Cl)c1O 169891412 KQAVFWQUZPQHMS-UWLYNBDASA-N 425.916 4.814 50 10 IJGE O=C(N/N=C\c1ccc(OCCCc2ccccc2)cc1)c1ccc2nc(S)[nH]c2c1 169917497 AZDGYKQTBONIEB-XYGWBWBKSA-N 430.533 4.627 50 10 IJGE CC(C)C[C@H](Br)CNC(=O)c1cc(Br)cc(Br)c1 232639239 YQYOPBAQECKSSF-LBPRGKRZSA-N 441.989 4.751 50 10 IJGE CC(=NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1)c1ccc(-n2ccnc2)cc1 254430706 YOTQXUVXEYGYGP-UHFFFAOYSA-N 440.532 4.735 50 10 IJGE CC(C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)=NNC(=O)c1ccccc1 254506302 URUBKMSOSXNCIF-UHFFFAOYSA-O 437.503 4.786 50 10 IJGE CC[C@@](C)(CO[C@](C)(CI)c1ccccc1Br)OC 319264035 BYDPGBVDKWNUIC-LSDHHAIUSA-N 441.147 4.931 50 10 IJGE Cc1cc(S(=O)(=O)N2CCCC[C@@H]2C[C@H](C)Br)sc1Br 383529305 ALMMOQVHDSYTKG-WDEREUQCSA-N 445.242 4.536 50 10 IJGE FC(F)Oc1c(Br)ccc(I)c1CBr 575682091 JMWGUDBPUIEGJE-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE FC(F)Oc1c(Br)cc(CBr)cc1I 575682615 WCDOINJIERFQGX-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE C[C@]12CN(Cc3ccccc3)C[C@H]1CN(c1cc(CBr)sc1[N+](=O)[O-])C2 702106847 GNUFGDXTCGKOHD-HNAYVOBHSA-N 436.375 4.510 50 10 IJGE CCO[C@@H](CO[C@@H](CI)c1ccccc1Br)C1CC1 703472117 VSLHKMRHWNFGOM-GJZGRUSLSA-N 439.131 4.757 50 10 IJGE C[C@H]1CCN(C(=O)c2scc(Br)c2Br)[C@H]1CBr 705518946 SYWADLBOGKPHDY-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE O=C(CSCc1ccccc1Br)NN=Cc1ccccc1Br 725424469 XOXGTONGQNKEAF-UHFFFAOYSA-N 442.176 4.595 50 10 IJGE C[C@H]1C[C@H](C)CC[C@@H]1NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 733113889 HIFUKWCPAUMOOU-PMGBMGRRSA-N 435.959 4.965 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCCc2ccc(O)nc2)c(C)n1-c1cccc2ccccc12 1157169454 OQJNYAJIIFBWDN-HAHDFKILSA-N 436.515 4.614 50 10 IJGE C#CCCCC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)C[C@@H](C)C2 1558513247 PRKYRPALKOKPIL-GROYHEBESA-N 427.504 4.515 50 10 IJGE C=C(C)CN1CCC(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(OCC)cc3)c2C)CC1 1632862714 IQIAYXAHJLTKPM-KQWNVCNZSA-N 446.595 4.557 50 10 IJGE CCN(C(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc(OC)cc1)CCC2)c1ccccc1 1772746044 PXOOFWLDFNYSAW-UHFFFAOYSA-N 445.519 4.734 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CCC)nn3CC(C)C)cc1OC 1865697167 OKVLXZYPMGRWMT-QFIPXVFZSA-N 438.572 4.897 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)N/N=C\c1ccccc1Br 1865762322 ZJZWGHPHCSMQMU-MYKKPKGFSA-N 430.252 4.862 50 10 IJGE CSCC[C@H](NC(=O)CCCc1ccccc1C)C(=O)Nc1ccc(SC#N)cc1 1867121242 FHNCHMOJRNRQDQ-NRFANRHFSA-N 441.622 4.768 50 10 IJGE C[C@@H](C[C@@H](C)Br)NC(=O)c1csc(Br)c1Br 1937737547 KLUPNKZWGGXMPP-RITPCOANSA-N 433.991 4.565 50 10 IJGE Cn1nc([C@@H](Br)c2ccc(F)c(Br)c2)cc1Br 1945319833 LWFGWCFNTNTXBS-NSHDSACASA-N 426.909 4.569 50 10 IJGE CC1(C)[C@H](Br)CCN1Cc1c(Br)cccc1Br 1945333727 ULZFAVMEVMNALZ-GFCCVEGCSA-N 425.990 4.959 50 10 IJGE C[C@]12CN(Cc3ccccc3)C[C@H]1CN(c1nc(Cl)c(CBr)s1)C2 1949585255 DGKUNVVJFUCGFS-KBXCAEBGSA-N 426.811 4.650 50 10 IJGE O=Cc1cc(Br)c(OCC2CC(Br)C2)c(Br)c1 2020214693 QHNZMWCLORIAPF-UHFFFAOYSA-N 426.930 4.576 50 10 IJGE FC(F)Oc1c(I)cc(CBr)cc1OC(F)(F)F 2060221704 ZDZJWPOJQXZFNG-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE C[C@H](CCCCCI)NCCOc1ccc(Br)cc1 2117887942 RRYNTAAJDGVIMZ-CYBMUJFWSA-N 440.163 4.801 50 10 IJGE Cc1c(Br)ccc([C@@H](Cl)[C@H]2CCCCS2(=O)=O)c1Br 2138862148 FUQJKFGIPSJPBD-DGCLKSJQSA-N 430.589 4.767 50 10 IJGE O=C(N[C@@H]1C[C@H]2CC[C@H]1[C@@H](Cl)C2)c1cc(Br)sc1Br 2139718513 IZMLLGPRBABDSL-ZRUAGYDASA-N 427.589 4.799 50 10 IJGE CC(C)(C)OC(=O)N1CCC(C)(C)[C@@H](CNC(=O)c2ccc(CBr)cc2)C1 2162494945 OVGOHRSFTNWDNT-KRWDZBQOSA-N 439.394 4.595 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(NC(=O)[C@@H](Br)C3CCCC3)CCCCC[C@@H]12 2167031754 JSIWQPRITJAYMN-LLGFUMIMSA-N 443.426 4.769 50 10 IJGE Cn1cnc(Cl)c1CC(CBr)(CBr)c1ccccc1Cl 2168232541 WZHAAMYRJXONPR-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE ClCc1ccc(Br)c(Cl)c1-n1cnc2c(Br)ncnc21 2175915707 CMLCAKWEVFLENX-UHFFFAOYSA-N 436.922 4.733 50 10 IJGE CCC(CC)N(CC)S(=O)(=O)c1cc(CBr)ccc1Br 2179858958 WGAXVOIVGKVSNK-UHFFFAOYSA-N 427.202 4.543 50 10 IJGE CCC[C@H](CC)N(C)S(=O)(=O)c1ccc(CBr)cc1Br 2193557613 KJQOQGIHCFITTQ-LBPRGKRZSA-N 427.202 4.543 50 10 IJGE O=C(c1c(Cl)cccc1Br)N1CC[C@@H](C(F)(F)CBr)C1 2197763605 PGSQRLBZZKXONU-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE Cc1cc(Br)c(C(=O)NC2CC([C@H](F)CBr)C2)cc1Cl 2199059214 QSLSPHPFRSHONL-KJHLLKJSSA-N 427.539 4.652 50 10 IJGE Cc1cc(Br)c([C@H](Cl)[C@@H]2CCCS2(=O)=O)c(C)c1Br 2227352050 BFGHKLRILDXXME-GXFFZTMASA-N 430.589 4.686 50 10 IJGE BrC[C@@H]1C[C@H]2CCCC[C@@H]2N1Cc1ccc(I)cc1 2231964298 KNASCRFVGUYHQI-KBMXLJTQSA-N 434.159 4.819 50 10 IJGE CCCN(C[C@@H](C)Cl)C(=O)c1cc(Br)ccc1I 2259762481 MFEUETGLWFMWIQ-SECBINFHSA-N 444.538 4.533 50 10 IJGE O=C(N[C@H](CCl)c1ccsc1)c1ccc(Cl)c(I)c1 2268339970 KKPHQUFXWLUYOV-GFCCVEGCSA-N 426.106 4.716 50 10 IJGE CC(C)[C@H](CCCl)NCc1ccc(I)c(Br)c1 2306218503 AQEMVAFQJLHOBJ-ZDUSSCGKSA-N 430.555 4.797 50 10 IJGE C[C@@H]1CCN(Cc2cc(I)ccc2Cl)[C@@H]1CBr 2307324120 IOKPQFJSJLHHCY-NOZJJQNGSA-N 428.539 4.550 50 10 IJGE Cc1cccc(C(=O)NC(C)(C)[C@H](Br)C(C)C)c1I 2340407065 RFYFPNYIXWHJMV-CYBMUJFWSA-N 438.147 4.528 50 10 IJGE CN(C[C@@H]1CN(CC2(CBr)CCCCC2)CC12CC2)C(=O)OC(C)(C)C 2340535974 KIYXHJTWXWIDKG-QGZVFWFLSA-N 429.443 4.911 50 10 IJGE CC(C)(C)OC(=O)N1CC(OC2CCN(C[C@](C)(CBr)C(C)(C)C)CC2)C1 2380166347 YSBJQYOMCDCPCG-NRFANRHFSA-N 447.458 4.534 50 10 IJGE COc1ccc(/C(C)=N\NC(=O)COc2ccc(C(C)(C)C)cc2Br)cc1 5909893 WESIEUMPNWZVGY-UCQKPKSFSA-N 433.346 4.674 50 10 IJGE O=C(N/N=C/c1ccc(-c2cccc(Cl)c2)o1)C(=O)Nc1cccc(C(F)(F)F)c1 33898130 PKVHCPKKAGLMHB-OPEKNORGSA-N 435.789 4.708 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1cc([N+](=O)[O-])ccc1Br)[C@@H]2Br 35025440 JGXPZIMLYGPVRX-WQVCFCJDSA-N 446.139 4.886 50 10 IJGE COc1ccc2ccccc2c1/C=N/NC(=O)CSc1nnc(-c2ccccc2)s1 40947744 FDDMHQDIHPNPOX-YDZHTSKRSA-N 434.546 4.609 50 10 IJGE COc1ccc(CCN2C(=O)C(C#N)=C(C)/C(=C\Nc3cccc4ccccc34)C2=O)cc1 101233916 SPJKOYIMLLHKJM-JJIBRWJFSA-N 437.499 4.596 50 10 IJGE CC[C@](C)(CO[C@@H](CI)c1cccc(Br)c1)OC 319034470 BVJASZNWMHDSLR-UONOGXRCSA-N 427.120 4.757 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1Cc1ccn(Cc2ccccc2)n1 389615061 UQEXGMRKKXQOIB-ZDUSSCGKSA-N 430.737 4.787 50 10 IJGE Clc1cccc(C(CBr)(CBr)CO[C@@H]2CCCOC2)c1 394474282 VHOPIYXHLJZTNG-CQSZACIVSA-N 426.576 4.563 50 10 IJGE O=C(CBr)c1cc(Br)cc(Br)c1Br 575715345 XNQIOVATUGKTPS-UHFFFAOYSA-N 435.735 4.552 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1C(=O)c1cc(Br)ccc1Br 705613040 SQWQMVJELUZQJN-WPRPVWTQSA-N 439.973 4.600 50 10 IJGE O=S(=O)(N[C@@H](CCBr)C1CCCCC1)c1cc(Br)cs1 725085228 JDZGRJRPVVOIQP-LBPRGKRZSA-N 445.242 4.523 50 10 IJGE O=C(NNc1cccc(F)c1F)c1cccnc1Oc1ccc(F)cc1Br 743720604 IPDLSIOWDJLPAU-UHFFFAOYSA-N 438.203 4.811 50 10 IJGE CSc1ccccc1[C@@H](C)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 800578961 FYLBNGQDIUPSBP-KETZHDHUSA-N 441.560 4.970 50 10 IJGE Cc1ccc(-n2nc(C)c(C=NNC(=O)c3ccc(Br)cc3)c2C)c(C)c1 1084160179 YWZOBWLKZNENTD-UHFFFAOYSA-N 425.330 4.632 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1)c1ccccc1 1469468777 NYHCDKYUHPMABQ-XMMPIXPASA-N 443.547 4.694 50 10 IJGE O=C(NNc1ccccc1Oc1ccccc1)c1ccc2c(c1)nc(O)n2CC(F)(F)F 1628598847 KFALQMDEJFXJBL-UHFFFAOYSA-N 442.397 4.853 50 10 IJGE CC(=O)C(=O)CCC[C@H]1C[C@]2(C)C(=CC1=O)[C@H](Cl)C[C@H]1[C@H]2CC[C@@]2(C)[C@H](O)CC[C@H]12 1857787856 WFQUYBYCFZVLQH-RCVMWNMUSA-N 435.004 4.651 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3CC(C)C)cc1OCC 1865687149 KMKHTYLSTLJULJ-QFIPXVFZSA-N 438.572 4.897 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1ccc(C)cc1 1865690981 GMHNEXVWFSBAJU-QHCPKHFHSA-N 426.520 4.585 50 10 IJGE Cc1nn(C)c2c1[C@H](c1ccc(OCc3ccc(Cl)cc3Cl)cc1)C(C#N)=C(N)O2 1865700893 HDVHOXYBKPZYCM-HXUWFJFHSA-N 441.318 4.833 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2)[C@H]1c1ccccc1[N+](=O)[O-] 1865709354 AIMOOGVQMUPGMS-NRFANRHFSA-N 435.443 4.666 50 10 IJGE Cc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865713288 VRPGBEROZBQWPM-GOSISDBHSA-N 442.262 4.614 50 10 IJGE O=C(N[C@H](CC1CC(Br)C1)C(=O)O)OCC1c2ccccc2-c2ccccc21 1880432091 OECLZONWYNIENY-RUZSNYSVSA-N 444.325 4.542 50 10 IJGE CCN(CC(C)(C)CI)C1CCC(NC(=O)OC(C)(C)C)CC1 1904653035 HMUSWQPLLWYGIT-UHFFFAOYSA-N 438.394 4.605 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cc2c(s1)CCSC2 1916335356 QOISRTQUTUOFTE-MRXNPFEDSA-N 440.428 4.590 50 10 IJGE CCc1nc(Br)c(Br)n1C[C@@H](CBr)C1CCC1 1942155289 XRNSJABKQNMYKA-SECBINFHSA-N 428.994 4.782 50 10 IJGE BrC[C@H]1CCCN(Cc2cc(Br)ccc2Br)C1 2006503792 SADXVDPPZUZNTG-SNVBAGLBSA-N 425.990 4.819 50 10 IJGE CN(C(=O)c1csc(Br)c1Br)C1(CCBr)CC1 2015866742 WRTYLMKGGGPRLG-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Cl)c2)CC[C@@H]1Br 2026560695 MCIZPPMRURVCIH-KOLCDFICSA-N 428.539 4.550 50 10 IJGE CCC[C@H](CBr)CN=[S@](C)(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C 2044706539 VCXXDWVGGNPTLD-OKXMYEFYSA-N 441.476 4.835 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)[C@H](Br)C2CCCC2)n1 2082966111 SGBYXMVSNYXTQT-ZWNOBZJWSA-N 432.384 4.621 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@@H]2CCC[C@]2(CCl)C1 2103177297 WIICUULWBTWHTN-SDBXPKJASA-N 427.589 4.754 50 10 IJGE CCC(CC)(CBr)CN1CC[C@H](C(F)(F)F)[C@@H](NC(=O)OC(C)(C)C)C1 2106783146 XHOVOEURZPTKQU-KBPBESRZSA-N 445.364 4.965 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C[C@@H](CBr)c2ccccc2)C1 2106783969 DZAIFUQVHXZPOU-YTQUADARSA-N 425.411 4.790 50 10 IJGE C[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)CN1C[C@H](CBr)c1ccccc1 2106787119 YBLPQONEBSHBKR-LMMKCTJWSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C(F)(F)F)CCCN1C[C@@H](CBr)CC1CC1 2112864896 WHAYTJLPWRUSIJ-RHSMWYFYSA-N 443.348 4.719 50 10 IJGE FC1(F)C[C@]12C[C@H]2[C@H](Br)c1cc(I)cc2c1OCC2 2115294689 MPFJZIOYQPZMNO-LOWVWBTDSA-N 441.053 4.707 50 10 IJGE Fc1cc(CBr)ccc1N1CCN(Cc2ccccc2)C[C@H]1C(F)(F)F 2130159925 PPOVNTZORRKEQK-SFHVURJKSA-N 431.271 4.974 50 10 IJGE C[C@H](Br)C[C@H]1CCCCCN1S(=O)(=O)c1cscc1Br 2143915853 UJPZHZMTEQGVKZ-WDEREUQCSA-N 445.242 4.617 50 10 IJGE O=C(N1CCN(CC2(CBr)CCCCC2)CC12CCCCC2)C(F)(F)F 2163064171 SVUDZNQKWLAKNP-UHFFFAOYSA-N 439.360 4.741 50 10 IJGE C[C@@H](Cl)c1nc2cccc(Br)c2n1C[C@H]1COCCN1Cc1ccccc1 2194649714 OFKGPYJPRZYZIW-WBVHZDCISA-N 448.792 5.000 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@H]([C@H](C)Br)C(F)(F)F)cc1Br 2195309669 JMSYGUNZJSCNQA-QUBYGPBYSA-N 437.481 4.855 50 10 IJGE Clc1cc(CN2C[C@@H](Br)CCC23CC3)ccc1I 2220275854 ZIFROCKPEDXFBF-NSHDSACASA-N 440.550 4.837 50 10 IJGE Clc1cc(OCCOCCOCCOCc2ccccc2)ccc1CBr 2227772884 UKABOJYHGJBQBE-UHFFFAOYSA-N 443.765 4.864 50 10 IJGE CC1CC(CBr)(CN2C[C@]34CCC[C@]3(C2)CN(C(=O)OC(C)(C)C)C4)C1 2265307628 IOWITXGPBGZGBW-APHPEJJXSA-N 427.427 4.521 50 10 IJGE C[C@H](NC(=O)c1cc(Br)c(F)cc1Cl)[C@@H]1CCC[C@H]1Br 2285836022 WCUDBYQXASWNNQ-OYNCUSHFSA-N 427.539 4.924 50 10 IJGE N#CC(=Cc1cn(Cc2cccc(Cl)c2)c2ccccc12)C(=O)NCc1ccccn1 2295672418 WLJQOTAKECAQKT-UHFFFAOYSA-N 426.907 4.961 50 10 IJGE Clc1ccc(CN2CCCC[C@H](Br)C2)cc1I 2300242611 MICTYDRRBOGJEM-NSHDSACASA-N 428.539 4.694 50 10 IJGE C[C@@H](CCCl)CCNCc1ccc(I)c(Br)c1 2306219286 KHQZCCAHXFDFDD-JTQLQIEISA-N 430.555 4.798 50 10 IJGE CC(C)(CI)CN1CCN(C(=O)OC(C)(C)C)Cc2ccccc21 2306810599 VJFXVCQQHNIMPU-UHFFFAOYSA-N 444.357 4.705 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cc(Cl)c(F)cc1F 2320361383 RDTWLKYQCGWWBQ-ZDUSSCGKSA-N 432.692 4.718 50 10 IJGE COc1cc(C=C(C#N)c2ccccc2OC)ccc1OC(=O)c1ccc([N+](=O)[O-])cc1 2320506213 DXVGMXSZMAQGPR-UHFFFAOYSA-N 430.416 4.895 50 10 IJGE N#CC(=CNC(c1ccccc1)c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 2325254987 TVEWZNLHKYBVAI-UHFFFAOYSA-N 432.867 4.973 50 10 IJGE FC1CC(CBr)(COCc2cc(I)ccc2Cl)C1 2327260802 WDCUOPYCOIEZTB-UHFFFAOYSA-N 447.513 4.974 50 10 IJGE CC1(C)COC[C@@H]1CO[C@@H](CI)c1cccc(Br)c1 2339010724 NBGQSHKRMZNXSD-OCCSQVGLSA-N 439.131 4.614 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)COc2ccc(Cl)cc2Cl)cc1 14025399 ONIOUWMUDWQWJB-UHFFFAOYSA-N 439.339 4.793 50 10 IJGE C/C(CCc1ccco1)=N\NC(=O)CCC(=O)Nc1cc(C(F)(F)F)ccc1Cl 27497971 AMOGKJPINPVEJA-BRJLIKDPSA-N 429.826 4.795 50 10 IJGE COc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3cccc(C)c3)c(C)c21 40813202 NBBYJQAAQHGKQP-ZXVVBBHZSA-N 431.492 4.628 50 10 IJGE Cc1c(C(=O)NC(C)C)oc2c1/C(=N/NC(=O)C(c1ccccc1)c1ccccc1)CCC2 40815489 BUHDYTNTOAZMOX-XHLNEMQHSA-N 443.547 4.715 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)Nc3cc(NC(C)=O)ccc3F)c2C)cc1 105729321 JSPNRHMVSNTJSB-XDHOZWIPSA-N 446.482 4.746 50 10 IJGE Cc1cc(Br)ccc1N/C=C(/C#N)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 217229645 WTECREHJASRDQN-LUAWRHEFSA-N 435.665 4.777 50 10 IJGE CCC[C@H](Br)CNC(=O)c1cc(Br)c(Br)s1 218438506 BEQAIUUJWGBSFD-LURJTMIESA-N 433.991 4.567 50 10 IJGE CC[C@H](CCBr)CNC(=O)c1cc(Br)cc(Br)c1 234004675 KPBIWRDLCULDBJ-SECBINFHSA-N 441.989 4.753 50 10 IJGE O=C(NN=Cc1cc(Br)ccc1O)c1cc(-c2ccccn2)nc2ccccc12 254815830 HLANZUXZVAANJS-UHFFFAOYSA-N 447.292 4.529 50 10 IJGE C[C@H](Cl)c1nc2c(Br)cccc2n1C[C@@H]1CN(Cc2ccccc2)CCO1 380403926 BZYFXZNOUCJUNH-RDJZCZTQSA-N 448.792 5.000 50 10 IJGE O=c1sccn1CCC(CBr)(CBr)c1ccccc1Cl 700207863 XHISEWGRSFCUOA-UHFFFAOYSA-N 439.600 4.681 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1C(=O)c1cc(Br)sc1Br 705491835 TXBDHPQIMDVUAA-RQJHMYQMSA-N 446.002 4.661 50 10 IJGE BrCc1ccc(N2CC3(CN(Cc4ccccc4)C3)C2)c(Br)c1 706115405 XNQREHOKRXNMHA-UHFFFAOYSA-N 436.191 4.666 50 10 IJGE Cc1cc(Br)c(C(=O)N2CCS[C@H](CCBr)C2)cc1Cl 720060204 HVZQMHHQDRBRHZ-SNVBAGLBSA-N 441.616 4.754 50 10 IJGE CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNc1c(F)cccc1F 735699873 BDIOFDNIEACRSN-MRXNPFEDSA-N 430.282 4.559 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCn4c(C(C)C)nnc4[C@@H]3C)c2C)c1 784685121 DWNBZJIQFLIXJY-ISXGRJCASA-N 442.567 4.628 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(C(=O)Nc3ccccc3)cc2)c(C(F)(F)F)c1 799394805 JUEYVHJFRAHBST-UHFFFAOYSA-N 439.397 4.978 50 10 IJGE C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1 804207517 JYZKLJQNBUTAIJ-QBFSEMIESA-N 443.385 4.617 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)ccc1OCc1cccc(C(=O)O)c1 1084584511 IZPJDXAPJSQIAM-CIAFOILYSA-N 442.471 4.827 50 10 IJGE C/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1 1623476957 NXHTWBXPMFMPJK-FBMGVBCBSA-N 440.478 4.543 50 10 IJGE Cc1c(C(=O)NCc2ccccc2)oc2c1C(=NNC(=O)c1cccc(Cl)c1)CCC2 1772746022 OBIRHVROTMZEAR-UHFFFAOYSA-N 435.911 4.642 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2)cc1 1865693291 ITAAEHXOKBVVRL-QGZVFWFLSA-N 426.398 4.508 50 10 IJGE CCN(CC)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CC)cc1 1865702132 NNXIAUZHEAZGDG-JOCHJYFZSA-N 443.551 4.643 50 10 IJGE O=C(N[C@@H](C[C@H]1C[C@@H](Br)C1)C(=O)O)OCC1c2ccccc2-c2ccccc21 1877472988 OECLZONWYNIENY-MNVSYLFESA-N 444.325 4.542 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1Cc1ccc(Br)cc1Br 1943860915 ZNZLZCNEOVRLTP-BXKDBHETSA-N 425.990 4.959 50 10 IJGE C[C@@H]1CN(C(=O)c2csc(Br)c2Br)CC[C@H]1Br 1945189436 QMQKPDOGNHQBPS-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE Cc1nc(C(=O)N(Cc2ccccc2)[C@H](C)CBr)c(Br)s1 1956718989 CAFTVCXHAFHTLP-SNVBAGLBSA-N 432.181 4.640 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cc(Br)cs1 1961678938 NIVWBXZFGZPJBH-AWEZNQCLSA-N 447.192 4.563 50 10 IJGE COC[C@H](C)COc1c(Br)cc(Br)cc1CBr 2022005212 LGUBTTATWDHCRQ-QMMMGPOBSA-N 430.962 4.768 50 10 IJGE CC[C@@H](C)[C@H](CBr)NC(=O)c1cc(Br)c(Br)s1 2023035741 NYOZWUFIHZODIH-SVRRBLITSA-N 448.018 4.813 50 10 IJGE CCCCN(CCBr)Cc1ccc(I)c(Cl)c1 2026559599 BQHWFRQMOBMYBO-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE O=C(CBr)c1ccc(C(F)(F)F)c(C(F)F)c1I 2060395582 SJDQOMCUZRPJAG-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE Brc1cccc(CN2CC[C@H](Br)[C@H]3CC[C@H]32)c1Br 2069997354 SUBTVUVWIDRIJW-NTZNESFSSA-N 438.001 4.959 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC2(CCC2)C[C@@H]1CCl 2095173905 SWPRZPJDDMRLHT-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1cc(F)ccc1Br 2117896087 XRQWEMGWPCBSJJ-SNVBAGLBSA-N 442.110 4.702 50 10 IJGE FC(F)(F)c1cnc(NC[C@@H](CCl)C(F)(F)F)c(I)c1 2161573010 ZTVJXSRQSMBNHE-ZCFIWIBFSA-N 432.533 4.534 50 10 IJGE CN(Cc1ccc(NC(=O)OC(C)(C)C)nc1)C(=O)c1ccc(CBr)cc1 2165641473 JBDJCYLRLGHBKE-UHFFFAOYSA-N 434.334 4.596 50 10 IJGE O=C(Nc1cc(Cl)cc(Br)c1OC(F)F)[C@H]1C[C@@H](Br)C1 2196881556 ULSJADVUJAWYMQ-OLQVQODUSA-N 433.474 4.816 50 10 IJGE CC1CC(CBr)(CN2CCOc3ccc(CNC(=O)OC(C)(C)C)cc32)C1 2280057599 QPUXDBNVQSKJQZ-UHFFFAOYSA-N 439.394 4.721 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2[C@]12C[C@H]1CN(Cc1ccccc1)C2 2286081310 QYRUXNXBNDPJFU-BTYIYWSLSA-N 446.776 4.777 50 10 IJGE COC(=O)c1ccsc1NC(=O)C(C#N)=Cc1cccc(OC)c1OCc1ccccc1 2295670008 XTMDSYURNKPXKR-UHFFFAOYSA-N 448.500 4.668 50 10 IJGE C[C@@H](Br)[C@H]1CCN(Cc2ccc(Cl)cc2I)C1 2302325407 HFCPFWNLQZUTMN-ZJUUUORDSA-N 428.539 4.550 50 10 IJGE C[C@H]1CCN(Cc2cc(I)ccc2Cl)[C@@H]1CBr 2307324122 IOKPQFJSJLHHCY-TVQRCGJNSA-N 428.539 4.550 50 10 IJGE CC[C@H]1CN(Cc2cc(I)ccc2Cl)C[C@H]1Br 2307328687 PXAHKUMXELBCQE-JOYOIKCWSA-N 428.539 4.550 50 10 IJGE Cc1nc(Br)c([C@@H](Br)c2ccc(F)c(Br)c2)n1C 2315595641 JZBWPOFFJUSZDC-JTQLQIEISA-N 440.936 4.877 50 10 IJGE C[C@@H](CBr)CN1CC[C@@H](CCNC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2315864888 WQTDTASGPSHVMA-MJBXVCDLSA-N 431.337 4.575 50 10 IJGE CC(C)[C@H](Br)C(C)(C)CNC(=O)c1sccc1I 2317976207 VVIXUMJBTCFMAA-NSHDSACASA-N 444.176 4.528 50 10 IJGE N#CC(=CN1CCN(c2ccccc2)CC1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 2325384981 LTBCYIWQABVLQM-UHFFFAOYSA-N 434.849 4.527 50 10 IJGE CC(C)C[C@H](CBr)CN=[S@](C)(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2328519469 SJHQKNVEHKJLPO-ITNZAGEZSA-N 439.460 4.541 50 10 IJGE N#CC(=C(O)C=Cc1ccc2c(c1)OCCO2)c1nc(-c2ccc3c(c2)OCO3)cs1 2331333941 PQACZYANHBKIOF-UHFFFAOYSA-N 432.457 4.816 50 10 IJGE CN(c1c(CBr)c(C(F)(F)F)nn1C)C1CC(OCc2ccccc2)C1 2339773512 KHBOFMJJZUDPOG-UHFFFAOYSA-N 432.284 4.518 50 10 IJGE BrCc1ccc(N2C[C@H]3[C@@H](C2)OCCN3Cc2ccccc2)cc1C1CC1 2364567963 HUKKGLSCIPLMKD-XZOQPEGZSA-N 427.386 4.549 50 10 IJGE C[C@H](Cl)C[C@H]1CCCCN1C(=O)c1ccc(Cl)cc1I 2365589203 SKXPBLDKSISDDU-CMPLNLGQSA-N 426.125 4.957 50 10 IJGE O=C1CCc2cc([C@@H](Br)c3cccc(I)c3)ccc2N1 40283377 QDWBYHRZMQUHOS-INIZCTEOSA-N 442.094 4.660 50 10 IJGE COc1cc(Cl)c(/C=N/NC(=O)c2cc3cc(Br)ccc3o2)cc1OC 59303837 KWPITQMPGCKORA-ZVBGSRNCSA-N 437.677 4.630 50 10 IJGE Cc1c(Cl)cccc1NC(=O)CCC(=O)NNC(=O)[C@H](C)c1ccc(CC(C)C)cc1 66199254 QHKXBKVSCOJFFY-MRXNPFEDSA-N 443.975 4.517 50 10 IJGE O=S(=O)(NC1(CCl)CCCCC1)c1c(Cl)cc(Br)cc1Cl 96873247 JXWJEUDZGRORPW-UHFFFAOYSA-N 435.598 4.976 50 10 IJGE CCCCCCCOc1ccc(C(=O)NC(=S)NNC(=O)c2ccc(Cl)cc2)cc1 100154385 VUGSJLBJZWBNBZ-UHFFFAOYSA-N 447.988 4.639 50 10 IJGE CCS(=O)(=O)CCCC(CBr)(CBr)c1ccccc1Cl 118877957 YCTUUMAJJSAFPA-UHFFFAOYSA-N 446.632 4.583 50 10 IJGE CCC(CC)(CBr)CNC(=O)c1cccc(C)c1I 230247730 IHKPVJWUPAQJPF-UHFFFAOYSA-N 438.147 4.531 50 10 IJGE O=C(NCCCCCCBr)c1cc(Cl)ccc1I 236048521 CFNQYJQWPBHPBT-UHFFFAOYSA-N 444.538 4.630 50 10 IJGE COc1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)NN=C(C)/C=C\c2ccccc2)cc1 254380812 NCHREFJEXWKMQY-UHKUHPCESA-N 439.515 4.672 50 10 IJGE COC(C)(C)COc1c(Br)cc(Br)cc1CBr 383167096 FNYOASOQARDQRA-UHFFFAOYSA-N 430.962 4.910 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC1CCCCCCC1 721100508 LQVKSBCVUYJPRJ-KRWDZBQOSA-N 425.351 4.834 50 10 IJGE CC(=O)N(C)c1ccccc1NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C)c2)c1C 735640530 HQWALRDDXTWIRF-PXLXIMEGSA-N 426.520 4.931 50 10 IJGE O=C(NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)NNc1cccc(F)c1F 745920962 GEFUJKPOEMLJQE-UHFFFAOYSA-N 428.386 4.933 50 10 IJGE C[C@@H]1CCN(C(=O)C(=O)Nc2ccc(S(F)(F)(F)(F)F)cc2)C[C@@H]1n1ccnc1 773405385 BCAPAELPHHFUSG-DOMZBBRYSA-N 438.422 4.589 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCc2ccc([N+](=O)[O-])cc2)c(-c2ccccc2)cc1OC 787149006 LOKAKGKGJIHRPJ-NDENLUEZSA-N 443.459 4.502 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)Nc2cc(C)nn2-c2ccccc2C)c1C 788100591 KKVUOJFYGFPKFK-CVHFWEDTSA-N 431.540 4.661 50 10 IJGE CCOc1ccccc1C=NNC(=O)COc1ccc2ccccc2c1Br 1084173810 VKQCEEZUUTZAFC-UHFFFAOYSA-N 427.298 4.530 50 10 IJGE O=C(CC[C@@H](O)c1ccccc1)NN=Cc1cn(Cc2ccc(F)cc2)c2ccccc12 1084180370 AUJNVJCPJQGHAR-RUZDIDTESA-N 429.495 4.793 50 10 IJGE COc1cc(C=NNC(=O)c2cc3ccccc3o2)ccc1OCc1ccccc1C#N 1084243273 GTYAIIVEWUQRGE-UHFFFAOYSA-N 425.444 4.656 50 10 IJGE C#CCCN(CCOC)C(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1280419777 ALVDFKKGCGJHCX-XMHGGMMESA-N 444.362 4.806 50 10 IJGE C[C@H](SCc1nc(O)c2ccccc2n1)C(=O)N1CC[C@@H](O[Si](C)(C)C(C)(C)C)C1 1557691316 YQUSCSUTQZZFSI-JKSUJKDBSA-N 447.677 4.580 50 10 IJGE C=C(C)CN1CCC(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(OCC)cc3)c2C)CC1 1632862715 IQIAYXAHJLTKPM-XQNSMLJCSA-N 446.595 4.557 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@@H]2C)oc2c1C(=NNC(=O)c1ccc(F)cc1)CCC2 1772745167 SDSLASTZFQCAJQ-HNNXBMFYSA-N 445.494 4.789 50 10 IJGE C[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)[C@@H]1CC[C@H](NC(=O)OC(C)(C)C)C1 1877876788 FOAUZGZZQFOFMK-APIJFGDWSA-N 435.403 4.604 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)c1ccc(I)cn1 1915069697 NLFASAROYBDBNW-ZDUSSCGKSA-N 445.142 4.866 50 10 IJGE ClCCc1nc2ccc(Br)cc2n1Cc1csnc1Br 1926873824 TXMBUOWFFBZHCB-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE IC[C@H]1CC[C@]2(CN(Cc3ccccc3)C3(CCCCC3)C2)O1 1939537577 SXYNHPANIMVVSI-QUCCMNQESA-N 425.354 4.948 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)CCc1cccc(C(F)(F)F)c1 1994837598 NCXIEIUXXUKDDL-CQSZACIVSA-N 426.232 4.698 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@H]1CC[C@@H]1NC(=O)OCc1ccccc1 1999516120 XTMPRXKSWGPYNT-ACRUOGEOSA-N 431.374 4.554 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)C(C)(C)CCBr 2026566202 IJVJPGCYOZNXNX-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE C[C@@H]1C[C@@H](CBr)CCN1Cc1cc(Cl)ccc1I 2052367780 NUDAZBYNYTZRDI-MNOVXSKESA-N 442.566 4.940 50 10 IJGE O=C(CCl)c1ccc(I)c(C(F)(F)F)c1OC(F)(F)F 2055120280 GOWYKWIJPNNTPZ-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE COC[C@@]1([C@@H](Br)c2ccc(Br)cc2Br)CCCO1 2083317480 GSZNPULJLKRXLK-QWHCGFSZSA-N 442.973 4.843 50 10 IJGE O=S1(=O)CCC[C@@H]([C@@H](Br)c2cc(Br)c(Cl)cc2F)C1 2097823898 KQHIYUAEDIECNU-JMCQJSRRSA-N 434.552 4.502 50 10 IJGE CC(C)(C)OC(=O)NC[C@H](NC(=O)[C@@H](Br)C1CCCC1)C1CCCCC1 2110721779 IPBVEGHJZVBBFH-IRXDYDNUSA-N 431.415 4.530 50 10 IJGE COc1cc(CBr)ccc1S(=O)(=O)N(Cc1ccccc1)[C@H](C)C1CC1 2123271390 QNBBAPVPTBYQPR-OAHLLOKOSA-N 438.387 4.580 50 10 IJGE O=C(NC12CCC(CCl)(CC1)C2)c1cc(Br)sc1Br 2132808961 QXPKJXHWLCGKNB-UHFFFAOYSA-N 427.589 4.945 50 10 IJGE O=S1(=O)CCC([C@H](Br)c2csc3c(Br)cccc23)CC1 2146096165 UKDPENINMSNPDS-ZDUSSCGKSA-N 438.206 4.925 50 10 IJGE Cc1cc(Br)c(C(=O)NC[C@@H](CBr)C(F)(F)F)cc1Cl 2161574032 BZPFTVSKUCNOTR-SSDOTTSWSA-N 437.481 4.714 50 10 IJGE FC(F)(F)[C@]1(CCl)CCN(Cc2cc(Cl)ccc2I)C1 2167681951 ZFALVSPKXZYWSS-LBPRGKRZSA-N 438.058 4.938 50 10 IJGE Cc1c(Cl)cc(CN2CCOC[C@@H]2C[C@@H](C)Br)cc1Br 2185304722 FCRYVWBLNDLEFR-MFKMUULPSA-N 425.592 4.785 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)[C@@H]2CCCS2(=O)=O)c(C)c1Br 2227352048 BFGHKLRILDXXME-GWCFXTLKSA-N 430.589 4.686 50 10 IJGE COc1ncc(COc2c(Br)cc(CCl)cc2Br)s1 2231431473 WOUIXKBBZFCXHO-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE Cc1c(Br)sc([C@H](Br)[C@]23CCC[C@H]2CS(=O)(=O)C3)c1C 2234212172 CHAKOKARWRQJAP-JKOKRWQUSA-N 442.238 4.778 50 10 IJGE CC1CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)[C@@H](CC(F)(F)F)C2)C1 2265307045 AUWVZCXCXNEMNK-UUCFBXCCSA-N 443.348 4.671 50 10 IJGE CN(C[C@@H](Cl)C1CCCC1)C(=O)c1ccc(Cl)c(I)c1 2283668389 YOARWNUELKZQTA-CYBMUJFWSA-N 426.125 4.814 50 10 IJGE C[C@@]1(CBr)C=CCCN1C(=O)c1cc(Br)c(F)cc1Cl 2285956858 BLCSZKBSSBKYLJ-AWEZNQCLSA-N 425.523 4.797 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccc(F)cc2)ccc1OCc1cccc(C(=O)O)c1 2313562472 SRKOXQSLMYRPPN-UHFFFAOYSA-N 446.434 4.657 50 10 IJGE COCCOc1ccc(C=C(C#N)C(=O)N(Cc2ccccc2)Cc2ccccc2)cc1 2325108079 NFYZRQQJYPKGMP-UHFFFAOYSA-N 426.516 4.848 50 10 IJGE COc1cccc(-c2csc(C(C#N)=C(O)[C@H]3CC(=O)N(Cc4ccccc4)C3)n2)c1 2331246794 YOZZOKQSMSAYMQ-SFHVURJKSA-N 431.517 4.660 50 10 IJGE Cn1nc(C(F)F)c(CBr)c1N1CC[C@]1(C)CCOCc1ccccc1 2339775609 PHSHMJPXKAUYKN-LJQANCHMSA-N 428.321 4.828 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)C1CCC(C(F)(F)F)CC1 2343416442 QCHGIQPNSRVSRU-JCYILVPMSA-N 436.312 4.842 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)C1(C(F)(F)F)CCCCC1 2343416620 RYMOJTYNWZNHMS-INIZCTEOSA-N 436.312 4.986 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@]12CCC[C@H](CN(C[C@]3(CBr)CC3(F)F)C1)C2 2351893724 HSWMQASPWRITLO-QGTPRVQTSA-N 437.369 4.518 50 10 IJGE Cc1c(Br)csc1C(=O)N1CCC[C@H](Br)[C@@H]1C(F)(F)F 2370259862 BKIYNZAHPWKZQZ-OIBJUYFYSA-N 435.103 4.749 50 10 IJGE ClCCCOC1CCN(Cc2cc(I)ccc2Cl)CC1 2380513256 RZEPHXPQVTYXDH-UHFFFAOYSA-N 428.141 4.555 50 10 IJGE CCN(CC)c1cc(OC)c(/C=C(/C#N)C(=O)NC2CCCCC2)cc1Br 109021205 HDAFUGCQCVFXSN-WJDWOHSUSA-N 434.378 4.660 50 10 IJGE N#CC1=NN(c2ccccc2)[C@@H](c2ccccc2)C2=C1OC(N)=C(C#N)[C@H]2c1ccccc1 168467206 OOIRBZKJFJFCKO-NOZRDPDXSA-N 429.483 4.889 50 10 IJGE COc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)/C=C\c3ccc(C)cc3)ccc21 205641269 XKTDVQKFUKOBGM-RDQNCKLBSA-N 438.483 4.841 50 10 IJGE Cc1cc(N/C=C(/C#N)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)ccc1Br 217229649 QCYDHQOUSQVEKF-LUAWRHEFSA-N 435.665 4.777 50 10 IJGE CO[C@@H]1CCC[C@@H](O[C@H](CI)c2ccc(Br)cc2)C1 253135985 RUKSDQQSYFKXDI-RBSFLKMASA-N 439.131 4.899 50 10 IJGE CC(=NNC(=O)c1cc(-c2ccc(-c3ccccc3)cc2)n[nH]1)c1ccc([N+](=O)[O-])cc1 254387348 NBEKINCYYQILAO-UHFFFAOYSA-N 425.448 4.806 50 10 IJGE O=C(CSc1nc2ccccc2n1Cc1ccccc1)NN=C/C=C/c1ccccc1 254400734 PBDCGUDVGHORBP-LUQCOAQOSA-N 426.545 4.992 50 10 IJGE Cc1ccsc1C=NNC(=O)c1ccc([C@H]2SCC(=O)N2Cc2ccccc2)cc1 254794055 APOOBICBUCUBRB-HSZRJFAPSA-N 435.574 4.595 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CBr)[C@H](c2ccc(F)c(Br)c2)C1 382693828 ANTMUFJZZCQKOM-RYUDHWBXSA-N 437.147 4.934 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)cnc2n1[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 398463437 SWMTVGLIFZDZEM-ANRZDRKOSA-N 431.765 4.797 50 10 IJGE Cc1cc([C@H](Br)c2nn(C)cc2Br)sc1Br 693102924 SBYNPAHWROFFEB-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE ClCc1nc2cccc(Br)c2n1CC[C@@H]1CN(Cc2ccccc2)CCO1 697743135 LBENYRYKICZIIM-QGZVFWFLSA-N 448.792 4.829 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)cnc2n1Cc1ncc(Br)s1 714926772 OISDPHAYWYLVQR-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(-c3ccccn3)nc3ccccc23)c1C 736691129 HBKXKMQKRGXFJA-UHFFFAOYSA-N 447.502 4.523 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])cc1Br)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 741442632 MMTAIRGNPUFWAW-VXGBXAGGSA-N 446.175 4.965 50 10 IJGE Cc1cccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)NNc3cc(C)ccc3F)c2)c1 760136802 FZADCKVPBQBFFM-UHFFFAOYSA-N 447.919 4.654 50 10 IJGE Cc1nc2cc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)ccc2n1-c1ccccc1 799752597 QCPXJWWWJSNFQK-UHFFFAOYSA-N 435.409 4.981 50 10 IJGE C#CCOc1ccc(CNS(=O)(=O)c2cccc(S(F)(F)(F)(F)F)c2)cc1 1475310211 SHFZFBXBBWKDIN-UHFFFAOYSA-N 427.416 4.835 50 10 IJGE CCOc1cc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)ccc1OC 1614687755 CUZXRDWDRFVMQC-MOPGFXCFSA-N 448.357 4.841 50 10 IJGE O=C(CCSc1ccccc1Br)NNc1nc2ccccc2[nH]c1=S 1640943251 KJPXOJSTEKQGAD-UHFFFAOYSA-N 435.372 4.680 50 10 IJGE CCCc1nn(Cc2ccc(F)cc2)c2c1[C@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689837 XKZLLKQSEKAGKB-HXUWFJFHSA-N 438.890 4.600 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3Cc2ccccc2)cc1 1865712886 KTSBSZPMIWPLTB-HSZRJFAPSA-N 434.499 4.825 50 10 IJGE CO[C@@H]1C[C@]2([C@@H](Br)c3sc(Cl)cc3I)C[C@H]12 1900924529 MSVJMGTXPBZUKF-RDEUGQNKSA-N 433.536 4.867 50 10 IJGE CC[C@H]1C[C@@H]1CCOC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1902773301 HMSPAGAFQULRMM-GJZGRUSLSA-N 437.362 4.644 50 10 IJGE Fc1cc(I)ccc1-n1c(Cl)nc(Cl)c1CBr 2006650374 VACLBKKQUVAXFX-UHFFFAOYSA-N 449.876 4.818 50 10 IJGE CCN[C@H](c1ccc(Br)c(C)c1Br)[C@H]1C[C@H]1Br 2024280596 ANFQLDIHMWHNLF-UFGOTCBOSA-N 425.990 4.954 50 10 IJGE CCCCN(CCBr)C(=O)c1cccc(Br)c1Br 2031484315 BCHJOUKNVZRTRY-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCCN1C[C@H](Br)C(F)(F)F 2044701135 GKLSUGOKISPKMK-MJBXVCDLSA-N 429.321 4.566 50 10 IJGE CC(C)(C)OC(=O)N1CCCN(C[C@@H](CBr)C(C)(C)C)CC(F)(F)C1 2044705634 MUFJVLLJOPJBIH-CQSZACIVSA-N 427.374 4.622 50 10 IJGE O=C(CBr)c1ccc(OC(F)(F)F)c(C(F)(F)F)c1Br 2054797504 XZLIOAMDCYVTQJ-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE Clc1nc(Cl)n([C@H]2CN(Cc3ccccc3)[C@]3(CCOC3)C2)c1CBr 2055098574 SUPQQSDZDJOCAX-RDTXWAMCSA-N 445.188 4.691 50 10 IJGE Cc1cc(C)c(S(=O)(=O)N(Cc2ccccc2)CC(F)F)cc1CBr 2059312196 HTJKJBDTTRVAFC-UHFFFAOYSA-N 432.330 4.654 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1C(=O)c1cc(Br)cc(Br)c1 2073311886 FVHCYFUWAHCTPZ-UFBFGSQYSA-N 439.973 4.600 50 10 IJGE C[C@H](Br)[C@H]1CCCN(Cc2ccc(I)c(Cl)c2)C1 2086658683 POHZFWBMBXZTAF-JQWIXIFHSA-N 442.566 4.940 50 10 IJGE CS(=O)(=O)c1csc([C@H](Br)c2ccc(Br)cc2F)c1 2093073487 CCLHJMTVJPBYMB-GFCCVEGCSA-N 428.142 4.538 50 10 IJGE ClCc1nc2cncc(Br)c2n1CC[C@@H]1CCN(Cc2ccccc2)C1 2095446679 ZGGPREPWFCNZAC-INIZCTEOSA-N 433.781 4.845 50 10 IJGE C[C@@H]1[C@H](C(F)(F)F)N(C[C@@H](CBr)C(C)(C)C)CCN1C(=O)OC(C)(C)C 2115979583 JEFWMBDJVZTZFP-MGPQQGTHSA-N 445.364 4.916 50 10 IJGE Cc1c(Br)cccc1C(=O)N[C@@H](C)CCCCCI 2117892246 COTVCANPGQXXHZ-NSHDSACASA-N 438.147 4.871 50 10 IJGE C[C@H](c1nscc1Br)N(C)c1ncc(Br)cc1CCl 2130019976 XDLSPDFMEMJBQD-SSDOTTSWSA-N 425.577 4.999 50 10 IJGE ClCCc1nc2cncc(Br)c2n1C1[C@H]2C[C@H]1CN(Cc1ccccc1)C2 2151780589 RAAOTPVKWLVWPO-HOTGVXAUSA-N 445.792 4.668 50 10 IJGE CC[C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CN1C[C@H](CBr)c1ccccc1 2163065294 ZBJJAZGNGVDERD-VNTMZGSJSA-N 437.422 4.742 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@H]1C[C@@H]2CC[C@H](C1)O2 2181362937 TXXKKHNJYLYLFN-DNVSUFBTSA-N 449.126 4.620 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 2196915570 ZOJIILFLKJWHCV-BZUAXINKSA-N 437.378 4.547 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Br)C1(S(C)(=O)=O)CCC1 2202996164 DYGKRUOAUNJIQH-GFCCVEGCSA-N 446.588 4.514 50 10 IJGE Fc1cc(Br)cc(F)c1CO[C@H]1CCCC[C@@H]1I 2259042310 PKVDLXVVLCXXQD-STQMWFEESA-N 431.058 4.990 50 10 IJGE CS(=O)(=O)C1([C@H](Br)c2cc3sc(Br)cc3s2)CC1 2263615522 LIDGNQKQLJDDGH-SNVBAGLBSA-N 430.208 4.739 50 10 IJGE CCn1nc(C)c(CBr)c1N(C)[C@@H]1C[C@@H]2C[C@@H](OCc3ccccc3)C[C@H]21 2281304018 QNLLDGHPQMKYTK-QEUVDIPISA-N 432.406 4.926 50 10 IJGE Cc1ccc(Oc2nc3ccccn3c(=O)c2C=C(C#N)C(=O)Nc2cccc(C)c2)cc1 2296720267 HDFQNBSJDVEZAO-UHFFFAOYSA-N 436.471 4.649 50 10 IJGE Clc1ccc(C[C@H]2CCOCC[C@H]2Br)cc1I 2300265704 OLIFYQGSMVZBLJ-GHMZBOCLSA-N 429.523 4.677 50 10 IJGE C[C@H](Cl)c1cnn(Cc2ccc(I)c(Br)c2)c1 2306198800 FIQWKTQVMJHZPS-QMMMGPOBSA-N 425.495 4.598 50 10 IJGE Cn1cc(I)c(C[C@@H]2CCCCCCC[C@@H]2Br)n1 2319223063 JGKIONGHLUQFTK-RYUDHWBXSA-N 425.152 4.691 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)C=Cc3cccc(OC(C)C)c3)c(C)n2)cc1 2321139532 WJEDWMAQNCNVTD-UHFFFAOYSA-N 443.547 4.881 50 10 IJGE N#C/C(=C\c1ccc(-n2cncn2)cc1)c1nc(C(c2ccccc2)c2ccccc2)no1 25062644 FOVZHVRKPVPYRO-PXLXIMEGSA-N 430.471 4.895 50 10 IJGE C=CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)cc1I 59335308 NDCOLZJWYGQLQQ-WJDWOHSUSA-N 444.272 4.710 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc(COc3ccccc3Cl)o2)cc1OC 252620867 MOAFMLSCAOTGCV-UHFFFAOYSA-N 428.872 4.683 50 10 IJGE CN(C)c1ccc(C=NNC(=O)CCn2cnc(-c3ccccc3)c2-c2ccccc2)cc1 252637424 XSWUMBGTXUEPED-UHFFFAOYSA-N 437.547 4.824 50 10 IJGE ClCc1ccc2c(I)csc2c1I 307671665 UKXVQCIFYDMGII-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE BrCC(CBr)(c1ccc(Br)cc1)[C@@H]1CCCO1 686741623 ZGDFISIBQFFSPC-LBPRGKRZSA-N 426.974 4.656 50 10 IJGE O=C(N[C@@H](CBr)C1CCC1)c1cc(Br)sc1Br 717614978 DZYRAIWWKMCNNQ-QMMMGPOBSA-N 446.002 4.567 50 10 IJGE Cc1ccccc1CC(=O)NNC(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 756028347 CSVPTTKMHMYVCP-OAHLLOKOSA-N 438.380 4.676 50 10 IJGE CCCc1ccc(-c2ccc(NC(=O)C(=O)NNc3ncccc3C(F)(F)F)cc2)cc1 783120673 ODXWXGVWJPSYDK-UHFFFAOYSA-N 442.441 4.802 50 10 IJGE CC(=O)N(c1ccc(F)cc1)c1nc(/C=C(/C#N)C(=O)N(C)Cc2ccccc2)cs1 787150972 WVTUESUBRIHWRZ-PDGQHHTCSA-N 434.496 4.532 50 10 IJGE Cc1ccc(NC(=O)C(=O)NN=Cc2cccc(OCc3ccc(Cl)cc3)c2)cc1C 1083873426 RRFRXXIRMJSLEM-UHFFFAOYSA-N 435.911 4.625 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2cc(Cl)ccc2OCc2cccc(C#N)c2)cc1 1083963481 ILMZHOAAGKRNFW-UHFFFAOYSA-N 433.895 4.953 50 10 IJGE COc1ccc(Br)c(NNC(=O)c2ccc(-c3cccc(Cl)c3)nc2O)c1 1469065184 IKBFFGQSGMPBOQ-UHFFFAOYSA-N 448.704 4.636 50 10 IJGE C/C(=C\C(=O)NNC(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1OC(F)F 1556340960 OSPKFXPOBQYXGW-CSKARUKUSA-N 430.238 4.851 50 10 IJGE C/C(=C/C(=O)NNC(=O)COc1ccccc1Cc1ccccc1)c1ccccc1Cl 1654115560 WHXXDGUZVWAQBO-SDXDJHTJSA-N 434.923 4.561 50 10 IJGE C=CCCC[C@@H](NC(=O)NNC(=O)c1cc(F)ccc1Br)c1ccccc1 1684893722 GXDZFGNWLOHXRB-GOSISDBHSA-N 434.309 4.630 50 10 IJGE Cc1c(C(=O)Nc2ccccc2Cl)oc2c1C(=NNC(=O)c1ccc(O)cc1)CCC2 1772745236 UNVBOLJOFKSJIB-UHFFFAOYSA-N 437.883 4.670 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@H]1c1cccc(O)c1 1865681840 YHBQFWWSLOWYLP-INIZCTEOSA-N 446.816 4.527 50 10 IJGE CCCc1nn(Cc2cccc(F)c2)c2c1[C@@H](c1ccc(OCC)cc1)C(C#N)=C(N)O2 1865693366 IZTZXJTWUJDDPO-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE CC/C(=C\C(=O)N[C@](C)(CC)C(=O)Nc1ccc(SC#N)cc1)c1ccc(OC)cc1 1866687604 HDKHPTZIUVXNTF-VUNQTZOZSA-N 437.565 4.985 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2cc(CBr)sc2[N+](=O)[O-])C1 1921470455 QQHKJIUAIPFJAO-HUUCEWRRSA-N 438.391 4.898 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1C1CCN(C[C@H](CBr)C2CCC2)CC1 1966156376 KPHLIDURVNWASY-OALUTQOASA-N 429.443 4.909 50 10 IJGE C[C@@H]1CN(Cc2cc(Br)ccc2Br)C[C@@H]1CBr 2006500104 MNHNAXLTHBIPJK-KOLCDFICSA-N 425.990 4.674 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](O[C@@H]2CCC[C@@H]3CCCC[C@@H]32)C1 2022999284 SXDJZCXEBNAURT-SMLCLMEVSA-N 449.373 4.785 50 10 IJGE C[C@H]1CC[C@H](CNC(=O)C(F)(F)F)N(CCCCCCCCCBr)C1 2106786348 UOHIGLFCZVJLFG-JKSUJKDBSA-N 429.365 4.891 50 10 IJGE CCC[C@H](CBr)CN1CC[C@H](C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)C1 2106787494 ZHXDUCPPUTVMSM-KFWWJZLASA-N 445.364 4.823 50 10 IJGE C[C@H](Br)C[C@H]1CCCCCN1Cc1nn(C)c(Cl)c1Br 2152984854 IDHKJAFVJYDHJN-WDEREUQCSA-N 427.612 4.754 50 10 IJGE CN(C(=O)c1cc(Br)ccc1Br)[C@@H](CCCl)C(F)(F)F 2178516525 XFASOTKLMXDERL-JTQLQIEISA-N 437.481 4.843 50 10 IJGE Cc1cccc(N(C)S(=O)(=O)c2cc(CBr)sc2Br)c1 2179786455 ASOPCRMUOBSBPA-UHFFFAOYSA-N 439.194 4.539 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@@H](Br)C12CC(CO1)C2 2213489412 LPDSLINXKIDJPH-LXJQOYHNSA-N 428.921 4.966 50 10 IJGE CC(C)(C)OC(=O)N[C@H](C[S@](C)(=O)=NCCCCCCBr)C(C)(C)C 2223286917 BFMRQLDRRTZGFR-BZQUYTCOSA-N 441.476 4.979 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)C[C@H]1C[C@H](Br)C1 2300266189 VFJAVLUXYQCOKO-XYPYZODXSA-N 428.539 4.550 50 10 IJGE C[C@@]1(CBr)CCCN(Cc2ccc(Cl)c(I)c2)C1 2315551191 NUBCKVZOEAUEAH-AWEZNQCLSA-N 442.566 4.942 50 10 IJGE CC[C@@H]1CN(Cc2ccc(Cl)cc2I)C[C@H]1CBr 2318542327 WKBVQODTUSQORY-ZYHUDNBSSA-N 442.566 4.798 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)C1(C(F)(F)F)CCCCC1 2343412711 RYMOJTYNWZNHMS-MRXNPFEDSA-N 436.312 4.986 50 10 IJGE C[C@H]1CN(c2nccc(N(C)C)c2CBr)[C@H](C)[C@H](C)N1Cc1ccccc1 2377484544 IOAFYGIGQPXDKF-OKZBNKHCSA-N 431.422 4.530 50 10 IJGE CC(/C=C/c1ccccc1)=NNC(=O)c1cc(Br)cc(Br)c1N 4231490 OAOUILHSJAYDLP-ZOQADIETSA-N 437.135 4.613 50 10 IJGE O=C(COc1ccc(Cl)cc1Br)N/N=C/c1cccc(Cl)c1Cl 13986057 YDKYDIZJRIFETM-IFRROFPPSA-N 436.520 4.938 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(C)cc2)cc1 38649203 OFKVPPZGHQKZPU-DEOSSOPVSA-N 426.472 4.831 50 10 IJGE Cc1ccc(Oc2nc3ccccn3c(=O)c2/C=C(/C#N)C(=O)Nc2ccccc2C)cc1 39858539 RSYWVOLKCMOCPC-CYVLTUHYSA-N 436.471 4.649 50 10 IJGE O=C1CCc2cc([C@@H](Br)c3ccccc3I)ccc2N1 40283279 DBLIDOYMCRVAKE-MRXNPFEDSA-N 442.094 4.660 50 10 IJGE CCOc1cc(/C=N\NC(=O)CC[C@@H](O)c2ccccc2)ccc1OCc1cccc(C)c1 58887900 GMDRFAQCMYQOHP-IVRBHCBNSA-N 446.547 4.937 50 10 IJGE O=C([C@@H](Br)Cc1ccccc1Cl)N1CCN(c2cccc(Cl)c2)CC1 96574344 RCWLXFIXYZPAGN-KRWDZBQOSA-N 442.184 4.648 50 10 IJGE CCC[C@@H](Br)CNC(=O)c1cc(Br)ccc1Br 161242169 UVLQXOJDPUUTAY-SECBINFHSA-N 427.962 4.505 50 10 IJGE COc1ccc(C(=O)Oc2ccc(C=NNC(=O)Cc3cccc4ccccc34)cc2)cc1 254302997 CIIZTQVNUAPBLJ-UHFFFAOYSA-N 438.483 4.760 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 398464806 UGFPTUNVATUVEX-IKDJWVMYSA-N 434.740 4.980 50 10 IJGE CCCOCC(CBr)(CBr)c1ccc(Br)cc1 709730122 KRPJMISBJBPKPR-UHFFFAOYSA-N 428.990 4.903 50 10 IJGE Cc1cccc(NC(=S)NNC(=O)[C@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)c1 732576939 DIYVSZDCFALDFS-GOTSBHOMSA-N 431.561 4.695 50 10 IJGE O=C(NNc1cccc(F)c1F)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 745812109 OIICSDJZODUQJH-UHFFFAOYSA-N 429.298 4.562 50 10 IJGE O=C(NNc1c(Br)cccc1Br)c1cc(O)c2ccccc2c1 801500172 NFKXLHCKPZGVCP-UHFFFAOYSA-N 436.103 4.827 50 10 IJGE C[C@@H](NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)c1ccc(Cl)c(Cl)c1 807044896 YCXCOILZKUGDFP-CYBMUJFWSA-N 448.306 4.871 50 10 IJGE C=CCOc1cccc(NC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)c1 1198958324 UBUMPIGAJBYDKT-MRXNPFEDSA-N 427.570 4.930 50 10 IJGE C#CCOc1ccccc1CNC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Cl)cc2)c1C 1265222052 QUXPBAMLNXRJQZ-PXLXIMEGSA-N 443.934 4.983 50 10 IJGE C#CCOc1ccc(COC(=O)/C(C#N)=C\c2cc(C)n(-c3ccccc3F)c2C)cc1 1268853818 KJFQQRAQWXZLPK-JCMHNJIXSA-N 428.463 4.896 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)c1C 1650818179 WLZRASAHAWFQSR-FUHWJXTLSA-N 425.895 4.585 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2)[C@@H]1c1ccc(C(=O)O)cc1 1865709260 SFWNFJIZTKEECI-JOCHJYFZSA-N 448.482 4.515 50 10 IJGE COC(=O)c1ccc2c(O)nc(/C(C#N)=C/c3cccc(OCc4ccccc4)c3)nc2c1 1872727699 UMMMSSOUGKHBOI-UDWIEESQSA-N 437.455 4.765 50 10 IJGE CC(C)[C@@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1cc(Br)cs1 1915264568 WNQFNFIWBKXHID-OAHLLOKOSA-N 436.824 4.965 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2cccnc12 1915749265 HMGGDUXXNGOANY-UHFFFAOYSA-N 433.371 4.599 50 10 IJGE Cc1ccc(CO[C@@](C)(CI)CNC(=O)OC(C)(C)C)cc1C 1994340505 VMOFSJPZCJYBGF-SFHVURJKSA-N 433.330 4.538 50 10 IJGE C=CC[C@@H](CBr)CNC(=O)c1scc(Br)c1Br 2023511098 IDOMGRVRFJIPRO-ZETCQYMHSA-N 446.002 4.590 50 10 IJGE CC1(C)[C@H](Br)CCN1C(=O)c1c(Br)cccc1Br 2033095746 PWVFORZVCJKZND-SNVBAGLBSA-N 439.973 4.600 50 10 IJGE Br[C@H](Cc1ccc2c(c1)CCO2)c1sccc1I 2049595052 GZLKWHIULIJIPG-LLVKDONJSA-N 435.124 4.966 50 10 IJGE CCn1cc(Br)c([C@@H](Br)Cc2ncccc2Br)n1 2060851960 STMPTAWOIUTHTR-VIFPVBQESA-N 437.961 4.502 50 10 IJGE C[C@]1(NC(=O)c2c(Br)cccc2Br)CCC[C@H]1Br 2062577268 CHHVBSNZKVRGBF-MFKMUULPSA-N 439.973 4.648 50 10 IJGE BrC[C@@]12CC[C@H]1CN(Cc1cccc(Br)c1Br)C2 2078133633 OATOBIHOMWFZID-SMDDNHRTSA-N 438.001 4.819 50 10 IJGE C[C@H]1CC[C@H](CBr)N(Cc2ccc(I)c(Cl)c2)C1 2086651386 HMLLESSCWWOZEI-CMPLNLGQSA-N 442.566 4.940 50 10 IJGE ClCc1cnc(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c(Br)c1 2092523125 FDAZPPSTLJIVTQ-RBUKOAKNSA-N 434.809 4.931 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Br)c2cccc(F)c2Br)c1 2093075241 UXBVTIZQMREJDE-LBPRGKRZSA-N 428.142 4.538 50 10 IJGE C[C@]1(Cn2c(CCl)nc3cncc(Br)c32)CCN(Cc2ccccc2)C1 2095445209 DQEDYYJIJCIICS-FQEVSTJZSA-N 433.781 4.845 50 10 IJGE BrCc1c(N2CCC[C@H]2[C@H]2CCN(Cc3ccccc3)C2)nc2sccn12 2145252388 DYTLJTRPUMJFAF-ROUUACIJSA-N 445.430 4.782 50 10 IJGE BrCC1(CN2CCC[C@@]3(CN(Cc4ccccc4)CCO3)C2)CCCCC1 2151740827 UBTRRNZXDTVJMG-HSZRJFAPSA-N 435.450 4.699 50 10 IJGE O=C(c1ccc(OCc2ccccc2)cc1)N1C[C@]2(F)CCC[C@@]2(CBr)C1 2176639644 IXIVHEYPOLNKHZ-FGZHOGPDSA-N 432.333 4.995 50 10 IJGE O=C(c1cc(Br)ccc1Cl)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Br)C2 2190678785 NNYURTWKDWDNHZ-JBSCMGISSA-N 425.523 4.581 50 10 IJGE CCOCc1cc(Br)c([C@H](Br)[C@]23COC[C@@H]2C3(F)F)s1 2233017393 XJOHFQODAUTSHF-DLOVCJGASA-N 432.124 4.765 50 10 IJGE O=C(Nc1ccccc1CCBr)c1c(F)cccc1I 2282771836 SPCHNAMNUGJEFY-UHFFFAOYSA-N 448.073 4.620 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1CBr)c1cc(F)c(Br)cc1Cl 2282982613 LBIJNZDAOQYUEN-OQPBUACISA-N 427.539 4.925 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCS[C@@H](CCBr)C1 2285844783 RCUDQJKXUWWINO-QMMMGPOBSA-N 445.579 4.584 50 10 IJGE N#CC(=CNC1CCN(Cc2ccccc2)CC1)C(=O)Nc1cc(Cl)ccc1Cl 2318455322 RCDMYQNJIXSPAA-UHFFFAOYSA-N 429.351 4.594 50 10 IJGE CC(C)[C@@H](CBr)N(C)C(=O)c1c(Br)cccc1Br 2318855423 OJISFPYBGPUHET-LLVKDONJSA-N 441.989 4.703 50 10 IJGE Cc1ccc(NC(=O)C(C#N)=CNc2ccc(I)cc2C)c(C)c1 2325352741 KCJOZLCNLOZIJW-UHFFFAOYSA-N 431.277 4.675 50 10 IJGE CCCc1sc(Br)cc1[C@@H](Br)[C@H]1CCCCS1(=O)=O 2338018404 BFOWGLMOSZJFLL-DGCLKSJQSA-N 430.227 4.866 50 10 IJGE COC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1ccc(OC(=O)c2ccc(C)cc2)cc1 948762 BDFMMGRBQXQDRX-HKWRFOASSA-N 440.455 4.547 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)COc3ccccc3)ccc2[C@@H]1c1ccc(Cl)cc1 38651306 POZKWCHGQBJPFZ-QHCPKHFHSA-N 432.863 4.543 50 10 IJGE C[C@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cccc(F)c1 38678094 QSWLJMBRMXYZRE-LFVRLGFBSA-N 448.425 4.556 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(O)cc2)CCC3)cc1 40812127 DMQKNROMMOJHKQ-LHLOQNFPSA-N 432.476 4.546 50 10 IJGE C=CCc1cc(/C=N/NC(=O)c2cc3ccccc3o2)cc(Br)c1OCC#N 59304064 LKHNKDCDUOFGSA-ZMOGYAJESA-N 438.281 4.590 50 10 IJGE COc1cc(C(C)=NNC(=O)c2cc(-c3ccc(-c4ccccc4)cc3)n[nH]2)ccc1O 254440195 DOUVLNPNUXEBKI-UHFFFAOYSA-N 426.476 4.612 50 10 IJGE COc1ccc(Br)cc1C=NNC(=O)c1ccc(OCc2ccccc2)cc1 254524226 YATSBRCGBQBZRA-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3cccc(O)c3)n2C2CCCCC2)cc1 254869502 JXJLAMAGLLNWEW-UHFFFAOYSA-N 449.580 4.707 50 10 IJGE ClCc1cc(I)c2sccc2c1I 306911098 KETXCOKDUORELA-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE C[C@H]1[C@H](Br)CCCN1C(=O)c1cc(Br)ccc1Br 384244996 JFVXECZQEVDZMJ-GZMMTYOYSA-N 439.973 4.600 50 10 IJGE O=C(N[C@H](CBr)C1CCC1)c1scc(Br)c1Br 717649619 SVESKRQIECUDTP-MRVPVSSYSA-N 446.002 4.567 50 10 IJGE CCCCSc1ccc(C(=O)NNc2cccc(S(C)(=O)=O)c2)cc1C(F)(F)F 760929511 FGYLLUHLOPPFOH-UHFFFAOYSA-N 446.516 4.758 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2cc(C)n(-c3ccc(Cl)c([N+](=O)[O-])c3)c2C)cc1 1083961019 WBQQNTOTSOKIMS-UHFFFAOYSA-N 440.887 4.818 50 10 IJGE CC(=O)N(N=Cc1cc([N+](=O)[O-])c(Cl)cc1Cl)c1c(F)c(F)c(F)c(F)c1F 1084275557 YJQFINAJPPDKAY-UHFFFAOYSA-N 442.127 4.984 50 10 IJGE CC(=O)N1CCc2c(NC(=O)/C(C#N)=C\c3cc(C)n(-c4ccccc4C)c3C)cccc21 1269899751 LDAMKKODOHZFPO-JCMHNJIXSA-N 438.531 4.857 50 10 IJGE C#CCCN(CCOC)C(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1280419776 ALVDFKKGCGJHCX-RGEXLXHISA-N 444.362 4.806 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNC(=O)c1ccc(Br)cc1 1529734830 WRWGUCCXSSXIAX-KTKRTIGZSA-N 428.113 4.620 50 10 IJGE C/C(=C/c1cccc(Cl)c1)C(=O)NNC(=O)COc1ccccc1Cc1ccccc1 1638026394 NMCZLJCWQOGEQX-JXAWBTAJSA-N 434.923 4.561 50 10 IJGE Cc1ccc(C(=O)CCC(=O)Nc2cccc(C(=O)Nc3ccc(SC#N)cc3)n2)cc1 1860565087 DJLBDAWVMIRICW-UHFFFAOYSA-N 444.516 4.817 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc(Cl)c2)[C@H]1c1ccc(F)cc1 1865708260 RQVIXWLMISBIPX-HNNXBMFYSA-N 434.780 4.902 50 10 IJGE CC(=O)Nc1ccc2nc(NC(=O)/C(C#N)=C/c3ccc(Br)cc3)sc2c1 1866128604 BEVKTFSRFPXCNP-MDWZMJQESA-N 441.310 4.563 50 10 IJGE CC(C)[C@H](CCl)N(Cc1ccccc1)C(=O)c1cc(I)sn1 1909914048 BLBFNNYUYBSRGJ-AWEZNQCLSA-N 448.757 4.654 50 10 IJGE COc1cccc([C@@H](CI)OCCCOCc2ccccc2)c1 1983390662 SRHIAQUWMJYYMZ-LJQANCHMSA-N 426.294 4.795 50 10 IJGE C[C@@H]1CCC[C@@H](CNC(=O)OC(C)(C)C)N1C[C@@H](CBr)c1ccccc1 2106782415 QGGFAAGNVPNUHS-QRQLOZEOSA-N 425.411 4.933 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2CCN(CC3(CBr)CCCCC3)C[C@@H]2C1 2106788794 SPBRRGQCDSSCBC-QZTJIDSGSA-N 429.443 4.911 50 10 IJGE CS(=O)(=O)C1([C@H](Br)c2cc(Br)c(Cl)cc2F)CCC1 2110377175 BXQIMZRGKRYLFA-LLVKDONJSA-N 434.552 4.645 50 10 IJGE COc1cc(Cl)c([C@@H](Cl)c2cnn(C)c2Br)cc1Br 2137637800 QWOBLIYCEJKHRH-LLVKDONJSA-N 428.939 4.935 50 10 IJGE COc1ccc(OCC(=O)NN=C(C)C=CC=Cc2ccccc2)c(Br)c1 2297313951 ZQTCNIJLJSZAFB-UHFFFAOYSA-N 429.314 4.598 50 10 IJGE C[C@@H](c1ccncc1F)[C@@H](Br)c1cc(I)sn1 2304297464 GVNAQZKSMYSXTA-UPONEAKYSA-N 427.080 4.522 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)NC(C)C)ccc1OCc1ccc(Br)cc1 2313681042 ACDIOOKGNKRIRQ-UHFFFAOYSA-N 443.341 4.858 50 10 IJGE CCCOc1ccccc1C=C(C#N)C(=O)Nc1sc2c(c1C(=O)OC)CC[C@@H](C)C2 2314774245 ZVJQKPGLVNVDCW-OAHLLOKOSA-N 438.549 4.994 50 10 IJGE COCCOc1ccc(C=C(C#N)C(=O)NCc2ccc(-c3ccccc3OC)cc2)cc1 2331118941 MTJFEGOQGIODQD-UHFFFAOYSA-N 442.515 4.611 50 10 IJGE Clc1cc(Br)c(CN2C[C@@H](Br)C[C@@]3(CCCO3)C2)s1 2345957456 BNBFCSZMPALHOH-ZANVPECISA-N 429.605 4.682 50 10 IJGE C[C@H](Oc1ccc(OCc2ccccc2)cc1)C(=O)N/N=C/c1cccc2cccnc12 20311514 LESHKFCNVQMWEY-XTFCHBONSA-N 425.488 4.731 50 10 IJGE Fc1cc(-n2c(CCCl)nc3cc(Br)cnc32)ccc1Br 98040516 QHLVNDJRGJUBOV-UHFFFAOYSA-N 433.506 4.866 50 10 IJGE CCOC(=O)[C@H](Cl)Cc1c(Br)cc(Br)cc1Br 134948100 QZLGBEHNMCFIQM-SNVBAGLBSA-N 449.364 4.687 50 10 IJGE C[C@H](Br)C[C@H](C)NC(=O)c1ccc(Br)cc1Br 235405583 CESYWNXRLJFPML-YUMQZZPRSA-N 427.962 4.503 50 10 IJGE C[C@@H]1[C@@H](C)N(Cc2ccccc2)[C@H](C)CN1c1ccc([N+](=O)[O-])c(CBr)c1 404289075 UCIWFFUQEFYXSY-BRWVUGGUSA-N 432.362 4.977 50 10 IJGE CC(C)N(C[C@@H](C)Br)C(=O)c1scc(Br)c1Br 705447002 DLNNIQDHYPXBOB-SSDOTTSWSA-N 448.018 4.907 50 10 IJGE C[C@H](Br)CCCNC(=O)c1scc(Br)c1Br 705510142 IEJQSEXPJNDZFQ-LURJTMIESA-N 433.991 4.567 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1Cc1ncc(Br)s1 714926767 OISDPHAYWYLVQR-LURJTMIESA-N 436.560 4.761 50 10 IJGE C[C@@H](NC(=O)NNC(=O)COCc1ccccc1)c1ccccc1-c1ccc(Cl)cc1 740057708 HXMKMSOBAJBEJG-QGZVFWFLSA-N 437.927 4.615 50 10 IJGE CCCn1c(C)cc(/C=C(\C#N)C(=O)OCc2coc(-c3ccc(C(=O)OC)cc3)n2)c1C 782299898 HGRPDYBEIKMDMY-CIAFOILYSA-N 447.491 4.607 50 10 IJGE CC(C)(C)n1nc(-c2ccccc2)cc1NC(=O)C(=O)NNc1ccc(Cl)cc1Cl 784800803 AXEYVXMQJKBEFV-UHFFFAOYSA-N 446.338 4.694 50 10 IJGE Cc1c(O)nc2ccccc2c1C(=O)NNc1ccc(Br)cc1C(F)(F)F 1136628953 UZVDRASZTNJITE-UHFFFAOYSA-N 440.219 4.787 50 10 IJGE C/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12 1264241235 RONVZPCNPGYUOI-BMRADRMJSA-N 425.463 4.905 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CC(C)C)cc1 1865709065 MSQBYSGYKMILAZ-QFIPXVFZSA-N 428.536 4.995 50 10 IJGE C[C@@H](CCl)N(Cc1ccccc1)C(=O)c1ccc(F)cc1I 1914222711 CJGNKCULUPALIM-LBPRGKRZSA-N 431.676 4.700 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)C(=O)c1ccc(Cl)c(Br)c1 1916354687 KTMSOEPSNGQXPT-OAHLLOKOSA-N 431.157 4.999 50 10 IJGE Brc1cc([C@H](Br)[C@@H]2[C@H]3CCOC[C@H]32)c(Br)s1 1937556893 BMPRUVOYPXQRCN-MMBFECLISA-N 430.987 4.992 50 10 IJGE BrC[C@@H]1CSCCN1Cc1c(Br)cccc1Br 1945333685 TZFGRRCNBJKKJN-SECBINFHSA-N 444.030 4.524 50 10 IJGE BrCC[C@H]1CCCN(c2ncc(Br)cc2Br)CC1 2032377077 BPQDRFBHPHFHDN-SNVBAGLBSA-N 441.005 4.998 50 10 IJGE C[C@H]1CC[C@H](Br)CN1C(=O)c1c(Br)cccc1Br 2033089868 YKNNHRIVHXLXDX-IUCAKERBSA-N 439.973 4.600 50 10 IJGE Brc1ccc(Br)c(CN2CC[C@H](Br)[C@H]2C2CC2)c1 2067010479 BFCYFZQTBLJZEC-UONOGXRCSA-N 438.001 4.959 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)C[C@H]1CCC[C@H]1Br 2086653428 XYHYYJITNYKGFR-VXGBXAGGSA-N 442.566 4.940 50 10 IJGE CN(C[C@H]1CCCCN1C[C@H](CBr)c1ccccc1)C(=O)OC(C)(C)C 2106782100 NWRZSTADIMWZRY-RBUKOAKNSA-N 425.411 4.887 50 10 IJGE CCn1cc(Br)c([C@@H](Cl)c2sc(COC)cc2Br)n1 2124767413 CFCCNJWBYYWVSB-SNVBAGLBSA-N 428.577 4.964 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CC[C@H]2CCN(Cc3ccccc3)C[C@@H]2C1 2148929711 OMUBGKGQPOLVSN-IFMALSPDSA-N 427.386 4.566 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CC[C@H](Cl)C(F)(F)CC1 2150504217 UDRZZVQNZPCDOW-JTQLQIEISA-N 431.502 4.690 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H](NC(=O)OC(C)(C)C)C[C@@]12CCOC2 2163061695 HQWXLFJLCJWZFR-DYESRHJHSA-N 447.458 4.726 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OCCCCC(F)F)C1 2212213344 HAQMJJCUJXFMBP-MRXNPFEDSA-N 447.304 4.643 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](Br)[C@@H](OCc2ccc(Cl)cc2Cl)C1 2212516490 ODMSPLISTHWROF-JSGCOSHPSA-N 425.150 4.893 50 10 IJGE CN(CC[C@H](Br)c1ccccc1)C[C@H]1CC1(Br)Br 2218005887 KVMKHGPHKUTYSY-OLZOCXBDSA-N 440.017 4.951 50 10 IJGE ClCCC[C@@H]1CCCN(c2ncc(I)cc2Br)C1 2218756982 AUZTZHBPJXZHFS-SNVBAGLBSA-N 443.554 4.684 50 10 IJGE CN[C@@H](Cc1cc(Br)cc(Br)c1)[C@H]1C[C@@H](Br)C1 2252836546 DCDMCNLYSAIZQB-BIMULSAOSA-N 425.990 4.516 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1C(=O)c1cc(Br)cc(Br)c1 2260379072 KVQBKLVHPJOXIY-VXGBXAGGSA-N 439.973 4.600 50 10 IJGE CC1(C)C[C@H](CCl)CN(C(=O)c2ccc(Cl)c(I)c2)C1 2283656891 PYLTZHRUPLBJIQ-SNVBAGLBSA-N 426.125 4.672 50 10 IJGE C[C@H]1C[C@H](CBr)CN1Cc1ccc(Cl)c(I)c1 2300239996 GSHMPFZTHBTPSU-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE COc1ccc(CNC(=O)C(C#N)=Cc2ccc(OCc3cccc(C)c3)c(OC)c2)cc1 2313681137 MJYKERZBAAIMMX-UHFFFAOYSA-N 442.515 4.815 50 10 IJGE CCCCCCOc1ccc(C=C(C#N)C(=O)Nc2ccccc2C(=O)OC)cc1OC 2314729120 WWQVGLMHLYIMDW-UHFFFAOYSA-N 436.508 4.987 50 10 IJGE N#CC(=CNCc1ccccc1Br)C(=O)Nc1cccc(Cl)c1Cl 2324381056 BEACATBUEHCEOK-UHFFFAOYSA-N 425.113 4.892 50 10 IJGE COc1ccc([C@@H](C)NC(=O)C(C#N)=CN[C@@H](C)c2ccc3c(c2)CCCC3)cc1OC 2325044964 OPCXVARRIOFILS-ZWKOTPCHSA-N 433.552 4.518 50 10 IJGE Clc1cc(Br)c(CN2CCC3(CC2)C[C@@H](Br)CO3)s1 2345962122 SBMRSGJEXJKJNC-SECBINFHSA-N 429.605 4.682 50 10 IJGE F[C@]12CCC[C@@]1(CCl)CN(Cc1ccc(Cl)c(I)c1)C2 2362371811 UTGJTPYZWFGZPZ-CABCVRRESA-N 428.116 4.878 50 10 IJGE CC[C@@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)COc1cc(C)ccc1C(C)C 9873215 OPVLTUSEAJRSTO-RTBURBONSA-N 426.557 4.626 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccs4)ccc32)c1 38684408 RRYSFRXZEKYIAC-JOCHJYFZSA-N 432.501 4.974 50 10 IJGE Cc1c(C(=O)N2CCCCCC2)oc2c1/C(=N/NC(=O)c1cccc(Cl)c1)CCC2 40813321 VTQBCPZZWLGPEL-XIEYBQDHSA-N 427.932 4.728 50 10 IJGE CCN(C(=O)c1oc2c(c1C)/C(=N/NC(=O)Cc1ccccc1)CCC2)c1cccc(C)c1 40815856 GJKHSJZCXGVXQS-XAYXJRQQSA-N 443.547 4.962 50 10 IJGE CCOc1c(Br)cc(/C=N/NC(=O)COc2ccccc2C(C)C)cc1OC 40911844 VVKDXUHFWBRWLG-FSJBWODESA-N 449.345 4.509 50 10 IJGE CC[C@@H](N/C=C(/C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1ccc2c(c1)CCCC2 217230286 LQQHYDBZQAUEOC-OHUBLEDJSA-N 434.496 4.569 50 10 IJGE Cc1ccc(Sc2c(C=NNC(=O)c3ccncc3)c(C)nn2-c2ccccc2)cc1 252627003 RJYNSZUDIGVIIF-UHFFFAOYSA-N 427.533 4.799 50 10 IJGE CC(C)CCOc1ccc(C=NNC(=O)CSc2nnc(-c3ccccc3)s2)cc1 256028461 NUVVNQTZLJVTEX-UHFFFAOYSA-N 440.594 4.872 50 10 IJGE CC(=O)[C@@H](Br)[C@@H](C)c1ccc(I)c(Br)c1 300892024 FZBGHOVANDXODO-KGFZYKRKSA-N 445.920 4.510 50 10 IJGE CC[C@](C)(CO[C@](C)(CI)c1ccccc1Br)OC 319264034 BYDPGBVDKWNUIC-HUUCEWRRSA-N 441.147 4.931 50 10 IJGE C[C@H](Br)C[C@@H](C)CNC(=O)c1ccc(Br)cc1Br 397836216 MQHFWAJVGLRWES-BDAKNGLRSA-N 441.989 4.751 50 10 IJGE Cn1cc(CC(CCl)(CCl)c2ccccc2Br)c(Br)n1 714089612 RCZWCKQGNXBZLR-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE O=C(N[C@@H](CCCl)C1CCCC1)c1ccc(I)c(Cl)c1 725043185 LAKNZQZMRRUSET-AWEZNQCLSA-N 426.125 4.862 50 10 IJGE O=C(NCc1ccc2ccccc2c1)NNC(=O)c1ccccc1OCc1ccc(F)cc1 729618087 ZNSPRZJSJNYUNV-UHFFFAOYSA-N 443.478 4.702 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N[C@@H](Cc2nccn2C)c2ccccc2)c(C)n1CCC(C)C 744351234 YHZVYQHTPQALRG-NHOMFQCRSA-N 443.595 4.892 50 10 IJGE O=S(=O)(NCC[C@@H]1COc2ccccc2O1)c1ccc(S(F)(F)(F)(F)F)cc1 782985555 PDVAHFNYRQYLLH-GFCCVEGCSA-N 445.431 4.852 50 10 IJGE Cn1nccc1[C@@H]1CCCCN1S(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1 798473381 HAHXLZYYWGTFNQ-HNNXBMFYSA-N 431.452 4.993 50 10 IJGE Cc1cc(C=NNC(=O)[C@@H]2COc3ccccc3O2)c(C)n1-c1cc(Cl)ccc1Cl 1084279288 VHNNIQJXZOUVQI-NRFANRHFSA-N 444.318 4.691 50 10 IJGE Cc1cc(C=NNC(=O)C(=O)Nc2cccc3ccccc23)c(C)n1-c1ccccc1Cl 1084325590 QHKUUHFFTPKNKJ-UHFFFAOYSA-N 444.922 4.990 50 10 IJGE C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1nc2cc(Cl)ccc2cc1C 1137831136 NIDVFDMGHWMSAR-MRXNPFEDSA-N 439.343 4.676 50 10 IJGE C#CC[C@]1(C(=O)NNc2ccc(Cl)c(C(F)(F)F)c2)CCCN1C(=O)OC(C)(C)C 1165454187 OILUBYOGPOBXNF-LJQANCHMSA-N 445.869 4.595 50 10 IJGE C=CCNC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(C)cc2)c1C 1524971548 LUPLTAPVKSZZSR-CJLVFECKSA-N 438.531 4.864 50 10 IJGE CCOc1ccc(Br)cc1C=NNC(=O)COc1ccc(C(C)(C)C)cc1 1772753661 AMQUKSLRWUHKSN-UHFFFAOYSA-N 433.346 4.674 50 10 IJGE CCCC[C@H](NC(=O)[C@@H](C)Cc1ccc(F)cc1)C(=O)Nc1ccc(SC#N)cc1 1866840966 RDELNJJTEOSFEP-KKSFZXQISA-N 427.545 4.891 50 10 IJGE CC[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1880757032 WEQGIGPVAGMLJH-RBSFLKMASA-N 435.403 4.558 50 10 IJGE CC(C)[C@H](C)[C@@H](C)O[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1901527238 SMRFVCWQMLUNEX-HDMKZQKVSA-N 439.378 4.888 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@@H]2CCCC23CC3)C1 1986119054 PFMXMISCEUFGJP-KDOFPFPSSA-N 435.346 4.540 50 10 IJGE Cc1ccc([C@@H](CI)OCCOCCOCc2ccccc2)cc1 2007814675 VURTZUSQWMAXLZ-HXUWFJFHSA-N 440.321 4.721 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OCC[C@]23CCC[C@H]2C3)CC1 2011684862 IOUKTDSNIBEOBY-YJBOKZPZSA-N 449.373 4.788 50 10 IJGE C[C@H](Br)[C@H]1CCCN1Cc1cc(Cl)ccc1I 2018105819 YJBUUSLWJHPKQX-TVQRCGJNSA-N 428.539 4.692 50 10 IJGE CN[C@@H](c1ccc(Br)c(C)c1Br)C1CC(Br)C1 2024281146 CSJYJIRSJLKOTG-KJHLLKJSSA-N 425.990 4.954 50 10 IJGE CC1(C)[C@@H](Cl)CC[C@@H]1Nc1ncc(I)cc1Br 2026157986 WOYFDOSYXCMOAD-UWVGGRQHSA-N 429.527 4.657 50 10 IJGE CCN(CCCCBr)C(=O)c1ccc(I)c(Cl)c1 2041183982 RFUFXYFIJRJEGW-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE C[C@H]1CCCN(Cc2ccc(I)c(Cl)c2)[C@H]1CBr 2086661489 MXFIZDDQIBCFEB-HZMBPMFUSA-N 442.566 4.940 50 10 IJGE C[C@@H]1CCO[C@H]1CO[C@](C)(CI)c1ccccc1Br 2096130624 XNTKDBYOWHIQCB-BYCMXARLSA-N 439.131 4.541 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H](CNC(=O)C(F)(F)F)C2(CCC2)C1 2174053040 FUAMWARPZJSBGF-HNNXBMFYSA-N 441.376 4.749 50 10 IJGE O=C(c1c(Cl)cccc1Br)N1CC[C@H](C(F)(F)CBr)C1 2197763606 PGSQRLBZZKXONU-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE CCn1ncc(Br)c1[C@H](Br)c1cc(Cl)c(F)cc1OC 2207358898 ZJQHSYFFBVLFSY-GFCCVEGCSA-N 426.511 4.951 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N(CC(C)C)C[C@H](C)Br)c1Br 2288057122 CWWHOBKYSRMBMF-VIFPVBQESA-N 447.258 4.558 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@H](Br)[C@@H]1OCCO[C@@H]1C 2295264779 JYCRNQWSJQJXQU-OXHMUOHRSA-N 428.548 4.659 50 10 IJGE Cc1cc(I)c(OC[C@H](Br)C(F)(F)F)cc1Cl 2299800064 XNVCCDUOACOEML-VIFPVBQESA-N 443.428 4.958 50 10 IJGE COc1cc(C=NNC(=O)c2ccc3nc(-c4ccccc4)[nH]c3c2)ccc1OC(C)C 2323744554 NCMWFGYFSBOACF-UHFFFAOYSA-N 428.492 4.790 50 10 IJGE CN(C[C@@]1(CBr)CC1(F)F)[C@@H]1CCCC[C@H]1N(C)C(=O)OC(C)(C)C 2326923919 ZZUJMAASZYKGFT-CPUCHLNUSA-N 425.358 4.517 50 10 IJGE COc1ccccc1C1(CNC(=O)C(C#N)=Cc2ccc(Br)cc2)CCCC1 2329659918 ZJEVQJKMROAXTB-UHFFFAOYSA-N 439.353 4.993 50 10 IJGE COc1ccc(OC)c(CC(O)=C(C#N)c2nc(-c3ccc4c(c3)OCCO4)cs2)c1 2331329986 HEBFLXLFKADYSB-UHFFFAOYSA-N 436.489 4.634 50 10 IJGE CCCCCOc1ccc(C(=O)NC(=S)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1 14029790 NCHCPIJAWBTTEU-UHFFFAOYSA-N 441.597 4.502 50 10 IJGE CCC(C)(C)c1ccc(OCC(=O)NNC(=O)COc2ccc(-c3ccccc3)cc2)cc1 14784139 BTDGMGJMOFVWNQ-UHFFFAOYSA-N 446.547 4.646 50 10 IJGE N#C/C(=C/c1ccc(-c2cccc(C(=O)O)c2)o1)C(=O)Nc1ccc(Br)cc1 33301333 HAWMDOFJCWBFGQ-PTNGSMBKSA-N 437.249 4.953 50 10 IJGE CCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2F)c1 38652185 AXQHEJWFAPUUCB-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2cc(C)n(-c3cccc(C)c3)c2C)cc1 58893338 ZPUPTGNRTXSERP-RWJNZEQESA-N 433.552 4.765 50 10 IJGE CCOC(=O)c1ccc(-n2c(C)cc(/C=N/NC(=O)c3cc4ccccc4o3)c2C)cc1 59304281 NMWRLEFTFHJHOC-CVKSISIWSA-N 429.476 4.781 50 10 IJGE CCCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccccc3F)c(OC)c2)C1=O 214230903 YFQZRWHHYXBKLQ-MOSHPQCFSA-N 448.494 4.806 50 10 IJGE C[C@H](Cl)c1nc2cc(I)ccc2n1C[C@@H]1CSCCS1 229627154 FLMSTSAVZOEPNY-GXSJLCMTSA-N 438.787 4.789 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)N1CCN(c3cccc(Cl)c3)CC1)[C@H]2Br 256019801 FRGCDDKBHSLWEF-DBVUQKKJSA-N 425.798 4.578 50 10 IJGE ClCc1sc2cccc(I)c2c1I 307666666 FAYBWHRGPHJVMB-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE BrCC1(CN2CCO[C@H]3CCN(Cc4ccccc4)C[C@@H]32)CCCCCC1 404261213 RNBRBQAJRRBTMC-VXKWHMMOSA-N 435.450 4.697 50 10 IJGE N#CSc1ccc(NC(=O)Nc2cccc(C(=O)Nc3ccc4c(c3)OCO4)c2)cc1 586732465 BAYAURAYBTWWEX-UHFFFAOYSA-N 432.461 4.885 50 10 IJGE CC[C@@H](CBr)N(C)C(=O)c1scc(Br)c1Br 705425020 JGEBXRNPEXLVDJ-LURJTMIESA-N 433.991 4.519 50 10 IJGE O=C(N[C@@H](CBr)C1CCC1)c1scc(Br)c1Br 717649620 SVESKRQIECUDTP-QMMMGPOBSA-N 446.002 4.567 50 10 IJGE CC(C)[C@@H](NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1cccc(C(F)(F)F)c1 726609984 FYSYAWJVRVFIAH-LJQANCHMSA-N 432.446 4.538 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)c1C 726766098 LFZADOHQPNNBQO-SJJOQSKNSA-N 444.539 4.521 50 10 IJGE O=C(NNC(=O)[C@H](Sc1cc(F)ccc1F)c1ccccc1)c1cccc2cccnc12 730215599 FZMOGMFKBVCCFW-JOCHJYFZSA-N 449.482 4.808 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1C 736696327 CRKZVSDQFSOVFT-UHFFFAOYSA-N 447.502 4.523 50 10 IJGE CCN1CCC(CCNC(=O)C(=O)Nc2cccc(S(F)(F)(F)(F)F)c2)CC1 762666279 ONYNYSDXJOPEAD-UHFFFAOYSA-N 429.455 4.521 50 10 IJGE C=C(CBr)COC(=O)C1(c2ccc(OCc3ccccc3)cc2)CCOCC1 795528576 WNMBOYVXZSJRDB-UHFFFAOYSA-N 445.353 4.808 50 10 IJGE O=C(NNc1ccc2c(=O)[nH]ccc2c1)[C@H](Oc1ccc(F)c(Cl)c1)c1ccccc1 803439296 ZQDRTZGVCUCGBO-OAQYLSRUSA-N 437.858 4.584 50 10 IJGE C/C(=C/c1ccc(Br)o1)C(=O)NNC(=O)Nc1ccc(Cl)cc1Cl 1467439886 RDJBLBFREZPKHP-VURMDHGXSA-N 433.089 4.605 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2cc(Cl)ccc2Oc2ccc(F)cc2)c1 1637295262 SYVVGGQVJHCBOK-UHFFFAOYSA-N 439.899 4.884 50 10 IJGE CC(=O)c1ccc(Br)c(NC(=O)NNc2ccc(Br)c(F)c2)c1 1673984951 UTHYFVXXVGQYMG-UHFFFAOYSA-N 445.086 4.702 50 10 IJGE CCc1nn(Cc2cc(C)ccc2C)c2c1[C@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689367 QSKARSOEOFSUGG-OAQYLSRUSA-N 434.927 4.688 50 10 IJGE CCCC[C@H](NC(=O)[C@H]1C[C@H]1c1ccc(F)cc1)C(=O)Nc1ccc(SC#N)cc1 1866939725 MEIOOYFUESTKIG-ACRUOGEOSA-N 425.529 4.816 50 10 IJGE CN(CC1CC(Br)C1)C(=O)CCc1ccc(NC(=O)OC(C)(C)C)cc1 1887829767 NORISVHXKIXGNX-UHFFFAOYSA-N 425.367 4.598 50 10 IJGE Fc1cc(Br)c2nc(CCl)n([C@H]3[C@@H]4CN(Cc5ccccc5)C[C@@H]43)c2c1 1912683858 NLSWSLIUPOZFLD-QVDMIQRCSA-N 434.740 4.980 50 10 IJGE CC1(C)CN(C(=O)c2scc(Br)c2Br)[C@H]1CBr 1944096565 MSYBYDYOTCCBFP-ZETCQYMHSA-N 446.002 4.519 50 10 IJGE Cc1c(I)cccc1-n1c(Cl)nc(Cl)c1CBr 2006648472 UJKXRUKJKLENJW-UHFFFAOYSA-N 445.913 4.987 50 10 IJGE C[C@H](N(Cc1ccccc1)S(=O)(=O)CCC(F)(F)CBr)C(C)(C)C 2009713211 XMZTXGMJWCJHED-AWEZNQCLSA-N 426.367 4.673 50 10 IJGE CC(C)(C)OC(=O)NCCCC[S@](C)(=O)=NCC1(CBr)CCCCC1 2047800245 KWCVUKHJXSQNHZ-VWLOTQADSA-N 439.460 4.735 50 10 IJGE C[C@@H]1CN(c2ncc(Br)cc2Br)CC[C@@H]1CCBr 2052374861 OEGDCDSSRGGVJW-ZJUUUORDSA-N 441.005 4.854 50 10 IJGE C[C@@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)c1c[nH]c(CBr)c1 2059323867 OSTMOWGMMOKJLX-AWEZNQCLSA-N 439.400 4.923 50 10 IJGE C[C@H](Br)[C@H]1CCCN1C(=O)c1cc(Br)cc(Br)c1 2073319406 FVHCYFUWAHCTPZ-QPUJVOFHSA-N 439.973 4.600 50 10 IJGE CN(C[C@]1(Br)CC1(F)F)c1cccc(Br)c1CBr 2082522182 SLVPZLZXCPCYQF-LLVKDONJSA-N 447.943 4.953 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@@H]2C[C@@H](Cl)CC[C@@H]21 2087665448 WBXIGAGWDQPYFX-WEDXCCLWSA-N 427.589 4.895 50 10 IJGE Brc1ccccc1[C@H](CI)OC[C@@H]1CCCCCO1 2096321537 FMIGFOHUSVWALX-WFASDCNBSA-N 439.131 4.901 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N(C[C@H](CBr)c2ccccc2)C1 2106785846 COCZWBYJOVARRS-LNLFQRSKSA-N 425.411 4.742 50 10 IJGE Fc1cc2c(cc1Br)nc(CCCl)n2[C@@]12C[C@H]1CN(Cc1ccccc1)C2 2155862867 KJUBBHIHJQHHNZ-YCRPNKLZSA-N 448.767 4.950 50 10 IJGE CN(Cc1ncc(Cl)n1C)c1cc(Br)cc(F)c1CBr 2170692632 SSMYHYZQSUBGAI-UHFFFAOYSA-N 425.527 4.506 50 10 IJGE O=C(c1ccc(Br)cc1Cl)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Br)C2 2190679447 QKLDQWMMZMZPIF-JBSCMGISSA-N 425.523 4.581 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@H](Cl)c2ccc(Br)cc2Br)C1 2203682403 HRKXWPFYRPOADW-CUOATXAZSA-N 442.600 4.706 50 10 IJGE COc1cc(N2CC[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)ccc1CBr 2204559498 PRSPMYNNOSXZPC-CTNGQTDRSA-N 429.402 4.939 50 10 IJGE O=C(c1cc(Cl)ccc1I)N1CCCC[C@@H]1CCCCl 2206691162 IDWYTUBOXNWKKW-GFCCVEGCSA-N 426.125 4.958 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C(F)(F)F)N(CCCCCCBr)CC1 2223283621 UZLROEJSZXJUES-AWEZNQCLSA-N 431.337 4.815 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@]1(C)CBr 2282977511 CVGZIXGHFZLYDW-CLAHSXSESA-N 427.539 4.735 50 10 IJGE Cc1cc(C(=O)N2CCC(CBr)(C(F)F)CC2)c(Br)s1 2289943896 WRBOXIXPJLWXHF-UHFFFAOYSA-N 431.140 4.701 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)cc2I)CC[C@@H]1Br 2302315130 GAOJLZKCGDJRRA-CABZTGNLSA-N 428.539 4.550 50 10 IJGE Clc1ccc(CN[C@H](CBr)C2CCC2)c(I)c1 2302325797 KIRDSPBDBUXFBI-CYBMUJFWSA-N 428.539 4.598 50 10 IJGE CCN(C)C[C@H](Cl)CCc1ccc(I)c(Br)c1 2306218285 YPPVZROOUWUDMD-LLVKDONJSA-N 430.555 4.545 50 10 IJGE BrC[C@@H]1C[C@@H]2CC[C@H]1N2Cc1ccc(Br)cc1Br 2308525613 VKWFBCZEBNKPIY-VHRBIJSZSA-N 438.001 4.959 50 10 IJGE N#CCOC(=O)c1cc(-c2ccc(C=C(C#N)C(=O)Nc3ccccc3)o2)ccc1Cl 2313548844 HBEDUXOAPWHKCZ-UHFFFAOYSA-N 431.835 4.826 50 10 IJGE O=C(NN=C1C(=O)N(CC=Cc2ccccc2)c2ccccc21)c1cc2ccccc2cc1O 2313646602 LQQOPYNRFCPSTG-UHFFFAOYSA-N 447.494 4.740 50 10 IJGE CC(C)N(C)C[C@H](Br)CCc1ccc(Cl)c(I)c1 2315550094 ZQXNRTAAHAPHBX-GFCCVEGCSA-N 444.582 4.981 50 10 IJGE N#CC(=Cc1ccc(Br)cc1)C(=O)Nc1nc2ccc([N+](=O)[O-])cc2s1 2329663600 FUIDCBUDSUYMIA-UHFFFAOYSA-N 429.255 4.513 50 10 IJGE N#CC(=C(O)[C@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2cccc([N+](=O)[O-])c2)cs1 2331232922 ZYAFBVHBGPPYLN-KRWDZBQOSA-N 446.488 4.560 50 10 IJGE Cc1nnsc1CN(C)c1c(CBr)ccc(Br)c1Cl 2335984305 RFPXYHHIFOCECP-UHFFFAOYSA-N 425.577 4.794 50 10 IJGE C[C@H](O[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1Br)c1cccc(OC2CC2)c1 2342607118 MKUQEYWXNKMOAK-MORSLUCNSA-N 426.351 4.688 50 10 IJGE ClCc1cc(Cl)c(OCc2ncc(I)cn2)c(Cl)c1 2353065532 PHSXHECWRUFESN-UHFFFAOYSA-N 429.472 4.706 50 10 IJGE Cc1sc(Br)c([C@@H](Br)[C@]23CCC[C@H]2CS(=O)(=O)C3)c1C 2358059135 USXATHPBMTVARZ-SUHUHFCYSA-N 442.238 4.778 50 10 IJGE O=C(c1ccc(Cl)cc1I)N1CCC[C@@H](CCCCl)C1 2365593090 RWRDBIIDGHIUSC-LLVKDONJSA-N 426.125 4.816 50 10 IJGE Cc1ccc(COc2ccccc2/C=N\NC(=O)CSc2nc3ccccc3[nH]2)cc1 50954545 VQCIMLNHGFJEQJ-QFEZKATASA-N 430.533 4.693 50 10 IJGE CS(=O)(=O)c1cccc([C@H](Br)c2cc(F)c(Br)cc2F)c1 70474471 SSSQLORSBDXRTJ-AWEZNQCLSA-N 440.103 4.615 50 10 IJGE O=C(NCC1(CCBr)CC1)c1cc(C(F)(F)F)ccc1Br 97908001 KGCZOIFBRUVBBN-UHFFFAOYSA-N 429.074 4.763 50 10 IJGE O=[N+]([O-])c1ccccc1C[C@H](Br)c1ccc(I)cc1 104169007 DMNQKILJOQFZDO-ZDUSSCGKSA-N 432.055 4.878 50 10 IJGE [C-]#[N+][C@@H](c1ccc(Br)c(Br)c1)S(=O)(=O)c1ccc(C)cc1 138944739 IOZWLLBEPSQIMR-OAHLLOKOSA-N 429.133 4.912 50 10 IJGE CC(=NNC(=O)c1cc(-c2ccc(OCc3ccccc3)cc2)n[nH]1)c1ccccc1O 254817099 WTLUMLBOOXLPNO-UHFFFAOYSA-N 426.476 4.515 50 10 IJGE O=C(NNc1ccccc1[N+](=O)[O-])c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 727721726 PQXXFPKIHXFSRI-UHFFFAOYSA-N 433.399 4.571 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2ccccc2SCc2cscn2)c1C 734256256 SSJCPFGKGJGVCE-UHFFFAOYSA-N 448.577 4.661 50 10 IJGE C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)NNC(=O)c3cccc4cccnc34)c2)C1 756256377 HXMXRJWMNRGUML-DYESRHJHSA-N 432.524 4.797 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OCc2ccc(Cl)cc2F)c(-c2ccccc2)n1 781125593 CVSKWCLCZBVPIC-WOJGMQOQSA-N 434.858 4.907 50 10 IJGE CC(C)Cn1nc(-c2ccccc2)cc1NC(=O)C(=O)NNc1ccc(Cl)cc1Cl 784801505 QDKOYLBRYNMRDD-UHFFFAOYSA-N 446.338 4.595 50 10 IJGE C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F 792383470 CJKCWSYAPCDITB-TVLCNXBWSA-N 448.816 4.644 50 10 IJGE Cc1sc2nc(CS[C@@H](C)C(=O)NNc3cc(F)cc(Cl)c3)nc(O)c2c1C 1300533176 OLTSYLCJEKWQJE-JTQLQIEISA-N 440.953 4.571 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2ccc(-n3ccc(O)n3)cc2)c(C)n1-c1ccc(F)cc1 1630884236 MTUXRLPUZGOZGP-XMHGGMMESA-N 441.466 4.670 50 10 IJGE Cc1c(C(=O)Oc2ccc3ccccc3c2)oc2c1C(=NNC(=O)c1cccnc1)CCC2 1772746729 ZAZCBLSNGFROEA-UHFFFAOYSA-N 439.471 4.826 50 10 IJGE CCc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccc1O)CCC2 1772751894 PKBCGRVUQVNLKP-UHFFFAOYSA-N 431.492 4.579 50 10 IJGE CCOc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3CC)ccc1OCc1ccc(C)cc1 1865689603 UDABNYIOOFAPBC-XMMPIXPASA-N 444.535 4.716 50 10 IJGE CCCc1nn(Cc2ccccc2)c2c1[C@H](c1ccc(OCC)c(OC)c1)C(C#N)=C(N)O2 1865694864 DKANZNCCRWESKS-HSZRJFAPSA-N 444.535 4.509 50 10 IJGE CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)/C(C#N)=C/c3ccc(F)cc3)c2C(N)=O)C1 1866127940 NZEDSFRNXFTUDT-YVGNARHYSA-N 425.529 4.683 50 10 IJGE COc1ccc(Cl)cc1-c1csc(/C(C#N)=C(\O)[C@H]2CC(=O)N(C(C)(C)C)C2)n1 1872758708 MROFBBIGAPFDJL-IBPDABBASA-N 431.945 4.912 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C[C@H](Br)C(F)(F)F)CC2)C1 1879207064 ZEYWQOYGTRZTKC-CABCVRRESA-N 443.348 4.671 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C(C)(C)C(=O)NC[C@H]2C[C@@H](Br)C2)cc1 1887793142 HCLBXGKAZCQBIF-OTVXOJSOSA-N 425.367 4.601 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC[C@@H]1CC[C@@H]1C(C)(C)C 1902716553 UIPQDQRWHPXXDJ-DEYYWGMASA-N 439.378 4.794 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@@H](CI)O2)CC12CCCC2 1990423895 KRHWFUDGLHLXCB-KBXCAEBGSA-N 435.346 4.683 50 10 IJGE Cc1ccc([C@H](CI)OCCOCCOCc2ccccc2)cc1 2007814674 VURTZUSQWMAXLZ-FQEVSTJZSA-N 440.321 4.721 50 10 IJGE FC1(F)CCN(c2ncc(Br)cc2Br)CC[C@@H]1Br 2032656061 FLJQMPRLVZSEJD-VIFPVBQESA-N 448.931 4.606 50 10 IJGE C[C@H](CCBr)CCN1CCN(C(=O)OC(C)(C)C)[C@@H](CC(F)(F)F)C1 2055947362 HAEYLDVBUHTGNG-KGLIPLIRSA-N 431.337 4.671 50 10 IJGE CCCN(c1ncc(Br)c(CCl)n1)C1CCN(Cc2ccccc2)CC1 2089808995 CMFRIGRXGPXWJV-UHFFFAOYSA-N 437.813 4.859 50 10 IJGE CCn1cc(S(=O)(=O)N(Cc2ccccc2)CC2CCCC2)cc1CBr 2123199528 UEPGUUWCKQCNTD-UHFFFAOYSA-N 439.419 4.784 50 10 IJGE CC(C)(C)OC(=O)N1CCN(Cc2ccc(CBr)cc2)[C@@H](CC(F)F)C1 2127048878 XHBJFKGYHQNFFL-INIZCTEOSA-N 433.337 4.658 50 10 IJGE CC[C@H](CBr)CN1C[C@H](CNC(=O)OC(C)(C)C)[C@@H](c2ccccc2)C1 2129068458 QVYIODQJSIMUPT-NZSAHSFTSA-N 425.411 4.648 50 10 IJGE Cc1cc(C(=O)N[C@@H](C)CCCCCBr)ccc1I 2142140050 FFWINFOIHIACDP-LBPRGKRZSA-N 438.147 4.673 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CC2(CBr)CCC2)C[C@H]1c1ccccc1 2185530236 SFTKYQJMKJKWOM-OALUTQOASA-N 437.422 4.792 50 10 IJGE CC(C)CNCc1cc(Br)cc(Br)c1OC[C@@H]1C[C@@H]1Cl 2196897176 VTVQZXSOVIGYQK-FZMZJTMJSA-N 425.592 4.963 50 10 IJGE CC[C@H](C[C@@H](C)Br)NC(=O)c1ccc(Cl)c(I)c1 2256387862 GXIPPEDSMBVXFV-PSASIEDQSA-N 444.538 4.627 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@]12COC[C@H]1C2 2260000339 YTOPVLAKXXTHJM-ZSCXHOBISA-N 446.911 4.962 50 10 IJGE C[C@H]1CC[C@H](CBr)CN1C(=O)c1cc(Br)c(F)cc1Cl 2285844637 PJVPIRAODZHHAI-DTWKUNHWSA-N 427.539 4.877 50 10 IJGE CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)C(C#N)=Cc1cc(OC)ccc1O 2296833199 LHHUNDLRLSWRAS-UHFFFAOYSA-N 448.500 4.852 50 10 IJGE Clc1ccc(CN2C[C@H](Br)CC3(CC3)C2)c(I)c1 2318540337 PPPXXSSAXXLRSB-LLVKDONJSA-N 440.550 4.694 50 10 IJGE CC(C)N(C)C[C@H](Br)CCc1ccc(Cl)cc1I 2318542669 XFGUTRWBNOYZRF-GFCCVEGCSA-N 444.582 4.981 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccsc1C(F)(F)F 2320355815 CHOKNUNKYGKAOO-ZDUSSCGKSA-N 436.293 4.867 50 10 IJGE COc1ccc(C(C#N)=Cc2ccc(OC(=O)Cc3cccs3)c(OC)c2)cc1OC 2320506049 ALMJJWGCOOYYSK-UHFFFAOYSA-N 435.501 4.986 50 10 IJGE O=C(C=Cc1cccc(OCc2ccccc2)c1)NNC(=O)CCCSc1ccccc1 2321108663 AAANMPKSTZZYIV-UHFFFAOYSA-N 446.572 4.999 50 10 IJGE COc1cc(C=NNC(=O)c2ccc3nc(Cc4ccccc4)[nH]c3c2)cc(Cl)c1OC 2323721340 LDTNKEJNIFJZIP-UHFFFAOYSA-N 448.910 4.588 50 10 IJGE C[C@H](CBr)CC1CN(Cc2cc(I)ccc2Cl)C1 2327396527 DKQJBJWCLAAPNU-JTQLQIEISA-N 442.566 4.798 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCN(C[C@H]2C[C@@H](Br)C2)[C@@H](C(F)(F)F)C1 2337544374 BGHUALQPXGHHBK-APIJFGDWSA-N 443.348 4.718 50 10 IJGE COc1ccc(CCO[C@H]2CCCC[C@@H]2I)c(Br)c1 2339257668 LUNGRQBYXCNSQA-GJZGRUSLSA-N 439.131 4.763 50 10 IJGE CCN(C[C@]1(CBr)CC1(F)F)[C@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2351888374 WPFBGJDUADTSFN-RLFYNMQTSA-N 439.385 4.812 50 10 IJGE O=C(NNc1nc(-c2ccccc2)c2cc(Br)ccc2n1)c1ccc(F)cc1 1509812 DEVNWLVLOJVVMG-UHFFFAOYSA-N 437.272 4.955 50 10 IJGE CC[C@@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)COc1ccccc1C(C)C 10682346 CSLVROZOCBEZMT-WIYYLYMNSA-N 426.557 4.707 50 10 IJGE Cc1ccccc1CC(=O)NNC(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1 14562502 DAEMXCAUGLZUGM-UHFFFAOYSA-N 443.547 4.549 50 10 IJGE CCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(OC)cc2)c1 38650379 BMHXLCUNZOONLP-XMMPIXPASA-N 442.471 4.531 50 10 IJGE C[C@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccccc1F 38652079 MOUPILQEYJUYHS-PSLXWICFSA-N 448.425 4.556 50 10 IJGE Cc1ccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2[N+](=O)[O-])cc1 40648967 AQSFXWFJJNCGPO-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccc(OC)c2)CCC3)cc1 40822489 LINITDPGDDITNN-SZXQPVLSSA-N 446.503 4.849 50 10 IJGE C/C(N)=C(\C#N)C(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(C)cc1)CC2 103879122 DHTDSQDAYPQERK-FXHHBWITSA-N 437.499 4.512 50 10 IJGE Br[C@H](c1ccc(I)cc1)c1cnn(-c2ccccc2)c1 109864299 KEZJERRHABENDY-MRXNPFEDSA-N 439.094 4.961 50 10 IJGE BrCc1cc(Br)c(OC[C@@H]2CCOC2)c(Br)c1 232484686 KJPQYVDREUXITB-MRVPVSSYSA-N 428.946 4.522 50 10 IJGE CC(=NNC(=O)c1ccc([N+](=O)[O-])cc1)c1cccc(NC(=O)c2ccccc2Cl)c1 252630912 VFSZOTPTCDDDCI-UHFFFAOYSA-N 436.855 4.655 50 10 IJGE CC[C@@H](Br)[C@@H](C)NC(=O)c1cc(Br)c(Br)s1 395374459 QIPFMVROOYPFTI-PHDIDXHHSA-N 433.991 4.565 50 10 IJGE CCOC(=O)c1csc2c(I)cc(CBr)cc12 725276447 RCHKFKGSCFKVDA-UHFFFAOYSA-N 425.085 4.578 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OCc2ncc(C3CC3)o2)c(-c2ccc(Cl)cc2)n1 781869593 RUWNFAZAUSYLDK-YVLHZVERSA-N 447.882 4.633 50 10 IJGE CC(=NNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1)c1cn2c(n1)CCCC2 807945253 JBBRSQNKQMSKRW-UHFFFAOYSA-N 444.564 4.542 50 10 IJGE O=C(COc1ccc(C=NNC(=O)c2ccc(Cl)cc2Cl)cc1)Nc1ccccc1 1084478538 MOASTNRHQITOMJ-UHFFFAOYSA-N 442.302 4.775 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cccc2cc(C)cnc12 1915088373 JWSSJZSMXKFLAG-IBGZPJMESA-N 447.398 4.908 50 10 IJGE O=C(Nc1ccc(Cl)c(I)c1Cl)[C@H]1C[C@@H](Br)C1 2020159726 SOZJMBGCAWSVSH-OLQVQODUSA-N 448.913 4.710 50 10 IJGE CCCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@@H](Br)C(F)(F)F 2044704196 APTLIHAHKIXKHK-UONOGXRCSA-N 431.337 4.814 50 10 IJGE C[C@@H]1CO[C@H](COc2c(Br)cc(CBr)cc2Br)C1 2047588544 ACSRKOCLZWYTLA-WPRPVWTQSA-N 442.973 4.910 50 10 IJGE O=C(Nc1cc(I)ccc1Cl)[C@H](Br)C1CCCC1 2048139847 OFEIOYXQYYVHQV-GFCCVEGCSA-N 442.522 4.837 50 10 IJGE Br[C@@H](Cc1ccccc1I)c1ncn2ccsc12 2083990332 IVGJPROKWLGUNH-JTQLQIEISA-N 433.112 4.679 50 10 IJGE CS(=O)(=O)C1([C@H](Br)c2cc(C3CC3)c(Br)s2)CCC1 2110377445 FFMVXPJYBHWOQL-LLVKDONJSA-N 428.211 4.791 50 10 IJGE O=C(N[C@@H]1C[C@H]2CC[C@H]1[C@H](Cl)C2)c1cc(Br)c(Br)s1 2139718993 LNJWTCZECUITQO-AKEJEFCPSA-N 427.589 4.799 50 10 IJGE CN(Cc1nn(C)c(Cl)c1Br)C[C@@H](Br)C1CCCCC1 2167656452 QIWNRHFGRTXLNI-LLVKDONJSA-N 427.612 4.612 50 10 IJGE Cc1csc(C(=O)N2C[C@]3(F)CCC[C@]3(CBr)C2)c1Br 2176637689 WHNKPDOWRGEJPB-UONOGXRCSA-N 425.161 4.548 50 10 IJGE CN(C(=O)c1cccc(Br)c1Cl)[C@@H](CCBr)C(F)(F)F 2178516560 XPUCNWJSEASXPY-VIFPVBQESA-N 437.481 4.890 50 10 IJGE Cc1sc(C(=O)NCCCCCCI)c(Br)c1C 2221834043 DLQBFGNBMGZOSE-UHFFFAOYSA-N 444.176 4.853 50 10 IJGE CC(C)(C)[C@H]1C[C@@H](S(=O)(=O)N(Cc2ccccc2)C2(CBr)CCC2)C1 2223707314 LJRRUZGVQVTJIN-HDICACEKSA-N 428.436 4.961 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2CCC[C@H](C1)[C@]21CC[C@@](C)(CI)O1 2249370457 VCNYSHGQBLHFEA-KPHNSTPASA-N 449.373 4.833 50 10 IJGE C[C@@](CBr)(NC(=O)c1scc(Br)c1Cl)C(F)(F)F 2253544816 CLTURTWZGRHOJQ-QMMMGPOBSA-N 429.483 4.610 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@]2(CCC[C@@H]2Br)C1 2264510005 PJZQVHSZEGBGTI-TVQRCGJNSA-N 427.589 4.944 50 10 IJGE CC1(C)CCC[C@@]1(CCl)NC(=O)c1ccc(Cl)c(I)c1 2283652870 AJNSBFNYOKRNBU-HNNXBMFYSA-N 426.125 4.862 50 10 IJGE CC1=C(C#N)C(=O)N([C@H](C)c2ccccc2)C(=O)C1=CNc1ccc(Br)cc1 2314579516 VXZNAFIPCBDSAV-OAHLLOKOSA-N 436.309 4.715 50 10 IJGE COc1ccc(C=C(C#N)C(=O)N(c2ccc(C)cc2)S(=O)(=O)c2ccc(C)cc2)cc1 2314777441 FMVQHJBQLHELDJ-UHFFFAOYSA-N 446.528 4.641 50 10 IJGE CN(Cc1ccc(Cl)cc1I)C[C@@H]1CCC[C@H]1Br 2318529638 SJEXDYKCEBTZEZ-GXFFZTMASA-N 442.566 4.940 50 10 IJGE ClCc1ccnc(OCc2cc(I)ccc2Br)c1 2318981862 HBCZIPDASROZAL-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE O=C(Cc1cccc(Cl)c1F)N[C@@H](CCBr)COCc1ccccc1 2320358436 NXJUHTLLXGCPRW-INIZCTEOSA-N 428.729 4.508 50 10 IJGE COc1ccc([N+](=O)[O-])cc1NC=C(C#N)C(=O)Nc1ccc(Oc2ccccc2)cc1 2325141466 DNYFCTLYECIPPL-UHFFFAOYSA-N 430.420 4.854 50 10 IJGE C[C@H](NCc1ccc(I)c(Br)c1)[C@@H]1CCC[C@@H]1Cl 2325203708 ICZWEOLJISFWKB-GAFUQQFSSA-N 442.566 4.939 50 10 IJGE CC(C)N1C[C@H](Cc2ccc(I)c(Br)c2)[C@@H](Cl)C1 2325209926 SXMYQBBEADDLON-AAEUAGOBSA-N 442.566 4.544 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@H](Br)[C@@H]1C1CC1 2327406800 MNLXPKXYCLRNDP-JSGCOSHPSA-N 440.550 4.692 50 10 IJGE CN(C[C@@H](CBr)CC1CC1)C1C[C@@H]2C[C@H](C1)CN(C(=O)OC(C)(C)C)C2 2339978653 WDQVUIGGOBTQIK-MHYDHLEJSA-N 429.443 4.765 50 10 IJGE Cc1cc(C(=O)N[C@H](CCBr)COCc2ccccc2)c2ccccc2n1 2369431400 QLLVZKLOIKXXNU-GOSISDBHSA-N 427.342 4.643 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)COc1ccccc1-c1ccccc1 9871223 QGFQIWPSOWBSHS-VQTJNVASSA-N 446.547 4.861 50 10 IJGE C/C(=N\NC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 27497417 WVGCDPKZOIAMKT-AFUMVMLFSA-N 436.855 4.655 50 10 IJGE N#C/C(C(=O)Nc1ccccc1)=C1\S[C@@H](Cc2ccccc2)C(=O)N1c1ccccc1 33783508 OHKVOWSLKADTAZ-SCIJIFGBSA-N 425.513 4.752 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4OC)ccc32)c1 38684839 SUCHQEJUDYYGSB-XMMPIXPASA-N 442.471 4.531 50 10 IJGE CCc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)COc1ccccc1)CCC2 40816022 MFQIRXWKYACIHF-SGWCAAJKSA-N 445.519 4.638 50 10 IJGE CCC1CCC(=NNC(=O)CN(c2cccc(Cl)c2)S(=O)(=O)c2ccccc2)CC1 59372382 BNBBSJKINRPQOZ-UHFFFAOYSA-N 447.988 4.608 50 10 IJGE CSc1ccc(/C=C2/CNCC3=C2OC(N)=C(C#N)[C@H]3c2ccc(SC)cc2)cc1 98064696 HFJDDCKHGKRXBV-CJBPROBKSA-N 433.602 4.879 50 10 IJGE O=S(=O)(c1c(Cl)cc(Br)cc1Cl)N1CCCCC[C@@H]1CCl 157746940 DJSHOWGMHOQLHR-SNVBAGLBSA-N 435.598 4.928 50 10 IJGE Cc1cc(Br)c(C(=O)N2CCSC[C@H]2CCBr)cc1Cl 689301230 ZXUVLOGEKRNHIA-SNVBAGLBSA-N 441.616 4.754 50 10 IJGE BrCc1ccc(Br)cc1N1CC2(CN(Cc3ccccc3)C2)C1 706114804 LOTJCFJNAWVNSF-UHFFFAOYSA-N 436.191 4.666 50 10 IJGE CCOc1cc(C(=O)NNc2cccc(F)c2F)ccc1OCCOc1ccccc1 743725438 CXAVOHZFKWGBPD-UHFFFAOYSA-N 428.435 4.578 50 10 IJGE CN1CCC[C@H](CNC(=O)NNc2nc(Cl)c(Cl)cc2Cl)[C@@H]1c1cccs1 745850331 WUUGDDPHKPSJNB-QMTHXVAHSA-N 448.807 4.813 50 10 IJGE Cc1cc(N)cc(C)c1C=NNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1 752717937 KCNJWBPSKFAETF-UHFFFAOYSA-N 429.549 4.818 50 10 IJGE CCCCc1oc2ccccc2c1/C=C\C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1 770964376 AHGBYTWSUIDGEO-SEYXRHQNSA-N 448.527 4.532 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc3nc(-c4ccccn4)oc3c2)c(C(F)(F)F)c1 799409592 HXYIZOSDEXXCEJ-UHFFFAOYSA-N 438.369 4.929 50 10 IJGE O=C(O)c1ccc(COc2ccccc2C=NNC(=O)C23CC4CC(CC(C4)C2)C3)cc1 1084108658 URYVHUPTYJXWBA-UHFFFAOYSA-N 432.520 4.630 50 10 IJGE Cc1sc2nc(CS[C@@H](C)C(=O)NNc3cccc(F)c3Cl)nc(O)c2c1C 1557604036 QNYQDULQODMDHI-JTQLQIEISA-N 440.953 4.571 50 10 IJGE C/C(=C\c1ccco1)C(=O)NNc1nc2ccccc2c(=O)n1-c1ccc(C(C)C)cc1 1617519027 GBSCPBHERUSMRD-BMRADRMJSA-N 428.492 4.649 50 10 IJGE Cc1ccc(NNC(=O)CCSCc2nc(O)c3c4c(sc3n2)CCC4)c(Cl)c1 1635719147 GPILQDYZWWCVMI-UHFFFAOYSA-N 449.001 4.614 50 10 IJGE N#C/C(C(=O)CSc1nc(O)c2ccc(Cl)cc2n1)=C1\Nc2ccccc2S1 1656291373 JVXBPJCLFUBIFY-PDGQHHTCSA-N 426.910 4.603 50 10 IJGE Cc1ccc(Cn2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2cccc(O)c2)cc1 1865681293 JOVOOHWXYALRSW-QHCPKHFHSA-N 434.499 4.831 50 10 IJGE CCCOc1c(OC)cccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2CC 1865692440 FWIRIUYNIUYORH-FQEVSTJZSA-N 430.508 4.586 50 10 IJGE O=C1/C(=C/c2cccc(Br)c2)Oc2cc(OC(=O)C(Cl)Cl)ccc21 1871385316 MDXWMJYMIDFKRX-AUWJEWJLSA-N 428.065 4.774 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]([C@H](CBr)NC(=O)OC(C)(C)C)C12CCC2 1882085698 VNVBZFBMGDRUCD-KKUMJFAQSA-N 447.414 4.606 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C2CN(CC3(CBr)CCCCCC3)C2)C1 1886875680 FOOLSDJIDIVRPH-KRWDZBQOSA-N 429.443 4.911 50 10 IJGE C[C@H](Br)C(C)(C)CNC(=O)c1csc(Br)c1Br 1913834261 QLJAEWGCXAWOAH-LURJTMIESA-N 448.018 4.813 50 10 IJGE C[C@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1c(Cl)cccc1Br 1914351876 XYAUXCGBYUXFDT-GFCCVEGCSA-N 437.186 4.921 50 10 IJGE CN(C)CCN(Cc1ccccc1)c1ccc(CBr)c(Br)c1 1931935130 HHCKPKXOZLGVJE-UHFFFAOYSA-N 426.196 4.912 50 10 IJGE CC[C@H](C)N(CCBr)C(=O)c1csc(Br)c1Br 1945189304 NMBXBAIDEFUGML-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE CCN(C[C@@](C)(CI)OCC1CC(C)(C)C1)C(=O)OC(C)(C)C 1989575458 HHIWVZGGYDADGY-GOSISDBHSA-N 439.378 4.890 50 10 IJGE C[C@@H]1C[C@H]1N(CCBr)C(=O)c1cc(Br)sc1Br 2002024998 ZAPVKRUVXBQKKZ-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE COc1ccc(Cl)cc1[C@@H](Br)c1cc(I)sn1 2007643625 GZJWXIJBVXAAPJ-LLVKDONJSA-N 444.519 4.894 50 10 IJGE COc1cc(Br)c(OCC2CC(Br)C2)cc1Br 2020236289 URXOFMADIUBAQM-UHFFFAOYSA-N 428.946 4.773 50 10 IJGE CC(N)=C(C#N)C(=O)COC(=O)c1c2c(nc3ccccc13)C(=Cc1ccc(C)cc1)CC2 2040424627 DHTDSQDAYPQERK-UHFFFAOYSA-N 437.499 4.512 50 10 IJGE COCC1(COc2c(Br)cc(CBr)cc2Br)CC1 2074581463 KCDWCTJEDMLDEZ-UHFFFAOYSA-N 442.973 4.912 50 10 IJGE C[C@@H]1CN(C(=O)CCCCBr)c2ccccc2CN1C(=O)OC(C)(C)C 2106772531 NTISNVBFBNFGSM-OAHLLOKOSA-N 425.367 4.724 50 10 IJGE CN(C(=O)c1ccc(OCc2ccccc2)cc1)C1(CBr)CCSCC1 2114723373 SGMWBPRJGQEOQH-UHFFFAOYSA-N 434.399 4.998 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(CBr)cc2)[C@@H]2CCCC[C@H]21 2162912294 TZLDJPHXSZRHQS-QZTJIDSGSA-N 437.378 4.586 50 10 IJGE Cc1ccc(CBr)c(N2CCOCC23CCN(Cc2ccccc2)CC3)c1 2163143783 NVWOYNQLDORFOL-UHFFFAOYSA-N 429.402 4.761 50 10 IJGE O=C(c1cc(Cl)ccc1I)N(CCCl)Cc1ccsc1 2171095369 XSWQAIXVDSGDLV-UHFFFAOYSA-N 440.133 4.887 50 10 IJGE FC(F)C1CC([C@H](Br)c2cc(I)cc3c2OCC3)C1 2232338867 RDVWMHOFZFGELN-KWPJZBAWSA-N 443.069 4.953 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1Cc1cc(Cl)ccc1I 2251035271 FLKYKMQSHTUVPJ-WCQYABFASA-N 428.539 4.692 50 10 IJGE COc1c(Br)cc([C@H](Br)[C@@H]2C[C@H]2Br)c(OC)c1C 2263577950 ZNTCMGDIAZZPQD-BCMRRPTOSA-N 442.973 4.994 50 10 IJGE C[C@H](Br)CN(CCC(C)(C)C)S(=O)(=O)C1CC(OCc2ccccc2)C1 2272388298 BMRZDQAXFFXJGD-IVMQYODDSA-N 446.451 4.586 50 10 IJGE CC(F)(F)C[C@@H](CCl)NC(=O)Cc1cc(Br)cc(Br)c1 2295312650 ZTAHCPSDKZZLCK-NSHDSACASA-N 433.518 4.523 50 10 IJGE CCN(CC)c1ccc(C=C(NC(=O)c2ccccc2)C(=O)NN=Cc2cccs2)cc1 2297451109 MCZBPMRKIHNGQM-UHFFFAOYSA-N 446.576 4.516 50 10 IJGE C[C@@H](Br)C12CCC(CC1)N2Cc1sccc1I 2301076882 QUQLBALEUOWQBG-TTXORMCVSA-N 426.161 4.633 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1Cc1ccc(Cl)cc1I 2302309554 NZARHRSWXFQQMW-NOZJJQNGSA-N 428.539 4.692 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Br)c1cc(F)ccc1F 2316723838 FJISTKOBRLRQJG-MRVPVSSYSA-N 444.899 4.708 50 10 IJGE Br[C@@H]1CC[C@H]2CCCN(Cc3sccc3I)[C@@H]2C1 2316761324 CWGINHWQIKSRJZ-NQBHXWOUSA-N 440.188 4.881 50 10 IJGE CCOc1cc(C=C(C#N)c2nc3cc(C)c(C)cc3[nH]2)ccc1OCC(=O)N(CC)CC 2323840749 SHNHHAXRDNUXHV-UHFFFAOYSA-N 446.551 4.890 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)[C@H]3CC(=O)N(C(C)(C)C)C3)n2)cc1Cl 2331398275 BTYOXXZYCAJBMD-ZDUSSCGKSA-N 431.945 4.912 50 10 IJGE Nc1c(Cl)c(Cl)nc(C(=O)N/N=C/c2ccc(OCc3ccccc3)cc2)c1Cl 20885218 LGFRTNZYPODJIR-KIBLKLHPSA-N 449.725 4.967 50 10 IJGE CCCCOc1ccc(/C=C2/C(=O)N(Cc3ccccc3)C(=O)C(C#N)=C2C)cc1OC 38605943 IRKJODOSSIWADW-KGENOOAVSA-N 430.504 4.667 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccc(F)cc1Br)[C@H](Br)C2=O 39881042 JIXINVSTZOYWAU-JLZZUVOBSA-N 447.142 4.686 50 10 IJGE Cc1c(C(=O)N2CCCC[C@@H]2C)oc2c1/C(=N/NC(=O)c1ccc(Cl)cc1)CCC2 40811588 AQWIGQBAFNMJMW-GYQDZVIGSA-N 427.932 4.726 50 10 IJGE CCC(CC)N(CCCl)S(=O)(=O)c1cc(Br)ccc1Br 109646962 LIZRQSKMGBZKAY-UHFFFAOYSA-N 447.620 4.630 50 10 IJGE O=C(NC[C@H]1CCC[C@@H]1Br)c1cc(C(F)(F)F)ccc1Br 124440516 GWKWHZDWAWHFIP-KCJUWKMLSA-N 429.074 4.761 50 10 IJGE CCN(CC)c1c(/C=N/NC(=O)CCCNc2cccc(C)c2)c(C)nn1-c1ccccc1 253560422 ATSISOWFNOQDEH-TURZUDJPSA-N 446.599 4.678 50 10 IJGE COc1ccc(Cl)cc1C(=O)NN=C(C)c1cccc(NC(=O)c2cccs2)c1 254392134 BFKRCQPMZLRBJU-UHFFFAOYSA-N 427.913 4.816 50 10 IJGE O=C(NN=Cc1cc(Cl)ccc1OCc1cccc(Cl)c1)c1cc(O)cc(O)c1 254874116 IHRPMVGGFYFSTA-UHFFFAOYSA-N 431.275 4.748 50 10 IJGE Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)CC/C=C/c3ccccc3)cc12 737468891 YXEXLRRYSZPHFF-XYOKQWHBSA-N 430.533 4.650 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OCc2ccc(F)cc2)c(-c2ccc(Cl)cc2)n1 782093836 AEPXROGUNAQTPO-LDADJPATSA-N 434.858 4.907 50 10 IJGE COC(=O)Nc1cc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc(C(F)(F)F)c1 799753589 JHQJQPBXHCDNJO-UHFFFAOYSA-N 446.307 4.531 50 10 IJGE COc1ccccc1Nc1ccccc1C(=O)NNc1nc(-c2cccnc2)nc(C)c1C 800692576 WCOKBOROKYEXSK-UHFFFAOYSA-N 440.507 4.665 50 10 IJGE Cc1ccc(-c2ccc(C=NNC(=O)Nc3ccc(Br)cc3)o2)cc1C(=O)O 1084270329 PMBZWURAWHVUNC-UHFFFAOYSA-N 442.269 4.871 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNC(=O)c2sc3ccccc3c2Cl)cc1)C1CC1 1562890083 RPBGXHIJPAKIHV-UHFFFAOYSA-N 442.928 4.537 50 10 IJGE CCOc1cc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)ccc1O 1614707133 YUOSZTDDEDPSGZ-MSOLQXFVSA-N 434.330 4.538 50 10 IJGE CCc1nn(-c2ccc(Br)cc2)c2c1[C@@H](c1ccc(C)cc1)C(C#N)=C(N)O2 1865685114 DDXWJSCQELPEJL-IBGZPJMESA-N 435.325 4.724 50 10 IJGE Cc1ccc(CCCC(=O)NNC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)c(C)c1 1865759495 CYDWTQHTQLQHFD-UHFFFAOYSA-N 437.490 4.736 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)c1cc(F)ccc1F 1865759738 PUCUZQDCWVSCOX-UHFFFAOYSA-N 436.245 4.717 50 10 IJGE CC1(NC(=O)OC(C)(C)C)CCC([C@H](CBr)NC(=O)OC(C)(C)C)CC1 1880761236 LYNDDJGQEWGZPF-BIWSTMPVSA-N 435.403 4.748 50 10 IJGE CCc1cc(Br)c([C@@H](Cl)c2cnn(C)c2I)s1 1942097438 IABUHSIYTJDMTD-VIFPVBQESA-N 445.551 4.739 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCC[C@@H]1CCBr 1945189678 XJJOGYGPPACWES-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1C(=O)c1scc(Br)c1Br 2018115858 VYUOPUACMFUXEG-SVRRBLITSA-N 446.002 4.661 50 10 IJGE O=C(C[n+]1ccccc1)N/N=C/c1c(-c2ccccc2)n(-c2ccccc2)c2ccccc12 2033808946 YXWOIYXEYVLHBI-ZTKZIYFRSA-O 431.519 4.735 50 10 IJGE CCCN1C[C@@H](Br)[C@@H](Cc2cc(Cl)ccc2I)C1 2039250371 JJIHQCPDDIBULH-WCQYABFASA-N 442.566 4.592 50 10 IJGE O=C(CBr)c1cc(Br)cc(C(F)(F)F)c1OC(F)(F)F 2054796872 YABBOYHDTFPIQM-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE O=C(CCl)c1cc(I)cc(C(F)(F)F)c1OC(F)(F)F 2055162663 GMMFOFKROFMGMU-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE C[C@H](Br)CCc1cn(-c2cc(Br)cc(Br)c2)nn1 2068977222 MAJGZYDKGJTJEW-QMMMGPOBSA-N 437.961 4.508 50 10 IJGE Fc1ccc(Cn2nc(CCl)c(I)c2C(F)(F)F)cc1F 2079210549 ULLFBYODVKIWGO-UHFFFAOYSA-N 436.549 4.572 50 10 IJGE CC[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1C[C@@H](CBr)c1ccccc1 2106789391 YDMJCHRINQVOKQ-RTBURBONSA-N 425.411 4.887 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCC([C@H](F)CCl)CC1 2106950423 OIWQEHAOAURFQX-SECBINFHSA-N 433.568 4.702 50 10 IJGE O=C(c1c(Cl)cccc1Br)N1CC[C@H](CBr)C(F)(F)C1 2169457322 BRCGZCBJECOPOL-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC2(CCOCC2)N(C[C@@H](CBr)C(C)(C)C)C1 2193493716 FBKMIIYSTZPDKW-IAGOWNOFSA-N 447.458 4.582 50 10 IJGE CC[C@H]1CC[C@H](N(C)S(=O)(=O)c2cc(CBr)sc2Br)C1 2206136238 IBRFWABVGUHISD-UWVGGRQHSA-N 445.242 4.605 50 10 IJGE CC1(C)CN(C(=O)c2ccc(I)c(Cl)c2)C[C@H]1CCCl 2238467286 CYHNBALCQPXWCO-LLVKDONJSA-N 426.125 4.672 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1sc(Cl)cc1Br 2242100864 UMCXMZUTUBNMHT-ZETCQYMHSA-N 433.593 4.995 50 10 IJGE CC1(C)CC(CCl)(CNC(=O)c2ccc(Cl)c(I)c2)C1 2283663114 FHIWDPVPIDKOCK-UHFFFAOYSA-N 426.125 4.720 50 10 IJGE FC(F)(CBr)[C@@H]1CCN(c2nc3ccc(Br)cc3s2)C1 2296503996 RBGHXNGEYXKYTQ-MRVPVSSYSA-N 426.124 4.915 50 10 IJGE C[C@H](Br)CCCN(C)C(=O)c1cc(Br)c(Br)s1 2299509364 NEGPVPMWIJHXPH-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)C=Cc2ccc(Cl)cc2)c(OCC)c1 2314735839 GGYUGVSNOGUHNJ-UHFFFAOYSA-N 425.868 4.828 50 10 IJGE CCN(C[C@](C)(CBr)OC[C@@H]1C[C@H]2[C@@H](C1)C2(F)F)C(=O)OC(C)(C)C 2320756897 FSNRJDNRNMGJKP-LOUJCGABSA-N 426.342 4.705 50 10 IJGE C[C@H]1CC[C@H](CCl)CN1Cc1ccc(I)c(Br)c1 2325214894 TWAYZMGLBYLLGV-CMPLNLGQSA-N 442.566 4.893 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@](C)(CBr)C(C)(C)C)C[C@@H]1C(F)F 2327116534 UTTCJVYBRFPHAJ-JCGVRSQUSA-N 427.374 4.524 50 10 IJGE FC(F)(CCl)C(F)(F)CNCc1c(Br)cccc1Br 2336537287 VLXPERRWEMUIPK-UHFFFAOYSA-N 427.461 4.811 50 10 IJGE COCCOCCN(Cc1ccccc1)c1nc(C(F)(F)F)ccc1CBr 2369843593 SBPQLCLMXBROGY-UHFFFAOYSA-N 447.295 4.665 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1COC2(CCN(C[C@@](C)(CBr)C(C)(C)C)CC2)C1 2380177578 WBKXDYPQJLDBTE-OXJNMPFZSA-N 447.458 4.582 50 10 IJGE CCc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2O)CCC3)cc1 40826369 AAVGOKYGCMFHIW-ZXVVBBHZSA-N 431.492 4.579 50 10 IJGE CCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)CCc2ccc(C(C)(C)C)cc2)c(OC)c1 40995882 YUHCXKPEWDJMIP-LTGZKZEYSA-N 448.563 4.964 50 10 IJGE N#C/C(=C/c1ccc(OCc2ccc(Cl)cc2Cl)cc1)C(=O)NC[C@@H]1CCCO1 96584977 SOJSGRGZALDMLE-PSXSOWLISA-N 431.319 4.775 50 10 IJGE O=S(=O)(Nc1ccc(CCl)cc1)c1cc(Br)ccc1Br 96873115 HKNOHHOPNZOBIP-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)ccc2n1C[C@@H]1CN(Cc2ccccc2)CCO1 312356618 AJZDCFLWYAIMQX-YJBOKZPZSA-N 448.792 5.000 50 10 IJGE CSSCCn1c(CCCl)nc2cc(I)c(F)cc21 397819396 JMLVNIRLKLJDNT-UHFFFAOYSA-N 430.739 4.573 50 10 IJGE C[C@H](CNC(=O)c1cc(Br)ccc1Br)C[C@@H](C)Br 397850829 SAVVIMXSLLFYKO-DTWKUNHWSA-N 441.989 4.751 50 10 IJGE C[C@H]1CCN(Cc2cc(Cl)ccc2I)C[C@H]1Br 405345552 PWQOHZCAJDYLTA-JOYOIKCWSA-N 428.539 4.550 50 10 IJGE C[C@H]1CO[C@](CBr)(Cc2cc(Cl)ccc2I)C1 718539000 YHUFWNMBDPHNGA-RNCFNFMXSA-N 429.523 4.677 50 10 IJGE CCS(=O)(=O)c1ccc(Sc2ccccc2C(=O)NNc2cccc(F)c2F)cc1 748805659 PMBUJSKYQGVJQF-UHFFFAOYSA-N 448.516 4.667 50 10 IJGE C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)NNC(=O)c3cccc4cccnc34)c2)C1 756256382 HXMXRJWMNRGUML-UTKZUKDTSA-N 432.524 4.797 50 10 IJGE Cn1cc(C=NNC(=O)c2ccccc2OCc2ccc(F)cc2)c(C2CCCCC2)n1 783799400 OGOZQNLUNYFLMU-UHFFFAOYSA-N 434.515 4.950 50 10 IJGE C=CCNC(=S)NNC(=O)/C(=C/c1cccc(OCc2ccccc2)c1)c1cccs1 1290173508 MIVYUVIXGHBEAI-LTGZKZEYSA-N 449.601 4.549 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNc3cccc4c3OC(F)(F)O4)cc2)cc1 1629256077 BUFNBVPWORNOHO-UHFFFAOYSA-N 426.375 4.760 50 10 IJGE Cc1c(C(=O)Nc2ccccc2C(F)(F)F)oc2c1C(=NNC(=O)c1ccco1)CCC2 1772746734 GDGDDUSWSOPCDW-UHFFFAOYSA-N 445.397 4.923 50 10 IJGE CC[C@H](C)NC(=O)c1oc2c(c1C)C(=NNC(=O)Cc1coc3cc(C)cc(C)c13)CCC2 1772751516 DYOUNARCJSUTLE-INIZCTEOSA-N 449.551 4.879 50 10 IJGE CCOc1c(Br)cc(C=NNC(=O)c2ccc(C(C)(C)C)cc2)cc1OC 1772753575 OOVUEBXLGUCRAF-UHFFFAOYSA-N 433.346 4.918 50 10 IJGE CCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccc(O)cc1)C(C#N)=C(N)O2 1865684827 ZLUIZMFWFVOFGA-SFHVURJKSA-N 427.291 4.665 50 10 IJGE Cc1nn(-c2ccc(Br)cc2)c2c1[C@@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865699569 XEEGZGVDAPFTEM-HXUWFJFHSA-N 446.308 4.643 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccc(Cl)c(Cl)c2)[C@H]1c1ccc[nH]1 1865710060 NLRVXCJCJCLJDE-CYBMUJFWSA-N 440.212 4.744 50 10 IJGE Cn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@H]2c1cccc(OCc2ccccc2)c1 1865711830 IVAVWGHCEUIISG-HSZRJFAPSA-N 434.499 4.884 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)NNC(=O)/C=C/c1ccc(C(C)C)cc1 1865759536 FSFPEQPZWAIBTN-AWNIVKPZSA-N 435.474 4.933 50 10 IJGE COc1ccc([C@H](CC(=O)N[C@H](C)C(=O)Nc2ccc(SC#N)cc2)C(C)C)cc1C 1866763084 YWHWCKBEQBCQPD-DYESRHJHSA-N 439.581 4.850 50 10 IJGE O=C1c2ccccc2C(=O)N1CCc1nccn1CCCCCCCCCBr 1913015704 JGAPWORWTBCNMC-UHFFFAOYSA-N 446.389 4.847 50 10 IJGE BrCC(CBr)(Cc1ccc(Br)cn1)C1CCC1 1942093802 WEEOUNCYNKKDMI-UHFFFAOYSA-N 425.990 4.963 50 10 IJGE Cl[C@@H]1CCC[C@@H](CNc2ncc(I)cc2Br)C1 2015756427 FRSSRNQFTCEVFS-RKDXNWHRSA-N 429.527 4.658 50 10 IJGE O=C(N[C@H](CCBr)C1CC1)c1cc(Br)ccc1Br 2029973818 TWFOPBVEYWVKIN-GFCCVEGCSA-N 439.973 4.505 50 10 IJGE O=C(c1cccc(Br)c1Br)N(CCCBr)C1CC1 2031477836 OFGQNJVZQSCWQJ-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE C[C@@H](Br)C[C@@H](C)CNC(=O)c1c(Br)cccc1Br 2033089483 UCFIWJITOCQWBN-RKDXNWHRSA-N 441.989 4.751 50 10 IJGE CCO[C@@H](C)c1nc(CN(C)C[C@@H](Br)COCc2ccccc2)cs1 2050592376 ZQSSAVVRTAQGSH-DOTOQJQBSA-N 427.408 4.653 50 10 IJGE O=S(=O)(c1ccc(F)c(CBr)c1F)N(Cc1ccccc1)C1CCC1 2059312141 GXRWSDUMVSHUGE-UHFFFAOYSA-N 430.314 4.603 50 10 IJGE ClC[C@H]1CCCC[C@@H]1CNc1ncc(I)cc1Br 2069526177 RMWGSFZLHKQHSI-NXEZZACHSA-N 443.554 4.906 50 10 IJGE CCCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2167031430 IOODMMREARUVKN-QZTJIDSGSA-N 445.442 4.968 50 10 IJGE CCC(CC)N(CC)S(=O)(=O)c1ccc(CBr)cc1Br 2179859802 JJILRUGZHNUANQ-UHFFFAOYSA-N 427.202 4.543 50 10 IJGE O=C(c1cc(Cl)ccc1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Br)C2 2190678755 NEOMXLWGRCMKHS-ZBPZKIAKSA-N 425.523 4.581 50 10 IJGE COc1cc(N2C[C@@]3(C)CN(Cc4ccccc4)C[C@]3(C)C2)ccc1CBr 2204547709 KZGZWAGARIEJOS-DHIUTWEWSA-N 429.402 4.939 50 10 IJGE CCCN(C[C@@H](C)Br)C(=O)c1cccc(Br)c1Br 2259746163 JYDJAXWDFHBRRF-SECBINFHSA-N 441.989 4.847 50 10 IJGE COc1ccc([C@H](Br)C23CC(C)(C2)O[C@@H]3C)cc1I 2269545170 MTMJSYUUCKRUFP-BWYOJNGRSA-N 437.115 4.693 50 10 IJGE COc1cc(N(C)Cc2ccccc2I)ccc1CBr 2280258678 UNGWTGMKVVSPIG-UHFFFAOYSA-N 446.126 4.831 50 10 IJGE C[C@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)CC[C@H]1CBr 2285845703 DSNKRDHEGZBFLD-IUCAKERBSA-N 427.539 4.735 50 10 IJGE C[C@H]1CC[C@@](CBr)(NC(=O)c2cc(Br)c(F)cc2Cl)C1 2285962928 JNRMBRPVYHXRBG-RMLUDKJBSA-N 427.539 4.925 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@H](Br)C1COCCOC1 2295262548 KCZIBHJOGIPRJN-CYBMUJFWSA-N 428.548 4.519 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=C(C#N)C(=O)Nc3ccc(C)cc3[N+](=O)[O-])o2)cc1 2297306936 BMCUBQOJMICDEF-UHFFFAOYSA-N 445.431 4.886 50 10 IJGE N#CC(=Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccccc1Oc1ccccc1 2297381920 XZFZPZYTQMDUSQ-UHFFFAOYSA-N 425.488 4.861 50 10 IJGE Clc1ccc(CN2C3CCC2(CBr)CC3)c(I)c1 2318539374 LKSKBTCWBPUDHJ-UHFFFAOYSA-N 440.550 4.837 50 10 IJGE Cc1ccc(NC=C(C#N)C(=O)Nc2ccc(Br)cc2)c(Br)c1 2324090810 QNYYDSXULFBSPP-UHFFFAOYSA-N 435.119 4.978 50 10 IJGE N#CC(=CNC1CCN(Cc2ccccc2)CC1)C(=O)Nc1ccc(Cl)cc1Cl 2324494732 ZYXJKSYNQFLJLH-UHFFFAOYSA-N 429.351 4.594 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C)CN(CCCCCCCBr)CC1(F)F 2326656866 LTSMYAXRMRMXGV-QGZVFWFLSA-N 427.374 4.814 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)C12COC(C(F)(F)F)(C1)C2 2338564910 VXMBFGNJMHJCCD-FAEJEUNOSA-N 434.296 4.546 50 10 IJGE CN(CC[C@@H](Br)c1cccs1)C(=O)Cc1cnn(Cc2ccccc2)c1 2340653043 MXFKAHUMEARGBG-GOSISDBHSA-N 432.387 4.520 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)[C@@H]1CCCS(=O)(=O)C1 2365226429 UTFWCBFFXUTRRX-PRHODGIISA-N 448.579 4.764 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@](C)(CBr)C(C)(C)C)C2(CCOCC2)C1 2380199480 MLKCPETXVWBUEV-HXUWFJFHSA-N 447.458 4.536 50 10 IJGE O=C(CNc1cccc2ccccc12)N/N=C/c1ccc(OC(=O)/C=C/c2ccco2)cc1 3038621 NCONQZSJSJJAMU-MVUNRXBLSA-N 439.471 4.614 50 10 IJGE Cc1ccc(C)c(NC(=O)/C(C#N)=C\c2ccc(Sc3ncccn3)c([N+](=O)[O-])c2)c1 17097487 DMYCCGBIJYTNLS-BOPFTXTBSA-N 431.477 4.699 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(OC(C)C)cc4)ccc32)o1 38659248 YXWCIPQHRWMFIB-QHCPKHFHSA-N 430.460 4.813 50 10 IJGE N#C/C(=C/c1ccccc1OCc1ccccc1Cl)C(=O)NCc1ccc2c(c1)OCO2 96504276 MSYINSPEVVKPTJ-NDENLUEZSA-N 446.890 4.871 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)cc(Cl)c1OC 169891217 JTBPTXBGZVVKCO-UWLYNBDASA-N 425.916 4.727 50 10 IJGE C[C@H]1C[C@@H](O[C@@](C)(CI)CNC(=O)OC(C)(C)C)CC[C@H]1C 231317402 JYYHURNHODTVMS-FHIRATQRSA-N 425.351 4.546 50 10 IJGE O=C(NCC1(CCl)CCCCC1)c1ccc(I)c(Cl)c1 232349659 UXRKSQVSEVLLCD-UHFFFAOYSA-N 426.125 4.864 50 10 IJGE CCC[C@H](Oc1ccc(OC)cc1)C(=O)NN=Cc1ccc(OC(=O)c2ccccc2)cc1 245285916 ZRAMBMVEKAWQLW-DEOSSOPVSA-N 446.503 4.612 50 10 IJGE ClCc1nc2cc(Br)ccc2n1CC[C@@H]1CN(Cc2ccccc2)CCO1 381937791 UKYJXAKHFGKKTE-GOSISDBHSA-N 448.792 4.829 50 10 IJGE FC(F)(F)c1c(Br)ccc(CBr)c1I 575691010 FISPACKKUZKEPT-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE COc1ccccc1CNC(=O)c1cccc(NC(=O)Nc2ccc(SC#N)cc2)c1 586699906 BZYXNSSYKNIPNZ-UHFFFAOYSA-N 432.505 4.842 50 10 IJGE CS(=O)(=O)CC1(CC(CBr)(CBr)C2CCCCC2)CC1 692841886 YAFMCJQEEYFTAX-UHFFFAOYSA-N 430.246 4.558 50 10 IJGE CCC[C@@H](CCCl)NC(=O)c1cc(Br)ccc1I 716855484 NSFOCSLYVWSLQZ-JTQLQIEISA-N 444.538 4.581 50 10 IJGE CC[C@@H](NC(=S)NNC(=O)c1ccccc1OCc1ccc(F)cc1)c1cccs1 734367199 BBVWSDKNPQSPLV-GOSISDBHSA-N 443.569 4.726 50 10 IJGE COc1ccc(CCCC(=O)NN=Cc2ccc(OCc3nc4ccccc4[nH]3)cc2)cc1 1084114541 ONPOJGVVKFCXOO-UHFFFAOYSA-N 442.519 4.624 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)Cc2csc([C@H]3CC[C@H](C)CC3)n2)c1C 1457671987 YXNOTYQYSJLZQK-CZIWCDLHSA-N 436.585 4.591 50 10 IJGE C[C@H](SCc1nc(O)c2ccccc2n1)C(=O)NNc1c(Cl)cc(F)cc1Cl 1527689009 GPRVQVZFTBRZJM-VIFPVBQESA-N 441.315 4.546 50 10 IJGE C#CC[C@H](CCOC)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1530713171 OIJNQLITWGARQE-CWDSQJGSSA-N 444.362 4.853 50 10 IJGE C=CCOc1cc(OC)ccc1C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2 1628472002 VNEAVVWFYKVVNN-MRXNPFEDSA-N 442.581 4.547 50 10 IJGE Cc1sc(-c2ccc(C(F)(F)F)cc2)nc1C(=O)NNc1nc(O)c2ccccc2n1 1648629977 VCJHSQBLQRWEDL-UHFFFAOYSA-N 445.426 4.543 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1)c1ccccc1 1650685813 CDPILOPATXASQO-BMRADRMJSA-N 442.544 4.720 50 10 IJGE CC(C)[C@@H](/C(O)=C(\C#N)c1nc(-c2cccs2)cs1)N1C(=O)c2ccccc2C1=O 1872750978 WDXASLLLWOVMFS-SWVCQTRFSA-N 435.530 4.985 50 10 IJGE C[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)[C@@H]1CCCCN1C(=O)OC(C)(C)C 1880761087 LBXSWXKIDYTCGI-KFWWJZLASA-N 435.403 4.700 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)Cc1c(Br)cnn1CC 1915097884 ZWMZJBQKOKRXGR-HNNXBMFYSA-N 429.200 4.841 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CC12CCC1(CCC[C@H](CI)O1)CC2 1996430045 GOYKHCZFNCGYRS-QAQJPARQSA-N 449.373 4.834 50 10 IJGE CC(C)(C)[C@@H](CBr)CN1CCC12CCN(C(=O)OCc1ccccc1)CC2 1999500842 MOIBBBDLIWIJNT-IBGZPJMESA-N 437.422 4.921 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1Cc1cc(Br)ccc1Br 2018104514 HYDKIZVOCKAIQU-NOZJJQNGSA-N 425.990 4.959 50 10 IJGE Cc1nccc2c1nc(CCl)n2CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 2063413822 CWAXKLBLCMOQTO-UHFFFAOYSA-N 446.982 4.950 50 10 IJGE Cn1ncc(COc2c(Br)cc(Cl)cc2CBr)c1Cl 2111943767 AFWYSXWYVIRBHO-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE CN([C@H]1CC[C@@H]1OCc1ccccc1)S(=O)(=O)c1cc(Cl)cc(CCl)c1F 2156443218 PYYDVSQGNWTJAX-IRXDYDNUSA-N 432.344 4.586 50 10 IJGE CC(C)(C)OC(=O)N1CCc2c(cccc2NC(=O)[C@@H](Br)C2CCCC2)C1 2167040276 POLXTQKQERTUGF-SFHVURJKSA-N 437.378 4.872 50 10 IJGE Cc1cc(C(=O)N(CCBr)c2ccccc2)ccc1I 2207112100 VYXSDFYYJQUMCS-UHFFFAOYSA-N 444.110 4.641 50 10 IJGE COCc1cc(Br)c([C@@H](Br)c2c(Cl)c(C)nn2C)s1 2232171106 ZIMHGVQRDZXHQL-VIFPVBQESA-N 428.577 4.837 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1C[C@@H]2CC[C@@H]1C[C@H]2NC(=O)OC(C)(C)C 2241631269 VSBSKOSZELPMCK-LYYZXLFJSA-N 447.414 4.604 50 10 IJGE CC1(C)C[C@H](Br)CN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282984637 YACJSXJXLQSKCE-QMMMGPOBSA-N 427.539 4.877 50 10 IJGE CCc1ccccc1N=c1cc(-c2cccnc2)nc(C2CCN(C(=O)[C@@H](C)Cl)CC2)[nH]1 2296572178 BVQBUWCTISEROA-QGZVFWFLSA-N 449.986 4.600 50 10 IJGE COc1ccc([N+](=O)[O-])cc1C=C(C#N)c1nc(-c2cc3ccccc3oc2=O)cs1 2296790098 OTFGZDZQFDITIL-UHFFFAOYSA-N 431.429 4.897 50 10 IJGE CC1([C@@H](CCl)NCc2ccc(I)c(Br)c2)CC1 2306223072 ACDDDYCLPFVJSM-GFCCVEGCSA-N 428.539 4.551 50 10 IJGE CC1CCC([C@@H](CBr)NC[C@@H]2CC2(Br)Br)CC1 2306825761 LJFINHKRGJGBME-MMVSWEMESA-N 432.038 4.672 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)c2ccccc2Br)c(OCC)c1 2313517535 NCQPKQCJGHWJQF-UHFFFAOYSA-N 444.281 4.537 50 10 IJGE CC[C@@H](Br)CN(CC)C(=O)c1ccc(Cl)cc1I 2317774703 RXZNSDGHKFHVRS-SECBINFHSA-N 444.538 4.580 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)[C@H](CCl)CC1CC1 2325210764 BISCPTFLVOBELF-LBPRGKRZSA-N 442.566 4.893 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@H]2CC[C@H](Cl)[C@@H]1C2 2330965383 XNXPMPYYCXHVCX-JEZHCXPESA-N 427.589 4.895 50 10 IJGE BrC[C@@H](COCc1cccc(I)c1)c1ccccc1 2341702702 YQDIBFITFYGIKL-HNNXBMFYSA-N 431.111 4.987 50 10 IJGE CCn1nc(Br)c(COc2c(Cl)cc(CBr)cc2Cl)n1 2379954804 QVDZRKJLIMTSAW-UHFFFAOYSA-N 443.954 4.841 50 10 IJGE FC(F)(F)[C@]1(CCl)CCN(Cc2cc(I)ccc2Cl)C1 2380521952 JNCKWHWBCGKHBE-LBPRGKRZSA-N 438.058 4.938 50 10 IJGE ClCc1c(Br)cccc1N1CC[C@@]2(CN(Cc3ccccc3)CCO2)C1 717594548 RBDREMGHIMCICI-OAQYLSRUSA-N 435.793 4.669 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N2[C@H]3CC[C@H]2CC(O)C3)c(C)n1-c1cc(Cl)ccc1Cl 736189527 PVPDVVJRXUSLCG-CZKNHELESA-N 444.362 4.822 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1ccc(-c2nc3ccccc3s2)cc1 755457102 CCVIOQPEIFHBEJ-UHFFFAOYSA-N 439.500 4.978 50 10 IJGE Cc1ccccc1C(=O)Nc1ccc(C(=O)NN=Cc2ccc(Br)cc2)cc1 1084027311 WXPSOQCXCHNLCN-UHFFFAOYSA-N 436.309 4.774 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNc3ncccc3C(=O)OC(C)(C)C)cc2)cc1 1643348899 HYMOQJGUMAJRHU-UHFFFAOYSA-N 447.491 4.789 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2c(C)cccc2Br)cc1)[C@H]1C[C@@H]1C 1662058836 MSDSSUIYSHZUGD-UGSOOPFHSA-N 431.334 4.667 50 10 IJGE Cc1cccnc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1cccc(Cl)c1)CCC2 1772746265 TXPFPHCMDBCFBP-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE CCCc1nn(-c2ccccc2Cl)c2c1[C@@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865702222 PSAGMDCACORWRE-IBGZPJMESA-N 426.854 4.975 50 10 IJGE CC1(C)C[C@H](C[C@H](CBr)NC(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)C1 1880753837 JLIFOVVLKKBSJU-KGLIPLIRSA-N 435.403 4.700 50 10 IJGE CC(C)(CBr)CCNC(=O)c1csc(Br)c1Br 1945189302 NKPBCTVJKJMAOF-UHFFFAOYSA-N 448.018 4.814 50 10 IJGE ClCc1c(Cl)ncn1-c1cc(I)ccc1Br 1982522785 XCIJELIQOQMAFF-UHFFFAOYSA-N 431.886 4.632 50 10 IJGE C[C@@]1([C@H](Br)c2sc(Br)cc2Br)COCCO1 1992638164 IISFXCVDSRYNAH-ZJUUUORDSA-N 434.975 4.515 50 10 IJGE CC1(C)[C@@H](Br)CCN1Cc1cc(Br)ccc1Br 2006503891 SVVJQIZANBJLQI-LBPRGKRZSA-N 425.990 4.959 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1C(=O)c1cc(Br)sc1Br 2018118367 ADOIUOIDROCOHE-SVRRBLITSA-N 446.002 4.661 50 10 IJGE CN(C(=O)c1cccc(Br)c1Br)C(C)(C)CCBr 2031480914 ADUJOHPSCNKQLH-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE C[C@@H]1CO[C@@H](COc2c(Br)cc(Br)cc2CBr)C1 2047588862 CIXMZUQDKOFRLN-GZMMTYOYSA-N 442.973 4.910 50 10 IJGE C[C@@H]1C[C@@H](C(F)(F)F)N(CC(C)(C)CBr)CCN1C(=O)OC(C)(C)C 2058049373 MLULFDXEINGJCC-OLZOCXBDSA-N 431.337 4.670 50 10 IJGE C[C@H]1C[C@@H](CBr)CN(Cc2ccc(I)c(Cl)c2)C1 2086652362 OSXXZCIWCSOWFR-JQWIXIFHSA-N 442.566 4.798 50 10 IJGE Br[C@H](CCc1ccc(I)cc1)CN1CCCCCC1 2099448636 ADVWRPDDKQJKKX-OAHLLOKOSA-N 436.175 4.863 50 10 IJGE O=S(=O)(c1ccc(OCCCBr)cc1)N(Cc1ccccc1)C1CCC1 2123248189 VBCCATFGBLBNHI-UHFFFAOYSA-N 438.387 4.594 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@H]1CCCCN1CC1(CBr)CCCC1 2128727405 YKIKOHMTFPIBSD-OAHLLOKOSA-N 439.385 4.956 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](CN(C(=O)[C@H](Br)C2CCCC2)C2CC2)C1 2167033413 RACQLPPRUOBECR-CRAIPNDOSA-N 443.426 4.578 50 10 IJGE CCCN(C(C)(C)C)S(=O)(=O)c1cc(CBr)ccc1Br 2179858113 JZEHVTPUECKJAJ-UHFFFAOYSA-N 427.202 4.543 50 10 IJGE Cc1sc(C[C@H](CBr)NC(=O)OC(C)(C)C)c(C)c1Br 2209174654 DPQYJUVOFNVSRM-SNVBAGLBSA-N 427.202 4.958 50 10 IJGE Fc1ccc(CBr)c(OC[C@@H]2CC2(Br)Br)c1F 2213086424 XYXHDMOORUNUDZ-ZETCQYMHSA-N 434.900 4.745 50 10 IJGE CC[C@@H](COC)Oc1c(Br)cc(Br)cc1CBr 2217088310 NESJAYNGDABSBX-JTQLQIEISA-N 430.962 4.910 50 10 IJGE C[C@H](CCCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(Br)c1 2217391602 CPHJANJCARPBAD-CYBMUJFWSA-N 434.758 4.797 50 10 IJGE Fc1cc(Br)cc(F)c1CO[C@@H](CCl)[C@H](Br)CCl 2259032467 ODBSTDOFKINZQN-KCJUWKMLSA-N 426.910 4.854 50 10 IJGE CS(=O)(=O)C1CC([C@H](Br)c2cc3sc(Br)cc3s2)C1 2278020269 IYFLPERGBBOVCS-FOEZSWGGSA-N 444.235 4.985 50 10 IJGE C[C@H]1C[C@H](CBr)CN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282978366 MEXQCRBINDOQAB-DTWKUNHWSA-N 427.539 4.735 50 10 IJGE N#CC(=Cc1cc(Cl)ccc1OCc1ccc(C(=O)O)cc1)C(=O)NCc1ccccc1 2293335519 YRILESQJQNLDPU-UHFFFAOYSA-N 446.890 4.841 50 10 IJGE Clc1ccc(CN2C[C@H]3C[C@@H](Br)C[C@H]3C2)cc1I 2315548924 MIVSYEIDNCKZQH-ZSBIGDGJSA-N 440.550 4.550 50 10 IJGE COc1ccc([C@@H](C)NC(=O)C(C#N)=CN(Cc2ccccc2)Cc2ccccc2)cc1 2325055384 DDJPUBYDBNGBSQ-OAQYLSRUSA-N 425.532 4.982 50 10 IJGE CN(C[C@@](C)(CBr)C(C)(C)C)[C@@H](CNC(=O)OC(C)(C)C)C(F)(F)F 2327107415 VUUFRUMPLIXEDM-BLLLJJGKSA-N 433.353 4.821 50 10 IJGE CC(C)[C@H](C(O)=C(C#N)c1nc(-c2cccs2)cs1)N1C(=O)c2ccccc2C1=O 2331326853 WDXASLLLWOVMFS-GOSISDBHSA-N 435.530 4.985 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@]3(F)CCC[C@]3(NC(=O)OC(C)(C)C)C2)C1 2345008193 LXNVZEQSUSKNNM-PMACEKPBSA-N 433.406 4.659 50 10 IJGE CCCc1cc(C(=O)OC)c(NC(=O)/C(C#N)=C\c2c[nH]nc2-c2ccc(CC)cc2)s1 34983481 OKNVSXPWHLIMQF-BOPFTXTBSA-N 448.548 4.985 50 10 IJGE Cc1ccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2N)cc1Cl 40703785 FPZRUFKKZWPVST-UHFFFAOYSA-N 437.718 4.828 50 10 IJGE CCCCOc1ccc(/C=N/NC(=O)COc2cc(Cl)ccc2Cl)cc1OC 40910949 BOFHWDALQXINRH-FSJBWODESA-N 425.312 4.710 50 10 IJGE CCN(CC)c1ccc(/C=N/NC(=O)CCCSc2nc3ccccc3s2)c(O)c1 59519460 BJILHFWBRRFXKO-HZHRSRAPSA-N 442.610 4.871 50 10 IJGE C[C@@H]1CCC[C@@](CBr)(NC(=O)c2c(F)cc(Br)cc2F)C1 125131220 IMJHXYOAOTXOST-RFAUZJTJSA-N 425.111 4.801 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2ccc(OC)c(OC(C)C)c2)sc(C)c1C 209408186 YVDKUFDWBSWMPV-YVLHZVERSA-N 442.537 4.883 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccc(C)cc3)c(OC)c2)C1=O 214223282 WDEQMZBDQTVENL-BKUYFWCQSA-N 430.504 4.585 50 10 IJGE CCCN(CCBr)C(=O)c1cc(Br)sc1Br 233048419 KHZHRCYEINWSDK-UHFFFAOYSA-N 433.991 4.520 50 10 IJGE BrCc1cc(Br)ccc1N1C[C@H]2C[C@H]1CN2Cc1ccccc1 309790591 HQNMOWCQWWDMNP-MSOLQXFVSA-N 436.191 4.807 50 10 IJGE COc1ccc(Br)cc1[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CBr 394786973 PGARRXNQJLZMDY-RISCZKNCSA-N 449.183 4.803 50 10 IJGE FC(F)(F)c1cc(CBr)cc(I)c1Br 575691342 HXOHZWDQEHBGEH-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NC(=O)c1scc(Br)c1Br 716903969 AAXZGNYPFSYGOQ-RQJHMYQMSA-N 448.018 4.955 50 10 IJGE CCOC(=O)c1ccc(-n2c(C)cc(C=NNC(=O)c3cc4ccccc4o3)c2C)cc1 1083918927 NMWRLEFTFHJHOC-UHFFFAOYSA-N 429.476 4.781 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NN=Cc3cccc([N+](=O)[O-])c3)cc2)cc1 1084546566 NXPMPABPJUFIEP-UHFFFAOYSA-N 444.491 4.909 50 10 IJGE C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccccc1Cc1ccccc1 1165357847 ZJBRLCFFHJIMDE-FQEVSTJZSA-N 429.948 4.756 50 10 IJGE CCc1ccc(S(=O)(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)cc1 1860405488 LYRZWZCRQKKWRS-UHFFFAOYSA-N 436.558 4.754 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1cc(C)ccc1O)C(C#N)=C(N)O2 1865686821 BQFCUYIBCHJNEG-OAQYLSRUSA-N 434.927 4.770 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccccc2Cl)c1 1865692510 GPLLZBBIFHBAQL-JOCHJYFZSA-N 434.927 4.900 50 10 IJGE Cc1ccsc1[C@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2Cc1ccccc1F 1865698964 HBDPCBKSRQHHEZ-AWEZNQCLSA-N 434.418 4.677 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc(Cl)c2)[C@@H]1c1cccc(F)c1 1865710513 ACPIAVKXYKPZKI-OAHLLOKOSA-N 434.780 4.902 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865712748 GSGLJKRZSNFGCP-FQEVSTJZSA-N 449.898 4.664 50 10 IJGE COc1cc2nc(/C(C#N)=C/c3ccccc3OCc3ccccc3)nc(O)c2cc1OC 1872727444 BEJBQLCIAIWFPM-XDHOZWIPSA-N 439.471 4.996 50 10 IJGE CCCn1nc(Br)nc1N(Cc1ccccc1)[C@@H](CBr)C(C)C 1905466192 LZSQSQKKGFAWRC-HNNXBMFYSA-N 444.215 4.877 50 10 IJGE C[C@@H](CCCl)N(Cc1ccccc1)C(=O)c1cc(I)ccc1O 1915093712 YMLAWWVMZVRPDK-ZDUSSCGKSA-N 443.712 4.657 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@]2(CCC[C@@H](CI)O2)C1 1939617853 FTMNDOJPRSFOLP-MPGHIAIKSA-N 437.362 4.834 50 10 IJGE BrCC1CCN(Cc2c(Br)cccc2Br)CC1 1945332685 GXMJFRWTGLWQRU-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC2CC3(CCC3)C2)C1 1985548914 BWOYONJJLAUYDS-GOSISDBHSA-N 435.346 4.540 50 10 IJGE O=S(=O)(C[C@@H](Br)c1cscc1OCc1ccccc1)N1CCCCC1 2038675779 AXZCYFLVZXAKNO-QGZVFWFLSA-N 444.416 4.579 50 10 IJGE CC(C)N1C[C@@H](Br)[C@@H](Cc2ccc(Br)cc2Br)C1 2039262903 RTHKVHHSGJOKAZ-SMDDNHRTSA-N 440.017 4.858 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CCCCCBr)CC[C@@H]1C(F)(F)F 2044695170 AZTAPTWWOCFQBJ-KBPBESRZSA-N 431.337 4.577 50 10 IJGE FCC1([C@H](Br)c2cc(I)cc3c2OCC3)CCC1 2047700321 ICCPIRHSUBCZNA-CYBMUJFWSA-N 425.079 4.802 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H](Br)C3(CCC3)C2)c1 2054722499 SKGCJBVBKYTEGL-ZDUSSCGKSA-N 438.001 4.961 50 10 IJGE BrC[C@H]1[C@H]2CC[C@@H](C2)N1Cc1cccc(Br)c1Br 2058369506 BWBSJFBMEZZJTR-GAFUQQFSSA-N 438.001 4.959 50 10 IJGE CCCN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)cc(CBr)c1OC 2059286922 RFJREVAUCABXJL-UHFFFAOYSA-N 446.794 4.844 50 10 IJGE CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)ccc1OC 2059312618 NOADEKHBXCCGPW-HNNXBMFYSA-N 426.376 4.580 50 10 IJGE COCC1(COc2c(Br)cc(Br)cc2CBr)CC1 2074580961 HJKHMLFZULWIMQ-UHFFFAOYSA-N 442.973 4.912 50 10 IJGE Fc1cc(C(F)(F)F)cc(-n2nc(CCl)c(Br)c2C(F)(F)F)n1 2078865640 LREARYDWMNXFPT-UHFFFAOYSA-N 426.517 4.945 50 10 IJGE COC[C@]1([C@H](Br)c2ccc(Br)cc2Br)CCCO1 2083317479 GSZNPULJLKRXLK-OLZOCXBDSA-N 442.973 4.843 50 10 IJGE CS(=O)(=O)c1csc([C@H](Br)c2c(F)cccc2Br)c1 2093075401 WLFMKBRWJVBSLW-LBPRGKRZSA-N 428.142 4.538 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@H](Br)[C@H]1CCCCS1(=O)=O 2137644666 ZIGHWSFNISNRKX-OLZOCXBDSA-N 430.589 4.814 50 10 IJGE Cc1cc(C(=O)NC[C@H](Br)CC(C)(C)C)ccc1I 2142105346 CNAAHWSQSUJMGU-GFCCVEGCSA-N 438.147 4.529 50 10 IJGE Cc1sc(Br)c(C(=O)N2[C@H]3CC[C@H]2[C@@H](F)[C@H](Br)C3)c1C 2190680965 ZZRDHKVLURTZTI-WYFGTUCQSA-N 425.161 4.606 50 10 IJGE C[C@@H](CBr)CC1CN(Cc2ccc(I)c(Cl)c2)C1 2222849539 WVKYZRTZUKKAQK-SNVBAGLBSA-N 442.566 4.798 50 10 IJGE C[C@@H]1CCC[C@@](CBr)(OCCOCCOCCOCc2ccccc2)C1 2227775455 AOGVXPCSSVWIEM-TZIWHRDSSA-N 429.395 4.597 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1[C@@H](C)C[S@](C)=O 2234059306 IIJPSAIKNACZME-VQXVYSPMSA-N 442.604 4.801 50 10 IJGE O=C(c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@H](Br)C1 2250729333 LDANZXVXFQRZNZ-URHBZAFASA-N 432.884 4.846 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1C(=O)c1csc(Br)c1Br 2251003577 PSLRLSGXKIZOCA-HTQZYQBOSA-N 446.002 4.661 50 10 IJGE C=CC[C@]1(CCl)CCN(C(=O)c2csc(Br)c2Br)C1 2272179268 LWSVPMYRBBNUAY-CYBMUJFWSA-N 427.589 4.920 50 10 IJGE CC(C)(C)[C@H]1[C@@H](Cl)CCN1C(=O)c1ccc(Cl)c(I)c1 2283670706 VINYCEBWXYBUSZ-WCQYABFASA-N 426.125 4.813 50 10 IJGE COc1ccc([C@H](Br)c2ccc3c(c2)COC3)cc1I 2285017501 ZTFLTZBQHHLPMX-MRXNPFEDSA-N 445.094 4.814 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@]12C[C@@H](CBr)C2 2285846767 RWCIXQDMIAXFIM-PWRNUNNXSA-N 425.523 4.631 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCCC[C@@H](CBr)C1 2285960875 VZQUIKPWFIYMBH-VIFPVBQESA-N 427.539 4.879 50 10 IJGE COc1ccc(C=C(C#N)C(=O)OC(C)C)cc1COc1c(F)c(F)c(F)c(F)c1F 2297104314 ICXDKBIONFZOMG-UHFFFAOYSA-N 441.352 4.828 50 10 IJGE Cc1ccc(NC(=O)[C@@H](OC(=O)C(C#N)=Cc2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 2297400542 LSMCOTFKLUNHAD-QHCPKHFHSA-N 441.443 4.733 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC[C@H]2C[C@@H]3CC[C@H]2C3)C1 2298751494 MGJUTUZILHAWSG-YYAJDYIMSA-N 449.373 4.644 50 10 IJGE Cc1c(F)ccc(C(=O)N[C@H](CCBr)COCc2ccccc2)c1Cl 2320359197 ZCTKBOXAUHKDHT-OAHLLOKOSA-N 428.729 4.888 50 10 IJGE COc1ccccc1OCC(=O)Oc1ccc(C=C(C#N)c2ccccc2OC)cc1OC 2320506140 CJZPHYVABWJNML-UHFFFAOYSA-N 445.471 4.761 50 10 IJGE CC(=O)Oc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4Cl)[nH]c3c2)cc1 2323744378 XTPTVWSFNCWLGX-UHFFFAOYSA-N 432.867 4.573 50 10 IJGE Cl[C@H]1C[C@H]2CC[C@H]1N(Cc1ccc(I)c(Br)c1)C2 2325468740 FZKTYAPJCFMGOX-SCDSUCTJSA-N 440.550 4.645 50 10 IJGE COc1cccc(-c2csc(C(C#N)=C(O)c3ccc4c(c3)C(=O)N(C(C)C)C4=O)n2)c1 2331246370 GYWBLRGBMCGYNX-UHFFFAOYSA-N 445.500 4.773 50 10 IJGE FC1(F)C[C@]12C[C@H]2CO[C@@H](CI)c1ccc(Br)cc1 2352459479 QRHZDLJSLKNEGN-DRZSPHRISA-N 443.069 4.987 50 10 IJGE Brc1ccccc1[C@H](CI)OC[C@H]1O[C@H]2CC[C@H]1C2 2352572133 FHJBFOQEMCNFQI-LWWSYDQCSA-N 437.115 4.509 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CNC(=O)[C@H](Br)C3CCCC3)CCC[C@@H]12 2354959019 PLWMOSNPGRCHEP-CBGDNZLLSA-N 443.426 4.626 50 10 IJGE Cc1scc(C(=O)N2CCC[C@@H](Br)[C@@H]2C(F)(F)F)c1Br 2370255047 QNFVQTGDDINLIG-PSASIEDQSA-N 435.103 4.749 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1Cl)c1cccc(OCCOc2ccccc2)c1 14040888 LZPXDHOWGAPGFA-UHFFFAOYSA-N 445.302 4.526 50 10 IJGE C/C(=N\NC(=O)C1CCN(Cc2ccc(Cl)cc2)CC1)c1ccc(Br)cc1 33304005 LSGUYKKEQIOTIU-BUVRLJJBSA-N 448.792 4.855 50 10 IJGE C=CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccs4)ccc32)c1 40529839 RSWZBFNLLGUOHU-QFIPXVFZSA-N 430.485 4.750 50 10 IJGE O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@@H](Br)Cc1ccccc1Cl 96568401 KBFBQYDRGNTRKT-AZUAARDMSA-N 435.793 4.599 50 10 IJGE C[C@H](Cl)c1nc2cc(I)c(F)cc2n1CCc1nccs1 97409183 HUCBRXSICLHWOR-QMMMGPOBSA-N 435.693 4.779 50 10 IJGE C[C@@H]1CCc2c(sc(NC(=O)/C(C#N)=C\c3ccc(-c4ccc(F)cc4)o3)c2C(N)=O)C1 102668828 JUCIVKITMPHUNX-LKKYZFDUSA-N 449.507 4.917 50 10 IJGE CC[C@](C)(CBr)NC(=O)c1cc(Br)c(Br)s1 124755611 LVRFEQHNCKBOLX-SNVBAGLBSA-N 433.991 4.567 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(Br)sc2Br)CC[C@@H]1Br 235355081 VEAPBBUHMXVCCN-SVRRBLITSA-N 446.002 4.519 50 10 IJGE O=C(Cc1nc(CCl)cs1)NCCCN(Cc1ccccc1)Cc1ccccc1 390637701 MEMVQTIQFFPCDY-UHFFFAOYSA-N 428.001 4.633 50 10 IJGE CC[C@@H](C)N(CCBr)Cc1cc(Cl)ccc1I 405356025 XZWZOFVOWCLEKD-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE BrCC(CBr)(c1cccc(Br)c1)[C@@H]1CCCO1 686741284 VMOAIUZSLYUCLN-LBPRGKRZSA-N 426.974 4.656 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N(C[C@H]2CCCO2)c2ccncc2)c(C)n1-c1ccc(F)cc1 733972697 WPHFKXNCEBALPB-KQQLFIIESA-N 444.510 4.747 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc(C(C)(C)C(F)(F)F)cc2)c1C 765847649 SKDARMGCKVPSAZ-UHFFFAOYSA-N 429.446 4.752 50 10 IJGE O=C(NN=Cc1cccn1-c1ccc(Br)cc1)c1ccccc1Br 1084065312 DZNIWCRIGRKYAS-UHFFFAOYSA-N 447.130 4.766 50 10 IJGE CCc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(c3ccccc3)CC2)c1C 1084278508 VFKFODHQVCGYIA-NCELDCMTSA-N 438.575 4.912 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(F)c(Oc3ccccc3)c(F)c2)c1C 1457672007 YYVJPMZAKGRZQB-UHFFFAOYSA-N 447.445 4.983 50 10 IJGE CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N1CCC[C@H](O[Si](C)(C)C(C)(C)C)C1 1527931175 CZGVUZRKSNNCSF-UNMCSNQZSA-N 428.649 4.963 50 10 IJGE O=C(NNc1ccc(Br)c(F)c1)c1ccc(-c2cccc(Cl)c2)nc1O 1556243054 HBHDPHNCIVCIDA-UHFFFAOYSA-N 436.668 4.766 50 10 IJGE COc1cc2nc(CN3CCCC[C@@H]3CO[Si](C)(C)C(C)(C)C)nc(O)c2cc1OC 1643642179 HLOMDAZMKRFSEP-MRXNPFEDSA-N 447.652 4.729 50 10 IJGE Cc1ccc(COc2ccc(C=NNC(=O)CSc3nc4ccccc4o3)cc2)cc1 1772760421 KWEZFFDNOHVYKE-UHFFFAOYSA-N 431.517 4.958 50 10 IJGE COC(=O)c1ccc(N(C(=O)/C(C#N)=C/c2ccccc2)C2CCCCC2)c([N+](=O)[O-])c1 1859506001 SARHDIVFGIVBMJ-XMHGGMMESA-N 433.464 4.654 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2Cc1ccccc1 1865703488 WQEQRDZQIPBOLB-HSZRJFAPSA-N 428.536 4.891 50 10 IJGE COc1cc(CBr)cc(Br)c1OC[C@@H]1C[C@H]1Br 1910162138 LAUWDUVYEWCGBA-DTWKUNHWSA-N 428.946 4.515 50 10 IJGE CC[C@H](Br)[C@@H](C)NC(=O)c1c(Br)cccc1Br 1945331485 SMUHMMRUGWMVCX-SFYZADRCSA-N 427.962 4.503 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)CCc1cccc(C(F)(F)F)c1 1994837597 NCXIEIUXXUKDDL-AWEZNQCLSA-N 426.232 4.698 50 10 IJGE Brc1ccc(Br)c(C[C@H]2CN(C3CC3)C[C@@H]2Br)c1 2054717871 KARYEAKOYJHGRR-HZMBPMFUSA-N 438.001 4.612 50 10 IJGE Clc1nc(Cl)n([C@@H]2CN(Cc3ccccc3)[C@@]3(CCOC3)C2)c1CBr 2055098573 SUPQQSDZDJOCAX-KSSFIOAISA-N 445.188 4.691 50 10 IJGE C[C@@H](Cc1ccc(Br)cc1)NCCSSCCNC(=O)OC(C)(C)C 2061263902 IGPGYANDCKCIBL-AWEZNQCLSA-N 449.480 4.876 50 10 IJGE Cc1cnc(-n2nc(CCl)c(I)c2C(F)(F)F)cc1C1CC1 2078881311 VWSLQALCYKJERX-UHFFFAOYSA-N 441.622 4.815 50 10 IJGE O=S1(=O)CCCC[C@H]1[C@@H](Br)c1cc(C2CC2)c(Br)s1 2094674346 UTZUKEVJJKCPFX-RYUDHWBXSA-N 428.211 4.791 50 10 IJGE CCC[C@H](CBr)CN1CC[C@@](NC(=O)OC(C)(C)C)(c2ccccc2)C1 2106783142 XFNARTGVMCBXKB-UTKZUKDTSA-N 425.411 4.924 50 10 IJGE CN(Cc1ccccc1NC(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2110716347 WTKACTZZJVWTCF-QGZVFWFLSA-N 425.367 4.946 50 10 IJGE COc1ccc([C@H](Cl)c2cc(I)sn2)c(OC)c1Cl 2120030672 DNQAGRJEGQOAAP-JTQLQIEISA-N 430.094 4.747 50 10 IJGE CN(C1CC(OCc2ccccc2)C1)S(=O)(=O)c1cc(Cl)cc(CCl)c1F 2156449399 QRFTZJAQTRTZLL-UHFFFAOYSA-N 432.344 4.586 50 10 IJGE Clc1c(Br)ccc(CBr)c1-n1cnc2c(Cl)ncnc21 2177727469 DSVWMAHCTPFPGB-UHFFFAOYSA-N 436.922 4.780 50 10 IJGE CC(C)(C)[C@@H](CBr)CNC(=O)Cc1ccc(Br)cc1Cl 2237445423 FIZNIZMABOJFDL-NSHDSACASA-N 425.592 4.818 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccccc2)ccc1OCc1ccc(C(=O)O)cc1 2294193522 XJWSSQDYOWIMML-UHFFFAOYSA-N 428.444 4.518 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1)C(=CC=Cc1ccccc1)NC(=O)c1ccccc1 2297620105 MGXWQTWUORMQEL-UHFFFAOYSA-N 429.907 4.817 50 10 IJGE C[C@@H](Cl)C[C@@H](C)CNCc1ccc(I)c(Br)c1 2306219778 PZVIWGDNIWSFBA-NXEZZACHSA-N 430.555 4.797 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Br)c2)C[C@]1(C)CCl 2325214487 OSESQWUCQMPIII-YGRLFVJLSA-N 442.566 4.751 50 10 IJGE CCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2326919584 OPCUADYXTRPFGG-RHSMWYFYSA-N 425.358 4.518 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN(Cc2cc(I)ccc2Cl)C1 2327403113 LVGWVNVVWKCSGB-GHMZBOCLSA-N 442.566 4.940 50 10 IJGE BrC1CCC([C@@H]2CCN(C[C@@H]3CC3(Br)Br)C2)CC1 2327998291 DSVRYJXTLWCHNQ-QBHFIFKDSA-N 444.049 4.768 50 10 IJGE Cc1cnccc1CO[C@@H](CI)c1ccc(Br)cc1 2340085353 QFVQWTCKORLVJF-HNNXBMFYSA-N 432.099 4.845 50 10 IJGE CCOc1cccc(N2C[C@@H]3CN(Cc4ccccc4)C[C@]3(C)C2)c1CBr 2367569957 JLCNTCJCPBYHFR-WMZHIEFXSA-N 429.402 4.939 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)C1CC2(C1)C(F)(F)C21CCC1 2369430987 LHGMBCFBSLKNIX-OHTSDLOESA-N 442.344 4.689 50 10 IJGE COc1ccc(/C(C#N)=C\c2ccc(OC(=O)c3cccc(NC(C)=O)c3)c(OC)c2)cc1 31902316 DPMNVCWZMRFEAK-BKUYFWCQSA-N 442.471 4.946 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C\c2ccc(OCC)cc2)c(OCC)c1 35110518 YZEODDNOEXRLCO-QWSJWRMISA-N 435.476 4.573 50 10 IJGE CCCCCCCOc1ccc(C(=O)NNC(=O)c2ccc(NC(=O)C(C)C)cc2)cc1 100153794 REEDSHXYRJTJRV-UHFFFAOYSA-N 439.556 4.705 50 10 IJGE COc1ccc2cc(C(=O)O/N=C3\C[C@H]4CC[C@@]3(C)[C@]4(C)CBr)c(=O)oc2c1 100948198 ZBFCKTZGCANFNK-DKGSIRPASA-N 448.313 4.536 50 10 IJGE O=C(NC[C@@H]1CCC[C@H]1Br)c1ccc(Br)c(C(F)(F)F)c1 124439862 XSIIHGCUWWSNBE-GXSJLCMTSA-N 429.074 4.761 50 10 IJGE COc1ccc(Br)cc1/C=N\NC(=O)c1nc(-c2ccccc2)sc1C 169927109 IAZAZLQLTUJJEZ-NHDPSOOVSA-N 430.327 4.654 50 10 IJGE CCCCN(CCBr)C(=O)c1ccc(I)c(Cl)c1 232347948 ORTHOFOCQYIQIA-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE CC1(C)C[C@H](NC(=O)NC[C@@]2(c3ccc(F)cc3F)CC2(C)C)C[C@@](C)(CN=C=O)C1 243461576 NHKOTQILITZNSV-PKKBDPGCSA-N 433.543 4.853 50 10 IJGE COc1ccccc1OCC(=O)NN=Cc1cn(Cc2cccc(C)c2)c2ccccc12 254406876 MOTQOLMWSDIELZ-UHFFFAOYSA-N 427.504 4.536 50 10 IJGE O=C(NN=Cc1ccc(F)cc1)c1cc(-c2ccc(OCCc3ccccc3)cc2)[nH]n1 254789716 ZLOFXJORAHECOW-UHFFFAOYSA-N 428.467 4.601 50 10 IJGE CC(=O)[C@@H](Br)[C@H](C)c1cc(I)ccc1Br 300889912 DLYGKXKEFOOPSQ-KBUNVGBDSA-N 445.920 4.510 50 10 IJGE CC[C@@H](Br)[C@@H](CC)NC(=O)c1cc(Br)ccc1Br 313094319 VTXSXJMQDQFIMU-ZYHUDNBSSA-N 441.989 4.894 50 10 IJGE COc1cc([C@H]2CN(Cc3ccccc3)C[C@H]2CI)ccc1Cl 382683377 CNGNDUZHGULHOV-IAGOWNOFSA-N 441.740 4.999 50 10 IJGE Fc1cc2nc(CCl)n(Cc3cnn(Cc4ccccc4)c3)c2cc1Br 390394481 NCOLSPBJHSAERF-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE Cn1ncc(Br)c1[C@@H](Br)c1ccc(F)c(Br)c1 693046238 GZSXIGHVVPUEFB-JTQLQIEISA-N 426.909 4.569 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 784811760 AICVZENRUNFTMD-UHFFFAOYSA-N 435.789 4.631 50 10 IJGE O=C(NN=Cc1ccccc1OCc1ccccc1Cl)c1ccc(N2CCCC2=O)cc1 1084305940 JHTLBBQIJCZWPW-UHFFFAOYSA-N 447.922 4.810 50 10 IJGE CCOc1ccc(Nc2ncccc2C(=O)NNc2nc3ccccc3[nH]c2=S)cc1 1557584879 UFRSPLIEWHKGIY-UHFFFAOYSA-N 432.509 4.587 50 10 IJGE CC(=O)C1CCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)CC1 1644957527 QEGBUURWBQRRPU-NDENLUEZSA-N 443.469 4.848 50 10 IJGE CCOc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccoc1C)CCC2 1772749698 PMFIZWKPSMRXFL-UHFFFAOYSA-N 435.480 4.611 50 10 IJGE CCCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3-c2ccccn2)cc1 1865693976 SOYJROSTEHYVRZ-JOCHJYFZSA-N 429.524 4.617 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2cccc(F)c2)c1 1865694438 VGDFXFRPVAYTAA-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE CCCc1nn(Cc2ccc(F)cc2)c2c1[C@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865700265 OFHCQEADGSUNMP-QFIPXVFZSA-N 427.483 4.722 50 10 IJGE CC(C)N1C[C@@H](/C(O)=C(\C#N)c2nc(-c3cccc(Br)c3)cs2)CC1=O 1872746113 SNJZBQIUXRTFLY-VLFBTDHHSA-N 432.343 4.622 50 10 IJGE Cc1cc(Br)sc1[C@H](Br)c1c(Br)ncn1C 1900422282 OITIOIIETPLTIH-SSDOTTSWSA-N 428.975 4.799 50 10 IJGE C[C@H](CCCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)cc1Br 1915080280 AJKZYYXZLOXJHV-CYBMUJFWSA-N 434.758 4.797 50 10 IJGE C[C@@H]1C[C@H](Br)CN(Cc2ccc(Br)cc2Br)C1 1943860182 VRTNKJHDAPZPIC-SKDRFNHKSA-N 425.990 4.817 50 10 IJGE CC1(C)OC[C@H](Cc2cccc(Br)c2Br)[C@H]1Br 1943886696 XIONLLPAZLXSHR-JOYOIKCWSA-N 426.974 4.943 50 10 IJGE COc1cc(NC[C@H]2C[C@@H](Br)C2)c(Br)cc1Br 2020204506 WGYQNQOYQNDOIE-OCAPTIKFSA-N 427.962 4.806 50 10 IJGE CC[C@H](C[C@@H](C)Br)NCc1ccc(I)c(Cl)c1 2026565564 CDWVQTGXEAVOKU-MWLCHTKSSA-N 430.555 4.986 50 10 IJGE C[C@@H](NC(=O)c1c(Br)cccc1Br)C1(CBr)CC1 2033089631 VQDWCXSYLTVOFI-MRVPVSSYSA-N 439.973 4.505 50 10 IJGE FC1(F)[C@@H]2CC(CBr)(Cc3ccc(I)cc3)C[C@H]21 2045498586 LZTIFUOPAIUMHT-VXGBXAGGSA-N 427.070 4.890 50 10 IJGE CCCN1C[C@@H](Br)[C@@H](Cc2cc(Br)ccc2Br)C1 2054715937 AKKHQXUCHCTBTK-SMDDNHRTSA-N 440.017 4.859 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Br)c2ccc(Br)c(F)c2)c1 2093075164 UDGIVEXZRRZUFI-LBPRGKRZSA-N 428.142 4.538 50 10 IJGE Cc1cc(Br)sc1CN(C)c1ncc(Br)c(CCl)n1 2100771470 CZLWMHLWZQSKLH-UHFFFAOYSA-N 425.577 4.747 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](C(C)(C)C)CN(C(=O)CCCCBr)C1 2108378282 GLWKKWQQQABUJM-HZPDHXFCSA-N 433.431 4.587 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2CN(CC3(CBr)CCCCCC3)C[C@H]2C1 2112471607 HBVJXUVXVNFIEP-ROUUACIJSA-N 429.443 4.911 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@@](CNC(=O)C(F)(F)F)(C2CC2)C1 2163061247 FODZHIBQPHSZRL-SFHVURJKSA-N 441.376 4.749 50 10 IJGE COCCCCCO[C@@H](CI)c1ccc(Br)cc1 2258912224 ZRSSEWVEKOGMNQ-AWEZNQCLSA-N 427.120 4.759 50 10 IJGE CCCN(C[C@H](C)Cl)C(=O)c1cc(I)ccc1Br 2259753857 HCFABTYNCCHBAN-VIFPVBQESA-N 444.538 4.533 50 10 IJGE O=C(N[C@H](CBr)CC(F)(F)F)c1cc(F)c(Br)cc1Cl 2282977297 YRGSSPWMNPZPGN-YFKPBYRVSA-N 441.444 4.687 50 10 IJGE CCCCN1C(=O)C(=CNc2ccc(Cl)cc2Cl)C(=O)N(CCCCl)C1=O 2297454784 OEZLAHJASZQPJM-UHFFFAOYSA-N 432.735 4.509 50 10 IJGE C[C@H](CCCCBr)NCc1ccc(Cl)cc1I 2302326529 QATRTCJMXNIOCP-SNVBAGLBSA-N 430.555 4.988 50 10 IJGE C=CCC1(CBr)CCN(Cc2sccc2I)CC1 2316764426 MIYCVBAXVMZRLE-UHFFFAOYSA-N 440.188 4.906 50 10 IJGE CCOc1cc(C=NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)ccc1OC(C)C 2323766924 SMWJPRJDPPKFEY-UHFFFAOYSA-N 445.734 4.574 50 10 IJGE CCCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C(/C#N)C(=O)OCC)cc2OC)cc1 33629505 KGKOWXGTTJAMNL-FNQMJYDXSA-N 435.476 4.573 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccccc4C)ccc32)cc1 38649182 IKMYZKNMMOKYLP-RUZDIDTESA-N 426.472 4.506 50 10 IJGE CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccccc3C)ccc21 38650430 XHHKCRDCYLALPV-DEOSSOPVSA-N 426.472 4.831 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccc1)CCC2 40804031 OZKWDWRAFWRHHB-OVVQPSECSA-N 431.492 4.628 50 10 IJGE COc1cc(/C=N/NC(=O)COc2cc(C)ccc2C)ccc1OCc1ccc(C)cc1 40911193 FXYUTMCXPCBRIN-JFLMPSFJSA-N 432.520 4.729 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Br)c3ccc(F)c(Cl)c3)cc2[nH]1 212533275 ONRWTMPHCMDEBH-CYBMUJFWSA-N 434.490 4.896 50 10 IJGE O=C(CCCC[C@@H]1CCSS1)N1CC[C@@H](Oc2ncccc2Br)C1 238815051 BFZOJZIJAOLYMV-ZIAGYGMSSA-N 431.421 4.538 50 10 IJGE N#C/C(=C1/CCN(C(=O)OCc2ccccc2)C1)c1ccccc1I 382040447 IGOQZXIDWQGWDE-FBMGVBCBSA-N 444.272 4.611 50 10 IJGE C[C@H](CNC(=O)c1ccc(Br)cc1Br)C[C@@H](C)Br 397836219 MQHFWAJVGLRWES-DTWKUNHWSA-N 441.989 4.751 50 10 IJGE Clc1ccc(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@H]32)c(CBr)c1 404213545 XTOVHVZCLUCXSY-RTWAWAEBSA-N 435.793 4.715 50 10 IJGE FC(F)Oc1ccc(I)c(CBr)c1Br 575682041 HDUODUZZGXYLKJ-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE ClCc1nc2ccncc2n1CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 705864691 LPEPQOFSYMFQJL-UHFFFAOYSA-N 432.955 4.642 50 10 IJGE CC[C@@H](NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)c1ccc(F)cc1F 737934613 FOOHWQKBIINOSS-IUZFBFHQSA-N 445.473 4.916 50 10 IJGE Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)o1 742964852 KANJDFKZJXZFAC-JTSKRJEESA-N 446.551 4.558 50 10 IJGE Cc1ccc(Cl)cc1NNC(=O)[C@H](C)SCc1nc(O)c2c(C)c(C)sc2n1 1304402678 WKQYXORLBBVRQS-LBPRGKRZSA-N 436.990 4.741 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)COc1cc(C)ccc1C)c1ccc(C(F)(F)F)cc1 1680854577 GASUNJIDLQPWTM-IBGZPJMESA-N 449.473 4.739 50 10 IJGE Cc1cccc(C)c1OCC(=O)Nc1cc(C(=O)Nc2ccc(SC#N)cc2)ccn1 1860511328 SYTUFAOVBSOANF-UHFFFAOYSA-N 432.505 4.541 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(F)c2)[C@H]1c1ccccc1Cl 1865684978 CJPGUJLIDYQLBD-INIZCTEOSA-N 448.807 4.961 50 10 IJGE CCCc1nn(Cc2ccccc2F)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865698974 HIUFJAZLQPIKEA-HSZRJFAPSA-N 441.510 4.733 50 10 IJGE Cc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccc(F)cc2)c1 1865710780 IFRQHZDPWTVUQG-KRWDZBQOSA-N 428.389 4.616 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)[C@H](C)Oc3ccc(C(C)C)cc3)c(C)n2)cc1 1865758485 CLTKQNLLDNHPIO-IBGZPJMESA-N 445.563 4.971 50 10 IJGE C[C@H]1CN(Cc2ccc(Br)cc2Br)C[C@@H]1CBr 1943857499 DMFWXCKZWAHMRO-ONGXEEELSA-N 425.990 4.674 50 10 IJGE COc1ccc(C)cc1Cn1nc(CBr)c(Br)c1C(F)(F)F 2079232926 ISQMOQCZJZRIGG-UHFFFAOYSA-N 442.073 4.925 50 10 IJGE COC[C@@H]1C[C@H](Br)[C@@H](Cc2ccc(I)c(Cl)c2)C1 2086664020 GXEKCRDDYSUYBJ-SRVKXCTJSA-N 443.550 4.923 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@@H](Cl)CC2(CCC2)C1 2094997940 UTBJOPGINNOMDW-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(CC2(CBr)CCCCCC2)CC1(F)F 2106786562 VGENFFAFRJVCNT-HNNXBMFYSA-N 439.385 4.956 50 10 IJGE C[C@H]1CN(C(=O)OC(C)(C)C)C(C)(C)CN1C[C@@H](CBr)c1ccccc1 2133658241 XADKHKYSHNCOBI-FUHWJXTLSA-N 425.411 4.885 50 10 IJGE COc1cc(CCl)cc(Br)c1OCc1cc(Br)sn1 2139793220 XSOMXQLQFXAFPN-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(Cl)ccc2I)CC[C@@H]1CCCl 2172473458 KTYFLYMOIGGGFQ-MNOVXSKESA-N 426.125 4.672 50 10 IJGE COc1ccc(Br)c(CCl)c1OCc1ncsc1Br 2227747014 UZVFVAITURWOLA-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE Fc1cccc([C@@H](CI)OC2CCN(Cc3ccccc3)CC2)c1 2250369780 VXZWYFLAYJGQFZ-HXUWFJFHSA-N 439.312 4.983 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1C(=O)c1cc(Br)c(Br)s1 2251009894 NBAATJIFMHWIRG-XPUUQOCRSA-N 446.002 4.661 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@H]2[C@H](Br)CCC[C@H]2C1 2264506382 IHGWPSMTAGMHHY-DJLDLDEBSA-N 427.589 4.800 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)c1ncnc2cc(OC)c(OC)cc12 2294688723 MXWHIAMNWQGREP-INIZCTEOSA-N 430.346 4.827 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C1(C)C 2297077790 AARLRZZRWDBISQ-XQLPTFJDSA-N 447.414 4.556 50 10 IJGE CC(C)[C@@H](CBr)N(C)C(=O)c1cc(Br)c(Br)s1 2302551826 NQIHGYNTQQGYDU-MRVPVSSYSA-N 448.018 4.765 50 10 IJGE CC1=C(C#N)C(=O)N([C@@H](C)c2ccccc2)C(=O)C1=CNc1ccccc1C(F)(F)F 2314579645 YZMSEWFRFOYOHJ-HNNXBMFYSA-N 425.410 4.971 50 10 IJGE Cc1scc(C(=O)N[C@H](C)CCCCCI)c1Br 2320492889 CVMFHNJELZMMMQ-SECBINFHSA-N 444.176 4.933 50 10 IJGE CCCC1(NC(=O)OC(C)(C)C)CCN(C[C@@]2(CBr)CC2(F)F)CC1 2326918044 XXBRYYQKMDQSNI-INIZCTEOSA-N 425.358 4.566 50 10 IJGE N[C@@H](Cc1ccccc1)C(=O)NN=Cc1cccc(OCc2ccc(Cl)cc2Cl)c1 2328798549 IEWXXFNGTPTESG-QFIPXVFZSA-N 442.346 4.593 50 10 IJGE Cc1nc(NC(=O)C(C#N)=Cc2cccc(Br)c2)sc1C(=O)OCC(C)C 2329698752 BJRVAQUUAFTQHO-UHFFFAOYSA-N 448.342 4.573 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2cn(C)c3ccccc23)sc2c1CCCC2 33726122 CBTUKWOECCBIAY-QINSGFPZSA-N 433.533 4.841 50 10 IJGE O=C(N/N=C/c1ccccc1OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1Cl 48572943 MBJNMGBNRWKPSW-DHRITJCHSA-N 442.302 4.661 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2ccc(-c3ccc(Cl)cc3)o2)cc1 58893119 GVAREHIOBZUPLO-BABSMXRMSA-N 426.900 4.963 50 10 IJGE O=S(=O)(c1c(Cl)cc(Br)cc1Cl)N1CCCC[C@@H]1CCCl 109644831 HVWKAUIVPZVZGH-SNVBAGLBSA-N 435.598 4.928 50 10 IJGE CCN(Cc1ccccc1)c1ccc(/C=N\NC(=O)CSc2nc3ccccc3[nH]2)cc1 169886225 INRVBWIAHHUJFM-QQXSKIMKSA-N 443.576 4.832 50 10 IJGE CCSc1ccc(Cl)cc1CC(=O)N/N=C\c1ccc(O)c(Br)c1 169922349 PJZUHIBEKVRVQV-JMIUGGIZSA-N 427.751 4.613 50 10 IJGE O=C(NN=Cc1ccc(OCc2ccc(Cl)cc2Cl)cc1)c1cc(O)ccc1O 254852654 IHNOOBLHSALHPV-UHFFFAOYSA-N 431.275 4.748 50 10 IJGE COC(=O)c1c(NC(=O)[C@@]23CC[C@@](C)([C@@H]2Br)C3(C)C)sc2c1CCCC2 256018933 AVOGSUJBIAHSRW-FFZOFVMBSA-N 440.403 4.942 50 10 IJGE CC[C@H](Cl)[C@H](CC)NS(=O)(=O)c1cc(Br)c(C)cc1Br 313139860 HFWLCIQCBWSOIP-RYUDHWBXSA-N 447.620 4.594 50 10 IJGE BrC[C@H]1CCCN(c2ncc(Br)cc2Br)CC1 378821030 FFRMTXMNVAUTDN-VIFPVBQESA-N 426.978 4.608 50 10 IJGE CC(F)(F)c1ccc(CNC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cc1 817462181 HVMHTNVNTNKHTD-XSFVSMFZSA-N 445.473 4.799 50 10 IJGE Cc1cc(C(=O)O)ccc1-c1ccc(C=NNC(=O)Cc2cccc(C(F)(F)F)c2)o1 1084600494 ZMBOFKKCUOCFIP-UHFFFAOYSA-N 430.382 4.665 50 10 IJGE C[C@@H](SCc1nc(O)c2ccccc2n1)C(=O)NNc1c(Cl)cc(F)cc1Cl 1527689007 GPRVQVZFTBRZJM-SECBINFHSA-N 441.315 4.546 50 10 IJGE CCN(CC)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CC)cc1 1865702133 NNXIAUZHEAZGDG-QFIPXVFZSA-N 443.551 4.643 50 10 IJGE CCc1nn(-c2ccc(Br)cc2)c2c1[C@H](c1cccc(C)c1)C(C#N)=C(N)O2 1865710703 FRLAGLIDHBJMSE-LJQANCHMSA-N 435.325 4.724 50 10 IJGE Cc1nc(Nc2ccc(SC#N)cc2)cc(N2CCN(C)[C@H](c3ccc(F)cc3)C2)n1 1868480770 SMDPCYNJBJOSLE-NRFANRHFSA-N 434.544 4.734 50 10 IJGE CCOc1cc(/C=C(\C#N)c2nc(O)c3cc(OC)c(OC)cc3n2)ccc1OC(C)C 1872727527 HVQZEDIOQUVMIO-CXUHLZMHSA-N 435.480 4.603 50 10 IJGE C[C@H](CC[C@H](Br)CN1C(=O)c2ccccc2C1=O)COCc1ccccc1 1880124768 PWYQURSRFHFUTE-AEFFLSMTSA-N 430.342 4.679 50 10 IJGE C[C@H](Br)C(C)(C)CNC(=O)c1c(Br)cccc1Br 1913833704 MJGVJWUKMLATEH-QMMMGPOBSA-N 441.989 4.751 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H](Br)CC3(CC3)C2)c1 1926002642 IFARWULEIOVPQR-NSHDSACASA-N 440.550 4.694 50 10 IJGE C[C@H]1C[C@H](Br)[C@H](C)CN1c1ncc(Br)cc1Br 1944576315 PTSZRRRDHGQCMU-WEDXCCLWSA-N 426.978 4.605 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN1Cc1cc(Cl)ccc1I 1950510333 LZAJMRSQEQYRJQ-ZJUUUORDSA-N 428.539 4.550 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C2CCN(C[C@@H](CBr)C3CCC3)CC2)C1 1966288537 QYPWQSPSDJLHCQ-RBUKOAKNSA-N 429.443 4.767 50 10 IJGE CC[C@H]1CN(C(=O)OCc2ccccc2)[C@@H](CC)CN1CC(C)(C)CBr 1977884924 NQMVWTLJMOHTBU-OALUTQOASA-N 425.411 4.919 50 10 IJGE I[C@H]1CCCCCC[C@@H]1OCCOCCOCc1ccccc1 1983389620 HBHBYWJSBNWFRC-OALUTQOASA-N 432.342 4.763 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1C(=O)c1c(Br)cccc1Br 2033086130 IYDQDXRHVAHTJZ-IUCAKERBSA-N 439.973 4.600 50 10 IJGE FC1(F)C[C@@H](CBr)N(Cc2ccc(Br)cc2Br)C1 2041126592 FZKGSYDFAVZFEU-JTQLQIEISA-N 447.943 4.816 50 10 IJGE BrC[C@@H]1C[C@@H]2CN(Cc3cccc(Br)c3Br)C[C@@H]21 2053982112 KKOBDCRZKIFNKX-QJPTWQEYSA-N 438.001 4.674 50 10 IJGE O=C(CBr)c1c(OC(F)(F)F)ccc(Br)c1Br 2054921281 JKDWTSIFZNNISW-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE CCC(CC)(CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](CC(F)F)C1 2057193479 SJSBUNCSXQBJQX-CQSZACIVSA-N 427.374 4.764 50 10 IJGE O=S(=O)(c1cc(Cl)ccc1F)N(Cc1ccccc1)[C@H](CBr)C1CC1 2057408367 RFNCFUQCJMDSAR-QGZVFWFLSA-N 446.769 4.844 50 10 IJGE Cc1ccc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)CC(F)(F)F 2059265433 VRQBTOLELQUQPR-UHFFFAOYSA-N 436.293 4.643 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2CC(Br)C[C@@H]2C1 2065397931 VBLNJWCEANEPHM-NXEZZACHSA-N 438.001 4.817 50 10 IJGE BrC[C@@H]1CCN(Cc2cc(Br)ccc2Br)C12CC2 2070147286 RRBOSISRAYXKPC-NSHDSACASA-N 438.001 4.961 50 10 IJGE BrC[C@@H]1CN(Cc2ccc(I)cc2)CCC12CCC2 2095293026 ABMOWNHJSCCINN-CQSZACIVSA-N 434.159 4.678 50 10 IJGE Cn1nc(COc2cccc(CCl)c2Br)c(Br)c1Cl 2096685117 WXERFDGONDPRNO-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE CC(C)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCN(C[C@@H](Br)C(F)(F)F)CC2 2106787866 LCPPMVVSZGSNDA-KGLIPLIRSA-N 443.348 4.670 50 10 IJGE O=C(c1scc(Br)c1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Cl)C2 2134133490 SXZOFFRWFSMDSM-BNJNZJEJSA-N 431.552 4.596 50 10 IJGE COc1c(CCl)cc(Cl)cc1S(=O)(=O)N(Cc1ccccc1)CC(F)(F)F 2152211766 RPJJVVCBSXNMTM-UHFFFAOYSA-N 442.286 4.841 50 10 IJGE Cc1cc(Br)c(C(=O)NC[C@H](CBr)C(F)(F)F)cc1Cl 2161574133 BZPFTVSKUCNOTR-ZETCQYMHSA-N 437.481 4.714 50 10 IJGE C=CC[C@@]1(CBr)CCCCN1C(=O)c1ccccc1I 2287754083 SLTZQXJYHIOHQF-INIZCTEOSA-N 448.142 4.627 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CCCCCCCBr)CC2CCOCC2)C1 2294701166 OKDGOYSHMSMQRZ-UHFFFAOYSA-N 447.458 4.680 50 10 IJGE N#CC(=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1nc2cc(Br)cnc2[nH]1 2313631559 QUUQHZHJMNPCHS-UHFFFAOYSA-N 436.225 4.953 50 10 IJGE Clc1ccc(CN2C[C@@H](Br)CC3(CC3)C2)cc1I 2315554967 LKTQNHSSXDITHG-NSHDSACASA-N 440.550 4.694 50 10 IJGE COc1ccc(C(C#N)=Cc2ccc(OC(=O)c3cccc([N+](=O)[O-])c3)c(OC)c2)cc1 2320506240 FMMSKGACTRHLSS-UHFFFAOYSA-N 430.416 4.895 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@H]2[C@@H]3CC[C@@H](CN3C(=O)OC(C)(C)C)[C@H]2C1 2353833745 HUCGWONAUVYJQS-ZRSRNVLSSA-N 429.443 4.621 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@@H]2C)oc2c1/C(=N/NC(=O)c1ccccc1F)CCC2 40812368 QYKIAARNTFHUIW-GQIVLKDASA-N 445.494 4.789 50 10 IJGE O=[N+]([O-])c1ccccc1C[C@@H](Br)c1ccc(I)cc1 104169011 DMNQKILJOQFZDO-CYBMUJFWSA-N 432.055 4.878 50 10 IJGE CCc1nn(CC)c(CC(C)(CBr)CBr)c1Br 118669722 HLOFNBNJNOARTR-UHFFFAOYSA-N 431.010 4.567 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\N(Cc1ccccc1)Cc1ccccc1 217155847 MZBPIINQBSFATC-ATJXCDBQSA-N 439.515 4.912 50 10 IJGE CCc1cccc(CC)c1NC(=O)/C(C#N)=C\Nc1ccc(I)cc1 217208716 HWPLCGGACBPCCW-SSZFMOIBSA-N 445.304 4.874 50 10 IJGE O=C(NCCCCCBr)c1ccc(Br)cc1Br 232475480 CYKOFZFKDOXJAJ-UHFFFAOYSA-N 427.962 4.507 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCC[C@@H]1CCOC1 400518307 CTWGEDCOWYYRDX-VIFPVBQESA-N 442.973 4.912 50 10 IJGE C[C@@H]1C[C@@H](Br)CN(C(=O)c2cc(Br)sc2Br)C1 401899044 MDEMLMQCNHQOFO-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H]1Br)c1scc(Br)c1Br 705396987 BEJQEJVFJCBFNP-BQBZGAKWSA-N 446.002 4.567 50 10 IJGE CC(=O)Nc1cncc(C(=O)NN=Cc2ccc(-c3ccc(C(F)(F)F)cc3)s2)c1 772862078 UZBXJLOYYGEMJJ-UHFFFAOYSA-N 432.427 4.551 50 10 IJGE O=C(Cc1cccc2ccccc12)NN=Cc1ccc(OCc2nc3ccccc3[nH]2)cc1 1084014616 IDXUENWKXWAIJR-UHFFFAOYSA-N 434.499 4.988 50 10 IJGE Cc1cc(C=NNC(=O)C(=O)Nc2ccccc2F)c(C)n1-c1ccc(Cl)cc1Cl 1084407543 KPIVDTKLXZURRW-UHFFFAOYSA-N 447.297 4.629 50 10 IJGE N#CC1=NN(c2ccccc2)[C@H](c2ccccc2)[C@H]2[C@@H](c3ccccc3)C(C#N)=C(N)O[C@@H]12 1616047647 XEYUYBYGHLJCJG-QUMGSSFMSA-N 431.499 4.620 50 10 IJGE CCOc1ccc(NNC(=O)c2c(Nc3ccc4c(c3)CCCC4)cc(C)nc2O)cc1 1637709530 XFKBTHGBWHTAAM-UHFFFAOYSA-N 432.524 4.874 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccc([N+](=O)[O-])c2)CCC3)cc1 1772746511 WPQCTEMZWJPIJR-UHFFFAOYSA-N 446.463 4.527 50 10 IJGE CC(=O)[C@@H](Br)c1ccc(I)cc1SC(F)(F)F 1848425918 RZWJHMYKVFEGQQ-SECBINFHSA-N 439.034 4.928 50 10 IJGE CCCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3-c2ccccn2)cc1 1865693978 SOYJROSTEHYVRZ-QFIPXVFZSA-N 429.524 4.617 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CN(C(=O)OC(C)(C)C)C2(CCCC2)C1 1882088798 UNMYYNUNGLUOSE-LSDHHAIUSA-N 447.414 4.844 50 10 IJGE O=C(c1c(Cl)cc(Br)c(F)c1Br)[C@H]1C[C@H]1Br 1900377023 RDNWSSYTKVZBIF-IUYQGCFVSA-N 435.312 4.970 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1Cc1ccc(Br)cc1Br 1943859442 PCQCZWKMNRZHNC-BXKDBHETSA-N 425.990 4.959 50 10 IJGE CN(Cc1cccc(Br)c1Br)[C@@H]1CCC[C@H]1Br 1943885500 WISIFWFQYGDRDI-ZYHUDNBSSA-N 425.990 4.959 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCC[C@H](Br)CC1 1945190391 MGZAQLBTUBINMN-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE CCn1cc(Br)c(CN(Cc2ccccc2)[C@@H](CBr)C2CC2)n1 1985197546 FDFZHSGVYLKDLF-SFHVURJKSA-N 441.211 4.841 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC[C@H]1C[C@H]1C1CCCC1 1993088825 IUJONRVOFKJHCA-VKJFTORMSA-N 437.362 4.548 50 10 IJGE COc1cc([C@H](Br)C2(Br)CC2)c(OC)cc1Br 2002806422 LAIKOBDEVSQINR-NSHDSACASA-N 428.946 4.830 50 10 IJGE Brc1cccc(C[C@@H]2CN(C3CC3)C[C@H]2Br)c1Br 2039252296 WKPJZLFORHUVLW-ZWNOBZJWSA-N 438.001 4.612 50 10 IJGE CN(C(=O)c1cc(Br)c(Cl)s1)[C@@H](CCBr)C(F)F 2058234595 OSMCYHAFRVNJFQ-LURJTMIESA-N 425.520 4.655 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN(Cc2ccc(I)c(Cl)c2)C1 2086658685 POHZFWBMBXZTAF-ZYHUDNBSSA-N 442.566 4.940 50 10 IJGE CC[C@@]1([C@@H](Br)c2cc(I)cc3c2OCC3)CCCO1 2090698399 YMZIRXDBQBKKNP-GJZGRUSLSA-N 437.115 4.621 50 10 IJGE Cc1cc(C(=O)NCC(C)(C)C[C@@H](C)Br)ccc1I 2142140343 IJHGSYMHVRRUTE-LLVKDONJSA-N 438.147 4.529 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@@H](CBr)CC(F)(F)F)cc1Br 2167384493 OMPCCFJECSDRHS-MRVPVSSYSA-N 437.481 4.857 50 10 IJGE O=[N+]([O-])c1ccc(CBr)c(N2CC[C@H]3CC[C@@H](C2)N3Cc2ccccc2)c1 2176907344 XGROVDCOSMDYAL-QUCCMNQESA-N 430.346 4.733 50 10 IJGE CN(C(=O)c1ccc(Br)c(Cl)c1)[C@@H](CCBr)C(F)(F)F 2178515917 QDJVWQTUCYCLSA-JTQLQIEISA-N 437.481 4.890 50 10 IJGE ClCCCOC1CCN(Cc2ccc(I)c(Cl)c2)CC1 2208027875 BKXGGGJDQJDZRK-UHFFFAOYSA-N 428.141 4.555 50 10 IJGE BrC1CCC2(CCCN2C[C@H]2CC2(Br)Br)CC1 2213088593 QDDYWVLUKHRCAC-VOMCLLRMSA-N 430.022 4.665 50 10 IJGE CC(C)(C)OC(=O)NC1(c2csc(NC(=O)[C@@H](Br)C3CCCC3)n2)CC1 2224309900 IJUCNZAZZDMAPF-ZDUSSCGKSA-N 444.395 4.549 50 10 IJGE O=C(Nc1ccc(I)cc1)O[C@H]1CCCC[C@@H]1CBr 2227209276 MJYKZENZZQLPJX-MFKMUULPSA-N 438.103 4.793 50 10 IJGE C[C@@H](COC(F)F)O[C@H](CI)c1ccc(Br)cc1 2253920173 SZBRHLDTLTXVPS-GZMMTYOYSA-N 435.046 4.570 50 10 IJGE CC(C)(C)OC(=O)NC1CC(C[S@](C)(=O)=NCCCCCCCBr)C1 2263161421 ACXNFCHPPGMHLU-HRTIZWQRSA-N 439.460 4.733 50 10 IJGE CC12COC(CO[C@@H](CI)c3cccc(Br)c3)(C1)C2 2266291602 WSWBVARHYDVHDI-NFOMZHRRSA-N 437.115 4.511 50 10 IJGE C=CC[C@@](C)(CBr)CNC(=O)c1cc(F)c(Br)cc1Cl 2282988716 VLDUGOZXHYIMMW-AWEZNQCLSA-N 427.539 4.949 50 10 IJGE N#CC(=Cc1c(Oc2ccccc2)nc2ccccn2c1=O)C(=O)Nc1ccc(Cl)cc1 2296719313 AMCVWHVJTNRZGD-UHFFFAOYSA-N 442.862 4.686 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)n2)cc1F 2331337457 ALWOFHIXLYFEPY-UHFFFAOYSA-N 442.384 4.724 50 10 IJGE Cc1c(C(=O)N2CCCCCC2)oc2c1/C(=N/NC(=O)c1ccc3ccccc3n1)CCC2 40825830 XBPPHOCWGHGWNW-VFCFBJKWSA-N 444.535 4.623 50 10 IJGE O=S(=O)(c1cc(CCl)sc1Br)N(Cc1ccsc1)C1CC1 91271678 BDWCACXAGUBSNK-UHFFFAOYSA-N 426.810 4.664 50 10 IJGE CN(c1ncc(Br)cc1Br)[C@H]1CCCC[C@@H]1Br 157647710 KVBUUFLXPFGINV-ONGXEEELSA-N 426.978 4.749 50 10 IJGE COc1cc(/C=C2\C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 214383027 PHXQCTDSBJYYFA-UUYOSTAYSA-N 444.531 4.831 50 10 IJGE CCC[C@H](C)CO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 233337135 QWSASFXCRXBKPI-WMLDXEAASA-N 425.351 4.644 50 10 IJGE CC[C@H](C)N(CCBr)C(=O)c1ccc(Br)cc1Br 310717330 WWWVSJWSTDGODW-VIFPVBQESA-N 441.989 4.847 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CCl)c1Cl)N1CC[C@H](OCc2ccccc2)C1 383887080 IDAJMMLCEJHCBL-INIZCTEOSA-N 434.772 4.712 50 10 IJGE FC(F)c1ccc(I)c(Br)c1CBr 575688063 ZFLOAENHHVYFFG-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE CC(=O)CCc1ccc2oc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c(C)c2c1 799747260 UXOXLYSBTYXOJM-UHFFFAOYSA-N 429.398 4.910 50 10 IJGE Cc1c(C(=O)Nc2ccc(Cl)cc2)oc2c1C(=NNC(=O)c1ccccc1O)CCC2 1772751378 AFKOUYARMPXUIM-UHFFFAOYSA-N 437.883 4.670 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2)[C@@H]1c1cccc(Cl)c1 1865684389 XYPKOBXQDBSIJG-MRXNPFEDSA-N 430.817 4.822 50 10 IJGE CCCc1nn(-c2ccccc2Cl)c2c1[C@@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706076 MXIXDTWWDNJTHE-IBGZPJMESA-N 435.871 4.605 50 10 IJGE COc1ccccc1-c1ccc(C(=O)N/N=C\c2ccc(Br)cc2F)c(C)n1 1865762523 LWXAGPMOIHNLQO-MSXFZWOLSA-N 442.288 4.731 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C)C[C@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1880767119 NBBLDLXAZCITHG-TUVASFSCSA-N 435.403 4.556 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)Cc1ccc(Br)c(Br)c1 1882072588 AVVNZMUFECESHX-JTQLQIEISA-N 427.564 4.886 50 10 IJGE CC(C)CC(CC(C)C)O[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1I 1899502781 GYLGXAUOEUAWEH-HZPDHXFCSA-N 439.378 4.887 50 10 IJGE Cc1cccc(S(=O)(=O)N(Cc2ccccc2)[C@H](CBr)C(C)C)c1F 1915300986 QQPNEEOEVGXGAM-QGZVFWFLSA-N 428.367 4.745 50 10 IJGE CCN(CCCCBr)C(=O)c1cc(Br)c(Br)s1 1996952853 CMSUHLVHBVFNSA-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE Cn1ncc(Br)c1CC(CBr)(CBr)C1CCCC1 2027111907 NDAWAODIAAFTSO-UHFFFAOYSA-N 443.021 4.692 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2[C@H]1C[C@@H](Br)C1 2063145447 JUUPCICSVIQFDM-KNVOCYPGSA-N 443.485 4.617 50 10 IJGE C[C@H](CCBr)CCN1CCCC[C@H]1C(F)(F)CNC(=O)OC(C)(C)C 2065451875 DSWSWUCTXXUITD-CABCVRRESA-N 427.374 4.812 50 10 IJGE Clc1cc(CN2CC[C@H](Br)[C@@H]3CC[C@@H]32)ccc1I 2086656016 SHTGRVROTYVGOM-MJVIPROJSA-N 440.550 4.692 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)[C@H]1CN(CCCCCCCCCBr)CCO1 2106780705 AYCIJRGGWGPXON-ZWKOTPCHSA-N 435.447 4.726 50 10 IJGE C[C@H](CCBr)CCN1CC[C@H](C(F)(F)F)C[C@@H]1CNC(=O)OC(C)(C)C 2107584863 NUYVLALBNLAOAN-QLFBSQMISA-N 445.364 4.965 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H](NC(=O)c1ccc(CBr)cc1)C1CCCCC1 2162485286 BWAHQONFDBXDKO-GOSISDBHSA-N 439.394 4.785 50 10 IJGE Cc1cc(C(=O)N2C[C@@]3(CBr)CCC[C@]3(F)C2)sc1Br 2176631312 YARSXAMYEPLOAB-KBPBESRZSA-N 425.161 4.548 50 10 IJGE CC[C@@H]1CCCN(S(=O)(=O)c2cc(CBr)sc2Br)CC1 2179791855 XJKZIESMWZVRFA-SNVBAGLBSA-N 445.242 4.606 50 10 IJGE C[C@@H]1[C@@H](NC(=O)OC(C)(C)C)CC[C@@H](C(=O)N(C)C[C@H]2C[C@H](Br)C2)C1(C)C 2196913590 DZNBBBUSGFIMGW-MTSZKFMLSA-N 445.442 4.584 50 10 IJGE COC(=O)[C@]1(CCl)C[C@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 2230922119 SZNXTPCJMSKXCC-LAUBAEHRSA-N 442.028 4.570 50 10 IJGE Cc1c([C@@H](Cl)c2c(F)cc(F)c(Br)c2F)nn(C)c1Br 2236107254 GKKIUHOCQBOINZ-VIFPVBQESA-N 432.465 4.999 50 10 IJGE COc1ccc(N(C)Cc2cccc(I)c2)c(CBr)c1 2280263839 KKOHCWHMRJKSHT-UHFFFAOYSA-N 446.126 4.831 50 10 IJGE CCc1cc([C@H](Br)c2ccc(S(C)(=O)=O)cc2)sc1Br 2283058606 MJQKUMKPQVYDBU-CYBMUJFWSA-N 438.206 4.961 50 10 IJGE CCCCOC(=O)c1ccc(NC(=O)C(C#N)=Cc2cc(Br)ccc2O)cc1 2296819075 RGQAKSDUEFPZQW-UHFFFAOYSA-N 443.297 4.657 50 10 IJGE COC(=O)c1c(NC(=O)c2cc(=O)c3cc(Cl)ccc3o2)sc(C(C)=CC#N)c1C 2296857819 JSRRZHGHHFOFIF-UHFFFAOYSA-N 442.880 4.782 50 10 IJGE COC(=O)C(C#N)=Cc1cccc(OC(=O)C=Cc2ccc(OCCC(C)C)c(OC)c2)c1 2314770472 BGHPJFVLRGHZNB-UHFFFAOYSA-N 449.503 4.819 50 10 IJGE CCC(CC)(CBr)CN1CC(F)(F)[C@@](C)(CNC(=O)OC(C)(C)C)C1 2326658535 GFGIFWHOVZRNFC-INIZCTEOSA-N 427.374 4.670 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@@H](CBr)C12CC2 2327394330 DFOZSZLFLSUPGU-NSHDSACASA-N 440.550 4.694 50 10 IJGE Cc1cnc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)cc1CBr 2380364280 CPSZGYWDTUQFFN-NMIHRBCNSA-N 426.402 4.632 50 10 IJGE CC1CCN(C(=O)/C(C#N)=C/c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)CC1 1452597 WPXNJBSDKDZBOQ-HMMYKYKNSA-N 441.491 4.613 50 10 IJGE CC[C@@H](C)Oc1ccc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)cc1 10291748 NSCKKYPORZJJQA-CQSZACIVSA-N 439.339 4.791 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C\Nc3ccc(F)c([N+](=O)[O-])c3)n2)cc1OC 11853112 OLPBSTOOGDNZID-RAXLEYEMSA-N 426.429 4.851 50 10 IJGE COc1ccc(CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(Cl)cc2)cc1 38651427 QPHDKFSXTZCVTR-XMMPIXPASA-N 446.890 4.715 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)COc2ccccc2)CCC3)c(C)c1 40815982 FFUMIUUVABCXTF-SGWCAAJKSA-N 445.519 4.693 50 10 IJGE CCOc1ccc(/C=N/NC(=O)CCCOc2ccc(CC)cc2Br)cc1 40959328 BBTFMQRGDCURSP-HZHRSRAPSA-N 433.346 4.720 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)C(C)(C)C)cc1Cn1nc(C)c(Br)c1C 96438911 CMFDRQJLCKZETQ-SXGWCWSVSA-N 430.346 4.842 50 10 IJGE Br[C@H](c1cccc(I)c1)c1ccc2c(c1)OCCO2 109851582 DKAKJGZNCLPRFD-OAHLLOKOSA-N 431.067 4.547 50 10 IJGE CC[C@H](CCBr)CNC(=O)c1cc(Br)c(Br)s1 127048113 HSUVQFIGWSMFEF-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE COc1ccc(Cl)c(CC(=O)N/N=C/c2cccc(OC)c2OCc2ccccc2)c1 169921940 YOFZBFMRXMAZKM-CVKSISIWSA-N 438.911 4.629 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)N/C=C(/C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 217234158 HWJLABUHHZEJFW-UZFBZYOGSA-N 428.876 4.652 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\Nc1cc([N+](=O)[O-])ccc1Cl 217240359 XDKTXQOLCLSVDD-YPKPFQOOSA-N 442.859 4.663 50 10 IJGE C[C@@H](CCCCBr)NC(=O)c1ccc(Br)cc1Br 398536306 SSUHCAYWQJHUPE-VIFPVBQESA-N 441.989 4.895 50 10 IJGE Cc1ccc(C(C)(C)CNC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cc1 728537712 HCDKWFBLOWVXKJ-CJLVFECKSA-N 437.547 4.773 50 10 IJGE Cc1ccccc1NNC(=O)C(=O)Nc1ccc(Oc2ccc(F)cc2)c2ccncc12 783333146 RCYCLKVHWUEMFK-UHFFFAOYSA-N 430.439 4.556 50 10 IJGE BrC[C@@H](CN1CCC[C@H]1c1ccc(I)cc1)C1CC1 1307642804 INHVKEHYSGQXFL-HOCLYGCPSA-N 434.159 4.849 50 10 IJGE Cc1ccc(NNC(=O)CCc2nc(O)c3c4c(sc3n2)C[C@@H](C)CC4)c(Cl)c1 1449704474 RCLCCAXQZIFMRC-LBPRGKRZSA-N 430.961 4.559 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)CCCSc3ccccc3)c(C)n2)cc1 1865758513 DOJXZXQXWCFAOO-UHFFFAOYSA-N 433.577 4.953 50 10 IJGE BrCCCCOc1cc(Br)cc(I)c1 1888183335 MVTGNKPFMNXCFZ-UHFFFAOYSA-N 433.909 4.608 50 10 IJGE Cc1sc(Br)cc1[C@H](Br)c1c(Br)ncn1C 1900420491 MYGIHRQGMJXPRU-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE C[C@H]1OCC[C@]1(CBr)Cc1cccc(Br)c1Br 1943886826 YGOZOZVKUJKNBF-NOZJJQNGSA-N 426.974 4.944 50 10 IJGE C[C@H](Br)Cc1cc(NC(=O)OC(C)(C)C)ccc1I 1951906580 XEGSNLSGNUYKGO-VIFPVBQESA-N 440.119 4.964 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@H]2CCCC23CC3)C1 1986119055 PFMXMISCEUFGJP-KSSFIOAISA-N 435.346 4.540 50 10 IJGE CC(C)CN(CCBr)C(=O)c1cc(Br)cc(Br)c1 2036717960 QMDHAEWOZFOHAI-UHFFFAOYSA-N 441.989 4.705 50 10 IJGE C[C@H](CCBr)CCN=[S@@]1(=O)CC[C@H](CNC(=O)OC(C)(C)C)C1(C)C 2044706708 WMICHSGKWQEQAS-KDCSIKNMSA-N 439.460 4.589 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCN[C@H]1CCc2c(Br)cccc21 2061265224 YCPFHJFXAYUKFS-INIZCTEOSA-N 447.464 4.932 50 10 IJGE Cc1nn(C)c(C[C@@H](Br)c2ccc(Br)cc2)c1Br 2072280478 SRPFRQJKBADFFB-LLVKDONJSA-N 436.973 4.932 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2C[C@H](C)N(C)Cc1ccccc1 2096786829 NRXIZSQWFWHPCL-AWEZNQCLSA-N 435.797 4.804 50 10 IJGE ClCCc1nc2cccc(Br)c2n1[C@@]12C[C@@H]1CN(Cc1ccccc1)C2 2099679991 WKGBABOMPMAGDN-IIBYNOLFSA-N 430.777 4.811 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CN(C[C@H](Br)C(F)(F)F)c2ccccc21 2106781406 HKMHPGYPCAOCNZ-WFASDCNBSA-N 437.300 4.831 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H](C)CC[C@@H]1CNC(=O)C(F)(F)F 2106784713 KREKQSZWKCQAGY-HUUCEWRRSA-N 429.365 4.747 50 10 IJGE CO[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)N(CCCCCCCCCBr)C1 2106787619 JIMPOULOHNBECE-ZWKOTPCHSA-N 435.447 4.726 50 10 IJGE COc1ccc([C@H](Br)c2nn(C)c(Cl)c2Br)c(Cl)c1 2110721379 HPWDABZDITZMBI-VIFPVBQESA-N 428.939 4.982 50 10 IJGE CN(Cc1ccccc1NC(=O)[C@@H](Br)C1CCCC1)C(=O)OC(C)(C)C 2110723277 NDSGVKBPEKYPLK-KRWDZBQOSA-N 425.367 4.946 50 10 IJGE COc1cc(Cl)c([C@H](Br)c2c(Cl)cnn2C)cc1Br 2137644297 CVHYRVMEYXIGGH-NSHDSACASA-N 428.939 4.982 50 10 IJGE COc1cc(Cl)c([C@H](Cl)c2cc(Br)n(C)n2)cc1Br 2137648180 LIOULFCKYHKRNM-LBPRGKRZSA-N 428.939 4.935 50 10 IJGE O=C(c1ccc(OCc2ccccc2)cc1)N1C[C@]2(F)CCC[C@]2(CBr)C1 2176639643 IXIVHEYPOLNKHZ-FCHUYYIVSA-N 432.333 4.995 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]21 2185533277 MONSMHKFLOIMBN-QZTJIDSGSA-N 447.458 4.678 50 10 IJGE C[C@@H](c1nscc1Br)n1c(CCl)nc2cncc(Br)c21 2186653130 VZALKRKHAMZSFL-LURJTMIESA-N 436.560 4.761 50 10 IJGE CCc1sc(Br)cc1[C@H](Br)[C@@]12CCC[C@H]1CS(=O)(=O)C2 2201881645 PRBNJAMGZWVLMP-QCZZGDTMSA-N 442.238 4.724 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)[C@H]2CCCS2(=O)=O)c(C)c1Br 2227352052 BFGHKLRILDXXME-MFKMUULPSA-N 430.589 4.686 50 10 IJGE FC(F)(F)CN(CCBr)c1ncc(C(F)(F)F)cc1Br 2240943517 QYXUHLHZQCDALT-UHFFFAOYSA-N 429.984 4.627 50 10 IJGE Brc1cccc(Br)c1OCCCCI 2241511028 QGAFWRCTRKQRGL-UHFFFAOYSA-N 433.909 4.806 50 10 IJGE Fc1ccc([C@@H](CI)O[C@@H]2CCN(Cc3ccccc3)C2)cc1 2244771418 LYLOIEAXECLVRO-RTBURBONSA-N 425.285 4.593 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@H]2CCC23CCC3)CC1 2247315731 FCCXRBCMQOJSHC-OAHLLOKOSA-N 449.373 4.788 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@H](CBr)C(C)(C)C)[C@H](C(F)(F)F)C1 2266272050 JXKBBDFTBUTAJS-MJBXVCDLSA-N 445.364 4.964 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1c(F)ccc(Cl)c1F 2320356804 RPRIGHJYZQYPRF-CYBMUJFWSA-N 432.692 4.718 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)cc(Cl)c1O 2323168587 KQAVFWQUZPQHMS-ZDUSSCGKSA-N 425.916 4.814 50 10 IJGE Cc1ccc(CN[C@@H](C)CCCCCI)c(O)c1Br 2352686616 CGFJFCUADSWJGD-LBPRGKRZSA-N 440.163 4.937 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3cccc(Cl)c3)ccc2[C@H]1c1cccc([N+](=O)[O-])c1 38654096 URNXQYVYWQNLKP-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(C)cc4)ccc32)cc1 38676919 PHIYFFRMZGFQMY-SANMLTNESA-N 440.499 4.760 50 10 IJGE Br[C@H](c1ccc2c(c1)OCCCO2)c1ccccc1I 109843177 UZTQYUKTHTVYEK-MRXNPFEDSA-N 445.094 4.937 50 10 IJGE O=C(N[C@H]1CCC[C@H]1CBr)c1cc(Br)ccc1Br 231580533 VISUFGCJKICHGV-UFBFGSQYSA-N 439.973 4.505 50 10 IJGE O=C(NN=Cc1cc(Cl)ccc1O)c1cccc(NC(=O)c2cccc(Cl)c2)c1 252515383 JHBHHMAQHFRNOG-UHFFFAOYSA-N 428.275 4.715 50 10 IJGE C[C@@H](Br)C[C@@H]1CCCCN1C(=O)c1csc(I)c1 310731190 MYFOCKBPRUVFLY-KOLCDFICSA-N 442.160 4.521 50 10 IJGE CC(C)[C@](C)(CBr)NC(=O)c1cc(Br)cc(Br)c1 398531241 BXFLUUVVMLCZRN-ZDUSSCGKSA-N 441.989 4.751 50 10 IJGE Clc1cc2c(cc1[C@@H](Br)c1nscc1Br)OCCO2 404804555 MJKZKKBIDAHAFD-LLVKDONJSA-N 425.529 4.815 50 10 IJGE C[C@H](Br)CN(C(=O)c1cc(Br)sc1Br)C1CC1 691355478 GWVQJOHFZHUFHR-LURJTMIESA-N 446.002 4.661 50 10 IJGE COc1ccc(-c2cc(N)c(C(=O)NN=C3CCN(Cc4ccccc4)C[C@H]3C)s2)cc1 734365480 IROWQONHVMQNJM-QGZVFWFLSA-N 448.592 4.634 50 10 IJGE Cc1cc(C(=O)NNc2ccccc2Br)ccc1NC(=O)c1cccs1 759659156 LLVXOJSBOLLAKH-UHFFFAOYSA-N 430.327 4.828 50 10 IJGE CCc1c(C)nn(-c2cccc(C(=O)NNc3ccc(Br)c(F)c3)c2)c1C 771688630 FFGHQQUYORBDOC-UHFFFAOYSA-N 431.309 4.710 50 10 IJGE C#C[C@H](NC(=O)NNC(=O)c1ccc(OCCCCCC)cc1)c1ccc(Cl)cc1 1252448623 JMOHYAVMFSDVSV-NRFANRHFSA-N 427.932 4.618 50 10 IJGE C#CCC1(NC(=O)CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)CCCCC1 1304006816 ILEXDKHDAOQJAU-UHFFFAOYSA-N 447.695 4.796 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C(F)(F)c2ccc(C(C)(C)C)cc2)c1C 1306606986 KHQFGZCVKRLYEO-UHFFFAOYSA-N 425.483 4.688 50 10 IJGE O=C(NNc1ccc(F)cc1Br)c1cc2cccc(C(F)(F)F)c2nc1O 1566585358 ZBUBVCKRANQKHH-UHFFFAOYSA-N 444.182 4.618 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2cccc3c(Br)cccc23)c1C 1650810074 SOBJFRJPBKZVKE-UHFFFAOYSA-N 448.324 4.828 50 10 IJGE N#CSc1ccc(NC(=O)Oc2ccc(CNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)cc1 1858905793 PREINORDODHUNE-UHFFFAOYSA-N 448.460 4.709 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1cc(C)ccc1C 1865691636 XBRSWOLQSSWZQD-DEOSSOPVSA-N 426.520 4.640 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@@H](c1ccc(OC)cc1)C(C#N)=C(N)O2 1865714751 PHGRZLOUPAZVIF-QHCPKHFHSA-N 428.536 4.728 50 10 IJGE CC(C)(CI)CN1CCCC[C@@H]1CCCNC(=O)OC(C)(C)C 1904652949 GXDRDOFVLXXHQK-OAHLLOKOSA-N 438.394 4.607 50 10 IJGE Cc1nsc(Br)c1[C@@H](Cl)c1cc2nc(O)[nH]c2cc1Br 1912982405 MBAHCICSLCXUSB-JTQLQIEISA-N 437.544 4.887 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1sncc1Br 1915126044 MGEZQRSPXZLQHF-LBPRGKRZSA-N 432.181 4.722 50 10 IJGE O=S(=O)(N[C@@H](CBr)CC1CCCCC1)c1ccc(Br)s1 1926739249 YBMCBZGCJALWIK-LLVKDONJSA-N 445.242 4.523 50 10 IJGE CCN(CCCCBr)Cc1ccc(I)c(Cl)c1 2026562895 FVOAJLURFCHHTB-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE O=C(N[C@H](CCBr)C(F)(F)F)c1cc(Br)c(Cl)s1 2052436022 FYTCPMHHOCGMBS-ZCFIWIBFSA-N 429.483 4.610 50 10 IJGE Fc1cc(-n2nc(CBr)c(Br)c2C(F)(F)F)cnc1Cl 2078912518 QQAUJIYHWUTLBA-UHFFFAOYSA-N 437.416 4.736 50 10 IJGE CC[C@@H](C)[C@@H](CI)NCc1c(F)ccc(Br)c1F 2081240353 HEOTYCLVPRCHNE-PRHODGIISA-N 432.090 4.667 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H]3CC[C@@H](CN3CC3(CBr)CCCC3)[C@H]2C1 2106786382 FFPIZLKUICXEFC-MLHJIOFPSA-N 427.427 4.519 50 10 IJGE O=C(NC[C@@]1(CBr)CC12CCC2)c1cc(Br)c(Cl)s1 2115926457 SYFBJIKRYHHOJL-ZDUSSCGKSA-N 427.589 4.849 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@@]1(C)CN(c1nc(CCl)ccc1Br)C2 2120532097 QPGABURLJHZGHZ-SFTDATJTSA-N 434.809 4.931 50 10 IJGE N#C[C@H]1CN(c2cc(C(F)(F)F)ccc2CBr)CCN1Cc1ccccc1 2155759234 NWZROYRAFDVRLM-SFHVURJKSA-N 438.291 4.815 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(CC3(CBr)CCCCC3)C[C@H]21 2163057920 GJTQABNNKMROJI-MKXGPGLRSA-N 441.454 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCC[C@H]2NC(=O)[C@H](Br)C2CCCC2)CC1 2167050732 NUUJFNUNSSFKGI-IAGOWNOFSA-N 443.426 4.626 50 10 IJGE Cc1cc(C(=O)NCC2(F)CCC(CBr)CC2)c(Br)s1 2178581942 YMRKSGURVLPHJH-UHFFFAOYSA-N 427.177 4.842 50 10 IJGE ICCCCCN1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1 2211184365 CWXIYDCRBCBHLT-WOJBJXKFSA-N 426.386 4.578 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)[C@@H]1[C@@H]2CCO[C@@H]21 2213490725 VYMFIKGUJLQYMM-KPHQYVGYSA-N 428.921 4.822 50 10 IJGE Fc1cc2c(cc1I)nc(CCCl)n2CCSC(F)F 2232495753 WATOYGWVVGHDHO-UHFFFAOYSA-N 434.652 4.517 50 10 IJGE COc1ccc([C@@H](Br)CC[C@H]2CCCO2)cc1I 2257370141 ZSGYEXSEWSJUMQ-NEPJUHHUSA-N 425.104 4.695 50 10 IJGE COc1cc(F)c(CBr)c(N2CCN(Cc3ccccc3)CC(F)(F)C2)c1 2283391753 KDMYFYTVHKGAHR-UHFFFAOYSA-N 443.307 4.687 50 10 IJGE CC(C)Oc1cccc(C=CC(=O)N2CCC(C(=O)Nc3ccc(SC#N)cc3)CC2)c1 2318784473 HQULVISKWKNTPL-UHFFFAOYSA-N 449.576 4.937 50 10 IJGE Clc1cc(C[C@]2(CBr)O[C@H]3CC[C@H]2C3)ccc1I 2327577110 IKIJVVYDHLDTNB-COPLHBTASA-N 441.534 4.820 50 10 IJGE Cn1cc(I)c(CC(CCl)(CCl)c2cccc(Cl)c2)n1 2367585985 JHLDGCZANRSABN-UHFFFAOYSA-N 443.543 4.636 50 10 IJGE CCCCN(CCCC)Cc1ccc(C(=O)NNC(=S)Nc2cc(C)ccc2C)o1 4683357 YXZQTQBXJTWGKT-UHFFFAOYSA-N 430.618 4.930 50 10 IJGE Cc1cccc(-n2c(SCC(=O)NN)nc(-c3ccccc3)c2-c2ccccc2)c1C 35666745 DDHRFSBIAZTTEG-UHFFFAOYSA-N 428.561 4.905 50 10 IJGE CCOc1ccc2ccccc2c1/C=N/NC(=O)c1nc(Cl)c(Cl)c(N)c1Cl 58643704 VQQMWRILBAVZLK-PGGKNCGUSA-N 437.714 4.940 50 10 IJGE O=C(N/N=C/c1ccccc1Oc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1 59463950 YDFHMSPRUDOKJN-LPYMAVHISA-N 440.253 4.914 50 10 IJGE CCc1cc(CC(CBr)(CBr)c2ccccc2Cl)n(C)n1 118878000 CQZSHZLMNPYPGS-UHFFFAOYSA-N 434.603 4.906 50 10 IJGE COc1ccc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)c(Cl)c1OC 169891442 NCTGXHKWMCTNND-QOWQLIIWSA-N 425.916 4.727 50 10 IJGE COc1ccc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)c(Cl)c1OC 169891443 NCTGXHKWMCTNND-UWLYNBDASA-N 425.916 4.727 50 10 IJGE CCn1c(C)c(/C=N\NC(=O)c2cccn(Cc3ccc(Cl)cc3)c2=O)c2ccccc21 169920393 BGJTVMWWABVNNM-DICXZTSXSA-N 446.938 4.597 50 10 IJGE BrCC(CBr)(COCC1CC1)c1cccc(Br)c1 232468982 GTZUEFAJOIGZLD-UHFFFAOYSA-N 441.001 4.903 50 10 IJGE CC(=NNC(=O)c1ccc(COc2cccc3cccnc23)cc1)c1ccc2c(c1)OCO2 254413718 AYKBUFZKZWSYRB-UHFFFAOYSA-N 439.471 4.697 50 10 IJGE COCC[C@H](C)Oc1c(Br)cc(CBr)cc1Br 300442502 VLTHHZOELKKMNN-QMMMGPOBSA-N 430.962 4.910 50 10 IJGE Cc1ccccc1NNC(=O)c1nn(-c2cccc(Br)c2)c2c1CCCC2 739391579 QJUATLXGGJACAC-UHFFFAOYSA-N 425.330 4.579 50 10 IJGE O=C(NNc1ccc(F)cc1Br)C1CCN(c2nc3ccccc3s2)CC1 748077421 PERKXANWZQZIHW-UHFFFAOYSA-N 449.349 4.558 50 10 IJGE O=C(NNC(=O)c1ccccc1OCc1ccc(F)cc1)Nc1cccc(-c2ncco2)c1 757769832 DWDQDLCLCPFCAE-UHFFFAOYSA-N 446.438 4.526 50 10 IJGE O=C(NNc1nc2ccccc2[nH]1)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 768505875 YBSZFMBYXCKIGR-UHFFFAOYSA-N 428.427 4.540 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)c2ccc(Sc3ccc(Cl)cc3)cc2)cc1 773493349 WWNDIYIJQFVSAL-UHFFFAOYSA-N 432.954 4.652 50 10 IJGE Cc1ccc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1NC(=O)OC(C)(C)C 799753677 NKPYWIOFUCGUHU-UHFFFAOYSA-N 434.418 4.989 50 10 IJGE CCCOc1ccc(OC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cc1 916853648 DJMMQJWYUJSBQH-SILNSSARSA-N 426.476 4.765 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)C1(c2cccc(OC(F)(F)F)c2)CCC1 1453767148 DVEFPRVQEZHRCY-UHFFFAOYSA-N 434.443 4.756 50 10 IJGE C/C(=C\C(C)(C)C)C(=O)NNC(=O)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1 1530289183 KSDYLQOWNPXFCD-BMRADRMJSA-N 441.531 4.754 50 10 IJGE COc1cc(/C=C(\C#N)n2cnc3ccccc32)ccc1OCC(=O)Nc1ccc(C)cc1 1872727179 CNQBQSICPWXYNN-FYJGNVAPSA-N 438.487 4.893 50 10 IJGE Cn1nc(C(=O)N(Cc2ccccc2)[C@H](CBr)C2CC2)c(Cl)c1Cl 1915264052 QAKBPDRSAOHXOQ-CYBMUJFWSA-N 431.161 4.543 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc([C@@]2(C)CCC[C@H](CI)O2)cc1 2014210802 PGRZBGWDNSVOGY-VQIMIIECSA-N 445.341 4.931 50 10 IJGE C=CCC[C@@H](CBr)NC(=O)c1cc(Br)c(Br)s1 2019475003 JHAOMHZUTAXFBD-ZETCQYMHSA-N 446.002 4.733 50 10 IJGE O=Cc1cc(Br)cc(Br)c1OC[C@H]1C[C@@H](Br)C1 2020212679 DZCWOAHMVGLTRD-OTSSQURYSA-N 426.930 4.576 50 10 IJGE Clc1ccc(I)c(C[C@@]2(CBr)C[C@@]23CCOC3)c1 2039014787 GOOJZDNRAMCKSY-KGLIPLIRSA-N 441.534 4.679 50 10 IJGE Cn1c(C(C#N)=Cc2sc(N3CCOCC3)nc2-c2ccccc2)nc2ccccc21 2040447837 XKYSBZKFYFSFAV-UHFFFAOYSA-N 427.533 4.598 50 10 IJGE C#CCN(CC1(CBr)CCCCC1)C1CCN(C(=O)OC(C)(C)C)CC1 2106786268 TYDRWNPTZLXASJ-UHFFFAOYSA-N 427.427 4.667 50 10 IJGE Fc1ccccc1C(CBr)(CBr)CCS[C@H]1CCOC1 2149122842 KZKWURDIZBJNIB-LBPRGKRZSA-N 426.189 4.766 50 10 IJGE CC1(C)C[C@@H](CNC(=O)c2ccc(CBr)cc2)CN(C(=O)OC(C)(C)C)C1 2172558116 VJZQYFUMYNHAED-INIZCTEOSA-N 439.394 4.595 50 10 IJGE CC[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1N(C)CCCCCI 2211184366 CXMBCAOMRAVNKL-CVEARBPZSA-N 438.394 4.559 50 10 IJGE Cc1ccc(NC(=O)[C@H](Br)C2CCCC2)cc1CNC(=O)OC(C)(C)C 2231338333 IVVZZLGRIMCJMS-QGZVFWFLSA-N 425.367 4.912 50 10 IJGE CCC[C@H]1CN(C(=O)OC(C)(C)C)CCN1C[C@H](CBr)c1ccccc1 2231938882 CSUBDXGYCVEYCY-OALUTQOASA-N 425.411 4.887 50 10 IJGE Cc1ccccc1[C@H](CBr)OCCOCCOCCOCc1ccccc1 2236089341 QKLWPITXAFUSQE-QFIPXVFZSA-N 437.374 4.698 50 10 IJGE Cc1cc(Cl)c(Cl)cc1C[C@H](Br)CN1C(=O)c2ccccc2C1=O 2241616511 KEZXVXPLESMUAU-LBPRGKRZSA-N 427.125 4.904 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2CC23CCOCC3)cc1I 2269540737 HFFIXRUVMIOMLI-BXUZGUMPSA-N 437.115 4.553 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CC3(CCC3)CO2)cc1I 2269557241 SXAALVYGLMQUFS-KBPBESRZSA-N 437.115 4.695 50 10 IJGE C[C@@H]1CC[C@@H](CBr)CN1C(=O)c1cc(Br)c(F)cc1Cl 2285844636 PJVPIRAODZHHAI-BDAKNGLRSA-N 427.539 4.877 50 10 IJGE Cc1ccc(CSc2nnc(SCC(=O)NN=CC=Cc3ccco3)s2)cc1 2293704421 ZXQBTTUEWHMECD-UHFFFAOYSA-N 430.580 4.639 50 10 IJGE C[C@@H]1C[C@H](CBr)CN1Cc1ccc(Cl)c(I)c1 2300239998 GSHMPFZTHBTPSU-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE CO[C@@H]1C[C@@H](Cl)C[C@@H]1Cc1ccc(I)c(Br)c1 2306199759 PPFCXQBDAFPXJS-OUJBWJOFSA-N 429.523 4.629 50 10 IJGE C[C@H]1CN(Cc2cc(I)ccc2Cl)CC[C@H]1Br 2307335024 XZQCJFPHIZSFEA-JOYOIKCWSA-N 428.539 4.550 50 10 IJGE Cc1cc(C=C(C#N)C(=O)NCc2ccccc2)c(C)n1-c1ccc(C(=O)O)c(Cl)c1 2313546049 YZJLQGUINXEYOK-UHFFFAOYSA-N 433.895 4.669 50 10 IJGE CC(C)[C@@H]1C[C@@H](Br)CN1Cc1ccc(I)c(Cl)c1 2321367407 DMBRTMZCTWZEEY-RISCZKNCSA-N 442.566 4.938 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2328527843 MLRAEQSTVMHVHY-KGLIPLIRSA-N 431.337 4.527 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@@H]2CC[C@H](Br)[C@H]1C2 2330967810 ZWWURSYFBDMXMT-OYNCUSHFSA-N 427.589 4.942 50 10 IJGE CSCC[C@H](C(O)=C(C#N)c1nc(C(C)(C)C)cs1)N1C(=O)c2ccccc2C1=O 2331308341 UDYZCHJAUGRWBX-MRXNPFEDSA-N 441.578 4.651 50 10 IJGE CO[C@H](COC1(CBr)CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1 2336256071 MTVDVUGITNSZEB-QGZVFWFLSA-N 428.367 4.555 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@@H]3CCN(Cc4ccccc4)[C@H]3C2)c1 2340266723 BFLXZTXDMBTXGF-KKSFZXQISA-N 435.793 4.954 50 10 IJGE O=C(Nc1ccc(CBr)c(F)c1)c1ccccc1I 2341937600 MQKLYEHVYBZKSP-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE Cc1nc(C(=O)Nc2cc(F)c(CBr)cc2F)c(Br)s1 2368909325 KVJXQEJSZDOPNL-UHFFFAOYSA-N 426.080 4.639 50 10 IJGE CC1CCN(C(=O)/C(C#N)=C/c2cn(-c3ccccc3)nc2-c2cccc([N+](=O)[O-])c2)CC1 1452595 FBOANOUDXVJAGU-XSFVSMFZSA-N 441.491 4.613 50 10 IJGE O=C(NN=Cc1cccc(OCc2ccc(Cl)c(Cl)c2)c1)c1cc(O)ccc1O 13321332 AMLHWELMUNNGIQ-UHFFFAOYSA-N 431.275 4.748 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4C)ccc32)cc1 38685602 ODCBZHVBBBKRNW-DEOSSOPVSA-N 426.472 4.831 50 10 IJGE COc1ccccc1/C=C(\C#N)C(=O)N(c1ccc(C)cc1)S(=O)(=O)c1ccc(C)cc1 40977759 NQZDTJVYNCGBAQ-LTGZKZEYSA-N 446.528 4.641 50 10 IJGE COc1cccc(NC(=O)/C(C#N)=C\c2ccc(OCc3ccc(C(=O)O)cc3)cc2)c1 96476253 VBMIEEAWYCFKNP-MOSHPQCFSA-N 428.444 4.518 50 10 IJGE COc1ccc([C@@H](Br)c2ccc(I)cc2)cc1OC 109840063 KBHXPMHIRVYFBN-HNNXBMFYSA-N 433.083 4.793 50 10 IJGE COc1cc([C@H](C)[C@H](Br)C(C)=O)c(Br)cc1Br 234800492 GGFFTIGDJMAKSZ-QTTZVWFDSA-N 428.946 4.676 50 10 IJGE CC(=O)c1cccc(N2Cc3ccccc3C2=NC(=O)/C(C#N)=C\c2ccc3c(c2)OCO3)c1 254440592 BNBOOSJKKXCBFD-JMKWSEBXSA-N 449.466 4.518 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3ccccc3O)n2C2CCCCC2)cc1 254508419 KYOYBEJIHHTUBT-UHFFFAOYSA-N 449.580 4.707 50 10 IJGE C[C@@H]1[C@H]2CC[C@@H](C[C@]13CC[C@@](C)(CI)O3)N2C(=O)OC(C)(C)C 686235678 GEGHBTACZRFXIW-NFBPQSOOSA-N 435.346 4.537 50 10 IJGE ClCCc1nc2cccc(Br)c2n1Cc1ccn(Cc2ccccc2)n1 697702992 MMXJOQKNXHZTNB-UHFFFAOYSA-N 429.749 4.873 50 10 IJGE C[C@H](CCCCCl)NC(=O)c1ccc(I)c(Br)c1 721616483 URNFDCQDOXCXCO-SECBINFHSA-N 444.538 4.581 50 10 IJGE C[C@@H](NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1ccccc1Oc1ccccc1 725874791 IZQOOFBOVGVGHE-QGZVFWFLSA-N 428.492 4.676 50 10 IJGE CC(C)(C)OC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2nc3ccccc3nc2Cl)cc1 764889167 WZAQIPAVYOZFNM-FOWTUZBSSA-N 434.883 4.784 50 10 IJGE CCc1cccc(C)c1NC(=S)NNC(=O)c1cccc(-n2nc(C)c(CC)c2C)c1 766556415 UYHGQRXFDMTBDW-UHFFFAOYSA-N 435.597 4.554 50 10 IJGE CC(=O)N(c1nc(/C=C/C(=O)Oc2ccc([N+](=O)[O-])c(C)c2)cs1)c1ccccc1F 1086866708 DXIXZOIZJQNUSL-JXMROGBWSA-N 441.440 4.802 50 10 IJGE CC(=O)N(C)c1ccc(CNS(=O)(=O)c2cccc(S(F)(F)(F)(F)F)c2)cc1 1192653696 YWBUDHNQLMBSHE-UHFFFAOYSA-N 444.447 4.805 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2cccc(Cl)c2)[C@@H]1c1ccccn1 1865699922 GPYJXDUYUBVQFG-FQEVSTJZSA-N 425.879 4.806 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 1880762979 ZZPUHVIUKCZAAS-KBPBESRZSA-N 435.403 4.558 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H](CCC(=O)NCC1CC(Br)C1)C(C)(C)C 1887795113 XLCMQLSYKMWMEA-PCKAHOCUSA-N 433.431 4.633 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CCl)Cc1ccc(Cl)cc1I 1892995663 RRZDXPUZKBHUCL-LLVKDONJSA-N 430.113 4.619 50 10 IJGE C[C@H](Br)[C@H]1CCN(Cc2c(Br)cccc2Br)C1 1945329813 PDLWXLWDPOPOEE-UWVGGRQHSA-N 425.990 4.817 50 10 IJGE CCN(C[C@@](C)(CI)O[C@H]1CCCC12CC2)C(=O)OC(C)(C)C 1986117872 CLMBGZCKBIMQFE-WMLDXEAASA-N 437.362 4.786 50 10 IJGE CC[C@H](C)[C@@H](Br)CNC(=O)c1c(Br)cccc1Br 2033090827 JTPDQFZMZUPLEQ-KWQFWETISA-N 441.989 4.751 50 10 IJGE COc1ccc(Br)cc1CN[C@@H](C)CCCCCI 2117884195 FHDMWHJKESAGKZ-LBPRGKRZSA-N 440.163 4.931 50 10 IJGE O=C(N[C@H](CCl)c1ccsc1)c1ccc(I)c(Cl)c1 2119041009 XFMGZEHIPKOEJN-GFCCVEGCSA-N 426.106 4.716 50 10 IJGE C[C@H]1C[C@@H](C(F)(F)F)N(CC2(CBr)CCC2)CCN1C(=O)OC(C)(C)C 2121770469 HVFHNMSYOTWRAX-KBPBESRZSA-N 443.348 4.814 50 10 IJGE COc1cc(Cl)c([C@H](Br)c2cnc(Cl)n2C)cc1Br 2137644762 GBOVWZRVAWGPAM-NSHDSACASA-N 428.939 4.982 50 10 IJGE COCCCCN(Cc1ccccc1)S(=O)(=O)c1cc(F)c(Cl)c(CCl)c1 2152211371 LJLQQAHOADCDTC-UHFFFAOYSA-N 434.360 4.835 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2Cc1ccn(Cc2ccccc2)n1 2153120281 QOIPCCROIZIILT-UHFFFAOYSA-N 444.764 4.577 50 10 IJGE C[C@H]1OC2(C)CC1([C@@H](Br)c1cc(I)cc3c1OCC3)C2 2156697108 BIZGIMMDWALZIY-FEOKSLRTSA-N 449.126 4.620 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CCN(C[C@H](CBr)c3ccccc3)C2)C1 2163061717 HSTNLNNSLWXTQV-UGKGYDQZSA-N 437.422 4.888 50 10 IJGE CCCC(CBr)(CCC)CN1CC(C)(C)OC[C@@H]1CNC(=O)OC(C)(C)C 2194647571 CICJSVWCDDRFHQ-KRWDZBQOSA-N 449.474 4.972 50 10 IJGE ICCCCCN1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1 2211184362 CWXIYDCRBCBHLT-PMACEKPBSA-N 426.386 4.578 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1C[C@H]2CC[C@H]1C2)C(=O)OC(C)(C)C 2212690722 OGTHHNSKLDEBPI-AFIMGQEJSA-N 437.362 4.642 50 10 IJGE CCN[C@H](c1cc(Br)c(Br)cc1F)[C@H]1C[C@H]1Br 2213489380 LHNJTMBAEFZNFK-ZQWFHOFHSA-N 429.953 4.785 50 10 IJGE O=[N+]([O-])c1cc(N2[C@H]3CCC[C@@H]2CN(Cc2ccccc2)C3)ccc1CBr 2234689838 MDBMSIUBBXVBGG-BGYRXZFFSA-N 430.346 4.733 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@H]2CCCC23CCC3)CC1 2250320583 XSMBYFOGRWNPPX-HNNXBMFYSA-N 449.373 4.931 50 10 IJGE C[C@@]1(CBr)CCCN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285843786 DMPHKEMGCCAAHV-AWEZNQCLSA-N 427.539 4.879 50 10 IJGE O=S1(=O)CC[C@@H]1[C@@H](Br)c1c(F)cc(Cl)c(Br)c1Cl 2313742360 FYTNEYZMMATPDR-HZGVNTEJSA-N 440.943 4.518 50 10 IJGE COc1ccc(-c2ccc(C(=O)NN=Cc3ccccc3C(F)(F)F)c(C)n2)cc1OC 2321248497 HCOXHKSCEANXII-UHFFFAOYSA-N 443.425 4.857 50 10 IJGE CC[C@@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)c1ccccc1Br 10683798 QSYJMEYGESNHLV-RDTXWAMCSA-N 433.346 4.581 50 10 IJGE CCC(=O)Nc1ccc(C(=O)NNC(=O)N2c3ccccc3Sc3ccccc32)cc1 13988829 ITLRGDRKWJFDQV-UHFFFAOYSA-N 432.505 4.692 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)COc2ccccc2[C@H](C)CC)cc1 14025344 UTMLLBSXUWBPGJ-LJQANCHMSA-N 426.557 4.999 50 10 IJGE N#C/C(=C/c1cccc(OC(=O)CN2C(=O)c3ccccc3C2=O)c1)c1ccc(Cl)cc1 31903029 JKTZIKFYGGFLOO-PDGQHHTCSA-N 442.858 4.606 50 10 IJGE CSC[C@H](C)Cn1c(CCCl)nc2cc(I)c(F)cc21 97409283 CORNDTQCHROCTD-SECBINFHSA-N 426.726 4.560 50 10 IJGE N#C/C(=C/Nc1ccccc1C(N)=O)c1nc(-c2cccc(Br)c2)cs1 102415549 OYCKGRFBZRDORA-RAXLEYEMSA-N 425.311 4.648 50 10 IJGE Cc1cnc([C@H](C)n2c(CCCl)nc3cc(I)ccc32)s1 125300342 UHIFOGYZRCKWFD-JTQLQIEISA-N 431.730 4.796 50 10 IJGE CC[C@@H](CCBr)NC(=O)c1cc(Br)ccc1Br 161241317 VWUQHHRGPADHNQ-VIFPVBQESA-N 427.962 4.505 50 10 IJGE COc1cc(/C=N/NC(=O)c2cc3ccccc3n2C)cc(OC)c1OCc1ccccc1 169925959 ZHIXRRVKTCTOCG-JVWAILMASA-N 443.503 4.538 50 10 IJGE COc1ccc(N/C=C(/C#N)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c(OC)c1 217249916 GUUGKGHUGUVKOP-KHPPLWFESA-N 425.794 4.834 50 10 IJGE CC[C@@H](Br)c1nnc(-c2cc(Cl)ccc2I)o1 233824224 QJOYDQNUFFEBRD-MRVPVSSYSA-N 427.467 4.841 50 10 IJGE O=C(NN=C(CCc1ccccc1)CCc1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 253560977 BMXSCRDATRBJOV-UHFFFAOYSA-N 446.463 4.854 50 10 IJGE Br[C@H](Cc1ccccc1)c1cc(I)cc2c1OCC2 306070746 WGBUGNHZCFCOGZ-OAHLLOKOSA-N 429.095 4.905 50 10 IJGE O=C(NC[C@H](Br)C1CCC1)c1cc(Br)sc1Br 316364415 UFBABTTVMCEIND-QMMMGPOBSA-N 446.002 4.567 50 10 IJGE COC[C@@H]1C[C@H](Br)[C@@H](Cc2cc(Cl)ccc2I)C1 698765339 JCGBFZJVSQVXPD-CWSCBRNRSA-N 443.550 4.923 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H]1Cn1c(CCl)nc2cc(Br)cnc21 708510692 UVRWHLIDYKJWRK-HOCLYGCPSA-N 433.781 4.701 50 10 IJGE CC[C@@H](C[C@H](C)Br)NC(=O)c1cc(Br)sc1Br 716854914 KSRUUOYQWVVOLG-BQBZGAKWSA-N 448.018 4.955 50 10 IJGE C[C@H]1CO[C@@](CBr)(Cc2cc(Cl)ccc2I)C1 718538988 YHUFWNMBDPHNGA-NOZJJQNGSA-N 429.523 4.677 50 10 IJGE Cc1nc([C@@H]2CCCCN2C(=O)/C(C#N)=C/c2cc(C)n(-c3ccccc3F)c2C)no1 737614946 HHUXHXBHIBDAME-JJEHFPDLSA-N 433.487 4.585 50 10 IJGE CCc1ncsc1NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 747233174 IBJBAKQSDZSAHU-GDNBJRDFSA-N 436.928 4.682 50 10 IJGE O=C(CCCCl)Nc1ccc(N2CCN(C(=O)/C=C/c3ccccc3)CC2)c(Cl)c1 953055524 XOHNEVMFFGBPNI-DHZHZOJOSA-N 446.378 4.660 50 10 IJGE COc1cc(C)ccc1C(=O)NN=Cc1c(Br)c(C)n(-c2ccccc2)c1C 1084421001 OBWJHGYBWVCTOM-UHFFFAOYSA-N 440.341 4.938 50 10 IJGE C=CCCN(OCc1ccccc1)C(=O)/C(C#N)=C/c1cc(C)n(C[C@H]2CCCO2)c1C 1634163765 ODIYBJGEUOSNSB-NPWCAHBGSA-N 433.552 4.727 50 10 IJGE CCN(C(=O)c1oc2c(c1C)C(=NNC(=O)c1cccc(OC)c1)CCC2)c1ccccc1 1772747749 QLTUMFGTHYRTOV-UHFFFAOYSA-N 445.519 4.734 50 10 IJGE CCOc1ccc(Br)cc1C=NNC(=O)COc1ccc(C(C)C)c(C)c1 1772753683 BOYBOMNUUFEKIA-UHFFFAOYSA-N 433.346 4.809 50 10 IJGE CCCCOc1ccc(C=NNC(=O)COc2ccc(Cl)cc2Cl)cc1OC 1772754825 XIPUIYKDNLTBJK-UHFFFAOYSA-N 425.312 4.710 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2c(F)cccc2Cl)[C@H]1c1ccccc1 1865680716 UAAZCQYVFFVVQD-INIZCTEOSA-N 448.807 4.961 50 10 IJGE CCc1nn(-c2ccc(OC)cc2)c2c1[C@@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865701901 HOQLOPDSULYKIX-QHCPKHFHSA-N 443.551 4.508 50 10 IJGE C[C@@H](CCBr)CCN(OCc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 1881877777 ATLDKXOUYDUHFJ-KRWDZBQOSA-N 441.410 4.851 50 10 IJGE O=C(c1ccc(C(F)(F)F)cn1)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915311730 HIAVKEIJFNQSGA-QGZVFWFLSA-N 427.264 4.916 50 10 IJGE CC(C)(C)OC(=O)NC1CCC([C@]2(C)CC[C@](C)(CI)O2)CC1 1936000429 WAQQOMDDQRBYFY-PCHAPFSGSA-N 437.362 4.833 50 10 IJGE Brc1cccc(Br)c1C[C@H](Br)CN1CCCC1 1949866272 IXFJGOBSGCKLPE-JTQLQIEISA-N 425.990 4.613 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@](C)(CI)O2)C[C@H]1C1CC1 1990240813 MCQSNYUQGYIWMC-BMGDILEWSA-N 435.346 4.539 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)Cc1cccc(Cl)c1C(F)(F)F 1994843317 YEHLGDMGKDSQRB-NSHDSACASA-N 446.650 4.961 50 10 IJGE BrC[C@@H]1[C@@H]2CCN(Cc3c(Br)cccc3Br)C[C@@H]12 2033087885 XVDPSXGEYARWJJ-HBNTYKKESA-N 438.001 4.674 50 10 IJGE O=C(NC[C@@H]1CCC[C@H]1Br)c1c(Br)cccc1Br 2033094260 NPFIZTUVWUXGSO-DTWKUNHWSA-N 439.973 4.505 50 10 IJGE BrC[C@@]12CC[C@@H](CN1Cc1c(Br)cccc1Br)C2 2033096997 WAWOEUAOLUXRBM-YGRLFVJLSA-N 438.001 4.961 50 10 IJGE C[C@@H]1CCO[C@@H]1COc1c(Br)cc(CBr)cc1Br 2034998021 ZYLONPISRDVGHN-PRHODGIISA-N 442.973 4.910 50 10 IJGE CCC(=O)[C@H](Br)Cc1ccc(C(F)(F)F)cc1I 2083650869 XBXPXIVSBGCOSR-SECBINFHSA-N 435.021 4.595 50 10 IJGE CN(Cc1ccc(NC(=O)OC(C)(C)C)cc1)CC1(CBr)CCOCC1 2106786926 WJPAHGZUKFZBEW-UHFFFAOYSA-N 427.383 4.657 50 10 IJGE O=C(c1scc(Br)c1Br)N1[C@H](CCl)C[C@@H]2CCC[C@@H]21 2108395234 VYDJWGORGYUBEX-NRPADANISA-N 427.589 4.895 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1ccccc1OC(F)(F)F 2181748762 XBXIZJWMBKLDBS-UHFFFAOYSA-N 426.526 4.581 50 10 IJGE COc1cc(Cl)c([C@H](Br)[C@H]2OCCOC2(C)C)cc1Br 2202353971 SRGDNGBLVJQJFQ-QWHCGFSZSA-N 428.548 4.741 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@@H]2CCC2(C)C)CC1 2243132806 XRAVOPKNKLOYFW-AWEZNQCLSA-N 437.362 4.644 50 10 IJGE C[C@H](CCBr)CCN1CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2255000221 AKTHADSPCJDKQO-MCIONIFRSA-N 431.337 4.718 50 10 IJGE COc1ccc([C@@H](Br)[C@@]2(C)CCCCO2)cc1I 2257364853 MBRBOBUCGHDPBH-ZIAGYGMSSA-N 425.104 4.695 50 10 IJGE CC1CC(CBr)(CN2C[C@H](c3ccccc3)[C@@H](NC(=O)OC(C)(C)C)C2)C1 2280056939 MNCFSFKXDNDFDK-KWUMJBAFSA-N 437.422 4.790 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCC12CC(CBr)C2 2285959912 RWCIXQDMIAXFIM-UHFFFAOYSA-N 425.523 4.631 50 10 IJGE CCOC(=O)C(C#N)=Cc1c(Oc2ccc(Cl)cc2Cl)nc2c(C)cccn2c1=O 2296720855 DZASQUBWQQBHIF-UHFFFAOYSA-N 444.274 4.572 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccccc2C)ccc1OCc1cccc(C(=O)O)c1 2313562479 SWPMJCDQUQMDOX-UHFFFAOYSA-N 442.471 4.827 50 10 IJGE O=C(Cc1cccc2ccccc12)NN=C1C(=O)N(CC=Cc2ccccc2)c2ccccc21 2313649555 BLATVEQBPIWGLY-UHFFFAOYSA-N 445.522 4.963 50 10 IJGE COc1cc(C=C(C#N)c2ccc(Cl)cc2)ccc1OC(=O)CNC(=O)c1ccccc1 2320506884 UDHWXBGCZPGPBR-UHFFFAOYSA-N 446.890 4.748 50 10 IJGE CC(C)[C@H]1C[C@H](Br)CN1Cc1ccc(I)c(Cl)c1 2321367408 DMBRTMZCTWZEEY-SMDDNHRTSA-N 442.566 4.938 50 10 IJGE CC(C)COc1ccc(C=NNC(=O)c2ccc3nc(Cc4ccccc4)[nH]c3c2)cc1 2323723805 FGMJGKVOPSZKBF-UHFFFAOYSA-N 426.520 4.952 50 10 IJGE C[C@@H]1CN(Cc2cc(I)ccc2Cl)[C@H](C)C[C@@H]1Br 2327404738 KJQTTWXXKLHBPM-BREBYQMCSA-N 442.566 4.938 50 10 IJGE Cc1cnccc1CO[C@@H](CI)c1cccc(Br)c1 2340137388 FJVWUKPEGIREIQ-HNNXBMFYSA-N 432.099 4.845 50 10 IJGE CC1(C)CC(CBr)(CN2CCC3(CC2)CCN(C(=O)OC(C)(C)C)C3)C1 2345011760 VVJLZFBJKVQTRE-UHFFFAOYSA-N 429.443 4.911 50 10 IJGE O=C(c1scc(Br)c1Cl)N(CCCBr)C1CCOCC1 2381023080 IJVIVSFNMRMYKR-UHFFFAOYSA-N 445.604 4.570 50 10 IJGE Cc1ccc(-c2nn(-c3ccccc3)cc2/C=N/NC(=O)c2c(C)nc3cc(C)ccn23)cc1 1036517 WTJJZBGMMRUVKF-LQKURTRISA-N 448.530 4.876 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)C(c1ccccc1)c1ccccc1 9872019 PANFEYSVUJELBP-VQTJNVASSA-N 430.548 4.947 50 10 IJGE COc1cc(/C=C(\C#N)c2nc(N)nc(Nc3ccccc3)n2)ccc1OCCC(C)C 11296549 XCSIMLAITHYBMT-QGOAFFKASA-N 430.512 4.695 50 10 IJGE CCSc1ccc(Cl)cc1CC(=O)N/N=C\c1cc(Br)ccc1O 169922284 VABGSWVEZOBJPV-JMIUGGIZSA-N 427.751 4.613 50 10 IJGE O=C(N[C@H]1CCC[C@@H]1CBr)c1cc(Br)ccc1Br 231580507 VISUFGCJKICHGV-PELKAZGASA-N 439.973 4.505 50 10 IJGE COCCOCCCC(CBr)(CBr)c1ccccc1Cl 234750125 JRYJXWXZSMENIJ-UHFFFAOYSA-N 428.592 4.811 50 10 IJGE Fc1ccc([C@@H](Br)c2ccc3c(c2)COC3)c(I)c1 236184691 SBZYTXFLSLNKND-HNNXBMFYSA-N 433.058 4.945 50 10 IJGE CC1=C(C(=O)c2ccccc2)C(c2cccc(Br)c2)=C(C#N)C(=C(C#N)C#N)N1 257540594 ZMRLDZQHORUSFK-UHFFFAOYSA-N 441.288 4.788 50 10 IJGE ClCc1c(I)sc2c(I)cccc12 307192463 CPQVKHRDBKLIJS-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE ClCc1cc(I)c2cc(I)sc2c1 307288318 BKTNNLFGJNYSBC-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE Brc1cc(Br)cc([C@@H]2CC[C@@H](CI)O2)c1 307601034 UFHIKHJTQVNFOD-QWRGUYRKSA-N 445.920 4.867 50 10 IJGE COc1ccc(Br)cc1[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CBr 394786969 PGARRXNQJLZMDY-BXUZGUMPSA-N 449.183 4.803 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CCC(F)(F)[C@H](CCl)C1 404025517 RGEVIMRQYKMRFQ-MRVPVSSYSA-N 431.502 4.548 50 10 IJGE COc1ccc(OC[C@@H](CBr)C(C)(C)C)cc1I 712906111 SHRDAJDGSQQJSC-SNVBAGLBSA-N 427.120 4.736 50 10 IJGE O=C(NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1)c1ccc(-c2ccccc2)o1 753434923 PHJZJCDWWRKWSR-UHFFFAOYSA-N 433.489 4.504 50 10 IJGE COc1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1OCC(F)(F)F 799385271 VZPCPIKTTIQRKB-UHFFFAOYSA-N 448.323 4.675 50 10 IJGE CCCc1c(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cnn1-c1ccc(C)cc1 799748372 OZWDWRLMCUUIKK-UHFFFAOYSA-N 427.430 4.781 50 10 IJGE C=CCC1(C(=O)NNC(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)CCCC1 1472483131 DEKCPPVURODYPT-UHFFFAOYSA-N 434.565 4.753 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@H]2c1ccc(Br)cc1 1865714124 DEMLRQPQDKZJHW-GOSISDBHSA-N 435.325 4.941 50 10 IJGE CC[C@@](C)(NC(=O)CCCC(=O)c1cccs1)C(=O)Nc1ccc(SC#N)cc1 1866792543 MGYFXYJEMWIMHN-OAQYLSRUSA-N 429.567 4.598 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCN(Cc2ccccc2)CC12CCC2 1882089159 XQBQRENXRXFAPO-OALUTQOASA-N 437.422 4.967 50 10 IJGE Cc1nc(Br)c([C@@H](Br)c2sccc2Br)n1C 1900420783 GIEAIIKOTAVGNE-SSDOTTSWSA-N 428.975 4.799 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)C(=O)c1ccc(Br)c(O)c1 1914230221 VIMRGFNWTVWKEQ-GFCCVEGCSA-N 427.136 4.581 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1cc(OC)c(OC)cc1OC 1915098335 FXYPTKMZTDHONJ-MRXNPFEDSA-N 436.346 4.528 50 10 IJGE CCOc1c(C(=O)N(Cc2ccccc2)C(C)(C)CBr)cccc1[N+](=O)[O-] 1915765076 CDFIHGNOXZYMRO-UHFFFAOYSA-N 435.318 4.809 50 10 IJGE CC(C)(C)OC(=O)NC1CCC([C@@]2(C)CCC[C@@H](CI)O2)CC1 1935996594 BAOHDOCTKBLTHA-ZUBZBLCWSA-N 437.362 4.833 50 10 IJGE O=C(N[C@H](CBr)C1CCC1)c1csc(Br)c1Br 1945183595 JFMVJUMGLLBNBL-MRVPVSSYSA-N 446.002 4.567 50 10 IJGE CCN(C)C[C@@H](Br)CCc1ccc(Br)cc1Br 1949931676 SWUDSZYVSSZCQG-LBPRGKRZSA-N 428.006 4.859 50 10 IJGE FC1(F)[C@H]2C[C@](CBr)(Cc3ccc(I)cc3)C[C@H]21 2045498581 LZTIFUOPAIUMHT-ITGUQSILSA-N 427.070 4.890 50 10 IJGE CC1(C)C[C@H](O[C@@H](CI)c2cccc(Br)c2)CO1 2052239726 HTRJEFGOMDLOKB-STQMWFEESA-N 425.104 4.509 50 10 IJGE CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(OC)c(CBr)c1 2059312648 NVXVXPYNGNHWJL-OAHLLOKOSA-N 426.376 4.580 50 10 IJGE Cc1ccc(O)c(Cn2nc(CBr)c(Br)c2C(F)(F)F)c1 2079233290 RRLPYGPNYGIIMR-UHFFFAOYSA-N 428.046 4.622 50 10 IJGE O=S(=O)(c1cc(CBr)n(C2CC2)c1)N(Cc1ccccc1)C1CCCC1 2123267978 BQIXBKBYOILMJY-UHFFFAOYSA-N 437.403 4.851 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@]2(F)CCC[C@]2(CCl)C1 2176642005 WYSPWLGDTPJHNK-QWHCGFSZSA-N 445.579 4.846 50 10 IJGE C[C@H](CCC1CC1)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2179788643 FTBCINMZAROIOU-SECBINFHSA-N 445.242 4.605 50 10 IJGE Cc1c(Cl)cc(CN2CC[C@H](OCCCBr)C2)cc1Br 2207038544 NZRUKKKQJCQYHV-ZDUSSCGKSA-N 425.592 4.787 50 10 IJGE COC[C@@H](Cl)Cc1sc(Br)c(Br)c1Br 2209974778 AKDGWPZHDLBFSR-BYPYZUCNSA-N 427.383 4.832 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CCCCCI)C2(CCCC2)C1 2211186175 VTWDUKYNIARPIH-OAHLLOKOSA-N 436.378 4.504 50 10 IJGE Cc1c([C@@H](Cl)c2c(F)cc(F)c(Br)c2F)c(Br)nn1C 2236109180 MCPACJWJUWEXMW-SNVBAGLBSA-N 432.465 4.999 50 10 IJGE COc1ccc(CBr)c(N(C)[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)n1 2239881417 CVUMIAPOELUUPC-PMOLBWCYSA-N 430.390 4.617 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC[C@@H]2CCC23CCC3)C1 2247331179 ZXAZVBSVAWNOCY-KXBFYZLASA-N 449.373 4.788 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(CC2(CBr)CCCC2)[C@H](C(F)(F)F)C1 2266311128 XCEBAJJPROLSPE-KGLIPLIRSA-N 443.348 4.862 50 10 IJGE C[C@H](CBr)CC1CN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282971333 AWDPBPCNAJUXSO-QMMMGPOBSA-N 427.539 4.735 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)C=Cc1ccc(F)cc1 2321143266 TXTMUJWEBUYUFG-UHFFFAOYSA-N 444.293 4.977 50 10 IJGE CCSc1ccc(Cl)cc1CC(=O)NN=Cc1cc(Cl)c(OC)c(OC)c1 2323679995 WSRNVJDUJTUXHI-UHFFFAOYSA-N 427.353 4.815 50 10 IJGE Cc1ccc(S(=O)(=O)NCC(O)=C(C#N)c2nc(-c3ccccc3Cl)cs2)cc1 2331273336 BRJCYLBOUPFDKX-UHFFFAOYSA-N 445.953 4.543 50 10 IJGE CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(NC(=O)C3CCCCC3)cc2)c(O)c1 12487434 RPXHCIADUNRZGT-YZSQISJMSA-N 436.556 4.521 50 10 IJGE CC[C@@H](C)NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(Cl)cc1Cl)CCC2 40813651 WULWUAKWNZTRTC-BDFCVOJHSA-N 436.339 4.894 50 10 IJGE COc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4cccc(C)c4C)c(C)c32)cc1 40813792 KHXUPHBJDJRXDV-SGWCAAJKSA-N 445.519 4.936 50 10 IJGE CCCOc1ccccc1/C=C(\C#N)C(=O)Nc1cc(OC)c(C(=O)OCC)cc1Cl 41018272 NOXZJTRGOOSDBE-LFIBNONCSA-N 442.899 4.860 50 10 IJGE O=C([C@H](Br)Cc1ccccc1Cl)N1CCN(c2cccc(Cl)c2)CC1 96574345 RCWLXFIXYZPAGN-QGZVFWFLSA-N 442.184 4.648 50 10 IJGE CCCCCCCOc1ccc(/C=C2/C(=O)N(C[C@H]3CCCO3)C(=O)C(C#N)=C2C)cc1 101337285 AFNGADLKZWDVLB-PXJFTPKESA-N 436.552 4.807 50 10 IJGE Fc1ccc(-n2c(CCCl)nc3cc(Cl)cnc32)c(I)c1 149360791 WYXRLIPNDCNDDO-UHFFFAOYSA-N 436.055 4.599 50 10 IJGE CCCCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C(/C#N)C(=O)OC)cc2OC)cc1 206272507 GRRJRDJHMBRNNS-FNQMJYDXSA-N 435.476 4.573 50 10 IJGE O=C(COc1ccc(Cl)cc1)NN=Cc1cn(-c2ccccc2)nc1-c1ccccc1 252625338 QHQTVRABQOPJAV-UHFFFAOYSA-N 430.895 4.722 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=NNC(=O)CSc3nc4ccccc4o3)o2)cc1 254741439 SFFLCGAJMSWYFX-UHFFFAOYSA-N 449.488 4.507 50 10 IJGE Cc1cc(Cl)c([C@@H](Br)c2cnn(C)c2I)cc1C 379219106 RVBMCUDQKZNQAK-GFCCVEGCSA-N 439.522 4.779 50 10 IJGE CC(C)[C@H](CBr)CNC(=O)c1scc(Br)c1Br 705438907 MBCCJWFCWMTAEH-SSDOTTSWSA-N 448.018 4.670 50 10 IJGE Fc1ccc(Br)c(F)c1CNC1(CCBr)CCSCC1 719692949 CRIFXNVMYWBQRF-UHFFFAOYSA-N 429.168 4.868 50 10 IJGE CC[C@H](Cl)[C@@H](CC)NC(=O)c1ccc(I)c(Br)c1 721601172 FIVGPDPOXKIYHJ-CMPLNLGQSA-N 444.538 4.580 50 10 IJGE Cc1ccc(NC(=O)NNC(=O)NCc2ccc(COc3ccccc3)cc2)c(Cl)c1 743535038 CRDIELDPCSCBAA-UHFFFAOYSA-N 438.915 4.763 50 10 IJGE COc1cc(/C=C\C(=O)Cl)cc(I)c1OCc1ccccc1F 1081475937 SRXGCEBELYLJNW-SREVYHEPSA-N 446.643 4.797 50 10 IJGE C=C(C)[C@H](NC(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1)c1ccc(F)c(F)c1 1680280756 PTPJTTDKYXMYEI-NYHFZMIOSA-N 439.462 4.533 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@@H]2C)oc2c1C(=NNC(=O)Cc1ccccc1)CCC2 1772747576 DGVNGPQEJHHBDB-KRWDZBQOSA-N 441.531 4.579 50 10 IJGE Cc1ccc(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2ccccc2F)cc1 1865684328 WPBSJDTWXSNSBT-KRWDZBQOSA-N 428.389 4.616 50 10 IJGE CCCc1nn(Cc2ccc(C)cc2)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699143 LYZSXEGHXHPLOE-XMMPIXPASA-N 437.547 4.902 50 10 IJGE Cc1nn(C)c2c1[C@@H](c1ccc(OCc3ccc(Cl)cc3Cl)cc1)C(C#N)=C(N)O2 1865700892 HDVHOXYBKPZYCM-FQEVSTJZSA-N 441.318 4.833 50 10 IJGE CC(C)Cn1nc(C(F)(F)F)c2c1OC(N)=C(C#N)[C@H]2c1ccc(Br)cc1 1865714326 HIHLNSQOIJRBDN-CYBMUJFWSA-N 441.251 4.539 50 10 IJGE CC1CC(CCl)(CNc2ncc(I)cc2Br)C1 2015766281 JLQJPFWTNDCDNW-UHFFFAOYSA-N 429.527 4.516 50 10 IJGE CC[C@H](C)[C@H](Br)CNC(=O)c1c(Br)cccc1Br 2033090825 JTPDQFZMZUPLEQ-GZMMTYOYSA-N 441.989 4.751 50 10 IJGE Cn1nc(COc2cc(Cl)ccc2CBr)c(Br)c1Cl 2096682962 HBFUCKIKXAIDGV-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE C[C@@H]1CC[C@H](CNC(=O)C(F)(F)F)N(CC2(CBr)CCCCCC2)C1 2106783846 CZEUHANRWHKHQT-HUUCEWRRSA-N 427.349 4.501 50 10 IJGE O=C(c1ccc(Cl)cc1Br)N1CC[C@@H](CBr)C(F)(F)C1 2146374674 DAQZUEDSLFLBAU-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@H]1CN(Cc2ccccc2)C[C@H]1C 2153119540 HMAOYVOWVAZPCR-KUHUBIRLSA-N 447.808 4.977 50 10 IJGE O=C(c1cccc(Br)c1Cl)N1CCC([C@H](F)CBr)CC1 2163245693 MXOYELQHVPFDAC-GFCCVEGCSA-N 427.539 4.688 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)c2ccccc21 2196912917 BFOUODMDMMTSQO-BFYDXBDKSA-N 437.378 4.547 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 2196913156 CCAJYZDLZACCLV-BPQIPLTHSA-N 439.394 4.665 50 10 IJGE O=[N+]([O-])c1cc(N2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)ccc1CBr 2234718783 CBSLUYSADQFSLV-BGYRXZFFSA-N 430.346 4.733 50 10 IJGE C=CC[C@@]1(CBr)CCN(C(=O)c2scc(Br)c2Cl)C1 2272179417 NHGIMUPXAFXANN-ZDUSSCGKSA-N 427.589 4.967 50 10 IJGE Cn1nc(COc2c(Cl)cc(CBr)cc2Cl)cc1Br 2278798753 ZBRPRBREANFDFV-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE O=C(NC1(CCCl)CCSCC1)c1ccc(Cl)c(I)c1 2283663736 OGVLCULOOQKVKG-UHFFFAOYSA-N 444.165 4.569 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCc2ccco2)ccc1OCCOc1cc(C)cc(C)c1 2293689663 DSMZCWGLDMOGRQ-UHFFFAOYSA-N 446.503 4.586 50 10 IJGE N#CC(=Cc1cn(CCOc2ccc(F)cc2)c2ccccc12)C(=O)NCc1ccco1 2296762215 OJBKIWIGUUNOBS-UHFFFAOYSA-N 429.451 4.676 50 10 IJGE CN(Cc1ccc(Cl)cc1I)C1(CCBr)CC1 2302325476 HXUDXIYBSMBYPU-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE CC1(C)[C@H](Cl)C[C@H]1NCc1ccc(I)c(Br)c1 2306216934 LIGXDCGTZHIVFP-VXGBXAGGSA-N 428.539 4.549 50 10 IJGE C[C@@H](Br)CN(Cc1cc(I)ccc1Cl)C1CC1 2307329236 YDKXLPAQSLKIQT-SECBINFHSA-N 428.539 4.692 50 10 IJGE Clc1ccc(CN[C@@H](CBr)C2CCCC2)c(I)c1 2318558621 XFKVMTRWGWWYLO-AWEZNQCLSA-N 442.566 4.988 50 10 IJGE COCCOc1ccc(C=C(C#N)C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)cc1 2325118417 RIILPHZARSBXQG-UHFFFAOYSA-N 429.520 4.506 50 10 IJGE CC(C)(C)OC(=O)NCCC[C@H]1CCCCN1C[C@@]1(CBr)CC1(F)F 2326917279 NRJFLVQHIXNVCJ-PBHICJAKSA-N 425.358 4.566 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@]12CCC[C@H](CN(C[C@H](CBr)CC3CC3)C1)C2 2333679559 LCHGOPKACOOMCW-WFXMLNOXSA-N 429.443 4.909 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@H](C2)[C@@H]1CBr 2359285779 NZXGBMHDVCAZIF-UJVNDKKSSA-N 425.523 4.630 50 10 IJGE Cc1scc(C(=O)N2C[C@@]3(F)CCC[C@@]3(CBr)C2)c1Br 2369603288 KCKZWMIFAIJMIN-KGLIPLIRSA-N 425.161 4.548 50 10 IJGE COc1ccc2nc(N(/N=C/c3ccco3)C(=O)c3ccc([N+](=O)[O-])s3)sc2c1 9629106 KQLGPQUDMYRQQV-VXLYETTFSA-N 428.451 4.549 50 10 IJGE O=C1OC(=O)[C@H]2[C@H]1[C@H]1C[C@H]2[C@@H]2[C@@H](c3ccc(Cl)cc3)c3sc(=S)[nH]c3S[C@@H]12 101202033 TZTGJCWNBZDYHI-AOUWHDERSA-N 435.979 4.647 50 10 IJGE BrCCN(c1ncc(Br)cc1Br)C1CCCC1 129136142 GUINEVHZQYKATL-UHFFFAOYSA-N 426.978 4.751 50 10 IJGE O=C(N/N=C/c1ccccc1OCc1ccccc1)c1nn(-c2ccccc2)c2c1CCC2 169927728 ULPMBDZJNYPVOD-MTDXEUNCSA-N 436.515 4.704 50 10 IJGE N#C/C(=C/NCCc1ccc(Br)cc1)C(=O)Nc1ccccc1C(F)(F)F 217067740 DYSMSCIMOFHTDX-OWBHPGMISA-N 438.247 4.646 50 10 IJGE C[C@H](Cl)c1nnc(-c2cc(I)ccc2Br)s1 235501149 SCQHKRUYSISUEN-YFKPBYRVSA-N 429.508 4.872 50 10 IJGE CCOc1ccc2ccc(OCC)c(C=NNC(=O)Cn3cc(C#N)c4ccccc43)c2c1 252631122 VIHCFQVWUYFPHP-UHFFFAOYSA-N 440.503 4.614 50 10 IJGE COC[C@H](O[C@H](CI)c1ccc(Br)cc1)C(C)C 404107527 HOYIRFMCIZGVOU-KGLIPLIRSA-N 427.120 4.613 50 10 IJGE O=C(NCC1(N(Cc2ccccc2)Cc2ccccc2)COC1)c1ccc(CCl)cc1 705861394 LGBVNJZUDKVASH-UHFFFAOYSA-N 434.967 4.627 50 10 IJGE ClCCc1nc2cc(Br)ccc2n1Cc1cnc(Br)s1 718874269 PPHLJKZOPRQROO-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CCCCCCOCC(=O)NS(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1 783463732 BTDXQUYXWKORLG-UHFFFAOYSA-N 425.441 4.746 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNc1ccc(F)cc1Br 1446461665 SXGQJLNFPHSALS-UHFFFAOYSA-N 433.199 4.929 50 10 IJGE C=CC[C@@H](NC(=O)NNc1cc(C(F)(F)F)ccc1Br)c1ccncc1 1669192534 RSOWIDFMTNUUPH-CQSZACIVSA-N 429.240 4.806 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)/C=C/c1cccc(F)c1 1865759946 ZSFNGFDBWSKWOQ-BJMVGYQFSA-N 444.293 4.977 50 10 IJGE CCOc1ccc(/C=N\NC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)cc1OC 1865760591 FUTDYUFWVZEFRK-ZMFRSBBQSA-N 425.435 4.506 50 10 IJGE O=C(NCCCBr)c1ccc(N2COc3ccc4ccccc4c3C2)cc1 1865891551 CTHAAZXVIJNSEL-UHFFFAOYSA-N 425.326 4.711 50 10 IJGE COc1ccc(C/C(O)=C(\C#N)c2nc(-c3ccc4c(c3)OCCO4)cs2)c(OC)c1 1872750327 BRWHUQWOXBMCHS-ZPHPHTNESA-N 436.489 4.634 50 10 IJGE COc1cccc(/C=C(\C#N)c2nc(-c3ccc(OC)c(OC)c3OC)cs2)c1OC 1872795164 QQPBBWLGSMTKHN-RVDMUPIBSA-N 438.505 4.917 50 10 IJGE CC1(CCCOC2(CI)CCN(C(=O)OC(C)(C)C)CC2)CC1 1902024617 XMYZCAYEQJPBLQ-UHFFFAOYSA-N 437.362 4.788 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC2(CCC2)[C@@]12CC[C@](C)(CI)O2 1924954448 GHVJZAHGBTXEDV-POZUXBRTSA-N 449.373 4.834 50 10 IJGE Brc1ccc(Br)c([C@@H]2CC[C@H](CI)O2)c1 1927790708 WSGSECUVBBXXIF-KCJUWKMLSA-N 445.920 4.867 50 10 IJGE COC[C@]1([C@H](Br)c2cc(Br)sc2Br)CCCO1 1943037278 RAVYERHCHFIRFZ-KOLCDFICSA-N 449.002 4.905 50 10 IJGE CC(C)(C)[C@H](CBr)NC(=O)c1csc(Br)c1Br 1945189636 VTBCIZFLCUOPAE-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE CC(C)(C)CC1CC(O[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2I)C1 1987833959 OLUPIGLTQPSQMC-CVSAEHQPSA-N 437.362 4.641 50 10 IJGE CC(C)[C@@H](Br)[C@H](C)NC(=O)c1cc(Br)sc1Br 1997050943 SEYNMVROECZHMU-IMTBSYHQSA-N 448.018 4.811 50 10 IJGE CC[C@@H](Br)c1cn(Cc2c(Br)cccc2Br)nn1 2033089518 UKTCDCFSUOYTIZ-SECBINFHSA-N 437.961 4.697 50 10 IJGE Brc1ccc(Br)c(CN2CCC3(CC(Br)C3)C2)c1 2054714812 VZWIYLOUEYDHKI-UHFFFAOYSA-N 438.001 4.961 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H](Br)[C@H](C3CC3)C2)c1 2054716421 DEHDCUHFDCQANT-JSGCOSHPSA-N 438.001 4.817 50 10 IJGE CC(C)C[C@](C)(CNC(=O)OC(C)(C)C)NC(=O)c1ccc(CBr)cc1 2106204008 PJHQPLWJZZAOAB-HXUWFJFHSA-N 427.383 4.641 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1ccc(Br)cc1F 2117891664 AITPBODYJLNTST-SNVBAGLBSA-N 442.110 4.702 50 10 IJGE CN(CC1(CBr)CCCCCC1)C1(CNC(=O)OC(C)(C)C)CCOCC1 2163061734 HVPVUCGIZHDMDJ-UHFFFAOYSA-N 447.458 4.728 50 10 IJGE Cc1ccc(N(C)S(=O)(=O)c2cc(CBr)sc2Br)cc1 2179787659 RZFPMBAFOBUWJC-UHFFFAOYSA-N 439.194 4.539 50 10 IJGE CCN(C[C@](C)(CI)O[C@H]1C[C@H]2CC[C@H]1C2)C(=O)OC(C)(C)C 2212690724 OGTHHNSKLDEBPI-XSWJXKHESA-N 437.362 4.642 50 10 IJGE C[C@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@]1(C)CBr 2282977514 CVGZIXGHFZLYDW-RTHLEPHNSA-N 427.539 4.735 50 10 IJGE Cc1cc(Br)c(C)c([C@@H](Cl)C2CC(S(C)(=O)=O)C2)c1Br 2285391641 PSXGOHZXSMOWRN-FDZGAKKTSA-N 444.616 4.932 50 10 IJGE Cc1ccc(C(=O)NN=C2C(=O)N(CC=Cc3ccccc3)c3ccccc32)cc1Cl 2313643897 HETOYGIHKJBIFZ-UHFFFAOYSA-N 429.907 4.843 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)Nc2cccc(OC)c2)cc(Br)c1OCC 2313670786 WQUJULXBLWAPFK-UHFFFAOYSA-N 445.313 4.801 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cc(Cl)cc(F)c1F 2320360030 IOYNWPQRGISVSO-AWEZNQCLSA-N 432.692 4.718 50 10 IJGE Clc1ccc(I)cc1CN1CCC[C@@H](CCBr)C1 2327409412 OCXABZRAJVQWCS-NSHDSACASA-N 442.566 4.942 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@H]1CN(C[C@H](CBr)c2ccccc2)CC1(C)C 2336372498 CWWJFALXCCSONN-ZWKOTPCHSA-N 425.411 4.742 50 10 IJGE Cn1cc(I)c(C[C@@H]2C[C@H](C(C)(C)C)CC[C@@H]2Br)n1 2341856365 JUHBKNYQFMLHHD-TUAOUCFPSA-N 439.179 4.793 50 10 IJGE FC(F)(F)[C@@]1(CCl)CCN(Cc2ccc(Cl)cc2I)C1 2366726006 PDAOWLZPACEPNQ-GFCCVEGCSA-N 438.058 4.938 50 10 IJGE CCOC(=O)c1ccc(NC(=O)/C(C#N)=C\c2ccc(-c3ccc([N+](=O)[O-])cc3C)o2)cc1 33704919 NTCUMTRFKCTULR-LGMDPLHJSA-N 445.431 4.886 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(=O)Nc3ccc(N(C)C)cc3)o2)cc1 33750276 YCABFBZMTXQQCA-XDJHFCHBSA-N 429.476 4.735 50 10 IJGE O=C(N/N=C/c1ccccc1Oc1ccccc1[N+](=O)[O-])c1cccc(Br)c1 59463948 WLJGCDWBKBYTHG-LPYMAVHISA-N 440.253 4.914 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N[C@@H](C)c3ccc4c(c3)OCO4)c2C)cc1 97074820 AOYWSSWXWWLCJJ-WCEBZYJUSA-N 443.503 4.616 50 10 IJGE O=C1c2ccccc2C(=O)c2c(O)c(OCCBr)cc(Nc3ccccc3)c21 206301200 YBBMALCFAZKRJC-UHFFFAOYSA-N 438.277 4.685 50 10 IJGE CC[C@H](Br)[C@@H](C)NC(=O)c1ccc(Br)cc1Br 395360280 JAQPTQAIIXQXGP-XCBNKYQSSA-N 427.962 4.503 50 10 IJGE CC(C)(C)OC(=O)NCCN1CCNC[C@H]1c1ccccc1CO[Si](C)(C)C(C)(C)C 616603974 JEYLQDLKNCQJEU-NRFANRHFSA-N 449.712 4.679 50 10 IJGE CC(C)(C)OC(=O)NCCN1CCNC[C@@H]1c1ccc(CO[Si](C)(C)C(C)(C)C)cc1 616637289 UZKRYWHEJBOQGP-OAQYLSRUSA-N 449.712 4.679 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NCc1cc(Cl)ccc1I 716806067 AZOXFHIADKBXIU-SKDRFNHKSA-N 430.555 4.986 50 10 IJGE CCN(C(=O)/C(C#N)=C\c1cc(C)n([C@H](C)COC)c1C)[C@@H](C)Cc1ccc(OC)cc1 731335431 OEGFATXGPYWJGV-YTUAFBIUSA-N 437.584 4.708 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 775993749 BHVPFJZEIAYDMV-CYBMUJFWSA-N 439.743 4.606 50 10 IJGE CCOC(=O)c1cc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)ccc1Cl 799388717 QBDTYXSNCQSVFA-UHFFFAOYSA-N 426.782 4.556 50 10 IJGE O=C(NN=Cc1ccc(OCc2ccc(Br)cc2)cc1)c1cccc(F)c1 1081086763 GORATTAUTUODLO-UHFFFAOYSA-N 427.273 4.931 50 10 IJGE O=C(COc1ccc(Cl)cc1Br)NN=Cc1ccccc1C(F)(F)F 1083930261 ZNVXPHYDIDHMAU-UHFFFAOYSA-N 435.627 4.650 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNc3ncc(Br)cc3C)cc2)cc1 1627118049 YGAHWGQJYDTORS-UHFFFAOYSA-N 440.297 4.904 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2c(-c3cccc(Cl)c3Cl)noc2C)c1 1633773377 BPEOYUHEIWODML-UHFFFAOYSA-N 445.331 4.570 50 10 IJGE Cc1cccc(NNC(=O)CCc2nc(O)c3c4c(sc3n2)C[C@@H](C)CC4)c1Cl 1636650676 JRMWLFYNHSRAAO-NSHDSACASA-N 430.961 4.559 50 10 IJGE C=C[C@H](CC(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1)c1ccccc1 1641052937 QATKQLFJLYEYQQ-QGZVFWFLSA-N 430.533 4.516 50 10 IJGE Cc1c(C(=O)NNc2nc3ccccc3[nH]c2=S)oc2ccc(Br)cc12 1641874083 NJJNWQUZOPHXPB-UHFFFAOYSA-N 429.299 4.866 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccc(Cl)c2)CCC3)n1 1772748982 VJLVCBWCXOTFSM-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE Cn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@H]2c1ccc(OC(=O)c2ccccc2)cc1 1865705018 KDIZXAHFBYRNGL-JOCHJYFZSA-N 448.482 4.524 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C1 1882088958 VUTUVIVYJCZODR-LVQVYYBASA-N 447.414 4.558 50 10 IJGE Cc1ncnc(N(Cc2ccccc2)[C@H](CBr)C2CC2)c1Br 1915198982 RVVXKYDUYFXHHV-OAHLLOKOSA-N 425.168 4.728 50 10 IJGE O=S(=O)(c1ccc(Br)cc1F)N(Cc1ccccc1)C1(CCl)CCC1 1915762996 VAFANDCSNVAEJW-UHFFFAOYSA-N 446.769 4.941 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@@]12CCC[C@@H](C1)OC2 1925087719 HCKSABXOOBJSOR-RCBQFDQVSA-N 449.126 4.621 50 10 IJGE O=C(N[C@@H](CCl)CC1CCCC1)c1ccc(I)c(Cl)c1 1926735433 JCQNMVHIWYIBPV-GFCCVEGCSA-N 426.125 4.862 50 10 IJGE BrCC[C@H](NCc1c(Br)cccc1Br)C1CC1 1945321880 JDXNEFCJGHHUET-ZDUSSCGKSA-N 425.990 4.865 50 10 IJGE CCN(C)C[C@@H](Br)CCc1c(Br)cccc1Br 1949935603 WEVRDEVJORYPKQ-JTQLQIEISA-N 428.006 4.859 50 10 IJGE COc1ccccc1[C@H](CI)OCCCOCc1ccccc1 1983391629 VYXOHZWZDYYJBY-IBGZPJMESA-N 426.294 4.795 50 10 IJGE CC(C)[C@@H](Br)[C@H](C)NC(=O)c1scc(Br)c1Br 1997062659 JHZJOJPMMJIBJY-POYBYMJQSA-N 448.018 4.811 50 10 IJGE Cc1cc(F)c([C@@H](Br)c2cc(I)sn2)cc1C 2007647725 NDKPIFVOKVXIKW-GFCCVEGCSA-N 426.092 4.988 50 10 IJGE CCN(C)C[C@@H](Br)CCc1ccc(I)c(Cl)c1 2026562233 ZGIALMHFQJENII-NSHDSACASA-N 430.555 4.592 50 10 IJGE Brc1cnc(N2C[C@H](Br)CC3(CCC3)C2)c(Br)c1 2033947243 XTOKVEIEOZUXSY-SNVBAGLBSA-N 438.989 4.751 50 10 IJGE BrC[C@]12CC[C@@H]1CN(Cc1c(Br)cccc1Br)C2 2078146657 ZJANMRVPIHJSBR-YGRLFVJLSA-N 438.001 4.819 50 10 IJGE CC(C)N(CCCCl)C(=O)c1ccc(Br)cc1I 2086147576 OTQJGTUKKGKDEF-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCC2(CC1)C[C@@H]2CCl 2093942425 RTHFTCCMXDMASE-MRVPVSSYSA-N 427.589 4.754 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1[C@]12C[C@H]1CN(Cc1ccccc1)C2 2099678487 JAOOCDSFRQWAPN-KPHUOKFYSA-N 431.765 4.725 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)C(C)(C)C)C[C@@H]1CC(F)(F)F 2119512311 FQUFTGVCMNRECR-KGLIPLIRSA-N 445.364 4.917 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(C[C@H](CBr)c3ccccc3)C[C@@H]21 2163062169 KFICIVNFKTUHGZ-FUMNGEBKSA-N 437.422 4.790 50 10 IJGE Clc1c(Br)cccc1CN1CCC(COCCBr)CC1 2167398608 QLKFAMYEJOKOFK-UHFFFAOYSA-N 425.592 4.726 50 10 IJGE CC1(C)C[C@H](CCl)CN(C(=O)c2cc(Cl)ccc2I)C1 2172585006 IFYKPKUUDHAVOT-SNVBAGLBSA-N 426.125 4.672 50 10 IJGE C[C@H](CCCl)N(Cc1ccccc1)S(=O)(=O)Cc1ccc(Br)cc1 2213761355 VBFMBVXAOVJPOZ-OAHLLOKOSA-N 430.795 4.799 50 10 IJGE CCC(CC)[C@@H](Br)CNC(=O)c1cc(C)ccc1I 2232158565 XPCRFTGFLODFGV-ZDUSSCGKSA-N 438.147 4.529 50 10 IJGE Cc1c(Br)sc([C@@H](Cl)[C@H]2C[C@H](S(C)(=O)=O)C2)c1Br 2257536890 ZEAAXLWHIVFVIX-ZKWXMUAHSA-N 436.618 4.685 50 10 IJGE CC1(C)[C@@H](Cl)C[C@@H]1OCc1cc(I)ccc1Br 2302815195 XMOREWVHGHYMKW-RYUDHWBXSA-N 429.523 4.976 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Br)c2)[C@@H]1CCl 2306226137 YEYMPMSJFWFVRH-GFCCVEGCSA-N 428.539 4.503 50 10 IJGE CC1(C)C[C@@H](Br)CN1Cc1cc(I)ccc1Cl 2307322959 VCAMWPSILRVILC-SNVBAGLBSA-N 428.539 4.692 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cc1Cl 2323766961 XJHYCAKTVYJPEC-UHFFFAOYSA-N 436.126 4.830 50 10 IJGE Cc1ccc(CN[C@H](C)CCCCCI)c(O)c1Br 2352686615 CGFJFCUADSWJGD-GFCCVEGCSA-N 440.163 4.937 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@@H](CNC(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1 2353830105 JQWDGJWTPGHUBP-KFWWJZLASA-N 445.364 4.679 50 10 IJGE Cc1cc(Br)c(C(=O)N2CC[C@@H](Br)C[C@@H]2C(F)(F)F)s1 2361464842 RMXSWZUDRTYDJF-VXNVDRBHSA-N 435.103 4.749 50 10 IJGE CN(CCn1cc(Br)cn1)c1c(CCl)ccc(Br)c1Cl 2361654566 QWORVYTUGSUSAS-UHFFFAOYSA-N 441.982 4.937 50 10 IJGE Cn1nc(C(F)F)c(CBr)c1N1CCN(Cc2ccccc2)CCC1(C)C 2365337980 VBIKCLSQGBWMPS-UHFFFAOYSA-N 441.364 4.744 50 10 IJGE Cc1cc(C(=O)N2CCC[C@H](Br)[C@@H]2C(F)(F)F)c(Br)s1 2370247024 ISVHYPXGFDSRQT-DTWKUNHWSA-N 435.103 4.749 50 10 IJGE COc1ccc([C@H]2CC(=O)N3CN(c4ccc(Cl)cc4)CSC3=C2C#N)cc1OC 9693119 YSXHSGGOFWWUAD-QGZVFWFLSA-N 441.940 4.577 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(Cl)cc2)cc1 38651310 QBQSNFBOEPTTAQ-DEOSSOPVSA-N 446.890 4.851 50 10 IJGE C/C(=N\NC(=O)CSc1nc2ccc([N+](=O)[O-])cc2s1)c1ccc2ccccc2c1 58991208 VUBMUDIHMCZJFZ-YDZHTSKRSA-N 436.518 4.990 50 10 IJGE COc1cccc(/C=C(/C#N)C(=O)Nc2ccc3c(c2)OCO3)c1OCc1ccccc1 96438294 VYLSETLQHQOXCL-UNOMPAQXSA-N 428.444 4.549 50 10 IJGE COc1cc(/C=N/NC(=O)c2ccc(C)nc2)ccc1OC(=O)c1cccc2ccccc12 103379728 CXZJQCGZNLULMQ-RWPZCVJISA-N 439.471 4.535 50 10 IJGE CCCCSc1cc(CBr)cc(S(N)(=O)=O)c1Cc1ccccc1 147062144 QQZLPQPSSMFKAF-UHFFFAOYSA-N 428.417 4.712 50 10 IJGE Nc1nc2ccc(C(=O)N/N=C\c3ccc(OCCCc4ccccc4)cc3)cc2s1 169916765 BAQJAHYMRHEFBV-QQXSKIMKSA-N 430.533 4.654 50 10 IJGE CCSc1ccc(Cl)cc1CC(=O)N/N=C\c1cc(Br)ccc1OC 169922283 KEPOPEAWTHROHH-NHDPSOOVSA-N 441.778 4.916 50 10 IJGE Cc1cc(C=NNC(=O)Cc2cn3ccsc3n2)c(C)n1-c1cc(Cl)ccc1Cl 254506041 GGMDUVVUHTYVJT-UHFFFAOYSA-N 446.363 4.803 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(OC[C@@H]2C[C@H]3CCCC[C@H]3O2)CC1 380845195 ZLLVWAXURMHKKQ-IXDOHACOSA-N 432.399 4.515 50 10 IJGE COc1ccc(Br)c(C=NNC(=O)[C@H](C)Oc2cccc3ccccc23)c1 606518264 UJLBFLPAYIDDTG-AWEZNQCLSA-N 427.298 4.529 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1C(=O)c1scc(Br)c1Br 705425014 JGBGGUPCYIGPFV-RNFRBKRXSA-N 446.002 4.661 50 10 IJGE CCCOCC(CBr)(CBr)c1cccc(Br)c1 709728259 ADEFTVKAUUKQFM-UHFFFAOYSA-N 428.990 4.903 50 10 IJGE CN(OCc1ccccc1)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 749137591 FBZFOCOIQIOLSQ-ZHZULCJRSA-N 445.910 4.614 50 10 IJGE N#Cc1ccc(Cc2cnc(NC(=O)NNc3ccc(C#N)cc3C(F)(F)F)s2)cc1 799382026 SAQCEOBROXRBOF-UHFFFAOYSA-N 442.426 4.645 50 10 IJGE COc1cc(C=NNC(=O)c2cc3ccccc3o2)ccc1OCc1ccc([N+](=O)[O-])cc1 1084285256 SIOGJGUKARZVPE-UHFFFAOYSA-N 445.431 4.693 50 10 IJGE C=CCN(CCOC)C(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1543595052 AGUMYYAKFYGVET-LDADJPATSA-N 432.351 4.969 50 10 IJGE CC(C)(C)N(NC(=O)Nc1ccc2c(c1)OCCO2)C(=O)c1cc(Cl)cc(Cl)c1 1615950077 LXYDRDDFSBLZJG-UHFFFAOYSA-N 438.311 4.742 50 10 IJGE C/C(=C/c1ccc(Cl)cc1)C(=O)NNC(=O)COc1ccccc1Cc1ccccc1 1650629240 SRBMRFQEKCLHOH-SDXDJHTJSA-N 434.923 4.561 50 10 IJGE CCc1nn(CC(C)C)c2c1[C@@H](c1ccc(OCc3ccccc3)cc1)C(C#N)=C(N)O2 1865689959 HOMDRRCFOITVSQ-QHCPKHFHSA-N 428.536 4.899 50 10 IJGE N#C/C(=C\c1cccc(Br)c1)C(=O)NCCc1ccc(-c2cccnc2)cc1 1866130541 ABVHZFLDZYQMKK-FYJGNVAPSA-N 432.321 4.777 50 10 IJGE CC(C)(C)[C@H]1CCc2c(sc(NC(=O)/C(C#N)=C/c3cccc(F)c3)c2C(N)=O)C1 1866131048 DSWQIWTWUFEHLG-HNRFISLBSA-N 425.529 4.683 50 10 IJGE O=C(N[C@H](CCl)[C@@H]1CC=CCC1)c1cc(Br)sc1Br 1885066658 CTWUHTAYYSVJDT-PSASIEDQSA-N 427.589 4.967 50 10 IJGE O=C(c1cc(F)c(F)c(O)c1F)N(Cc1ccccc1)C1(CBr)CCC1 1915755524 OTZJGABNTHUELQ-UHFFFAOYSA-N 428.248 4.770 50 10 IJGE O=S1(=O)CCC[C@@H]1[C@@H](Cl)c1c(Br)sc(Br)c1Cl 1923054857 LDPWINBIYXNAFQ-INEUFUBQSA-N 443.009 4.784 50 10 IJGE Brc1cccc(CN2CCC[C@H](Br)CC2)c1Br 1943880333 DCDGJHHDTKUFLF-NSHDSACASA-N 425.990 4.961 50 10 IJGE Cn1nc([C@H](Br)c2cc(F)c(Br)cc2F)cc1Br 2033076473 URLCOQOJFFZFRT-LLVKDONJSA-N 444.899 4.708 50 10 IJGE CC(C)N(C[C@H]1CCCN(C[C@@H](Br)C(F)(F)F)C1)C(=O)OC(C)(C)C 2044698087 ZGHZXFPCYIWBGT-UONOGXRCSA-N 431.337 4.670 50 10 IJGE C[C@@H](CCCCCl)NC(=O)c1ccc(Br)cc1I 2086150522 BYEHBTHYJQYBNU-VIFPVBQESA-N 444.538 4.581 50 10 IJGE CCC[C@]1(NC(=O)[C@H](Br)C2CCCC2)CCCN(C(=O)OC(C)(C)C)C1 2110714160 ARDDTTZZTQUUPW-UZLBHIALSA-N 431.415 4.626 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CCC[C@@H]1[C@@H]1CCN(Cc2ccccc2)C1 2145255939 RFWSIEROCCZQQY-FGZHOGPDSA-N 427.386 4.708 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CCC[C@@]23CC[C@](C)(CI)O3)C1 2213351911 DOTMMIBUZMOBDZ-OHDICMOHSA-N 449.373 4.786 50 10 IJGE ClCCc1nc2cc(Br)c(Br)cc2n1C[C@@H]1C[C@H]1Cl 2225702270 PNYZSWHLAIIMAC-OIBJUYFYSA-N 426.967 4.970 50 10 IJGE Fc1ccccc1[C@@H](CI)O[C@H]1CCN(Cc2ccccc2)C1 2244803768 YZAUEYXAHVYYSZ-QFBILLFUSA-N 425.285 4.593 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC[C@](C)(CI)O2)C[C@@H]2CCCC[C@@H]21 2246604629 ZETSDKIUZBWJGK-SAKMYQHLSA-N 449.373 4.929 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@H]2[C@H]3OCCC[C@@H]32)c1 2263514349 AIMRLQXKYUXFEA-RFGFWPKPSA-N 438.985 4.943 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC2(CC[C@H]1CBr)CC2 2264505719 BDBSATBEGILMJQ-QMMMGPOBSA-N 427.589 4.944 50 10 IJGE O=C(COc1ccc(Cl)cc1Cl)NN=CC=Cc1ccc(Br)cc1 2293429996 PGQGACRSWPPYBL-UHFFFAOYSA-N 428.113 4.950 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=C(C#N)C(=O)Nc3ccc(C)cc3OC)o2)cc1 2297169410 BVRLTJZNGJYTCO-UHFFFAOYSA-N 430.460 4.986 50 10 IJGE BrC[C@]12CCC[C@@H]1N(Cc1sccc1I)CCC2 2316760190 RLPWFLIOAORCMD-UONOGXRCSA-N 440.188 4.882 50 10 IJGE COc1ccc(C(C#N)=Cc2ccc(OC(=O)c3ccc4c(c3)OCO4)c(OC)c2)cc1 2320506717 QBPJBHRGBCCHBY-UHFFFAOYSA-N 429.428 4.716 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=CN(c2ccccc2)c2ccc(N)cc2)cc1 2324335564 IDZNLKKLVAOLAM-UHFFFAOYSA-N 426.476 4.630 50 10 IJGE CCc1cccc(CC)c1NC(=O)C(C#N)=CNCCc1ccccc1Br 2325129564 HCVKFANTTCQUCY-UHFFFAOYSA-N 426.358 4.752 50 10 IJGE C[C@@H]1C[C@H](CCl)CN(Cc2ccc(I)c(Br)c2)C1 2325206301 DBWYRXUTPLEYAZ-ZYHUDNBSSA-N 442.566 4.751 50 10 IJGE CC(C)(C)Oc1cccc(CCNC(=O)C(C#N)=Cc2ccc(Br)cc2)c1 2329659938 CTHUUZFMTDIFLC-UHFFFAOYSA-N 427.342 4.892 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CCC[C@]3(CNC(=O)OC(C)(C)C)C2)C1 2345004573 MIXPRSJCIREXIO-IERDGZPVSA-N 429.443 4.815 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H](NC(=O)OC(C)(C)C)CC3(CCC3)C2)C1 2345005386 XWSSQQBJBLCHSC-MRXNPFEDSA-N 429.443 4.957 50 10 IJGE C[C@@H]1CC2CC([C@@H](Br)c3cc(I)cc4c3OCC4)(C2)O1 2368035740 MNKXMJGYGGRWMH-BVSRGYKMSA-N 449.126 4.620 50 10 IJGE CCOC(=O)c1cccc(-c2ccc(/C=C(/C#N)c3c(C#N)c(N)nn3-c3ccccc3)o2)c1 33476954 VMVATMIGMSJVBH-RGEXLXHISA-N 449.470 4.827 50 10 IJGE Cc1nn(-c2ccc([N+](=O)[O-])cc2)c(C)c1/C=N/NC(=O)[C@H](C)c1ccc(CC(C)C)cc1 59147894 SFVGZVGTKCCASZ-CIRUFVMISA-N 447.539 4.850 50 10 IJGE Cc1ccccc1SCC(=O)N/N=C/c1ccc(OCc2nc3ccccc3[nH]2)cc1 59501664 JCHUHWOWUFETSR-AFUMVMLFSA-N 430.533 4.693 50 10 IJGE COc1cccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc([N+](=O)[O-])cc3C)c2C)c1 96838652 XIMAKFAHTXCSOS-UNOMPAQXSA-N 430.464 4.865 50 10 IJGE C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)OC[C@@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C 195803882 KEOUSSOURMHEKN-WCXIOVBPSA-N 438.862 4.855 50 10 IJGE FC(F)(F)SCCn1c(CCCl)nc2cc(I)ccc21 231964301 ULUYWYYWBAHNAH-UHFFFAOYSA-N 434.652 4.675 50 10 IJGE C=CCC(CBr)(CBr)Cc1c(Br)c(C)nn1CC 387098432 BTNCNQTWOVMYBM-UHFFFAOYSA-N 443.021 4.869 50 10 IJGE CC(C)(C)N(CCCCl)S(=O)(=O)c1cc(Br)ccc1Br 691039576 IDNPLVDQSTXABD-UHFFFAOYSA-N 447.620 4.630 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)c1nn(-c2ccc(Cl)cc2Cl)c2c1CCC2 730282018 AVGARZULANFCHN-UHFFFAOYSA-N 441.240 4.842 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)/C=C/c2ccc(-c3ccccc3Cl)s2)cc1 748162055 XPPKLUPIQABPPU-UKTHLTGXSA-N 432.954 4.629 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 756539400 MXJUVSIQGMSTAE-UHFFFAOYSA-N 441.422 4.649 50 10 IJGE COCCc1nc(C)c(C(C)=NNC(=O)c2ccccc2OCc2ccc(F)cc2)s1 770591990 QBUPCICLDFGSSY-UHFFFAOYSA-N 441.528 4.513 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc(CC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1 799749058 LEMBUKAFYJETDJ-UHFFFAOYSA-N 434.418 4.610 50 10 IJGE C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 1087433624 DORICNQCXRLSNI-VHKYSDTDSA-N 442.437 4.577 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)Nc3cccc(-n4ccnc4O)c3)c2C)c1 1125333396 WPUGYJDYWAOCEY-KGENOOAVSA-N 437.503 4.840 50 10 IJGE C#CCn1ccc(CN(CC)C(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Cl)cc3)c2C)n1 1128671600 CPOBGNFZXAJJDJ-QNGOZBTKSA-N 445.954 4.533 50 10 IJGE O=C(CSc1nc(-c2ccc(Cl)cc2)cs1)NN=Cc1ccc([N+](=O)[O-])cc1 1772755254 XNGCDCYVAKEDFC-UHFFFAOYSA-N 432.914 4.614 50 10 IJGE O=C(Cc1ccc(Cl)cc1)N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21 1860822402 CMURMBOYEHWMJH-QYQHSDTDSA-N 438.314 4.603 50 10 IJGE CCCc1nn(-c2ccc(OC)cc2)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699403 SSEFGOZMIOEAEF-QHCPKHFHSA-N 439.519 4.543 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] 1915274643 SSXNTAOROAMTAB-GOSISDBHSA-N 441.272 4.935 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)Cc1c(Br)cnn1C 1915299279 CFIUHJQWBXJPDR-INIZCTEOSA-N 429.200 4.604 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)C(=O)c1cccc(Br)c1Cl 1916352817 BVYBJJZTGOGUEJ-CQSZACIVSA-N 431.157 4.999 50 10 IJGE O=C(NC[C@H]1CC[C@H](CCl)CC1)c1cc(Cl)ccc1I 1922674001 FGXHGDNTTSFPGN-XYPYZODXSA-N 426.125 4.720 50 10 IJGE C[C@@H]1OCCO[C@@H]1[C@H](Br)c1cc(Br)sc1Br 1935544135 ZMBXYBCWJUXTII-NGESMGFYSA-N 434.975 4.513 50 10 IJGE C[C@]1(CBr)CCN(Cc2ccc(Br)cc2Br)C1 1943839786 CKMONIYADWRKRG-CYBMUJFWSA-N 425.990 4.819 50 10 IJGE CC[C@@H](CCCBr)NC(=O)c1csc(Br)c1Br 1948444929 KWGFUFZUMORCOM-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]23CCC[C@@]2(CN(C[C@@H](CBr)C2CCC2)C3)C1 1966579049 JZMYTGIOWXOZES-UIFIKXQLSA-N 427.427 4.521 50 10 IJGE IC[C@@H]1CCCC2(O1)[C@H]1CCC[C@H]2CN(Cc2ccccc2)C1 1979905190 KVGZFOLGAHJZAV-FHWLQOOXSA-N 425.354 4.661 50 10 IJGE O=C(N[C@H]1C[C@H](CCBr)C1)c1csc(Br)c1Br 2021780733 CSVWQIPOROHHDW-LJGSYFOKSA-N 446.002 4.567 50 10 IJGE Brc1ccc(CN2CC[C@H](Br)[C@H]3CC[C@H]32)c(Br)c1 2069994625 AFDRPZSZPVYKLS-MBNYWOFBSA-N 438.001 4.959 50 10 IJGE O=C1Cc2cc([C@@H](Br)[C@H]3C[C@@H](Br)C3)c(Br)cc2N1 2076181764 IULSZLBEDARHRU-DAROEXNTSA-N 437.957 4.553 50 10 IJGE CCOc1ccc(-n2nc(CBr)c(Br)c2C(F)(F)F)cc1 2079234976 KWTNXUJKMDDRBD-UHFFFAOYSA-N 428.046 4.947 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@@H]2CCC[C@]2(CCl)C1 2103164166 HHBNMZVBHLXAPV-SDBXPKJASA-N 427.589 4.754 50 10 IJGE Fc1cc(CBr)ccc1N1CCN(Cc2ccccc2)C[C@@H]1C(F)(F)F 2130159924 PPOVNTZORRKEQK-GOSISDBHSA-N 431.271 4.974 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1CN(CC1CC1)C(=O)[C@H](Br)C1CCCC1 2167033143 PTXCIZUDSOUKRF-ZWKOTPCHSA-N 443.426 4.578 50 10 IJGE CCCC1(CN(C)S(=O)(=O)c2cc(CBr)sc2Br)CC1 2179774877 IDSDJTFZVDFUCB-UHFFFAOYSA-N 445.242 4.606 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@H]1CCCCN1CCCCCI 2211187018 YXFXZQCMBJIUSI-OAHLLOKOSA-N 438.394 4.750 50 10 IJGE Cc1sc(C(=O)NCCCCCCI)cc1Br 2213747472 YLRIVFLQDILENS-UHFFFAOYSA-N 430.149 4.544 50 10 IJGE C[C@@H]1CC[C@@H](CO[C@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)C1 2243469985 PBBHPHLAYYWSPP-RKVPGOIHSA-N 437.362 4.644 50 10 IJGE CC[C@@H]1CC[C@@H]([C@@H](Br)c2ccc(OC)c(I)c2)O1 2257356113 RLWUWJSKOKDKEF-SWHYSGLUSA-N 425.104 4.693 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@H]2C[C@H]3C[C@@H]3CO2)c1 2263514868 HPPYRCWSNICRBG-JYILRKAJSA-N 438.985 4.943 50 10 IJGE Cc1ccc(N(C)Cc2ccc(I)cc2)c(CBr)n1 2271559141 BQBMDBJFMBUPRS-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE CS(=O)(=O)c1cscc1[C@H](Br)c1ccc(F)c(Br)c1 2272850957 BUPNQIWDAKKKIC-GFCCVEGCSA-N 428.142 4.538 50 10 IJGE COc1cccc(N(C)Cc2cccc(I)c2)c1CBr 2280262630 BCZWVDDWZFLVQX-UHFFFAOYSA-N 446.126 4.831 50 10 IJGE C[C@@H](CCl)[C@H]1CCCCN1C(=O)c1ccc(Cl)c(I)c1 2283670662 UWRXSJFJURNKRY-IINYFYTJSA-N 426.125 4.814 50 10 IJGE C[C@@H](CCCBr)CNCc1ccc(Cl)c(I)c1 2300238420 KQYYDQYRSYGDTF-JTQLQIEISA-N 430.555 4.845 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)CNC(=O)c1sccc1I 2317976206 VVIXUMJBTCFMAA-LLVKDONJSA-N 444.176 4.528 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)NN=Cc1ccc(Cl)c([N+](=O)[O-])c1 2321244521 KWACSJSXXUHPLM-UHFFFAOYSA-N 430.798 4.661 50 10 IJGE CC1(C)CC(CBr)(CN=[S@](C)(=O)CCCCNC(=O)OC(C)(C)C)C1 2321755690 WNBXOHLCMVZBLU-RUZDIDTESA-N 439.460 4.590 50 10 IJGE Clc1ccc(I)cc1CN1[C@H]2CC[C@@H](C2)[C@H]1CBr 2327405671 DYOHSFPZHUHOQH-DUFXMDAXSA-N 440.550 4.692 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCCN1C[C@]1(CBr)CC1(F)F 2351886720 CZQFAQABKVBZLE-HDMKZQKVSA-N 437.369 4.661 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCN(C[C@]2(CBr)CC2(F)F)c2ccccc21 2379984536 MYFLZOMZNDVESQ-IFXJQAMLSA-N 445.348 4.925 50 10 IJGE C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)/C=C/c1cccc2ccccc12 12578378 FHTAAYZPVAKHHC-TZIYXEQSSA-N 429.303 4.775 50 10 IJGE COc1ccc2cc([C@@H](C)C(=O)N/N=C/c3ccc(O)c(Br)c3)ccc2c1 20551199 KZDFDBKZWKCQAV-GHONEHJGSA-N 427.298 4.570 50 10 IJGE O=C1COc2ccc([C@@H](Br)c3ccc(Br)cc3Cl)cc2N1 40288761 QEWWFDZGEWHFAT-OAHLLOKOSA-N 431.511 4.918 50 10 IJGE Cc1c(C(=O)NCc2ccccc2Cl)oc2c1/C(=N/NC(=O)c1cccs1)CCC2 40823643 AWOWSVUPOYJAMN-PCLIKHOPSA-N 441.940 4.703 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccc(Cl)cc2)ccc1OCc1ccccc1C 40911511 WUBRFIVYSQJNIX-VULFUBBASA-N 438.911 4.765 50 10 IJGE N#CC(C#N)=Cc1ccc(OC(=O)c2cc(Br)c(Br)s2)cc1 40991736 QSMAYYOFVRZCJL-UHFFFAOYSA-N 438.100 4.923 50 10 IJGE O=C(NC[C@H]1CCC[C@@H]1Br)c1ccc(Br)c(C(F)(F)F)c1 124439639 XSIIHGCUWWSNBE-KOLCDFICSA-N 429.074 4.761 50 10 IJGE Brc1ccc([C@@H](CI)OC[C@H]2CCCCO2)cc1 161961509 QYFTYLQVKMRDJE-ZIAGYGMSSA-N 425.104 4.511 50 10 IJGE CC[C@@H](C)N1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccc(C)cc3)c(OC)c2)C1=O 214269727 XHSWDMZBMSMRBQ-QLTNSANVSA-N 444.531 4.973 50 10 IJGE N#C/C(=C/N1CCN(C(c2ccccc2)c2ccccc2)CC1)C(=O)Nc1ccc(F)cc1 217226665 JPLAYYNJNWTRSA-ATJXCDBQSA-N 440.522 4.579 50 10 IJGE CCC(CC)(CBr)NC(=O)c1cc(Br)cc(Br)c1 232851077 SYTWIYFFXHTCDJ-UHFFFAOYSA-N 441.989 4.895 50 10 IJGE BrCCN(Cc1ccccc1)Cc1cc(Br)cc2c1OCC2 309788520 CIESCDHLNKAGHV-UHFFFAOYSA-N 425.164 4.781 50 10 IJGE C[C@H]1CCN(Cc2cc(Cl)ccc2I)C[C@@H]1CBr 700418764 NLUJKPKURYOOAX-JQWIXIFHSA-N 442.566 4.798 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)c1C 736694123 OWLAAPYBKGEDKJ-DLBZAZTESA-N 428.323 4.709 50 10 IJGE CCc1cccc(C)c1NC(=S)NNC(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 741298715 GTDRERLFZUKJTC-HOTGVXAUSA-N 437.487 4.577 50 10 IJGE C[C@H](CCCC(F)(F)F)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 757642850 BUZRWHAJWWKVEN-APVMCDBPSA-N 429.446 4.608 50 10 IJGE O=C(NNc1ccc(Br)c(F)c1)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 771680465 CNWWJRLZCACAED-VXGBXAGGSA-N 433.199 4.734 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCN(C[C@H](CBr)C3CC3)C2)C1 1643212854 MIANQKOMPQWMHG-FHWLQOOXSA-N 429.443 4.767 50 10 IJGE C=CCOc1ccc(CNC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)cc1 1681031390 GZQKZOLUVWSTSE-SFHVURJKSA-N 441.597 4.608 50 10 IJGE N#CSc1ccc(Nc2cc(N3CCC[C@@H](CO)C3)nc(Cc3ccccc3)n2)cc1 1868207000 BVSVMKACPNCGCA-LJQANCHMSA-N 431.565 4.593 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCC(C)(C)N(C[C@@H](CBr)c2ccccc2)C1 1879062627 RSKYACLAEBTSGH-MSOLQXFVSA-N 425.411 4.933 50 10 IJGE CC[C@@H]1C[C@H]1CCO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1902818118 TVGMXCVINSJREX-IIDMSEBBSA-N 437.362 4.644 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1sccc1Br 1916370380 MHZJOSVFAWRGHV-ZDUSSCGKSA-N 447.192 4.563 50 10 IJGE CCN(CCCCBr)C(=O)c1csc(Br)c1Br 1996953798 RTCFUCGIPGMILO-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE CCCC(CBr)(CCC)CN=[S@](C)(=O)CCNC(=O)OC(C)(C)C 1999498610 ZRIFXDOASWHEEY-XMMPIXPASA-N 427.449 4.590 50 10 IJGE BrCC[C@H]1CCCN1Cc1cc(Br)ccc1Br 2006504246 XSYQQWPUJSLWHJ-GFCCVEGCSA-N 425.990 4.961 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3[C@@H](Br)CC[C@H]3C2)c1 2027640885 BYPGQTGSLFPVAN-BIMULSAOSA-N 440.550 4.550 50 10 IJGE Brc1cccc(CN2C[C@H]3[C@H](Br)CC[C@H]3C2)c1Br 2031477596 MTBGMJXFWZPEPC-MVWJERBFSA-N 438.001 4.817 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1C(=O)c1cccc(Br)c1Br 2031480517 WKFSONRPLBIPCR-PSASIEDQSA-N 439.973 4.600 50 10 IJGE CCc1nn(C[C@H](CBr)C(C)(C)C)c(CC)c1I 2032918118 KVFFWCRPSUYUOC-JTQLQIEISA-N 427.168 4.670 50 10 IJGE ClC[C@@]12CCC[C@]1(CNc1ncc(I)cc1Br)C2 2086659250 UVYLBMLLLJOBCM-QWHCGFSZSA-N 441.538 4.660 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(CC2(CBr)CCCCCC2)CC1(F)F 2106786563 VGENFFAFRJVCNT-OAHLLOKOSA-N 439.385 4.956 50 10 IJGE CCC(CC)(CBr)CN1C[C@@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)OC(C)(C)C)C1 2106787551 ZUDZFKBLUNFTIZ-FJIDUMEYSA-N 429.443 4.765 50 10 IJGE CN(Cc1ccccc1NC(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2110716346 WTKACTZZJVWTCF-KRWDZBQOSA-N 425.367 4.946 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN(C[C@H](CBr)CC2CC2)C1 2112870048 ZGLHYTBCQUCLKP-IPMKNSEASA-N 429.443 4.909 50 10 IJGE O=C(C1CC1)[C@H](Br)Cc1ccc(C(F)(F)F)cc1I 2139266735 MURBEOCQCOPRQE-SNVBAGLBSA-N 447.032 4.595 50 10 IJGE O=C(N[C@@H]1C[C@H]2CC[C@H]1[C@H](Cl)C2)c1csc(Br)c1Br 2139711434 BKFLMBXOZPBNMT-AKEJEFCPSA-N 427.589 4.799 50 10 IJGE O=S(=O)(c1ccc(F)c(CCl)c1F)N(CCC(F)(F)F)Cc1ccccc1 2152211004 HFVKPBDKYFNESE-UHFFFAOYSA-N 427.822 4.847 50 10 IJGE Cc1csc(C(=O)N2C[C@]3(F)CCC[C@@]3(CBr)C2)c1Br 2176637690 WHNKPDOWRGEJPB-ZIAGYGMSSA-N 425.161 4.548 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCc2ccccc2N(CCCCI)C1 2248250692 RCIBZEUEXMUAGE-MRXNPFEDSA-N 444.357 4.548 50 10 IJGE CC12COC(CO[C@H](CI)c3ccc(Br)cc3)(C1)C2 2266254230 MSEKLLLQUDNGGC-WLYUNCDWSA-N 437.115 4.511 50 10 IJGE C[C@H]1CC[C@H](Br)CN1Cc1ccc(Cl)c(I)c1 2300238294 JDXRLXHALCYFLZ-ONGXEEELSA-N 428.539 4.692 50 10 IJGE N#CC(=Cc1ccccc1OCc1ccccc1F)C(=O)N1CCN(c2ccccc2)CC1 2313567169 HRMNQAJVMQPMDK-UHFFFAOYSA-N 441.506 4.660 50 10 IJGE COc1ccc2c(c1)c(C=C1Oc3c(ccc(OC(=O)C(Cl)Cl)c3C)C1=O)cn2C 2323758603 PBJQVHCBJGNUFA-UHFFFAOYSA-N 446.286 4.821 50 10 IJGE Cc1csc(C(=O)N2CC[C@H](Br)C[C@H]2C(F)(F)F)c1Br 2361457898 GSUUIEPIFSMVHP-YUMQZZPRSA-N 435.103 4.749 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2c(CBr)c(C(F)F)nn2C)C1 2365332644 JYFAUFRTDQJENX-LSDHHAIUSA-N 441.364 4.599 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCC([C@@H]2CCCN(C(=O)C(F)(F)F)C2)CC1 2382184981 SDOMWQFSUPQGHF-DOTOQJQBSA-N 441.376 4.557 50 10 IJGE Cc1ccccc1C(=O)Nc1ccc(C(=O)N/N=C/c2ccc(Br)cc2)cc1 12578617 WXPSOQCXCHNLCN-ZVHZXABRSA-N 436.309 4.774 50 10 IJGE CCOc1ccc(/C(C)=N/NC(=O)c2cc(-c3c(OC)ccc4ccccc34)n[nH]2)cc1 27520577 MDOKXRWSHAIJQB-WGOQTCKBSA-N 428.492 4.791 50 10 IJGE CC[C@@H]1CCC[C@@H](O[C@@](C)(CI)CNC(=O)OC(C)(C)C)C1 231317000 WIFIBBPYTSMREM-CPUCHLNUSA-N 425.351 4.690 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CI)[C@@H](c2ccc(CCl)cc2)C1 382696254 BBLABJHBLXIWAV-HUUCEWRRSA-N 435.733 4.811 50 10 IJGE COC1CCC(O[C@H](CI)c2cccc(Br)c2)CC1 686230067 AIBFVYDWROPWMK-YMAMQOFZSA-N 439.131 4.899 50 10 IJGE Brc1cnc(N2CC[C@H]3CC[C@@H](Br)[C@H]2C3)c(Br)c1 687601473 QXOPQLBMMQPVIN-HLUHBDAQSA-N 438.989 4.749 50 10 IJGE CC[C@@H](Oc1ccccc1C(C)C)C(=O)NNC(=O)c1ccc(COc2ccccc2)o1 729966310 HUEVXSYUKWAPMW-OAQYLSRUSA-N 436.508 4.601 50 10 IJGE C=CC[C@]1(C(=O)NNc2ccc(Br)cc2C)CCCN1C(=O)OC(C)(C)C 1151480699 RSDLPCSEPLRHGA-HXUWFJFHSA-N 438.366 4.546 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cc(Cl)ccc2SC(C)C)cc1 1200243354 GVMVVBWGBIDVLX-AWEZNQCLSA-N 449.960 4.663 50 10 IJGE Cc1cccc(Cl)c1NNC(=O)CSCc1nc(O)c2c3c(sc2n1)CCCC3 1449701511 IPWQBDQXHKVTEG-UHFFFAOYSA-N 449.001 4.614 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@@H](COC(=N)O)Cc2ccccc2)c(C)n1C1CCCCC1 1469026294 UKWYHRHXWLORBB-VKIDYWOHSA-N 448.567 4.754 50 10 IJGE CC[C@H]1CN(C[C@H](CBr)C2CC2)[C@H](CC)CN1C(=O)OCc1ccccc1 1615577198 FOKQUWRUKPDZTP-HBMCJLEFSA-N 437.422 4.919 50 10 IJGE Cn1cc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccn2)c2ccccc21 1865699297 PUUFXNOLANOKLO-QHCPKHFHSA-N 444.498 4.644 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)[C@H](C)Oc3ccc(Cl)cc3)c(C)n2)cc1C 1865756090 FWWDGQZGEXAODE-KRWDZBQOSA-N 437.927 4.556 50 10 IJGE C[C@H]1[C@H](OC2(CI)CCN(C(=O)OC(C)(C)C)CC2)CC1(C)C 1901818115 FRIGVPBAHSLATE-UONOGXRCSA-N 437.362 4.642 50 10 IJGE COc1ncc(Br)c(C)c1CN(Cc1ccccc1)[C@H](C)CBr 1902484665 PFAYVANZCYLNSY-CYBMUJFWSA-N 442.195 4.947 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)c1ccc(I)cn1 1915086910 OLBOSDYUUWQJTP-CQSZACIVSA-N 445.142 4.866 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cc(F)c(Cl)cc1F 1916334154 CTTXUXVWXSAHHF-ZDUSSCGKSA-N 432.692 4.671 50 10 IJGE Brc1ccccc1[C@H](CI)O[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21 1917452885 ILZHNYBOVDSZAP-AUSPFATMSA-N 433.127 4.986 50 10 IJGE C[C@H]1OCC[C@@]1(CBr)Cc1ccc(Br)cc1Br 1943843257 IBDQAOHCVKIUQI-RNCFNFMXSA-N 426.974 4.944 50 10 IJGE O=C(c1csc(Br)c1Br)N(CCCBr)C1CC1 1945186986 PBGUJOQCROAVLJ-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE CC[C@@H](NC(=O)c1c(Br)cccc1Br)[C@H](C)Br 1945321854 JAWXQZLYKKISMC-OIBJUYFYSA-N 427.962 4.503 50 10 IJGE C[C@@H](CCCBr)NC(=O)c1c(Br)cccc1Br 1945333315 OFVVQWONPAQBHV-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE C[C@H]1C[C@H](Br)CN(Cc2cc(Br)ccc2Br)C1 2006497154 QJYUCIKZJWERBG-CABZTGNLSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC[C@H]2CC23CCCC3)C1 2021267936 SSBNDZIEGMSZMA-BEFAXECRSA-N 449.373 4.788 50 10 IJGE C[C@@H]1CCN(Cc2ccc(I)c(Cl)c2)C[C@H]1Br 2026560972 OHSXJHICNRKRES-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE Brc1cccc(CN2C[C@@H]3CC[C@H](Br)[C@H]3C2)c1Br 2031477595 MTBGMJXFWZPEPC-DLOVCJGASA-N 438.001 4.817 50 10 IJGE BrC[C@H]1[C@H]2CN(Cc3cccc(Br)c3Br)CC[C@H]21 2032219308 HRFXNGCYKFOUCA-TUAOUCFPSA-N 438.001 4.674 50 10 IJGE Cc1c([C@H](Br)Cc2cccc(Br)c2)nn(C)c1Br 2049254827 BWGRIHZTVHHSEK-LLVKDONJSA-N 436.973 4.932 50 10 IJGE O=C(CBr)c1c(Br)ccc(Br)c1OC(F)(F)F 2054920995 CBIBCRDDPUQYRB-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE COc1ccc(C(CCNC(=O)C(C#N)=Cc2ccccc2)c2ccc(OC)cc2)cc1 2077542588 HBQJKJWWSMTBKF-UHFFFAOYSA-N 426.516 4.949 50 10 IJGE ClCCc1nc2cc(Br)ccc2n1Cc1nccn1Cc1ccccc1 2090021960 QZWDMVURJCEVPU-UHFFFAOYSA-N 429.749 4.873 50 10 IJGE O=S1(=O)CCCC[C@@H]1[C@@H](Br)c1cc(C2CC2)c(Br)s1 2094674344 UTZUKEVJJKCPFX-NEPJUHHUSA-N 428.211 4.791 50 10 IJGE CN(Cc1ccccc1)CC(C)(C)n1c(CCCl)nc2cncc(Br)c21 2095448706 YBGCYSPOLJIQMB-UHFFFAOYSA-N 435.797 4.842 50 10 IJGE Brc1ccc(Br)c([C@@H](Br)[C@@H]2CCn3ncnc3C2)c1 2108964069 ANFWJJNSZCVDGW-OQPBUACISA-N 449.972 4.502 50 10 IJGE Brc1ccc(Br)c([C@@H](Br)[C@H]2CCn3ncnc3C2)c1 2108964070 ANFWJJNSZCVDGW-SDBXPKJASA-N 449.972 4.502 50 10 IJGE Cn1ncc(Cl)c1COc1c(Br)cc(Cl)cc1CBr 2111948716 OZPVSVDIUUXKBO-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE CCN(CC)CCCO[C@H](CI)c1ccccc1Br 2119264409 PULLTTAWOOMGEM-OAHLLOKOSA-N 440.163 4.674 50 10 IJGE CC(C)(CBr)CN1C[C@H](CNC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2129068442 QSPIRYBIWUHCCK-ROUUACIJSA-N 425.411 4.648 50 10 IJGE CC1(C)[C@H](CBr)OCCN1Cc1ccc(Cl)c(Br)c1F 2166823816 OWNUWUXYNCHZKU-NSHDSACASA-N 429.555 4.616 50 10 IJGE CCOCc1cc(Br)c([C@H](Br)c2c(Cl)cnn2C)s1 2224797559 YXUGRCJLAOUXIS-SNVBAGLBSA-N 428.577 4.918 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@H]1CC2(CCCC2)CCN1C(=O)OC(C)(C)C 2237000483 DFMUNNQMUSCUJB-BRWVUGGUSA-N 443.426 4.578 50 10 IJGE COc1ccc(CBr)c(N(C)[C@@H]2C[C@@H]3C[C@H](OCc4ccccc4)C[C@H]32)n1 2239875665 BEQCAULSAXHUSB-VNTMZGSJSA-N 431.374 4.805 50 10 IJGE CN(Cc1ccc(I)cc1)c1ccc(F)cc1CBr 2265605568 RTSMNAWVWAQEFG-UHFFFAOYSA-N 434.090 4.962 50 10 IJGE CC(C)(C)C1(O[C@@H](CI)c2ccc(Br)cc2)COC1 2272932809 YIMBHMVZYVWNPX-ZDUSSCGKSA-N 439.131 4.757 50 10 IJGE CCn1c(SCC(=O)NN=CC(Cl)=Cc2ccccc2)nnc1-c1ccc(C)cc1 2293749601 ZXQAORULRONPBA-UHFFFAOYSA-N 439.972 4.747 50 10 IJGE CC(C)c1cccc(CO[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2I)c1 2303761756 GXXWBWKMBGIANK-SJORKVTESA-N 445.341 4.750 50 10 IJGE C=CC[C@H](Br)[C@H]1CCN1Cc1ccc(I)c(Cl)c1 2314255350 SXHICLSCQXDKQW-SMDDNHRTSA-N 440.550 4.859 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc(OCC)cc2)sc2c1CC[C@H](C)C2 2314735324 QXBFSGIKYGFNIP-HNNXBMFYSA-N 438.549 4.994 50 10 IJGE BrCC1(COc2cc(Br)cc(Br)c2)CCOCC1 2316726061 LZNRQISUIIIURX-UHFFFAOYSA-N 442.973 4.782 50 10 IJGE C[C@@H](CCCCBr)NC(=O)c1ccc(Cl)cc1I 2317770484 HGTJLOZKQZQNDW-VIFPVBQESA-N 444.538 4.628 50 10 IJGE CN(C(=O)C(C#N)=Cc1ccccc1)c1nnc(-c2ccc(Br)cc2)s1 2322378782 DFQGQESBMPNEKA-UHFFFAOYSA-N 425.311 4.538 50 10 IJGE ClC[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(I)c(Br)c1 2325203212 BWLYUSDRDHOPBL-WDMOLILDSA-N 440.550 4.645 50 10 IJGE Cl[C@@H]1CCN(Cc2ccc(I)c(Br)c2)[C@H]2CC[C@H]21 2325210328 XBDHHWMVJJIKLD-SUHUHFCYSA-N 440.550 4.645 50 10 IJGE N#CC(=Cc1cccc(Cl)c1)C(=O)NC[C@@H](c1c(F)cccc1Cl)N1CCCC1 2329684268 WEWCLZRDIALLEK-FQEVSTJZSA-N 432.326 4.993 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)CCCN3C(=O)c4ccccc4C3=O)n2)cc1 2331273677 MTJKDPPBYOXUAH-UHFFFAOYSA-N 445.500 4.688 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@H]2CC(Cl)C[C@@H](C2)C1 2338793749 ZIPHQKDPNJZDBN-HTQZYQBOSA-N 427.589 4.753 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)c1 2340264905 WQYJMKKKUJCBHJ-IRXDYDNUSA-N 435.793 4.954 50 10 IJGE C[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@H](CCBr)COCc1ccccc1 2343704073 FJNPDRSSGYCHFV-CRAIPNDOSA-N 440.765 4.594 50 10 IJGE CC[C@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)COc1ccc(Cl)cc1Cl 9871836 RXOJYLYEPKGGKC-KBPBESRZSA-N 439.339 4.501 50 10 IJGE COc1cc(OC)c([C@H]2C(C#N)=C(N)Oc3ccc4ccccc4c32)cc1Br 12575423 YHVMUFWKJGPIET-FQEVSTJZSA-N 437.293 4.838 50 10 IJGE CCCCCOc1ccc(C(=O)NNC(=O)c2ccc(OCc3ccccc3)cc2)cc1 14029526 TYLDSALXDKBIIN-UHFFFAOYSA-N 432.520 4.909 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] 33930208 NAFMGPRRQGNLGU-LCYFTJDESA-N 438.783 4.962 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)N(c2cc(C)ccc2C)S(=O)(=O)c2ccccc2)cc1 40971406 ORGOLFFESMPJAC-LTGZKZEYSA-N 446.528 4.641 50 10 IJGE O=C(O)c1ccc(COc2ccccc2/C=N/NC(=O)c2cc(F)c(F)cc2Cl)cc1 59160631 LVXGMJJXBNXQHU-KBKYJPHKSA-N 444.821 4.659 50 10 IJGE Cc1ccccc1SCC(=O)N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21 59166989 CMKVKKBQCKKQAN-VYIQYICTSA-N 449.963 4.808 50 10 IJGE O=C1COc2ccc([C@H](Cl)c3cc(Br)ccc3Br)cc2N1 161071413 ICTMADVLTHUAPS-HNNXBMFYSA-N 431.511 4.871 50 10 IJGE C[C@@H]1CC(O[C@@H](CI)c2ccc(Br)cc2)C[C@@H](C)O1 162584491 FNYCRCULNQUCNT-HFAKWTLXSA-N 439.131 4.898 50 10 IJGE N#C/C(=C/Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)NCCc1ccc(O)cc1 217180657 JLAODFGWWQTEDB-QBFSEMIESA-N 443.347 4.608 50 10 IJGE CCn1c(SCC(=O)NN=C/C=C/c2ccco2)nnc1-c1ccc(C(C)(C)C)cc1 254850376 YCOARULTPCXJPJ-JHCSHHCCSA-N 437.569 4.763 50 10 IJGE CCCCOc1ccccc1C=NNC(=O)CSc1nnc(-c2ccccc2)s1 256028529 SOJPHOCUMYRLFT-UHFFFAOYSA-N 426.567 4.626 50 10 IJGE C[C@]1(CBr)CCN(Cc2cc(Cl)ccc2I)C1 405348770 SHBOEHNUIURIFG-CYBMUJFWSA-N 428.539 4.552 50 10 IJGE FC(F)Oc1c(I)cc(CBr)cc1C(F)(F)F 575723660 SFUVUDASWMQDSV-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE CC1CCC(O[C@@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)CC1 685992974 OBTBSYXVSLBDLP-JTTJXQCZSA-N 437.362 4.786 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@H]1Cn1c(CCl)nc2cc(Br)cnc21 708510693 UVRWHLIDYKJWRK-ZBFHGGJFSA-N 433.781 4.701 50 10 IJGE Cc1ccc(C=NNC(=O)CSc2nnc(-c3ccccc3)n2-c2ccccc2)c(C)c1 725432423 IMJOKYUVBYRDGP-UHFFFAOYSA-N 441.560 4.794 50 10 IJGE Cc1ccccc1OCC(=O)NN=Cc1cc(C)n(-c2ccc(Br)cc2)c1C 725434813 QUPCPBOBZVSEOG-UHFFFAOYSA-N 440.341 4.694 50 10 IJGE CC(=O)N(C)c1cccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccccc3C)c2C)c1 744772421 HYEPWUYFDZRHSJ-HYARGMPZSA-N 426.520 4.931 50 10 IJGE CC(/C=C(/C#N)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O)=C\c1ccc(Cl)cc1 753716332 YDMOKJIQYZVUGX-WXEMXXEISA-N 432.911 4.630 50 10 IJGE CC(C)c1nnc2n1CCN(S(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1)[C@H]2C 784043047 PRHBSEQUIRKZHH-NSHDSACASA-N 446.467 4.824 50 10 IJGE O=S(=O)(NCc1ccnc(OC(F)F)c1)c1cccc(S(F)(F)(F)(F)F)c1 790445082 HWAZFMXZDBLUHS-UHFFFAOYSA-N 440.362 4.819 50 10 IJGE O=C(NN=Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)c1nnc(-c2ccccc2)o1 920384931 FWMFLJVVTUFLDN-UHFFFAOYSA-N 443.410 4.643 50 10 IJGE C#C[C@H](NC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2)c1ccc(Cl)cc1 1478897126 SRVAOYNKPZWTLU-WMZOPIPTSA-N 444.000 4.871 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNC(=S)Nc2cc(C)ccc2C)cc1 1628555688 SCNSVYSEDUSDKY-UHFFFAOYSA-N 432.549 4.881 50 10 IJGE O=C(Cc1csc(-c2ccc(Cl)s2)n1)NNc1nc2ccccc2[nH]c1=S 1633440331 XPBPDDFPAPZOHH-UHFFFAOYSA-N 433.971 4.817 50 10 IJGE C/C(=N\NC(=O)c1ccc(-c2ccc(Cl)c(Cl)c2)nc1C)c1ccc(O)c(O)c1 1865763621 UTFFXOSBFGHVQR-OPEKNORGSA-N 430.291 4.929 50 10 IJGE O=C(N[C@@H](CCl)[C@@H]1CC=CCC1)c1cc(Br)c(Br)s1 1885070344 VOKSSLRTKOORED-SCZZXKLOSA-N 427.589 4.967 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OCC[C@@H]1CC[C@H]1C1CC1 1902509135 RCBJNEOWWNZXMI-MPGHIAIKSA-N 437.362 4.548 50 10 IJGE CC(C)C[C@H](CNC(=O)OC(C)(C)C)[C@H]1CC[C@](C)(CI)O1 1931099595 QHFPIFAWHCJHEL-CKEIUWERSA-N 425.351 4.546 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]3(CC[C@@](C)(CI)O3)C[C@H]21 2001952403 RDNNIRCHJFVSKB-LTDCPUDJSA-N 449.373 4.929 50 10 IJGE C[C@@H]1[C@H](CBr)CCN1Cc1ccc(I)c(Cl)c1 2026567578 SZKBRVITLNSZFL-KOLCDFICSA-N 428.539 4.550 50 10 IJGE CC[C@@H](C)[C@@H](Br)CNC(=O)c1c(Br)cccc1Br 2033090826 JTPDQFZMZUPLEQ-KCJUWKMLSA-N 441.989 4.751 50 10 IJGE CCC[C@H](CBr)CN1CCC[C@H](N(CC(F)F)C(=O)OC(C)(C)C)C1 2044699108 HYUNENMNPYNHKQ-CABCVRRESA-N 427.374 4.764 50 10 IJGE C[C@H]1CN(Cc2cc(Cl)ccc2I)CC[C@@H]1CBr 2046687349 RKIFUCSUDQEKLB-WDEREUQCSA-N 442.566 4.798 50 10 IJGE Clc1ccc(I)c(CN2CC[C@@H](Br)[C@H]2C2CC2)c1 2067022574 WXQGATGZAUUAMG-TZMCWYRMSA-N 440.550 4.692 50 10 IJGE BrCc1cc(Br)cc(Br)c1OC[C@]12C[C@H](CO1)C2 2073833547 SQGADGUHECKKPN-KTLJEJPDSA-N 440.957 4.664 50 10 IJGE FC(F)(F)c1cc(Br)nc(-n2nc3c(c2CBr)[C@@H]2C[C@H]2C3)c1 2080648134 OERORICAVKLHCA-POYBYMJQSA-N 437.057 4.603 50 10 IJGE C[C@@H](NC(=O)N1CCC(Br)CC1)c1ccc(NC(=O)OC(C)(C)C)cc1 2106196128 UFXYYSAAAPYJSO-CYBMUJFWSA-N 426.355 4.664 50 10 IJGE C[C@H]1CC[C@H](CNC(=O)C(F)(F)F)N(CC2(CBr)CCCCCC2)C1 2106783847 CZEUHANRWHKHQT-LSDHHAIUSA-N 427.349 4.501 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@@H](CBr)c2ccccc2)CC1(C)C 2106788168 NMXSHDHQLUOMHL-QZTJIDSGSA-N 425.411 4.648 50 10 IJGE C[C@@H]1C[C@H](C(F)(F)F)N(C[C@@H](CBr)C2CC2)CCN1C(=O)OC(C)(C)C 2121769788 ASSPKMRJQWOOMD-BPLDGKMQSA-N 443.348 4.670 50 10 IJGE CC(C)[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(OCCBr)cc1 2123267722 BBYSOYZIARSODJ-QGZVFWFLSA-N 440.403 4.696 50 10 IJGE O=C(N[C@@H](CCl)Cc1ccccc1)c1csc(Br)c1Br 2150344222 GAGUHVGYMGZEDB-SNVBAGLBSA-N 437.584 4.853 50 10 IJGE CCC[C@@H]1CCCN(S(=O)(=O)c2cc(CBr)sc2Br)C1 2179792184 CLPLSJFCOOWEJC-SNVBAGLBSA-N 445.242 4.606 50 10 IJGE Cc1nscc1C[C@@H](Br)c1c(F)cccc1I 2247948553 BPNDNFAMCRUZLT-SECBINFHSA-N 426.092 4.874 50 10 IJGE CC(=O)Nc1ccc(Oc2cccc(C3CCN(C(=O)[C@@H](Cl)C(C)C)CC3)n2)cc1 2296578132 LFPFYQSKZGEOCI-QFIPXVFZSA-N 429.948 4.802 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1Cc1ccc(Cl)cc1I 2302326758 SPDNBSMZWNFVBW-MWLCHTKSSA-N 428.539 4.692 50 10 IJGE Cc1cc(Br)c([C@@H](Br)[C@H]2OCCO[C@H]2C)cc1Br 2308098081 UNDZQPAUBORDOP-CKLFPEKLSA-N 442.973 4.760 50 10 IJGE Cc1c(F)ccc(CO[C@@H](CCl)[C@H](I)CCl)c1Cl 2317183800 NJJQHVKSGAFZQB-MNOVXSKESA-N 425.496 4.954 50 10 IJGE N#CC(=Cc1ccc(OC(=O)CN2C(=O)c3ccccc3C2=O)cc1)c1cccc(Cl)c1 2320506558 MHFZHPBPODKOFW-UHFFFAOYSA-N 442.858 4.606 50 10 IJGE CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1ccc(OCc2ccccc2)cc1 2328822730 IMIMEZZKMHXJMT-QFIPXVFZSA-N 439.556 4.655 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCN(CC2(CBr)CC2)[C@@H](C(F)(F)F)C1 2337585167 JLNJOAQTNHFDTI-ZIAGYGMSSA-N 443.348 4.719 50 10 IJGE FC(F)(F)[C@H]1C[C@]1(CCl)CNCc1ccc(Cl)c(I)c1 2362371371 PTQTZARHQVTGQM-RYUDHWBXSA-N 438.058 4.842 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@]2(CBr)CC2(F)F)[C@H](c2ccccc2)C1 2379985467 ILNNBAJAMQEZJV-LPHOPBHVSA-N 445.348 4.701 50 10 IJGE O=C(N/N=C/c1ccc2ccccc2c1)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 27520015 JAKZIMBUBOTKAV-WGOQTCKBSA-N 438.443 4.764 50 10 IJGE O=C(CBr)Nc1ccc(Cl)cc1C(=O)c1cccc(Br)c1 28166873 ZICOANYDJBMVHS-UHFFFAOYSA-N 431.511 4.667 50 10 IJGE Cc1c(C(=O)N2CCCCC2)oc2c1/C(=N/NC(=O)c1cccc3ccccc13)CCC2 40813573 LLWGRHZVEZNMFB-SZXQPVLSSA-N 429.520 4.838 50 10 IJGE COc1ccc(C(=O)N/N=C/c2ccc(Sc3cccc4cccnc34)o2)cc1OC 59383736 MLEZOWMUDJKKMX-AFUMVMLFSA-N 433.489 4.760 50 10 IJGE C[C@H](NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)c1ccc(C(C)(C)C)cc1 71997210 YGAFMQKQOWQLFZ-KRWDZBQOSA-N 435.524 4.861 50 10 IJGE CCOc1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(NC(C)=O)cc3)c2C)cc1 97610454 MPPVBQQNCDWNPU-RCCKNPSSSA-N 442.519 4.997 50 10 IJGE Cc1cc(Br)ccc1N/C=C(/C#N)C(=O)Nc1ccc(Br)cc1 216793766 JQAUDMKINNXZBU-BENRWUELSA-N 435.119 4.978 50 10 IJGE Cc1cc(I)ccc1NC(=O)/C(C#N)=C\Nc1cccc(C)c1C 217253887 CJGLUVKDQWCQSU-PTNGSMBKSA-N 431.277 4.675 50 10 IJGE Clc1ccc([C@H](Br)c2cc(I)cc3c2OCC3)o1 302477251 GYEDZLYPXHXBOD-GFCCVEGCSA-N 439.474 4.957 50 10 IJGE CN(CCCOCc1ccccc1)S(=O)(=O)c1cc(Cl)cc(CCl)c1Cl 383878302 FKLOTEJUPKNIOH-UHFFFAOYSA-N 436.788 4.960 50 10 IJGE CC1(C)CN(C(=O)c2cc(Br)c(Br)s2)C[C@@H]1Br 387912600 VZLHFMDEGYGHNK-QMMMGPOBSA-N 446.002 4.519 50 10 IJGE Clc1ccc(CBr)c(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@@H]32)c1 404140901 FRZMKWZBIOKUCK-SFTDATJTSA-N 435.793 4.715 50 10 IJGE Fc1ccc2nc(CCl)n(Cc3cnn(Cc4ccccc4)c3)c2c1Br 689712189 TUCWTBTZUDLKMP-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@@]1(C)CN(c1ncc(CCl)cc1Br)C2 705899505 ZKZGEYUEBORDDW-SFTDATJTSA-N 434.809 4.931 50 10 IJGE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NNc1ccccc1C(F)(F)F 742517082 ZEVQBWDXSLAPIR-UHFFFAOYSA-N 431.443 4.630 50 10 IJGE Cc1ccnc(C2CCN(C(=O)/C(C#N)=C/c3cc(C)n(-c4ccccc4F)c3C)CC2)n1 754539609 PVVTXHNVHHZNDE-PXLXIMEGSA-N 443.526 4.645 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)nn1)/C(=C\c1ccc(Cl)cc1)c1ccc(F)cc1 755197178 ALKWWJCDSOCCEL-WJDWOHSUSA-N 436.796 4.972 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNc1ccc(Br)c(F)c1)O[C@@H](C)C2 771678488 FSUDFVCKSGFSPG-PJODQICGSA-N 449.320 4.557 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccnc(Oc3ccc(F)cc3F)c2)c(C(F)(F)F)c1 799752860 VSYTXNWPWZGFJT-UHFFFAOYSA-N 434.324 4.799 50 10 IJGE CC(C)(C)Sc1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1 799841917 RKTFAFZNXRNCEA-UHFFFAOYSA-N 436.459 4.549 50 10 IJGE CC(C)OCc1ccc(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cc1 919996424 FYOQRVLKPQEDQW-JCMHNJIXSA-N 439.519 4.934 50 10 IJGE Cc1ccc(-n2nc(C)c(C=NNC(=O)COc3ccc(Cl)cc3Cl)c2C)c(C)c1 1084556891 VUHAPDOEJHDABE-UHFFFAOYSA-N 445.350 4.942 50 10 IJGE CC(=O)c1cc(F)c(O)c(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(C)cc3)c2C)c1 1156194098 JAENMYMNDWAUOP-JMIUGGIZSA-N 431.467 4.996 50 10 IJGE C#Cc1ccccc1CC(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12 1629372170 ATWPJONPDPSNJK-UHFFFAOYSA-N 439.902 4.540 50 10 IJGE C[C@H](NC(=O)COc1cccnc1NC(=O)Nc1ccc(SC#N)cc1)c1ccccc1 1858842026 FUVGYOFJHJUGCX-INIZCTEOSA-N 447.520 4.555 50 10 IJGE CCc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689174 LNPQECHYYTYXRA-IBGZPJMESA-N 441.318 4.724 50 10 IJGE N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1cccc(OCc2ccc(Cl)cc2Cl)c1 1873793309 IEWXXFNGTPTESG-VATWTLTGSA-N 442.346 4.593 50 10 IJGE C[C@@H]1CN(Cc2cc(Br)ccc2Br)C[C@H]1CBr 1907415957 MNHNAXLTHBIPJK-MWLCHTKSSA-N 425.990 4.674 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cccc(Cl)c1 1915291771 RURDCUGHABTLEO-GOSISDBHSA-N 430.795 4.950 50 10 IJGE Brc1cccc(Br)c1[C@@H]1CC[C@H](CI)O1 1931393615 BJPZZFPHTQEYAV-XCBNKYQSSA-N 445.920 4.867 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1C(=O)c1cccc(Br)c1Br 2031477189 KEWSTGSMDWROOC-BDAKNGLRSA-N 439.973 4.600 50 10 IJGE Brc1cccc(CN2CC[C@@H](Br)C3(CC3)C2)c1Br 2032267148 VXQONKOJKBZYRV-GFCCVEGCSA-N 438.001 4.961 50 10 IJGE CC1(C)[C@H](CBr)CCN1Cc1cc(Cl)ccc1I 2034137778 PFWWOVYMYGYFDL-NSHDSACASA-N 442.566 4.940 50 10 IJGE O=C(N[C@H](CBr)CC(F)(F)F)c1cc(Br)c(Cl)s1 2052453384 INXLFOQUDXJWAF-BYPYZUCNSA-N 429.483 4.610 50 10 IJGE CCC(CBr)(CBr)NC(=O)Cc1c(Cl)cccc1Cl 2104773021 QSIHCJIMRCPXKP-UHFFFAOYSA-N 431.983 4.591 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](OC)C[C@H]1CNC(=O)OC(C)(C)C 2106787422 IWJPPMUBZUOVAW-IRXDYDNUSA-N 435.447 4.582 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1cccc(F)c1Br 2117895281 QPTANTQWRSZZLP-SNVBAGLBSA-N 442.110 4.702 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@H]1Br)c1cc(Br)c(Cl)s1 2172565359 UEJDKWYMQGUCLA-BXKDBHETSA-N 435.568 4.955 50 10 IJGE Cc1ccc(I)c(C(=O)NC[C@H](Br)CC(C)(C)C)c1 2232158845 ZIVLRFDJPJHQMX-LLVKDONJSA-N 438.147 4.529 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC[C@H]2CCC2(C)C)C1 2243127475 OLBLHEXNBVMUSY-KDOFPFPSSA-N 437.362 4.644 50 10 IJGE COc1ccc([C@@H](Cl)c2cn(C)nc2Br)c(Br)c1Cl 2268266046 MZDJAJMXCSSUTP-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(OC2(C3CCCCC3)COC2)CC1 2272933941 XKJLXPQBJKNAPJ-UHFFFAOYSA-N 432.399 4.517 50 10 IJGE CCn1nc(C)c(CBr)c1N1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1 2281295524 IWHZVNQEFLESLJ-FPOVZHCZSA-N 431.422 4.597 50 10 IJGE COc1cc(F)c(CBr)c(N2C[C@H]3C[C@@H](CN(Cc4ccccc4)C3)C2)c1 2283359825 IKMZNQSJLRVBJS-ROUUACIJSA-N 433.365 4.688 50 10 IJGE O=C(N[C@H]1CC[C@H](CBr)CC1)c1cc(Br)c(F)cc1Cl 2285956634 ISZIKTOCKFNOQE-KYZUINATSA-N 427.539 4.925 50 10 IJGE COc1cc(C=C(C#N)C(N)=O)c(Br)cc1OCc1cccc2ccccc12 2293826904 ALIHKHUIHWUCDV-UHFFFAOYSA-N 437.293 4.582 50 10 IJGE Cc1ccc(C)c(OCCn2cc(C=C(C#N)C(=O)NC[C@@H]3CCCO3)c3ccccc32)c1 2297456347 KIWJGDMDRPTPRV-QHCPKHFHSA-N 443.547 4.539 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Cl)cc2I)[C@@H]1CBr 2302314873 BWSPETBNJMONGD-NOZJJQNGSA-N 428.539 4.550 50 10 IJGE CC1(C)[C@@H](Cl)C[C@H]1NCc1ccc(I)c(Br)c1 2306216932 LIGXDCGTZHIVFP-NWDGAFQWSA-N 428.539 4.549 50 10 IJGE CC[C@@](C)(CCCl)NCc1ccc(I)c(Br)c1 2306232841 ZJEDVJRXRCROTG-ZDUSSCGKSA-N 430.555 4.941 50 10 IJGE C=CCc1cc(C=C(C#N)C(=O)Nc2cccc(Cl)c2Cl)ccc1OCC(=O)OC 2313570935 JMOWPVZVBKEIMJ-UHFFFAOYSA-N 445.302 4.819 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Br)Cc1ccccc1F 2316702137 WBOSZOYOQBMCME-MRVPVSSYSA-N 440.936 4.763 50 10 IJGE O=C(Cc1c(F)cccc1Cl)N[C@H](CCBr)COCc1ccccc1 2320358066 JEWBGIRRVGNJBI-OAHLLOKOSA-N 428.729 4.508 50 10 IJGE CC(C)N1C[C@@H](Cl)[C@@H](Cc2ccc(I)c(Br)c2)C1 2325209928 SXMYQBBEADDLON-WCQYABFASA-N 442.566 4.544 50 10 IJGE CN(C)c1ccc([C@@H](CNC(=O)C(C#N)=Cc2ccc(Cl)cc2)N2CCCCC2)cc1 2329647014 IGWYAECQDFZNLD-XMMPIXPASA-N 436.987 4.656 50 10 IJGE C=CCOc1ccccc1OCC(O)=C(C#N)c1nc(-c2ccc3c(c2)OCO3)cs1 2331335650 BERVBRGKZRXLIJ-UHFFFAOYSA-N 434.473 4.975 50 10 IJGE FC(F)(CCl)C(F)(F)CNCc1ccc(Cl)c(I)c1 2337222370 ZDNRIJGEASOIQL-UHFFFAOYSA-N 430.010 4.544 50 10 IJGE COc1ccc(Cl)cc1[C@@H](Cl)c1c(Br)c(Br)nn1C 2338723446 XGMNIRKGYPXJSG-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE COc1ccc(OC)c(-c2cc(C(=O)NN=Cc3ccc(F)cc3)c3ccccc3n2)c1 13108498 YPWLIOLESMTHEU-UHFFFAOYSA-N 429.451 4.822 50 10 IJGE O=C(COc1ccc(Cl)cc1Br)N/N=C/c1cccc(C(F)(F)F)c1 14017353 XVQDCUXNRBLLHK-GZIVZEMBSA-N 435.627 4.650 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4)ccc32)cc1 38650584 KRJIMCNVRKUGFK-DEOSSOPVSA-N 426.472 4.913 50 10 IJGE Cc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)N4CCc5ccccc5C4)c(C)c32)cc1 40804689 MJFSJKKXKUDPHQ-XAYXJRQQSA-N 441.531 4.565 50 10 IJGE CCc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1cccc(OC)c1)CCC2 40822215 LSFYNMMGTAEIAV-SGWCAAJKSA-N 445.519 4.882 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NCCc2ccccc2)ccc1OCCc1ccccc1 206487263 PDDQKMNISXONKX-HKOYGPOVSA-N 426.516 4.583 50 10 IJGE O=C(NN=Cc1cn(Cc2ccccc2)c2ccccc12)c1cc(Br)ccc1O 252594081 BPHSAJSKKRBYRS-UHFFFAOYSA-N 448.320 4.922 50 10 IJGE Cc1ccc(NC(=O)CCC(=O)NN=Cc2ccccc2OCc2ccccc2)c(C)c1 254413765 BBHHNDARWNVENZ-UHFFFAOYSA-N 429.520 4.751 50 10 IJGE CSc1ccc(C=NNC(=O)CSc2nnc(SCc3ccccc3)s2)cc1 254817186 RIUDMPGRDCSJQA-UHFFFAOYSA-N 446.648 4.795 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccc(F)cc1Br)[C@@H](Br)C2=O 256021982 JIXINVSTZOYWAU-VUCTXSBTSA-N 447.142 4.686 50 10 IJGE CC(C)Cc1ccc([C@H](Br)c2cnn(C)c2I)cc1 379139572 ADWXBKPEEKGJAH-AWEZNQCLSA-N 433.131 4.708 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@H]1Cl)c1cc(Br)sc1Br 379725108 KRGDFAIUKUNJMY-PWSUYJOCSA-N 435.568 4.908 50 10 IJGE O=C(CBr)c1c(OC(F)(F)F)ccc(Br)c1OC(F)F 575687346 QVOJOLFAVKMLRR-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE O=C(CBr)c1cc(Br)c(Br)cc1Br 575715161 SYZMPUZAPQVPGB-UHFFFAOYSA-N 435.735 4.552 50 10 IJGE CC[C@@](C)(CCCl)NC(=O)c1ccc(I)c(Br)c1 721606910 XTVXVZSSBJUABO-ZDUSSCGKSA-N 444.538 4.581 50 10 IJGE Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)c3c[nH]c4cc(Cl)ccc34)cc2)cc1 726980674 FGNZPGWUCJQUPD-UHFFFAOYSA-N 439.924 4.719 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2csc(-c3ccc(Cl)s3)n2)c1C 736697310 WDMMCVTZKJQNBG-UHFFFAOYSA-N 442.957 4.751 50 10 IJGE O=C(NNc1ccc(OCC(F)(F)F)cc1)c1cc2c(Br)cccc2[nH]1 748702141 MAOVIHXIMPDLTQ-UHFFFAOYSA-N 428.208 4.628 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNC(=S)Nc2ccc(C)cc2C)cc1 1135697123 RLVFEIGWFUKBFP-UHFFFAOYSA-N 432.549 4.881 50 10 IJGE C=CC[C@@H](C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1 1623476686 GNVATAHFICSZKJ-HSZRJFAPSA-N 436.515 4.660 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNc2cc(Cl)ccc2[N+](=O)[O-])s1 1624407671 IRJSECKMHFTLRI-UHFFFAOYSA-N 433.342 4.544 50 10 IJGE C=CCCC[C@@H](NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)c1ccccc1 1687449526 CXZCZDDNBFDXHZ-JOCHJYFZSA-N 433.508 4.900 50 10 IJGE Cc1c(C(=O)N2CCC(C)CC2)oc2c1C(=NNC(=O)c1cccc(Cl)c1)CCC2 1772746210 RYHKJUWRZXDEQC-UHFFFAOYSA-N 427.932 4.584 50 10 IJGE COc1cc(C=NNC(=O)COc2c(C)cccc2C)ccc1OCc1ccc(C)cc1 1772754797 VRYIBMDQJNROIR-UHFFFAOYSA-N 432.520 4.729 50 10 IJGE COc1ccc(-c2nn(Cc3ccc(C)cc3)c3c2[C@@H](c2ccncc2)C(C#N)=C(N)O3)cc1 1865701811 GALGSMIEYRIMNX-QHCPKHFHSA-N 449.514 4.529 50 10 IJGE CCCn1nc(CC)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(OCc2ccccc2C)cc1 1865703213 QEJWDNYOUCFBBS-QHCPKHFHSA-N 428.536 4.961 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3-c2ccc(Br)cc2)cc1 1865707155 PFOHVYZAQCTQJI-HXUWFJFHSA-N 449.352 4.978 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@H]2[C@H]3OCCC[C@@H]32)s1 1900923825 FKMLNWNCUULRNE-NZENMJELSA-N 433.536 4.867 50 10 IJGE CC[C@@H](C)[C@@H](Br)CNC(=O)c1cc(Br)c(Br)s1 1942802876 HMRCODBNKSTQPO-SVRRBLITSA-N 448.018 4.813 50 10 IJGE CC1(C)C[C@@H](Br)CN1Cc1cccc(Br)c1Br 1949218305 IEKSQCLXUIGGOS-SNVBAGLBSA-N 425.990 4.959 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCCC[C@@H](Br)C1 2003417527 OVFZVVXLIQTBBR-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE C[C@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)[C@H](CBr)C1CC1 2009644931 GTCKKELGBRFEFH-RDTXWAMCSA-N 428.417 4.815 50 10 IJGE CN(C(=O)c1cccc(Br)c1Br)[C@@H]1CCC[C@H]1Br 2031477428 LULKMHDYRUVTBF-MWLCHTKSSA-N 439.973 4.600 50 10 IJGE C[C@H](Br)C[C@@H](C)CNC(=O)c1c(Br)cccc1Br 2033089480 UCFIWJITOCQWBN-BDAKNGLRSA-N 441.989 4.751 50 10 IJGE FC(F)(F)c1cc(Br)cc(-n2nc3c(c2CBr)[C@H]2C[C@H]2C3)n1 2080641459 BQRYQACDYDTSFK-XPUUQOCRSA-N 437.057 4.603 50 10 IJGE O=C(c1csc(Br)c1Br)N1[C@H]2CC[C@H]1CC(CCl)C2 2093942005 IDYAIDOJGCAWLI-IUCAKERBSA-N 427.589 4.895 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CCl)c1F)N(Cc1ccccc1)CC(F)(F)F 2095874020 OGVMYUQIJXBUDE-UHFFFAOYSA-N 430.250 4.971 50 10 IJGE CC(C)[C@@H](Br)C(=O)Nc1ccc(CCCCNC(=O)OC(C)(C)C)cc1 2106201712 XWTSHANABZZXLV-QGZVFWFLSA-N 427.383 4.892 50 10 IJGE C[C@@H](CCBr)CCN1CC[C@](NC(=O)OC(C)(C)C)(c2ccccc2)C1 2106782526 QYDHKCAZHTVIAM-LAUBAEHRSA-N 425.411 4.924 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2CN(CC3(CBr)CCCCCC3)C[C@H]21 2106784482 JAOWAYFOTGFQNB-RCCFBDPRSA-N 429.443 4.957 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@H](Br)C2(CCCC2)C1 2117739561 CRLICVGPYYQQNH-JTQLQIEISA-N 427.589 4.944 50 10 IJGE Brc1ccccc1[C@H](CI)OC[C@H]1C2C[C@@H]3C1[C@@H]3C2 2134523761 ZOZPKGYYFDPBLG-QGEJBMBVSA-N 433.127 4.844 50 10 IJGE CC(C)([C@@H](Br)c1c(Br)cc(F)c(Cl)c1F)S(C)(=O)=O 2136966991 PCWDZNYOZLUCQE-JTQLQIEISA-N 440.531 4.640 50 10 IJGE C[C@@H](Br)C[C@H]1CCCCCN1S(=O)(=O)c1cscc1Br 2143915844 UJPZHZMTEQGVKZ-GHMZBOCLSA-N 445.242 4.617 50 10 IJGE C[C@@H]1C[C@@H](C)N(C(=O)c2ccc(CBr)cc2)C[C@H]1CNC(=O)OC(C)(C)C 2163055163 DTDVORDKJNXTJX-IIDMSEBBSA-N 439.394 4.593 50 10 IJGE CN(C(=O)c1cc(Cl)ccc1I)[C@H]1CCCCC[C@H]1Cl 2172546798 IXIABOXLUUPNIA-OCCSQVGLSA-N 426.125 4.957 50 10 IJGE CC(C)(C)OC(=O)N1CC(C2CCN(C[C@H](CBr)c3ccccc3)CC2)C1 2176944548 LUGNPSSNKQRPJG-IBGZPJMESA-N 437.422 4.744 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CCCCCCCBr)C[C@H]1C(F)(F)F 2263154725 SGZQBRLYVZDWPY-ZIAGYGMSSA-N 431.337 4.719 50 10 IJGE Cc1cc(F)c(Br)cc1C(=O)NCCCCCCI 2270349654 MIVTWMYAWHSQER-UHFFFAOYSA-N 442.110 4.622 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCC(CCBr)CC1 2282979034 UPENDOJFKIWNLV-UHFFFAOYSA-N 427.539 4.879 50 10 IJGE N#CC(=Cc1ccc(COc2ccc(Br)cc2)o1)C(=O)Nc1nccs1 2295672205 AVAUBBJFMGWYCO-UHFFFAOYSA-N 430.283 4.623 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1C[C@@H]2CN(C(=O)OC(C)(C)C)C[C@]2(C)C1 2297085858 PMEYSZZCTATQBV-ZOZBEKFXSA-N 447.414 4.558 50 10 IJGE C[C@@H]1C[C@H]1N(CCCl)Cc1ccc(I)c(Br)c1 2306225109 UZRTZWYVUPEUSM-NOZJJQNGSA-N 428.539 4.503 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NN=C(C)c2ccc(Br)cc2)c(C)n1 2321282992 PBDSJRREWUYYMK-UHFFFAOYSA-N 438.325 4.982 50 10 IJGE ClC[C@@H]1[C@H]2CC[C@@H](C2)N1Cc1ccc(I)c(Br)c1 2325210268 WURHHUBKHQKXMV-COPLHBTASA-N 440.550 4.645 50 10 IJGE C[C@H]1CN(Cc2cc(I)ccc2Cl)C[C@@H](C)[C@@H]1Br 2327401445 ALRMWUJSDGEVMP-MSRIBSCDSA-N 442.566 4.796 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CC[C@H]3C[C@@H]2CO3)cc1I 2334463532 LAECCBRCWYEDSK-ZAZJYDDPSA-N 437.115 4.551 50 10 IJGE CC(C)CN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2351885521 LAUGMEDNIQFRMJ-MAUKXSAKSA-N 439.385 4.764 50 10 IJGE C=CCOc1ccc(Br)cc1/C=N/NC(=O)[C@@H](C)Oc1cccc(Cl)c1 20311311 RTNXWARWDNAZDP-UMYHVIPVSA-N 437.721 4.585 50 10 IJGE CCOC(=O)c1c(NC(=O)[C@@]23CC[C@@](C)([C@@H]2Br)C3(C)C)sc2c1CCC2 35548391 VLYOCIDKHMPMHM-FFZOFVMBSA-N 440.403 4.942 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@@H](C)Oc4ccc(F)cc4)ccc32)cc1 38649237 VWCSOQRONFYMPX-GYCJOSAFSA-N 444.462 4.725 50 10 IJGE COc1cc(C(=O)N/N=C/c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc(OC)c1OC 59152946 ACGGXOXRQKRUSW-VULFUBBASA-N 442.556 4.777 50 10 IJGE CCOc1cc(C(=O)N/N=C(/C)c2ccc(Cl)c([N+](=O)[O-])c2)cc(OCC)c1OCC 59579042 REGMEHPJTHYPFF-QRVIBDJDSA-N 449.891 4.598 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CI)[C@H](c2cccc(Cl)c2F)C1 382682810 CHDACDDJQDIXPV-CMPLNLGQSA-N 439.696 4.865 50 10 IJGE CC(C)(C)[Si](C)(C)OCCN1C[C@H](S(=O)(=O)c2ccccc2)Nc2ccccc21 616682354 AMFFTVKMDLPVEG-NRFANRHFSA-N 432.662 4.740 50 10 IJGE ClCCc1nc2cnccc2n1CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 705868909 DVIOTHIJYUZUPX-UHFFFAOYSA-N 446.982 4.684 50 10 IJGE COc1ccc(C(C)=NNC(=O)COc2ccc(Cl)cc2Cl)cc1Br 725406523 GHUZWMRKZIMEFN-UHFFFAOYSA-N 446.128 4.684 50 10 IJGE CCC[C@@H](NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1cccc(C(F)(F)F)c1 726798197 ZVASEKKLPIGHDR-GOSISDBHSA-N 432.446 4.683 50 10 IJGE CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(C=NNC(=O)CCC(C)C)cs1 727260279 LWZSJIMTLVQTQJ-UHFFFAOYSA-N 426.464 4.733 50 10 IJGE O=C(NNc1cccc(F)c1F)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12 743721709 KCPWKUICJDNVSJ-UHFFFAOYSA-N 433.414 4.708 50 10 IJGE COc1cc(F)cc(NNC(=O)c2cc(-c3ccc(F)cc3)nc3onc(C4CC4)c23)c1 759324624 GGMLIYNVFNIOAL-UHFFFAOYSA-N 436.418 4.811 50 10 IJGE O=C1NCCc2c1ccc(NS(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1)c2F 790074770 RFPKSNZLKJYCFZ-UHFFFAOYSA-N 446.394 4.570 50 10 IJGE C#CCC1(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Br)cc3)c2C)CCC1 1611039544 LUVMBXWVJQQHMI-XMHGGMMESA-N 436.353 4.826 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccc1F)CCC2 1772744023 OTRTVUXHTJQDRI-UHFFFAOYSA-N 449.482 4.767 50 10 IJGE Cc1c(C(=O)Nc2cccc3ccccc23)oc2c1C(=NNC(=O)c1ccncc1)CCC2 1772745690 HYQPGSROJBCXMI-UHFFFAOYSA-N 438.487 4.859 50 10 IJGE COc1cc(C=NNC(=O)COc2ccccc2Cl)ccc1OCc1ccccc1C 1772753667 AUNOQRZUPULBDR-UHFFFAOYSA-N 438.911 4.765 50 10 IJGE CCCn1nc(C)c2c1OC(N)=C(C#N)[C@H]2c1ccc(OCc2ccccc2)c(OCC)c1 1865693351 IYSCDGNRXMLRQH-XMMPIXPASA-N 444.535 4.797 50 10 IJGE COc1ccc(-c2nn(CC(C)C)c3c2[C@@H](c2ccc(F)cc2F)C(C#N)=C(N)O3)cc1 1865701932 IQLDNRAZPIPUOX-FQEVSTJZSA-N 436.462 4.711 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1ccc(F)cc1)C(C#N)=C(N)O2 1865708435 WVGNPJWRLWEQOU-IBGZPJMESA-N 426.854 4.644 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(Cl)c(Cl)c2)cc1 1865714448 KNXLIHWHGMDZPP-IBGZPJMESA-N 427.291 4.714 50 10 IJGE O=C(/C=C/c1ccc(OCc2ccccc2)cc1)NNC(=O)CCCSc1ccccc1 1865756003 AFGBRKWTWFHCJI-OBGWFSINSA-N 446.572 4.999 50 10 IJGE Cc1ccc(OCC(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3Cl)nc2C)cc1 1865759874 WTGMURCODQBTBH-UHFFFAOYSA-N 444.318 4.512 50 10 IJGE O=C(NCC1CC2(CC[C@H]2Cl)C1)c1scc(Br)c1Br 1882856111 PQLHSZCFONNAKE-ZNZYBQRESA-N 427.589 4.801 50 10 IJGE CC[C@H](Br)CN(C)C(=O)c1cc(Br)sc1Br 1977843335 PNHNSYQIANDFBC-LURJTMIESA-N 433.991 4.519 50 10 IJGE CC[C@@H](Br)CN(CC)Cc1cc(Cl)ccc1I 1999380655 STXSCOKWJXXHLI-LLVKDONJSA-N 430.555 4.940 50 10 IJGE CC(C)N(C[C@H]1CCCN(C[C@H](Br)C(F)(F)F)C1)C(=O)OC(C)(C)C 2044698085 ZGHZXFPCYIWBGT-KBPBESRZSA-N 431.337 4.670 50 10 IJGE O=C(Nc1cc(Cl)ccc1I)[C@H](Br)C1CCCC1 2048149291 WICNZWJUYJPMOY-GFCCVEGCSA-N 442.522 4.837 50 10 IJGE C[C@@]1(NC(=O)c2cc(Br)cc(Br)c2)CCC[C@@H]1Br 2062572911 FIJUKDSUBRDZIV-WCQYABFASA-N 439.973 4.648 50 10 IJGE CC[C@@H](C)[C@H](CI)NCc1c(F)ccc(Br)c1F 2081240352 HEOTYCLVPRCHNE-PELKAZGASA-N 432.090 4.667 50 10 IJGE ClCc1nc2cncc(Br)c2n1C1[C@H]2C[C@H]1CN(Cc1ccccc1)C2 2095445432 HOJGBGTVIDLZPT-GJZGRUSLSA-N 431.765 4.626 50 10 IJGE CC(C)(C)OC(=O)NCCO[C@H]1CCN(CCCCCCCCCBr)C1 2112695300 FWUYZMCLIJZEID-SFHVURJKSA-N 435.447 4.728 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2[C@@H]1CN(Cc2ccccc2)C[C@@H]1C 2128517324 FRWWMBVEEMMWTO-SUMWQHHRSA-N 433.781 4.934 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(C[C@H](CBr)c2ccccc2)C(C)(C)C1 2132466690 HGZHMSOODNQJJC-WMZOPIPTSA-N 425.411 4.790 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Br)C2 2134105743 UJANCDYGDBVXGP-UEGXPFIPSA-N 431.552 4.643 50 10 IJGE Cc1cc(S(=O)(=O)N(C)[C@@H]2CC(C)(C)[C@H]2OCc2ccccc2)sc1CCl 2156441420 GLPQUJQGKLAPCV-APWZRJJASA-N 428.019 4.800 50 10 IJGE CN([C@H]1CCC(C)(C)C1)S(=O)(=O)c1cc(CBr)sc1Br 2179787858 UVVBHTFIXMKDEB-VIFPVBQESA-N 445.242 4.605 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@H]1CCl 2208030624 TZHFOYZPOLTWCK-NXEZZACHSA-N 438.058 4.794 50 10 IJGE Sc1nc2cc(Br)c(Br)cc2n1C1CC(Br)C1 2213498701 MOMUCTKEIDHVTR-UHFFFAOYSA-N 440.986 4.948 50 10 IJGE C[C@@H]1CCC[C@@]12[C@@H](OCCOCCOCCOCc1ccccc1)C[C@H]2Br 2236089237 PXBKKPHQDABBLJ-PSWRPDDJSA-N 441.406 4.595 50 10 IJGE COc1ccc([C@H](Br)C(F)(F)C(F)F)cc1I 2248890748 XCTIFGCHABJQNX-QMMMGPOBSA-N 426.973 4.636 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@@H](Br)[C@H]1CC2 2282971608 FLVOLRIAWVRCES-WIMUKIRHSA-N 425.523 4.772 50 10 IJGE CCCC(CBr)(CCC)CN(C)C[C@@]1(O)CCCN(Cc2ccccc2)C1 2286350910 YAWVIXPMDSTRRS-QHCPKHFHSA-N 439.482 4.927 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2c[nH]nc2-c2ccccc2)sc2c1CCCC2 2295187799 RNEXDXQHFMBJGJ-UHFFFAOYSA-N 446.532 4.739 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1Cc1ccc(Cl)cc1I 2302325361 GTWUJEBYBLXQFQ-MWLCHTKSSA-N 428.539 4.692 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cc(Cl)cc(Cl)c1O 2320558349 NTHVTTZQIUZASV-AWEZNQCLSA-N 447.156 4.799 50 10 IJGE CCOc1ccc(CCNC=C(C#N)C(=O)Nc2cccc(Cl)c2Cl)cc1OCC 2324380693 HHVPJDYENFCTKO-UHFFFAOYSA-N 448.350 4.969 50 10 IJGE ClC[C@@H]1CN(Cc2ccc(I)c(Br)c2)CC12CC2 2325208585 XEFPMCCNROUSAO-LLVKDONJSA-N 440.550 4.505 50 10 IJGE C[C@H](O[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1Br)c1cccc(OC2CC2)c1 2342607116 MKUQEYWXNKMOAK-DOPJRALCSA-N 426.351 4.688 50 10 IJGE Cc1ccnc(CO[C@@H](CI)c2cccc(Br)c2)c1 2343572335 CXBDJRMFDOEADI-HNNXBMFYSA-N 432.099 4.845 50 10 IJGE CC(C)[C@@H]1C[C@H](Br)CN1C(=O)c1cc(Br)c(F)cc1Cl 2370882778 GWFNXKRNSFPZJG-SDBXPKJASA-N 427.539 4.876 50 10 IJGE COc1ccc(CC(=O)Oc2ccc(/C=C(/C#N)c3ccc(OC)cc3)cc2OC)cc1 31902241 KLOFROMCAJFLBQ-STZFKDTASA-N 429.472 4.925 50 10 IJGE CCOc1cc(/C=C2/C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1F 38604642 HUDITSWQRPWONI-UDWIEESQSA-N 448.494 4.804 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)ccc1OC(=O)/C=C/c1ccccc1 40869995 IITXKELITKHLJZ-LQKQQMOUSA-N 438.483 4.537 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Cl)c3ccc(Br)cc3F)cc2[nH]1 109883923 KLZCRNHASFXJNU-ZDUSSCGKSA-N 434.490 4.849 50 10 IJGE CCCCCCOc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)OC)c2)cc1OC 206237168 HLUVFVAWKKHYFP-ZHZULCJRSA-N 436.508 4.987 50 10 IJGE N#C/C(=C/N1CCN(c2cccc(Cl)c2)CC1)C(=O)Nc1ccc(Cl)c(Cl)c1 217005855 GGENQTXJYVXKNU-YPKPFQOOSA-N 435.742 4.815 50 10 IJGE CC(=NNC(=O)CSc1nnc(SCc2ccccc2)s1)c1ccc(F)cc1 254703641 HIAKUMYQHCYUNZ-UHFFFAOYSA-N 432.571 4.602 50 10 IJGE Cc1cccc(C(=O)Oc2ccc3ccccc3c2C=NNC(=O)c2ccc(O)cc2O)c1 254763957 NPIQDEKXPAKWQN-UHFFFAOYSA-N 440.455 4.543 50 10 IJGE CCCO[C@@H]1[C@@H](Br)C[C@H]1Oc1ccc(Br)cc1Br 300467224 BNMCYLXNMXOXPO-CYZMBNFOSA-N 442.973 4.921 50 10 IJGE C[C@H]1[C@H](Br)CCCN1C(=O)c1cc(Br)c(Br)s1 395261215 RBMDCMAHXNYWGQ-NKWVEPMBSA-N 446.002 4.661 50 10 IJGE CCN(C(=O)c1cc(Br)ccc1Br)C(C)(C)CBr 688361546 VKEIXMJBSNRPMV-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@@H]2CC[C@@H](Cl)C[C@H]2C1 705436560 AIOITVOGIBOPTC-XHNCKOQMSA-N 427.589 4.753 50 10 IJGE C=CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccc(Cl)c(Br)c1 1472044681 YKKOCTNCUNZFCM-HNNXBMFYSA-N 446.773 4.795 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNc2ccc(Cl)c(C(F)(F)F)c2)c(O)n1 1583799174 QGXUIEMBCFRPBR-UHFFFAOYSA-N 437.805 4.892 50 10 IJGE N#Cc1ccc(CN(C[C@H](CBr)C2CC2)c2ccc3nc(O)[nH]c3c2)cc1 1657631831 CVGCUOIBISDFQT-KRWDZBQOSA-N 425.330 4.568 50 10 IJGE CCOc1ccc(C=NNC(=O)COc2cc(C)c(Br)cc2C(C)C)cc1 1772754721 REJWCQYOCCDNJX-UHFFFAOYSA-N 433.346 4.809 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCC(C)(C)N(C(=O)OC(C)(C)C)C1 1880762844 YYZUIHNZJKQFMN-KBPBESRZSA-N 435.403 4.700 50 10 IJGE Cc1sc([C@@H](Br)c2c(Br)ncn2C)cc1Br 1900419332 HUXLHZGAGOZVJA-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1Cc1c(Br)cccc1Br 1945321268 GABOGEPGENWRBE-VHSXEESVSA-N 425.990 4.959 50 10 IJGE C[C@H]1C[C@@H]1N(CCBr)C(=O)c1scc(Br)c1Br 2002041300 PMQAHDUEMWKQHE-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE Brc1ccc(Br)c(CN2CCCC[C@@H](Br)C2)c1 2006497568 VYBYNPNIKMGKSW-GFCCVEGCSA-N 425.990 4.961 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1csc(Br)c1Br 2023033177 BSIRZXMEFMVRKD-POYBYMJQSA-N 448.018 4.813 50 10 IJGE C[C@@](CCl)(NC(=O)c1cc(Br)sc1Br)C(F)(F)F 2043177089 QWMBXOBIRBWPRI-QMMMGPOBSA-N 429.483 4.563 50 10 IJGE CC(C)(C)CN(Cc1ccccc1)S(=O)(=O)c1ccc(OCCBr)cc1 2123270950 PEDWFRZGZPQQIO-UHFFFAOYSA-N 440.403 4.697 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CCN(C(=O)[C@H](Br)C1CCCC1)C2 2167035343 XYEQNYMBKFNNHE-GOSISDBHSA-N 437.378 4.872 50 10 IJGE Cc1csc(C(=O)NC[C@]2(F)CC[C@H](CBr)CC2)c1Br 2178582587 JEMJCFLUOPHTJK-YPFXGUDJSA-N 427.177 4.842 50 10 IJGE CCOCc1cc(Br)c([C@H](Br)c2cc(Cl)n(C)n2)s1 2224771154 GSDCNAQEDLZISA-LLVKDONJSA-N 428.577 4.918 50 10 IJGE COc1ccc(CBr)c(N2[C@H]3CCC[C@H]2CN(Cc2ccccc2)CC3)n1 2239885850 KKCTZFBXZCFATF-PMACEKPBSA-N 430.390 4.619 50 10 IJGE CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)C21CC[C@](C)(CI)O1 2249320886 VCNYSHGQBLHFEA-SNNOENIYSA-N 449.373 4.833 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)cc2C=C(C#N)C(=O)NCc2ccco2)cc1C 2296707923 YUZZHETUPKPIJW-UHFFFAOYSA-N 438.487 4.673 50 10 IJGE CC(C)N(Cc1ccc(Cl)c(I)c1)C[C@H](C)Br 2300240718 PLGLWFGXTPXSJA-JTQLQIEISA-N 430.555 4.938 50 10 IJGE FC(F)C(F)(F)CO[C@H](CI)c1ccc(Br)cc1 2315877012 CKIRYOKCNJFHFV-SECBINFHSA-N 441.000 4.842 50 10 IJGE Cc1nc(Cc2ccccc2)sc1C(=O)NNC(=O)C=Cc1ccc(Cl)cc1Cl 2323423957 CIJXHAUCUVWMAW-UHFFFAOYSA-N 446.359 4.824 50 10 IJGE ClCC1CC2(C1)CN(Cc1ccc(I)c(Br)c1)C2 2325209845 RYUBAGFFAVANLU-UHFFFAOYSA-N 440.550 4.505 50 10 IJGE CC(C)N(C)C[C@H](Br)CCc1cc(I)ccc1Cl 2327394472 FTLABXXDNDCLBF-GFCCVEGCSA-N 444.582 4.981 50 10 IJGE COc1cc([C@H](Cl)c2cc(I)sn2)c(OC)cc1Cl 2338224990 FHHNDBWVYQFIOT-LBPRGKRZSA-N 430.094 4.747 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](CC)C(=O)NNC(=O)COc1ccc(C(C)C)cc1 10682464 OYAXSZSZAUYTMM-PGRDOPGGSA-N 426.557 4.707 50 10 IJGE COc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(Cl)c2)c1 38651127 KEHSHQBQBYHOMP-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE Cc1cc(C)c2c(CC(=O)N/N=C3\CCCc4oc(C(=O)N5CCCC5)c(C)c43)coc2c1 40826924 LEDJIXBMQNFBKI-ZXVVBBHZSA-N 447.535 4.586 50 10 IJGE O=[N+]([O-])c1ccc(C[C@@H](Br)c2cccc(I)c2)cc1 104185108 DEFVDILNMXBXGN-CQSZACIVSA-N 432.055 4.878 50 10 IJGE CC(C)N(CCCBr)C(=O)c1cc(Br)c(Br)s1 122530466 WQXXXDYPRAZREF-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE O=c1c(Br)cc(Br)cn1C[C@H](CBr)c1ccccc1 128484293 LRGAEKRJUFBRDR-NSHDSACASA-N 449.968 4.552 50 10 IJGE CCCCN(/C=C(/C#N)C(=O)Nc1ccc(I)cc1C)CCCC 217254038 KZMGGCIAFDSDTB-PEZBUJJGSA-N 439.341 4.848 50 10 IJGE CC(=NNC(=O)Cc1ccc(-c2ccccc2)cc1)c1ccc(NC(=O)C(F)(F)F)cc1 254380724 KYRVADBPPYUTGK-UHFFFAOYSA-N 439.437 4.937 50 10 IJGE CC(C)c1ccc(OCC(=O)NN=Cc2ccc(OC(=O)/C=C\c3ccccc3)cc2)cc1 254746214 XBOQKYQOTGSITF-APWHJIGLSA-N 442.515 4.958 50 10 IJGE O=C(NN=Cc1cn(-c2ccccc2)nc1-c1ccc(OC(F)F)cc1)c1ccccc1 254748959 HYEZXDHYLXXJNJ-UHFFFAOYSA-N 432.430 4.905 50 10 IJGE CCC(CC)CO[C@@](C)(CI)CN(CC)C(=O)OC(C)(C)C 300721134 CPSMYVHMDNRYNB-KRWDZBQOSA-N 427.367 4.890 50 10 IJGE C[C@@H](Cl)c1cnnn1-c1c(Br)cc(Br)cc1Br 310173126 LPHTVYIVEFVGQT-RXMQYKEDSA-N 444.352 4.855 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1CC[C@H]1CCN(Cc2ccccc2)C1 723938090 JWTUWHWFMCNFHB-QGZVFWFLSA-N 447.808 4.887 50 10 IJGE C/C(=C\C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl)c1cccc(F)c1 1540389324 IGSZZMOSXKPMQE-JLHYYAGUSA-N 425.287 4.542 50 10 IJGE C=CCCCCCCCCNC(=O)NNC(=O)c1ccc(Br)cc1Cl 1564864038 WFJYRFDHWQBIRT-UHFFFAOYSA-N 430.774 4.963 50 10 IJGE CCN1CCN(c2cc(Nc3ccc(SC#N)cc3)nc(-c3ccc(C)cc3)n2)CC1 1859833681 FTFSXWCMHSRIJV-UHFFFAOYSA-N 430.581 4.911 50 10 IJGE CCc1nn(-c2ccc(OC)cc2)c2c1[C@@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 1865685196 FMWQTIJTESPSAL-IBGZPJMESA-N 441.318 4.968 50 10 IJGE CCCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(OCC)cc1 1865695022 HZTQXDILSBSSHQ-NRFANRHFSA-N 430.508 4.586 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2Cc1ccccc1 1865703489 WQEQRDZQIPBOLB-QHCPKHFHSA-N 428.536 4.891 50 10 IJGE Cc1ccc(-c2csc(/C(C#N)=C(\O)[C@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1C 1872756435 JYLKOAKNOUFXBA-AYAKEVCGSA-N 429.501 4.904 50 10 IJGE C[C@H]([C@@H]1CCCN(C(=O)OC(C)(C)C)C1)[C@H](CBr)NC(=O)OC(C)(C)C 1880760293 FPNHVPCILULRSL-KFWWJZLASA-N 435.403 4.558 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)c1ccc(S(=O)(=O)C(F)F)cc1 1915086629 KPLBROKWIHGIQN-CQSZACIVSA-N 432.330 4.863 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)Cc1cnn(Cc2ccccc2)c1 1915130049 GPHBPSXDIDVCSF-JOCHJYFZSA-N 440.385 4.676 50 10 IJGE CN(Cc1ccc(OC(F)(F)F)cc1)C[C@@H](Br)COCc1ccccc1 1916369031 DVHNAPSBSXEGMG-QGZVFWFLSA-N 432.280 4.997 50 10 IJGE Fc1cc(Br)c2nc(CCl)n(-c3csnc3Br)c2c1 1926869516 JZUFBFKIAONZOV-UHFFFAOYSA-N 425.508 4.885 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN1Cc1cccc(Br)c1Br 1950534093 BJCBHXRHHOEPAC-ZJUUUORDSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]3(CC[C@H](CI)O3)C[C@@H]21 1979566489 JXTHQTSGRCEHRL-BSXFFOKHSA-N 435.346 4.539 50 10 IJGE CCCN1C[C@H](Cc2c(Br)cccc2Br)[C@@H](Br)C1 2039264210 BWBBOYYVKFOVAZ-HZMBPMFUSA-N 440.017 4.859 50 10 IJGE FC(F)(F)c1cc(CCl)cc(I)c1I 2060238470 JYZYBUQVIZYLTJ-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE COC[C@H](C)CCO[C@@H](CI)c1cccc(Br)c1 2067237645 NEWSXHSNHXGODG-RISCZKNCSA-N 427.120 4.614 50 10 IJGE Cc1cc(O)cc(C)c1-n1nc(CCl)c(I)c1C(F)(F)F 2079211303 OKIALJLPMZLDRA-UHFFFAOYSA-N 430.595 4.557 50 10 IJGE Cc1cc(-n2nc(CCl)c(I)c2C(F)(F)F)cc(C)c1O 2079211701 YKQPZGULQQKZMC-UHFFFAOYSA-N 430.595 4.557 50 10 IJGE Cc1cc(F)c(Cl)cc1[C@@H](Br)c1cnn(C)c1I 2081923441 BIVNWLGKFURAQR-LLVKDONJSA-N 443.485 4.610 50 10 IJGE COC[C@H](C)CCO[C@@](C)(CI)c1ccccc1Br 2130878665 FEYWDMFKEBUOMO-DOMZBBRYSA-N 441.147 4.789 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@@H](Br)C1CCS(=O)(=O)CC1 2137657121 RSSOIERHCYBZEF-ZDUSSCGKSA-N 430.589 4.672 50 10 IJGE O=C(N[C@@H](CBr)c1cccs1)c1c(F)cc(Br)cc1F 2175668946 LMEODIHLOWOPCD-JTQLQIEISA-N 425.092 4.655 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1Br)[C@@H](CCBr)C(F)(F)F 2178514945 HQDGSIVGZJUMJG-JTQLQIEISA-N 437.481 4.890 50 10 IJGE CN(C(=O)c1cc(Cl)ccc1Br)[C@@H](CCBr)C(F)(F)F 2178515255 KHMNTOZLTUIPBF-JTQLQIEISA-N 437.481 4.890 50 10 IJGE O=C(NCC[C@@H]1CCCC[C@H]1Cl)c1cc(Cl)ccc1I 2179638743 RVJOYGLBLHWYJU-GXFFZTMASA-N 426.125 4.862 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1cc(F)ccc1C(F)(F)F 2181740834 GEFABMGNTNLYMY-UHFFFAOYSA-N 428.517 4.840 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2N1C(=O)OC(C)(C)C 2196906336 CNCQUVONXAFDIT-GNBAHCQZSA-N 443.426 4.577 50 10 IJGE C[C@@H]1CCC[C@H]([C@H](Br)c2cc(I)cc3c2OCC3)O1 2226862869 DZVYWMTVAFEIMJ-OWYVNGRQSA-N 437.115 4.620 50 10 IJGE Fc1ccccc1[C@@H](CBr)OCCOCCOCCOCc1ccccc1 2236090420 YGMKDDJDMQBCTN-OAQYLSRUSA-N 441.337 4.528 50 10 IJGE ICCCCCn1ccc2cc(I)ccc21 2245942700 FAKWTYIRRXUVNG-UHFFFAOYSA-N 439.078 4.851 50 10 IJGE COc1ccc([C@H](Br)C2C[C@@H](C)O[C@H](C)C2)cc1I 2269555930 KCQPSNMVCAVRTB-FCHSOHFDSA-N 439.131 4.939 50 10 IJGE C[C@H](Br)CN(CC(C)(C)C)C(=O)c1ccc(I)cc1 2272439655 RXXYLODVCPTWNZ-NSHDSACASA-N 438.147 4.563 50 10 IJGE CS(=O)(=O)C1CC([C@H](Br)c2csc3c(Br)cccc23)C1 2285283559 NLMVWDNIEUKBFV-RPTIHFLNSA-N 438.206 4.923 50 10 IJGE Cc1cc(Br)c(C)c([C@H](Cl)C2CC(S(C)(=O)=O)C2)c1Br 2285391642 PSXGOHZXSMOWRN-RPFQZYLTSA-N 444.616 4.932 50 10 IJGE Clc1ccc(CN2C[C@H]3C[C@H]2CC[C@H]3Br)c(I)c1 2318528976 KWKJPWAVTNUDTC-RAIGVLPGSA-N 440.550 4.692 50 10 IJGE CC[C@H]1CN(C[C@]2(CBr)CC2(F)F)[C@H](CC)CN1C(=O)OC(C)(C)C 2326918558 AOZVQFAQQQWRSE-JKIFEVAISA-N 425.358 4.517 50 10 IJGE N#CC(=Cc1cccc(Br)c1)C(=O)Nc1nc2ccc([N+](=O)[O-])cc2s1 2329699486 KIAAYUJOQRYOGW-UHFFFAOYSA-N 429.255 4.513 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1[C@H]2CCC[C@H]2C[C@@H]1CBr 2330259830 LCCKJKDOWAXFIF-XKSSXDPKSA-N 427.589 4.942 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@H]2CC(Cl)C[C@@H](C2)C1 2338877476 MUOQXFYTDDJRMP-HTQZYQBOSA-N 427.589 4.753 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCCCN(C[C@]2(CBr)CC2(F)F)C1 2351890526 MLFSPHHQQVXAJK-QGZVFWFLSA-N 437.319 4.640 50 10 IJGE Cc1cc(C)n(-c2ccc(-n3cccc3/C=C(\C#N)S(=O)(=O)c3ccccc3)cc2)n1 1043649 UTDDRNJCOQRWPU-LFVJCYFKSA-N 428.517 4.618 50 10 IJGE CCOc1cc(C(=O)N/N=C/c2ccc(Cl)c(Cl)c2)cc(OCC)c1OCC 10038216 RWYOIHZZHHKBIC-FSJBWODESA-N 425.312 4.953 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCc2ccco2)ccc1OCCOc1cc(C)cc(C)c1 33793194 DSMZCWGLDMOGRQ-STZFKDTASA-N 446.503 4.586 50 10 IJGE N#C/C(=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 33930117 OWVJIXMMQGGAPX-LCYFTJDESA-N 438.783 4.962 50 10 IJGE Cc1c(C(=O)Nc2ccc(F)cc2F)oc2c1/C(=N/NC(=O)c1cccs1)CCC2 40823759 JOVWIUKLBJNTOM-MFKUBSTISA-N 429.448 4.650 50 10 IJGE C[C@@H]1CCCC[C@H]1NC(=O)[C@@H](c1ccccc1Cl)N(Cc1ccco1)C(=O)CCl 97914415 QZISYCZGFXOATA-QFIXIFRTSA-N 437.367 4.937 50 10 IJGE CCCCCCCCCCCCCC(=O)NNC(=O)CCC(=O)NCc1ccccc1 100442973 OVHSBNLNDVOFDC-UHFFFAOYSA-N 431.621 4.932 50 10 IJGE N#C/C(=C/NCCc1cccc(Br)c1)C(=O)Nc1cccc(Cl)c1Cl 217130116 SEGPJZPQDXLMJA-QBFSEMIESA-N 439.140 4.934 50 10 IJGE BrCc1ncoc1-c1cc(Br)ccc1I 232484168 FDUALYVZYYPZFK-UHFFFAOYSA-N 442.876 4.604 50 10 IJGE CC(C)C[C@H](CBr)NC(=O)c1cc(Br)sc1Br 232626130 QVRVCDFPQCSXFN-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE Cc1onc(-c2ccccc2)c1C(=O)NN=Cc1cccc(OC(=O)c2cccs2)c1 254625965 YCRFRBPPPKRROO-UHFFFAOYSA-N 431.473 4.695 50 10 IJGE CC(C)OC(=O)[C@@]12CC[C@@](C(Br)Br)([C@H]1Br)C2(C)C 256019784 DOZFCBGAMFKXMY-OXHMUOHRSA-N 447.005 4.624 50 10 IJGE FC(F)Oc1cc(I)c(C(F)(F)F)cc1CBr 575723198 LOOYLWQGBOEMQI-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE CCC[C@H](CCBr)NC(=O)c1cc(Br)cc(Br)c1 716856252 RPZKKXVGFDYDEP-GFCCVEGCSA-N 441.989 4.895 50 10 IJGE Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1C=NNC(=O)c1ccc(Cl)nc1 766695575 KLLRZUDQVCUODN-UHFFFAOYSA-N 449.873 4.924 50 10 IJGE CCCCOc1ccc(C(=O)NN=C2CCC(O)(c3cccc(F)c3)CC2)cc1OC 783810861 QEQXTMVZULWZGY-UHFFFAOYSA-N 428.504 4.561 50 10 IJGE CCCc1noc2nc(C3CC3)cc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c12 799747278 VUZGBWWCZWKEJV-UHFFFAOYSA-N 429.402 4.700 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2[N+](=O)[O-])ccc1OCc1ccc(Cl)cc1 1083900020 YAAPZSBONGPSJT-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE CCc1ccc(OCC(=O)NN=Cc2cc(Cl)cc(Cl)c2O)c(Br)c1 1084311923 VBXKYXZBECRVHA-UHFFFAOYSA-N 446.128 4.553 50 10 IJGE C=CCOc1ccc(/C=C/C(=O)NNc2cc(Cl)ccc2Br)cc1OC 1644409895 YAUJVKYRYBKHAZ-WEVVVXLNSA-N 437.721 4.832 50 10 IJGE Cc1cccnc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc(Cl)cc1)CCC2 1772743723 KGLMHJDGNIAJEI-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE C[C@H](Br)C(C)(C)CNC(=O)c1cc(Br)sc1Br 1913831913 VMCSTOKHTKUEHP-LURJTMIESA-N 448.018 4.813 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ccncc1Br 1915098739 KYDVQJJIWGLCFC-CQSZACIVSA-N 426.152 4.660 50 10 IJGE C[C@H](CCBr)N(C)C(=O)c1cc(Br)c(Br)s1 1917083796 GNYRCHOEYUAIKD-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE C[C@H]1CC[C@H](CBr)N(c2ncc(Br)cc2Br)C1 2001930023 RAVYQUHCTIPMGV-WCBMZHEXSA-N 426.978 4.606 50 10 IJGE CC(C)[C@@H](Br)CN(C)C(=O)c1scc(Br)c1Br 2002413646 CRUDFWUPKYINSY-ZETCQYMHSA-N 448.018 4.765 50 10 IJGE C[C@@H](Br)CN(Cc1cc(Br)ccc1Br)C1CC1 2006498323 CKFYIWWKACLOBZ-SECBINFHSA-N 425.990 4.959 50 10 IJGE COc1cc(Br)c([C@H](Br)[C@H]2C[C@H]2Br)cc1OC 2020149621 GGRDCVKGNKEMLM-BLYIZYRKSA-N 428.946 4.686 50 10 IJGE Brc1cccc(CN2C[C@@H]3CC[C@@H](Br)[C@H]3C2)c1Br 2031477598 MTBGMJXFWZPEPC-ZMLRMANQSA-N 438.001 4.817 50 10 IJGE CN(C(=O)c1csc(I)c1)[C@@H]1CCCCC[C@H]1Br 2052427308 BUAYTIOINKPLKX-GHMZBOCLSA-N 442.160 4.521 50 10 IJGE C[C@@H](CCCCCI)NCc1ncc(Br)cc1Cl 2063685630 YTRYHEHSGSVMKZ-JTQLQIEISA-N 445.570 4.971 50 10 IJGE CC(C)N(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2110714122 ANVSGBFTPKKSBO-IRXDYDNUSA-N 431.415 4.577 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(CCNC(=O)[C@@H](Br)C2CCCC2)cc1 2110723511 OEBGLMILJBEEDI-KRWDZBQOSA-N 425.367 4.646 50 10 IJGE Cc1sc(C)c(S(=O)(=O)Nc2cccc(CBr)c2)c1Br 2143909598 BCWYBUPGOFYNLP-UHFFFAOYSA-N 439.194 4.823 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CC[C@@H](Cl)C(F)(F)CC1 2150038640 HKGDRKNPTQTGOO-SNVBAGLBSA-N 431.502 4.690 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1sc(C)c(C)c1Br 2221820988 VQNHEQFFKTXDBM-GMSGAONNSA-N 444.176 4.707 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)c(Br)cc2n1CCC[S@@](C)=O 2234059634 JUORIODICOXGTH-ZPWHCFADSA-N 442.604 4.630 50 10 IJGE CC(C)CN(CCCCI)C[C@@H]1CCCN1C(=O)OC(C)(C)C 2243591034 NJZUJOXVFBDCBH-INIZCTEOSA-N 438.394 4.559 50 10 IJGE COc1ccc([C@H](Cl)c2ccc(Br)o2)cc1I 2248888849 OWXXKOWJSMCGBM-LBPRGKRZSA-N 427.463 4.984 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CCC[C@@H](OC)C2)cc1I 2269536279 YNZWCLBEBANWIB-JVLSTEMRSA-N 439.131 4.941 50 10 IJGE CS(=O)(=O)C1CC([C@@H](Br)c2cc(Br)c(Cl)cc2F)C1 2269762836 WBJCNZQKEMRKCX-LBVLNNNDSA-N 434.552 4.501 50 10 IJGE C[C@H]1CC[C@@](CBr)(NC(=O)c2cc(F)c(Br)cc2Cl)C1 2282974086 FOEBIPUDKHBXNS-RMLUDKJBSA-N 427.539 4.925 50 10 IJGE C[C@@H]1CCN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@H]1CBr 2285959317 PQBBSOPSAXUTKP-RKDXNWHRSA-N 427.539 4.735 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Br)C1(S(C)(=O)=O)CCC1 2295365192 NBZDEKMISWDJPJ-LBPRGKRZSA-N 446.588 4.514 50 10 IJGE CN(Cc1cc(I)ccc1Cl)C[C@@H](Br)C1CC1 2307326862 UCWNHPHHYIZRPM-GFCCVEGCSA-N 428.539 4.550 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)[C@@H]2C2CC2)c(I)c1 2318539138 LHSMEAARDJRKHA-JSGCOSHPSA-N 440.550 4.692 50 10 IJGE COc1cccc(-c2ccc(C(=O)NN=Cc3ccc(F)c(Br)c3)c(C)n2)c1 2321239515 ZUWOCVSKCJMZPP-UHFFFAOYSA-N 442.288 4.731 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)C(C#N)=CNc1cc([N+](=O)[O-])ccc1Cl 2325072404 WLBFVWIMKPOUOV-CQSZACIVSA-N 428.876 4.652 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C)CN(C[C@@H](CBr)C(C)(C)C)CC1(F)F 2326651348 ODDCBWPZALQDEK-CXAGYDPISA-N 427.374 4.526 50 10 IJGE CC(C)(C)OC(=O)N[C@@]12CCC(F)(F)C[C@@H]1CN(CC1(CBr)CCC1)C2 2344057434 SOFJWABSVQTVOV-RDTXWAMCSA-N 437.369 4.566 50 10 IJGE Cc1cc(C(=O)Nc2ccc(CBr)c(F)c2)ccc1I 2367690251 WIWYTVIHFKRAOV-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE COc1ccc([C@@H](C(=O)NC2CCCCC2)N(Cc2ccc(C)cc2)C(=O)CCl)cc1 3035316 IIQUGPPRHISEPM-DEOSSOPVSA-N 442.987 4.761 50 10 IJGE O=C(COc1ccc(Cl)cc1Cl)NNC(=O)c1sc2ccccc2c1Cl 12572470 YRECNIPFMODZQK-UHFFFAOYSA-N 429.712 4.702 50 10 IJGE Cc1cccc(C(=O)Oc2ccc(Br)cc2/C=N\NC(=O)c2ccccc2)c1 33785278 RZDJWEWXOQGHLP-OYKKKHCWSA-N 437.293 4.741 50 10 IJGE N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 35484929 JSPYZDJMDVDTHO-XMHGGMMESA-N 435.443 4.993 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccc(C)cc3)c(OCC)c2)C1=O 38603529 KFAXHHVGUHLJBR-HYARGMPZSA-N 444.531 4.975 50 10 IJGE CN1/C(=C(\C#N)C(=O)COC(=O)CSc2ccccc2Cl)Sc2ccccc21 103395132 HGAFUXPOWVHYAW-MOSHPQCFSA-N 430.938 4.522 50 10 IJGE Br[C@@H](c1cccc(I)c1)c1ccc2c(c1)OCCCO2 109843312 BXGFCUFJQSLMFD-INIZCTEOSA-N 445.094 4.937 50 10 IJGE CC(C)c1ccc(/C=C(/C#N)C(=O)Nc2ccc(S(=O)(=O)Nc3ccccn3)cc2)cc1 206291845 WUDMEBFQDQSFOZ-HKWRFOASSA-N 446.532 4.551 50 10 IJGE CCCOc1ccccc1/C=C(/C#N)C(=O)Nc1sc2c(c1C(=O)OC)CC[C@@H](C)C2 206982336 ZVJQKPGLVNVDCW-WIZMWCRPSA-N 438.549 4.994 50 10 IJGE CCC[C@H](Br)CNC(=O)c1cc(Br)sc1Br 233326221 SMWRYEWIBVJJML-LURJTMIESA-N 433.991 4.567 50 10 IJGE Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C=NNC(=O)c1cc2c(s1)CC[C@@H](C)C2 254440595 BOEADEMHABTDBG-CYBMUJFWSA-N 444.963 4.983 50 10 IJGE COc1cccc2cc(C(=O)NN=Cc3cc(C)n(-c4cc(C(=O)O)ccc4C)c3C)oc12 254758464 IEFFLUHGXPVUJF-UHFFFAOYSA-N 445.475 4.619 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@H](c2c(F)cccc2Br)C1 382689014 KNYJYJFCXGJNBZ-GHMZBOCLSA-N 437.147 4.934 50 10 IJGE ClCCc1nc2cccc(Br)c2n1C1[C@@H]2CN(Cc3ccccc3)C[C@@H]12 700134852 DSYPTXQRCHJRTE-HZPDHXFCSA-N 430.777 4.883 50 10 IJGE CC[C@H](C[C@H](C)Br)NC(=O)c1ccc(I)c(Cl)c1 716942142 XHHKFUBLMSHSKH-WCBMZHEXSA-N 444.538 4.627 50 10 IJGE O=C(NNc1ccc(F)cc1Br)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 748074966 QQQVZUBXJYFWHQ-NWDGAFQWSA-N 433.199 4.734 50 10 IJGE CC[C@@H](NC(=O)NNc1ccc(C#N)cc1C(F)(F)F)c1nc(C(F)(F)F)cs1 799598012 WFDSLKFUPGFXMC-SNVBAGLBSA-N 437.369 4.830 50 10 IJGE COc1ccc(C(=O)NN=Cc2cc(C)n(-c3cccc(Br)c3)c2C)cc1 1084162868 UGEHTNACMOEQGX-UHFFFAOYSA-N 426.314 4.629 50 10 IJGE C=CCOc1ccc(C=NNC(=O)c2cc3cc(Br)ccc3o2)cc1OC 1084222017 AKNNOUWVBPWPIV-UHFFFAOYSA-N 429.270 4.533 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1)c1ccc(C(F)(F)F)cc1 1135740435 HIBZEZRMQAINLE-PEZBUJJGSA-N 434.458 4.995 50 10 IJGE C[C@@H](SCc1nc(O)c2ccccc2n1)C(=O)NN=C(c1ccccc1)c1ccccc1 1351474281 DFBZZXYZAUMBNY-QGZVFWFLSA-N 442.544 4.526 50 10 IJGE CC[C@@H]1CN(C(=O)OCc2ccccc2)[C@H](CC)CN1C[C@H](CBr)C1CC1 1615577250 FOKQUWRUKPDZTP-PWRODBHTSA-N 437.422 4.919 50 10 IJGE C=CCC1(CNC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)CCCC1 1686450124 MTHRQJPAQQYZHM-UHFFFAOYSA-N 428.360 4.619 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccccn2)[C@@H]1c1cccc2ccccc12 1865681962 BXTHUBDBGPICQX-GOSISDBHSA-N 433.393 4.657 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@H](c1cc(C)ccc1O)C(C#N)=C(N)O2 1865687586 VMIVPBOYDQWQDD-HSZRJFAPSA-N 428.536 4.733 50 10 IJGE Cc1ccc(C)c(Cn2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2ccncc2)c1 1865700218 NGTAARNGXRSGBJ-HSZRJFAPSA-N 433.515 4.828 50 10 IJGE CC[C@H](NC(=O)[C@@H](Cc1ccccn1)c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1866697766 VYNLMZODTGSWIN-GOTSBHOMSA-N 444.560 4.515 50 10 IJGE CCCCOc1ccc(/C=N/NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)cc1OCC 1873794728 XMIBITIGRGQJMV-CNQUNWPHSA-N 449.592 4.654 50 10 IJGE C[C@@H]1[C@@H](O[C@@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)CC1(C)C 1901820168 PXABLPRWYGJTGF-QWQRMKEZSA-N 437.362 4.642 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCOc2ccc(Br)cc21 1975074180 WUGRLALXPVPEJQ-DGCLKSJQSA-N 435.156 4.603 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCC[C@H](CI)O2)[C@H]2CCCC[C@H]21 1984438288 BKAJCQLHBOTHIY-BASYENTBSA-N 435.346 4.539 50 10 IJGE CC(C)[C@@H](Br)[C@H](C)NC(=O)c1cc(Br)c(Br)s1 1997051364 VQEFZFPMKFIXKY-IMTBSYHQSA-N 448.018 4.811 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1Cc1cc(Br)ccc1Br 2006508118 OUOHOCDLVXDSAR-CABZTGNLSA-N 425.990 4.959 50 10 IJGE CC(C)[C@@H]1[C@@H](Br)CCN1c1ncc(Br)cc1Br 2011341940 QGDCOKISYBSLPH-GXSJLCMTSA-N 426.978 4.605 50 10 IJGE CC1(C)OCCO[C@H]1[C@@H](Br)c1sc(Br)cc1Br 2013734248 NGVZPHXZLKYIMJ-WPRPVWTQSA-N 449.002 4.903 50 10 IJGE C[C@H](Br)[C@H]1CCCN1Cc1c(Br)cccc1Br 2018117034 JXWPCVHTGKYFDE-TVQRCGJNSA-N 425.990 4.959 50 10 IJGE CC(C)(C)[C@@H](CBr)NCc1ccc(I)c(Cl)c1 2026562818 FESVIXVYHCOUNG-GFCCVEGCSA-N 430.555 4.844 50 10 IJGE Cn1cc(Br)c(C[C@@H](CBr)c2cccc(Br)c2)n1 2027111485 HPICGEYWPNZDBV-JTQLQIEISA-N 436.973 4.666 50 10 IJGE CCC[C@@](C)(CBr)NC(=O)c1cccc(Br)c1Br 2031482481 SIVFHNKBXXRPOA-ZDUSSCGKSA-N 441.989 4.895 50 10 IJGE C[C@@]1([C@@H](Br)c2cc(I)cc3c2OCC3)CC1(F)F 2036108003 GPNONSHBDMMIKK-RYUDHWBXSA-N 429.042 4.707 50 10 IJGE CC(C)CN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@H](Br)C(F)(F)F 2044704999 IAPPOALKHQBAFS-KBPBESRZSA-N 431.337 4.670 50 10 IJGE O=S(=O)(c1c[nH]c(CBr)c1)N(Cc1ccccc1)CC1CCCCC1 2059319598 IXJVLSIHLDGZSG-UHFFFAOYSA-N 425.392 4.681 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCN[C@@H]1CCc2cc(Br)ccc21 2061263919 INZQQAALZKCZND-MRXNPFEDSA-N 447.464 4.932 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)C(C)(C)C)[C@@H](C(F)(F)F)C1 2066604212 SRWQPOXWISECEI-CHWSQXEVSA-N 431.337 4.527 50 10 IJGE CSCC[C@@H](Cl)CCNC(=O)c1cccc(Br)c1Br 2092335780 QNTTZOPENQUOOM-VIFPVBQESA-N 429.605 4.692 50 10 IJGE CC(C)(C)OC(=O)N1CCN(Cc2ccc(CBr)cc2)C[C@@H]1C(F)(F)F 2130170456 RGCYPZGNROUTPK-OAHLLOKOSA-N 437.300 4.565 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@]1(F)CN(C[C@H](CBr)c1ccccc1)C2 2198086871 OPFGTJIIFQTCNO-YYWHXJBOSA-N 441.385 4.636 50 10 IJGE Cc1cc(C(=O)Nc2ccc(F)c(CBr)c2)ccc1I 2207108870 ZLUZLKXWEDSHRX-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE O=C(c1cc(Cl)ccc1I)N1CCC[C@H](CCCCl)C1 2234183894 OQXPUDQFIDPHKE-NSHDSACASA-N 426.125 4.816 50 10 IJGE Cc1sc([C@H](Cl)c2cnn(C)c2I)c(Br)c1C 2246426099 QJESNCCBTTVDRI-SECBINFHSA-N 445.551 4.794 50 10 IJGE CC(C)N(CCCBr)C(=O)c1ccc(Cl)c(I)c1 2256392959 VPGCJZRJYQWYNB-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(OC2(C3CCCCC3)COC2)C1 2272934508 DOPHYLIRMLCNNB-IBGZPJMESA-N 432.399 4.517 50 10 IJGE CCCOc1ccc(C=C2C(=O)N(Cc3ccc(F)cc3)C(=O)C(C#N)=C2C)cc1OCC 2314620171 LHGGDOGTGDMPCQ-UHFFFAOYSA-N 448.494 4.806 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCCC2)C[C@@]2(CBr)CC2(F)F)C1 2351892581 QXTPGZSSNZQHRJ-SFHVURJKSA-N 437.369 4.518 50 10 IJGE Cc1sc2ncn(CC(=O)N/N=C/c3ccc(C(C)C)cc3)c(=O)c2c1-c1ccccc1 33343498 HLSTWGWITVZSBR-UVHMKAGCSA-N 444.560 4.707 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccc(Cl)cc3)ccc2[C@@H]1c1ccc([N+](=O)[O-])cc1 38654404 QNIPZHIGYCEERJ-NRFANRHFSA-N 447.834 4.686 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)NCCc2ccccc2)ccc1OCc1ccccc1 96453277 RQMNYTAETACPQR-ULJHMMPZSA-N 426.516 4.930 50 10 IJGE N#CC1=NN(c2ccccc2)[C@H](c2ccccc2)C2=C1OC(N)=C(C#N)[C@@H]2c1ccccc1 168467496 OOIRBZKJFJFCKO-UKILVPOCSA-N 429.483 4.889 50 10 IJGE CC(C)(C)C[C@@H](Cl)CNS(=O)(=O)c1cc(Br)ccc1Br 226264499 DQRJDFFHXKTMCB-SNVBAGLBSA-N 447.620 4.534 50 10 IJGE O=C(NC[C@@H]1CCC[C@H]1Br)c1cc(Br)sc1Br 232453556 OIXCRWNNSIBCNG-POYBYMJQSA-N 446.002 4.567 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=NNC(=O)COc3c(C)ccc(C)c3C)o2)cc1 254700974 LDXSFRDHWOWROL-UHFFFAOYSA-N 434.492 4.578 50 10 IJGE Oc1cc(Cl)ccc1[C@H]1CN(Cc2ccccc2)C[C@H]1CI 382677826 ZYZQZCJQPCHLQR-PBHICJAKSA-N 427.713 4.696 50 10 IJGE CCOc1ccc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)Nc2c(C(C)=O)oc3ccccc23)cc1 744569579 FNSIMMPZBWBLFX-APVMCDBPSA-N 446.459 4.511 50 10 IJGE C#CCOc1ccc(F)cc1NC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2 1675013937 FDTGJAHRLOQGBL-OAHLLOKOSA-N 443.544 4.517 50 10 IJGE Cc1cccc(C(=O)NN=C2CCCc3oc(C(=O)N4c5ccccc5C[C@@H]4C)c(C)c32)c1 1772744934 OLZHJANKNYKSGC-KRWDZBQOSA-N 441.531 4.958 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2Cl)[C@@H]1c1ccccn1 1865700452 UGJRLKSPSSKTAB-NRFANRHFSA-N 439.906 4.865 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)c3ccccc3C(F)(F)F)c(C)n2)cc1C 1865756080 FKIBFWAHLZOWBB-UHFFFAOYSA-N 427.426 4.767 50 10 IJGE Cc1cc(C)c(-c2csc(/C(C#N)=C(\O)CN3C(=O)c4ccccc4C3=O)n2)c(C)c1 1872756854 DMKVTODFPGTWHZ-ZZEZOPTASA-N 429.501 4.824 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C[C@@H](Br)C(F)(F)F)CC2)C1 1879207071 ZEYWQOYGTRZTKC-HUUCEWRRSA-N 443.348 4.671 50 10 IJGE O=C(N[C@H](CCl)[C@H]1CC=CCC1)c1cc(Br)c(Br)s1 1885070346 VOKSSLRTKOORED-WCBMZHEXSA-N 427.589 4.967 50 10 IJGE Clc1cc(Br)c(C[C@]23CO[C@](CI)(C2)C3)s1 1903682484 FXNYSFVUXKYFAW-PHIMTYICSA-N 433.536 4.691 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1ccccc1Cl 1915291965 UKKQDEQGBHVREK-QGZVFWFLSA-N 430.795 4.950 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@]23CC[C@@](C)(CI)O3)C1 1918347497 SZKPMRIZUITEKJ-RCCFBDPRSA-N 435.346 4.540 50 10 IJGE C[C@H]1[C@H](CBr)CCN1Cc1c(Br)cccc1Br 1945333747 UQJFVAZRDIISJG-UWVGGRQHSA-N 425.990 4.817 50 10 IJGE CC[C@H]1CN(C(=O)CCCCBr)[C@H](CC)CN1C(=O)OCc1ccccc1 1999432079 YREMTLYKPOXNQY-MOPGFXCFSA-N 439.394 4.590 50 10 IJGE Fc1ccccc1[C@@H](CI)OCCOCCOCc1ccccc1 2007814768 XPCOUHKHIGDQLB-LJQANCHMSA-N 444.284 4.552 50 10 IJGE C[C@]1(NC(=O)c2scc(Br)c2Br)CCC[C@H]1Br 2011556651 SUCOHRFOCVHNQS-HQJQHLMTSA-N 446.002 4.709 50 10 IJGE FC1(F)C[C@@]1(Br)COc1c(Br)cccc1CBr 2023779168 RSLTTYOFFCTQKO-SNVBAGLBSA-N 434.900 4.896 50 10 IJGE O=C(N[C@@H](CCBr)C1CC1)c1c(Br)cccc1Br 2033091093 MZFJTCAMUDXLSC-NSHDSACASA-N 439.973 4.505 50 10 IJGE O=C(N[C@H]1C[C@H](CCBr)C1)c1c(Br)cccc1Br 2078353317 DMAAYIMYTWSOTB-KYZUINATSA-N 439.973 4.505 50 10 IJGE CC[C@@](C)(CCCl)NC(=O)c1ccc(Br)cc1I 2086148273 YMETVGOKLQYAJH-ZDUSSCGKSA-N 444.538 4.581 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1CN(CC1CC1)C[C@H](CBr)CC1CC1 2112868850 NPYAOGLSSHXTPY-OALUTQOASA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CCc2ccc(NC(=O)[C@H](Br)C3CCCC3)cc2C1 2167039269 HZKBPJJAEOBUOE-GOSISDBHSA-N 437.378 4.872 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@]2(F)CCC[C@]2(CCl)C1 2176640089 LBEZDBUJBGJLNW-QWHCGFSZSA-N 445.579 4.846 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2185510339 ICOHREUTANNDLF-YADHBBJMSA-N 437.466 4.943 50 10 IJGE CCCN(CCCCI)C[C@H]1CCCCN1C(=O)OC(C)(C)C 2243591785 ZHPFADZGIMPGQG-MRXNPFEDSA-N 438.394 4.703 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCC[C@H](CI)O2)C[C@@H]2CCCC[C@@H]21 2246608482 ZNWJAJNWMMAMIA-RCJHGTSTSA-N 449.373 4.929 50 10 IJGE COc1ccc([C@H](Br)[C@@]23CCC[C@@H](C2)OC3)cc1I 2269554378 XXRMDQAQTQFXEC-CQDKDKBSSA-N 437.115 4.695 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCN(CC3(CBr)CC(F)C3)C2)C1 2280360818 WVMBUBKRQITOKC-IRDVNMAFSA-N 447.433 4.859 50 10 IJGE CC1(C)CN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@H]1CBr 2285845751 FLMAMIRKZRWVPS-MRVPVSSYSA-N 427.539 4.735 50 10 IJGE O=C(NC[C@@H]1CCCC[C@H]1Br)c1cc(Br)c(F)cc1Cl 2285957384 GSJJVAOJMUUSJY-WCBMZHEXSA-N 427.539 4.925 50 10 IJGE Cc1ccccc1C(=O)Nc1ccc(C(=O)NNC(=O)C=Cc2cccc3ccccc23)cc1 2293512378 YUMGREDMZCYMBV-UHFFFAOYSA-N 449.510 4.875 50 10 IJGE CCOc1c(Br)cc(C=C(C#N)C(=O)N[C@@H](C)c2ccccc2)cc1OC 2293665639 ULEYLJQMABHMEV-AWEZNQCLSA-N 429.314 4.641 50 10 IJGE Cc1ccc(C(=O)NC2=NC(=C(C#N)C(=O)Nc3cc(C)ccc3C)c3ccccc32)cc1 2296255992 GJQFPSPOXYDZQW-UHFFFAOYSA-N 434.499 4.675 50 10 IJGE CC(C)(CI)CN1Cc2ccccc2[C@@H](NC(=O)OC(C)(C)C)C1 2306815765 MRNHXGLPKLROPY-INIZCTEOSA-N 444.357 4.529 50 10 IJGE C[C@]12CN(Cc3ccc(Cl)c(I)c3)C[C@@]1(CBr)C2 2315555381 QEIKIHGXRIQDOU-KBPBESRZSA-N 440.550 4.552 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC=C(C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 2325254931 HWJLABUHHZEJFW-AWEZNQCLSA-N 428.876 4.652 50 10 IJGE CC(C)[C@H](CBr)N(CCCS(=O)(=O)c1ccccc1)Cc1ccccc1 2343235559 LEDPSPOOCOMKNO-NRFANRHFSA-N 438.431 4.772 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)/C=C\c3cccs3)cc2)cc1 33333690 VPQULKBGUJQUDD-PFONDFGASA-N 447.560 4.772 50 10 IJGE O=C(c1ccc([N+](=O)[O-])o1)[C@H](Br)[C@@H](Br)c1ccc(Cl)cc1 106866683 SCPVKHUTGFKSOJ-NWDGAFQWSA-N 437.471 4.924 50 10 IJGE O=C1COc2ccc([C@@H](Cl)c3cc(Br)c(Br)s3)cc2N1 128544880 MPURZJXDPBCKCK-GFCCVEGCSA-N 437.540 4.932 50 10 IJGE O=S(=O)(N=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccc(F)cc1 146539485 AJDCMJAXTYHUCL-UHFFFAOYSA-N 435.460 4.692 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C\NCc1cccc(Br)c1)C12CC3CC(CC(C3)C1)C2 217058929 XESQDPCCCJMCET-LJKAJTEJSA-N 442.401 4.667 50 10 IJGE CC(C)COCCO[C@@H](CI)c1cccc(Br)c1 232675514 HYKHOLLMTNZGKC-AWEZNQCLSA-N 427.120 4.614 50 10 IJGE CCCO[C@@H]1[C@@H](Br)C[C@@H]1Oc1c(Br)cccc1Br 233234286 TWKVFHOHWXHILT-GMXVVIOVSA-N 442.973 4.921 50 10 IJGE COc1ccc(C(=O)Oc2ccc3ccccc3c2C=NNC(=O)c2ccc(O)cc2)cc1 254292278 PLBAEUYITXFLEZ-UHFFFAOYSA-N 440.455 4.537 50 10 IJGE O=C1CCc2cc([C@@H](Br)c3sccc3I)ccc2N1 311684302 JSSGYDCRTZNSLT-CYBMUJFWSA-N 448.123 4.722 50 10 IJGE CCO[C@H](CO[C@H](CI)c1ccc(Br)cc1)C1CC1 703470742 NYWNVDZCMKUYSB-HUUCEWRRSA-N 439.131 4.757 50 10 IJGE C[C@@H]1[C@H](CBr)CCN1C(=O)c1scc(Br)c1Br 705426901 PFTLELSNUNDROA-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE O=C(NNc1cccc(F)c1F)c1cccc(NC(=O)c2cccc(Br)c2)c1 743721535 GEYKJVFRMKAIHA-UHFFFAOYSA-N 446.251 4.737 50 10 IJGE CCCOc1ccccc1[C@@H](CC(C)C)NC(=O)NNC(=O)c1cn(C)c2ccccc12 746427313 VYDPYKKUMWFGSU-OAQYLSRUSA-N 436.556 4.699 50 10 IJGE CC(=O)c1c(C)[nH]c(C(=O)NNc2nnc(-c3ccccc3)n2-c2ccccc2)c1C(C)C 753578465 MOWXBZXJUPSAGA-UHFFFAOYSA-N 442.523 4.654 50 10 IJGE Cc1c(Br)ccc(C(=O)NNc2c(F)cc(F)cc2Br)c1F 788754783 BTZKASMFNJIXEO-UHFFFAOYSA-N 438.041 4.694 50 10 IJGE CC(=O)c1cc2c(cc1NC(=O)/C(C#N)=C/c1cc(C)n(-c3ccc(C)cc3)c1C)OCO2 1124396979 GMHJGSXUYFCZIF-KEBDBYFISA-N 441.487 4.880 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNC(=O)c2cc3ccccc3cc2O)cc1 1306211815 NDBMETDVSDLMOE-UHFFFAOYSA-N 439.471 4.566 50 10 IJGE C=CC[C@@H]1CCCC[C@H]1NC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1 1470785772 DGAZPDDNPQEEKZ-AUSIDOKSSA-N 443.551 4.618 50 10 IJGE BrC[C@@H](CN(Cc1cccc(Br)c1)C1CCOCC1)C1CC1 1473387184 VMLHBMRRNGBXQE-INIZCTEOSA-N 431.212 4.851 50 10 IJGE O=C(NNC(=O)c1cc2ccccc2oc1=O)c1ccc(-c2ccc3ccccc3c2)s1 1860391555 NNDTYCOXYCCKRP-UHFFFAOYSA-N 440.480 4.750 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@H]1c1ccc(O)cc1 1865684418 QCZWHQQXJARDKR-INIZCTEOSA-N 446.816 4.527 50 10 IJGE N#C/C(=C(/O)CN1C(=O)c2ccccc2C1=O)c1nc(-c2ccc3c(c2)CCCC3)cs1 1872745565 SYHQNIGHUJBTTF-XDOYNYLZSA-N 441.512 4.778 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C[C@@H](Br)C(F)(F)F)CC2)C1 1879207075 ZEYWQOYGTRZTKC-LSDHHAIUSA-N 443.348 4.671 50 10 IJGE CC[C@]1(C)[C@@H]([C@H](CBr)NC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C 1887218560 YRADNODIOLYJEW-BIENJYKASA-N 435.403 4.700 50 10 IJGE CC(C)C[C@@H](CBr)CN1C[C@H](C)N(C(=O)OCc2ccccc2)[C@H](C)C1 1905533906 ZHOGIWKHWDFXBC-NSHGMRRFSA-N 425.411 4.775 50 10 IJGE CCc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@H](CBr)C(C)C)s1 1915291102 LPJFNAQQEUGPQG-QGZVFWFLSA-N 430.433 4.921 50 10 IJGE CS(=O)(=O)C1([C@H](Cl)c2c(Br)sc(Br)c2Cl)CC1 2002553209 XVVVKFIQTCHROF-ZCFIWIBFSA-N 443.009 4.784 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1Cc1cccc(Br)c1Br 2018118172 YGUPTMGOIDUOBR-BXKDBHETSA-N 425.990 4.959 50 10 IJGE O=C(N[C@H]1C[C@@H](CCBr)C1)c1scc(Br)c1Br 2021784059 FJOSNZIRNOBJNN-KNVOCYPGSA-N 446.002 4.567 50 10 IJGE O=C(N[C@@H](CCBr)C(F)(F)F)c1cc(Br)c(Cl)s1 2052436020 FYTCPMHHOCGMBS-LURJTMIESA-N 429.483 4.610 50 10 IJGE Clc1cc(CN2C[C@H](C3CC3)[C@@H](Br)C2)ccc1I 2086651837 LBMHXFOHEUVHRL-NEPJUHHUSA-N 440.550 4.550 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1cc(Br)ccc1Cl 2090386203 XMOVBIUFUNYNFJ-SECBINFHSA-N 429.605 4.739 50 10 IJGE O=C(NC[C@@]1(CCl)CC12CCC2)c1cc(Br)sc1Br 2097912185 UNQHJLNOHASOQB-ZDUSSCGKSA-N 427.589 4.802 50 10 IJGE CN(CCCCCCCCCBr)C[C@H]1COCCN1C(=O)OC(C)(C)C 2106787805 KNEQXPRELVAVIK-SFHVURJKSA-N 435.447 4.680 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](C(C)(C)C)CN(C[C@@H](CBr)C2CC2)C1 2108378894 XRLZGWMQSLDSDI-CGTJXYLNSA-N 431.459 4.916 50 10 IJGE CCN(CC)[C@@H](C)CO[C@@H](CI)c1ccccc1Br 2119222330 YCAFGBQHGBUMJR-WFASDCNBSA-N 440.163 4.672 50 10 IJGE Oc1nc2ccc([C@@H](Br)Cc3ccccc3I)cc2[nH]1 2143868983 USYFNASXFKOULI-NSHDSACASA-N 443.082 4.552 50 10 IJGE CC[C@@H]1CN(C(=O)c2ccc(CBr)cc2)[C@H](CC)CN1C(=O)OC(C)(C)C 2162914255 CZBRZGZYUOSAMZ-QZTJIDSGSA-N 439.394 4.832 50 10 IJGE CCCCN(CCCC)S(=O)(=O)c1cc(CBr)sc1Br 2179790982 LDINQOGPGKOKPW-UHFFFAOYSA-N 447.258 4.996 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)c2ccccc2)[C@@H](CC(F)F)C1 2183407162 GRXJTOHRKLUBBK-SJORKVTESA-N 447.364 4.742 50 10 IJGE ClCc1nc2cncc(Br)c2n1C[C@]12CC[C@@H]1CN(Cc1ccccc1)C2 2201228590 JOBSCLICQLQACS-IIBYNOLFSA-N 445.792 4.845 50 10 IJGE Cc1ccc(I)c([C@H](Br)c2ccc3nc(O)[nH]c3c2)c1 2240997962 WQVSGTLBNBBJJN-CQSZACIVSA-N 443.082 4.666 50 10 IJGE CC[C@@H](Br)c1nnc(-c2ccc(Cl)c(I)c2)o1 2248252877 PBAYIZRFNBYUHR-SSDOTTSWSA-N 427.467 4.841 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]([S@](C)(=O)=NCCCCCCCBr)C1 2263163857 APTSZDWFPMNPJK-CPJLOUKISA-N 439.460 4.829 50 10 IJGE CCOc1ccccc1NC(=O)[C@@H](OC(=O)C(C#N)=Cc1ccccc1)c1ccccc1 2297400549 RBHLVBJLARAEPT-DEOSSOPVSA-N 426.472 4.915 50 10 IJGE ClCC[C@H]1C[C@H](NCc2ccc(I)c(Br)c2)C1 2306216424 FZTVBACAPLIOMH-HOMQSWHASA-N 428.539 4.551 50 10 IJGE COc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2F)cc1 2314634059 HTTQVIVUOUHWBQ-RUZDIDTESA-N 442.446 4.671 50 10 IJGE Clc1ccc(CN2C[C@H]3C[C@H](Br)C[C@H]3C2)cc1I 2315546828 MIVSYEIDNCKZQH-GDNZZTSVSA-N 440.550 4.550 50 10 IJGE CCN(CC)C[C@H](Cl)CCc1ccc(I)c(Br)c1 2325208217 GGDVQLJQYGPCOO-GFCCVEGCSA-N 444.582 4.936 50 10 IJGE Cn1cc(I)c(C[C@H]2[C@@H](Br)C(C)(C)CCC2(C)C)n1 2341858048 YOJZEGZEQTWDQV-GXFFZTMASA-N 439.179 4.793 50 10 IJGE CN(C)c1ccnc(N(C)[C@@H]2CC(C)(C)[C@@H]2OCc2ccccc2)c1CBr 2377476691 GXOMDTLKMWIXQY-WOJBJXKFSA-N 432.406 4.863 50 10 IJGE COc1ccc([C@H](C)NC(=O)/C(C#N)=C\N[C@H](C)c2ccc3c(c2)CCCC3)cc1OC 217171648 OPCXVARRIOFILS-HZPUXAHQSA-N 433.552 4.518 50 10 IJGE Cc1ccc(C)c(N/C=C(/C#N)C(=O)Nc2ccc(I)cc2C)c1 217254178 OIRHSETXYQKMGT-PTNGSMBKSA-N 431.277 4.675 50 10 IJGE Cc1ccc2ccccc2c1[C@H](Br)c1cnn(C)c1I 379220956 SUZVQIFQLYRUBS-OAHLLOKOSA-N 441.110 4.971 50 10 IJGE O=[N+]([O-])c1ccc(N2CC[C@H]3CC[C@@H](C2)N3Cc2ccccc2)cc1CBr 399712128 BTSHAMTZQQQUAH-QUCCMNQESA-N 430.346 4.733 50 10 IJGE O=C(c1cc(Br)ccc1Br)N(CCCBr)C1CC1 404222197 MAQHPNPEZLXLFF-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE CC[C@H]1CN(Cc2cc(Cl)ccc2I)C[C@@H]1Br 405321876 ZPSYZVRQMPFXRZ-CABZTGNLSA-N 428.539 4.550 50 10 IJGE CCN(C(=O)c1cc(Cl)ccc1I)C(C)(C)CBr 688360891 NEEANTBTBCQYPM-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE Cc1ccc(NC(=O)NNC(=O)NCc2ccc(-c3csc(C)n3)cc2)c(Cl)c1 745792875 PJBZNLRAGOZBRL-UHFFFAOYSA-N 429.933 4.616 50 10 IJGE Cc1nc(C(=O)Oc2ccc([N+](=O)[O-])c3ncccc23)nn1-c1c(Cl)cccc1Cl 770135888 ALZRJBBBWVJEMW-UHFFFAOYSA-N 444.234 4.558 50 10 IJGE CC(=NNC(=O)Cc1nc(O)c2c(C)c(C)sc2n1)[C@H]1C[C@@H]1c1ccccc1Cl 920365632 SUOAQANSJDPLPM-HUUCEWRRSA-N 428.945 4.505 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2cc(C)n(-c3ccccc3C)c2C)cc1 1084396477 GYILDGDQNBHWHI-VWLOTQADSA-N 433.552 4.765 50 10 IJGE COc1cccc(C(=O)NN=Cc2ccccc2OCc2cccc(Br)c2)c1 1084610923 IYNCDWISSTXEOH-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE C=CCNC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C)c2)c1C 1352385092 WFGMPIODNBWICF-CJLVFECKSA-N 438.531 4.864 50 10 IJGE Cc1c(C(=O)N2CCCC2)oc2c1C(=NNC(=O)c1ccc(Cl)cc1Cl)CCC2 1772749163 XQLDCZZVFVKXBP-UHFFFAOYSA-N 434.323 4.601 50 10 IJGE CCCc1ccc(OCC(=O)NN=Cc2c(F)cccc2Cl)c(Br)c1 1772756236 PKKISERBEHFXMD-UHFFFAOYSA-N 427.701 4.723 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc3ccccc23)c(OC)c1 1865707654 CIJJSBLEZMYAGL-DEOSSOPVSA-N 438.487 4.569 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1ncccc1Br 1915111283 SWTGXZKJAXGTCT-CYBMUJFWSA-N 426.152 4.660 50 10 IJGE CCc1nn(C)c(CN(Cc2ccccc2)[C@H](C)CCBr)c1Br 1915116938 ZZJIVIAGUYXFMJ-CQSZACIVSA-N 443.227 4.921 50 10 IJGE Brc1cnccc1C[C@@H](Br)c1nscc1Br 1924069343 UNRSZSBYAMHNJJ-SSDOTTSWSA-N 426.959 4.742 50 10 IJGE O=C(NC[C@H]1CC[C@@H](Br)C1)c1csc(Br)c1Br 1945188810 BRROOXSULZYQFH-NKWVEPMBSA-N 446.002 4.567 50 10 IJGE CN(c1ncc(Br)cc1Br)C1CCC(Br)CC1 1997616634 BVWGKCPBHHJCQI-UHFFFAOYSA-N 426.978 4.749 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1cc(Br)cs1 2006103534 SKKJTRGBQSVBTP-VIFPVBQESA-N 430.149 4.624 50 10 IJGE Cc1cc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)C2CC2)sc1CBr 2009647256 SLGPPCCEVWJNOM-CQSZACIVSA-N 428.417 4.941 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1C(=O)c1csc(Br)c1Br 2018124039 WCMQEPFWOCKSAM-HTRCEHHLSA-N 446.002 4.661 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1scc(Br)c1Br 2023036498 ACYKXZXZZUBRBT-POYBYMJQSA-N 448.018 4.813 50 10 IJGE CCN(CCCCBr)C(=O)c1c(Br)cccc1Br 2041181858 FSDRZKGWMAQVHN-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE CC1(CBr)CC(NC(=O)c2cccc(Br)c2Br)C1 2055640902 PDQOWSSQOAIUSH-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE CC(C)(C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)n(C2CC2)c1 2059311969 DUFHEOJYNAKEQH-UHFFFAOYSA-N 425.392 4.707 50 10 IJGE C[C@@H]1[C@@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1csc(Br)c1Br 2093947861 JLZVNSDZPLYMCJ-GTDKDYCYSA-N 427.589 4.894 50 10 IJGE O=C(c1scc(Br)c1Br)N1[C@H]2CC[C@@H]1C[C@H](CCl)C2 2128161074 ZELNMQZMCBVYJC-AYMMMOKOSA-N 427.589 4.895 50 10 IJGE C[C@@H](Cl)CCc1cn(-c2ccc(Cl)c(I)c2Cl)nn1 2132766630 ZYBHUYAWVSXHPE-SSDOTTSWSA-N 430.504 4.739 50 10 IJGE Cc1cc(-c2nnc(CBr)n2C(C)(C)C)ccc1I 2142113109 MPPQOAORVVRWKC-UHFFFAOYSA-N 434.119 4.508 50 10 IJGE C[C@H]1[C@H](C)CC[C@H](CNC(=O)OC(C)(C)C)N1C(=O)c1ccc(CBr)cc1 2163056327 QEFZZDPFJOKLHQ-RVKKMQEKSA-N 439.394 4.735 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CC2(CBr)CCCC2)C[C@H]1c1ccccc1 2163057773 DZQFOAFMWBTDRN-OALUTQOASA-N 437.422 4.934 50 10 IJGE C[C@H]1CN(C(=O)c2cc(Cl)ccc2I)CC[C@@H]1CCCl 2172473459 KTYFLYMOIGGGFQ-QWRGUYRKSA-N 426.125 4.672 50 10 IJGE C[C@@H]1CCCC[C@@H]1N(C)S(=O)(=O)c1cc(CBr)sc1Br 2179790826 JHIGUEVGQIIRMF-KOLCDFICSA-N 445.242 4.605 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CC[C@@H](C(F)(F)CCl)C1 2197766912 VPMVPPMEPOIXRX-SECBINFHSA-N 431.502 4.548 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C(F)(F)F)CCCN1CCCCCCBr 2223283131 PFVFWBXQNDMLKK-MRXNPFEDSA-N 431.337 4.863 50 10 IJGE C[C@H]1[C@H](C(F)(F)F)N(CCCCCCBr)CCN1C(=O)OC(C)(C)C 2223289497 IQQYXMIJIUWUIV-UONOGXRCSA-N 431.337 4.814 50 10 IJGE FC(F)(F)c1ccc(CO[C@@H](CCl)[C@@H](I)CCl)cc1 2231129899 QRPHEWJYYGFUMF-QWRGUYRKSA-N 427.031 4.872 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@@H]1COC2(CCC2)C1 2284739709 KRLQHWLUFDMYCR-FZMZJTMJSA-N 449.126 4.621 50 10 IJGE Clc1ccc(CN2CC[C@H](CCBr)C2)cc1I 2300242976 PUACTRMEZIQLDX-JTQLQIEISA-N 428.539 4.552 50 10 IJGE CC1(C)C[C@@H](Br)CN1Cc1ccc(Cl)cc1I 2302307408 OSVAMGQBYXRZRR-SNVBAGLBSA-N 428.539 4.692 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)ccc1OCc1ccc2c(c1)OCO2 2313567264 FSKHWTOZTIDABI-UHFFFAOYSA-N 442.471 4.857 50 10 IJGE CCCN1C(=O)C(=Cc2ccc(OCc3ccc(C)cc3)c(OCC)c2)C(C)=C(C#N)C1=O 2314610615 KFAXHHVGUHLJBR-UHFFFAOYSA-N 444.531 4.975 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)cc2I)CC[C@@H]1Br 2318526898 ONVYLEXFALNICB-ZDUSSCGKSA-N 442.566 4.940 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=CNC(c2ccccc2)c2ccccc2)cc1 2324332087 MEDRTOHPTZZGKY-UHFFFAOYSA-N 425.488 4.588 50 10 IJGE Cn1cc(I)c(C[C@@H]2[C@H](Br)C(C)(C)CCC2(C)C)n1 2341858049 YOJZEGZEQTWDQV-MFKMUULPSA-N 439.179 4.793 50 10 IJGE CC[C@@H](C)c1ccccc1OCC(=O)NNC(=O)c1ccccc1OCCc1ccccc1 10508843 MEOKZVGRUTZPPV-HXUWFJFHSA-N 446.547 4.662 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cccc(OCc2ccccc2)c1 21284010 FBSFLFFHDZLSRU-UHFFFAOYSA-N 431.370 4.950 50 10 IJGE CCOc1cc(/C=C2/C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1 38605720 QPDTYRDNUBLMAY-LPYMAVHISA-N 444.531 4.913 50 10 IJGE CCc1ccc(O[C@@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(C)o2)cc1 38659354 XQDYYWKVDYSKGK-UPCLLVRISA-N 444.487 4.742 50 10 IJGE Cc1c(C(=O)Oc2cccc3ccccc23)oc2c1/C(=N/NC(=O)c1cccnc1)CCC2 40814186 AMXFCWLYDLQMDD-VFCFBJKWSA-N 439.471 4.826 50 10 IJGE CC(C)(C)c1cc(Br)ccc1OCC(=O)N/N=C/c1c[nH]c2ccccc12 40912281 XXDNJUAEMARCGW-WYMPLXKRSA-N 428.330 4.757 50 10 IJGE C[C@@H](Cl)c1nc2cc(I)c(F)cc2n1CCc1nccs1 97409184 HUCBRXSICLHWOR-MRVPVSSYSA-N 435.693 4.779 50 10 IJGE Cc1ccc2nc(-c3ccc(N/C=C(/C#N)C(=O)N(C)C4CCN(C)CC4)cc3)sc2c1 216908808 POQLLEWQSCVBMN-MNDPQUGUSA-N 445.592 4.644 50 10 IJGE Nc1ccc(Cl)cc1[C@H]1CN(Cc2ccccc2)C[C@H]1CI 382734206 WDLWWXSTQSCRJY-PBHICJAKSA-N 426.729 4.573 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1C(=O)c1cc(Br)ccc1Br 384245031 JFVXECZQEVDZMJ-LDYMZIIASA-N 439.973 4.600 50 10 IJGE C[C@@H]1CCCN(C(=O)c2cc(Cl)ccc2I)[C@@H]1CCCl 697192865 FFKMJRMLPNUXFM-QMTHXVAHSA-N 426.125 4.814 50 10 IJGE O=C(NC1(CCBr)CCSCC1)c1ccc(Br)c(Cl)c1 719665455 LLEJNFRMUNJEDN-UHFFFAOYSA-N 441.616 4.883 50 10 IJGE CC(C)C[C@H](C)O[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 725343879 UALACBCWDZQSGU-WMLDXEAASA-N 425.351 4.642 50 10 IJGE O=C(NCc1ccccc1OC(F)(F)F)NNC(=O)Nc1ccc(-c2ccccc2)cc1 743504378 QMEFYMSYUXUBQH-UHFFFAOYSA-N 444.413 4.788 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)NNc1ccc(Br)c(F)c1)O[C@@H](C)C2 771678487 FSUDFVCKSGFSPG-HZUKXOBISA-N 449.320 4.557 50 10 IJGE COc1ccc(NNC(=O)C(=O)Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)cc1 783021355 DJNZNFRQZAOMGH-UHFFFAOYSA-N 430.291 4.751 50 10 IJGE C#C[C@@H](NC(=O)NNC(=O)c1cc2c(s1)CCCCCC2)c1ccc(Cl)cc1F 1312938682 ZHOGLQQOTGZPBC-QGZVFWFLSA-N 433.936 4.518 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)Nc2ccc3nc(O)n(C)c3c2)c1C 1617357655 RSBLNLNLSYWEEW-XDHOZWIPSA-N 425.492 4.541 50 10 IJGE O=C(CCc1cc(Cl)ccc1Br)NNc1nc2ccccc2[nH]c1=S 1640943507 QXXSORWCSCZGIX-UHFFFAOYSA-N 437.750 4.784 50 10 IJGE C[C@H](Cl)C(=O)Nc1ccc(Oc2ccc(NC(=O)[C@@H]3CCCC[C@@H]3C(=O)O)cc2)cc1 1859505271 SCUYKLBZWZHYOR-KPOBHBOGSA-N 444.915 4.874 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2cccc(F)c2)[C@H]1c1ccc(O)cc1 1865683435 DODWRLRQCNZDSS-QFIPXVFZSA-N 438.462 4.661 50 10 IJGE COc1ccc(-c2nn(C)c3c2[C@@H](c2ccc(Cl)c(Cl)c2)C(C#N)=C(N)O3)cc1 1865685266 HJUDXYVXRWLWRK-KRWDZBQOSA-N 427.291 4.621 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2cc(C)ccc2C)cc1 1865693993 NUKXUTNTHDRBPK-XMMPIXPASA-N 428.536 4.864 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)NNC(=O)c1ccc(Cl)c(Cl)c1 1865755988 ZTIJIPOEDOHTFZ-UHFFFAOYSA-N 436.245 4.717 50 10 IJGE CC[C@H](Br)[C@@H](C)NC(=O)c1cccc(Br)c1Br 1943882779 HUUJUYFXYXPNOU-APPZFPTMSA-N 427.962 4.503 50 10 IJGE CCc1nc(C(=O)N(Cc2ccccc2)C[C@H](C)Br)c(Br)s1 1961182755 UWBJAQUKNZKBRB-NSHDSACASA-N 446.208 4.894 50 10 IJGE Cc1ccc(CNCCSSCCNC(=O)OC(C)(C)C)c(Br)c1 2010826256 YVKFHADHBMWPFH-UHFFFAOYSA-N 435.453 4.753 50 10 IJGE C[C@]12CN(Cc3cc(Cl)ccc3I)C[C@@]1(CBr)C2 2046801301 GPOQZZYHUMDTJE-KBPBESRZSA-N 440.550 4.552 50 10 IJGE CCN(C(=O)c1ccc(Br)cc1I)C(C)(C)CCl 2086151520 OWMFDAAIFIZXJY-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE CC(C)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCN(C[C@H](Br)C(F)(F)F)CC2 2106787865 LCPPMVVSZGSNDA-KBPBESRZSA-N 443.348 4.670 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@@H](CBr)C2(CCC2)C1 2115923673 ILOAWSMLBANYJQ-MRVPVSSYSA-N 427.589 4.801 50 10 IJGE O=S(=O)(c1ccc(Cl)c(CCl)c1)N(Cc1ccccc1)CC1CCOCC1 2152169172 NJJSNGBPGATBEZ-UHFFFAOYSA-N 428.381 4.696 50 10 IJGE CN(C(=O)c1cc(Br)ccc1Br)C1(CCl)CCSCC1 2171186631 XCESPOHFDILJBK-UHFFFAOYSA-N 441.616 4.788 50 10 IJGE CCCCCCCN(C)S(=O)(=O)c1cc(CBr)oc1Br 2196736058 DHGODCYJBTWDAL-UHFFFAOYSA-N 431.190 4.528 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)[C@H]1CCCC[C@H]1N(C)C(=O)OC(C)(C)C 2203609229 JNODMMIPNNRXSM-ZWKOTPCHSA-N 439.394 4.832 50 10 IJGE Cl[C@@H](c1cocc1Br)c1cc(I)cc2c1OCC2 2258099765 UWIINFDPTOVLOO-GFCCVEGCSA-N 439.474 4.910 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@@]2(CCC[C@H]2Br)C1 2264510004 PJZQVHSZEGBGTI-RNCFNFMXSA-N 427.589 4.944 50 10 IJGE CC1(C)C[C@@H](Br)CN1Cc1ccc(Cl)c(I)c1 2300239879 FCOQMJFOGVFPTG-SNVBAGLBSA-N 428.539 4.692 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)cc2I)C[C@@H]1Br 2302337346 WUHJLDKQWIKDJR-LBPRGKRZSA-N 428.539 4.550 50 10 IJGE Cc1ccc(NC(=O)C(C#N)=CN2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1 2324124731 AQPRBDHQDWUIRR-UHFFFAOYSA-N 436.559 4.748 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C)CN(C[C@H](CBr)C(C)(C)C)CC1(F)F 2326651351 ODDCBWPZALQDEK-SUMWQHHRSA-N 427.374 4.526 50 10 IJGE CCN(CC)C(=O)c1cc(C)ccc1NC(=O)C(C#N)=Cc1cccc(Br)c1 2329698970 SNBKAOSIRIRSJG-UHFFFAOYSA-N 440.341 4.785 50 10 IJGE Cl[C@@H](c1cc2c(cc1Br)OCCO2)c1cnsc1Br 2337304787 XQDMWMBGCRFMCZ-NSHDSACASA-N 425.529 4.768 50 10 IJGE Cc1cc(C(=O)N2CC[C@@H](Br)C[C@H]2C(F)(F)F)c(Br)s1 2361459958 BIGRQGIWPJKSIQ-APPZFPTMSA-N 435.103 4.749 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCC2CC1(CBr)C2 2361581719 MTPKFBXKHFMLFS-UHFFFAOYSA-N 425.523 4.631 50 10 IJGE COc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(Cl)cc4)ccc32)c1 38650124 GPLQEAIDJMUVAY-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE CCCCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccco4)ccc32)c1 38685132 CIGGFFXRIDFLIB-HSZRJFAPSA-N 430.460 4.896 50 10 IJGE Oc1nc2ccc([C@H](Br)c3ccccc3I)cc2o1 40285669 RMSAOUFPWMSBHZ-ZDUSSCGKSA-N 430.039 4.622 50 10 IJGE COCCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(-c3ccc(Cl)c(Cl)c3)o2)C1=O 101335692 QOQBCNJXEXJFMH-LFIBNONCSA-N 445.302 4.882 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N[C@H](C)c2cc3cccc(OC)c3o2)c1C 105890080 KCRGSGDSZGOKBC-OXUKKPJISA-N 435.524 4.852 50 10 IJGE CC(C)(CCBr)CNC(=O)c1cc(Br)cc(Br)c1 227910226 DAOHOAOTJWFUQG-UHFFFAOYSA-N 441.989 4.753 50 10 IJGE CC[C@](C)(CCBr)NC(=O)c1cc(Br)c(Br)s1 228569719 MXFXBJFENUNMBR-LLVKDONJSA-N 448.018 4.957 50 10 IJGE CC[C@@](C)(CCBr)NC(=O)c1ccc(I)c(Cl)c1 228570032 NVFTUHOVHFRORX-ZDUSSCGKSA-N 444.538 4.628 50 10 IJGE Cn1cc([C@@H](Br)c2cc(F)c(Br)cc2F)nc1Br 698431910 DKAZZAQSUPZTOE-JTQLQIEISA-N 444.899 4.708 50 10 IJGE COc1ccc(C=NNC(=O)COc2ccc(C(C)C)cc2Br)c(C)c1C 1083949151 ZVYBNSSHOAFNHW-UHFFFAOYSA-N 433.346 4.727 50 10 IJGE COc1cccc(C=NNC(=O)c2ccc(-n3c(C)ccc3-c3ccccc3)cc2)c1O 1084511558 DBZSBXZVADBWQA-UHFFFAOYSA-N 425.488 4.931 50 10 IJGE C#Cc1ccccc1CC(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 1349866067 QAMDOWOYSPQUIL-UHFFFAOYSA-N 434.948 4.617 50 10 IJGE C=C(C)COc1cccc(NC(=O)NNC(=O)COc2ccccc2-c2ccccc2)c1 1465535835 YSUNVHADQQHPHC-UHFFFAOYSA-N 431.492 4.540 50 10 IJGE C=C(CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1c1ccccc1Cl 1473418102 AKWOKGZAHMPIAV-KRWDZBQOSA-N 429.786 4.885 50 10 IJGE CC(C)(Oc1ccc(Cl)cc1)C(=O)NN=Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 1772765473 ZAXLISGJNMAEKG-UHFFFAOYSA-N 427.844 4.816 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C(=O)NNC(=O)C(c2ccccc2)c2ccccc2)cc1 1858081844 KYUYVKFWDLWDAW-UHFFFAOYSA-N 445.519 4.627 50 10 IJGE O=C(c1cccc(F)c1I)N(CCCCl)Cc1ccccc1 1914641246 YZRVAYIVYSLWBH-UHFFFAOYSA-N 431.676 4.702 50 10 IJGE C[C@@H](CS(=O)(=O)N(Cc1ccccc1)[C@@H](CBr)C1CC1)c1ccccc1 1915171232 CTWUTORIPFDLIJ-UWJYYQICSA-N 436.415 4.796 50 10 IJGE CN(Cc1sccc1Br)C[C@@H](Br)COCc1ccccc1 1916347631 JMVPFFOLXMGINS-CQSZACIVSA-N 433.209 4.923 50 10 IJGE C[C@@H](CCBr)N(C)C(=O)c1cc(Br)sc1Br 1917084928 QXRMFPVCXWLNNP-LURJTMIESA-N 433.991 4.519 50 10 IJGE O=S1(=O)CC[C@@H]([C@@H](Br)c2c(Cl)sc(Br)c2Cl)C1 1925570087 AYWSGRDPSPNCHS-INEUFUBQSA-N 443.009 4.688 50 10 IJGE C[C@H]1C[C@H](Br)CCN1C(=O)c1csc(Br)c1Br 1945183713 LYTHREHKWBPOGR-NKWVEPMBSA-N 446.002 4.661 50 10 IJGE C[C@@H](Br)[C@H]1CCN(Cc2c(Br)cccc2Br)C1 1945329815 PDLWXLWDPOPOEE-ZJUUUORDSA-N 425.990 4.817 50 10 IJGE CCC[C@H](Br)CCNC(=O)c1cc(Br)cc(Br)c1 2029924999 WFWRNRSPACWSNK-JTQLQIEISA-N 441.989 4.895 50 10 IJGE CC(C)[C@@H](CCBr)NC(=O)c1c(Br)cccc1Br 2033092471 BHAOXXUQRKVBJU-LLVKDONJSA-N 441.989 4.751 50 10 IJGE CC(N)=C(C#N)c1csc(NC(=O)c2cccc3c(=O)c(C)c(-c4ccccc4)oc23)n1 2040489396 CDEMVDDEAZYNTO-UHFFFAOYSA-N 442.500 4.691 50 10 IJGE CC[C@@H](Br)CN(CC)C(=O)c1cc(Cl)ccc1I 2044550372 KCRPQPDWONOCMI-SECBINFHSA-N 444.538 4.580 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)C(C)(C)C)C[C@@H]1CC(F)F 2057192327 GCEXOOXQLVVDET-KGLIPLIRSA-N 427.374 4.620 50 10 IJGE C[C@@H](Cl)[C@@H](NC(=O)c1cc(Br)c(Br)s1)C(F)(F)F 2074737978 NFCFSBNQZAMSRI-AWFVSMACSA-N 429.483 4.561 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C[C@H](CBr)c1ccccc1 2106782661 SDRCWTRLSKRYHQ-OALUTQOASA-N 425.411 4.742 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@H](NC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2106784062 FQQSYFHSRMWOEQ-QYZOEREBSA-N 425.411 4.646 50 10 IJGE COc1ccc(Br)cc1[C@@H](Cl)c1nn(C)c(Cl)c1Br 2110720031 AIEFIRRTMXYTEY-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE CC1(C)CO[C@@H](COc2c(Br)cc(Br)cc2CCl)CO1 2176668121 QDYWYALQVWOXLA-NSHDSACASA-N 428.548 4.523 50 10 IJGE CCN(CCCCCI)CC1CCN(C(=O)OC(C)(C)C)CC1 2211185563 KKDIVKXECKUEGS-UHFFFAOYSA-N 438.394 4.561 50 10 IJGE Cc1cc(Br)c([C@H](Cl)C2(C)CS(=O)(=O)C2)c(C)c1Br 2227346040 BIUYAFXCYCCUBS-LBPRGKRZSA-N 430.589 4.543 50 10 IJGE C[C@@H]1CC[C@H](COC2(CI)CCN(C(=O)OC(C)(C)C)CC2)C1 2243469181 GFEQLIXGOZDYDO-CABCVRRESA-N 437.362 4.644 50 10 IJGE C[C@H](CC1CCN(CC2(CBr)CC(F)C2)CC1)N(C)C(=O)OC(C)(C)C 2265632148 KWTYNCITDJQWPW-XRTORIHISA-N 435.422 4.857 50 10 IJGE C=CC[C@]1(CBr)CCCCN1Cc1ccc(I)cc1 2272132593 PXBDJTSFFWVMGM-MRXNPFEDSA-N 434.159 4.987 50 10 IJGE COC[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)N(CCCCCCCCCBr)C1 2289504120 UEPQSYZHJQZMHA-OALUTQOASA-N 449.474 4.974 50 10 IJGE CC1(C)OC[C@H](Cc2ccc(I)c(Br)c2)[C@@H]1Cl 2306216492 GUCCHFWBQQXDIB-CABZTGNLSA-N 429.523 4.629 50 10 IJGE Clc1cc(CN2[C@H]3CC[C@H](C3)[C@@H]2CBr)ccc1I 2312137802 ROZBHFLWOJEIQS-SUNKGSAMSA-N 440.550 4.692 50 10 IJGE CNC(=O)C(C#N)=C1S[C@H](Cc2ccc(C)c(C)c2)C(=O)N1c1ccc(C(C)C)cc1 2314593101 HNIAIBVCOAXPOV-JOCHJYFZSA-N 433.577 4.599 50 10 IJGE COc1cc(C=C2C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(C)cc1 2314611517 WEAYIZCVHUSPAI-UHFFFAOYSA-N 444.531 4.831 50 10 IJGE CC(C)[C@@H]1[C@@H](Br)CCN1Cc1ccc(Cl)c(I)c1 2315549889 XJDCXWLQISLLCQ-SMDDNHRTSA-N 442.566 4.938 50 10 IJGE CN(C)c1ccc([C@H](CNC(=O)C(C#N)=Cc2ccc(Cl)cc2)N2CCCCC2)cc1 2329647013 IGWYAECQDFZNLD-DEOSSOPVSA-N 436.987 4.656 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)c3cc(OC)c(OC)cc3[N+](=O)[O-])n2)cc1 2331276398 QHBILUGJOHFZOU-UHFFFAOYSA-N 439.449 4.694 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@]12CCC[C@H](CN(C[C@@H](CBr)C3CCC3)C1)C2 2333680215 YDKZNQCGEMIZBI-CDXJDZJCSA-N 429.443 4.909 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CCCC[C@]3(NC(=O)OC(C)(C)C)C2)C1 2345004348 JKZVVCRQWXTMAL-IERDGZPVSA-N 429.443 4.957 50 10 IJGE Cc1nc(Oc2c(F)cc(Br)cc2[N+](=O)[O-])sc1CBr 2364175392 MMUDNLPUEICQBU-UHFFFAOYSA-N 426.061 4.949 50 10 IJGE CN(C[C@@H](Cl)C1CCCC1)C(=O)c1ccc(Cl)cc1I 2365601598 ZONOMZYZHGJWAW-CYBMUJFWSA-N 426.125 4.814 50 10 IJGE CC1CCC([C@H](CBr)NCc2nn(C)c(Cl)c2Br)CC1 2379755145 LDJBRXCOPRBMIM-ILDUYXDCSA-N 427.612 4.515 50 10 IJGE Cc1csc(SCc2ccc(C(=O)NNC(=O)c3oc4ccccc4c3C)cc2)n1 17448000 XFYJYRMSGZWKMS-UHFFFAOYSA-N 437.546 4.873 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4OC)ccc32)cc1 38676809 CAYUSLMXQZCUHT-DEOSSOPVSA-N 426.472 4.695 50 10 IJGE C[C@@H](Oc1ccc(F)cc1)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cccc(F)c1 38678116 VMTRYLSBLADRHY-QKFKETGDSA-N 448.425 4.556 50 10 IJGE N#CC1=C(N)N2C(=C(C#N)[C@@H]1c1ccc(-c3cccc([N+](=O)[O-])c3)o1)Sc1ccccc12 39794224 LCLNKBYYZREVAP-OAQYLSRUSA-N 439.456 4.993 50 10 IJGE COc1c(C)cccc1C(=O)N/N=C1/C(=O)N(Cc2cccc3ccccc23)c2ccccc21 59160779 NENVZLSTZHCBMU-XLVZBRSZSA-N 449.510 4.838 50 10 IJGE C[C@@H]1c2ccsc2CCN1S(=O)(=O)c1cc(CCl)sc1Br 91269524 HQROFSAUVZBFGZ-MRVPVSSYSA-N 426.810 4.619 50 10 IJGE Fc1cc(Br)cc(F)c1-n1c(CCl)nc2cc(Br)cnc21 98040519 ITDMDFPTJUMFOH-UHFFFAOYSA-N 437.469 4.963 50 10 IJGE Br[C@@H](c1ccc(I)cc1)c1ccc2c(c1)OCCCO2 109842981 BZDLKQYGSIWAGO-INIZCTEOSA-N 445.094 4.937 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1Br)c1cc(C(F)(F)F)ccc1Br 123004828 GRLSEJJDTNWHQF-NEPJUHHUSA-N 429.074 4.904 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3ccccc3C)n2-c2ccccc2)cc1 263628512 LXCOLPXAOAJGDP-UHFFFAOYSA-N 441.560 4.794 50 10 IJGE CCCCc1ccc([C@@H](Br)c2cnn(C)c2I)cc1 381900700 LLOWANSQAKFRSQ-CQSZACIVSA-N 433.131 4.852 50 10 IJGE CC(CBr)(CBr)NC(=O)c1ccc(OCc2ccccc2)cc1 390799602 NEKKXYKILUPKBR-UHFFFAOYSA-N 441.163 4.544 50 10 IJGE C[C@@H]1CCCN(C(=O)c2ccc(I)c(Cl)c2)[C@@H]1CCCl 697196117 YJZYKKCRHUUBDV-QMTHXVAHSA-N 426.125 4.814 50 10 IJGE CCO[C@@H](CO[C@H](CI)c1ccc(Br)cc1)C1CC1 703470734 NYWNVDZCMKUYSB-CABCVRRESA-N 439.131 4.757 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCCOc2ccc(C(C)(C)C)cc2)c1C 736697073 SSCKXFKEVOBQHE-UHFFFAOYSA-N 433.556 4.755 50 10 IJGE O=C(NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl)[C@@H]1C[C@@H]1c1cc(F)ccc1F 743301052 QYPOGKBLFMVSIY-ZYHUDNBSSA-N 449.832 4.758 50 10 IJGE Cc1ccc2c(CCC(=O)NNC(=O)c3ccccc3OCc3ccc(F)cc3)c[nH]c2c1 744455964 RLFKFSHPWCIQTD-UHFFFAOYSA-N 445.494 4.588 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N[C@H]2CCCC(F)(F)C2)c(-c2ccc(Cl)cc2)n1 769341268 CSVKHZCYEBVYJX-SKTWIKFTSA-N 443.885 4.718 50 10 IJGE Cc1sc2nc(CC(=O)NN=C3CC(c4ccc(C(F)(F)F)cc4)C3)nc(O)c2c1C 781582898 XFGRESSMKVJKON-UHFFFAOYSA-N 448.470 4.625 50 10 IJGE C=C(C)COc1cccc(NC(=O)NNC(=O)c2ccc(OCCC(C)C)c(OC)c2)c1 1199787411 SBAJIVQQWFCJTA-UHFFFAOYSA-N 441.528 4.542 50 10 IJGE C#CC1(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Br)cc3)c2C)CCCC1 1625026687 HBQNCIJVRBXWQJ-XMHGGMMESA-N 436.353 4.826 50 10 IJGE C=C(C)[C@H](NC(=O)NNc1ccccc1I)c1ccc(F)c(F)c1 1680284415 NLCSTAGCKQVOQR-INIZCTEOSA-N 443.235 4.513 50 10 IJGE Cc1c(C(=O)Nc2cccc3ccccc23)oc2c1C(=NNC(=O)c1ccccn1)CCC2 1772747715 SROTVUJDALIRGT-UHFFFAOYSA-N 438.487 4.859 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2cc(C)ccc2C)cc1 1865694874 DOJYCMFRVOWQRQ-HSZRJFAPSA-N 428.536 4.728 50 10 IJGE CCc1nn(CC)c2c1[C@H](c1ccc(OCc3ccc(Cl)cc3)cc1)C(C#N)=C(N)O2 1865694905 FGPADZHQYOYNBL-OAQYLSRUSA-N 434.927 4.916 50 10 IJGE CC(C)Oc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2-c1ccccc1 1865705198 OLNXNUZAHNOPBN-GOSISDBHSA-N 440.425 4.896 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CCl)Cc1sc(Cl)cc1I 1889589971 YCFXJDNHUMDNPS-SSDOTTSWSA-N 436.142 4.681 50 10 IJGE C[C@H](CS(=O)(=O)N(Cc1ccccc1)C1(CBr)CCC1)c1ccccc1 1915754884 FLFDMKWNASRCEM-GOSISDBHSA-N 436.415 4.940 50 10 IJGE CCN(C[C@@](C)(CI)OCCC1(F)CCC1)C(=O)OC(C)(C)C 1994682719 ZFTURUHRGCGVHN-MRXNPFEDSA-N 443.341 4.736 50 10 IJGE Cn1nc([C@@H](Br)c2cc(F)c(Br)cc2F)cc1Br 2033076474 URLCOQOJFFZFRT-NSHDSACASA-N 444.899 4.708 50 10 IJGE Clc1ccc(I)c(CN2[C@H]3CC[C@@H](C3)[C@@H]2CBr)c1 2058367129 XNHHFPULAGYWGZ-WFBYXXMGSA-N 440.550 4.692 50 10 IJGE COC[C@@H](C)CCO[C@@H](CI)c1cccc(Br)c1 2067237644 NEWSXHSNHXGODG-FZMZJTMJSA-N 427.120 4.614 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2106784059 FQQSYFHSRMWOEQ-CEXWTWQISA-N 425.411 4.646 50 10 IJGE O=S(=O)(N(Cc1ccccc1)CC1CCCCC1)N1CCCC[C@H]1CBr 2123230882 WVDMKTPCCOFBRB-FQEVSTJZSA-N 443.451 4.563 50 10 IJGE Cc1cc(Br)c(C(=O)N2CC(F)(F)C[C@@H]2CBr)cc1Cl 2159045985 FYOFRXOYLXWDMO-MRVPVSSYSA-N 431.502 4.656 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]2CC[C@H](C1)N2C[C@H](CBr)c1ccccc1 2163063022 OCYAALMBQCSBHF-FRYIKTPZSA-N 437.422 4.933 50 10 IJGE Cn1nc([C@H](Br)c2cc(Cl)cc3c2OCC3)c(Br)c1Cl 2167047942 MWFBVGPDHHLCHW-SECBINFHSA-N 440.950 4.909 50 10 IJGE Cc1sc(Br)c([C@H](Br)[C@]23CCC[C@H]2CS(=O)(=O)C3)c1C 2203025053 USXATHPBMTVARZ-JKOKRWQUSA-N 442.238 4.778 50 10 IJGE Cc1sc(C(=O)N2CCC(F)(F)[C@@H](CBr)C2)c(Br)c1C 2237623544 KLOCNKSYLWFPTA-VIFPVBQESA-N 431.140 4.620 50 10 IJGE CC(C)(C)CCN(CCBr)C(=O)c1sccc1I 2261133839 JNQNKCOYRNGEQB-UHFFFAOYSA-N 444.176 4.626 50 10 IJGE CCCN(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)CC1(CBr)CC(F)C1 2265632804 QCEZMHVQBWXJMG-VXESANQCSA-N 435.422 4.859 50 10 IJGE COC[C@@]1([C@@H](Br)c2cc(Cl)cc(Br)c2OC)CCCO1 2295360602 SBIIRXMUILLILN-UONOGXRCSA-N 428.548 4.743 50 10 IJGE COc1ccc(OC)c(-c2cc(C(=O)NN=CC=Cc3ccco3)c3ccccc3n2)c1 2295532769 XUFBRLUALGMQGN-UHFFFAOYSA-N 427.460 4.941 50 10 IJGE O=C(NN=CC(Br)=Cc1ccccc1)[C@H]1COc2cc3ccccc3cc2O1 2296845217 IAZPECNVYCBUQO-OAQYLSRUSA-N 437.293 4.518 50 10 IJGE N#CC(=Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 2297551516 OWVJIXMMQGGAPX-UHFFFAOYSA-N 438.783 4.962 50 10 IJGE CCN[C@@H](c1cc(Br)c(Br)cc1F)[C@@H]1C[C@@H]1Br 2298019751 LHNJTMBAEFZNFK-UTMSNSNXSA-N 429.953 4.785 50 10 IJGE C[C@@H]1OCC[C@]1(CBr)Cc1ccc(Cl)c(I)c1 2300242378 JVBHTJSWJRSGKM-TVQRCGJNSA-N 429.523 4.677 50 10 IJGE CC(C)[C@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)[C@H](Br)C(C)C)n1 2315749217 UWZIHQLOGNGUCZ-OLZOCXBDSA-N 434.400 4.723 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2N)ccc1OCc1ccc(Cl)c(Cl)c1 2323203033 MDMGMUFMDXOLAU-UHFFFAOYSA-N 444.318 4.927 50 10 IJGE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1cccc(OCc2ccccc2)c1 2328796332 DGZWDAUXGMARBL-AVRDEDQJSA-N 439.556 4.655 50 10 IJGE Cc1sc(Br)cc1C(=O)N1CC[C@@H](Br)C[C@H]1C(F)(F)F 2361459037 QEVPMJPTPYATMC-APPZFPTMSA-N 435.103 4.749 50 10 IJGE CN(Cc1csc(Br)c1)c1c(CBr)c(C(F)F)nn1C 2365274439 BVBXWUIZDKCANH-UHFFFAOYSA-N 429.128 4.713 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)NS(=O)(=O)c1ccc(Cl)c(Br)c1 2365957516 UAFFSFGBMMVTTG-GFCCVEGCSA-N 447.620 4.579 50 10 IJGE Cc1sc(C)c(S(=O)(=O)NC(C)(C)[C@H](Br)C(C)C)c1Br 2365961529 HJXOEKXKCVTRAF-GFCCVEGCSA-N 447.258 4.604 50 10 IJGE FC(F)(F)c1ccc(CBr)c(N2C[C@H]3CN(Cc4ccccc4)C[C@@H]3C2)n1 2369843361 UWPQPEWZBNQTGW-IAGOWNOFSA-N 440.307 4.564 50 10 IJGE COc1ccc(N(C(=O)CCl)[C@@H](C(=O)NC2CCCCC2)c2ccccc2F)cc1 3033999 GYUQWBJGCYYTHE-JOCHJYFZSA-N 432.923 4.596 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(C(=O)NNC(=O)/C=C/c3cccc4ccccc34)cc2)c1 12578317 PRKOUTBOXSKHCP-SAPNQHFASA-N 449.510 4.875 50 10 IJGE COc1cc(/C=C(/C#N)c2nc3ccccc3[nH]2)ccc1OCC(=O)N[C@@H]1CCCC[C@@H]1C 33555945 JHHZZZISGQTAMO-AWZDISBRSA-N 444.535 4.709 50 10 IJGE CCCCCCCCCOc1ccc(/C=N\NC(=O)c2cccn(C)c2=O)cc1OCC 169918736 PEFGEFBIBKGEDU-XHPQRKPJSA-N 441.572 4.677 50 10 IJGE CCC(CC)[C@H](Br)CNS(=O)(=O)c1ccc(Br)cc1Cl 230664219 LSKBIXQPKWPECO-LLVKDONJSA-N 447.620 4.581 50 10 IJGE FC(F)(F)CN(CCBr)c1ncc(Br)cc1C(F)(F)F 231483226 VGFDWCZWRXQSHR-UHFFFAOYSA-N 429.984 4.627 50 10 IJGE Cc1c(CNC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)oc2ccccc12 734674145 PVYNWYDKRYMEKJ-UHFFFAOYSA-N 447.466 4.604 50 10 IJGE COc1cc([C@@H](C)NC(=O)NNC(=O)c2cccc3ccccc23)ccc1OC1CCCC1 743536595 IFLKYNUKLKWEHF-QGZVFWFLSA-N 447.535 4.875 50 10 IJGE COc1ccccc1Oc1ccc(NC(=O)NNC(=O)c2cccc3cccnc23)cc1F 756212345 OJEYRELKCIEGSC-UHFFFAOYSA-N 446.438 4.641 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccccc3S[C@@H](C)CC#N)n[nH]2)cc1C 756489605 QDSRFGMAUHYUDL-INIZCTEOSA-N 448.552 4.554 50 10 IJGE Cc1cc(C(=O)NNc2ccc([N+](=O)[O-])cc2Cl)ccc1NC(=O)c1cccs1 759662234 HOVXHIAULZFASO-UHFFFAOYSA-N 430.873 4.627 50 10 IJGE CS(=O)(=O)c1cccc(NNC(=O)/C(=C\c2ccc(Cl)cc2)c2ccc(F)cc2)c1 776720633 GGYBDLLSDQEPDE-BKUYFWCQSA-N 444.915 4.567 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)Nc2cccc3ocnc23)c(-c2ccc(Cl)cc2)n1 791002286 HEDKRFGOJVYUQR-LFIBNONCSA-N 442.866 4.804 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NC[C@@H]2CCC(F)(F)C2)c(-c2ccc(Cl)cc2)n1 797558814 GJZBPEHQUNAGSC-DISPHTKASA-N 443.885 4.576 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1NNC(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 805375046 XLSCIAZHFIEFSQ-UHFFFAOYSA-N 447.426 4.880 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCCCCC[C@H]1C(=O)NNc1nc2ccccc2[nH]c1=S 1148222607 FBFLHXISDJXOJX-CABCVRRESA-N 445.589 4.599 50 10 IJGE Cc1cc(Cl)ccc1NNC(=O)CSCc1nc(O)c2c3c(sc2n1)CCCC3 1154538656 UWHJQPVEWUIWPQ-UHFFFAOYSA-N 449.001 4.614 50 10 IJGE CC(C)c1ccccc1NC(=S)NNC(=O)c1cccc2nc(O)n(CC(C)(C)C)c12 1448544817 BSYSTWVSQSWFHD-UHFFFAOYSA-N 439.585 4.543 50 10 IJGE O=C(CSc1nc(O)c2ccc(Cl)cc2n1)NN=C(c1ccccc1)c1ccccc1 1472989629 CTEPPGVVELPTOE-UHFFFAOYSA-N 448.935 4.650 50 10 IJGE C=CCOc1ccc(CNC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 1525527549 RYHAEXUXEZFZDS-XQNSMLJCSA-N 441.531 4.891 50 10 IJGE Cc1ccc(N2C(=O)c3ccc(C(=O)Nc4ccc(SC#N)cc4)cc3C2=O)c(C)c1 1859467178 PFGGJLZMDPMILZ-UHFFFAOYSA-N 427.485 4.930 50 10 IJGE Cc1cccc(OCCCC(=O)NNC(=O)c2ccc(-c3ccc(C)c(C)c3)nc2C)c1 1865756421 XVWIRXBEBNHBPF-UHFFFAOYSA-N 431.536 4.602 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3C)n2)cc1 1872745905 JCNUQLYKWNNHRD-MNDPQUGUSA-N 438.421 4.893 50 10 IJGE COC(=O)[C@]1(C(C)C)C[C@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 1912260393 SGCVWFPRCVYWRR-WMZHIEFXSA-N 435.637 4.987 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC12CCC1(CC2)CC[C@](C)(CI)O1 1937359264 AHKOSPLNJYZOHS-XXXLFRTPSA-N 435.346 4.587 50 10 IJGE CC[C@@H](Br)CCCNC(=O)c1csc(Br)c1Br 1945186700 KQGBOMPRPMSXTQ-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE C[C@@H](Br)C[C@@H](C)NC(=O)c1c(Br)cccc1Br 1945333866 WBMSZFDCBKGTOV-HTQZYQBOSA-N 427.962 4.503 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@@]1(CCC[C@@H](CI)O1)C2 1949545467 AGKZDVKFMWUETI-KXBFYZLASA-N 449.373 4.931 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)CCc1nc(-c2ccccc2)cs1 2025439303 BHADPKOYKADUGQ-HNNXBMFYSA-N 441.350 4.802 50 10 IJGE C[C@H]1[C@@H](CBr)CCN1Cc1ccc(I)c(Cl)c1 2026567577 SZKBRVITLNSZFL-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE CC(C)(C)[C@H](CBr)NC(=O)c1cccc(Br)c1Br 2031479071 KNWPJWMUWHHEGE-JTQLQIEISA-N 441.989 4.751 50 10 IJGE CCC[C@H](Cl)c1cn(-c2cc(I)ccc2Br)nn1 2057422510 VARBXRGCXTXTCV-JTQLQIEISA-N 440.510 4.714 50 10 IJGE ClC[C@@H]1CCCC[C@@H]1CNc1ncc(I)cc1Br 2069526179 RMWGSFZLHKQHSI-VHSXEESVSA-N 443.554 4.906 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1cc(Br)ccc1Cl 2090386204 XMOVBIUFUNYNFJ-VIFPVBQESA-N 429.605 4.739 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)C1CCN(C[C@@H](CBr)c2ccccc2)CC1 2106789553 ZGHFCVOKVZQGNY-QFBILLFUSA-N 425.411 4.790 50 10 IJGE C[C@@](CI)(OC[C@@H]1CCCOC1)c1ccccc1Br 2116006773 RUVYYJQPFWXISZ-DOMZBBRYSA-N 439.131 4.543 50 10 IJGE F[C@]12CCC[C@@]1(CCl)CN(Cc1cc(Cl)ccc1I)C2 2176637281 UCUBAYSRZLIDNS-CABCVRRESA-N 428.116 4.878 50 10 IJGE O=C(NC[C@]1(CBr)C[C@@H]1C(F)(F)F)c1cccc(OCc2ccccc2)c1 2192581193 OZMLNRVIPJQNSE-PKOBYXMFSA-N 442.275 4.959 50 10 IJGE O=C(c1cc(Cl)cc(Br)c1)N1CC[C@H](C(F)(F)CBr)C1 2197764945 YCEXDUKEXKFOJC-VIFPVBQESA-N 431.502 4.595 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@H]2C[C@H](Br)CC[C@H]2C1 2264503119 CIMVVBUVZFYWEX-DJLDLDEBSA-N 427.589 4.800 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CCC([C@H](F)CBr)CC1 2264512319 BGQPNRQWFGXXPV-SECBINFHSA-N 433.568 4.749 50 10 IJGE CC1CC(CBr)(CN2CCC3(CC2)CCN(C(=O)OC(C)(C)C)CC3)C1 2265311022 ARFBNLAPURJEJH-UHFFFAOYSA-N 429.443 4.911 50 10 IJGE CC[C@@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@H]1CBr 2282969697 GATBDUGRHWXHTG-RKDXNWHRSA-N 427.539 4.735 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCC[C@](F)(CBr)C1 2285845668 DJAQTTPKDOXRJN-ZDUSSCGKSA-N 431.502 4.581 50 10 IJGE CC(C)CN(CCBr)Cc1ccc(Cl)c(I)c1 2300240755 PZNZJOWOLRRIDF-UHFFFAOYSA-N 430.555 4.798 50 10 IJGE FC1(F)[C@@H]2CC(CBr)(Cc3sccc3I)C[C@H]21 2301052799 KMVVHOAFJXQNEE-HTQZYQBOSA-N 433.099 4.952 50 10 IJGE ClCc1cnc(OCc2cc(I)ccc2Br)s1 2302647790 YJQHOJZUUBYZII-UHFFFAOYSA-N 444.519 4.828 50 10 IJGE COc1cccc(C=C(C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)c1OCc1ccccc1 2313681232 WFAMXORLPRXKCM-UHFFFAOYSA-N 429.432 4.728 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Br)c2)C[C@H](C)C1Cl 2325215305 XSYGLMVSVHTLML-UWVGGRQHSA-N 442.566 4.749 50 10 IJGE FC(F)(F)[C@H]1C[C@@H](Br)CCN1Cc1ccc(I)cc1 2336292822 XJNLLHCLDRZBNW-CMPLNLGQSA-N 448.064 4.581 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@]2(CBr)CC2(F)F)c2ccccc2C1 2351887072 ISXWCVMJDWOYPA-GOSISDBHSA-N 431.321 4.664 50 10 IJGE FC1(F)C[C@]1(CBr)CN1CCC[C@@]2(CCCN(Cc3ccccc3)C2)C1 2351892431 PAFQFSNMWWBAIL-UXHICEINSA-N 427.377 4.785 50 10 IJGE Cc1ccc(C(=O)NNC(=O)c2ccc(N3CCc4cc5ccc(C)cc5nc43)cc2)cc1 39881540 RDBNADWXTCBADF-UHFFFAOYSA-N 436.515 4.621 50 10 IJGE CS(=O)(=O)c1cccc([C@@H](Cl)c2cc(Br)ccc2Br)c1 40269140 LQKDWPUETWKDBV-CQSZACIVSA-N 438.568 4.943 50 10 IJGE Cc1ccc(C(=O)NNc2ncnc(Nc3cc(Cl)cc(Cl)c3)c2[N+](=O)[O-])cc1 40588055 PWTKZYSLULXRQP-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2cc(C)n(-c3ccccc3F)c2C)cc1 58894348 YKXJBCWILSWWPQ-YMCFUUGVSA-N 437.515 4.596 50 10 IJGE O=C(NNC(=O)c1ccco1)/C(=C\c1cccc(OCc2ccccc2)c1)c1cccs1 98004346 NOBMOOUYWCEOGV-PGMHBOJBSA-N 444.512 4.922 50 10 IJGE CNC(=O)/C(C#N)=C1\S[C@H](Cc2cccc(Cl)c2)C(=O)N1c1ccc(C(C)C)cc1 101240531 NDYPJOILHSMYBB-LBMWUGKUSA-N 439.968 4.636 50 10 IJGE CCCCOc1ccc(C(=O)NN=Cc2ccc(OC(=O)c3ccccc3F)cc2)cc1 254815027 ZFMOGSHGQNPLHR-UHFFFAOYSA-N 434.467 4.988 50 10 IJGE C[C@H](Br)[C@H](Br)[C@@H]1CC[C@@H](Br)[C@H](Br)C1 256837865 GBWKXPCFLWAUOQ-CBHQDSPSSA-N 441.827 4.860 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@@H](c2cc(Br)ccc2F)C1 382696385 VPLRNTMYLKDETK-MFKMUULPSA-N 437.147 4.934 50 10 IJGE O=C(NC1(CCBr)CCCCC1)c1ccc(I)cc1 687326890 TXYCOTIGPIUFEO-UHFFFAOYSA-N 436.131 4.509 50 10 IJGE CC[C@]1(C)[C@@H](Br)C[C@H]1Oc1ccc(OC)c(I)c1 712929946 KDVYAEVJZWEBSF-BFHYXJOUSA-N 425.104 4.631 50 10 IJGE CC[C@@]1(C)[C@@H](Oc2ccc(OC)c(I)c2)C[C@H]1Br 712929949 KDVYAEVJZWEBSF-HZSPNIEDSA-N 425.104 4.631 50 10 IJGE COc1ccccc1Nc1nc2sc(C(=O)NNc3ccc(Cl)nc3)cc2s1 743818810 NSJFAIVJTUCJRT-UHFFFAOYSA-N 431.930 4.915 50 10 IJGE O=C(/C=C(\c1ccc(Cl)cc1)C(F)(F)F)NNC(=O)C12CC3CC(CC(C3)C1)C2 761702202 JBSVAKVNOTTWNV-CAOOACKPSA-N 426.866 4.650 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=O)N[C@@H](c2cccc(Cl)c2)c2ccccn2)cc1 761801433 UHSHYXHUQOCPDJ-NRFANRHFSA-N 436.943 4.766 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OCc2cccc(F)c2)c(-c2ccc(Cl)cc2)n1 782090002 GPTXOSPRLZRQMR-LDADJPATSA-N 434.858 4.907 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(C)c1C=NNC(=O)[C@@H](C)SCc1ccccc1 1084201124 LVKPTJYJHBCAJH-GOSISDBHSA-N 441.000 4.974 50 10 IJGE CC(=O)C(C)(C)CCC(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12 1136132008 WBYIVHBERXLVNB-UHFFFAOYSA-N 437.927 4.712 50 10 IJGE CC(=O)C1(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Cl)c(C(F)(F)F)c3)c2C)CC1 1141858072 YORSLPKQEZSAPO-SXGWCWSVSA-N 449.860 4.911 50 10 IJGE C#C[C@@H](NC(=O)NNC(=O)c1ccc(OCCCCCC)cc1)c1ccc(Cl)cc1 1252448628 JMOHYAVMFSDVSV-OAQYLSRUSA-N 427.932 4.618 50 10 IJGE C=CC[C@]1(C(=O)N2CC[C@@H](O[Si](C)(C)C(C)(C)C)C2)CCCN1C(=O)OC(C)(C)C 1470550376 BKSMIKMDNHQVGQ-WZONZLPQSA-N 438.685 4.955 50 10 IJGE C=CC[C@]1(C(=O)NNc2cc(C(F)(F)F)ccc2F)CCCN1C(=O)OC(C)(C)C 1556051342 MJLHQGVPMZVRJH-LJQANCHMSA-N 431.430 4.633 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706302 SPKPTUIDNWWJON-FQEVSTJZSA-N 449.898 4.664 50 10 IJGE CCn1nc(C(F)(F)F)c2c1OC(N)=C(C#N)[C@H]2c1cccc(OCc2ccccc2)c1 1865712218 SLKBUZVDODSWTG-GOSISDBHSA-N 440.425 4.719 50 10 IJGE C[C@H](c1cccs1)N(Cc1ccccc1)Cc1cc(Br)cc(C(=O)NN)c1 1915379621 BHABLSYEPCYPJP-OAHLLOKOSA-N 444.398 4.878 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CC[C@H]2C[C@@H]2C1)C(=O)OC(C)(C)C 1917418955 CNVKOIXZDYYZHY-BORJPKMPSA-N 437.362 4.642 50 10 IJGE Brc1cnc(N2CC[C@@]3(CCC[C@H]3Br)C2)c(Br)c1 1918905537 XBCFXWDECWTILT-YPMHNXCESA-N 438.989 4.751 50 10 IJGE CCn1ncc(Br)c1[C@@H](Br)c1ccc(Br)s1 1937907727 KMZAAWHBLYVMQA-VIFPVBQESA-N 428.975 4.974 50 10 IJGE BrC[C@@H]1CCCCN1Cc1cc(Br)ccc1Br 2006502083 XHJIKSOZCCHMSY-LBPRGKRZSA-N 425.990 4.961 50 10 IJGE CCCN(CCCBr)C(=O)c1cc(Cl)ccc1I 2032096158 RXXGHPABRZOPKU-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CCC[C@H]1CCBr 2033093692 KJARWXFQAQNECE-VIFPVBQESA-N 439.973 4.601 50 10 IJGE O=C(Nc1cc(Br)ccc1Br)N1CCC(Br)CC1 2043823215 FMFUMAKRPUFUPK-UHFFFAOYSA-N 440.961 4.603 50 10 IJGE CC(C)N1C[C@@H](Br)[C@H](Cc2cc(Br)ccc2Br)C1 2054720264 WNEBCRSYEZVJIM-BXUZGUMPSA-N 440.017 4.858 50 10 IJGE CC(C)[C@@H](Cl)c1cn(-c2ccc(I)cc2Br)nn1 2057427323 PGJAUEFWLCIWGE-GFCCVEGCSA-N 440.510 4.570 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCCCC[C@H]1NC(=O)c1ccc(CBr)cc1 2106199031 FKEWQKSMGCTIMI-SJORKVTESA-N 425.367 4.537 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1cccc(Br)c1F 2117896117 XWVDUHJJRDAIJG-SNVBAGLBSA-N 442.110 4.702 50 10 IJGE CC(C)(C)OC(=O)NCCN(C(=O)[C@@H](Br)C1CCCC1)C1CCCCC1 2130058861 WFSVNNGTMYIVNR-KRWDZBQOSA-N 431.415 4.626 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)[C@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 2162866817 BPRLPUGOLVWETI-KRWDZBQOSA-N 439.394 4.689 50 10 IJGE CC(C)(C)OC(=O)N1CCCN(C(=O)N2CCC(Br)CC2)c2ccccc21 2163055074 CTFZHWKUILGEEJ-UHFFFAOYSA-N 438.366 4.618 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC[C@@H](NC(=O)[C@@H](Br)C3CCCC3)C2)CC1 2167035015 ZNOBDLQDKFTLNV-SJORKVTESA-N 443.426 4.626 50 10 IJGE CC(F)(F)C[C@H](CBr)NC(=O)c1scc(Br)c1Cl 2253554026 WYHUMXUXDBMSRP-RXMQYKEDSA-N 425.520 4.703 50 10 IJGE CC[C@]1([C@@H](Br)c2ccc(OC)c(I)c2)CCCO1 2257353227 CEZRFJVGXFBAFZ-UONOGXRCSA-N 425.104 4.695 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@@H](Br)CC2(CC2)C1 2282978356 MCXHYYQTJVDUJF-QMMMGPOBSA-N 425.523 4.631 50 10 IJGE COc1cc(F)c(CBr)c(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1 2283392012 NFJNWXPYQZCDFC-QFIPXVFZSA-N 433.365 4.832 50 10 IJGE Cc1c(Br)csc1C(=O)N1CCC(CBr)(C(F)F)CC1 2289951107 IWHHJUCDMISODZ-UHFFFAOYSA-N 431.140 4.701 50 10 IJGE N#CC(=Cc1cn(Cc2ccccc2)nc1-c1ccccc1)C(=O)Nc1ccc2c(c1)OCO2 2295672651 JTKBNXVELKPQGN-UHFFFAOYSA-N 448.482 4.873 50 10 IJGE COc1ccc(C=C(C#N)C(=O)NC2CCC(c3c[nH]c4ccccc34)CC2)cc1OC 2329701020 QXYKEXLELXSPPG-UHFFFAOYSA-N 429.520 4.935 50 10 IJGE COc1ccc(C[C@H](Cl)c2c(Br)c(Br)nn2C)cc1F 2364230750 QIXQDRXUXBPJKY-QMMMGPOBSA-N 426.511 4.615 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(O[C@H]2CCOc3ccc(F)cc32)C1 2364439039 VYDLKFGZDIYUOK-PXNSSMCTSA-N 444.341 4.831 50 10 IJGE CC[C@@H](Oc1ccc2ccccc2c1Br)C(=O)N/N=C/c1ccccc1OC 20572893 OFHKZAGLJBOVJD-SDCZFJSOSA-N 441.325 4.919 50 10 IJGE N#C/C(=C/c1ccc(OC(=O)CCCN2C(=O)c3ccccc3C2=O)cc1)c1ccccc1 31900186 RVQOPYMDSKFJOJ-FXBPSFAMSA-N 436.467 4.733 50 10 IJGE CCc1ccc(O[C@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(C)o2)cc1 38659361 XQDYYWKVDYSKGK-GYCJOSAFSA-N 444.487 4.742 50 10 IJGE CCc1ccc(Nc2ncnc(NNC(=O)c3cccc4ccccc34)c2[N+](=O)[O-])cc1 40587348 KBWYRNMZEXZMLF-UHFFFAOYSA-N 428.452 4.601 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccn2)CCC3)cc1Cl 40814275 TZGJXKRSPBRAQX-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2cc(C)n(-c3ccccc3F)c2C)cc1 58894350 YKXJBCWILSWWPQ-GJVLPJBHSA-N 437.515 4.596 50 10 IJGE O=C(CSc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)o1)Nc1ccccc1 59381933 WHBZHJGQRSMCBY-AFUMVMLFSA-N 445.500 4.633 50 10 IJGE CCOc1ccc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccccc4)nc3c2)c(OCC)c1 169925766 YVTRUMFTTVPERZ-PKAZHMFMSA-N 442.519 4.715 50 10 IJGE CC(C)(C)S(=O)(=O)CC[C@H](CBr)Cc1ccccc1Br 232677614 FGJOGXNVFIHVPP-LBPRGKRZSA-N 426.214 4.606 50 10 IJGE O=C(NN=C1CC(=O)c2ccccc21)c1ccc(CSc2nc3ccccc3o2)cc1 254739967 GPDHLJYHZQAGNV-UHFFFAOYSA-N 427.485 4.841 50 10 IJGE CC[C@@H](Cl)[C@@H](CC)NS(=O)(=O)c1cc(Br)c(C)cc1Br 313139862 HFWLCIQCBWSOIP-VXGBXAGGSA-N 447.620 4.594 50 10 IJGE COc1cc(Br)c([C@H]2CCC[C@H](CI)O2)cc1OC 382199618 FSXCUUUQBRHBPC-BXKDBHETSA-N 441.103 4.512 50 10 IJGE O=[N+]([O-])c1ccccc1C[C@@H](Br)c1sccc1I 386582482 HSPROSCIKIRQSA-SECBINFHSA-N 438.084 4.940 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCC(F)(F)[C@@H](CCl)C1 404001751 MDAHPGJQUGFFPO-LURJTMIESA-N 437.531 4.609 50 10 IJGE CN(C(=O)c1cc(Br)cc(Br)c1)[C@H]1CCC[C@@H]1Br 709265248 BZOKVKMMKONBCN-RYUDHWBXSA-N 439.973 4.600 50 10 IJGE Cc1cc2nc(-c3ccccc3)cc(C(=O)NNc3ccc(S(C)(=O)=O)cc3)c2cc1C 748131441 NBQUJSADDFBQHR-UHFFFAOYSA-N 445.544 4.679 50 10 IJGE N#Cc1ccc(NNC(=O)c2cccc(NC(=O)c3ccc(F)cc3)c2)c(C(F)(F)F)c1 799753625 KOWYTMYSBIAHOM-UHFFFAOYSA-N 442.372 4.725 50 10 IJGE O=C(COc1cc(Cl)c(Cl)cc1Cl)NNc1nc2ccccc2[nH]c1=S 1453765398 RHZLVAQBRAZGJF-UHFFFAOYSA-N 429.716 4.775 50 10 IJGE Cc1c(C(=O)Nc2nc3ccccc3s2)oc2c1C(=NNC(=O)c1ccccc1)CCC2 1772745115 SIVKUAIUNZJNIQ-UHFFFAOYSA-N 444.516 4.920 50 10 IJGE C[C@H](Oc1cccnc1NC(=O)Nc1ccc(SC#N)cc1)C(=O)OCc1ccccc1 1858848822 PBYDQNGBVLAYQI-INIZCTEOSA-N 448.504 4.809 50 10 IJGE CCC[C@H](NC(=O)c1nc(C(C)(C)C)n2ccccc12)C(=O)Nc1ccc(SC#N)cc1 1866874631 DSLMNZFFDVJFTG-SFHVURJKSA-N 449.580 4.742 50 10 IJGE CC(=O)Nc1ccc(C/C(O)=C(\C#N)c2nc(-c3ccc4c(c3)OCCO4)cs2)cc1 1872750603 HUDPFVKSLSPRSA-ZZEZOPTASA-N 433.489 4.575 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CN(C(=O)OC(C)(C)C)C12CCCCC2 1883178942 DWDBWAOWJCXTES-HUUCEWRRSA-N 447.414 4.844 50 10 IJGE Cl[C@@H](c1c(Br)sc(Br)c1Br)C1COC1 1884435664 XMJDVQBUBSRNAG-ZCFIWIBFSA-N 425.367 4.962 50 10 IJGE CCc1ccc(NC(=O)OC(C)(C)C)c(C(=O)N(C)C[C@H]2C[C@@H](Br)C2)c1 1887823701 QMIRQGSRIMESMN-GASCZTMLSA-N 425.367 4.842 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]3(CC[C@H]21)CC[C@@](C)(CI)O3 1935707895 ZDRVODWGSNOAMI-KNCCTNLNSA-N 435.346 4.539 50 10 IJGE CC1(COC2(CI)CCN(C(=O)OC(C)(C)C)CC2)CCCC1 1938033233 PLAAXMCCMLNNPG-UHFFFAOYSA-N 437.362 4.788 50 10 IJGE CC[C@H]1CN(Cc2cccc(Br)c2Br)C[C@H]1Br 1943885746 WSXPHAIGBBXYNR-JOYOIKCWSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CC[C@@]23CC[C@](C)(CI)O3)C1 1986985114 KTCGHSXRWHZOSI-SQNIBIBYSA-N 435.346 4.540 50 10 IJGE Cc1ccc(C(F)(F)F)c(C[C@H](Br)CN2C(=O)c3ccccc3C2=O)c1 1994839438 GXLFGKJELBDKRC-ZDUSSCGKSA-N 426.232 4.616 50 10 IJGE C[C@H](Br)[C@H]1CCCN1Cc1ccc(I)c(Cl)c1 2026563769 MZEMDOMTOHQNAP-TVQRCGJNSA-N 428.539 4.692 50 10 IJGE CN(CCN(C[C@@H](CBr)C(C)(C)C)CC(F)(F)F)C(=O)OC(C)(C)C 2044699850 OKMLWAPWEULMTI-CYBMUJFWSA-N 433.353 4.775 50 10 IJGE C[C@@H](Br)CCc1cn(-c2ccc(Br)cc2Br)nn1 2068990847 IROBYXHIFVAZBQ-MRVPVSSYSA-N 437.961 4.508 50 10 IJGE CC(C)Oc1ccc(-n2nc(CBr)c(Br)c2C(F)(F)F)cn1 2078914000 SWIIUSKMVLQAGR-UHFFFAOYSA-N 443.061 4.731 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)[C@@H]1CC12CCC(F)(F)CC2 2107097568 ZFLAIGBIKVKAMU-SJORKVTESA-N 430.333 4.641 50 10 IJGE ClCc1nc(N2CCC3(CCN(Cc4ccccc4)CC3)CC2)ncc1Br 2146017210 KFJIKVACPJNJIW-UHFFFAOYSA-N 449.824 4.861 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)[C@H](Br)C2CCCC2)cc1 2167044248 WKKAYVBJIKQBRR-KBXCAEBGSA-N 439.394 4.842 50 10 IJGE Brc1cccc([C@H](CI)O[C@H]2C[C@H](n3ccnc3)C2)c1 2183661407 WHQWPWXATVDYFS-KKUMJFAQSA-N 447.114 4.542 50 10 IJGE CCOCc1cc(Br)c([C@H](Cl)c2cnn(C)c2Br)s1 2224775274 RUTDQMPKTNIAOK-SNVBAGLBSA-N 428.577 4.871 50 10 IJGE Cc1ccc(I)c(NC(=O)c2ccc(CBr)cc2)c1 2231932282 IYMATHFHHBJYGZ-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE Cc1ccc(I)c(C(=O)NCC(C)(C)C[C@H](C)Br)c1 2232159630 YMJVSGRNYLINMB-NSHDSACASA-N 438.147 4.529 50 10 IJGE CCc1nc(-c2ccc(I)c(F)c2)nc(CC)c1CBr 2237096667 YSQVOVKWGZTVDS-UHFFFAOYSA-N 449.105 4.907 50 10 IJGE O=C(c1cccc(Cl)c1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Br)C2 2283142356 JDDXYLMQHYZERX-PYEWSOSRSA-N 425.523 4.581 50 10 IJGE O=C(NC[C@H]1CCC[C@H](Br)C1)c1cc(Br)c(F)cc1Cl 2285956925 CCXNOLSZAGDMEU-IUCAKERBSA-N 427.539 4.925 50 10 IJGE N#CC(=Cc1ccc(-c2cccc(C(=O)O)c2)o1)C(=O)Nc1cccc(Br)c1 2293140451 ZMCKRMWNHDPLSY-UHFFFAOYSA-N 437.249 4.953 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)[C@H]1[C@@H]2CCO[C@@H]21 2298020090 VYMFIKGUJLQYMM-CFKOSQDASA-N 428.921 4.822 50 10 IJGE Clc1ccc(CN[C@H](CCBr)C2CC2)cc1I 2300240492 MUBNEJZBIDMLHX-CYBMUJFWSA-N 428.539 4.598 50 10 IJGE C[C@H]1CCCN(Cc2sccc2I)[C@@H]1CCBr 2301072788 AVZPSZPRONWYFH-CMPLNLGQSA-N 428.177 4.738 50 10 IJGE CNC(=O)C(C#N)=C1S[C@@H](Cc2ccc(C)c(C)c2)C(=O)N1c1ccc(C(C)C)cc1 2314593102 HNIAIBVCOAXPOV-QFIPXVFZSA-N 433.577 4.599 50 10 IJGE BrC[C@@H]1C[C@@H]2CCCC[C@@H]2N1Cc1sccc1I 2316765542 YGOJSMAHYKGBKT-GVXVVHGQSA-N 440.188 4.881 50 10 IJGE Cc1ccc2nc(-c3ccc(NC=C(C#N)C(=O)N(C)C4CCN(C)CC4)cc3)sc2c1 2324781201 POQLLEWQSCVBMN-UHFFFAOYSA-N 445.592 4.644 50 10 IJGE CC[C@H](CBr)CN1CC[C@@H](CCNC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2337614540 XAPQGAIDLYBREZ-RBSFLKMASA-N 445.364 4.965 50 10 IJGE N#C/C(=C/c1c[nH]c2ccc(OCc3ccccc3)cc12)C(=O)Nc1ccc(C(=O)O)cc1 2797276 VOGDKLMWGQWLPS-UNOMPAQXSA-N 437.455 4.991 50 10 IJGE CC[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)COc1ccccc1C(C)C 14768301 DWAXYBWVBNEIMS-DEOSSOPVSA-N 446.547 4.861 50 10 IJGE O=C(/C=C\c1cccc2ccccc12)NNC(=O)c1ccc(NC(=O)C2CCCCC2)cc1 35128101 BJIOMWZECOJSQO-SDXDJHTJSA-N 441.531 4.833 50 10 IJGE O=C(CCCc1ccccc1)N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21 59158159 NVEOCKBOKRTTSD-COOPMVRXSA-N 431.923 4.730 50 10 IJGE Cc1ccc(C)c(OCCCC(C)(C)C(=O)NNC(=O)COc2ccc(C(C)C)cc2)c1 66201385 SOPJSWAFDBJGBT-UHFFFAOYSA-N 440.584 4.838 50 10 IJGE COc1cc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4)nc3c2)cc(Cl)c1OC 169926842 VCBPJQYDMRCRMF-DHRITJCHSA-N 434.883 4.664 50 10 IJGE CCCOc1ccc([C@H](Br)[C@@H]2CCCCS2(=O)=O)cc1Br 229005209 XZYPMQNCKIMGJB-GJZGRUSLSA-N 440.197 4.641 50 10 IJGE COC(C)(C)CCO[C@](C)(CI)c1ccccc1Br 234706737 SGYOUZFAOSAQDQ-OAHLLOKOSA-N 441.147 4.931 50 10 IJGE CC[C@](C)(CO[C@@H](CI)c1ccc(Br)cc1)OC 319151508 ZIKIKCPECWBZJM-UONOGXRCSA-N 427.120 4.757 50 10 IJGE O=C(CCCN1C(=O)c2ccccc2C1=O)Nc1ccc(-c2nc(CCl)cs2)cc1 394245738 RSTINLWIENKOAN-UHFFFAOYSA-N 439.924 4.564 50 10 IJGE C[C@H](Br)[C@@H]1CCCN(c2ncc(Br)cc2Br)C1 688974831 BMVOAMRPBHLTIQ-DTWKUNHWSA-N 426.978 4.606 50 10 IJGE Cn1cc(Br)c([C@@H](Br)c2ccc(F)c(Br)c2F)n1 691558841 ITWBRAVYYVVUQU-QMMMGPOBSA-N 444.899 4.708 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N(C)[C@H](c2ccccc2)C(F)(F)F)c(C)n1C[C@H]1CCCO1 728499864 YMHXZYZQWPLQDR-ABZJWWJQSA-N 445.485 4.953 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 775983446 MQEDTCRHWUWPED-CYBMUJFWSA-N 439.743 4.606 50 10 IJGE C[C@@H](OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)c1cc(F)ccc1F 920156132 GTCRUGPOOJXJAH-UWCCDQBKSA-N 432.430 4.953 50 10 IJGE O=C(NN=Cc1ccccc1O)c1ccc(CN2CCC(Cc3ccccc3)CC2)cc1 1084090548 QAKPQDGJGDBFLZ-UHFFFAOYSA-N 427.548 4.611 50 10 IJGE CCc1ccc(OCC(=O)NN=Cc2c(Cl)cccc2Cl)c(Br)c1 1084570557 MBZOLCWTYDTFFN-UHFFFAOYSA-N 430.129 4.847 50 10 IJGE Cc1c([C@@H]2CN(Cc3ccccc3)C[C@H]2CI)cccc1[N+](=O)[O-] 1614628008 BHHVQEDPYLAGND-SJLPKXTDSA-N 436.293 4.554 50 10 IJGE CCOC(=O)c1sc(N(Cc2ccccc2)C(=O)/C(C#N)=C/c2ccccc2)nc1C 1859485427 HBOIUNHLQBSTDL-XSFVSMFZSA-N 431.517 4.769 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)/C=C/c3cccc(OC(C)C)c3)c(C)n2)cc1 1865757563 JFXXPKQKAUTKFY-XNTDXEJSSA-N 429.520 4.627 50 10 IJGE O=C(c1cccnc1C(F)(F)F)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915263313 FQIPRBSZTLCNGN-MRXNPFEDSA-N 427.264 4.916 50 10 IJGE C[C@H]1CCN(Cc2cccc(Br)c2Br)[C@H]1CBr 1943882390 VQKKCWFYRIBITM-CABZTGNLSA-N 425.990 4.817 50 10 IJGE Clc1nc(N2C[C@@H]3CN(Cc4ccccc4)CC[C@H]3C2)sc1CBr 1949583775 LNGSJDLJSBEDSG-GJZGRUSLSA-N 426.811 4.650 50 10 IJGE Cc1cc([C@@H](Br)c2cn(C)nc2Br)sc1Br 1981648539 PHCOKSYATODBGQ-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE Cc1cc(F)c([C@H](Br)c2cc(I)sn2)cc1C 2007647726 NDKPIFVOKVXIKW-LBPRGKRZSA-N 426.092 4.988 50 10 IJGE Fc1cccc([C@@H](CI)OCCOCCOCc2ccccc2)c1 2007814710 WOEQFKBCJGPXPA-LJQANCHMSA-N 444.284 4.552 50 10 IJGE BrC[C@@H]1[C@H]2CC[C@@H](C2)N1Cc1cc(Br)ccc1Br 2058366507 OHLOEUCHIOUNIH-DUFXMDAXSA-N 438.001 4.959 50 10 IJGE O=C(c1cccc(C(F)(F)F)n1)N(Cc1ccccc1)[C@H](CBr)C1CC1 2116171292 WPVXSXONNBQYPP-MRXNPFEDSA-N 427.264 4.916 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(C)CN(C[C@@H](CBr)c3ccccc3)C[C@@]2(C)C1 2163065287 ZBAYZFROZZFFBT-COPCDDAFSA-N 437.422 4.744 50 10 IJGE O=[N+]([O-])c1ccc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c(CBr)c1 2163332622 CUGGEBARKBCHBE-NRFANRHFSA-N 430.346 4.592 50 10 IJGE CC1(C)OCCO[C@H]1COc1c(Br)cc(CCl)cc1Br 2186967418 KNPCWAIIPDJIKL-LBPRGKRZSA-N 428.548 4.523 50 10 IJGE Clc1ccc(Br)cc1CC12COC(CI)(C1)C2 2216251505 FNLMHDUYHWZLLF-UHFFFAOYSA-N 427.507 4.629 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CCC[C@@H](C)O2)cc1I 2257355481 PDYJQQOQCHFTSE-FZQKWOKYSA-N 425.104 4.693 50 10 IJGE C[C@H]1C[C@H](Br)CCN1Cc1ccc(Cl)cc1I 2302325359 GTWUJEBYBLXQFQ-GXSJLCMTSA-N 428.539 4.692 50 10 IJGE COC(=O)C(C#N)=Cc1cccc(OC(=O)[C@@H](C)Oc2ccc(-c3ccccc3)cc2)c1 2314760706 YMDMFWFCMMBZDA-GOSISDBHSA-N 427.456 4.806 50 10 IJGE Clc1ccc(CN2CCC[C@H](CBr)CC2)cc1I 2315550931 JUIHRSUWSZRFHD-NSHDSACASA-N 442.566 4.942 50 10 IJGE CC(C)[C@H](Br)C(=O)Nc1nc([C@H](NC(=O)OC(C)(C)C)C(C)C)cs1 2315749218 UWZIHQLOGNGUCZ-QWHCGFSZSA-N 434.400 4.723 50 10 IJGE Cn1cc(I)c(C[C@@](C)(CBr)C2CCCCC2)n1 2319142437 CDWXOSHQZRCPCZ-AWEZNQCLSA-N 425.152 4.549 50 10 IJGE CCN(C[C@@](C)(CBr)OC[C@H]1C[C@H]2[C@@H](C1)C2(F)F)C(=O)OC(C)(C)C 2320844579 FSNRJDNRNMGJKP-VWPFQQQWSA-N 426.342 4.705 50 10 IJGE CCOc1cc(C=NNC(=O)Cc2cc(Cl)ccc2SC)cc(Cl)c1OC 2323686462 CFFJXPHXBONPFI-UHFFFAOYSA-N 427.353 4.815 50 10 IJGE CC1(C)C[C@H](CCl)CN1Cc1ccc(I)c(Br)c1 2325207999 FFRCRYJIXFCJDL-LLVKDONJSA-N 442.566 4.893 50 10 IJGE Clc1ccc(I)cc1C[C@@]1(CBr)O[C@H]2CC[C@H]1C2 2327569815 XWJXHUPEFUTGQD-JKOKRWQUSA-N 441.534 4.820 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@H]3CCCN(C(=O)OC(C)(C)C)[C@@H]3C2)C1 2345005082 TZGDZUDFVANYRG-DLBZAZTESA-N 429.443 4.909 50 10 IJGE C[C@@H]1CN(C(=O)c2ccc(Cl)cc2I)CC[C@H]1CCCl 2365582991 XUPKLPHLAGLYFG-GHMZBOCLSA-N 426.125 4.672 50 10 IJGE FC(F)(F)[C@H]1C[C@]1(CCl)CNCc1ccc(Cl)cc1I 2366715529 QVORCVSMOYJSNL-RYUDHWBXSA-N 438.058 4.842 50 10 IJGE CCCc1nc(N2CCN(C(=O)C(C)(C)CCl)CC2)c2c3c(sc2n1)CCCCC3 35892542 DTQJCGVTMXZOGU-UHFFFAOYSA-N 449.064 4.826 50 10 IJGE COc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4Cl)ccc32)c1 38650121 JDFSWOBGYBWUBX-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE Cc1ccc(COc2ccccc2/C=N/NC(=O)c2cc(-c3cccs3)nc(O)n2)cc1 169923531 GCQQXWLZAUAKMD-AFUMVMLFSA-N 444.516 4.562 50 10 IJGE COc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4Cl)nc3c2)cc1OC 169926779 UYSGJWYATVXWCH-DHRITJCHSA-N 434.883 4.664 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)N(c2ccc(C)cc2)S(=O)(=O)c2ccc(C)cc2)cc1 207128623 FMVQHJBQLHELDJ-PGMHBOJBSA-N 446.528 4.641 50 10 IJGE CCCCc1ccc(OCC(=O)NN=Cc2ccc(OC(=O)c3ccccc3F)cc2)cc1 254291676 NDZVPKDAPKEXEC-UHFFFAOYSA-N 448.494 4.917 50 10 IJGE COc1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)NN=C(C)/C=C/c2ccccc2)cc1 254380809 NCHREFJEXWKMQY-PVLZVPBNSA-N 439.515 4.672 50 10 IJGE Cc1cc([C@H](Br)c2cnn(C)c2I)c(C)cc1Cl 393608464 AQZFDXFKMYDNDW-LBPRGKRZSA-N 439.522 4.779 50 10 IJGE ClCc1cc(Br)ccc1N1CCO[C@H]2CCN(Cc3ccccc3)C[C@H]21 404217741 ZZKJOLZJFHESES-RTWAWAEBSA-N 435.793 4.668 50 10 IJGE ClCc1nc2cc(Br)cnc2n1CC[C@H]1CCN(Cc2ccccc2)C1 723978253 ZWKXXJOBCBRFNG-MRXNPFEDSA-N 433.781 4.845 50 10 IJGE CC(=O)N(c1ccccc1)c1nc(C=NNC(=O)c2cccc(C(F)(F)F)c2)cs1 729934291 NPBFDXQLFOZGRV-UHFFFAOYSA-N 432.427 4.610 50 10 IJGE CC(C)c1ccccc1NC(=S)NNC(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 741282259 HEVJXSLDTRDMNL-JKSUJKDBSA-N 437.487 4.830 50 10 IJGE CC(C)(C)OC(=O)N1CCCc2cccc(C=NNC(=O)c3cccc4cccnc34)c21 761812282 NCVNIIVFOQHHSR-UHFFFAOYSA-N 430.508 4.686 50 10 IJGE COc1ccccc1OCC(=O)NN=Cc1cc(C)n(-c2cc(Cl)cc(Cl)c2)c1C 1084584514 KGQGWDUIONCQGC-UHFFFAOYSA-N 446.334 4.939 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1Cc1ccccc1 1084599799 IOOFXFVKNKNCED-LKUDQCMESA-N 437.543 4.542 50 10 IJGE C=C(CBr)CN1CCC[C@]1(C)Cc1ccc(I)cc1 1654965764 WEJJFPFATVPWKU-MRXNPFEDSA-N 434.159 4.639 50 10 IJGE BrC[C@@H](CN1CCc2nc[nH]c2[C@H]1c1ccc(Br)cc1)C1CC1 1660254929 LYKWDHALISAPTQ-KBXCAEBGSA-N 439.195 4.541 50 10 IJGE COc1ccc(C(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)cc1[N+](=O)[O-] 1860391427 GJFNWWOPBIVODS-UHFFFAOYSA-N 447.472 4.560 50 10 IJGE CCc1nn(-c2ccccc2Cl)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699065 KCGRDFCDMVWXLE-OAQYLSRUSA-N 429.911 4.798 50 10 IJGE Cn1c(/C(C#N)=C/c2cc(Br)c(O)c(Br)c2O)nc2ccccc21 1872726786 KNWDZATYMWXAIU-UXBLZVDNSA-N 449.102 4.574 50 10 IJGE CC(C)(C)OC(=O)N1CC2(CCC3(CCC[C@H](CI)O3)CC2)C1 1923328221 XYMAGOKPIAULEN-CQSZACIVSA-N 435.346 4.540 50 10 IJGE CCCc1nc(Br)c(Br)n1CC1(CBr)CCC1 1940509269 VWKUJQNFSSFMDK-UHFFFAOYSA-N 428.994 4.926 50 10 IJGE CCCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@H](Br)C(F)(F)F 2044704194 APTLIHAHKIXKHK-KBPBESRZSA-N 431.337 4.814 50 10 IJGE BrC[C@@H]1CN(Cc2cc(Br)ccc2Br)CC12CC2 2054712326 HGUXOMFREUGPLW-LLVKDONJSA-N 438.001 4.819 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CN(C(=O)CCCCBr)c2ccccc21 2106771671 JVWQZOBHHPIZTK-HNNXBMFYSA-N 425.367 4.597 50 10 IJGE O=C(N[C@@H]1CCN(Cc2ccccc2)CC12CCC2)c1ccc(CBr)cc1 2154926984 RICDKVWLNXRLNX-OAQYLSRUSA-N 427.386 4.756 50 10 IJGE Cc1sc(CCl)cc1S(=O)(=O)N(C)[C@H]1CC(C)(C)[C@H]1OCc1ccccc1 2156441971 KHDXXMUVGITLSE-HKUYNNGSSA-N 428.019 4.800 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CN(CC1(CBr)CCOCC1)CC2 2163061260 FPMNVLWGFYFHMF-UHFFFAOYSA-N 439.394 4.583 50 10 IJGE Cc1cc(C(=O)NC[C@@]2(CBr)C[C@H]2C(F)(F)F)c(Br)s1 2192582198 ACWLKYNREXPJFX-KCJUWKMLSA-N 435.103 4.512 50 10 IJGE CCN(CCCCI)[C@@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2243591493 VCKSCCAJKSIXFQ-HZPDHXFCSA-N 438.394 4.607 50 10 IJGE COc1ccc([C@H](Br)[C@H]2C[C@]23CCCOC3)cc1I 2269547784 DRKLWIYNSFCWKT-UGFHNGPFSA-N 437.115 4.553 50 10 IJGE C=CC[C@@]1(CBr)CCCN1C(=O)c1ccc(I)c(C)c1 2287793145 ROLCNYJTJRMCMI-INIZCTEOSA-N 448.142 4.545 50 10 IJGE Cc1csc(C(=O)N2CCC(CBr)(C(F)F)CC2)c1Br 2289946861 YSXAPAHKBOKYNZ-UHFFFAOYSA-N 431.140 4.701 50 10 IJGE COc1ccc2nc(Cl)c(C=C(C#N)c3nc(O)c4cc(OC)c(OC)cc4n3)cc2c1 2297398870 WUHDEKBBWDWUTN-UHFFFAOYSA-N 448.866 4.627 50 10 IJGE COc1c(F)cc([C@H](Br)c2cc(I)sn2)cc1F 2321067361 MTJBMPRYFWZMJL-JTQLQIEISA-N 446.054 4.519 50 10 IJGE CCCOc1c(OC)cc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)cc1OC 2323163309 IQQCVCKKYCQHMW-INIZCTEOSA-N 449.551 4.863 50 10 IJGE CC(C)N(C)C[C@@H](Br)CCc1cc(I)ccc1Cl 2327394473 FTLABXXDNDCLBF-LBPRGKRZSA-N 444.582 4.981 50 10 IJGE FC1(F)C[C@@]1(CBr)CN1CCC[C@]2(CCCN(Cc3ccccc3)C2)C1 2351892432 PAFQFSNMWWBAIL-VQTJNVASSA-N 427.377 4.785 50 10 IJGE Cc1c(Br)csc1C(=O)N1CC[C@H](Br)C[C@H]1C(F)(F)F 2361461920 BNQVMBQJCWSMEA-CBAPKCEASA-N 435.103 4.749 50 10 IJGE COc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(F)c2)cc1 205652623 UDMPWYMVBARZDE-VWFRCSCGSA-N 442.446 4.671 50 10 IJGE Cc1ccc(OCC(=O)NN=Cc2cc(N=Nc3ccccc3)ccc2O)c([N+](=O)[O-])c1 254832994 AGRRBFZMMNIDRI-UHFFFAOYSA-N 433.424 4.553 50 10 IJGE C[C@@H](CCBr)CCNC(=O)c1cc(Br)c(Br)s1 397693169 ANDHUQUBSXVBRV-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE C[C@H]1CC[C@H](Br)CN1C(=O)c1scc(Br)c1Br 705440486 AWTRGDCAUTXZIS-BQBZGAKWSA-N 446.002 4.661 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N(C[C@H]2CCCO2)c2ccncc2)c(C)n1-c1ccccc1F 733969722 AIHATYLUYITYDK-FQWPPLDYSA-N 444.510 4.747 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CCCC[C@H]3c3noc(C)n3)c2C)c1 737622448 GMQBGRHQBKWGCD-CVGPFBNFSA-N 429.524 4.755 50 10 IJGE CCOC1=N/C(=C(\C#N)N=Nc2ccc(OC)cc2)NC(=N)[C@@H]1N=Nc1ccc(OC)cc1 1084251883 OZMQFSNQCOMIOT-LZTXTZKTSA-N 446.471 4.648 50 10 IJGE CC(=O)Nc1cccc(C(C)=NNC(=O)CSC2c3ccccc3-c3ccccc32)c1 1084291442 PXDRCNPSGULTIT-UHFFFAOYSA-N 429.545 4.988 50 10 IJGE C#C[C@@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(OC)cc2)c1C)c1ccc(F)cc1 1129717068 PGOZRNHSSJHAAZ-BTUGVJQXSA-N 427.479 4.640 50 10 IJGE C=CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccc(Cl)c(Br)c1 1472044682 YKKOCTNCUNZFCM-OAHLLOKOSA-N 446.773 4.795 50 10 IJGE CC(=O)N1CCc2c(NC(=O)/C(C#N)=C\c3cc(C)n(-c4ccc(F)cc4)c3C)cccc21 1523625832 JQNKGCXISFHLDH-ZHZULCJRSA-N 442.494 4.688 50 10 IJGE C=CCc1cc(C(=O)OC)cc(OC)c1OC(=O)/C(C#N)=C/c1cc(C)n(CCC)c1C 1531612882 PAAJMLKUIQDORV-FYJGNVAPSA-N 436.508 4.551 50 10 IJGE C/C(=C\C(=O)NNC(=O)CSc1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 1538917879 PDJLZBAUYKJZOH-FMIVXFBMSA-N 428.863 4.702 50 10 IJGE CC(=O)c1cc(C#N)ccc1NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(F)cc2)c1C 1543528237 VCLCLMHDSFEPBO-NDENLUEZSA-N 426.451 4.853 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2ccc3nc(O)[nH]c3c2)c(C)n1-c1ccc(Cl)cc1 1623792633 BDVOEMRZHTXFBL-WQRHYEAKSA-N 445.910 4.553 50 10 IJGE CCc1cc(C(=O)NNc2nc3ccccc3[nH]c2=S)c2c(CC(C)(C)C)noc2n1 1646017002 CYNBXSFDQXFCBW-UHFFFAOYSA-N 436.541 4.736 50 10 IJGE CC[C@@H](C)NC(=O)c1oc2c(c1C)C(=NNC(=O)Cc1coc3c(C)c(C)ccc13)CCC2 1772751787 MVXWTYDXUPHUSK-OAHLLOKOSA-N 449.551 4.879 50 10 IJGE COc1cc(C=NNC(=O)COc2ccc(C)cc2C)ccc1OCc1ccc(C)cc1 1772754149 CSPCOHRCNGDPMY-UHFFFAOYSA-N 432.520 4.729 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2cccc(F)c2)cc1 1865685898 ODNXACLQQCKDJY-KRWDZBQOSA-N 428.389 4.616 50 10 IJGE Brc1cnccc1C[C@@H](Br)c1cnsc1Br 1900435483 QBACNSJWALLHTR-MRVPVSSYSA-N 426.959 4.742 50 10 IJGE CC(C)n1nc(Br)nc1N(Cc1ccccc1)[C@@H](CBr)C1CC1 1905467311 JDUVCRRFPFSBJH-HNNXBMFYSA-N 442.199 4.802 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]1CC1(CCC[C@@H](CI)O1)C2 1922294338 XONKGJSLBAGDSM-KKUMJFAQSA-N 435.346 4.681 50 10 IJGE CCC1CC(O[C@@](C)(CI)CN(CC)C(=O)OC(C)(C)C)C1 1932714224 NQZNQIJZKIKDIZ-KVULBXGLSA-N 425.351 4.642 50 10 IJGE Brc1cccc(Br)c1C[C@@H](Br)CN1CCCC1 1949866273 IXFJGOBSGCKLPE-SNVBAGLBSA-N 425.990 4.613 50 10 IJGE CC[C@@H](Br)CN(CC)C(=O)c1cc(Br)sc1Br 1999377900 OOKMNZCYORQLMG-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE O=C(NC[C@H](Br)C1CCC1)c1c(Br)cccc1Br 2033086264 KHSKIBTZSABBAF-NSHDSACASA-N 439.973 4.505 50 10 IJGE CC(C)CN(C[C@H](CBr)c1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 2106787477 ZECNZXHDDACMPY-SFHVURJKSA-N 425.411 4.742 50 10 IJGE C[C@@H]1[C@@H](C(F)(F)F)N(C[C@H](CBr)C(C)(C)C)CCN1C(=O)OC(C)(C)C 2115979584 JEFWMBDJVZTZFP-RDBSUJKOSA-N 445.364 4.916 50 10 IJGE C[C@@H]1CCCN(C(=O)[C@H](Br)C2CCCC2)[C@@H]1CCCNC(=O)OC(C)(C)C 2167031935 HBEKSKWGUBEQQI-KBAYOESNSA-N 445.442 4.872 50 10 IJGE N#C[C@H]1CN(c2ccc(C(F)(F)F)c(CBr)c2)CCN1Cc1ccccc1 2181261154 QUHJBQHKWLZJJZ-SFHVURJKSA-N 438.291 4.815 50 10 IJGE COc1ccc([C@H](Cl)c2ncsc2Br)cc1I 2248891411 FAADHHIVFSDWAM-VIFPVBQESA-N 444.519 4.847 50 10 IJGE C[C@H](Br)CN(CC(C)(C)C)C(=O)c1csc(I)c1 2259755565 SZKBBDYUKNHTHB-VIFPVBQESA-N 444.176 4.624 50 10 IJGE CC(C)(C)C1(O[C@@H](CI)c2ccccc2Br)COC1 2272928520 BCAZZOMQCJVRKN-ZDUSSCGKSA-N 439.131 4.757 50 10 IJGE C[C@@H]1CCCN(C(=O)c2cc(F)c(Br)cc2Cl)[C@H]1CBr 2282978960 SXYYBBLOGSNUBB-OQPBUACISA-N 427.539 4.877 50 10 IJGE BrC[C@H]1CCC2(CCC2)N1Cc1sccc1I 2301073827 MCFYOFBVKTWMOO-SNVBAGLBSA-N 426.161 4.635 50 10 IJGE O=[N+]([O-])c1ccc([C@@H](Br)c2sc(Cl)cc2I)o1 2301083838 MIAWNHJUALTUBX-MRVPVSSYSA-N 448.463 4.992 50 10 IJGE COC[C@@H]1C[C@@H](Br)[C@@H](Cc2ccc(Cl)c(I)c2)C1 2315549931 XTRQMJAAJHLVDG-SDDRHHMPSA-N 443.550 4.923 50 10 IJGE CCCOc1ccc(C=NNC(=O)Cc2cc(OC)ccc2Cl)cc1Br 2323676420 UWOCGWMCGKLOSV-UHFFFAOYSA-N 439.737 4.593 50 10 IJGE COc1cc(C=C(C#N)n2cnc3ccccc32)ccc1OC(=O)c1cccc([N+](=O)[O-])c1 2331032764 ARKBUGXXSMPXNL-UHFFFAOYSA-N 440.415 4.694 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@H]3[C@H](CCCN3C(=O)OC(C)(C)C)C2)C1 2345010807 OIRHJXZTXKBOBG-IAGOWNOFSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CCN(C[C@H](CBr)c3ccccc3)C[C@@H]21 2361359783 DOZGHCKPDULXKU-AABGKKOBSA-N 437.422 4.887 50 10 IJGE Clc1cc(Cl)cc(CCCOC2(CI)CCOCC2)c1 2366939390 LRXVQZOZXVWESP-UHFFFAOYSA-N 429.125 4.927 50 10 IJGE Cc1cc(Br)cc(Br)c1OCC(=O)N/N=C1/CCC[C@H](C)C1 34967451 LNEJYPQQINUPKD-XEVDPLJKSA-N 432.156 4.581 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccccc4)ccc32)cc1 38650734 FBADVSKGAGRUOY-SANMLTNESA-N 440.499 4.842 50 10 IJGE Cc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)cc1 205645087 NYNHJALQGRCOSB-MKEUEUPWSA-N 426.447 4.971 50 10 IJGE CCOc1cc(/C=C2\C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1F 214253496 HUDITSWQRPWONI-NDENLUEZSA-N 448.494 4.804 50 10 IJGE COc1ccc(NC(=O)/C(C#N)=C\Nc2ccc(Cl)c(C(F)(F)F)c2)cc1OC 216728416 OOBNLVYRNYRZQQ-KHPPLWFESA-N 425.794 4.834 50 10 IJGE N#C/C(=C/N1CCC(Cc2ccccc2)CC1)C(=O)N1CCC(Cc2ccccc2)CC1 216872655 UPGBIALCYVADAC-QYQHSDTDSA-N 427.592 4.830 50 10 IJGE C[C@@H]1CCN(C(=O)c2cc(Br)c(Br)s2)C[C@H]1Br 230293424 DZNPMIPHIMYLQB-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE CCOC(=O)c1sc(NC(=O)NN=Cc2ccc(C(C)C)cc2)c(C(=O)OCC)c1C 256018540 PUVONQMEZHGAJN-UHFFFAOYSA-N 445.541 4.689 50 10 IJGE ClCc1ccc(I)c2cc(I)sc12 307643314 OQQLTMLQLWZPSF-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CC(C)(C)[C@H](CBr)NC(=O)c1cc(Br)c(Br)s1 393951356 QCKRCNFFBWOLGB-QMMMGPOBSA-N 448.018 4.813 50 10 IJGE FC1(F)CCN(c2ncc(Br)c3ccsc23)C[C@@H]1CBr 403992720 JWSWEQZLENLTFJ-QMMMGPOBSA-N 426.124 4.915 50 10 IJGE O=C(NC[C@@H]1CC[C@H](Br)C1)c1scc(Br)c1Br 705402014 SPMWYEGJXRNHOM-RQJHMYQMSA-N 446.002 4.567 50 10 IJGE Cc1noc(C)c1COc1ccccc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799746542 BZFLTCAVVOQULG-UHFFFAOYSA-N 430.386 4.518 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2cnc(O)c3ccccc23)c(C)n1-c1ccccc1F 1178115352 WHPFJQARUINWQP-XDHOZWIPSA-N 440.478 4.710 50 10 IJGE O=C(NN(c1ccccc1)c1ccccc1)c1ccc2c(c1)nc(O)n2CC(F)(F)F 1463964685 IPLXNZVFGUEIFX-UHFFFAOYSA-N 426.398 4.787 50 10 IJGE C=CCOc1ccc(/C=C\C(=O)NNc2ccc(Cl)cc2Br)cc1OC 1647735447 GOHZMZZRUQASFQ-UITAMQMPSA-N 437.721 4.832 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CNC1CC1)(C[C@H]1C[C@H](Br)C1)C2 1887901283 MVLUGDJDSVBNHX-LAQRGFTBSA-N 427.427 4.850 50 10 IJGE CC(C)n1nc(Br)nc1N(Cc1ccccc1)[C@H](CBr)C1CC1 1905467312 JDUVCRRFPFSBJH-OAHLLOKOSA-N 442.199 4.802 50 10 IJGE Cc1nn(-c2c(Cl)cccc2CBr)c(C)c1I 1945162611 TZLMVOFBLUWRAO-UHFFFAOYSA-N 425.495 4.642 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C2CCN(C[C@H](CBr)C3CCC3)CC2)C1 1966288535 QYPWQSPSDJLHCQ-MOPGFXCFSA-N 429.443 4.767 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](I)[C@H](OC2CC3(CCCCC3)C2)C1 1989967982 PKSVQMAAIXWSPV-HUUCEWRRSA-N 435.346 4.539 50 10 IJGE O=C(NC1(CCCBr)CC1)c1cccc(Br)c1Br 2031482282 QISHLVMELAMYFR-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE COc1cccc(OC(C)=O)c1[C@@H](C)n1nc(-c2ccccc2)cc1CBr 2070047942 ACAZKYZRUMZEIO-CQSZACIVSA-N 429.314 4.988 50 10 IJGE COc1cccc(OC)c1-n1nc(CBr)c(Br)c1C(F)(F)F 2079234065 MNOBKPXWNXBWBD-UHFFFAOYSA-N 444.045 4.566 50 10 IJGE C[C@]1(CCBr)CCN1C(=O)c1c(Br)cccc1Br 2084703097 RUWHOOZLGLMQBP-ZDUSSCGKSA-N 439.973 4.601 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCC([C@@H](F)CCl)CC1 2106949096 YKCVGIYWOUYGDX-VIFPVBQESA-N 433.568 4.702 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H](NC(=O)[C@H](Br)C1CCCC1)C1CCCCC1 2110721778 IPBVEGHJZVBBFH-IAGOWNOFSA-N 431.415 4.530 50 10 IJGE C[C@H](Br)c1ccccc1NC(=O)Cc1ccccc1I 2143869447 ZBHFGYDGFIYFHO-NSHDSACASA-N 444.110 4.928 50 10 IJGE Clc1ccc(C(CBr)(CBr)COC[C@@H]2CCCO2)cc1 2149039295 WZNQROZUOPBGSO-AWEZNQCLSA-N 426.576 4.563 50 10 IJGE CC[C@@]1(CNC(=O)c2ccc(CBr)cc2)CCCCN1C(=O)OC(C)(C)C 2162494131 FHYAMKPSZPSJIS-NRFANRHFSA-N 439.394 4.881 50 10 IJGE FC(F)(F)c1cnc(N[C@H](CCl)c2cscn2)c(I)c1 2175673383 ALPRNXHUDKKTNR-MRVPVSSYSA-N 433.624 4.554 50 10 IJGE CC[C@H](Br)C(=O)N[C@@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1 2179674256 JRZZSAOXGCEXHH-ROUUACIJSA-N 435.362 4.695 50 10 IJGE FC(F)(F)[C@@H]1C[C@@]1(CCl)CNCc1cc(Cl)ccc1I 2192573357 QHTIJTLCOYZJRT-VXGBXAGGSA-N 438.058 4.842 50 10 IJGE Cc1c(N2C[C@@]34CCC[C@]3(CN(Cc3ccccc3)C4)C2)ccnc1CBr 2205638214 SALYZDUBQULDFU-GOTSBHOMSA-N 426.402 4.777 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)C[C@@H](C)Br)c(Br)c1 2212701136 YNRSFNWSTLKRGT-CYBMUJFWSA-N 441.163 4.884 50 10 IJGE C[C@H](CCCl)N(Cc1ccccc1)S(=O)(=O)Cc1cccc(Br)c1 2213760354 DYCXRJJWBZXYTD-OAHLLOKOSA-N 430.795 4.799 50 10 IJGE CCC[C@@H](CCBr)CNC(=O)Cc1ccc(Br)cc1Cl 2237435576 AEOOUYQZUWGRCZ-NSHDSACASA-N 425.592 4.963 50 10 IJGE Fc1ccc([C@@H](CI)O[C@H]2CCN(Cc3ccccc3)C2)cc1 2244771417 LYLOIEAXECLVRO-RBUKOAKNSA-N 425.285 4.593 50 10 IJGE CC1(C)CCC[C@]1(CCl)NC(=O)c1ccc(Cl)c(I)c1 2283652871 AJNSBFNYOKRNBU-OAHLLOKOSA-N 426.125 4.862 50 10 IJGE C=CCOc1c(Br)cc(C=C(C#N)C(=O)Nc2ccccc2)cc1OCC 2313518823 VLRKVOQMKHAXSC-UHFFFAOYSA-N 427.298 4.958 50 10 IJGE Cl[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccc(I)c(Br)c1 2325217782 IARDVKRAIMDXFO-ZSBIGDGJSA-N 440.550 4.788 50 10 IJGE CCCc1sc(Br)cc1[C@@H](Br)C1(S(C)(=O)=O)CCC1 2338030224 SHELVJVXTSZZLP-GFCCVEGCSA-N 430.227 4.866 50 10 IJGE CC1(C)CC(CBr)(CN2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)C1 2345008820 UYFOZXOMIONZNU-KRWDZBQOSA-N 433.356 4.936 50 10 IJGE C=CC[C@H](Br)[C@H]1CCN1C(=O)c1cc(F)c(Br)cc1Cl 2360963490 JIKLQQGEVNVTLE-TVQRCGJNSA-N 425.523 4.796 50 10 IJGE CC(C)(C)[C@@](C)(CBr)CN1CCOCC12CCN(Cc1ccccc1)CC2 2380207494 YVTCXKNVJFGDMK-QFIPXVFZSA-N 437.466 4.801 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)Nc3ccc(N(C)C)cc3)o2)cc1 1509005 YCABFBZMTXQQCA-CYVLTUHYSA-N 429.476 4.735 50 10 IJGE Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@H](C)Oc2ccc(-c3ccccc3)cc2)c1 14038716 KQDRONPKEYRSRO-FQEVSTJZSA-N 446.547 4.779 50 10 IJGE COc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4cc(C)cc(C)c4)c(C)c32)c1 40822177 GIMHWQXSUCTYKA-SGWCAAJKSA-N 445.519 4.936 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Br)c3c(F)cccc3Cl)cc2[nH]1 109884316 WRGMTMLKRITTRA-CYBMUJFWSA-N 434.490 4.896 50 10 IJGE O=C(N[C@H](CBr)Cc1ccccc1)c1ccc(Br)cc1Cl 122472837 BHDQPHBDUQTOAQ-ZDUSSCGKSA-N 431.555 4.839 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)ccc1OC(=O)/C=C/c1ccccc1 206395476 IITXKELITKHLJZ-FUQMAIFMSA-N 438.483 4.537 50 10 IJGE O=C1OC(=O)[C@@H]2[C@H]3C[C@@H]([C@@H]4Sc5[nH]c(=S)sc5[C@H](c5ccc(Cl)cc5)[C@@H]43)[C@H]12 256027104 TZTGJCWNBZDYHI-QSAXWINLSA-N 435.979 4.647 50 10 IJGE C[C@H]1[C@@H](C)N(c2ccc(CBr)cc2[N+](=O)[O-])C[C@@H](C)N1Cc1ccccc1 404276180 NNJWROSXMMTJBC-IXDOHACOSA-N 432.362 4.977 50 10 IJGE FC(F)Oc1cc(CBr)c(I)cc1Br 575682263 MSMIZDWHEJRMCN-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N(C)Cc2cnccn2)c(C)n1-c1cc(Cl)ccc1Cl 735483256 QELKFTRQGXUBEJ-MFOYZWKCSA-N 440.334 4.757 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@@H](C)Cc2ccc(Cl)cc2Cl)c1C 736691965 VQDHCDJFDXRZGM-LBPRGKRZSA-N 430.339 4.784 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNc1ccc(F)cc1Br)O[C@H](C)C2 748073892 GMRBOOOVRWUSSY-WPGHFRTFSA-N 449.320 4.557 50 10 IJGE O=C(NNC(=O)c1ccccc1OCc1ccc(F)cc1)Nc1ccc(-c2ncco2)cc1 757801881 OLQUSNOPTRQGLU-UHFFFAOYSA-N 446.438 4.526 50 10 IJGE CC(C)c1nc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)nn1-c1ccccc1Cl 799746185 ZUNNHYXZHILEJO-UHFFFAOYSA-N 448.836 4.691 50 10 IJGE Cc1cc(C=NNC(=O)[C@@H]2COc3ccccc3O2)c(C)n1-c1cc(Cl)cc(Cl)c1 1084114534 MGEIAOFOZDQJSC-NRFANRHFSA-N 444.318 4.691 50 10 IJGE Cc1cc(C=NNC(=O)[C@H]2COc3ccccc3O2)c(C)n1-c1ccc(Cl)c(Cl)c1 1084223457 VJIAYMRLZSGDKG-OAQYLSRUSA-N 444.318 4.691 50 10 IJGE C/C(=C/C1CCC(C)CC1)C(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1 1472469156 NJBJLRQLFGMLNK-SSZFMOIBSA-N 436.581 4.929 50 10 IJGE C/C(=C\c1cccc(Cl)c1)C(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1 1641058849 XJBXNWKIOZTWQN-GHRIWEEISA-N 445.906 4.508 50 10 IJGE Cc1cccc(COc2ccc(C=NNC(=O)CSc3nc4ccccc4[nH]3)cc2)c1 1772760327 CIOPTZFHHOFWEQ-UHFFFAOYSA-N 430.533 4.693 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@H]1c1ccccc1F 1865684423 YDGFZKFTIGECOY-INIZCTEOSA-N 448.807 4.961 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(O[C@H]2COC3(CCCCC3)C2)C1 1879030686 VWCHYOOXPZJLPY-OXQOHEQNSA-N 432.399 4.659 50 10 IJGE O=S(=O)(c1ccc2c(c1)CCCC2)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915185480 BILQEAIGDGFBDQ-QFIPXVFZSA-N 448.426 4.930 50 10 IJGE O=C(Nc1ccc(F)c(CBr)c1)c1cccc(I)c1 1924858877 QNAUZRZWRQWPRD-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE CN(Cc1ccc(Br)cc1Br)[C@H]1CCC[C@@H]1Br 1943859019 LXCFZMXYPMBYLP-AAEUAGOBSA-N 425.990 4.959 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1ncc(Br)cc1F 1979831120 LVEGPUQNZLRGOW-ZDUSSCGKSA-N 444.142 4.799 50 10 IJGE CC(C)(C)C[C@H](Cl)CNc1ncc(I)cc1Br 2015756431 FTRVUYNPCHBDOM-QMMMGPOBSA-N 431.543 4.904 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CCC[C@H]1CCBr 2031487148 QZOHMMZCGNLMBO-VIFPVBQESA-N 439.973 4.601 50 10 IJGE O=C(CBr)c1c(C(F)(F)F)ccc(OC(F)(F)F)c1Br 2054796458 HMVAVRDJXODVKC-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE O=C(CBr)c1ccc(OC(F)(F)F)c(Br)c1Br 2054921121 FYKIKZUMFVZFPA-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE CC[C@@H](C[C@@H](C)Cl)NC(=O)c1ccc(Br)cc1I 2086153557 LWMOJSVLACSKGQ-SCZZXKLOSA-N 444.538 4.580 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H](N(C[C@H](CBr)C1CC1)C1CC1)C(F)(F)F 2106788750 SFSOXFWTLVEHAI-DZGCQCFKSA-N 443.348 4.718 50 10 IJGE Brc1cccc([C@@H](CI)OC[C@@H]2[C@H]3C[C@@H]4[C@H]2[C@@H]4C3)c1 2134536532 FKOJSISRKQDBLI-ZSDZXBNGSA-N 433.127 4.844 50 10 IJGE Cc1cc(Br)c(C)c([C@@H](Cl)[C@H]2CCCS2(=O)=O)c1Br 2136380485 UYNUFLLEUCPUAT-MFKMUULPSA-N 430.589 4.686 50 10 IJGE COc1ccc(Oc2ccnc(CBr)c2C)cc1I 2140701830 GGGYZHGEJNPVFT-UHFFFAOYSA-N 434.071 4.690 50 10 IJGE O=S(=O)(N[C@@H](CCBr)C1CCCCC1)c1cscc1Br 2143923267 QAZJEAQVWDCSNU-LBPRGKRZSA-N 445.242 4.523 50 10 IJGE Cc1cc2nc(CCl)n(C[C@H]3CN(Cc4ccccc4)CCO3)c2cc1Br 2158582867 NYVFICCHIZJOHW-QGZVFWFLSA-N 448.792 4.747 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCNC(=O)[C@H](Br)C1CCCC1)c1ccccc1 2167049217 VSZWFIWCTSEHBM-QZTJIDSGSA-N 439.394 4.712 50 10 IJGE O=C(NC1(CCBr)CCSCC1)c1c(Cl)cccc1Br 2169468163 VFDQVXPZSRUGTP-UHFFFAOYSA-N 441.616 4.883 50 10 IJGE BrCCCC1CN(Cc2cccc(Br)c2Br)C1 2216695381 DHFIFZYOBGWREN-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@]12CC[C@@](C)(CI)O2 2243452553 LXXYSWSOTVBIJC-JCGIZDLHSA-N 437.362 4.642 50 10 IJGE BrCCCCC1CCN(C[C@H]2CC2(Br)Br)CC1 2248098333 PDQZULBSVVJUNT-GFCCVEGCSA-N 432.038 4.770 50 10 IJGE Cc1c(CBr)cccc1NS(=O)(=O)c1sccc1Br 2268325659 KWTNNYMRSAYRRN-UHFFFAOYSA-N 425.167 4.515 50 10 IJGE COc1ccc([C@H](Br)C23CC(C)(C2)O[C@H]3C)cc1I 2269545172 MTMJSYUUCKRUFP-RCADUFJZSA-N 437.115 4.693 50 10 IJGE CCCC(CBr)(CCC)CN(C)C[C@]1(O)CCCN(Cc2ccccc2)C1 2286350907 YAWVIXPMDSTRRS-HSZRJFAPSA-N 439.482 4.927 50 10 IJGE C[C@H](Br)CN(Cc1ccc(Cl)c(I)c1)C1CC1 2300241170 VTXXRKPQPYPPLM-VIFPVBQESA-N 428.539 4.692 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2C[C@H]3O[C@H]2[C@@H]2C[C@H]32)s1 2300953540 KNSVWDFOLQYMSV-YBMBPHFDSA-N 445.547 4.866 50 10 IJGE C[C@H]1C[C@@H](CBr)CN1Cc1cc(I)ccc1Cl 2307322847 SXLZZOYSRWEGGS-UWVGGRQHSA-N 428.539 4.550 50 10 IJGE C[C@@]12CN(Cc3ccc(Cl)c(I)c3)C[C@]1(CBr)C2 2315555384 QEIKIHGXRIQDOU-ZIAGYGMSSA-N 440.550 4.552 50 10 IJGE COc1ccc(C(C#N)=Cc2cccc(OC(=O)COc3ccccc3OC)c2)cc1OC 2320511193 OEOTYIHGWJRNOQ-UHFFFAOYSA-N 445.471 4.761 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)[C@H]1C 2329487409 DPEVQDHCVKLEQT-RBSFLKMASA-N 429.365 4.745 50 10 IJGE COc1cc(F)c(CO[C@@H](CCl)[C@@H](I)CCl)c(Cl)c1 2339215980 APDXMQLQNPEHMQ-RYUDHWBXSA-N 441.495 4.654 50 10 IJGE O=C(NCC[C@@H]1CCCC[C@@H]1Cl)c1ccc(Cl)cc1I 2365592373 PLPQHYLMEUHHPP-GWCFXTLKSA-N 426.125 4.862 50 10 IJGE CC(C)/C=N/NC(=O)COc1ccc2cc(Br)ccc2c1Br 14017803 KMZMMKMVYNKINF-UFWORHAWSA-N 428.124 4.502 50 10 IJGE CCCOc1c(Br)cc(/C=C(/C#N)S(=O)(=O)c2ccccc2)cc1OC 33470829 WCKGYBWUGLPKMF-YBEGLDIGSA-N 436.327 4.585 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@H](C)Oc4ccc(F)cc4)ccc32)cc1 38649238 VWCSOQRONFYMPX-UPCLLVRISA-N 444.462 4.725 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccco2)cc1 38657490 WBQSCVLNFOCJRO-DEOSSOPVSA-N 444.487 4.780 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccs4)ccc32)c1 38684409 RRYSFRXZEKYIAC-QFIPXVFZSA-N 432.501 4.974 50 10 IJGE CCCN(CCC)c1ccc(C(=O)N/N=C/c2c(C)nn(Cc3ccccc3)c2C)cc1 59148679 WUFXFENSWIHLIK-OVVQPSECSA-N 431.584 4.939 50 10 IJGE O=C(NC1(CBr)CCCC1)c1cc(Br)c(Br)s1 122547811 FYNMZUPLWCEWDQ-UHFFFAOYSA-N 446.002 4.711 50 10 IJGE CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](O)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 196218016 YFXHWMFAYWHGCE-XQUALCHDSA-N 444.644 4.896 50 10 IJGE O=C(NN=Cc1c(OC(=O)c2ccccc2)ccc2ccccc12)c1ccc([N+](=O)[O-])cc1 254816821 ROYBITOSKLVMCO-UHFFFAOYSA-N 439.427 4.731 50 10 IJGE CC[C@@H]1CN(Cc2cc(Cl)ccc2I)C[C@@H]1Br 405321878 ZPSYZVRQMPFXRZ-SKDRFNHKSA-N 428.539 4.550 50 10 IJGE Clc1ccc(I)c(C[C@@]2(CBr)CCCOC2)c1 405541919 SSDNQLIANBGRSA-CYBMUJFWSA-N 429.523 4.679 50 10 IJGE CN(C(=O)c1cc(Br)c(Br)s1)C(C)(C)CCBr 688345637 YQJXLZKBPNPQDH-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)C1C2(CC2)C12CC2 720237284 IMRXBEKGZGEPJT-LBPRGKRZSA-N 431.111 4.852 50 10 IJGE O=C(NNc1cccc(F)c1F)c1cccc(NC(=O)c2ccc(Br)cc2)c1 743720509 AGNYVFFUDRXHPQ-UHFFFAOYSA-N 446.251 4.737 50 10 IJGE N#Cc1ccc(NNC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)c(C(F)(F)F)c1 799612841 DSTXWVDAPYCYMA-LJQANCHMSA-N 429.377 4.527 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2Br)cc(Cl)c1OC(C)C 1084541811 LKOQBAOERZPTRJ-UHFFFAOYSA-N 425.710 4.662 50 10 IJGE O=C(NNc1cc(C(F)(F)F)ccc1F)c1cc2cccc(C(F)(F)F)c2nc1O 1567106232 ASCLWMCWFCKWET-UHFFFAOYSA-N 433.283 4.874 50 10 IJGE C#C[C@@H](NC(=O)NNc1ccc(Cl)cc1Br)c1ccc(Cl)cc1F 1686922531 KZDNPEXXNBVBLY-CQSZACIVSA-N 431.092 4.896 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(Cl)cc2)CCC3)nc1 1772744098 SVDPEGSRTKSGMW-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE Cc1nn(-c2ccc(Br)cc2)c2c1[C@@H](c1cccc(Cl)c1)C(C#N)=C(N)O2 1865683143 GTSKWHLUBDEMCO-SFHVURJKSA-N 441.716 4.815 50 10 IJGE Cc1nn(-c2ccc(Cl)cc2)c2c1[C@@H](c1cccc(Br)c1)C(C#N)=C(N)O2 1865683203 AFNQXTPEWSGFCW-SFHVURJKSA-N 441.716 4.815 50 10 IJGE Cc1nc(Nc2ccc(SC#N)cc2)cc(N2CCN(C)[C@@H](c3ccc(F)cc3)C2)n1 1868480771 SMDPCYNJBJOSLE-OAQYLSRUSA-N 434.544 4.734 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cccc(Br)c1 1902778756 QRUOCHMLRVQZFG-QGZVFWFLSA-N 441.163 4.549 50 10 IJGE Fc1cc(Br)c2nc(CCCl)n(CC3CN(Cc4ccccc4)C3)c2c1 1912675022 WAMNQEMCXSZTIP-UHFFFAOYSA-N 436.756 4.851 50 10 IJGE O=S(=O)(c1cccc(Cl)c1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915167446 VYUQIKBZBDPXDH-SFHVURJKSA-N 428.779 4.704 50 10 IJGE O=C(N[C@H](CBr)CC1CC1)c1cc(Br)c(Br)s1 1942806083 RJDOUBNCTQLYEB-ZETCQYMHSA-N 446.002 4.567 50 10 IJGE C[C@H]1CN(Cc2c(Br)cccc2Br)C[C@@H]1CBr 1945321885 JFELGMGYBNZCBT-UWVGGRQHSA-N 425.990 4.674 50 10 IJGE C[C@@H](Br)Cc1cc(NC(=O)OC(C)(C)C)ccc1I 1951906578 XEGSNLSGNUYKGO-SECBINFHSA-N 440.119 4.964 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC[C@H]2C[C@H]3CC[C@H]2C3)C1 1997929608 MGJUTUZILHAWSG-GGXPGOJBSA-N 449.373 4.644 50 10 IJGE CCC[C@@H](Cl)CCNC(=O)c1ccc(I)c(Br)c1 2029917114 OJPUQCLEPMDZJW-SNVBAGLBSA-N 444.538 4.581 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1cc(Br)cc(Br)c1 2081239767 WPGRPYGTDKFAAM-PRHODGIISA-N 441.989 4.751 50 10 IJGE C[C@]12CN(Cc3ccc(I)c(Cl)c3)C[C@@]1(CBr)C2 2086651998 MJTNYODVDNDEOL-KBPBESRZSA-N 440.550 4.552 50 10 IJGE Clc1cc(CN2CC[C@]23C[C@@H](CBr)C3)ccc1I 2086662346 UHXKEJGOJLMOBA-YEORSEQZSA-N 440.550 4.694 50 10 IJGE Cc1sc(Br)cc1C(=O)NC1(CCBr)CCSCC1 2095696945 QJIULMAEHLTDPB-UHFFFAOYSA-N 427.227 4.600 50 10 IJGE CCN(C[C@@H](CBr)c1ccccc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2106784310 HTOLEKXCQBPEKQ-RTBURBONSA-N 425.411 4.887 50 10 IJGE C[C@H](CCBr)CCN=[S@](=O)(CCNC(=O)OC(C)(C)C)c1ccccc1 2107394620 MJRUWDAVNONEMZ-DXPJPUQTSA-N 447.439 4.849 50 10 IJGE O=C(NC[C@]1(CBr)CC12CCC2)c1cc(Br)c(Cl)s1 2115926456 SYFBJIKRYHHOJL-CYBMUJFWSA-N 427.589 4.849 50 10 IJGE Cc1sc(Br)cc1C(=O)N1C[C@@]2(CBr)CCC[C@]2(F)C1 2176631192 WJWSBZXJNAOLMQ-KBPBESRZSA-N 425.161 4.548 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@H](CNC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2185528923 KZGVIDFMNDROTN-AABGKKOBSA-N 439.438 4.894 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)C1(c2ccc(NC(=O)OC(C)(C)C)cc2)CC1 2196913559 DRWRTGQMYVWRKS-KOMQPUFPSA-N 437.378 4.697 50 10 IJGE Cc1ccc(C(=O)N(CCCBr)C(C)(C)C)cc1I 2224626932 KGUZCMMUGTWZMO-UHFFFAOYSA-N 438.147 4.625 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@]12CC[C@](C)(CI)O2 2243452554 LXXYSWSOTVBIJC-QGTPRVQTSA-N 437.362 4.642 50 10 IJGE C[C@H]1CCC[C@](CCl)(NC(=O)c2ccc(Cl)c(I)c2)C1 2283655789 KEQAUOHKWRBKKP-BONVTDFDSA-N 426.125 4.862 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCC[C@@H](CCBr)C1 2285957403 GZFQPPOSSDJJGG-VIFPVBQESA-N 427.539 4.879 50 10 IJGE CCOc1ccccc1NC(=O)C(C#N)=Cc1cc(Br)c(Br)o1 2297493511 SOPSTHHKPQUSLQ-UHFFFAOYSA-N 440.091 4.749 50 10 IJGE CC[C@]1(C)[C@H](Br)CCN1c1ncc(Br)cc1Br 2299988221 UAOVYLVYUMDXML-ZYHUDNBSSA-N 426.978 4.749 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@@H]1Cc1ccc(Cl)c(I)c1 2300267037 FGDRHODQSCGQMA-OUJBWJOFSA-N 429.523 4.676 50 10 IJGE Clc1ccc(CN[C@H](CBr)CC2CC2)c(I)c1 2302326010 LWEIQFNDBKFZSO-LBPRGKRZSA-N 428.539 4.598 50 10 IJGE Clc1ccc(I)cc1C[C@@]1(CBr)CC=CCO1 2307328175 KDXYVAFBTOUFDC-CYBMUJFWSA-N 427.507 4.597 50 10 IJGE CCCO[C@@H]1[C@@H](Br)C[C@@H]1Oc1cc(Br)cc(Br)c1 2316829345 PHMQHQOSLDAXHO-RWMBFGLXSA-N 442.973 4.921 50 10 IJGE COc1cccc(-c2csc(C(C#N)=C(O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)n2)c1 2331246793 YOZZOKQSMSAYMQ-GOSISDBHSA-N 431.517 4.660 50 10 IJGE CC1CCC([C@H](CBr)NCc2ccc(I)cc2)CC1 2351653136 STNRPVGOHMPLPC-PXCJXSSVSA-N 436.175 4.971 50 10 IJGE CC(C)(C)OC(=O)NCC(C)(C)C1CCN(C[C@@]2(CBr)CC2(F)F)CC1 2351886199 VHTPIRWWBUPPTN-SFHVURJKSA-N 439.385 4.670 50 10 IJGE CC(C)C[C@@H](CBr)CN1CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2353833671 GUWPVROXWYVSGP-SOUVJXGZSA-N 445.364 4.964 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)C1C[C@@H]2CCC[C@H](C1)C2(F)F 2369432905 IGWVSHRYELABCM-IPQPSQTFSA-N 444.360 4.935 50 10 IJGE CC[C@@H](C)c1ccccc1OCC(=O)NNC(=O)c1ccc(OCCc2ccccc2)cc1 14041568 UHOPQUPPAATTGR-HXUWFJFHSA-N 446.547 4.662 50 10 IJGE C=CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4F)ccc32)cc1 38658228 YMHIKDHALDZYEY-DEOSSOPVSA-N 442.446 4.828 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(C)cc4)ccc32)cc1 38676914 PHIYFFRMZGFQMY-AREMUKBSSA-N 440.499 4.760 50 10 IJGE CCOC(=O)c1c(NC(=O)N/N=C/c2c(Cl)cccc2Cl)sc2c1CCC2 40853819 BGIWDRCVQQAIQB-ZVBGSRNCSA-N 426.325 4.876 50 10 IJGE N#C/C(=C\c1ccc(OC(=O)/C=C/c2ccccc2Cl)cc1)C(=O)NCc1ccco1 40926725 ZBORFTJUEXPCCY-GKZQGBICSA-N 432.863 4.775 50 10 IJGE CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](O)[C@@H](OCc2ccccc2)[C@H]1OCc1ccccc1 211447864 YFXHWMFAYWHGCE-NEWJYFPISA-N 444.644 4.896 50 10 IJGE N#C/C(=C/NCCc1ccc(Br)cc1)C(=O)Nc1cccc(Cl)c1Cl 217130164 MGLSKBJWPWVASI-QBFSEMIESA-N 439.140 4.934 50 10 IJGE CCOc1ccccc1C(=O)NN=Cc1cn(-c2ccccc2)nc1-c1ccc(OC)cc1 254498401 CZGUPHZAZUFGDF-UHFFFAOYSA-N 440.503 4.711 50 10 IJGE CCCCCCCCCCCCCC(=O)NCC(=O)NN=Cc1ccc2c(c1)OCO2 254700080 BQDDERYZHXRRLV-UHFFFAOYSA-N 431.577 4.683 50 10 IJGE ClCc1nc2cccnc2n1-c1ccc(I)c(Br)c1 306019636 LQLVEBDBOPCVHA-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE CC1(C)CN(C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)C[C@@]2(CCOC2)O1 797612149 QUJPNCCMLLMTIC-RHSMWYFYSA-N 438.899 4.708 50 10 IJGE CC(=O)c1cccc(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)c1 817991688 GACMBWMRGRSESL-UNOMPAQXSA-N 443.894 4.865 50 10 IJGE CCn1c(SCCCC(=O)NN=Cc2cccc(Br)c2)nc2ccccc21 1084176582 XZJFNWJVZRHVNA-UHFFFAOYSA-N 445.386 4.841 50 10 IJGE COc1cc(C=NNC(=O)c2sc3ccccc3c2Cl)cc(Br)c1O 1084198669 WYNGQMSSEIZTCI-UHFFFAOYSA-N 439.718 4.795 50 10 IJGE C=CCN(CCC#N)C(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Br)cc2)c1C 1298465749 BTWGIDVXEJSFLJ-RGEXLXHISA-N 437.341 4.692 50 10 IJGE CCCc1nn(Cc2ccc(C)cc2)c2c1[C@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689047 ISOZPIQAVXGSLG-OAQYLSRUSA-N 434.927 4.770 50 10 IJGE CCCc1nn(CC(C)C)c2c1[C@H](c1cc(Br)ccc1F)C(C#N)=C(N)O2 1865702215 PMYKOWNTMGQPNK-QGZVFWFLSA-N 433.325 4.611 50 10 IJGE COc1ccc(-c2ccc(C(=O)N/N=C(/C)c3ccc(SC)cc3)c(C)n2)cc1OC 1865763685 YALQLDDJDBNTER-YSMPRRRNSA-N 435.549 4.950 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)C1 1882085890 XCFHIJWDSLCXJM-JYJNAYRXSA-N 449.430 4.996 50 10 IJGE CCc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@@H](CBr)C2CC2)s1 1915167789 XVDKUJABCCRBRF-KRWDZBQOSA-N 428.417 4.675 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2ccc([N+](=O)[O-])cc2CBr)C1 1921470796 SQOUMTHLNJTRIP-DLBZAZTESA-N 432.362 4.837 50 10 IJGE O=C(N[C@@H]1CCC[C@@H]1CBr)c1cccc(Br)c1Br 2031485355 HRTWKRXWDOENKN-LDYMZIIASA-N 439.973 4.505 50 10 IJGE CC1(C)CO[C@H]1COc1c(Br)cc(CBr)cc1Br 2043109250 QTLPKFSDPYMOJC-NSHDSACASA-N 442.973 4.910 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3C[C@H](Br)C[C@H]3C2)c1 2065397130 MBGFNMKKEMSYOC-IAZYJMLFSA-N 440.550 4.550 50 10 IJGE CC(C)[C@H](CBr)CN1CCCC[C@H]1C(F)(F)CNC(=O)OC(C)(C)C 2065453370 RBCTZYXTTQPWKJ-CABCVRRESA-N 427.374 4.668 50 10 IJGE Clc1cc(CN2C[C@@H]3CC(Br)C[C@H]3C2)ccc1I 2086655714 PXVMABXEGHPSNY-QWRGUYRKSA-N 440.550 4.550 50 10 IJGE Clc1cc(CN2C[C@H]3C[C@@H](Br)C[C@H]3C2)ccc1I 2086655715 PXVMABXEGHPSNY-ZSBIGDGJSA-N 440.550 4.550 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)c2ccccc2N1C(=O)N1CCC(Br)CC1 2163054140 UUBWNIYKQPHKBE-CQSZACIVSA-N 438.366 4.616 50 10 IJGE CC[C@@]1(CBr)COCCN1Cc1ccc(Cl)c(Br)c1F 2169024575 APFBUQNNOOVTFL-CQSZACIVSA-N 429.555 4.618 50 10 IJGE CC[C@@H](Br)[C@@H]1CCCCN1S(=O)(=O)c1cc(Br)sc1C 2170612543 JCENSLXXHZOEBQ-MNOVXSKESA-N 445.242 4.536 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@H]1CCCN(C[C@@H](CBr)C2CCC2)C1 2185499690 HEAXZXPHQLWYGH-JKSUJKDBSA-N 441.414 4.747 50 10 IJGE C[C@H](Cl)c1nc2cc(I)ccc2n1C[C@]1(Cl)CC1(F)F 2205572241 KRGDUHVTYOEVOI-JVXZTZIISA-N 431.051 4.957 50 10 IJGE F[C@]1(COc2c(Br)cc(CBr)cc2Br)CCOC1 2222395303 NMICVUIQVIMHDM-GFCCVEGCSA-N 446.936 4.614 50 10 IJGE CC1(NC(=O)OCc2ccccc2)CCC2(CC[C@@H](CI)O2)CC1 2241903826 UNMVWVPPNADQJV-IVMQYODDSA-N 443.325 4.598 50 10 IJGE Cc1c(Br)cccc1CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1Br 2243596332 HWSXCAXEWKASPF-GJZGRUSLSA-N 449.183 4.657 50 10 IJGE COCC1(C[C@@H](Br)c2ccc(OC)c(I)c2)CC1 2257369905 PDACLNCJYWFXIX-LLVKDONJSA-N 425.104 4.553 50 10 IJGE CCCN(C[C@H](C)Br)C(=O)c1ccc(Br)cc1Br 2259758500 VJBUFBROGHABIG-VIFPVBQESA-N 441.989 4.847 50 10 IJGE CC(C)[C@H](CBr)N(C)Cc1ccc(Cl)cc1I 2302494724 KFQBJIIRVOVULT-ZDUSSCGKSA-N 430.555 4.796 50 10 IJGE C[C@@H]1OCC[C@]1(CBr)Cc1cc(I)ccc1Cl 2307274155 JZZRDPGBIXWART-TVQRCGJNSA-N 429.523 4.677 50 10 IJGE CCOc1ccc(CCNC=C(C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1OCC 2324494340 UYBDUSPGLQKIDH-UHFFFAOYSA-N 448.350 4.969 50 10 IJGE CC1(C)COC[C@@]1(CCl)Cc1ccc(I)c(Br)c1 2325222083 QFQIXZJAWYTIIF-AWEZNQCLSA-N 443.550 4.878 50 10 IJGE CC1(C)C[C@@H](Br)CN(Cc2cc(I)ccc2Cl)C1 2327406121 RPTLCUGHMPEKEN-LLVKDONJSA-N 442.566 4.940 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@@H](Br)[C@@H]2CC[C@@H]21 2327406905 NCSLFPMEUMHIPP-SCRDCRAPSA-N 440.550 4.692 50 10 IJGE Cc1nc(NC(=O)C(C#N)=Cc2ccc(Br)cc2)sc1C(=O)OCC(C)C 2329663524 PRAAWVMEGZFXCQ-UHFFFAOYSA-N 448.342 4.573 50 10 IJGE N#CC(=C(O)CNC(=O)c1ccc(Cl)cc1)c1nc(-c2ccc(F)c(F)c2)cs1 2331351542 DDWLSKJPDDHNIC-UHFFFAOYSA-N 431.851 4.964 50 10 IJGE CCc1ccc(Oc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2[N+](=O)[O-])cc1 40658834 JHNIPIGKDSNJQP-UHFFFAOYSA-N 448.266 4.803 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)Cc2ccccc2)CCC3)cc1C 40815733 YBQZVOMAVFEICI-SGWCAAJKSA-N 429.520 4.856 50 10 IJGE COc1ccc([N+](=O)[O-])cc1/C=C(/C#N)c1nc(-c2cc3ccccc3oc2=O)cs1 102924257 OTFGZDZQFDITIL-NVNXTCNLSA-N 431.429 4.897 50 10 IJGE COc1cc(/C=N\NC(=O)Cc2ccc(Cl)cc2)cc(OC)c1OCc1ccccc1 169901760 QYTCWZARSUDVMD-YSMPRRRNSA-N 438.911 4.629 50 10 IJGE CC(C)Oc1ccc(/C=N/NC(=O)c2cc(-c3ccccc3)nc(N3CCCCC3)n2)cc1 169927435 BOSBFBAPKQFNRL-OVVQPSECSA-N 443.551 4.685 50 10 IJGE COc1cc(C=NNC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)ccc1O 254399283 SVGHOEWOVVDNCB-UHFFFAOYSA-N 426.557 4.784 50 10 IJGE CC(C)N(C[C@@H](C)Br)C(=O)c1cc(Br)c(Br)s1 691357955 RUOGNDBEDBAMDG-SSDOTTSWSA-N 448.018 4.907 50 10 IJGE CN(C(=O)c1cc(Br)ccc1Br)[C@H]1CCC[C@@H]1Br 709269744 YLJLGIWXDBZCRK-RYUDHWBXSA-N 439.973 4.600 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2cccc(OCc3cscn3)c2)c(C(F)(F)F)c1 799395174 RLVBFCNGGAPMFC-UHFFFAOYSA-N 433.415 4.761 50 10 IJGE O=C(COc1ccc(Br)cc1Cl)NN=Cc1ccccc1C(F)(F)F 1084135513 GWXWYWJQESUUIQ-UHFFFAOYSA-N 435.627 4.650 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(O)cc2O)ccc1OCc1cccc2ccccc12 1084154802 KJVXZSZYXNMDSB-UHFFFAOYSA-N 442.471 4.603 50 10 IJGE O=C(NN=Cc1ccc(Br)s1)c1ccc(NC(=O)C2CCCCC2)cc1 1084326842 PJOYDLLTYKKWQP-UHFFFAOYSA-N 434.359 4.793 50 10 IJGE C=CCCC[C@@H](C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)c1ccccc1 1463556229 NVFGBXXWSGAMLL-OXQOHEQNSA-N 445.357 4.504 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2cc(F)c(Oc3ccccc3)c(F)c2)c1C 1648570279 ODEBEPDWUFQIOB-UHFFFAOYSA-N 447.445 4.983 50 10 IJGE Cc1ccc(C)c(Cn2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2cccn2C)c1 1865699445 UKXLBLJJNWXJIC-QHCPKHFHSA-N 435.531 4.772 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2cccc(F)c2)[C@H]1c1ccccc1O 1865708017 LUCJJDYBJNWKDL-QFIPXVFZSA-N 438.462 4.661 50 10 IJGE Cc1ccc(SCCCC(=O)NNC(=O)COc2ccc(C)cc2C(C)(C)C)cc1 1865755764 OYNSCCXDKRGBHG-UHFFFAOYSA-N 428.598 4.700 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)Nc2sc3c(c2C(N)=O)CC[C@H](C(C)(C)C)C3)cc1 1866126468 SNWLXSGPOSGQBW-SFKKXYGYSA-N 437.565 4.552 50 10 IJGE COCCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)OC3CCCCC3)cc2)cc1 1866215181 GKRDHAUEYJSWFC-HEHNFIMWSA-N 448.519 4.747 50 10 IJGE CS(=O)(=O)Nc1ccc(/C(O)=C(\C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 1872748113 IZTCRXWSEFLGAB-VLGSPTGOSA-N 431.926 4.785 50 10 IJGE O=C(N[C@H](CCSC[C@@H]1C[C@@H]1Cl)C(=O)O)OCC1c2ccccc2-c2ccccc21 1883551939 LCHJKTXRJOLIKT-SZFUDVHCSA-N 445.968 4.729 50 10 IJGE CN(CC(C)(C)CI)[C@@H]1CCCC[C@H]1N(C)C(=O)OC(C)(C)C 1904651858 UYFRKTFNAWRTDI-HUUCEWRRSA-N 438.394 4.558 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)C(=O)c1cc(I)ccc1O 1915104457 ARYNRPCECOTCEE-AWEZNQCLSA-N 443.712 4.657 50 10 IJGE CC[C@@H](Br)[C@@H](CC)NC(=O)c1csc(Br)c1Br 1945184141 WCJBDRHTERCXPO-HTQZYQBOSA-N 448.018 4.955 50 10 IJGE CC[C@H](CBr)CN1C[C@@H](CC)N(C(=O)OCc2ccccc2)C[C@H]1CC 1977883687 FXCXEGHOHPXBIE-MISYRCLQSA-N 425.411 4.919 50 10 IJGE Cc1cccc(CNCCSSCCNC(=O)OC(C)(C)C)c1Br 2010829033 PFFFGSOWZUYPIO-UHFFFAOYSA-N 435.453 4.753 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@H](CI)O2)C[C@@H]1C1CCC1 2018371872 PGNLCWWHODEIAI-GPMSIDNRSA-N 449.373 4.929 50 10 IJGE CCC[C@H](CBr)CNC(=O)c1cccc(Br)c1Br 2057117503 NJZQJNOEOVNKTD-SECBINFHSA-N 441.989 4.753 50 10 IJGE F[C@@H]([C@H](Br)c1cc(I)cc2c1OCC2)C(F)(F)F 2059187373 OBEVXKBWTYXBFM-SCZZXKLOSA-N 438.984 4.563 50 10 IJGE Fc1ccc(I)c(Cn2nc(C3CCC3)cc2CBr)c1 2070025472 FAUJMNXSUOOFBI-UHFFFAOYSA-N 449.105 4.838 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Cl)c2)C[C@@H]1CBr 2086653023 UVJYRBBVKHRMAA-NSHDSACASA-N 442.566 4.798 50 10 IJGE Clc1cccc(N2CCCN(Cc3ccccc3)CCOCC2)c1CBr 2088627319 BGDHQSUEAQOWCK-UHFFFAOYSA-N 437.809 4.964 50 10 IJGE CC[C@@]1([C@H](Br)c2cc(I)cc3c2OCC3)CCCO1 2090698398 YMZIRXDBQBKKNP-CABCVRRESA-N 437.115 4.621 50 10 IJGE CCCN(C(=O)[C@@H](Br)C1CCCC1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2110716093 UHMFMXYWPHWEOX-IRXDYDNUSA-N 431.415 4.578 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN1C(=O)c1ccc(CBr)cc1 2162912256 SUKPSXQCMFBQIO-QZTJIDSGSA-N 437.378 4.586 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCCN1C(=O)[C@@H](Br)C1CCCC1 2167031578 JCMBXNNZOHULSO-KSZLIROESA-N 443.426 4.721 50 10 IJGE Cc1cccc(C(=O)N2CC[C@@H](Br)CC23CCC3)c1I 2169888648 PLZYJHXZXIILNK-GFCCVEGCSA-N 448.142 4.522 50 10 IJGE ClCCc1nc2ccc(Cl)cc2n1C[C@@H]1CC1(Br)Br 2224807504 STJCSKSTKPDKLB-QMMMGPOBSA-N 426.967 4.977 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@@]12COC[C@@H]1C2 2260000338 YTOPVLAKXXTHJM-WQAUNQLMSA-N 446.911 4.962 50 10 IJGE C[C@H]1CCCN(CC2(CBr)CC(F)C2)[C@@H]1CCCNC(=O)OC(C)(C)C 2265638707 NPVOZFIWSOMYTQ-RPTYLJJZSA-N 435.422 4.905 50 10 IJGE CCCCO[C@@H]1[C@@H](Br)C[C@@H]1Oc1cccc(C)c1I 2277956189 PSIDCLQMELOBRW-CORIIIEPSA-N 439.131 4.700 50 10 IJGE C[C@]1(CBr)CCCN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285843787 DMPHKEMGCCAAHV-CQSZACIVSA-N 427.539 4.879 50 10 IJGE C[C@H]1C[C@H](CBr)CN1Cc1ccc(Cl)cc1I 2302306593 FVMVFUODBUZFLF-VHSXEESVSA-N 428.539 4.550 50 10 IJGE CC[C@H](C[C@H](C)Br)NCc1ccc(Cl)cc1I 2302326442 PHYVGFMWJINROM-JOYOIKCWSA-N 430.555 4.986 50 10 IJGE Cc1cccc(NC(=O)C(C#N)=Cc2c(Oc3cccc(C)c3)nc3ccccn3c2=O)c1 2314534079 XUPXOKOTZLFVKZ-UHFFFAOYSA-N 436.471 4.649 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4)[nH]c3c2)cc1OC(C)C 2323745004 WJYQFSMYOFRHMO-UHFFFAOYSA-N 428.492 4.790 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](Br)[C@H](OCC2CCC(C(F)(F)F)CC2)C1 2327996743 RGPBNTGRCWAXFL-NWINJMCUSA-N 430.305 4.755 50 10 IJGE ClCc1nc(OCc2cc(I)ccc2Cl)ncc1Cl 2352273475 MLKMZHAQDMKQJM-UHFFFAOYSA-N 429.472 4.706 50 10 IJGE CCC[C@@H](C)c1ccc(OCC(=O)N/N=C/c2cc(Br)ccc2OC)cc1 20581782 ORSCHMGSQRPVKW-LJGKHRNASA-N 433.346 4.890 50 10 IJGE COc1ccc(N/C=C(/C#N)c2nc(-c3cc4ccccc4oc3=O)cs2)c([N+](=O)[O-])c1 102421282 SDXDAOKJGSJLSL-KAMYIIQDSA-N 446.444 4.810 50 10 IJGE COc1ccc([C@@H](Br)c2cccc(I)c2)c(OC)c1 109852148 SRSSSDPPRUAUBR-HNNXBMFYSA-N 433.083 4.793 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc3nc(N)sc3c2)ccc1OCc1ccc(C)cc1 169916681 XNKOBKBVIXRQRZ-ZMFRSBBQSA-N 446.532 4.538 50 10 IJGE CCOC(=O)c1ccc(NC(=O)/C(C#N)=C\N(Cc2ccccc2)Cc2ccccc2)cc1 217102471 UCJROJZHNNOQAE-GFMRDNFCSA-N 439.515 4.912 50 10 IJGE COc1cc(/C=C(/C#N)c2nc3ccccc3[nH]2)ccc1OCC(=O)N[C@@H]1CCCC[C@H]1C 254385235 JHHZZZISGQTAMO-VNVNLKCVSA-N 444.535 4.709 50 10 IJGE ClCc1cc2c(I)cc(I)cc2s1 306623566 XBTBGTXFPHIXBW-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@@H](c2ccc(Br)cc2F)C1 382701731 OWVVUSAQDFMDSU-MFKMUULPSA-N 437.147 4.934 50 10 IJGE O=C(CBr)c1cc(OC(F)F)cc(Br)c1OC(F)(F)F 575685026 JFAWMESYHYMXMH-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)Oc1ccc([N+](=O)[O-])c2ncccc12 770128276 YSUAHPKOXVOGAI-HXUWFJFHSA-N 441.443 4.610 50 10 IJGE CS(=O)(=O)c1ccc(-n2nc(-c3ccc(OC(F)(F)F)cc3)cc2CCl)cc1 1614819425 WAUIWRYFDGMAIV-UHFFFAOYSA-N 430.835 4.580 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CC1CCCCC1)C(=O)NNc1nc2ccccc2[nH]c1=S 1633443196 BGNKWVMDXBRGOH-KRWDZBQOSA-N 445.589 4.599 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@H]1c1ccccc1F 1865683316 IPVBJBQJWZUFHM-INIZCTEOSA-N 448.807 4.961 50 10 IJGE CCCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3C)cc1 1865694217 VYTQKXPNPURKEP-QFIPXVFZSA-N 444.535 4.883 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)Cc3ccc(Cl)c(Cl)c3)c(C)n2)cc1 1865757875 YSTSGWULZFVMBS-UHFFFAOYSA-N 428.319 4.676 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CCl)Cc1ccc(Br)c(Br)c1 1882072589 AVVNZMUFECESHX-SNVBAGLBSA-N 427.564 4.886 50 10 IJGE Ic1cccc(CO[C@H]2CCCC[C@H]2I)c1 1902241698 UTIOICLQYZQIRS-OLZOCXBDSA-N 442.078 4.554 50 10 IJGE Cc1cccc(C(=O)N(CCCCl)Cc2ccccc2)c1I 1914602008 BGGBQCZQZFTNCN-UHFFFAOYSA-N 427.713 4.871 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1F 1915272116 ICRJPLNDDMAHSW-KRWDZBQOSA-N 441.272 4.935 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1cncc(Br)c1 1915287865 CXKXFUSQCBKXGS-QGZVFWFLSA-N 440.179 4.906 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC2(CCC2)[C@@]12CCC[C@@H](CI)O2 1924959156 SVPNNTYFVSSVFT-YZVOILCLSA-N 449.373 4.834 50 10 IJGE FC(F)C[C@@H](CBr)NCc1ccc(Br)cc1Br 1943852556 VEOCFHQYPPNNFP-VIFPVBQESA-N 435.932 4.720 50 10 IJGE CC1(C)CN(C(=O)c2scc(Br)c2Br)[C@@H]1CBr 1944096564 MSYBYDYOTCCBFP-SSDOTTSWSA-N 446.002 4.519 50 10 IJGE O=C(N[C@H]1CCC[C@@H](Br)C1)c1csc(Br)c1Br 1945187604 YLLPZNNQOMLIRX-RQJHMYQMSA-N 446.002 4.709 50 10 IJGE O=C(c1ccccc1OCc1ccccc1)N1CCC(CI)CC1 1949197618 MSNAPRGTRGDCKC-UHFFFAOYSA-N 435.305 4.553 50 10 IJGE CC1(C)CC[C@H](Br)CN1c1ncc(Br)cc1Br 1950231377 WDFDFSBGXYKDCR-QMMMGPOBSA-N 426.978 4.749 50 10 IJGE CCS(=O)(=O)C[C@H](Br)c1c(Cl)sc(Br)c1Cl 1988336906 BJBOYRITZBYTHO-BYPYZUCNSA-N 430.998 4.688 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1F 2008321311 GWCVGXFCAZKWDZ-UHFFFAOYSA-N 434.758 4.844 50 10 IJGE CC(C)[C@H](Br)c1cn(-c2cc(Br)cc(Br)c2)nn1 2057421443 NPCXLJXCORKSGZ-LBPRGKRZSA-N 437.961 4.884 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2C[C@@H](Br)C[C@H]2C1 2065404522 VBLNJWCEANEPHM-JGPRNRPPSA-N 438.001 4.817 50 10 IJGE Cc1c([C@H](Br)Cc2ccc(Br)cc2)c(Br)nn1C 2067854856 KDEGIQLPLIGLCG-LLVKDONJSA-N 436.973 4.932 50 10 IJGE ClC[C@@H]1CCC[C@H](CNc2ncc(I)cc2Br)C1 2069526480 WJNPWYNOZZPUMF-ZJUUUORDSA-N 443.554 4.906 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)CCCCBr)c2ccccc21 2106768773 SYRMVPVHCZYKSM-HNNXBMFYSA-N 425.367 4.597 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C[C@@H](CBr)c1ccccc1 2106782660 SDRCWTRLSKRYHQ-MOPGFXCFSA-N 425.411 4.742 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CC2(CBr)CCCCC2)C[C@H]1C(F)(F)F 2106783005 VYUDKSFCQYTOOA-KGLIPLIRSA-N 443.348 4.719 50 10 IJGE Cc1ccc(NC(=O)OC(C)(C)C)cc1CNC(=O)[C@H](Br)C1CCCC1 2139016133 ASBAJFPHTHMVBZ-QGZVFWFLSA-N 425.367 4.912 50 10 IJGE COc1cc(F)c(Br)cc1[C@@H](Cl)c1c(Br)c(C)nn1C 2192374786 NBUFMDXKEHTPKM-GFCCVEGCSA-N 426.511 4.729 50 10 IJGE CS(=O)(=O)c1cccc([C@H](Cl)c2ccc(Br)cc2Br)c1 2203682754 JFCGCTYPVKNRPH-AWEZNQCLSA-N 438.568 4.943 50 10 IJGE C[C@@H](Br)CC(C)(C)CNC(=O)Cc1ccc(Br)cc1Cl 2237441957 UDCOFSTVZONYJY-SNVBAGLBSA-N 425.592 4.961 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(Cl)c1C=C(C#N)C(=O)NCc1ccccc1 2297388052 WETFMKJRHFVFLO-UHFFFAOYSA-N 425.319 4.770 50 10 IJGE Cc1oc(Oc2cc(Br)cc(I)c2)nc1CCl 2301040558 ZCXXXLZAGPRSOG-UHFFFAOYSA-N 428.451 4.881 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@@H]2CCCC3(CC3)C2)C1 2302706015 DGYQZEQJDBGJQC-BEFAXECRSA-N 449.373 4.931 50 10 IJGE C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)C=Cc1cccc2ccccc12 2313540944 FHTAAYZPVAKHHC-AWEZNQCLSA-N 429.303 4.775 50 10 IJGE CC1=C(C#N)C(=O)N(C(C)C)C(=O)C1=Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 2314610002 BQWMLCISDUNJSU-UHFFFAOYSA-N 440.478 4.679 50 10 IJGE CC[C@@H]1[C@H](CBr)CCN1Cc1ccc(Cl)c(I)c1 2315551750 VMYQSXYYQNUGBB-SMDDNHRTSA-N 442.566 4.940 50 10 IJGE COc1ccc(C=NNC(=O)c2ccncc2)cc1OCc1ccc(Cl)cc1Cl 2321730176 RJPOOOZRXRUSSW-UHFFFAOYSA-N 430.291 4.740 50 10 IJGE CCn1nc(Br)nc1C[C@@H](Br)c1ccc(Br)cc1 2328435441 KGVQYQRCFZCEBI-SNVBAGLBSA-N 437.961 4.502 50 10 IJGE FC(F)(CBr)C(F)(F)CNCc1cc(Br)ccc1Cl 2336541417 MTJRCJXWVKASLO-UHFFFAOYSA-N 427.461 4.858 50 10 IJGE CC[C@@H](CBr)CN1CC[C@@H](CCNC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2337588334 XAPQGAIDLYBREZ-ZNMIVQPWSA-N 445.364 4.965 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)C(C)(C)S(C)(=O)=O 2339650893 KDKJRSOCIVYMGJ-NSHDSACASA-N 436.568 4.762 50 10 IJGE Brc1ccc([C@H](CI)OC[C@@H]2O[C@H]3CC[C@H]2C3)cc1 2352572416 GEZZTYTXNBMFAY-MXAVVETBSA-N 437.115 4.509 50 10 IJGE CCOc1ccc(Br)c(/C=N/NC(=O)[C@H](C)Oc2cccc3ccccc23)c1 20176116 LTIDLBUASASKLT-BGHCKBSUSA-N 441.325 4.919 50 10 IJGE COC(=O)c1c(NC(=O)[C@@]23CC[C@@](C)([C@H]2Br)C3(C)C)sc2c1CCCC2 35548402 AVOGSUJBIAHSRW-LSTHTHJFSA-N 440.403 4.942 50 10 IJGE Cc1ccc2nc(N3CCC(C(=O)NNc4ccccc4)CC3)nc(-c3ccccc3)c2c1 35549420 LUHQNNNJVIEFHM-UHFFFAOYSA-N 437.547 4.965 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@H](C)Oc4ccc(F)cc4)ccc32)cc1 38649239 VWCSOQRONFYMPX-FYSMJZIKSA-N 444.462 4.725 50 10 IJGE COc1ccc(/C=N/NC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)cc1OC 40866534 QNPXGYVEYLJIKH-WPWMEQJKSA-N 432.520 4.559 50 10 IJGE CCCOc1ccc(/C=N/NC(=O)COc2ccc(Br)cc2C(C)C)cc1 40950927 AOYLRXGBFQCRRZ-YDZHTSKRSA-N 433.346 4.890 50 10 IJGE Cc1cc(I)ccc1N/C=C(/C#N)C(=O)Nc1ccc(Cl)cc1 217255501 YAXCGPBPDSAIGW-BENRWUELSA-N 437.668 4.711 50 10 IJGE C[C@H](Br)CCCNC(=O)c1cc(Br)cc(Br)c1 227717634 LHNYALGOJVSEGJ-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE CC(C)[C@@H](CCBr)NC(=O)c1cc(Br)ccc1Br 231125025 ALQHYRDUBBKFAL-GFCCVEGCSA-N 441.989 4.751 50 10 IJGE O=C(NC[C@@H]1CCC[C@H]1Br)c1cc(Br)cc(Br)c1 232453516 HEUBIBGWOGJFFU-QPUJVOFHSA-N 439.973 4.505 50 10 IJGE CC[C@H](Oc1cccc(Br)c1)C(=O)NN=Cc1ccc(N(CC)CC)cc1 252617603 KWXLXTCLQLFSRA-FQEVSTJZSA-N 432.362 4.603 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)COc2cc(Cl)c(Cl)cc2Cl)c(O)c1 254287324 WLZKFOZZUXLCKR-UHFFFAOYSA-N 444.746 4.728 50 10 IJGE CCCCOc1ccc(C(C)=NNC(=O)[C@]2(C)CC2(Br)Br)cc1 254841714 UGFLLUOFEYGXHH-INIZCTEOSA-N 446.183 4.602 50 10 IJGE COc1cc(C=NNC(=O)c2cc3ccccc3o2)ccc1OC(=O)c1ccc(C)cc1 254863162 JPMSIZNMTADMOV-UHFFFAOYSA-N 428.444 4.733 50 10 IJGE ClCc1ccc(Br)cc1N1CC[C@@H](N2CCN(Cc3ccccc3)CC2)C1 312608351 GNNWXMSTQQLJFJ-OAQYLSRUSA-N 448.836 4.584 50 10 IJGE CC[C@@H](C)N(CCCl)S(=O)(=O)c1cc(Br)c(C)cc1Br 312727649 INTIXYKLNIGOAK-SNVBAGLBSA-N 447.620 4.548 50 10 IJGE CC(C)(C)[C@H](Br)CNC(=O)c1ccc(Br)cc1Br 324398150 GXFLKFVXNYUTSI-LLVKDONJSA-N 441.989 4.751 50 10 IJGE CC[C@@H](C)N(CCBr)C(=O)c1cc(Br)c(Br)s1 393849972 VOYCNHTUZZMTSC-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE Cc1sc([C@H](Br)c2nn(C)cc2Br)cc1Br 693104219 YDUFVEVVVQCZSW-VIFPVBQESA-N 428.975 4.799 50 10 IJGE C[C@@H](Cl)c1nc2cccc(Br)c2n1C[C@H]1CN(Cc2ccccc2)CCO1 697705899 BRULOGTVAUUVOC-NVXWUHKLSA-N 448.792 5.000 50 10 IJGE CN(C(=O)c1cc(Br)cc(Br)c1)[C@@H]1CCC[C@@H]1Br 709265246 BZOKVKMMKONBCN-NWDGAFQWSA-N 439.973 4.600 50 10 IJGE O=C(NCc1ccccc1Sc1ccccc1)NNC(=O)c1cccc2cccnc12 730678049 HIFGTULDGHDLOX-UHFFFAOYSA-N 428.517 4.530 50 10 IJGE CC[C@H](NC(=S)NNC(=O)c1ccccc1OCc1ccc(F)cc1)c1cccs1 734367201 BBVWSDKNPQSPLV-SFHVURJKSA-N 443.569 4.726 50 10 IJGE CCc1noc(COc2ccc(OC(=O)/C(C#N)=C/c3cc(C)n(CC(C)C)c3C)cc2)n1 741629139 VLNWRSCCAWBORD-UDWIEESQSA-N 448.523 4.798 50 10 IJGE C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)NNC(=O)c3cccc4cccnc34)c2)C1 756256379 HXMXRJWMNRGUML-LAUBAEHRSA-N 432.524 4.797 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N2CCn3c(C(C)C)nnc3[C@@H]2C)c(C)n1C1CCCCC1 784697999 FWFFTUXSDGOLAI-BJLUOBIUSA-N 434.588 4.835 50 10 IJGE O=C(NN=Cc1cccc(OCc2ccccc2Cl)c1)C(=O)Nc1cccc(Cl)c1 1084125155 QRHZJQIQSXCJIX-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE O=C(NN=Cc1ccccc1Oc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cccc(O)c1 1084319530 JNFXWYAMAPDOAA-UHFFFAOYSA-N 445.353 4.875 50 10 IJGE C/C(=C\c1cccnc1)C(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 1523704708 XEPGEIHQDLIFQM-DTQAZKPQSA-N 437.952 4.892 50 10 IJGE CCc1nn(CC)c2c1[C@@H](c1ccccc1OCc1ccccc1Cl)C(C#N)=C(N)O2 1865703292 SNGQFHHWJMDUAV-NRFANRHFSA-N 434.927 4.916 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1cccc(OC)c1)C(C#N)=C(N)O2 1865711965 MJNYHQIWVKIQFC-HXUWFJFHSA-N 438.890 4.513 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)/C=C/c3cccc(OC(C)C)c3)c(C)n2)cc1C 1865756359 UCXNEHAWGIIDJF-GXDHUFHOSA-N 443.547 4.935 50 10 IJGE CC(C)(CCl)N(Cc1ccccc1)C(=O)Cc1ccccc1I 1915741142 KWDMSRBTQWRFJH-UHFFFAOYSA-N 441.740 4.880 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CC[C@]23CC[C@@](C)(CI)O3)C1 1986985113 KTCGHSXRWHZOSI-OKZBNKHCSA-N 435.346 4.540 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](C[S@@](C)(=O)=NCCCCCBr)C(C)(C)C 1999513748 DQOZXTNMXPWTMO-LFPIHBKWSA-N 427.449 4.589 50 10 IJGE C[C@H]1C[C@H]1N(CCBr)C(=O)c1scc(Br)c1Br 2002041298 PMQAHDUEMWKQHE-POYBYMJQSA-N 446.002 4.519 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@H]1Cc1cc(Cl)ccc1I 2007129381 TUBRMFDYOZXYJQ-GBIKHYSHSA-N 429.523 4.676 50 10 IJGE Cc1cc([C@@H](Br)c2cc(I)sn2)c(F)cc1F 2007644660 MYMQVWLPNMAMPW-LLVKDONJSA-N 430.055 4.819 50 10 IJGE Fc1cccc(F)c1C[C@H](Br)c1cc(I)sn1 2007645768 WXZRTAJBJQIPIU-ZETCQYMHSA-N 430.055 4.705 50 10 IJGE C[C@H](Br)[C@H]1CCCN1C(=O)c1csc(Br)c1Br 2018124040 WCMQEPFWOCKSAM-POYBYMJQSA-N 446.002 4.661 50 10 IJGE CN[C@H](c1cc(Br)c(C)cc1Br)[C@H]1C[C@@H](Br)C1 2020162010 SEZKDDQZNHUKCM-RWEMILLDSA-N 425.990 4.954 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1cc(Br)c(Br)s1 2023037718 NYOZWUFIHZODIH-POYBYMJQSA-N 448.018 4.813 50 10 IJGE BrC[C@@H]1C[C@H]2CCC[C@H]2N1c1ncc(Br)cc1Br 2046157276 LVOBCBPYPZIUAW-UBHAPETDSA-N 438.989 4.749 50 10 IJGE C[C@@]12CN(Cc3cc(Br)ccc3Br)C[C@]1(CBr)C2 2054721107 BRDGWOJDGKKNIJ-ZIAGYGMSSA-N 438.001 4.819 50 10 IJGE FC(F)c1c(I)cc(I)cc1CCl 2060238720 PWFMFNXMTNABLX-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE C[C@H]1CN(c2ncc(I)cc2Br)CC[C@H]1CCCl 2069529891 UCIOGFOEJONQNL-VHSXEESVSA-N 443.554 4.540 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2[C@@H]1CN(Cc2ccccc2)C[C@@H]1C 2096803840 TXHOZPNGXRLCOH-SCLBCKFNSA-N 433.781 4.934 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](Br)C(F)(F)F)[C@H](c2ccccc2)C1 2106785252 NYXGDJJROSLZFS-LSDHHAIUSA-N 437.300 4.606 50 10 IJGE Cc1sc(Br)cc1C(=O)N1C[C@]2(F)CCC[C@@]2(CBr)C1 2176631195 WJWSBZXJNAOLMQ-ZIAGYGMSSA-N 425.161 4.548 50 10 IJGE CCc1cc(Br)c([C@H](Br)[C@@]23CCC[C@H]2CS(=O)(=O)C3)s1 2201878828 MOIRTONFJHDVJC-QCZZGDTMSA-N 442.238 4.724 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCC(OCCCCl)CC1 2207525124 SLPQFMCTJMPZFM-UHFFFAOYSA-N 445.604 4.523 50 10 IJGE CC[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1N(C)CCCCCI 2211184368 CXMBCAOMRAVNKL-HZPDHXFCSA-N 438.394 4.559 50 10 IJGE Cc1sc(C(=O)N(C)C2(CBr)CCSCC2)c(Br)c1C 2237623904 OXXIWKAZKOQWHG-UHFFFAOYSA-N 441.254 4.860 50 10 IJGE Cn1nc(CN2C[C@H](Br)CC23CCCCC3)c(Br)c1Cl 2241053243 ARMVCLWFUDUYTG-SNVBAGLBSA-N 425.596 4.508 50 10 IJGE CCCN(CCCCI)C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2243590672 IHUQICORGXKXQF-INIZCTEOSA-N 438.394 4.561 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C[C@@H]3CC[C@H](C2)O3)cc1I 2269533533 FUKZHWOIOAJRRK-OXIQGZBJSA-N 437.115 4.693 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2ccc(OCc3ccc(C(=O)O)cc3)cc2)cc1 2297455887 QPTOIDHPXJTIMP-UHFFFAOYSA-N 442.471 4.908 50 10 IJGE CC[C@H](C[C@H](C)Br)NCc1ccc(Cl)c(I)c1 2300241429 ZAYUDQAIRQGXLY-GXSJLCMTSA-N 430.555 4.986 50 10 IJGE O=S1(=O)C[C@H]2C([C@@H](Cl)c3ccc(OCc4ccccc4)cc3Br)[C@@H]2C1 2314486511 BGFRUXVTGLZILK-MDZRGWNJSA-N 441.774 4.599 50 10 IJGE COc1cccc(CBr)c1OCc1sccc1I 2316756584 GGAXZWKFZKPBGZ-UHFFFAOYSA-N 439.112 4.835 50 10 IJGE CCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2326917342 OPCUADYXTRPFGG-RHSMWYFYSA-N 425.358 4.518 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@](C)(CBr)C(C)(C)C)CC1(F)F 2327109890 OGQAGEVKJUSRTE-DYVFJYSZSA-N 427.374 4.668 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H](CNC(=O)OC(C)(C)C)C3(CCC3)C2)C1 2345004355 JOLRCGFMWVMOCM-INIZCTEOSA-N 429.443 4.815 50 10 IJGE CCCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2351887541 ALCALDJPGPCJQJ-CRAIPNDOSA-N 439.385 4.908 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cccc(C(F)(F)F)c1F 2369434387 WVDNETCXJIHNSZ-AWEZNQCLSA-N 448.254 4.945 50 10 IJGE FC(F)(F)Cc1cccc(CO[C@@H](CCl)[C@H](I)CCl)c1 2381379394 BXQBXPRRXKAWHN-NEPJUHHUSA-N 441.058 4.958 50 10 IJGE CC[C@@H](C)c1ccc(OCC(=O)NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1 13983229 VYNLHQLVGIYZJI-ZIAGYGMSSA-N 439.339 4.501 50 10 IJGE N#C/C(=C\c1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1)C(=O)NCc1ccccc1 21270111 DLLHMQQVJDGBEA-SPQRHKFCSA-N 428.332 4.782 50 10 IJGE COc1ccc(/C(C#N)=C\c2ccc(OC(=O)Cc3cccs3)c(OC)c2)cc1OC 31902055 ALMJJWGCOOYYSK-WQRHYEAKSA-N 435.501 4.986 50 10 IJGE Cc1ccccc1C(=O)NNc1ncnc(Oc2cc(C)c(Cl)c(C)c2)c1[N+](=O)[O-] 40657737 UXBYWSVMQODXDN-UHFFFAOYSA-N 427.848 4.513 50 10 IJGE Cc1c(C(=O)Nc2ccccc2Cl)oc2c1/C(=N/NC(=O)c1ccccc1O)CCC2 40826465 KTWAXEYAGYVLIY-YZSQISJMSA-N 437.883 4.670 50 10 IJGE COc1ccc([C@@H](Br)c2csc(I)c2)c(F)c1 123464244 IXBXNAZNURWPRV-LBPRGKRZSA-N 427.076 4.985 50 10 IJGE Cc1cccc(Cn2cccc(C(=O)N/N=C\c3c(Cl)ccc(Cl)c3Cl)c2=O)c1 169918223 OMEBPKJWYFPTIK-GATIEOLUSA-N 448.737 4.929 50 10 IJGE COc1cc(N/C=C(/C#N)C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)c(OC)cc1Cl 217203892 MLWIFTPHSSWOHK-NOMGLIDZSA-N 439.943 4.933 50 10 IJGE CCC[C@H](CCCl)CNS(=O)(=O)c1cc(Br)ccc1Br 227504947 OZCKBPGWLKLXFM-SNVBAGLBSA-N 447.620 4.535 50 10 IJGE CCCS(=O)(=O)CCC(CBr)(CBr)c1ccc(Cl)cc1 233257866 FPYKQOSPPSSLDG-UHFFFAOYSA-N 446.632 4.583 50 10 IJGE CC[C@H](Br)c1nnc(-c2ccc(F)cc2I)s1 233989887 PKRSMWYBMNFYQZ-QMMMGPOBSA-N 427.080 4.795 50 10 IJGE O=C(Nc1ccc(CCBr)cc1)c1sccc1I 310864167 RCVSZTVLOJFGOC-UHFFFAOYSA-N 436.112 4.542 50 10 IJGE CN([C@H](CBr)C(C)(C)C)S(=O)(=O)c1ccc(Cl)c(Br)c1 689233583 WKVNOTQYKLMBPE-GFCCVEGCSA-N 447.620 4.533 50 10 IJGE O=C(Nc1ccc(CCBr)cc1)c1cccc(F)c1I 721664562 GQWJBSRZEOLTTH-UHFFFAOYSA-N 448.073 4.620 50 10 IJGE C=CCc1cc(C=NNC(=O)CC[C@@H](O)c2ccccc2)cc(Br)c1OCC 725401738 OWMRSHNPBCYXQQ-HXUWFJFHSA-N 445.357 4.540 50 10 IJGE O=C(NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1cccc(CN2CCCC2)c1 804210023 FBFISAJGAFHYMV-UHFFFAOYSA-N 441.457 4.515 50 10 IJGE O=C(NNc1ccc2ccccc2n1)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1 810388399 HZIFLKUICUYXBP-UHFFFAOYSA-N 432.867 4.762 50 10 IJGE O=C(Cc1ccc(F)cc1)NN=Cc1ccc(OCc2ccc(Br)cc2)cc1 1084598985 PYLKPLMLGXNAJH-UHFFFAOYSA-N 441.300 4.860 50 10 IJGE C#C[C@H]1CC[C@H](NC(=O)NNC(=O)c2ccc(COc3ccc4ccccc4c3)cc2)CC1 1471235732 YTDFVEHNTVHXIO-OGAOHHHESA-N 441.531 4.555 50 10 IJGE CC(C)[C@H]1N(C(=O)OC(C)(C)C)CC12CCN(C[C@@H](CBr)C1CC1)CC2 1620662413 CZYYAPRTVHMBBW-QZTJIDSGSA-N 429.443 4.765 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2cccc(Cl)c2)[C@@H]1c1cccnc1 1865700329 PYAYQRQOWJGOQH-OAQYLSRUSA-N 439.906 4.865 50 10 IJGE CCc1nn(CC(C)C)c2c1[C@@H](c1cccc(OCc3ccccc3)c1)C(C#N)=C(N)O2 1865712429 YCUZDYFUXORIFX-QHCPKHFHSA-N 428.536 4.899 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@H](C)[C@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1880760799 JCYSGKREHMCBQD-JFRXWTBNSA-N 425.411 4.679 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CC[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C1 1882088956 VUTUVIVYJCZODR-FXUDXRNXSA-N 447.414 4.558 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1ccc(F)cc1Br 1915069960 QEXOABULYDZPJM-AWEZNQCLSA-N 434.758 4.797 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1ccncc1Br 1915098738 KYDVQJJIWGLCFC-AWEZNQCLSA-N 426.152 4.660 50 10 IJGE C[C@H](Br)C[C@H](C)NC(=O)c1cccc(Br)c1Br 1943887237 NSVIRFYCTPNTPO-YUMQZZPRSA-N 427.962 4.503 50 10 IJGE CC(C)(C)OC(=O)N1C[C@](C)([C@H]2CC[C@@](C)(CI)O2)CC1(C)C 1992813776 LOOJEZCILXULAX-XWIAVFTESA-N 437.362 4.785 50 10 IJGE Brc1cccc(Br)c1C[C@@H]1CCOCC[C@H]1Br 2001024583 TUDTUGKQUXOYNZ-GXSJLCMTSA-N 426.974 4.944 50 10 IJGE C=CC[C@@](C)(CCl)CNc1ncc(I)cc1Br 2023509956 WEJFGCUXJNKOSW-LBPRGKRZSA-N 429.527 4.682 50 10 IJGE CC1([C@@H](CBr)NC(=O)c2cc(Br)cc(Br)c2)CC1 2033128964 AKRJZQIBMUIOLH-LLVKDONJSA-N 439.973 4.505 50 10 IJGE COc1cc(C=C(C#N)C(=O)c2c[nH]c3cccc(C)c23)c([N+](=O)[O-])cc1OC(F)F 2054672152 CJVIJXQIDSYNTJ-UHFFFAOYSA-N 427.363 4.784 50 10 IJGE BrC[C@@H]1C[C@@H]2CC[C@H](C1)N2c1ncc(Br)cc1Br 2064844384 WXRLOHHQUVULAD-GUDFOSOFSA-N 438.989 4.749 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)c1ccc(Cl)c(NC(=O)OC(C)(C)C)c1 2076216546 ROUDDKOZDGBFJA-BJHJDKERSA-N 431.758 4.933 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC2(CC[C@@H]1CCl)CC2 2097876902 JNSGVOWUGGDEDR-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE Brc1cccc([C@H](CI)OC[C@H]2C3C[C@@H]4C2[C@@H]4C3)c1 2134516180 FKOJSISRKQDBLI-LVNJGXIJSA-N 433.127 4.844 50 10 IJGE C[C@@H](Br)C[C@@H]1CCCCCN1S(=O)(=O)c1cscc1Br 2143915845 UJPZHZMTEQGVKZ-MNOVXSKESA-N 445.242 4.617 50 10 IJGE C[C@]1(C2CC2)CN(C(=O)c2ccc(CBr)cc2)CCN1Cc1ccccc1 2151075715 GQWZOHOGJITEKA-HSZRJFAPSA-N 427.386 4.708 50 10 IJGE CC(C)(C)OC(=O)NCC1(CO)CCN(CCCCCCCCCBr)CC1 2202906758 LBQFFEOVWAKPPA-UHFFFAOYSA-N 449.474 4.711 50 10 IJGE CN(c1cc(Br)cc(F)c1CBr)C1CSCCSC1 2228719102 LYIBBRHWJNMICT-UHFFFAOYSA-N 429.218 4.768 50 10 IJGE O=C(NCC1(CCl)CC(F)(F)C1)c1cc(Br)c(Br)s1 2266908369 GNUMNMMRNMGQLM-UHFFFAOYSA-N 437.531 4.657 50 10 IJGE CCCN[C@@H](c1ccc(OC)c(I)c1)[C@H]1C[C@H](Br)C1 2269589279 XNFLLBRMQBLSIG-HUBLWGQQSA-N 438.147 4.514 50 10 IJGE CC(C)CN(C[C@@H](C)Br)S(=O)(=O)c1c(Cl)cccc1Br 2288062976 WZTXPBNTVYAYOR-SNVBAGLBSA-N 447.620 4.533 50 10 IJGE C[P@@]1(=O)C[C@H](Cc2ccc(I)c(Br)c2)[C@@H](Cl)C1 2306223936 LBEHZVHGRLASRW-LTHLMHMASA-N 447.478 4.826 50 10 IJGE Clc1ccc(I)cc1C[C@]1(CBr)CCCCO1 2307275672 RYZPJGLUGJDKEH-ZDUSSCGKSA-N 429.523 4.821 50 10 IJGE C[P@@]1(=O)C[C@H](Cc2cc(I)ccc2Cl)[C@@H](Br)C1 2307330005 IVAUZWUGPHYRHC-LTHLMHMASA-N 447.478 4.873 50 10 IJGE Clc1ccc(CN2CCC[C@H](CCBr)C2)cc1I 2315550437 DJYJBIHLYOELBC-LLVKDONJSA-N 442.566 4.942 50 10 IJGE COc1ccc(CBr)cc1OCc1sccc1I 2316755516 UIADKLORZYDTTO-UHFFFAOYSA-N 439.112 4.835 50 10 IJGE C[C@@H](C(O)=C(C#N)c1nc(-c2ccc(F)c(F)c2)cs1)N1C(=O)c2ccccc2C1=O 2331351737 UGEPUPRHUCIFKP-NSHDSACASA-N 437.427 4.566 50 10 IJGE O=C(N[C@H]1C[C@@H]2C[C@H]1C[C@@H]2Br)c1cc(Br)c(F)cc1Cl 2359509201 RNXRPZWAXXDHIE-LOSGYTSQSA-N 425.523 4.533 50 10 IJGE CCOc1ccc([C@H](Cl)c2c(Br)c(Br)nn2C)c(F)c1 2367475564 ZUPYZKFFOWYUOY-NSHDSACASA-N 426.511 4.811 50 10 IJGE Clc1cccc(CN(CCCBr)C2CCOCC2)c1Br 2381161509 RGDYUXUFUROSEL-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE CCOc1cc([C@@H]2CC(=O)N3CN(c4ccc(C)c(C)c4)CSC3=C2C#N)ccc1O 6089714 XYQUFKWVWKDXQL-IBGZPJMESA-N 435.549 4.627 50 10 IJGE CCOc1ccccc1N1CSC2=C(C#N)[C@H](c3ccc(Cl)cc3)CC(=O)N2C1 9693225 FAIDMUPIZZIWQW-KRWDZBQOSA-N 425.941 4.958 50 10 IJGE C=CCOc1ccc(/C=N/NC(=O)CSCc2ccccc2Cl)c(OCC=C)c1 20073437 MNLUHNXXADOYDH-ZVHZXABRSA-N 430.957 4.853 50 10 IJGE Cc1ccccc1OCCn1cc(/C=C(/C#N)C(=O)NCc2ccco2)c2ccccc21 33932563 SKWVAFPWWFCJOG-HKWRFOASSA-N 425.488 4.845 50 10 IJGE COc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccccc3Cl)ccc21 38649936 BDGWAXDUQIGBLN-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE C=CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(F)cc4)ccc32)cc1 38658027 SKCSUOJIGLZLRD-XMMPIXPASA-N 442.446 4.828 50 10 IJGE CCOc1ccc2ccccc2c1/C=N/NC(=O)COc1ccc(Br)cc1 40912155 XCFXICUUIJJEQL-YDZHTSKRSA-N 427.298 4.530 50 10 IJGE C=CCNC(=O)/C(C#N)=C1\S[C@@H](Cc2ccccc2)C(=O)N1c1ccc(C(C)C)cc1 101241521 GKFPLBFYKMGRQC-JSIHEXFSSA-N 431.561 4.538 50 10 IJGE O=S(=O)(Nc1cccc(CCCBr)c1)c1cccc(Br)c1 139457312 UXDQPBVBGHWUTH-UHFFFAOYSA-N 433.165 4.577 50 10 IJGE CC[C@H](Cl)[C@H](CC)NC(=O)c1cc(I)ccc1Br 313087028 CFOIEXDZUFMYCF-RYUDHWBXSA-N 444.538 4.580 50 10 IJGE Nc1ccc([C@@H]2CN(Cc3ccccc3)C[C@H]2CI)c(Cl)c1 382683664 GJFYNIOGWBHEJY-RHSMWYFYSA-N 426.729 4.573 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 398463439 SWMTVGLIFZDZEM-BWUSGFMJSA-N 431.765 4.797 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21 404188613 CUWWHMDTTUAIOO-FCHUYYIVSA-N 437.466 4.943 50 10 IJGE O=C(N[C@H]1CCC[C@@H](Br)C1)c1scc(Br)c1Br 705449099 XPMUMNVDAGNWRF-RQJHMYQMSA-N 446.002 4.709 50 10 IJGE C[C@H](Br)[C@@H]1CCN(C(=O)c2cc(Br)sc2Br)C1 719965775 CBXNUAWTXBTBSE-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE C[C@H](Oc1ccccc1NC(=O)NNC(=O)c1cccc2cccnc12)c1ccccc1 756585955 OEJKYCWLYWVDQN-KRWDZBQOSA-N 426.476 4.841 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OCc2ccc(F)cc2)c(-c2ccc(Cl)cc2)n1 782093837 AEPXROGUNAQTPO-PDGQHHTCSA-N 434.858 4.907 50 10 IJGE Cc1nc2ccccc2n1CC(=O)NN=Cc1ccc(OCc2ccccc2Cl)cc1 1084141101 FILOXPXTQQJENO-UHFFFAOYSA-N 432.911 4.727 50 10 IJGE C=CCCC[C@H](C)NC(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1 1230814528 GMNNABKPBWSSIA-KRWDZBQOSA-N 429.948 4.916 50 10 IJGE CCOc1cccc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)c1O 1614624001 VOOLCAIJSHQBAD-FUHWJXTLSA-N 434.330 4.538 50 10 IJGE O=[N+]([O-])c1ccc(-n2nc(-c3cccc(Br)c3)cc2CCl)c([N+](=O)[O-])c1 1614817169 ILGDXZCFTSITSI-UHFFFAOYSA-N 437.637 4.857 50 10 IJGE Cc1cc(OCC(=O)NN=Cc2ccccc2Cl)c(Br)c(C)c1Cl 1772756534 NDORIRZVPFANQS-UHFFFAOYSA-N 430.129 4.902 50 10 IJGE CCc1nn(Cc2cc(C)ccc2C)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865698872 FJUAOEYPDBJOHV-DEOSSOPVSA-N 437.547 4.821 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2C[C@]23CCOC3)s1 1900920735 XQAKBTOFJIOLSL-OIVXANJASA-N 433.536 4.869 50 10 IJGE O=S(=O)(c1ccccc1Cl)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915165659 NGKREXMXVQNADR-QGZVFWFLSA-N 428.779 4.704 50 10 IJGE Fc1cc2nc(CCCl)n(-c3csnc3Br)c2cc1Br 1926865721 WUVHIGQAUSVRSK-UHFFFAOYSA-N 439.535 4.927 50 10 IJGE Cc1nn(C)c(Br)c1CN(Cc1ccccc1)[C@H](CBr)C1CC1 1986916237 YKYPDADCECSXCT-QGZVFWFLSA-N 441.211 4.667 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)Cc1ccc(Cl)c(C(F)(F)F)c1 1995148167 ZDIJYELTBPFSMH-LLVKDONJSA-N 446.650 4.961 50 10 IJGE C[C@H]1CC[C@](CCl)(Nc2ncc(I)cc2Br)C1 2018683097 MTEZTWIHIGVGFS-UFBFGSQYSA-N 429.527 4.658 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)c1cc(Br)ccc1CBr 2020228643 PGQSDRJMIYQWIM-OTCDBFHCSA-N 425.990 4.954 50 10 IJGE CCCC(CBr)(CCC)CN=[S@@]1(=O)CC[C@H](NC(=O)OC(C)(C)C)C1 2044700066 PHQGKHYXCTWQKG-ODCWNRFASA-N 439.460 4.733 50 10 IJGE COCCCCN(Cc1ccccc1)S(=O)(=O)c1c(C)csc1CBr 2059287058 SLWCXJLVWAVKSL-UHFFFAOYSA-N 446.432 4.569 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCCC[C@H]2NC(=O)CCCCBr)CC1 2106204167 RUWXBXVAFRIITK-MRXNPFEDSA-N 431.415 4.628 50 10 IJGE C[C@H](Br)C[C@@H]1CCCCCN1S(=O)(=O)c1cscc1Br 2143915851 UJPZHZMTEQGVKZ-QWRGUYRKSA-N 445.242 4.617 50 10 IJGE CC1(C)CCN(C(=O)c2cc(Cl)ccc2I)C[C@H]1CCl 2148665959 LFZCPJNBJVJBAI-SNVBAGLBSA-N 426.125 4.672 50 10 IJGE O=C(c1ccccc1OCc1ccccc1)N1C[C@@H](CBr)[C@@H](C(F)(F)F)C1 2163359238 QUNANSMHRCZCDN-WBVHZDCISA-N 442.275 4.911 50 10 IJGE FC(F)(F)C[C@@H](Cl)CNc1ncc(C(F)(F)F)cc1I 2175687898 CEHSHWMVPYOJTL-ZCFIWIBFSA-N 432.533 4.677 50 10 IJGE Brc1cccc([C@H](CI)O[C@H]2C[C@H](n3cccn3)C2)c1 2183664009 BCGWNUDVGGRIAS-KKUMJFAQSA-N 447.114 4.542 50 10 IJGE Cc1cc(C(=O)NC[C@@]2(CBr)C[C@@H]2C(F)(F)F)c(Br)s1 2192582201 ACWLKYNREXPJFX-KWQFWETISA-N 435.103 4.512 50 10 IJGE ICCCCCN1CCC2(CCN(Cc3ccccc3)CC2)C1 2211183814 HZZNSEIDHHDIIH-UHFFFAOYSA-N 426.386 4.580 50 10 IJGE O=S(=O)(Nc1ccc(Cl)cc1CBr)c1ccccc1Br 2239637694 GKAYURHUAWXNAV-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE CCN(CC1(CBr)CC(F)C1)[C@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2265637969 HOLXGSFCGBWRQG-HMFCVHIJSA-N 435.422 4.905 50 10 IJGE Clc1ccc(CN[C@@H](CCBr)C2CC2)cc1I 2300240493 MUBNEJZBIDMLHX-ZDUSSCGKSA-N 428.539 4.598 50 10 IJGE N#CC(=CN1CCN(Cc2ccccc2)CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1 2325129938 HIFBJEMQEXQZKH-UHFFFAOYSA-N 438.531 4.643 50 10 IJGE Cl[C@H]1C[C@H]2C[C@H]1C[C@@H]2NCc1ccc(I)c(Br)c1 2325227131 XGUNBOJZCMPMPQ-QPPBUOOMSA-N 440.550 4.549 50 10 IJGE C[C@H](O[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1Br)c1cccc(OC2CC2)c1 2342607117 MKUQEYWXNKMOAK-KKXDTOCCSA-N 426.351 4.688 50 10 IJGE CCC[C@H](CBr)CN1C[C@H]2CC(F)(F)CC[C@]2(NC(=O)OC(C)(C)C)C1 2344075178 CZZAEILPEZCQDD-RKVPGOIHSA-N 439.385 4.812 50 10 IJGE Clc1cc(Br)c(CN2C[C@@H]3CC[C@@H](CBr)O[C@H]3C2)s1 2345961955 PYACHAFBZYIQAT-QXEWZRGKSA-N 429.605 4.538 50 10 IJGE CC(C)(CCl)[C@H]1CCCN1C(=O)c1ccc(Cl)cc1I 2365596582 WSBXHBDNLKQCIC-CYBMUJFWSA-N 426.125 4.814 50 10 IJGE COc1ccc(C[C@@H](Br)c2ccccc2I)cc1OC 110295308 YGDOQHHPGTWDRV-CYBMUJFWSA-N 447.110 4.987 50 10 IJGE O=C1COc2ccc([C@@H](Br)c3ccc(Br)c(Cl)c3)cc2N1 129174790 XUKYMKVAEGMSOG-HNNXBMFYSA-N 431.511 4.918 50 10 IJGE Brc1cccc([C@@H](CI)OC[C@@H]2CCCCO2)c1 161965533 IOYSQNLTBJJTES-UONOGXRCSA-N 425.104 4.511 50 10 IJGE COc1ccc(CNC(=O)/C(C#N)=C/c2ccc(OCc3cccc(F)c3)c(OC)c2)cc1 207155340 PVYTVWLOPYCINS-CIAFOILYSA-N 446.478 4.645 50 10 IJGE COc1cc(N/C=C(/C#N)C(=O)N[C@@H](C)C23CC4CC(CC(C4)C2)C3)c(OC)cc1Cl 217054676 QPVQJCGVYALJMA-VODFYHNXSA-N 443.975 4.898 50 10 IJGE COc1cc(Br)ccc1[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CBr 382681392 BIZZBRQVLVNZQA-RISCZKNCSA-N 449.183 4.803 50 10 IJGE CC(C)C[C@H](CBr)NC(=O)c1scc(Br)c1Br 705396969 AVRXFFQTHLTXBI-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE CS(=O)(=O)CCCCC(CBr)(CBr)c1cccc(Cl)c1 706357136 HNYRLHFGLQXINM-UHFFFAOYSA-N 446.632 4.583 50 10 IJGE Cn1ccnc1C[C@@H](NC(=O)NN(Cc1ccccc1)c1ccccc1)c1ccccc1 745910517 TZJDSNKWEVZHIB-XMMPIXPASA-N 425.536 4.625 50 10 IJGE O=C(NNc1ccc(F)cc1Br)c1cc2c(Br)cccc2[nH]1 748077467 SDFGJGHBXYSPKH-UHFFFAOYSA-N 427.071 4.589 50 10 IJGE Cn1cc([C@H](NS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)C(F)(F)F)cn1 774947308 DKDQWFUGTGVZOY-NSHDSACASA-N 445.357 4.659 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNc1ccc(C#N)cc1C(F)(F)F)O[C@H](C)C2 799746460 LSRPWNHGOFZLJF-PVUWLOKVSA-N 445.441 4.546 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNC(=S)Nc2cccc(Cl)c2)s1 1463687542 GJNYYNKPIQNFKC-UHFFFAOYSA-N 447.438 4.510 50 10 IJGE CCN1C(=O)CCc2cc(-c3nc(NC(=O)/C(C#N)=C/c4ccccc4)sc3C)ccc21 1859513955 UTKKITUQICXTRX-DEDYPNTBSA-N 442.544 4.963 50 10 IJGE COc1ccc(-c2nn(Cc3ccccc3)c3c2[C@H](c2ccccc2)C(C#N)=C(N)O3)cc1 1865680837 XEJOQXGWBOEVQZ-HSZRJFAPSA-N 434.499 4.825 50 10 IJGE CC1([C@@H](CBr)NC(=O)c2cc(Br)c(Br)s2)CC1 1945361032 IVZWXQSSZQHYDJ-MRVPVSSYSA-N 446.002 4.567 50 10 IJGE C[C@H]1C[C@H](CBr)CN1Cc1cccc(Br)c1Br 1950534092 BJCBHXRHHOEPAC-VHSXEESVSA-N 425.990 4.817 50 10 IJGE C[C@H]1C[C@H](CBr)CN1Cc1c(Br)cccc1Br 1950540222 YYQOBJIWVGDHDX-VHSXEESVSA-N 425.990 4.817 50 10 IJGE Brc1cc([C@@H](Br)Cc2ccncc2Br)ns1 1983295123 NWFZBSDDRIZYAI-ZETCQYMHSA-N 426.959 4.742 50 10 IJGE CCS(=O)(=O)C[C@@H](Br)c1c(Cl)sc(Br)c1Cl 1988336907 BJBOYRITZBYTHO-SCSAIBSYSA-N 430.998 4.688 50 10 IJGE Cl[C@@H]1CCC[C@H](CNc2ncc(I)cc2Br)C1 2015756425 FRSSRNQFTCEVFS-DTWKUNHWSA-N 429.527 4.658 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1Cc1ccc(Br)cc1Br 2018114575 GDYLARCLVJXEGU-NOZJJQNGSA-N 425.990 4.959 50 10 IJGE O=C(c1cccc(OC(F)F)n1)N(Cc1ccccc1)C1(CBr)CCC1 2125351364 BAWGOYONTOZMHH-UHFFFAOYSA-N 425.273 4.643 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@H](CCl)C12CCC2 2133814563 ZJORKQFMCPVWBQ-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE C[C@]1(CBr)CC(F)(F)CN1C(=O)c1cc(Cl)ccc1Br 2159048327 DFIBBHOCRKODIE-GFCCVEGCSA-N 431.502 4.737 50 10 IJGE COCC(CCOc1c(CBr)ccc(Br)c1Cl)COC 2187435717 ZYTBSFJBLBQTIP-UHFFFAOYSA-N 430.564 4.675 50 10 IJGE CC(CBr)(CBr)NC(=O)c1cc(Cl)cc(C(F)(F)F)c1 2200837966 SHEAWLMIASSKCD-UHFFFAOYSA-N 437.481 4.637 50 10 IJGE C[C@@H](Cl)c1nc2cc(I)ccc2n1C[C@]1(Cl)CC1(F)F 2205572239 KRGDUHVTYOEVOI-JMCQJSRRSA-N 431.051 4.957 50 10 IJGE CN(CCCCCI)C1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2211185029 HABJSEDOPNPLRQ-YOFSQIOKSA-N 426.386 4.719 50 10 IJGE CN(CCCCCI)CCC1CCN(C(=O)OC(C)(C)C)CC1 2211185232 IPDPZLHJZLRVRJ-UHFFFAOYSA-N 438.394 4.561 50 10 IJGE CC[C@H](Br)[C@@H](CC)NC(=O)c1ccc(Cl)c(I)c1 2256386513 BZNZQMBUZDOVQX-JOYOIKCWSA-N 444.538 4.627 50 10 IJGE CCCN(c1c(CBr)c(C)nn1CC)C1CCN(Cc2ccccc2)CC1 2281304005 QIWBQWUTPWLCCR-UHFFFAOYSA-N 433.438 4.987 50 10 IJGE COc1ccc([C@H](Br)[C@@]23COC[C@H]2C3(F)F)c(Br)c1Cl 2283563633 ZNQNQFURMGQYDA-JFUSQASVSA-N 432.486 4.829 50 10 IJGE Clc1ccc(CN2CCC[C@H]2CCBr)cc1I 2300238380 KCMGYXYNBMDFEU-NSHDSACASA-N 428.539 4.694 50 10 IJGE COc1cccc(-c2nn(-c3ccccc3)cc2C=C(C#N)S(=O)(=O)c2ccccc2)c1 2314476855 WZACNXKIFOTQQA-UHFFFAOYSA-N 441.512 4.886 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCCc2ccccc2)ccc1OCc1ccccc1C 2314740044 SOHJKSLRYCWMCI-UHFFFAOYSA-N 426.516 4.849 50 10 IJGE CC[C@@H](NC(=O)C(C#N)=CNCCc1c[nH]c2ccccc12)c1ccc2c(c1)CCCC2 2325092693 OIIRPNJLLLWIGY-RUZDIDTESA-N 426.564 4.854 50 10 IJGE COc1cc(F)c(Br)cc1[C@@H](Cl)c1c(Br)nc(C)n1C 2362484177 YHSHROJKDLGMJV-LLVKDONJSA-N 426.511 4.729 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CC[C@H]2[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]32)C1 2371133523 NZYCJPFZSKPZJN-TVFCKZIOSA-N 441.454 4.765 50 10 IJGE CCn1cc(Br)c(COc2cc(F)c(CBr)c(Cl)c2)n1 2379786016 DKORKHCRTUHREV-UHFFFAOYSA-N 426.511 4.932 50 10 IJGE CNC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccc(OCCC(C)C)c(C)c1 1252790 BXWJETBMMHVCJX-QNGOZBTKSA-N 428.536 4.926 50 10 IJGE COc1cccc(CN(C(=O)CCl)[C@H](C(=O)NC2CCCCC2)c2ccc(F)cc2)c1 3037403 HCIUOMKZQDFDKQ-QHCPKHFHSA-N 446.950 4.592 50 10 IJGE O=C(NC1CCCC1)[C@H](c1ccc(Cl)cc1)N(Cc1cccs1)C(=O)CCl 3039461 HHACKPFXKXOFAP-IBGZPJMESA-N 425.381 4.769 50 10 IJGE C/C(=N\NC(=O)c1cccc(NC(=O)c2cccc(Cl)c2)c1)c1ccc([N+](=O)[O-])cc1 97729947 KNEZBECJLQWSDE-AFUMVMLFSA-N 436.855 4.655 50 10 IJGE N#C/C(C(=O)Cn1cnc2scc(-c3ccccc3)c2c1=O)=C1\Nc2ccccc2S1 103908373 BJENRNHTGZQZSA-QNGOZBTKSA-N 442.525 4.647 50 10 IJGE CC(C)Oc1cccc(/C=N\NC(=O)c2cccn(Cc3ccc(C(C)(C)C)cc3)c2=O)c1 169921149 DWMZRMHDHDNBBX-QRQIAZFYSA-N 445.563 4.745 50 10 IJGE N#C/C(=C/NCc1ccccc1Br)C(=O)Nc1cc(Cl)ccc1Cl 217136256 RIKGCXJQVKODIM-BENRWUELSA-N 425.113 4.892 50 10 IJGE CO[C@@H]1CCC[C@H](O[C@H](CI)c2ccccc2Br)C1 253136594 SMCBBEKNHLOQGJ-TYNCELHUSA-N 439.131 4.899 50 10 IJGE Cc1ccc(COc2ccc(C=NNC(=O)CSCc3ccc([N+](=O)[O-])cc3)cc2)cc1 254319770 OOMOTMBLWGKZFO-UHFFFAOYSA-N 449.532 4.866 50 10 IJGE COc1cc(C=NNC(=O)c2cc3ccccc3cc2O)ccc1OC(=O)c1cccs1 254790696 IRUMVOJBGYQWIT-UHFFFAOYSA-N 446.484 4.599 50 10 IJGE O=C(CNc1cccc2ccccc12)NN=Cc1cccc(OC(=O)/C=C\c2ccco2)c1 263629782 HPNFVZTULBCABC-GJSLQDSPSA-N 439.471 4.614 50 10 IJGE Cc1cc([C@H](Br)c2cnn(C)c2I)c(Cl)cc1F 379225267 WGHQOWBQABFKIQ-NSHDSACASA-N 443.485 4.610 50 10 IJGE Cc1cc(SC(F)(F)F)c(I)cc1C(=O)CBr 575709382 OZHFFNBJAASXJU-UHFFFAOYSA-N 439.034 4.789 50 10 IJGE C[C@@H]1CN(C(=O)c2scc(Br)c2Br)CC[C@H]1Br 707799490 DYOIJNMASKCYPW-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE Cc1nn(C)c(N2CCC3(CCN(Cc4ccccc4)CC3)CC2)c1CBr 709290362 MQVVQMCYALQQGV-UHFFFAOYSA-N 431.422 4.506 50 10 IJGE Cc1ccccc1-n1c(C)cc(C=NNC(=O)CSCc2ccc([N+](=O)[O-])cc2)c1C 1083891074 JCTQTTBZWOPAQJ-UHFFFAOYSA-N 436.537 4.694 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)Nc2ccccc2CC)cc(Br)c1OC 1084450979 YIXXVJDJCHLILN-YBEGLDIGSA-N 429.314 4.964 50 10 IJGE O=[N+]([O-])c1ccc(-n2nc(-c3ccc(Br)cc3)cc2CCl)c([N+](=O)[O-])c1 1614817073 SVXBFENSMFUMET-UHFFFAOYSA-N 437.637 4.857 50 10 IJGE C=CC(=O)N1CCC(C(=O)NNc2ccccc2Oc2ccccc2)(c2ccccc2)CC1 1628598689 CTMHRSPIAKQOAY-UHFFFAOYSA-N 441.531 4.668 50 10 IJGE CCOc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3CC)ccc1OCc1ccccc1 1865693823 MAHJTCWEPDTCIB-HSZRJFAPSA-N 444.535 4.661 50 10 IJGE CCCOc1ccc(/C=N\NC(=O)c2ccc(-c3ccccc3OC)nc2C)cc1OC 1865762605 RLRJPSAGDSJAJO-QQXSKIMKSA-N 433.508 4.627 50 10 IJGE Brc1cccnc1C[C@@H](Br)c1cnsc1Br 1900466137 BNCNOEILNWLWSN-MRVPVSSYSA-N 426.959 4.742 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cc(Cl)cc(Cl)c1O 1916383895 RFSICFUNHVRETC-CYBMUJFWSA-N 447.156 4.751 50 10 IJGE CC[C@@H](Br)CN(CC)C(=O)c1cc(Br)c(Br)s1 1999377511 KULKCUOVJPYXKC-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE Clc1cc(Br)cnc1CNCCCCCCI 2012043724 JVBVIZAVACLESC-UHFFFAOYSA-N 431.543 4.583 50 10 IJGE CCC[C@@](C)(CCl)NC(=O)c1cc(I)ccc1Br 2029944268 HVCMBNDSBSKUPP-ZDUSSCGKSA-N 444.538 4.581 50 10 IJGE CC(C)[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]1C(F)(F)F 2052478963 MHVPIROERSSLMB-BFHYXJOUSA-N 431.337 4.526 50 10 IJGE C[C@@H](Br)[C@H](NC(=O)c1cc(Br)c(Cl)s1)C(F)(F)F 2074719966 KDXCLAURBWOSEI-CVYQJGLWSA-N 429.483 4.608 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)C1(C(F)(F)F)CCOCC1 2116579757 KPAWAOOLTWAOSF-INIZCTEOSA-N 436.312 4.794 50 10 IJGE CC(C)CN(Cc1ccccc1)S(=O)(=O)c1ccc(OCCCBr)cc1 2123247196 PTLDTPXPPZOVAH-UHFFFAOYSA-N 440.403 4.697 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@@](C)(CBr)C(F)(F)F)cc1Cl 2161365340 MEIQEOFKHNAXHC-NSHDSACASA-N 437.481 4.857 50 10 IJGE COCC1(COC)C[C@@H](c2c(Br)cccc2Br)[C@H](Cl)C1 2190817580 QEGTUCLFWNXXHF-ZWNOBZJWSA-N 426.576 4.976 50 10 IJGE C[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)N(CCCCCI)[C@@H]1C 2211188872 GYEYMQOFFXKQEW-BZUAXINKSA-N 438.394 4.605 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OCC[C@@H]1CCCC12CC2 2243323043 UCCZZDADUKEHBT-WMLDXEAASA-N 437.362 4.692 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CN(CCCCI)CC2 2243585674 FFLAHAPGQSJLGE-UHFFFAOYSA-N 430.330 4.607 50 10 IJGE CN(C(=O)c1scc(Br)c1Cl)[C@H](CCBr)C(F)F 2253552590 RUXFOYUHXPHDBM-ZCFIWIBFSA-N 425.520 4.655 50 10 IJGE C=CCc1cc(C=C(C#N)C(=O)N(C)C)ccc1OCc1ccc(Br)cc1 2313566990 AHRHPGNXHSHBJJ-UHFFFAOYSA-N 425.326 4.752 50 10 IJGE CCOc1cccc(-c2nn(-c3ccccc3)cc2C=C(C#N)C(=O)NCc2ccco2)c1 2314476688 UAYIKRWXNMTGMT-UHFFFAOYSA-N 438.487 4.754 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)CSc2ccc(Cl)cc2)cc1 2314789654 SNDXREKNZMHJCH-UHFFFAOYSA-N 428.941 4.861 50 10 IJGE COCc1ccc(COC2(CBr)CCN(C(=O)OC(C)(C)C)CC2)s1 2319542096 QIAPSRQOARVANM-UHFFFAOYSA-N 434.396 4.576 50 10 IJGE Clc1cc(CN2C[C@H]3CC[C@H]2[C@H](Br)C3)ccc1I 2325451919 WYRFVPJNLMEVBQ-PXWWUCIGSA-N 440.550 4.692 50 10 IJGE Clc1cc(Br)c(CN2C[C@@H](CBr)OC3(CCC3)C2)s1 2345950688 VEDXWFQJILVGOE-SECBINFHSA-N 429.605 4.682 50 10 IJGE Cn1nc(C(F)(F)F)c(CBr)c1N1CC[C@@]1(C)CCOCc1ccccc1 2365253570 UKEREBPKQQJKGC-SFHVURJKSA-N 446.311 4.910 50 10 IJGE CCCn1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N[C@@H](C)c2cc3ccccc3o2)c1C 24001706 BWTXOSHWYVTJEP-WVWFITSPSA-N 447.535 4.977 50 10 IJGE Cc1cccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2Cl)c1 38651023 UKPGPLRGWJHYMI-XMMPIXPASA-N 446.890 4.851 50 10 IJGE Cc1cc(Cl)ccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccncc1)CCC2 40813972 IXWLIAKZMUMPOM-OVVQPSECSA-N 436.899 4.668 50 10 IJGE CCOC(=O)N/N=C1\CCCc2oc(C(=O)Oc3ccc(Cl)cc3Cl)c(C)c21 40825638 RRYYDBCCXQMNIH-LPYMAVHISA-N 425.268 4.901 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2cccnc2)C(=O)/C1=C/c1ccc(-c2ccccc2Cl)o1 101336552 XMIMIUAJJDBLJL-YBFXNURJSA-N 429.863 4.787 50 10 IJGE CCCCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C(/C#N)C(=O)OCC)cc2OC)cc1 206271418 BRECDANOPXUCHT-CFRAVMCGSA-N 449.503 4.963 50 10 IJGE N#C/C(=C/NCc1cccc(Br)c1)C(=O)Nc1cc(Cl)ccc1Cl 217136313 DTDCGGLKKFCTOW-BENRWUELSA-N 425.113 4.892 50 10 IJGE CCOC(=O)c1cc(I)c(CBr)c2ccsc12 725276357 CPSAXMNJYZJZFE-UHFFFAOYSA-N 425.085 4.578 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NCCCc2ccc(Cl)cc2)c(-c2ccccc2)n1 749624926 GOLCULIORDKHSZ-LTGZKZEYSA-N 443.938 4.773 50 10 IJGE CS(=O)(=O)c1cccc(NNC(=O)/C(=C/c2ccc(Cl)cc2)c2ccc(F)cc2)c1 776720634 GGYBDLLSDQEPDE-FYJGNVAPSA-N 444.915 4.567 50 10 IJGE CCN(CC)c1c(C=NNC(=O)C23CC4CC(CC(C4)C2)C3)c(C)nn1-c1ccccc1 1084075155 IVNZKOIYQLEFBA-UHFFFAOYSA-N 433.600 4.693 50 10 IJGE N#Cc1ccc(COc2ccccc2C=NNC(=O)c2ccccc2Br)cc1 1084393593 GAWFEKNDYDBYDO-UHFFFAOYSA-N 434.293 4.664 50 10 IJGE CCc1cc(C)cc(OCC(=O)NN=Cc2cccn2-c2ccc(Br)cc2)c1 1084540876 SKMNWRHAVDECSS-UHFFFAOYSA-N 440.341 4.640 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2cc(C)n(-c3ccc(C)cc3)c2C)cc1 1084570514 LEMOTRREOXZAOB-RUZDIDTESA-N 433.552 4.765 50 10 IJGE CC(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(Cl)cc3)nc3ccccc23)cc1 1141361631 UFVSSVIMNFJNDM-UHFFFAOYSA-N 443.890 4.833 50 10 IJGE C/C(=C/c1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(Br)cc1Cl 1359901179 ZBCVCBGUQRFOHB-YFHOEESVSA-N 428.113 4.620 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)Nc3cc4c(nc3O)CCCC4)c2C)cc1 1527719306 ZKTTUJPGYTXDDX-DEDYPNTBSA-N 442.519 4.628 50 10 IJGE C/C(=C\c1cccnc1)C(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12 1540614000 QWTFWOGZYJXNHD-DTQAZKPQSA-N 442.906 4.815 50 10 IJGE Cc1c(C(=O)N2CCCC[C@@H]2C)oc2c1C(=NNC(=O)c1cccc(Cl)c1)CCC2 1772746488 WHQWYEAZIVNKGO-AWEZNQCLSA-N 427.932 4.726 50 10 IJGE Cc1ccc(O)c([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2Cl)c1 1865687629 WGPUZLZBPUTIME-MRXNPFEDSA-N 446.816 4.777 50 10 IJGE Cc1ccc(C)c(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2cccc(F)c2)c1 1865711136 QKPFPUYERAEBPH-GOSISDBHSA-N 442.416 4.924 50 10 IJGE COc1ccc(C(=O)N(CCCBr)Cc2ccccc2)cc1Br 1914643109 JXZXNGZKIJKAMV-UHFFFAOYSA-N 441.163 4.885 50 10 IJGE O=C(NC[C@H]1CCCN(CC2(CBr)CCCCC2)C1)OCc1ccccc1 1999498458 YRWSLZZKBCLFNR-HXUWFJFHSA-N 437.422 4.970 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](C[S@@](C)(=O)=NCC1(CBr)CCC1)C(C)(C)C 2044706531 VBYJQPOLEXXBBJ-HWRSSNJWSA-N 439.460 4.589 50 10 IJGE Clc1ccc(I)c(CN2[C@H](CBr)[C@H]3CC[C@@H]2C3)c1 2058369218 XNHHFPULAGYWGZ-MRCXROJRSA-N 440.550 4.692 50 10 IJGE C[C@]1(NC(=O)c2ccc(Br)cc2Br)CCC[C@@H]1Br 2062573157 HBZITGVMWNJSEC-AAEUAGOBSA-N 439.973 4.648 50 10 IJGE C[C@H](CCBr)CCN1CCCC[C@@H]1C(F)(F)CNC(=O)OC(C)(C)C 2065451877 DSWSWUCTXXUITD-HUUCEWRRSA-N 427.374 4.812 50 10 IJGE CC(C)c1cc(CBr)n(Cc2c(F)cccc2I)n1 2070164920 IIUCTVGJFNNDCT-UHFFFAOYSA-N 437.094 4.693 50 10 IJGE C[C@@H]1CCc2c1c(CBr)nn2-c1cc(C(F)(F)F)cc(Br)n1 2080672391 HEFSSBAOZHASNX-SSDOTTSWSA-N 439.073 4.993 50 10 IJGE Fc1ccc(I)cc1[C@@H](Br)c1ncn2ccsc12 2083983972 GTFINLHXIAPGFX-SNVBAGLBSA-N 437.075 4.624 50 10 IJGE C[C@@H]1C[C@H](O[C@@H](CI)c2ccccc2Br)CCO1 2084725645 QIDPVNKCVUHXBJ-GYSYKLTISA-N 425.104 4.509 50 10 IJGE CCC[C@@H]1CN(c2ncc(Br)cc2Br)C[C@H]1CBr 2084887512 BYNJJTKUIMJOCD-NXEZZACHSA-N 441.005 4.854 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C(F)(F)F)N(C[C@H](CBr)C(C)(C)C)CC1 2106783801 CRWJKJYFUVDHNI-KBPBESRZSA-N 445.364 4.917 50 10 IJGE C[C@@H](c1cnn(Cc2ccccc2)c1)n1c(CCCl)nc2cncc(Br)c21 2151779983 YTKXAJYIMJVXFZ-AWEZNQCLSA-N 444.764 4.829 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@]2(CN(CCCCCCCCCBr)CCO2)C1 2163059557 UNRDVSQTKOAHLZ-OAQYLSRUSA-N 447.458 4.824 50 10 IJGE Oc1nc2ccc([C@H](Br)c3cc(I)ccc3F)cc2o1 2169669034 WXELLNKWSFUHID-ZDUSSCGKSA-N 448.029 4.761 50 10 IJGE COCC12CC([C@H](Br)c3cc(Cl)c(Br)cc3F)(CO1)C2 2206084516 UPXNDEKWMINHJI-IYXRBSQSSA-N 428.523 4.873 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1c(F)cccc1F 2220335316 LXVFDZZDDMCANU-KRWDZBQOSA-N 432.330 4.575 50 10 IJGE FC(F)(F)OCCn1c(CCl)nc2cc(Br)c(Br)cc21 2234074684 UUXMYPLLRBREOW-UHFFFAOYSA-N 436.453 4.837 50 10 IJGE CO[C@@H]1CC([C@H](Br)Cc2ccc(Br)cc2Cl)C[C@H]1OC 2237443315 INZPGAIWBBCWQU-BPLDGKMQSA-N 426.576 4.849 50 10 IJGE C[C@H](CCBr)CCNCc1ccc(Cl)c(I)c1 2300239368 XFUPSJAOXMGFRC-SNVBAGLBSA-N 430.555 4.845 50 10 IJGE CCC[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]1C(F)(F)F 2309540126 MWBKKEBTPIRXSC-IHRRRGAJSA-N 431.337 4.670 50 10 IJGE CCCOc1ccc(C=C(C#N)C(=O)Nc2ccc(I)cc2)cc1 2314722495 DPVOSTIEOUYWGB-UHFFFAOYSA-N 432.261 4.626 50 10 IJGE C[C@H](c1ccccn1)[C@H](Br)c1c(Br)c(Br)nn1C 2316718522 USXNRZFXXBFURM-APPZFPTMSA-N 437.961 4.580 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2N)ccc1OCc1ccc(Cl)cc1Cl 2323202957 DEICKPVLJMWGQD-UHFFFAOYSA-N 444.318 4.927 50 10 IJGE N#C/C(=C/c1cn(CCOc2ccc(F)cc2)c2ccccc12)C(=O)NCc1ccco1 33932564 OJBKIWIGUUNOBS-JXAWBTAJSA-N 429.451 4.676 50 10 IJGE CCOc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)Cc1ccccc1)CCC2 40815671 MATZQSRSZAQHHN-VFCFBJKWSA-N 445.519 4.638 50 10 IJGE CCOc1cc(/C=N\NC(=O)CC[C@H](O)c2ccccc2)ccc1OCc1ccc(C)cc1 58890317 XQBKWZXHBTXYRW-LKSMXUKOSA-N 446.547 4.937 50 10 IJGE COC(=O)c1cc(C(C)C)sc1NC(=O)/C(C#N)=C\c1c[nH]nc1-c1ccc(F)cc1 96438441 QHWHGCJVWISHHN-ZSOIEALJSA-N 438.484 4.733 50 10 IJGE C=CCOc1ccc(/C=C2/C(=O)N([C@H](C)c3ccccc3)C(=O)C(C#N)=C2C)cc1OC 101305602 CMTAYPOMKLLXSE-ALDSOSFCSA-N 428.488 4.613 50 10 IJGE Fc1ccc(C(CBr)(CBr)Cc2cn3ccsc3n2)cc1 149647320 HVMPCPGXKVZOIU-UHFFFAOYSA-N 432.156 4.805 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)N/C=C(/C#N)C(=O)Nc1ccc(Br)cc1 216779516 WAZUHJNWNWSORX-NWCRWOLESA-N 428.330 4.853 50 10 IJGE CCCOc1ccc(C(=O)NCC(=O)NN=Cc2c3ccccc3cc3ccccc23)cc1 254573238 MXHHUGZOGOWEQW-UHFFFAOYSA-N 439.515 4.662 50 10 IJGE CC(=O)O[C@@]1(C(C)=O)CC[C@@H]2[C@H]3CCC4=CC(=O)CC[C@]4(C)[C@]3(Cl)[C@H](Cl)C[C@]21C 263627068 LULGNBXHOOJRRU-CARAORCDSA-N 441.395 4.988 50 10 IJGE CN(c1ncc(Br)cc1Br)[C@@H](CBr)C(C)(C)C 689210449 WAYHSKRVMLBYOK-JTQLQIEISA-N 428.994 4.852 50 10 IJGE CC(C)(C)CN(CCBr)S(=O)(=O)c1c(Cl)cccc1Br 690942063 FEJCVDRWPICCRM-UHFFFAOYSA-N 447.620 4.534 50 10 IJGE C[C@H]1CCN(C(=O)c2scc(Br)c2Br)C[C@@H]1Br 707788375 AAZLJULOQJWXAV-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cccc(-c3nc[nH]n3)c2)c(C)n1-c1ccc(F)cc1 733979740 DVQOOKQIYLJGGV-ODLFYWEKSA-N 426.455 4.564 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OCc2cccc(C#N)c2)c(-c2ccc(Cl)cc2)n1 782091221 DFQNRXKIOUWMCH-NDENLUEZSA-N 441.878 4.639 50 10 IJGE CCCOc1ccc(C=NNC(=O)COc2ccccc2Br)c(OCCC)c1 1084543597 PJMMOOWPARWALB-UHFFFAOYSA-N 449.345 4.556 50 10 IJGE CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N1CCC[C@H](O[Si](C)(C)C(C)(C)C)C1 1275312957 BZBRXLNCZNYHAP-UNMCSNQZSA-N 430.665 4.535 50 10 IJGE CC(C)c1ccc(-c2noc(CCC(=O)NNc3nc4ccccc4[nH]c3=S)n2)cc1 1470319852 QZDCLCAOCMSFEM-UHFFFAOYSA-N 434.525 4.542 50 10 IJGE CC(=O)N1CCCc2cc(NC(=O)NNc3ccc(Cl)cc3Br)ccc21 1562306018 SVEJIFPVHJIVBT-UHFFFAOYSA-N 437.725 4.550 50 10 IJGE C=C(C)C[C@H](CO)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1633175919 VNQYSPCVQATLMK-IISPMBILSA-N 432.351 4.751 50 10 IJGE COc1cc(C=NNC(=O)COc2cccc(Cl)c2)ccc1OCc1ccc(C)cc1 1772754686 PNPDYMYCLIZNFI-UHFFFAOYSA-N 438.911 4.765 50 10 IJGE C[C@H]1CN(Cc2c(Br)cccc2Br)C[C@H]1CBr 1945321887 JFELGMGYBNZCBT-VHSXEESVSA-N 425.990 4.674 50 10 IJGE Fc1cc(F)c([C@H](Br)c2cc(I)sn2)cc1F 2007644640 MRCBRRDWNBNBOG-JTQLQIEISA-N 434.018 4.649 50 10 IJGE C[C@H](Br)[C@H]1CCCN1Cc1cc(Br)ccc1Br 2018104516 HYDKIZVOCKAIQU-TVQRCGJNSA-N 425.990 4.959 50 10 IJGE CN(C[C@H]1C[C@H]1Br)c1cc(Br)cc(F)c1CBr 2020222919 FMWYMEJIVKHTTO-GMSGAONNSA-N 429.953 4.703 50 10 IJGE Clc1ccc(I)c(CN2C[C@H](CBr)C3(CC3)C2)c1 2027536175 NXUMZPWGIGFUFB-NSHDSACASA-N 440.550 4.552 50 10 IJGE O=C(NC1CC(CCBr)C1)c1cccc(Br)c1Br 2031481571 IOUWFOFCIRKJOL-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE CC(C)N(CCCBr)C(=O)c1c(Br)cccc1Br 2033092573 BVMCVNMTAPKBPC-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE Brc1ccc(C[C@@H]2CN(C3CC3)C[C@@H]2Br)c(Br)c1 2039252815 ZJIXQQHZXDATEV-YGRLFVJLSA-N 438.001 4.612 50 10 IJGE CCC[C@@H](CBr)CNC(=O)c1ccc(Br)cc1Br 2057121219 YSGBSDBDAHNTET-VIFPVBQESA-N 441.989 4.753 50 10 IJGE COc1ccc(C)c(-n2nc(CCl)c(I)c2C(F)(F)F)c1 2079208391 QMYGKCOKRBZCKH-UHFFFAOYSA-N 430.595 4.552 50 10 IJGE Cc1c(Br)ccc([C@@H](Br)C2COCCOC2)c1Br 2083316880 AJQHPMFHWFROKL-ZDUSSCGKSA-N 442.973 4.619 50 10 IJGE C[C@H]1C[C@H](CBr)CCN1Cc1ccc(I)c(Cl)c1 2086655556 OPRDITZKLDGTGO-WDEREUQCSA-N 442.566 4.940 50 10 IJGE CC1(C)[C@@H](CBr)CCN1Cc1ccc(I)c(Cl)c1 2086661958 QMKSDLHVJVUVKJ-LLVKDONJSA-N 442.566 4.940 50 10 IJGE CN(C(=O)[C@H](Br)C1CCCC1)C1(CNC(=O)OC(C)(C)C)CCCCC1 2110716903 BSGPRNWEAYAIHO-MRXNPFEDSA-N 431.415 4.626 50 10 IJGE O=C(c1csc(Br)c1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Cl)C2 2134140187 YCWUMMOYDFDWFY-RXHUMLQZSA-N 431.552 4.596 50 10 IJGE Cc1c(Cl)cc(CN2CCOC[C@](C)(CBr)C2)cc1Br 2199837760 IZBNCQKZKDIPJO-OAHLLOKOSA-N 425.592 4.644 50 10 IJGE CS[C@H]1COC[C@@H]1n1c(CCl)nc2cc(Br)c(Br)cc21 2234076127 UWLRJUNIPSAQHZ-RYUDHWBXSA-N 440.588 4.603 50 10 IJGE CC1(C)C[C@@]1(Cl)Cn1c(CCl)nc2cc(I)c(F)cc21 2237920395 BIKYRWFMRADXJY-CQSZACIVSA-N 427.088 4.926 50 10 IJGE CCN[C@H](Cc1cc(Br)cc(Br)c1)[C@H]1C[C@@H](Br)C1 2263511606 SQANLMRKDWJQGL-DDTOSNHZSA-N 440.017 4.906 50 10 IJGE CC(C=NNC(=O)CCCCC(=O)NN=CC(C)=Cc1ccccc1)=Cc1ccccc1 2295431804 RTQBUBOGZYYOFB-UHFFFAOYSA-N 430.552 4.958 50 10 IJGE Clc1ccc(C[C@@]2(CBr)CC=CCO2)c(I)c1 2302328922 NPLJZNVOAFRLDU-CYBMUJFWSA-N 427.507 4.597 50 10 IJGE COc1cc(C(=O)N[C@@H](CCBr)COCc2ccccc2)sc1Cl 2303542319 BZQBGSPEWZYKJY-ZDUSSCGKSA-N 432.767 4.510 50 10 IJGE C[C@H](Cl)C[C@@H](C)CNCc1ccc(I)c(Br)c1 2306219781 PZVIWGDNIWSFBA-ZJUUUORDSA-N 430.555 4.797 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@H](CN(CC3(CBr)CC(F)C3)C1)C2 2334055186 LFXUQTIYFCYIJY-WUPNUQLISA-N 433.406 4.517 50 10 IJGE FC(F)(CBr)C(F)(F)CNCc1ccc(Br)cc1Cl 2336531467 JHFDSCIGWUUQNY-UHFFFAOYSA-N 427.461 4.858 50 10 IJGE CC(C)N(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2351887530 AIAMEXUODOVFAZ-CRAIPNDOSA-N 439.385 4.907 50 10 IJGE CC(C)[C@H](Br)C(C)(C)NS(=O)(=O)c1ccc(Br)cc1Cl 2366100574 QVZWEPRDCGAWHF-LBPRGKRZSA-N 447.620 4.579 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)[C@@](C)(C(=O)O)c1ccc(OCc2ccccc2)cc1 2374415562 QFWDSVSJZLUCQY-SFGWALBWSA-N 432.358 4.671 50 10 IJGE O=C(N/N=C/c1cc(Br)ccc1O)[C@H]1CC1(c1ccccc1)c1ccccc1 3028431 UQDSXJMZNZPXMS-PXMCARDJSA-N 435.321 4.611 50 10 IJGE CCC[C@H](C)c1ccc(OCC(=O)N/N=C/c2cc(Br)ccc2OC)cc1 20581786 ORSCHMGSQRPVKW-LUILSVGHSA-N 433.346 4.890 50 10 IJGE O=C(Cc1ccc(Cl)cc1)N/N=C/c1ccc(OC(=O)c2ccc(Cl)cc2)cc1 48573481 ZTIDTWVGZRADLX-AFUMVMLFSA-N 427.287 4.905 50 10 IJGE CCSc1ccc(Cl)cc1CC(=O)N/N=C\c1ccc(OC)c(OC)c1Cl 169922443 WKLJWBWUWHEXOF-JJFYIABZSA-N 427.353 4.815 50 10 IJGE CCOCCCN(C(=O)CCl)[C@H](C(=O)N[C@@H]1CCCC[C@H]1C)c1ccccc1Cl 252587621 ZMXUFBUKLSDQGJ-BSIFCXSSSA-N 443.415 4.570 50 10 IJGE O=C(Cc1cccs1)NN=C1C(=O)N(Cc2cccc3ccccc23)c2ccccc21 254614528 LKOSXKBVTOVOOV-UHFFFAOYSA-N 425.513 4.511 50 10 IJGE CC(C)(C)[C@@H](Br)CNC(=O)c1cc(Br)c(Br)s1 324636780 VXLLPAHNNVNXLI-QMMMGPOBSA-N 448.018 4.813 50 10 IJGE C[C@@H](CO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1)C1CCC1 398340418 CYBJLGOSXPASNF-KSSFIOAISA-N 437.362 4.644 50 10 IJGE BrCc1c(N2CC[C@@H]3[C@H](CCCN3Cc3ccccc3)C2)nc2sccn12 715014999 MYSHJBWHNYNPAQ-QZTJIDSGSA-N 445.430 4.782 50 10 IJGE CN(Cc1ccccc1)[C@@H](Cn1c(CCCl)nc2cc(Br)cnc21)C1CC1 717993785 DEHRLYKQXHEOQT-IBGZPJMESA-N 447.808 4.886 50 10 IJGE CC(=NNC(=O)CN1CCCCC1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(F)cc1)N2 1084020184 BUSIQTJPOUYRFY-KHVXQDHOSA-N 446.570 4.978 50 10 IJGE C/C(=C\C(=O)NNc1ccccc1I)c1cccc(C(F)(F)F)c1 1636930585 WQACZUAUXMBWKJ-PKNBQFBNSA-N 446.210 4.857 50 10 IJGE Cc1cc(Nc2ccc3c(c2)CCCC3)c(C(=O)NC[C@]2(C)C[C@H]2Br)c(O)n1 1642130279 WEDPSADJCTUCHN-GCJKJVERSA-N 444.373 4.621 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@@H]1CCCN(Cc2nc(O)c3cnn(-c4ccccc4)c3n2)C1 1654678574 JQYVRQIECIAZNK-GOSISDBHSA-N 439.636 4.507 50 10 IJGE CCOc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2F)CCC3)cc1 1772743515 ASHYKSBMZNVLCP-UHFFFAOYSA-N 449.482 4.849 50 10 IJGE CCc1nn(Cc2ccccc2F)c2c1[C@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865700656 AKNZARGKSCLKGQ-HSZRJFAPSA-N 445.542 4.697 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2)[C@@H]1c1cccc([N+](=O)[O-])c1 1865706036 MFQZIIZCAQBDAE-JOCHJYFZSA-N 449.470 4.725 50 10 IJGE CCCC[C@H](NC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(SC#N)cc1 1866823340 UVKZZTNQDIGRGA-IBGZPJMESA-N 434.521 4.842 50 10 IJGE O=C1/C(=C/c2ccccc2Br)Oc2cc(OC(=O)C(Cl)Cl)ccc21 1871385205 GWIJEDZBYQSTFQ-AUWJEWJLSA-N 428.065 4.774 50 10 IJGE C[C@H](CC(=O)NCC1CC(Br)C1)c1ccc(NC(=O)OC(C)(C)C)cc1 1887793008 GFWSISWEUYWEGR-VQCLRJIVSA-N 425.367 4.817 50 10 IJGE CO[C@@H]1C[C@]2([C@@H](Br)c3sc(Cl)cc3I)C[C@@H]12 1900924528 MSVJMGTXPBZUKF-IBESJACDSA-N 433.536 4.867 50 10 IJGE CN(CC[C@H]1CCCCN1CC(C)(C)CI)C(=O)OC(C)(C)C 1904650585 HVZAAQPPGMMHIV-OAHLLOKOSA-N 438.394 4.559 50 10 IJGE C[C@@H](CCCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)cc1Br 1915080281 AJKZYYXZLOXJHV-ZDUSSCGKSA-N 434.758 4.797 50 10 IJGE CN(Cc1cccc(Br)c1Br)[C@H]1CCC[C@@H]1Br 1943885498 WISIFWFQYGDRDI-JQWIXIFHSA-N 425.990 4.959 50 10 IJGE O=C(N[C@H](CBr)CC1CC1)c1csc(Br)c1Br 1945189175 KPYXYCCFFNLETH-ZETCQYMHSA-N 446.002 4.567 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCN(C[C@@H](CBr)C3CCC3)CC2)CC1 1966327598 YGQXVICPAUSBQB-GOSISDBHSA-N 429.443 4.911 50 10 IJGE CCN(C[C@@](C)(CI)O[C@@H]1CCC2CC1C2)C(=O)OC(C)(C)C 1992237254 GECLQWOQRQVTTH-PPPKJHQXSA-N 437.362 4.642 50 10 IJGE Clc1cc(CC2(CBr)CCOCC2)ccc1I 2026570436 RHLVZCDQEXIYDE-UHFFFAOYSA-N 429.523 4.679 50 10 IJGE C[C@](CBr)(NC(=O)c1cc(Br)cc(Br)c1)C1CC1 2029956290 FUXQCLBAUGBHHB-CYBMUJFWSA-N 439.973 4.505 50 10 IJGE CC[C@@H](Br)CN(CC)C(=O)c1cc(Br)ccc1Br 2044551849 YCAWHDOOKKBALF-SECBINFHSA-N 441.989 4.847 50 10 IJGE Cc1nn(C)c(Br)c1[C@H](Br)Cc1cccc(Br)c1 2065885369 CWCGGJZSHYTVTA-LLVKDONJSA-N 436.973 4.932 50 10 IJGE Cc1nn(C)c(Br)c1[C@@H](Br)Cc1ccc(Br)cc1 2065888125 VFUTVTVAMYLBLT-NSHDSACASA-N 436.973 4.932 50 10 IJGE ClCCc1nc2c(Br)cccc2n1[C@]12C[C@@H]1CN(Cc1ccccc1)C2 2099679096 NWLYRYGHJIWQFA-IERDGZPVSA-N 430.777 4.811 50 10 IJGE CCC[C@H](CBr)CN1CC[C@H](C(F)(F)F)[C@@H](CNC(=O)OC(C)(C)C)C1 2106787493 ZHXDUCPPUTVMSM-ILXRZTDVSA-N 445.364 4.823 50 10 IJGE C[C@@H](CCCN(C)C(=O)OC(C)(C)C)N(C)C(=O)c1ccc(CBr)cc1 2111836574 ZWZVYYNASBVMGF-HNNXBMFYSA-N 427.383 4.689 50 10 IJGE Cc1cc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)ncc1CBr 2130159998 QISHBHOHIFTTIO-QGZVFWFLSA-N 428.296 4.538 50 10 IJGE O=[N+]([O-])c1cc(N2CCN(Cc3ccccc3)C3(CCC3)C2)ccc1CBr 2188577332 NLOUYJUFAQHSSI-UHFFFAOYSA-N 430.346 4.735 50 10 IJGE CCC1(CN(C)S(=O)(=O)c2cc(CBr)sc2Br)CCC1 2189670343 RFOGAJBAGFXFAY-UHFFFAOYSA-N 445.242 4.606 50 10 IJGE F[C@]12CCC[C@]1(CCl)CN(Cc1ccc(I)c(Cl)c1)C2 2208029214 JNRMQNWHSFOWQA-GJZGRUSLSA-N 428.116 4.878 50 10 IJGE C[C@@]1([C@@H](Br)Cc2cc(Br)cc(Br)c2)CCOC1 2252836363 BFGVVBKGUJIPKP-QWHCGFSZSA-N 426.974 4.944 50 10 IJGE CC1CC(CBr)(CN2CCC[C@H](c3n[nH]cc3NC(=O)OC(C)(C)C)C2)C1 2280052538 SVNOKTOFGQSCOK-CHWWFWEZSA-N 441.414 4.747 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1cc(Br)c(F)cc1C 2285968494 CUJTVRJYGXGXKR-JTQLQIEISA-N 427.177 4.533 50 10 IJGE C[C@@H](Br)CN(CCC(C)(C)C)Cc1nn(C)c(Cl)c1Br 2288152993 CQGKLPMQQHKFNS-SNVBAGLBSA-N 429.628 4.858 50 10 IJGE CCCCCN1C(=O)C(=NNC(=O)C=Cc2ccccc2)c2cc(Br)ccc21 2314717545 ZAEUFQOQIMEYCH-UHFFFAOYSA-N 440.341 4.520 50 10 IJGE C[C@H](Cl)CN(c1ncc(I)cc1Br)C1CCCC1 2320057824 HRHJVTDBOMSVCS-VIFPVBQESA-N 443.554 4.825 50 10 IJGE COc1ccc(OC[C@H](CBr)CC(C)C)cc1I 2328535988 GEPHBZFHOBHWTI-NSHDSACASA-N 427.120 4.736 50 10 IJGE CCC[C@@H](CBr)CN1CC[C@H](C(F)(F)F)C[C@@H]1CNC(=O)OC(C)(C)C 2329543206 XNSHMICMHMUASF-SOUVJXGZSA-N 445.364 4.965 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1Br 33930106 RQBOWWFYDSQKPS-WDZFZDKYSA-N 436.649 4.565 50 10 IJGE Cc1ccc(Sc2ncnc(NNC(=O)c3cccc4ccccc34)c2[N+](=O)[O-])cc1 40650315 UEZCGEQLXPPNSU-UHFFFAOYSA-N 431.477 4.755 50 10 IJGE CC1=C(C#N)C(=O)N(C[C@H]2CCCO2)C(=O)/C1=C/Nc1ccc(/N=N/c2ccccc2)cc1 101233669 AANCYKFPSMORQE-KGKVRMSYSA-N 441.491 4.786 50 10 IJGE O=C(NC1CCC(Br)CC1)c1ccc(Br)cc1Br 232462091 LHUGZLJNGPEULK-UHFFFAOYSA-N 439.973 4.648 50 10 IJGE Cc1cc(C=NNC(=O)C(=O)Nc2ccc(C(C)C)cc2)c(C)n1-c1ccccc1Cl 252602751 FKVRFUBYFXCWGB-UHFFFAOYSA-N 436.943 4.960 50 10 IJGE CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)NN=Cc1cccc(Oc2ccccc2)c1 252618579 LHTDVZYQGDZNQS-CYFREDJKSA-N 429.520 4.774 50 10 IJGE O=S(=O)(Nc1cc(Br)ccc1Br)c1cccc(CCl)c1 312616698 XMPBLDFSDMXOPF-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE Cc1cc(C)c(C)c([C@@H](Br)c2cnn(C)c2I)c1C 394370122 WVMBKPSHCBMBRF-AWEZNQCLSA-N 433.131 4.743 50 10 IJGE N#CSc1ccc(NC(=O)Nc2cccc(C(=O)Nc3ccc(CC(=O)O)cc3)c2)cc1 586733321 ZBWNZWOOQXROKE-UHFFFAOYSA-N 446.488 4.783 50 10 IJGE CC[C@H](C[C@H](C)Cl)NC(=O)c1cc(Br)ccc1I 716924908 LRXBJTDFUKLOBX-WCBMZHEXSA-N 444.538 4.580 50 10 IJGE CCOc1ccc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)Nc2c(C(C)=O)oc3ccccc23)cc1 744569582 FNSIMMPZBWBLFX-OKSBFYSISA-N 446.459 4.511 50 10 IJGE Cc1ccc(CNC(=O)NNC(=O)c2cccc3cccnc23)c(O[C@@H](C)CC(C)C)c1 758865140 UNMLGQUQNGBUJW-SFHVURJKSA-N 434.540 4.501 50 10 IJGE CN(C)C(=O)/C(C#N)=C/c1cc(Cl)c(OCc2ccccc2F)c(Br)c1 1084466718 HUOBUNBEJKPGPB-VGOFMYFVSA-N 437.696 4.816 50 10 IJGE O=C(CSc1nc2ccccc2[nH]1)NN=Cc1ccc(OCc2ccccc2F)cc1 1772760622 ZJEOKZHUASMLQP-UHFFFAOYSA-N 434.496 4.523 50 10 IJGE CCc1nn(-c2ccc(OC)cc2)c2c1[C@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 1865685197 FMWQTIJTESPSAL-LJQANCHMSA-N 441.318 4.968 50 10 IJGE O=C1/C(=C/c2ccc(Br)cc2)Oc2cc(OC(=O)C(Cl)Cl)ccc21 1871385269 KGJBTUHKSVHFNH-AUWJEWJLSA-N 428.065 4.774 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)O[C@@H]1CCC2(CCCC2)C1 1902880706 GDICXGNSWHNPBK-RHSMWYFYSA-N 437.362 4.834 50 10 IJGE CC(C)(C)[C@@](C)(CBr)CN1CCC[C@H](NC(=O)OCc2ccccc2)C1 1904840505 IWVMIEFTEOFUAC-RXVVDRJESA-N 425.411 4.825 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@@H](CCl)C2(CCC2)C1 1914477709 OUYMBAWGAXLILJ-MRVPVSSYSA-N 427.589 4.754 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)C1CCC(C(F)(F)F)CC1 1916348279 NAMVFCJOLSLCMO-JCYILVPMSA-N 436.312 4.794 50 10 IJGE CC[C@H](Br)[C@H](CC)NC(=O)c1csc(Br)c1Br 1945184144 WCJBDRHTERCXPO-YUMQZZPRSA-N 448.018 4.955 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@H]([C@@]2(C)CCC[C@@H](CI)O2)CC1 1993734194 BAOHDOCTKBLTHA-YRBFXIGRSA-N 437.362 4.833 50 10 IJGE CC(C)(C)CN(Cc1ccccc1)S(=O)(=O)c1ccc(CCBr)s1 2009640906 ZBBPAUTTWKENEC-UHFFFAOYSA-N 430.433 4.923 50 10 IJGE CCOC(=O)[C@]1(C[C@H]2C[C@H](Br)C2)CCCN(C(=O)OCc2ccccc2)C1 2020239852 VZXIIILGNTZBSF-WFXMLNOXSA-N 438.362 4.532 50 10 IJGE C[C@]1(CCBr)CCN1C(=O)c1scc(Br)c1Br 2025223833 NGIGNVDMFDCHHS-NSHDSACASA-N 446.002 4.663 50 10 IJGE CC[C@@H](CCCBr)NC(=O)c1cc(Cl)ccc1I 2036513549 KTGSBTULLWMILK-JTQLQIEISA-N 444.538 4.628 50 10 IJGE BrCCN(Cc1ccc(I)cc1)Cc1cccs1 2051459110 ATCPDOXMIIWAAU-UHFFFAOYSA-N 436.156 4.750 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@@]1(C)CBr 2086658266 LYGXXIJSFMADQY-QMTHXVAHSA-N 442.566 4.798 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ccccc2)CCN1c1nc(CCl)ccc1Br 2130165200 DKTDUKZNZHQOBH-MRXNPFEDSA-N 448.714 4.836 50 10 IJGE CN(Cc1ccccc1)[C@]1(Cn2c(CCl)nc3c(Br)cccc32)CCOC1 2155116717 SSGSCRSIRNTBHB-NRFANRHFSA-N 448.792 4.829 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(CC3(CBr)CCCCC3)C[C@@H]21 2163057919 GJTQABNNKMROJI-HCXYKTFWSA-N 441.454 4.909 50 10 IJGE CN(C[C@@H]1CC1(Br)Br)[C@H](CBr)c1ccccc1 2253362059 BZMJWRLGCQDSPJ-NWDGAFQWSA-N 425.990 4.560 50 10 IJGE O=C(NCC1(CBr)CC(F)(F)C1)c1cc(Br)c(Cl)s1 2266907986 PRFKESZUWSRNSY-UHFFFAOYSA-N 437.531 4.704 50 10 IJGE CS(=O)(=O)C1CC([C@@H](Br)c2cc(Cl)c(Br)cc2F)C1 2269790937 XXXNLJYUQDBXGD-LBVLNNNDSA-N 434.552 4.501 50 10 IJGE CC[C@@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@H]1CBr 2282969694 GATBDUGRHWXHTG-BDAKNGLRSA-N 427.539 4.735 50 10 IJGE CN(C(=O)c1cccc(Cl)c1Br)C1(CBr)CCSCC1 2283199319 DXJYGWSPRWIBCA-UHFFFAOYSA-N 441.616 4.835 50 10 IJGE O=C(c1ccc(Cl)c(I)c1)N1CCC[C@H](CCCCl)C1 2283652690 YHTMRIFVWZOGLP-NSHDSACASA-N 426.125 4.816 50 10 IJGE CC1(C)C[C@H](Cl)C[C@@H](NC(=O)c2ccc(Cl)c(I)c2)C1 2283661210 GFOSPJVTEOFJOW-GHMZBOCLSA-N 426.125 4.861 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1CBr)c1cc(Br)c(F)cc1Cl 2285843920 GFXDAOVBMTXDSP-SDBXPKJASA-N 427.539 4.925 50 10 IJGE Cc1ccc(N2C[C@@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)c(CBr)n1 2287163828 STIYPVZNSZXXNQ-ZRZAMGCNSA-N 426.402 4.777 50 10 IJGE C[C@@H](Br)CCCN(C)C(=O)c1cc(Br)c(Br)s1 2299509363 NEGPVPMWIJHXPH-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE COc1cc(C(=O)N[C@H](CCBr)COCc2ccccc2)sc1Cl 2303542318 BZQBGSPEWZYKJY-CYBMUJFWSA-N 432.767 4.510 50 10 IJGE C[C@H](CCCCl)CNCc1ccc(I)c(Br)c1 2306224009 LWFLXDMWCJQBSQ-SNVBAGLBSA-N 430.555 4.798 50 10 IJGE Clc1ccc(I)cc1CN1CCCC[C@H](Br)C1 2307331423 FPPVQNYMDIKWPV-NSHDSACASA-N 428.539 4.694 50 10 IJGE CC1(C)[C@H](CBr)CCN1Cc1ccc(Cl)cc1I 2318556787 DRGPISLCJPHSSK-NSHDSACASA-N 442.566 4.940 50 10 IJGE C[C@@H](NC(=O)C(C#N)=CNCc1cccc(Br)c1)c1ccc2c(c1)CCCC2 2325118881 AGCLLDRBSQBYRV-MRXNPFEDSA-N 438.369 4.702 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)C[C@@H]1CCC[C@H]1Cl 2325224886 ZZVJLDWIBPLNAM-WCQYABFASA-N 442.566 4.893 50 10 IJGE CCCCCCOc1ccccc1C(=O)NNC(=O)COc1ccc([C@H](C)CC)cc1 7659989 NFTIKYOQVAOVNJ-LJQANCHMSA-N 426.557 4.999 50 10 IJGE C/C(=N\NC(=O)COc1c(C)cc(Br)cc1Br)c1cccs1 12483586 OELZIZCZVIYOMK-VCHYOVAHSA-N 446.164 4.501 50 10 IJGE CCCCOc1ccc(C(=O)NNC(=O)c2ccc(NC(=O)c3cccc(C)c3)cc2)cc1 14029906 YEBBCDGIGWTGSL-UHFFFAOYSA-N 445.519 4.501 50 10 IJGE N#CC1=C(N)C(C#N)(C#N)[C@@H](c2ccc(-c3ccc(Br)cc3)o2)[C@@H]2CCC=C12 27489641 BQOLBLXVNVFLDA-OXQOHEQNSA-N 431.293 4.913 50 10 IJGE CCCOc1ccc(/C=C2/C(=O)N(CCc3ccccc3)C(=O)C(C#N)=C2C)cc1OCC 38607541 WIACLDJBRJXPBV-CJLVFECKSA-N 444.531 4.709 50 10 IJGE C=CCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccc(F)cc3)c(OCC)c2)C1=O 38607775 VIYHOZLWQYWQHR-FYJGNVAPSA-N 446.478 4.582 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4cccc(Cl)c4)ccc32)cc1 38649342 JEHZRAWHICZEIB-XMMPIXPASA-N 446.890 4.851 50 10 IJGE CSc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccccc4)ccc32)cc1 38682618 VDLLRXYFBRQDOW-XMMPIXPASA-N 428.513 4.775 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@@H](C)c2nc(-c3ccc(F)cc3)no2)c(C)n1CC(C)C 212247720 WSBREFDKMQVKSV-YODDIOPGSA-N 435.503 4.734 50 10 IJGE CCCCCCCCCCCCCC(=O)NCC(=O)NN=Cc1cccc(OC)c1OC 254623218 HGKUQNSNIQVSST-UHFFFAOYSA-N 447.620 4.971 50 10 IJGE C[C@@]1(c2ccc(I)cc2)CC[C@](C)(CI)O1 309350931 BSPLKVLJVCEUMH-OLZOCXBDSA-N 442.078 4.511 50 10 IJGE Cn1cc(Br)c([C@H](Br)c2ccc(F)c(Br)c2F)n1 691558832 ITWBRAVYYVVUQU-MRVPVSSYSA-N 444.899 4.708 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1C(=O)c1scc(Br)c1Br 705440490 AWTRGDCAUTXZIS-NKWVEPMBSA-N 446.002 4.661 50 10 IJGE CN(C[C@H]1CCCCN1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1CBr 720015893 FGFXKGVXTVWAPM-HXUWFJFHSA-N 432.362 4.981 50 10 IJGE O=C(NNC(=O)[C@@H]1C[C@H]1c1cccc2ccccc12)c1ccc(Br)cc1Cl 730752517 HEFPYYJCOAEWHO-ZWKOTPCHSA-N 443.728 4.820 50 10 IJGE N#C/C(=C/c1ncc(I)s1)c1ncc(C(F)(F)F)cc1Cl 794697710 LUXFLPQXEFKBDI-BHQIHCQQSA-N 441.603 4.879 50 10 IJGE COc1cc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)ccc1OCc1ccccc1 799746762 IRNDRLRJYKMZCO-UHFFFAOYSA-N 441.409 4.922 50 10 IJGE C=CCNC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C)c3)c2C)cc1 1356380005 PNTDAYSURAKJTJ-XQNSMLJCSA-N 438.531 4.864 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cc(C(F)(F)F)ccc1Br 1585174243 ZVGNCEQZFARTGH-UHFFFAOYSA-N 443.248 4.831 50 10 IJGE C/C(=C\c1ccncc1)C(=O)NNC(=O)c1cc(-c2ccccc2Cl)nc2ccccc12 1608433053 XJGCQDBACKDOII-JQIJEIRASA-N 442.906 4.815 50 10 IJGE C=CC(C)(C)CCNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1 1682987052 VVPBZWXSKGFOIR-UHFFFAOYSA-N 429.948 4.774 50 10 IJGE Cc1c(C(=O)N2CCCc3ccccc32)oc2c1C(=NNC(=O)c1cccs1)CCC2 1772748317 BVPMIYZEVIDYQX-UHFFFAOYSA-N 433.533 4.713 50 10 IJGE CC1(C)OC[C@H](Cc2ccc(Br)cc2Br)[C@H]1Br 1943859985 UEQSWCRKXCPWAY-JOYOIKCWSA-N 426.974 4.943 50 10 IJGE CC1(C)CN(C(=O)c2csc(Br)c2Br)C[C@H]1Br 1945188908 DTBDNYHWDDVTMV-SSDOTTSWSA-N 446.002 4.519 50 10 IJGE O=C(N[C@@H](CCBr)C1CC1)c1ccc(Br)cc1Br 2029972445 OHXYAQYQYYZLOY-LBPRGKRZSA-N 439.973 4.505 50 10 IJGE CC(C)(C)OC(=O)N1CCC([S@](C)(=O)=NC[C@@H](CBr)C(C)(C)C)CC1 2044698446 BUZJIDPTSSVBEI-PWECECGKSA-N 439.460 4.541 50 10 IJGE C[C@@H](N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)n(C)c1)C(C)(C)C 2059284529 MBJRRTVJQOBIMW-OAHLLOKOSA-N 427.408 4.546 50 10 IJGE CCC(CC)(CBr)CN=[S@@]1(=O)CCN(C(=O)OC(C)(C)C)CC1(C)C 2069025691 ONCUWSQSKKBSNY-RUZDIDTESA-N 439.460 4.685 50 10 IJGE O=S(=O)(c1cc(CBr)ccn1)N(Cc1ccccc1)CC1CCCCC1 2123225509 QBPGAJBQNWGMFC-UHFFFAOYSA-N 437.403 4.748 50 10 IJGE BrCc1c(N2[C@H]3CCC[C@H]2CN(Cc2ccccc2)C3)nc2sccn12 2125906437 ILAQUCZICMKAOP-IRXDYDNUSA-N 431.403 4.534 50 10 IJGE O=C(N[C@H]1C[C@H]2CC[C@H]1[C@@H](Cl)C2)c1cc(Br)c(Br)s1 2139718995 LNJWTCZECUITQO-YIKMNZTOSA-N 427.589 4.799 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2Cc1sncc1Br 2153142149 BMEGUTZKCTXROW-UHFFFAOYSA-N 436.560 4.508 50 10 IJGE Cc1sc(C[C@@H](CBr)NC(=O)OC(C)(C)C)c(Br)c1C 2209324844 VGJBHLGPUDLWBA-JTQLQIEISA-N 427.202 4.958 50 10 IJGE CCOCc1cc(Br)c([C@@H](Br)c2cnc(Cl)n2C)s1 2224795745 DCCFHNUUSCISIQ-JTQLQIEISA-N 428.577 4.918 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2CCC[C@H](C1)[C@@]21CCC[C@@H](CI)O1 2249353366 DJXQVCSPTYMESE-IPXJXJKCSA-N 449.373 4.833 50 10 IJGE C[C@](CCl)(CI)OCc1c(F)cc(Br)cc1F 2250054986 MNPXKOXDJANMDP-NSHDSACASA-N 439.465 4.676 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1Cc1ccc(I)c(Cl)c1 2251038676 IEJKFUSIVRQJDQ-GXFFZTMASA-N 428.539 4.692 50 10 IJGE CC1CC(CBr)(CN2CCCCN(C(=O)OC(C)(C)C)CC(F)(F)C2)C1 2265308031 NMGVQIZVVDQTDU-UHFFFAOYSA-N 439.385 4.766 50 10 IJGE CN(Cc1ccc(I)cc1)C[C@H](CBr)c1ccccc1 2280256200 XABSRLLDOYDTDL-INIZCTEOSA-N 444.154 4.902 50 10 IJGE COC1(COc2c(Br)cc(CCl)cc2Br)CCOCC1 2280290274 UNSQCAXOBRVFQO-UHFFFAOYSA-N 428.548 4.525 50 10 IJGE Cc1ccc(C(=O)Oc2cccc(C=C(C#N)C(=O)Nc3cccc([N+](=O)[O-])c3)c2)cc1 2313724704 VCSIATANMIPUJO-UHFFFAOYSA-N 427.416 4.668 50 10 IJGE BrCC12CC(CCN1Cc1cc(Br)ccc1Br)C2 2314883637 WDHRUCCLEPLNIQ-UHFFFAOYSA-N 438.001 4.961 50 10 IJGE ClCc1cc(OCc2cc(I)ccc2Br)ccn1 2318982184 KGHUMCUQUIOBDX-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE O=C(N[C@H](CCCl)COCc1ccccc1)c1c(F)cc(Br)cc1F 2320558547 QSWORDZUABAZHA-CQSZACIVSA-N 432.692 4.671 50 10 IJGE CC(C)(C)OC(=O)NCCCC[S@@](C)(=O)=NC[C@](C)(CBr)C(C)(C)C 2327074979 CXMQEZNRPJUTBE-AVRWGWEMSA-N 441.476 4.836 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)[C@H]3CC(=O)N(Cc4ccccc4)C3)n2)cc1 2331273577 RBLYQYRLBVQZEW-SFHVURJKSA-N 431.517 4.660 50 10 IJGE Clc1cc(Br)c(CN2CCO[C@@H]3C[C@H](CBr)C[C@H]32)s1 2345956436 AIUDXXPSNCVGLT-FBIMIBRVSA-N 429.605 4.538 50 10 IJGE C[C@@H]1[C@H](Br)CCN(C(=O)c2cc(Br)c(F)cc2Cl)[C@@H]1C 2370657272 AZEFQCSBBBJAJE-QXFUBDJGSA-N 427.539 4.876 50 10 IJGE CCCCCN1C(=O)/C(=N/NC(=O)[C@H](C)Oc2ccc(Cl)cc2C)c2cc(C)ccc21 33959321 CGAUEPWWTWYLIW-KQMYFLNBSA-N 441.959 4.781 50 10 IJGE COC(=O)/C(C#N)=C/c1ccc(OC(=O)/C(=C\c2ccccc2)c2ccccc2)c(OC)c1 35238343 FLHSZFGKYFGNLJ-UGLCQJSWSA-N 439.467 4.921 50 10 IJGE CCCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(C)o2)c1 38659325 OSPOVNYJQGEYPJ-QHCPKHFHSA-N 430.460 4.814 50 10 IJGE C=CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)cc1 38678086 HWFDSSOUNKJQIW-XMMPIXPASA-N 442.446 4.828 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N[C@@H](C)c2nc(-c3ccc(F)cc3)no2)c(C)n1CC(C)C 109554786 WSBREFDKMQVKSV-VBNMEBLOSA-N 435.503 4.734 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H]1Br)c1ccc(Br)c(C(F)(F)F)c1 124439421 XSIIHGCUWWSNBE-ONGXEEELSA-N 429.074 4.761 50 10 IJGE O=S(=O)(N[C@H]1CCCCC[C@H]1Cl)c1c(Cl)cc(Br)cc1Cl 136223159 DJERWOMGBVSEJW-SKDRFNHKSA-N 435.598 4.974 50 10 IJGE O=C(N/N=C\c1ccc(Cl)c(Cl)c1)c1cccn(Cc2ccc(Cl)cc2)c1=O 169920399 UNNCQRZAGNGJJR-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE Cn1ncc([C@H](Br)c2csc3ccccc23)c1I 379143745 BWDJKDHBVUVBRC-LBPRGKRZSA-N 433.112 4.724 50 10 IJGE Nc1ccc(Cl)cc1[C@@H]1CN(Cc2ccccc2)C[C@@H]1CI 382734208 WDLWWXSTQSCRJY-WMLDXEAASA-N 426.729 4.573 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H]1n1c(CCCl)nc2cc(Br)cnc21 389782716 JEZGEBPZHDNJEY-KBXCAEBGSA-N 433.781 4.668 50 10 IJGE O=C(NNC(=S)Nc1cccc(Br)c1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 731232091 FPPBPAZUJFTOKP-MOPGFXCFSA-N 440.366 4.724 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C[C@@H](C)c2ccccc2C(F)(F)F)c1C 743462251 GPAWUGGSJFULOM-CYBMUJFWSA-N 429.446 4.811 50 10 IJGE O=C(Nc1cccc(S(F)(F)(F)(F)F)c1)C(=O)N1CCC(C2CCOCC2)CC1 762667659 IQVYYIKUHYASQF-UHFFFAOYSA-N 442.450 4.948 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2cccc(NC(=O)c3ccoc3)c2)c(C(F)(F)F)c1 799394582 BPEZSKFRNXDIDJ-UHFFFAOYSA-N 429.358 4.571 50 10 IJGE O=C(NNc1ncccc1F)c1cc(-c2ccccc2)nc2cc(Br)ccc12 804217153 RLLNQLPXVVSDBN-UHFFFAOYSA-N 437.272 4.955 50 10 IJGE Cn1cc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2)c2ccccc21 1865699427 UBMFMXJXJPJUOD-SFHVURJKSA-N 435.409 4.601 50 10 IJGE CC[C@H](NC(=O)[C@H](c1ccc(OC)cc1)C(C)C)C(=O)Nc1ccc(SC#N)cc1 1866980740 RFAYLYKQRSGWGG-SFTDATJTSA-N 425.554 4.541 50 10 IJGE N#CSc1ccc(NC(=O)CCC(=O)N2CCC[C@H]2c2nc3ccccc3s2)cc1 1868176864 FAGQYYIICGHBTG-SFHVURJKSA-N 436.562 4.952 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)CCC1CCN(C(=O)OC(C)(C)C)CC1 1880765894 CLQVSHSLPWADDG-HNNXBMFYSA-N 435.403 4.702 50 10 IJGE Fc1cc(Br)c2nc(CCl)n(Cc3sncc3Br)c2c1 1912671177 WYBHNRHSFKNKQJ-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC12CCC1(CC2)CC[C@@](C)(CI)O1 1937359261 AHKOSPLNJYZOHS-CCXQOOOBSA-N 435.346 4.587 50 10 IJGE BrC[C@H]1CCCCN1Cc1ccc(Br)cc1Br 1943840841 DNRVVZNMPYGLOK-GFCCVEGCSA-N 425.990 4.961 50 10 IJGE CC(C)(C)OC(=O)NCC[S@@](C)(=O)=NCCCCCCCCCBr 1999497338 OQJRGEQHMIUBSM-XMMPIXPASA-N 427.449 4.735 50 10 IJGE CCc1nc(Br)c(Br)n1C[C@H](CBr)CC1CC1 2003365963 FFFKHWWMQIHLRF-VIFPVBQESA-N 428.994 4.782 50 10 IJGE Clc1cc(CN(CCCBr)C2CC2)ccc1I 2026567575 SYUJEVZONBBTDZ-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)c2c(C)[nH]c3ccccc23)ccc1O[C@@H](C)C(=O)N(C)C 2040797400 FKCKZGDBZHCNCU-KRWDZBQOSA-N 445.519 4.520 50 10 IJGE C[C@H](CCBr)CCN1CCN(C(=O)OC(C)(C)C)CC[C@H]1C(F)(F)F 2044701993 XRYHYCRGLZZVPK-KGLIPLIRSA-N 431.337 4.671 50 10 IJGE O=C(CBr)c1c(Br)cc(OC(F)(F)F)cc1C(F)(F)F 2054797055 FWVULPZQKBUAIF-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE CC[C@H](C)[C@H](CBr)NC(=O)c1cccc(Br)c1Br 2081239246 PUFUMGZYHJYYGP-KWQFWETISA-N 441.989 4.751 50 10 IJGE Clc1cc(CN2CC[C@H](Br)[C@H]2C2CC2)ccc1I 2086654526 HESNMNBSSCAIJP-SMDDNHRTSA-N 440.550 4.692 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H](N(C[C@@H](CBr)C1CC1)C1CC1)C(F)(F)F 2106788751 SFSOXFWTLVEHAI-HIFRSBDPSA-N 443.348 4.718 50 10 IJGE COC1(C(F)(F)F)CC(C(=O)N(Cc2ccccc2)C2(CBr)CCC2)C1 2125553180 GBQISURUZPIBIC-UHFFFAOYSA-N 434.296 4.690 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(C[C@H](CBr)c2ccccc2)CC12CCC2 2163059443 SZYYKGOAPVAJAM-OALUTQOASA-N 437.422 4.792 50 10 IJGE Cc1ccccc1N(C)S(=O)(=O)c1cc(CBr)sc1Br 2179788033 WZPQLEOGWALNIF-UHFFFAOYSA-N 439.194 4.539 50 10 IJGE Cc1cc(C(=O)NC[C@@]2(CBr)C[C@@H]2C(F)(F)F)sc1Br 2192584297 XCUJDRPXMQVMEO-KWQFWETISA-N 435.103 4.512 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@H]1C[C@H](C(C)(C)C)CN(C(=O)OC(C)(C)C)C1 2196908359 XFGRECCYHAZLPH-YZUHTNEWSA-N 445.442 4.538 50 10 IJGE C[C@H](C(=O)N(C)C[C@H]1C[C@@H](Br)C1)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 2196913798 HLBLTTPJGGXVQV-CWLKWCNXSA-N 439.394 4.520 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)c2ccccc2)CCC1(C)C 2231332265 UEGQQNAINMTUMD-SFHVURJKSA-N 425.411 4.887 50 10 IJGE C[C@]1([C@@H](Br)Cc2cc(Br)cc(Br)c2)CCOC1 2252836364 BFGVVBKGUJIPKP-STQMWFEESA-N 426.974 4.944 50 10 IJGE CN(C[C@H]1CCC[C@H]1Br)C(=O)c1cc(Br)c(F)cc1Cl 2285843586 ATMLBSHXPDGAOS-PSASIEDQSA-N 427.539 4.877 50 10 IJGE C#CCOc1c(Br)cc(C=C(C#N)c2cccc([N+](=O)[O-])c2)cc1OCC 2297369750 WXWAALOATCLYHK-UHFFFAOYSA-N 427.254 4.832 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2C[C@H]3O[C@H]2[C@@H]2C[C@@H]32)s1 2300953538 KNSVWDFOLQYMSV-UFQFENACSA-N 445.547 4.866 50 10 IJGE ClCc1cnc(OCc2ccc(I)c(Br)c2)s1 2306307718 SPXBSRYNFTZJMO-UHFFFAOYSA-N 444.519 4.828 50 10 IJGE COC[C@H]1C[C@@H](Cc2ccc(Cl)c(I)c2)[C@H](Br)C1 2315549930 XTRQMJAAJHLVDG-QJPTWQEYSA-N 443.550 4.923 50 10 IJGE C[C@@H]1CC[C@@H](CBr)N(Cc2ccc(Cl)cc2I)C1 2318512124 QAWYCTGPHUYIOR-MFKMUULPSA-N 442.566 4.940 50 10 IJGE CC1(CBr)CCN(Cc2ccc(Cl)cc2I)CC1 2318526489 KNEWPFKNOFXLTR-UHFFFAOYSA-N 442.566 4.942 50 10 IJGE Clc1ccc(C[C@@]2(CBr)C[C@@]23CCOC3)c(I)c1 2318528324 DMSZMGKQBKUVAD-KGLIPLIRSA-N 441.534 4.679 50 10 IJGE CCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2326919754 QKPUMSRVAKVENA-WMLDXEAASA-N 425.358 4.518 50 10 IJGE BrC[C@@H]1C[C@@H]2C[C@H](C1)CN(Cc1ccc(I)cc1)C2 2343242241 LKWNPQHELIYHDL-QKDCVEJESA-N 434.159 4.534 50 10 IJGE CCOc1cccc(N2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)c1CBr 2367331825 OKMQNBODBVOHEF-WOJBJXKFSA-N 429.402 4.939 50 10 IJGE O=C(COc1ccc(C=NNC(=O)c2cc3ccccc3o2)cc1Cl)Nc1ccccc1 13108529 SCGRNQVEDWXYOS-UHFFFAOYSA-N 447.878 4.868 50 10 IJGE O=C(Nc1ccc(N2CCN(C(=O)C3CCCCC3)CC2)cc1)[C@@H](Cl)c1ccccc1 35744597 UJSGOWHEXOETSP-QHCPKHFHSA-N 439.987 4.834 50 10 IJGE Cc1cccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(Cl)cc2)c1 38651350 UVNMMUVUGGHDQN-DEOSSOPVSA-N 446.890 4.851 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3Cl)ccc2[C@@H]1c1cccc([N+](=O)[O-])c1 38653405 RMRMQRLCEYSHRH-NRFANRHFSA-N 447.834 4.686 50 10 IJGE CCN(C(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccc1F)CCC2)c1ccccc1 40812483 ZQPQLQLERIMEHO-NHFJDJAPSA-N 433.483 4.864 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 58894360 JBPUETPDNZAQML-GJVLPJBHSA-N 437.515 4.596 50 10 IJGE ClC[C@H](OCc1cccc(Br)c1)[C@@H](I)CCl 158544504 BMTYQFZDSKDABT-QWRGUYRKSA-N 437.930 4.616 50 10 IJGE Cc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)cc1 205645110 NYNHJALQGRCOSB-LJOQBGCZSA-N 426.447 4.971 50 10 IJGE CC[C@@H](NC(=O)c1cc(Br)cc(Br)c1)[C@@H](C)Br 395378109 RPQWUGKCGRNPQM-RDDDGLTNSA-N 427.962 4.503 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2C1[C@H]2CN(Cc3ccccc3)C[C@H]12 398464810 UGFPTUNVATUVEX-KBPBESRZSA-N 434.740 4.980 50 10 IJGE O=C(NC1CCC(Br)CC1)c1scc(Br)c1Br 705404133 ZCPLOWYRUMIDDR-UHFFFAOYSA-N 446.002 4.709 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCc2ccc(-c3csc(C)n3)cc2)c1C 790483178 CHJJMPPCSRGFEI-CMBCABCVSA-N 448.592 4.968 50 10 IJGE N#Cc1ccc(NNC(=O)Cc2c[nH]c3cc(Br)ccc23)c(C(F)(F)F)c1 799745822 KTQYWGKISQMYLU-UHFFFAOYSA-N 437.219 4.507 50 10 IJGE CCn1c(SCCCC(=O)NN=Cc2ccc(Br)cc2)nc2ccccc21 1084036305 NRTDVPRNOFHTLJ-UHFFFAOYSA-N 445.386 4.841 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cccc(-n3ccnc3O)c2)c(C)n1-c1ccc(F)cc1 1527763439 HSPPHVRNHZHKBF-UYRXBGFRSA-N 441.466 4.670 50 10 IJGE C=CCSc1ccccc1C(=O)NNC(=O)c1cc(-c2ccco2)nc2ccccc12 1540385389 YFPVYCNRNROKGL-UHFFFAOYSA-N 429.501 4.848 50 10 IJGE C=CC[C@H]1CCCC[C@@H]1NC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12 1565063748 SEDFICIXTJKUGM-AVRDEDQJSA-N 428.536 4.981 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccccc2Cl)cc1 1865695274 NBKJABFOLADRGE-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE CCCc1nn(-c2cccc(Cl)c2)c2c1[C@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865710297 UJMFCJBOKQFHOE-LJQANCHMSA-N 435.871 4.605 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21 1882066844 OQOLOYILZZDBHR-LVQVYYBASA-N 447.414 4.558 50 10 IJGE C[C@@H](CC(=O)NCC1CC(Br)C1)c1ccc(NC(=O)OC(C)(C)C)cc1 1887793006 GFWSISWEUYWEGR-HLIUYOAVSA-N 425.367 4.817 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Cl)Cc1c(Cl)ccc(Br)c1F 1905438136 LSOIAQDESLZIFM-SECBINFHSA-N 431.088 4.688 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)Cc1nn(C)cc1Br 1915299270 CCZULULWMUDRBU-QGZVFWFLSA-N 429.200 4.604 50 10 IJGE O=C(NCC[C@H](Br)C1CC1)c1cc(Br)sc1Br 1942742847 REZLKPOLTWMDRE-QMMMGPOBSA-N 446.002 4.567 50 10 IJGE O=C(c1cccc(OCc2ccccc2)c1)N1CCC(CI)CC1 1949198669 XTEOODIFXSJLSI-UHFFFAOYSA-N 435.305 4.553 50 10 IJGE C[C@H](NC(=O)c1ccc(Br)cc1Br)C(C)(C)CBr 2030084752 XKRHESVSYLAQEK-QMMMGPOBSA-N 441.989 4.751 50 10 IJGE Br[C@@H](c1ccc2c(c1)CCCO2)c1cc(I)sn1 2056487282 JMQIOOPNMIANGV-ZDUSSCGKSA-N 436.112 4.557 50 10 IJGE C[C@@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(CBr)c1 2059265194 QZVCYRQLSZUINY-AWEZNQCLSA-N 426.351 4.710 50 10 IJGE Brc1ccc(CN2CC[C@H](Br)[C@H]3CC[C@@H]32)c(Br)c1 2069994624 AFDRPZSZPVYKLS-DYEKYZERSA-N 438.001 4.959 50 10 IJGE Cc1c(Br)ccc([C@@H](Br)[C@]2(C)COCCO2)c1Br 2083319179 WJAJOUYPBKDAMF-OLZOCXBDSA-N 442.973 4.762 50 10 IJGE CC[C@@H]1CCOC[C@H]1O[C@H](CI)c1ccccc1Br 2096209354 YJTHXINFOVIRLJ-KCPJHIHWSA-N 439.131 4.757 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CCCN(C[C@@H](CBr)CC3CC3)C2)C1 2112868324 IRBAGDXEOAZZAM-NQIIRXRSSA-N 429.443 4.911 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1ccc(Br)c(F)c1 2117895026 ORTFSZQJDSVAOV-JTQLQIEISA-N 442.110 4.702 50 10 IJGE Clc1cc(CBr)ccc1N1CC[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2129054976 QODNIQRYVZTZMY-RTWAWAEBSA-N 435.793 4.715 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@H]1CCN(C(=O)OC(C)(C)C)CC12CC2 2185893401 NAESYWDQNWRWPZ-OALUTQOASA-N 437.422 4.887 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Cl)C2 2190669252 BAIIZHUGXWZPJB-OQCKYNKVSA-N 425.523 4.534 50 10 IJGE C[C@H](Cl)c1nc2c(Br)cccc2n1C[C@H]1COCCN1Cc1ccccc1 2194648519 IRUARCJDTADRCI-RDJZCZTQSA-N 448.792 5.000 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(CBr)cc1 2203609227 JNODMMIPNNRXSM-QZTJIDSGSA-N 439.394 4.832 50 10 IJGE CC(C)(CCl)N(Cc1ccccc1)S(=O)(=O)Cc1cccc(Br)c1 2213760655 JICXPKPCYIDXQA-UHFFFAOYSA-N 430.795 4.799 50 10 IJGE C[C@H]1CCN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@H]1CBr 2282976693 VZEPKTGWGIFPGK-IUCAKERBSA-N 427.539 4.735 50 10 IJGE Cc1ccc(COc2c(Cl)cc(C=C(C#N)C(=O)N(C)C)cc2Br)cc1 2313567710 MYZPTOGKJKDUOO-UHFFFAOYSA-N 433.733 4.985 50 10 IJGE Cc1cccc(Cn2cccc(C(=O)NN=Cc3c(Cl)ccc(Cl)c3Cl)c2=O)c1 2318418058 OMEBPKJWYFPTIK-UHFFFAOYSA-N 448.737 4.929 50 10 IJGE C[C@@H](NC(=O)C(C#N)=CNCc1ccc(Br)cc1)C12CC3CC(CC(C3)C1)C2 2324904595 CAXDGWFZAZIKJR-MBAYWBQQSA-N 442.401 4.667 50 10 IJGE COc1c(C)cc(Cl)cc1-c1csc(C(C#N)=C(O)[C@@H]2CC(=O)N(C(C)C)C2)n1 2331391749 AAIYLZYIGHADKL-CYBMUJFWSA-N 431.945 4.830 50 10 IJGE COc1c(F)c(F)cc(CN(C)C[C@H](Br)COCc2ccccc2)c1F 2339169087 MZQAFLNMXCCSFK-HNNXBMFYSA-N 432.280 4.525 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@H]3[C@@H](CCCN3C(=O)OC(C)(C)C)C2)C1 2345010805 OIRHJXZTXKBOBG-DLBZAZTESA-N 429.443 4.909 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H]2CC[C@@H]1C[C@H]2CBr 2359509352 XHTZBSHMCJZART-DAROEXNTSA-N 425.523 4.630 50 10 IJGE COc1cccc([C@H](C(=O)NC2CCCCC2)N(Cc2ccc(C)cc2)C(=O)CCl)c1 3039800 WULWGXQPMITLCL-XMMPIXPASA-N 442.987 4.761 50 10 IJGE Cc1cc2nc(-c3ccccc3)c(N3CCCN(C(=O)C(Cl)Cl)CC3)nc2cc1C 103029790 JAAORIAHENQWNT-UHFFFAOYSA-N 443.378 4.756 50 10 IJGE CCC(CC)(CBr)NC(=O)c1cc(Br)ccc1Br 161225470 XZZSZIOKTIDAKS-UHFFFAOYSA-N 441.989 4.895 50 10 IJGE CC(C)S(=O)(=O)CCC(CBr)(CBr)c1ccccc1Cl 232697074 NVSFGPHIQOCGFC-UHFFFAOYSA-N 446.632 4.581 50 10 IJGE CCC(CC)(CBr)NC(=O)c1cc(Br)sc1Br 232851269 YYJSCFQBLHBFLX-UHFFFAOYSA-N 448.018 4.957 50 10 IJGE C[C@@H]1CCN(C(=O)c2cc(Br)sc2Br)C[C@H]1Br 235334518 UDWRGNICOHUIJA-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE CC[C@H](Br)C(=O)Nc1c(Br)cc(Cl)cc1Br 300843128 KDGKELZRYGOYEN-LURJTMIESA-N 434.353 4.977 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1C(=O)c1cc(Br)ccc1Br 399441780 WJLFPDPZQYAKDE-WCBMZHEXSA-N 439.973 4.600 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc3c(s2)-c2ccccc2OC3)c1C 736693625 BRLQXZJYRPEQEM-UHFFFAOYSA-N 429.505 4.533 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(C3CC3)nc3ccc(Cl)cc23)c1C 751392481 QAJPNMIUGVFLBL-UHFFFAOYSA-N 444.926 4.991 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cc(F)c(F)cc1C(=O)c1ccccc1 1585179968 ZROBNDILRKBKPI-UHFFFAOYSA-N 436.443 4.558 50 10 IJGE O=C(NNc1ccc(Br)c(F)c1)c1cc2ccc(C(F)(F)F)cc2nc1O 1638851972 USSFMUOXJLRDRN-UHFFFAOYSA-N 444.182 4.618 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@H]1c1ccccc1 1865680680 RYUZHCSFDNASGK-INIZCTEOSA-N 430.817 4.822 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)[C@@H](C)Oc3ccc(C(C)C)cc3)c(C)n2)cc1 1865758656 LFTRUDUZTJQWCJ-LJQANCHMSA-N 431.536 4.717 50 10 IJGE CC1(C)OC[C@@H](Cc2cc(Br)ccc2Br)[C@@H]1Br 2006501610 USVRRMMUGULALU-SKDRFNHKSA-N 426.974 4.943 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1C(=O)c1cccc(Br)c1Br 2031477832 OEEBEQUDMXUNEM-RKDXNWHRSA-N 439.973 4.600 50 10 IJGE CC(C)(C)OC(=O)N1CCCN(C[C@H](CBr)C(C)(C)C)CC(F)(F)C1 2044705633 MUFJVLLJOPJBIH-AWEZNQCLSA-N 427.374 4.622 50 10 IJGE C[C@@H]1CN(c2ncc(Br)cc2Br)CC[C@H]1CCBr 2052374858 OEGDCDSSRGGVJW-NXEZZACHSA-N 441.005 4.854 50 10 IJGE COC[C@@]1([C@H](Br)c2ccc(Br)cc2Br)CCCO1 2083317478 GSZNPULJLKRXLK-CHWSQXEVSA-N 442.973 4.843 50 10 IJGE ClCCC[C@@H]1CCCCN1c1ncc(I)cc1Br 2085683526 MHRDWYROLQPVII-NSHDSACASA-N 443.554 4.827 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC2(CCC2)C[C@@H]1CCl 2095167705 FVTBCQNCQBPREE-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1N(CC1(CBr)CCOCC1)CC2 2106783860 DCHUFCCQOVVWEE-UHFFFAOYSA-N 425.367 4.588 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)N(C[C@H](CBr)CC1CC1)CCO2 2169172403 NSUANHCTRDRRRK-KRWDZBQOSA-N 439.394 4.721 50 10 IJGE CCCc1nc([C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)nc(O)c1CBr 2187324278 HIXCQYLFWHQTFB-NNZMDNLPSA-N 430.390 4.940 50 10 IJGE O=C(Nc1ccccc1CCBr)c1sccc1I 2222936598 QGGJPEIHSLZRNJ-UHFFFAOYSA-N 436.112 4.542 50 10 IJGE Cn1nc(Br)c([C@H](Cl)c2cc3sc(Br)cc3s2)n1 2263556996 ZCWSOJUPDVAQFK-MRVPVSSYSA-N 427.574 4.945 50 10 IJGE O=C(NC[C@@H]1CCC[C@H](CCl)C1)c1ccc(Cl)c(I)c1 2283658621 XQNTVXYTLFUEPG-WDEREUQCSA-N 426.125 4.720 50 10 IJGE O=C(N1CCC[C@H]([C@@H]2CCCCN2CCCCCCCBr)C1)C(F)(F)F 2294697556 COPYETOOTJCDMU-IRXDYDNUSA-N 441.376 4.987 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)C=Cc3ccccc3)ccc2[C@@H]1c1ccc(F)c(F)c1 2297679817 RZIGPCLOQPRXSH-DEOSSOPVSA-N 430.410 4.802 50 10 IJGE C[C@H]1OCC[C@]1(CCl)Cc1ccc(I)c(Br)c1 2306221169 FEYQRTKQIDZWHX-NOZJJQNGSA-N 429.523 4.630 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(C)C[C@H]2CC[C@H]1C[C@@]21CC[C@@](C)(CI)O1 2307494022 AJJVEBQKRHMUPP-ITOHMHRPSA-N 449.373 4.833 50 10 IJGE Brc1ccc(CN2CC[C@@H](Br)[C@H]3CC[C@H]32)c(Br)c1 2310809545 AFDRPZSZPVYKLS-YRGRVCCFSA-N 438.001 4.959 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1Cl)c1cccn(Cc2ccc(Cl)cc2)c1=O 2318417780 FVVHEJSOSJZHPL-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc3nc(Cc4ccccc4)[nH]c3c2)cc(Cl)c1O 2318417803 GPVBJOPPUXQOMZ-UHFFFAOYSA-N 448.910 4.675 50 10 IJGE CCCC1(NC(=O)OC(C)(C)C)CCN(C[C@]2(CBr)CC2(F)F)CC1 2326918045 XXBRYYQKMDQSNI-MRXNPFEDSA-N 425.358 4.566 50 10 IJGE N#CC(=C(O)[C@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2ccc(F)cc2F)cs1 2331286645 TYTLZLLMVSAGBG-HNNXBMFYSA-N 437.471 4.930 50 10 IJGE CCCc1sc(Br)cc1[C@H](Br)C1CCS(=O)(=O)CC1 2338025921 AKKQBEJFCUFZNU-CYBMUJFWSA-N 430.227 4.724 50 10 IJGE Cn1nc(C(F)F)c(CBr)c1N(Cc1ccccc1)[C@@H]1COC(C)(C)C1 2339727003 IDYWETAKDNQYTA-AWEZNQCLSA-N 428.321 4.827 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@@H]1C[C@H]2CBr 2359286277 SNYCUBXSGZLNGL-DAROEXNTSA-N 425.523 4.630 50 10 IJGE COc1cc(/C=C(/C#N)c2nc3ccccc3[nH]2)c(Br)c(Br)c1O 6239245 RUIZOXMVRBYAJJ-POHAHGRESA-N 449.102 4.866 50 10 IJGE CC[C@H](C)c1ccccc1OCC(=O)NNC(=O)[C@@H](C)Oc1ccccc1[C@@H](C)CC 9871275 XMLIQPCEBUCTLO-GBESFXJTSA-N 426.557 4.707 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(C(=O)N/N=C/c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 12577395 DENPPQWPQCLTFL-ZMOGYAJESA-N 436.855 4.573 50 10 IJGE COc1ccc(/C(C)=N/NC(=O)CCCOc2ccc(Cl)cc2Cl)c(OC)c1 12577996 HUCLNEAPFFABSW-YDZHTSKRSA-N 425.312 4.710 50 10 IJGE CCCCOc1ccccc1C(=O)NNC(=O)c1ccc(NC(=O)c2cccc(C)c2)cc1 14032082 YANOBRSQTSPPBW-UHFFFAOYSA-N 445.519 4.501 50 10 IJGE Cc1cccc(OCC(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2C(C)(C)C)c1C 14661805 AZPDSGDNDQGXSM-UHFFFAOYSA-N 440.584 4.504 50 10 IJGE COc1cccc(COc2ccccc2/C=N/NC(=O)COc2ccc3ccccc3c2)c1 20274319 IWUASTIAANEEBI-OGLMXYFKSA-N 440.499 4.957 50 10 IJGE Cc1ccccc1C(=O)NNc1ncnc(Nc2ccc(Cl)c(C(F)(F)F)c2)c1N 40784356 DUCROEPFKJNRSE-UHFFFAOYSA-N 436.825 4.540 50 10 IJGE Cc1c(C(=O)NCCc2ccccc2)oc2c1/C(=N/NC(=O)c1ccccc1Cl)CCC2 40812661 WTEGHHMQBZZFCC-VFCFBJKWSA-N 449.938 4.684 50 10 IJGE CNC(=O)/C(C#N)=C1\S[C@@H](Cc2cccc(Cl)c2)C(=O)N1c1ccc(C(C)C)cc1 101240530 NDYPJOILHSMYBB-ZNCVUUBVSA-N 439.968 4.636 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)[C@@H]2CCCCS2(=O)=O)cc1Br 169105511 VSQLLOCAVFAPGZ-QWHCGFSZSA-N 430.589 4.767 50 10 IJGE COc1cc(/C=N/NC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)cc(Br)c1OC 169889591 JSHVESRHPROFON-DUEOVSJMSA-N 449.389 4.913 50 10 IJGE CCCCCCCCO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1I 231314200 OPFVRCSZBZUERI-CABCVRRESA-N 425.351 4.786 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccncc2)ccc1OCCCOc1ccc(C)c(C)c1 254867315 FQXNFWIURYTODI-UHFFFAOYSA-N 447.535 4.709 50 10 IJGE ClCc1ccc2c(I)c(I)sc2c1 306823680 UHFAMAGVBBGTAK-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE O=C(NC[C@@H](Br)C1CCC1)c1cc(Br)sc1Br 316364414 UFBABTTVMCEIND-MRVPVSSYSA-N 446.002 4.567 50 10 IJGE CC(C)(C)N(CCBr)C(=O)c1scc(Br)c1Br 708588314 NLBMFPXQTIOFQI-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE COc1ccc(C(C)=NNC(=O)CSCc2ccccc2Cl)cc1Br 725404598 AZLDZWZTEJAXRX-UHFFFAOYSA-N 441.778 4.885 50 10 IJGE C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1 804207515 JYZKLJQNBUTAIJ-ACCUITESSA-N 443.385 4.617 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NC[C@@H]2CCCc3ccccc32)c(-c2ccccc2)n1 914469771 GWVQJMSMFSLULK-NRPPHEFGSA-N 435.531 4.607 50 10 IJGE Cc1ccccc1NC(=O)/C(C#N)=C/c1cc(Br)cc(Br)c1O 1084471445 NSVBQLDROOOJOI-WUXMJOGZSA-N 436.103 4.771 50 10 IJGE COc1ccc(NC(=O)OC(C)(C)C)c(NC(=O)[C@H](Br)C2CCCC2)c1 1183404479 FPDJATTYCIGHCQ-MRXNPFEDSA-N 427.339 4.934 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNc2nc3ccc(OC)cc3cc2C)s1 1631725041 CYKGMLQJIGUOLQ-UHFFFAOYSA-N 449.001 4.847 50 10 IJGE CC(=O)c1cc(NC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)ccc1F 1677406379 MQOJAMPVSDUBRF-AWEZNQCLSA-N 431.533 4.707 50 10 IJGE C[C@H](Br)C(=O)c1cccc(SC(F)(F)F)c1I 1848425896 OYSPJSBGAPCHQX-YFKPBYRVSA-N 439.034 4.869 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccc(F)cc2)[C@@H]1c1ccc(O)cc1 1865684784 YGPXKRPEDGXJBA-JOCHJYFZSA-N 438.462 4.661 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865702028 KXBGUYNRBUHSRC-JOCHJYFZSA-N 434.490 4.997 50 10 IJGE CCc1nn(C)c([C@@H](Cl)c2cc(Br)c(OC)s2)c1Br 1877186923 XHBHAENBEMHWRZ-JTQLQIEISA-N 428.577 4.906 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)CCc1cccc(Cl)c1Cl 1905342937 MIAUMDKKVBPNGZ-LBPRGKRZSA-N 427.125 4.986 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N(Cc2ccccc2)C[C@H](C)Cl)c1Br 1914667284 MRGWKEIKXICBMN-NSHDSACASA-N 436.824 4.946 50 10 IJGE CC[C@H]1CN(Cc2ccc(Br)cc2Br)C[C@@H]1Br 1943856853 BYWYVCBKQBPXNR-ZANVPECISA-N 425.990 4.817 50 10 IJGE Clc1ccc(I)cc1-n1cnc(Cl)c1CBr 1982517233 UOVRJPGGDWZMML-UHFFFAOYSA-N 431.886 4.679 50 10 IJGE O=C(OCc1ccccc1)N1CCC2(CC1)CCN2C[C@@H](CBr)CC1CC1 2003376391 GFSOPDVAWNZXED-HXUWFJFHSA-N 435.406 4.675 50 10 IJGE C=CC[C@H](CBr)CNC(=O)c1scc(Br)c1Br 2023511097 IDOMGRVRFJIPRO-SSDOTTSWSA-N 446.002 4.590 50 10 IJGE Cc1c(Br)sc([C@H](Br)C2COCCOC2)c1Br 2024260857 WBHSLBNNFSOONR-SECBINFHSA-N 449.002 4.681 50 10 IJGE Clc1cc(CN2CCC[C@H]2CCBr)ccc1I 2026559467 AOFRSJIQQAOGAR-NSHDSACASA-N 428.539 4.694 50 10 IJGE O=C(N[C@@H]1CCC[C@H]1CBr)c1cccc(Br)c1Br 2031485352 HRTWKRXWDOENKN-GZMMTYOYSA-N 439.973 4.505 50 10 IJGE CC(C)C[C@H](CBr)NC(=O)c1c(Br)cccc1Br 2033092360 APKCPPYPUCDCBA-SECBINFHSA-N 441.989 4.751 50 10 IJGE CCCN1C[C@H](Cc2cccc(Br)c2Br)[C@@H](Br)C1 2039263860 ZJLKQCDWTYFAJR-AAEUAGOBSA-N 440.017 4.859 50 10 IJGE C[C@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(CBr)c1 2059265195 QZVCYRQLSZUINY-CQSZACIVSA-N 426.351 4.710 50 10 IJGE O=S(=O)(c1ccc(CBr)o1)N(Cc1ccccc1)CC1CCCCC1 2059324250 UPWKSJXXEXJNEG-UHFFFAOYSA-N 426.376 4.946 50 10 IJGE BrCc1c(N2CCN(Cc3ccccc3)C3(CCC3)C2)nc2sccn12 2097013745 DUKUETLFUBAJIZ-UHFFFAOYSA-N 431.403 4.536 50 10 IJGE Clc1cc(CBr)ccc1N1CC[C@H]2OCCN(Cc3ccccc3)[C@H]2C1 2129054966 QODNIQRYVZTZMY-LEWJYISDSA-N 435.793 4.715 50 10 IJGE Brc1cccc([C@H](CI)OC[C@H]2[C@H]3C[C@@H]4[C@H]2[C@@H]4C3)c1 2134536530 FKOJSISRKQDBLI-NAXIGVNNSA-N 433.127 4.844 50 10 IJGE CCN(c1ccc(CBr)cc1[N+](=O)[O-])C1CCN(Cc2ccccc2)CC1 2143594014 LOKXDXJMYLKKPL-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@H]1C[C@@H]2CC[C@H](C1)O2 2181362722 TXXKKHNJYLYLFN-IKVITTDRSA-N 449.126 4.620 50 10 IJGE CC(C)(C)OC(=O)N1[C@H](CNC(=O)[C@H](Br)C2CCCC2)C[C@H]2CCCC[C@@H]21 2240997663 RHCOGNIATMOWMG-VSZNYVQBSA-N 443.426 4.625 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@@H](Br)CC1COC1 2250746353 YDNSRELWBNUBEO-LURJTMIESA-N 434.900 4.962 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2[C@H]1C[C@H](Br)C1 2263424700 JUUPCICSVIQFDM-LJGSYFOKSA-N 443.485 4.617 50 10 IJGE CN(Cc1cccc(OC(F)(F)F)c1)C[C@@H](Br)COCc1ccccc1 2271212088 UWCYJOIPBKJMAC-QGZVFWFLSA-N 432.280 4.997 50 10 IJGE CCCOc1c(Br)cc(C=C(C#N)C(=O)NCCc2ccccc2)cc1OC 2293594290 DBBHROISBDRMMG-UHFFFAOYSA-N 443.341 4.512 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)C1(CCl)CCC1 2306221924 NTIQPPIVGNXGNS-UHFFFAOYSA-N 428.539 4.647 50 10 IJGE CC1=C(C#N)C(=O)N(CCCOC(C)C)C(=O)C1=Cc1ccc(OCc2ccccc2)cc1 2314618380 MMVIDMIBDNFVKY-UHFFFAOYSA-N 444.531 4.673 50 10 IJGE COc1cc(Br)c(CCC(=O)Oc2ccc(C=CC#N)cc2OC)cc1OC 2314807963 MUGCFTMNZBUEKW-UHFFFAOYSA-N 446.297 4.550 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cc(F)c(F)cc1Cl 2320359214 ZGZHPKUFKFMVAW-CYBMUJFWSA-N 432.692 4.718 50 10 IJGE CSCC[C@H](NC(=O)C(C)=Cc1ccccc1)C(=O)Nc1ccc(SC#N)cc1 2330453876 APYOTYDFTIEBNS-FQEVSTJZSA-N 425.579 4.540 50 10 IJGE COCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)CC1(CBr)CC(C)(C)C1 2371132309 ZGZIPJSQQZVUHG-QGZVFWFLSA-N 447.458 4.536 50 10 IJGE Cc1ccccc1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccccc1Cl 38650991 XZYMACAQFUROGI-XMMPIXPASA-N 446.890 4.851 50 10 IJGE O=C(CSc1nc(-c2ccc(Cl)cc2)cs1)N/N=C/c1cccc([N+](=O)[O-])c1 40924687 DSRNFGOODITYHB-AWQFTUOYSA-N 432.914 4.614 50 10 IJGE CC(C)Cc1ccc([C@@H](C)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cc1 66199211 LDNYHAXYJAAPRF-HXUWFJFHSA-N 430.548 4.882 50 10 IJGE CC1=C(C#N)C(=O)N(CCc2ccccc2)C(=O)/C1=C/Nc1c(Cl)cccc1Cl 101233123 LJQJTZNQOIDXIA-GHRIWEEISA-N 426.303 4.741 50 10 IJGE O=C(c1cc(C(F)(F)F)ccc1Br)N1CCC[C@H](CBr)C1 159884585 WDVDFRSCRSEENJ-SECBINFHSA-N 429.074 4.715 50 10 IJGE CCOc1cc(C=NNC(N)=O)ccc1OCCOc1ccc(C2CCCCC2)cc1 254556928 XGAIOPKSMJZRFY-UHFFFAOYSA-N 425.529 4.593 50 10 IJGE Cc1cccc(NCC(=O)NN=Cc2cc([N+](=O)[O-])ccc2N(CC(C)C)CC(C)C)c1 254743786 IZCMOHOIKBYKCW-UHFFFAOYSA-N 439.560 4.584 50 10 IJGE ClCc1c(I)cc(I)c2ccsc12 306627129 ZJPJOYMAAXCQBH-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CBr)[C@@H](c2cc(Br)cs2)C1 382700733 CKEJEEJCJFVVCC-ONGXEEELSA-N 425.186 4.856 50 10 IJGE ClCCc1nc2ccc(Br)cc2n1Cc1ccn(Cc2ccccc2)n1 389665898 DNOSPWJKUQDCBZ-UHFFFAOYSA-N 429.749 4.873 50 10 IJGE Clc1ccc(I)c(CN2CCC[C@H](Br)CC2)c1 405349808 TUUCJTJFOCCLMP-NSHDSACASA-N 428.539 4.694 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@@H]1CN(c1cc(CBr)sc1[N+](=O)[O-])C2 702106829 GNUFGDXTCGKOHD-BEFAXECRSA-N 436.375 4.510 50 10 IJGE C[C@@]1(CBr)CCCN1C(=O)c1ccc(Br)cc1Br 723028463 ZRTSOPGZVBLMEC-ZDUSSCGKSA-N 439.973 4.601 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2CCCc3occc3C2)c(-c2ccc(Cl)cc2)n1 809391950 CKPJBKJHGQUFLV-UYRXBGFRSA-N 445.910 4.592 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N[C@H]2CCSc3ccccc32)c(-c2ccccc2)n1 914463482 GRQKJCWSCHTMJQ-SIWPHUPXSA-N 439.544 4.724 50 10 IJGE Cc1cccc(CN(C)C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)c1 914488541 FJVOUIFRGFQHDS-STZFKDTASA-N 443.938 4.991 50 10 IJGE CCCCCCCC(=O)NN=Cc1ccc(OCc2ccc(C(=O)O)cc2)c(OC)c1 1083939924 RRIAUEYXXQEGAC-UHFFFAOYSA-N 426.513 4.783 50 10 IJGE CC(=O)c1cc(Br)ccc1OCC(=O)NN(c1ccccc1)c1ccccc1 1463966165 QKKWNGXTGSSKQD-UHFFFAOYSA-N 439.309 4.900 50 10 IJGE C=CCN(CC=C)C(=O)c1ccc(NC(=O)NNc2cc(F)ccc2Br)cc1 1562263409 NCAJHRGDJPEZKP-UHFFFAOYSA-N 447.308 4.551 50 10 IJGE C=CCn1ncc2ccc(NC(=O)/C(C#N)=C\c3cn(CCC#N)nc3-c3ccccc3)cc21 1636357776 IKHNIGXLRJVXER-STZFKDTASA-N 447.502 4.545 50 10 IJGE CCOc1ccc(C(C)(C)C(=O)NNc2nc3ccccc3[nH]c2=S)cc1OCC 1646017937 WHZZHUJOXDPVLL-UHFFFAOYSA-N 426.542 4.511 50 10 IJGE COc1ccc(C(=O)NN=C2CCCc3oc(C(=O)Oc4cc(C)cc(C)c4)c(C)c32)cc1 1772745750 KBUYCZQGTHIQKO-UHFFFAOYSA-N 446.503 4.903 50 10 IJGE Cc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1ccc(Cl)cc1)C(C#N)=C(N)O2 1865682926 AYCMMIBUBLDZPW-IBGZPJMESA-N 429.282 4.904 50 10 IJGE Cc1nn(Cc2ccccc2F)c2c1[C@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 1865685533 JUYXHXGPCXXYQB-LJQANCHMSA-N 429.282 4.904 50 10 IJGE CCCc1nn(-c2ccccn2)c2c1[C@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 1865686460 WFAUACWESWKUIS-GOSISDBHSA-N 426.307 4.745 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2cccc(Cl)c2)[C@@H]1c1ccncc1 1865699797 CUPQLEYTVFGZGC-HXUWFJFHSA-N 425.879 4.806 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865704895 HECRWOIZDBDRQS-QFIPXVFZSA-N 434.927 4.899 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cccc2ncccc12 1915076666 DBTPNKIMLMSREW-QGZVFWFLSA-N 433.371 4.599 50 10 IJGE FC(F)(F)[C@@H](CBr)NCc1ccc(Br)cc1Br 1943846193 LFHLXZXIZUAZNE-SECBINFHSA-N 439.895 4.627 50 10 IJGE CC(C)(C)OC(=O)N[C@H](Cc1ccc(Br)cc1)C(F)(F)CBr 1951578085 UPVHOEPTBKJTDR-GFCCVEGCSA-N 443.126 4.915 50 10 IJGE CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)CC1(CBr)CCC1 1953585734 YFYYQTLSENIDEC-UHFFFAOYSA-N 425.411 4.969 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1cc(Br)ccc1C#N 2010827840 XJGAYNRSJWXVAX-UHFFFAOYSA-N 432.409 4.639 50 10 IJGE CCC[C@@](C)(CBr)NC(=O)c1cc(Br)ccc1Br 2029942940 AQQCVMLKOJMXRP-ZDUSSCGKSA-N 441.989 4.895 50 10 IJGE O=C(NC[C@@H](Cl)CC(F)(F)F)c1cc(Br)sc1Br 2055502506 LQPPJWFEECUIMV-BYPYZUCNSA-N 429.483 4.563 50 10 IJGE BrC[C@]12CC[C@H]1CN(Cc1cccc(Br)c1Br)C2 2078133627 OATOBIHOMWFZID-FZMZJTMJSA-N 438.001 4.819 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@@H]2CCC[C@H](Cl)[C@H]2C1 2094583818 LTPNHPKYMFNLBR-HGNGGELXSA-N 427.589 4.753 50 10 IJGE Brc1cccc([C@@H](CI)OC[C@H]2CCCCCO2)c1 2096322259 NJCJVRHJHUABTH-HUUCEWRRSA-N 439.131 4.901 50 10 IJGE Cc1ccc(C(=O)N[C@H](C)CCCCCI)c(Br)c1 2117893069 GWTMLHAHLWFAIO-GFCCVEGCSA-N 438.147 4.871 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)[C@@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2162915119 JDWLGMJQPVJDDT-QZTJIDSGSA-N 439.394 4.737 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)N(C[C@H](CBr)C(C)(C)C)CCO2 2163057991 GVRFOQKWNDYMIN-INIZCTEOSA-N 441.410 4.967 50 10 IJGE BrC[C@]12CCC[C@H]1N(C[C@@H]1CC1(Br)Br)CCC2 2213093258 YSMAEBBLLOSYPH-QJPTWQEYSA-N 430.022 4.522 50 10 IJGE BrCCCC1CN(Cc2cc(Br)ccc2Br)C1 2216685193 BPPROTLPGYGFJF-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE Cc1sc(C(=O)N2CC[C@@H](Br)C(F)(F)CC2)c(C)c1Br 2234464116 KXFKCISIOGIELY-SECBINFHSA-N 431.140 4.762 50 10 IJGE COc1ccc(N2CCCN(Cc3ccccc3)CC(F)(F)C2)c(CBr)c1 2235977618 TXOBXOPLKKEBNU-UHFFFAOYSA-N 439.344 4.938 50 10 IJGE C[C@]1(CCBr)CCN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282989799 KFXRKFJYDHJCTA-AWEZNQCLSA-N 427.539 4.879 50 10 IJGE CS(=O)(=O)C1([C@@H](Cl)c2ccc(OCc3ccccc3)cc2Br)CC1 2299499549 YNPFMSFAESEIFX-KRWDZBQOSA-N 429.763 4.885 50 10 IJGE CN(Cc1ccc(Cl)cc1I)[C@@H]1CCC[C@H]1Br 2302326663 RMIVGSBIMLAOMC-DGCLKSJQSA-N 428.539 4.692 50 10 IJGE C[P@]1(=O)C[C@@H](Cl)[C@@H](Cc2ccc(I)c(Br)c2)C1 2306223938 LBEHZVHGRLASRW-VKHBWIJISA-N 447.478 4.826 50 10 IJGE COC(=O)C(C#N)=Cc1cccc(OC(=O)[C@H](C)Oc2ccc(-c3ccccc3)cc2)c1 2314760707 YMDMFWFCMMBZDA-SFHVURJKSA-N 427.456 4.806 50 10 IJGE C[C@H]1CC[C@@H](CBr)N(Cc2ccc(Cl)c(I)c2)C1 2315554536 GHTCVEZICLSEHV-JQWIXIFHSA-N 442.566 4.940 50 10 IJGE BrC[C@@]12CCCC[C@H]1CN(Cc1sccc1I)C2 2316760763 XVXCKBPGEICPBH-SMDDNHRTSA-N 440.188 4.740 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC(=O)C(C#N)=CN(Cc1ccccc1)Cc1ccccc1 2318463007 UZYRRHLEMWKAJV-UHFFFAOYSA-N 442.475 4.652 50 10 IJGE CC(C)[C@H](Cl)C(C)(C)NS(=O)(=O)c1cc(Br)ccc1Br 2366094787 QZMJGSKOORIHOM-LBPRGKRZSA-N 447.620 4.532 50 10 IJGE CC(C)c1ccc(C(=O)NNC(=O)COc2ccc(C(C)C)cc2Br)cc1 10452052 YLUPWZUDGWGWAK-UHFFFAOYSA-N 433.346 4.536 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)/C=C/c3ccccc3)cc2)cc1 12491969 NZMGACZNBYDZPB-GIJQJNRQSA-N 441.531 4.711 50 10 IJGE O=C(COc1ccc(/C=N\NC(=O)c2ccc(Cl)cc2)cc1)Nc1cccc(Cl)c1 58882981 VKTKMRUONKIMNN-MXAYSNPKSA-N 442.302 4.775 50 10 IJGE COc1ccc(F)cc1[C@H](Br)c1csc(I)c1 123461733 BTLMDADNHNFOFT-GFCCVEGCSA-N 427.076 4.985 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1Br)c1cc(Br)ccc1Br 161220556 JMJYKIKQLNEJAF-NWDGAFQWSA-N 439.973 4.648 50 10 IJGE COc1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCc1cc(C)ccc1C 169879702 CDXWPRSMHDNSKB-AFUMVMLFSA-N 433.464 4.563 50 10 IJGE CCOc1ccc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)cc1Br 169890129 NSMOVHUOHKNYKC-CFRMEGHHSA-N 440.341 4.972 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C/c2ccccc2OCC)c(OCC)c1 206999415 QNARZRCPTVOJFR-NKAABVMBSA-N 435.476 4.573 50 10 IJGE CC[C@H](NC(=O)/C(C#N)=C\N[C@@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 217189419 CCDOGXUQFZICQM-QBGPYYQXSA-N 447.579 4.908 50 10 IJGE Cc1ccc2c(c1)c1c3n2CCN(CC(=O)NN=Cc2ccc(C(C)C)cc2)[C@@H]3CCC1 254403190 IPXMQNGZHBPDEF-RUZDIDTESA-N 428.580 4.916 50 10 IJGE ClCc1cc(Br)ccc1N1CC[C@H](N2CCN(Cc3ccccc3)CC2)C1 312717155 UJOVICQRUMZPAK-NRFANRHFSA-N 448.836 4.584 50 10 IJGE COC[C@@H](O[C@H](CI)c1ccc(Br)cc1)C(C)C 404107529 HOYIRFMCIZGVOU-ZIAGYGMSSA-N 427.120 4.613 50 10 IJGE CCC[C@H](CCCl)NS(=O)(=O)c1cc(Br)c(C)cc1Br 716905599 NCLBKWCUQLBCBN-SNVBAGLBSA-N 447.620 4.596 50 10 IJGE C[C@@]1(CBr)CCCN1C(=O)c1scc(Br)c1Br 723027558 SFOCQYJHFLWZDO-NSHDSACASA-N 446.002 4.663 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)Nc2cccc3ocnc23)c(-c2ccc(Cl)cc2)n1 791002287 HEDKRFGOJVYUQR-WJDWOHSUSA-N 442.866 4.804 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2)ccc1O 1084523304 PTGYILQUIOTJMG-UHFFFAOYSA-N 445.519 4.715 50 10 IJGE CCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1cccc(O)c1)C(C#N)=C(N)O2 1865681443 NKUMKDGIGDCMDI-SFHVURJKSA-N 427.291 4.665 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)Oc1cccc2c1C(=O)OC2=O 1865741725 VGCKWFGBOSKDDV-UHFFFAOYSA-N 428.227 4.894 50 10 IJGE Cc1nc(-c2ccc(F)cc2)ccc1C(=O)N/N=C\c1ccc(Br)cc1F 1865760502 ATFXWVUSPOQTKW-MYKKPKGFSA-N 430.252 4.862 50 10 IJGE Cc1ccc(-c2csc(/C(C#N)=C(\O)c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)n2)cc1 1872749540 WCWSGYWYFMPRPP-PYCFMQQDSA-N 448.504 4.813 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1C[C@H]2CN(C(=O)OC(C)(C)C)C[C@@]2(C)C1 1882084949 PMEYSZZCTATQBV-IGMJJTELSA-N 447.414 4.558 50 10 IJGE CN(C[C@@H](CBr)C1CCC1)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 1890233070 DZCOWXGQYACLGZ-RTBURBONSA-N 425.411 4.995 50 10 IJGE C[C@@H](c1cccs1)N(Cc1ccccc1)Cc1cc(Br)cc(C(=O)NN)c1 1915379620 BHABLSYEPCYPJP-HNNXBMFYSA-N 444.398 4.878 50 10 IJGE CCN(C[C@](C)(CI)OC1CC(C)(C)C1)C(=O)OC(C)(C)C 1932710245 LLMQLIOEQSZEQY-KRWDZBQOSA-N 425.351 4.642 50 10 IJGE C[C@H](NC(=O)c1cc(Br)sc1Br)C(C)(C)CBr 1942907451 ODCAOUBJMWGDGC-LURJTMIESA-N 448.018 4.813 50 10 IJGE C[C@@H](Br)CN(Cc1cccc(Br)c1Br)C1CC1 1943886497 ZQSOOCKPZRHPMU-SECBINFHSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@](C)(CI)O2)C[C@H]1C1CCC1 2018371739 OMMWTXWVQMOFSK-KFKAGJAMSA-N 449.373 4.929 50 10 IJGE Cc1ccc(CO[C@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)cc1 2024641617 CESKBFRXMCDHJT-IBGZPJMESA-N 445.341 4.716 50 10 IJGE CC(C)(CBr)CCNCc1ccc(I)c(Cl)c1 2026565272 AAAUOGBXGCHZNP-UHFFFAOYSA-N 430.555 4.845 50 10 IJGE O=C(c1c(Br)cccc1Br)N(CCBr)C1CCC1 2033092604 CKJCRXWHLSHBDN-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE FC1(F)[C@H]2C[C@@](CBr)(Cc3ccc(I)cc3)C[C@H]21 2045492434 LZTIFUOPAIUMHT-CLLJXQQHSA-N 427.070 4.890 50 10 IJGE Cc1cc(Br)c(C)c([C@@H](Cl)C2(C)CS(=O)(=O)C2)c1Br 2136383766 IGZUGIZUIRMFMB-GFCCVEGCSA-N 430.589 4.543 50 10 IJGE CC[C@@]1(CNC(=O)c2ccc(CBr)cc2)CCCN(C(=O)OC(C)(C)C)C1 2162494106 FBDFWBUYAZKPDJ-NRFANRHFSA-N 439.394 4.739 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]2CCC[C@@H]2N1C[C@@H](CBr)c1ccccc1 2164654458 AELCOYANOIHHPM-YRPNKDGESA-N 437.422 4.933 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCCN1C(=O)[C@H](Br)C1CCCC1 2167031582 JCMBXNNZOHULSO-KZNAEPCWSA-N 443.426 4.721 50 10 IJGE CC(F)(F)C[C@@H](CCl)Nc1ncc(C(F)(F)F)cc1I 2169538565 UREYDXREESJMSJ-ZETCQYMHSA-N 428.570 4.770 50 10 IJGE Cc1c(Br)sc([C@@H](Br)c2nn(C)nc2Br)c1C 2214372053 BWMAZEKLYWTWDN-LURJTMIESA-N 443.990 4.503 50 10 IJGE COc1ccc(Br)c(CBr)c1OC[C@@H]1C[C@H]1Br 2214869735 IDCJDEYWXHCUGX-OIBJUYFYSA-N 428.946 4.515 50 10 IJGE Cc1cc(Br)c([C@H](Cl)[C@@H]2CCCS(=O)(=O)C2)c(C)c1Br 2235609006 AOOPMDRXYLWHGU-QMTHXVAHSA-N 444.616 4.933 50 10 IJGE Cc1c(NC(=O)OC(C)(C)C)ccc(C(=O)N(C)C[C@H]2C[C@H](Br)C2)c1C 2268159598 GCMJTEXEWLUFCW-SHTZXODSSA-N 425.367 4.896 50 10 IJGE Cc1c(CBr)cccc1NC(=O)Cc1ccccc1I 2283558437 LETLAJZXBFGEMK-UHFFFAOYSA-N 444.110 4.676 50 10 IJGE CCC[C@H]1CN(C(=O)c2ccc(Cl)c(I)c2)C[C@H]1CCl 2283652327 SVTPFRAJBHKYBP-NWDGAFQWSA-N 426.125 4.672 50 10 IJGE COc1ccc([C@H](Br)Cc2ccccc2OC)cc1I 2284999669 QWHJACAVEVDWJB-CYBMUJFWSA-N 447.110 4.987 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2CCCN(C[C@H](CBr)c3ccccc3)[C@H]2C1 2290276769 UMZVTPBGBULGMD-UFYCRDLUSA-N 437.422 4.887 50 10 IJGE CCCc1cc(C(=O)OC)c(NC(=O)C(C#N)=Cc2c[nH]nc2-c2ccc(C)cc2)s1 2295347951 XLQFFURHWLFJMT-UHFFFAOYSA-N 434.521 4.731 50 10 IJGE CN(Cc1sccc1I)C1(CBr)CC(C)(C)C1 2301072505 YLCKUOQTYUFUQZ-UHFFFAOYSA-N 428.177 4.738 50 10 IJGE C[C@H](Cl)[C@@H]1CCCN1Cc1ccc(I)c(Br)c1 2306218057 WHYPROUWDJEDNE-ZANVPECISA-N 428.539 4.645 50 10 IJGE BrC[C@@H]1[C@H]2CN(Cc3c(Br)cccc3Br)CC[C@@H]12 2311904143 XVDPSXGEYARWJJ-DCAQKATOSA-N 438.001 4.674 50 10 IJGE ClCc1ccc(Br)c(OCc2cccc(I)c2)n1 2319094182 ANLFGFMGKXHTGC-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)cc1OC 2321215879 KRKPJTPBQVVACP-UHFFFAOYSA-N 439.462 4.897 50 10 IJGE CCCCOC(=O)c1ccccc1NC=C(C#N)C(=O)Nc1ccc(Br)cc1 2324084379 DLNYBUIGPIIGMW-UHFFFAOYSA-N 442.313 4.864 50 10 IJGE Cc1ccc(-c2csc(C(C#N)=C(O)CN3C(=O)COc4ccc(Cl)cc43)n2)cc1 2331313509 OKUFQOTXVIOXNC-UHFFFAOYSA-N 437.908 4.990 50 10 IJGE O=C(N[C@H]1CC[C@@H]2C[C@]12CBr)c1cc(Br)c(F)cc1Cl 2359507916 RAVSBVAIYTZLSY-FDHQVAJDSA-N 425.523 4.535 50 10 IJGE C[C@@H]1C[C@H]2C[C@]([C@H](Br)c3cc(I)cc4c3OCC4)(C2)O1 2368505244 MNKXMJGYGGRWMH-HKBFDHSMSA-N 449.126 4.620 50 10 IJGE Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2cccc(OCCc3ccccc3)c2)c1 10331534 VNMWOKMBPFVSCN-UHFFFAOYSA-N 446.547 4.580 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2ccccc2C(C)C)c(OCC)c1 40867329 WUCHUYCAZVFCIU-CPNJWEJPSA-N 437.492 4.663 50 10 IJGE COC(=O)c1cc(N/C=C(\C#N)c2nc(-c3ccc(C)cc3C)cs2)cc(C(=O)OC)c1 102457823 RLVRRLMCIOCYNO-LDADJPATSA-N 447.516 4.977 50 10 IJGE CN(CCCCCBr)C(=O)c1cc(Br)sc1Br 234281469 QGSHVCOUBCHZCA-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE COc1ccc(CC(=O)Nc2cccc(C(C)=NNC(=O)c3cccc(Cl)c3)c2)cc1 254633379 SAVNNRNKQZXYNF-UHFFFAOYSA-N 435.911 4.684 50 10 IJGE O=C(Nc1ccc(I)cc1F)c1ccc(CBr)cc1 697782661 WTPSTFBTINZIDI-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE Cc1cc(C(=O)NNC(=S)Nc2cccc(C)c2C)ccc1NC(=O)c1cccs1 760131674 MVSDEDBCPUIIER-UHFFFAOYSA-N 438.578 4.557 50 10 IJGE CCOc1ccccc1-c1cccc(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)c1 772916464 IUAYBMTVYMLKJS-UHFFFAOYSA-N 439.519 4.978 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)NNc2ccc([N+](=O)[O-])cc2)cc1 775555615 AENKQQMTMBULRW-UHFFFAOYSA-N 439.859 4.673 50 10 IJGE C=CCc1cc(C=NNC(=O)CC[C@@H](O)c2ccccc2)ccc1OCc1ccccc1 1084470099 QFDYVSCEWOULOS-RUZDIDTESA-N 428.532 4.958 50 10 IJGE CC(C)(C(=O)NNc1nc2ccccc2[nH]c1=S)[C@H](O)c1cc(Cl)cc(Cl)c1 1167430781 REQFGBHOWDFPGT-OAHLLOKOSA-N 437.352 4.802 50 10 IJGE C#C[C@@H](NC(=O)NNc1c(C)cccc1Br)c1ccc(Br)cc1 1312936033 FEMZKKSFGXAYEJ-OAHLLOKOSA-N 437.135 4.521 50 10 IJGE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)Cc1cccc2ccccc12 1351943592 UZUTXCOYKGIPOR-SQFISAMPSA-N 428.410 4.532 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cccc(-n3ccnc3O)c2)c(C)n1-c1ccccc1F 1355098584 BSCUTOURHLBVRE-UYRXBGFRSA-N 441.466 4.670 50 10 IJGE CCn1c(O)nc2ccc(C(=O)NNc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc21 1636385804 UXPSOXXRRYFQBT-UHFFFAOYSA-N 432.324 4.556 50 10 IJGE C/C(=C\c1ccc(Cl)cc1)C(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1 1648376286 QPKJTWAGCGBZFK-SAPNQHFASA-N 445.906 4.508 50 10 IJGE Cc1nn(Cc2ccc(F)cc2)c2c1[C@@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 1865686173 RKJBUBJJKDWKDI-IBGZPJMESA-N 429.282 4.904 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2)[C@H]1c1cccc([N+](=O)[O-])c1 1865706037 MFQZIIZCAQBDAE-QFIPXVFZSA-N 449.470 4.725 50 10 IJGE O=S(=O)(c1ccc(Cl)cc1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915165344 LSCAFTHJTNMZMR-SFHVURJKSA-N 428.779 4.704 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@H](CI)O2)C[C@H]1C1CCC1 2018371874 PGNLCWWHODEIAI-TXPKVOOTSA-N 449.373 4.929 50 10 IJGE O=C(N[C@H]1C[C@@H](CCBr)C1)c1csc(Br)c1Br 2021789895 CSVWQIPOROHHDW-KNVOCYPGSA-N 446.002 4.567 50 10 IJGE O=C(N[C@H]1C[C@@H](CCBr)C1)c1cc(Br)c(Br)s1 2021790827 CXTKDBGSMKPKCO-KNVOCYPGSA-N 446.002 4.567 50 10 IJGE CCC[C@@H](Cl)c1cn(-c2ccc(I)cc2Br)nn1 2057420376 HEJLOCIMQJPERM-SNVBAGLBSA-N 440.510 4.714 50 10 IJGE CC(C)(C)OC(=O)N1CC[S@@](=O)(=NC[C@H](CBr)C(C)(C)C)C(C)(C)C1 2069025074 HPHCXFANCNGRBN-SXBQZSJRSA-N 439.460 4.541 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1c(Br)cccc1Br 2081245321 DMCASVTVIOAAKP-LDYMZIIASA-N 441.989 4.751 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(Cl)c(NS(=O)(=O)CCC(CCl)CCl)c1 2106300492 DCMLQAVRFZOKIS-UHFFFAOYSA-N 445.796 4.913 50 10 IJGE CCC[C@@H](CBr)CN1CCOc2ccc(CNC(=O)OC(C)(C)C)cc21 2106785261 OBMDPUPSZSCIOJ-INIZCTEOSA-N 427.383 4.721 50 10 IJGE CN(C(=O)c1cc(Br)c(Br)s1)[C@H](CCCl)C(F)(F)F 2121994360 GYKLKHNCYWYIPQ-SSDOTTSWSA-N 443.510 4.905 50 10 IJGE Fc1ccc(CBr)c(N2CCCN(Cc3ccccc3)CCOCC2)c1F 2144877324 YRAFASDZDXUTJN-UHFFFAOYSA-N 439.344 4.589 50 10 IJGE CCN(C(=O)[C@H](Br)C1CCCC1)[C@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2167032810 OFZUVFJMNPXXFP-FGTMMUONSA-N 445.442 4.872 50 10 IJGE CN(C[C@@H](Cl)C1CCCC1)C(=O)c1cc(Cl)ccc1I 2167648402 VPVYXZVNEATOPO-CYBMUJFWSA-N 426.125 4.814 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C[C@H](CBr)CC2CC2)C1 2185502005 PQWSPNNPTALAJW-JKSUJKDBSA-N 441.414 4.747 50 10 IJGE Cc1sc(C(=O)N2CC(F)(F)C[C@]2(C)CBr)c(Br)c1C 2237610775 DJKLGANYCGQZJG-GFCCVEGCSA-N 431.140 4.762 50 10 IJGE Sc1nc2cc(Br)c(Br)cc2n1[C@H]1C[C@H](Br)C1 2252704963 MOMUCTKEIDHVTR-IZLXSQMJSA-N 440.986 4.948 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1CBr)c1cc(F)c(Br)cc1Cl 2282982609 LBIJNZDAOQYUEN-AMIZOPFISA-N 427.539 4.925 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@H]2C[C@H]1CC[C@@H]2Br 2285843606 AXWAVDHVBBBKPY-MRTMQBJTSA-N 425.523 4.630 50 10 IJGE O=S1(=O)CCC[C@H]1[C@@H](Cl)c1ccc(OCc2ccccc2)cc1Br 2299534087 ZWKSZACDBTWOJG-ROUUACIJSA-N 429.763 4.885 50 10 IJGE CCOC(=O)c1ccc(CNC=C(C#N)C(=O)N[C@@H](CC)c2ccc3c(c2)CCCC3)cc1 2318466974 BFJXXEBYJRUMKG-VWLOTQADSA-N 445.563 4.507 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H]2C[C@@H]3CBr)c(I)c1 2318524838 SQECZVSKQWJOEB-QKCSRTOESA-N 440.550 4.692 50 10 IJGE CN(C[C@@]1(CBr)CC1(F)F)C1(CNC(=O)OC(C)(C)C)CCCCC1 2326917673 SBSVCGFEXLHXCG-INIZCTEOSA-N 425.358 4.566 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@@H]1CCC[C@H](C(F)(F)F)C1 2343414618 QCAQKYUXQBNMKO-IXDOHACOSA-N 436.312 4.842 50 10 IJGE CC(C)(C)OC(=O)N1CCO[C@]2(CCCN(C[C@@](C)(CBr)C(C)(C)C)C2)C1 2380192446 QGJQVAWFPGEXRH-RTWAWAEBSA-N 447.458 4.536 50 10 IJGE Cc1ccc(C)c(-n2c(SCC(=O)NN)nc(-c3ccccc3)c2-c2ccccc2)c1 35666765 IKNRATFEIACWTN-UHFFFAOYSA-N 428.561 4.905 50 10 IJGE COc1ccc(C(=O)[C@@H](Br)[C@H](Br)c2ccc(OC)cc2)cc1 105418957 DTAHPGMKUAKDKW-CVEARBPZSA-N 428.120 4.786 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Br)c3ccc(Cl)cc3F)cc2[nH]1 109884260 IWSWAUSJBPAZTE-ZDUSSCGKSA-N 434.490 4.896 50 10 IJGE COc1ccc(/C=N\NC(=O)c2ccc3nc(N)sc3c2)cc1OCc1ccc(C)cc1 169916708 MUFBJHYJVUCTSM-ZMFRSBBQSA-N 446.532 4.538 50 10 IJGE CCOc1cc(/C=C2\C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)ccc1OCCC(C)C 214319920 GHQXKXYEANEMOM-BKUYFWCQSA-N 448.519 4.896 50 10 IJGE CC(=NNC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(C)cc1)c1cccs1 254383568 BTYQIFUPQDYUOV-UHFFFAOYSA-N 447.589 4.937 50 10 IJGE Cc1cccc(OCC(=O)NN=Cc2c(OC(=O)c3ccccc3)ccc3ccccc23)c1 254496831 DDMCLODXMPQZAC-UHFFFAOYSA-N 438.483 4.897 50 10 IJGE C[C@H](Br)C[C@H]1CCCN1c1ncc(Br)cc1Br 304588314 RPGRCOFSYHAZLY-WCBMZHEXSA-N 426.978 4.749 50 10 IJGE C[C@@H]1CCCN(C(=O)c2ccc(I)c(Cl)c2)[C@H]1CCCl 697196121 YJZYKKCRHUUBDV-YGRLFVJLSA-N 426.125 4.814 50 10 IJGE O=C(Nc1nc2c3c(ccc2s1)CCCC3)C(=O)NN(c1ccccc1)c1ccccc1 782821928 WAVMBSWWQFDZLF-UHFFFAOYSA-N 442.544 4.983 50 10 IJGE Cc1cc(C=NNC(=O)c2ccc(Cl)cc2)c(C)n1-c1ccc(C(=O)O)c(Cl)c1 1084273499 ZPWHZTDJAJZHBQ-UHFFFAOYSA-N 430.291 4.863 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2ccc3nc(O)n(C)c3c2)c(C)n1-c1cccc(Cl)c1 1296832660 SHMULCDVXMPOEC-YVLHZVERSA-N 445.910 4.886 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1cc2c(s1)CCCCCC2)c1ccccc1OC(F)F 1306191815 MKSQZIZPSJXEFZ-OWBHPGMISA-N 434.508 4.873 50 10 IJGE CN1C[C@H](CI)[C@H](c2cc(C(F)(F)F)ccc2Br)C1 1614693899 MMVPUZUZJIKCFL-GZMMTYOYSA-N 448.064 4.548 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNC(=S)Nc1cccc(Cl)c1 1624299072 IWNZQTVSBSIXLJ-UHFFFAOYSA-N 429.851 4.555 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@@H](c1cc(C)ccc1O)C(C#N)=C(N)O2 1865687587 VMIVPBOYDQWQDD-QHCPKHFHSA-N 428.536 4.733 50 10 IJGE CCCc1nn(C)c2c1[C@H](c1ccc(N(CC)Cc3ccccc3)cc1)C(C#N)=C(N)O2 1865707350 VBVDVTAOQGSHTG-HSZRJFAPSA-N 427.552 4.617 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)NNC(=O)c1ccc(CSC(C)C)o1 1865759882 WYEUYKKKTOCGSZ-UHFFFAOYSA-N 445.491 4.645 50 10 IJGE CCC[C@@H]1C[C@H]1CO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1897635446 OEIWAAXXSZAOAK-VKJFTORMSA-N 437.362 4.644 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CCC[C@@H]2C[C@@H]21)C(=O)OC(C)(C)C 1898107062 JFQMFADOBGXJSJ-FSZRXZPDSA-N 437.362 4.642 50 10 IJGE N#C[C@@H]1CN(c2ccc(CBr)cc2Br)CCN1Cc1ccccc1 1914889122 CPULCKHBPLZGMH-QGZVFWFLSA-N 449.190 4.558 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@]2(CC[C@@](C)(CI)O2)C1 1939622038 XZAGPEWGANENJW-WBAXXEDZSA-N 437.362 4.834 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCCC1COC1 1998054715 OLPLXHYDKNGNFO-UHFFFAOYSA-N 428.946 4.522 50 10 IJGE CC(F)(F)C[C@H](CCl)Nc1ncc(I)cc1Br 2015758644 KRJUICBQSBZBEJ-SSDOTTSWSA-N 439.469 4.513 50 10 IJGE FC1(F)CC(CO[C@@H](CI)c2ccccc2Br)C1 2035118069 CSPPXKJOPAMIRG-LBPRGKRZSA-N 431.058 4.987 50 10 IJGE BrC[C@@]1(Cc2ccc(Br)cc2Br)C[C@@]12CCOC2 2039024884 PDDSLEBFTQGUAZ-ZIAGYGMSSA-N 438.985 4.946 50 10 IJGE CC(C)[C@H](CBr)CN=[S@@](C)(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C 2044705871 ORFXXRWFXGZAEK-XESHVACXSA-N 441.476 4.691 50 10 IJGE BrC[C@]12CC[C@H]1CN(Cc1ccc(Br)cc1Br)C2 2078136076 XOLJILJODADAIK-FZMZJTMJSA-N 438.001 4.819 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@]2(C)COCCO2)cc1Br 2078515410 CCWVSHHVRQIUTJ-STQMWFEESA-N 442.973 4.762 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@@H](CN(C)C(=O)OC(C)(C)C)C1 2106783020 WCVXMUNHLCYJFP-KRWDZBQOSA-N 435.447 4.536 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1Cc2ccccc2N(C[C@H](Br)C(F)(F)F)C1 2106783716 CCIZRRGJNGKJPC-DOMZBBRYSA-N 437.300 4.516 50 10 IJGE CC(C)(C)OC(=O)N1CC[S@](=O)(=NCc2ccc(CBr)cc2)C(C)(C)C1 2132804998 QNYKWFONBJTKIE-AREMUKBSSA-N 445.423 4.579 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@@H](CCl)C12CCC2 2133814564 ZJORKQFMCPVWBQ-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE O=S(=O)(c1ccc(CCl)cc1Cl)N(Cc1ccccc1)CC1CCOCC1 2152170805 UUTIVAPAXXJDMC-UHFFFAOYSA-N 428.381 4.696 50 10 IJGE CCCN(CC(C)(C)CNC(=O)OC(C)(C)C)C(=O)c1ccc(CBr)cc1 2163051590 UZMFGYLHLCCIDX-UHFFFAOYSA-N 441.410 4.985 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@H]1CCCN(C[C@@H](CBr)CC2CC2)C1 2185501998 PQWSPNNPTALAJW-CVEARBPZSA-N 441.414 4.747 50 10 IJGE CC(C)(C)OC(=O)N1CC2(CCCC[C@@]23CCC[C@@H](CI)O3)C1 2211826887 YFEPRTXENRVHPL-KBXCAEBGSA-N 435.346 4.540 50 10 IJGE O=C(Cc1ccc(Br)cc1Cl)N[C@@H](CBr)c1cccs1 2237442467 YRFJZCNSIQVQHG-LBPRGKRZSA-N 437.584 4.959 50 10 IJGE Cc1sc([C@H](Br)[C@@]23CCC[C@@H]2CS(=O)(=O)C3)c(Br)c1C 2279098729 YPNFBNACAKYXJP-DDTOSNHZSA-N 442.238 4.778 50 10 IJGE COC[C@@]1([C@@H](Br)c2ccc(OC)c(Cl)c2Br)CCCO1 2283559423 GIMZCXXRXSLUQU-UONOGXRCSA-N 428.548 4.743 50 10 IJGE O=C(NC[C@H]1CCCC[C@H](Cl)C1)c1ccc(Cl)c(I)c1 2283661105 FEGLJQAYWHCRJK-JQWIXIFHSA-N 426.125 4.862 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2Cc3ccccc3O2)cc1I 2284998059 JPHWEYLIAXQRRT-HZPDHXFCSA-N 445.094 4.740 50 10 IJGE Cc1nn(-c2ccccc2)c(O[C@@H]2CCN(Cc3ccccc3)C2)c1CBr 2287642438 DWJNJYNVFCVWNX-HXUWFJFHSA-N 426.358 4.729 50 10 IJGE O=C(NN=Cc1c(Cl)cccc1Cl)C(=Cc1ccccc1)NC(=O)c1ccccc1 2297456329 ABWWNTYHQDSKEH-UHFFFAOYSA-N 438.314 4.915 50 10 IJGE ClC[C@@H]1CCCC[C@@H]1NCc1ccc(I)c(Br)c1 2325210660 AJHIEDFRANAHFA-FZMZJTMJSA-N 442.566 4.941 50 10 IJGE N#CC(=C(O)CNC(=O)c1ccccc1)c1nc(-c2ccc(Br)cc2)cs1 2331260012 FLGCTCIGBGQREI-UHFFFAOYSA-N 440.322 4.795 50 10 IJGE CCOc1ccccc1OCC(O)=C(C#N)c1nc(-c2ccc3c(c2)OCCO3)cs1 2331330759 FLJYONIDVAQCQG-UHFFFAOYSA-N 436.489 4.852 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CC2CCN(CC3CC(Br)C3)CC2)CC1 2335923333 SSLREMZSTHPGCI-UHFFFAOYSA-N 429.443 4.909 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CCC[C@@]3(CNC(=O)OC(C)(C)C)C2)C1 2345004574 MIXPRSJCIREXIO-IIBYNOLFSA-N 429.443 4.815 50 10 IJGE Clc1ccc(CN(CCCBr)C2CCOCC2)cc1Br 2381162652 IOXZRYCMFHYMAO-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE Cc1ccccc1C(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1 12578878 VJFHOOHSLWATSN-UHFFFAOYSA-N 442.302 4.629 50 10 IJGE C=CCOc1ccc(C(=O)NNC(=O)[C@@H](CC)Oc2ccc(-c3ccccc3)cc2)cc1 14768911 HPOZBYWUKYRHTO-XMMPIXPASA-N 430.504 4.537 50 10 IJGE Cc1ccc[n+]([C@H]2C(=O)N(CCc3ccccc3)C(O)=C(C#N)[C@@H]2c2ccc(Cl)cc2)c1 20407924 YBZMNNWTJUAKIP-BJKOFHAPSA-O 444.942 4.639 50 10 IJGE COc1ccc(Cl)cc1-n1c(C)cc(/C=N\NC(=O)CC[C@H](O)c2ccccc2)c1C 58890551 ROECMROWHBBQCY-XPUNOZPZSA-N 439.943 4.720 50 10 IJGE O=C1/C(=N/NC(=O)C23CC4CC(CC(C4)C2)C3)c2ccccc2N1C/C=C/c1ccccc1 59156471 AUYDXBZWRHVONT-JFTHWGFASA-N 439.559 4.783 50 10 IJGE CC(C)C[C@H](CBr)NC(=O)c1cc(Br)c(Br)s1 122675616 CWTQTHMCVIMHCR-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE CC(C)n1c(CBr)nnc1-c1cc(Br)ccc1Br 161341062 YLBWFNPZAZIKMU-UHFFFAOYSA-N 437.961 4.946 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)/C(C#N)=C\Nc1cccc(Br)c1 217186206 ABEXBBVZCJVPPE-NWCRWOLESA-N 428.330 4.853 50 10 IJGE C[C@@H]1CC[C@H](CBr)CN1c1ncc(Br)cc1Br 688663831 IIZNUDUMGKPSLK-RKDXNWHRSA-N 426.978 4.606 50 10 IJGE CCO[C@@H](CO[C@@H](CI)c1ccc(Br)cc1)C1CC1 703470738 NYWNVDZCMKUYSB-GJZGRUSLSA-N 439.131 4.757 50 10 IJGE Cc1ccnc2c1nc(CCl)n2CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 705869385 KVUBZFYPNQWAMB-UHFFFAOYSA-N 446.982 4.950 50 10 IJGE Fc1ccc2nc(CCCl)n(CC3CN(Cc4ccccc4)C3)c2c1Br 716245828 WXRBKDPSZJIPQX-UHFFFAOYSA-N 436.756 4.851 50 10 IJGE CC[C@@H](C[C@@H](C)Cl)NC(=O)c1cc(I)ccc1Br 716927249 UVXABHPBJOOFKT-SCZZXKLOSA-N 444.538 4.580 50 10 IJGE O=C(N[C@@H](CBr)C1CCC1)c1cc(Br)ccc1Br 717610990 ACPUSJMQABKAAS-LBPRGKRZSA-N 439.973 4.505 50 10 IJGE COc1ccc(-c2cc(N)c(C(=O)NN=C(C[C@@H]3CCOC3)c3ccccc3)s2)cc1 753923969 PCRQWUCUBIHLCF-INIZCTEOSA-N 435.549 4.567 50 10 IJGE CCCN(CCC)C(=O)c1cccc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1 799746027 TUQHYWBQRQGFKN-UHFFFAOYSA-N 432.446 4.596 50 10 IJGE CC(=O)Nc1ccc(C(=O)NN=Cc2ccc(OCc3c(C)cccc3Cl)o2)cc1 1084516543 YDWKDHDVOGGJQY-UHFFFAOYSA-N 425.872 4.543 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1cc2c(s1)CCCCCC2)c1ccccc1OC(F)F 1306191819 MKSQZIZPSJXEFZ-WYMLVPIESA-N 434.508 4.873 50 10 IJGE CC(=O)c1cc(C#N)ccc1NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccccc2F)c1C 1436276225 WMSWADUAKBNHMD-UDWIEESQSA-N 426.451 4.853 50 10 IJGE C#C[C@@H](NC(=O)NNc1c(Cl)cc(F)cc1Cl)c1ccc(Br)cc1 1683507367 BXRWTEMAOBNGLO-CQSZACIVSA-N 431.092 4.896 50 10 IJGE C#C[C@@H](NC(=O)NNc1ccc(Br)cc1Cl)c1ccc(Cl)cc1F 1683516485 AYONNCPRCGPDFS-CQSZACIVSA-N 431.092 4.896 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865712958 MVMPPHFYFBTQNR-JOCHJYFZSA-N 437.459 4.714 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)CCC(=O)c3ccc(Cl)cc3)c(C)n2)cc1 1865758491 CTBUKXKUEYZBOX-UHFFFAOYSA-N 449.938 4.697 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)CCc1cc(F)ccc1C(F)F 1900674682 VPHLKZFQVCSAGO-LBPRGKRZSA-N 426.232 4.756 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)[C@@H](C)CBr)cc1Br 1914228843 OUPMKJUQNVCZIJ-ZDUSSCGKSA-N 441.163 4.884 50 10 IJGE COc1cccc(Br)c1C(=O)N(Cc1ccccc1)C[C@H](C)Br 1914606726 BIMXXTRFICJPBH-ZDUSSCGKSA-N 441.163 4.884 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)c1ccc(S(=O)(=O)C(F)(F)F)cc1 1914651050 LKODZZHRBRECJA-ZDUSSCGKSA-N 436.293 4.770 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)c1ccc(S(=O)(=O)C(F)F)cc1 1915081196 FXSZULBQZBNGTC-OAHLLOKOSA-N 432.330 4.863 50 10 IJGE O=S(=O)(c1cccc(Br)c1)N(Cc1ccccc1)[C@@H](CCl)C1CC1 1915218268 ZEHHQCUWOBPTKS-SFHVURJKSA-N 428.779 4.657 50 10 IJGE O=C(N[C@@H](CCBr)C1CC1)c1cc(Br)sc1Br 1942802337 ADTAKVWMEJEHGV-QMMMGPOBSA-N 446.002 4.567 50 10 IJGE CC[C@H](CBr)CN1C[C@H](CC)N(C(=O)OCc2ccccc2)C[C@@H]1CC 1977883686 FXCXEGHOHPXBIE-HOJAQTOUSA-N 425.411 4.919 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1Cc1cccc(Br)c1Br 2018116071 YGUPTMGOIDUOBR-CABZTGNLSA-N 425.990 4.959 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1cc(Br)sc1Br 2023035375 IUGWOKGGXDRCRD-HTRCEHHLSA-N 448.018 4.813 50 10 IJGE O=C(NCC[C@@H](Br)C1CC1)c1cccc(Br)c1Br 2031482607 UYCFGXSCZFVTFE-SNVBAGLBSA-N 439.973 4.505 50 10 IJGE CCOc1cccc(-n2nc(CBr)c(Br)c2C(F)(F)F)c1 2079234502 YEEADWRGBOLTFS-UHFFFAOYSA-N 428.046 4.947 50 10 IJGE CC[C@H](Cl)[C@H](CC)NC(=O)c1ccc(Br)cc1I 2086152268 ZFDSVPJYRMDKDD-JQWIXIFHSA-N 444.538 4.580 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1cccc(Br)c1Cl 2090388976 XXZTWIITVHMPBX-VIFPVBQESA-N 429.605 4.739 50 10 IJGE ClCCc1nc2cncc(Br)c2n1Cc1ccsc1Br 2151789512 IJWCMFHWPYUROH-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE Cc1sc([C@H](Br)c2ccc3c(c2)CCS3(=O)=O)cc1Br 2170065687 CMWLGGQZCPGPRL-CQSZACIVSA-N 436.190 4.633 50 10 IJGE CC(C)C(CC(CBr)(CBr)[C@H]1CCS(=O)(=O)C1)C(C)C 2189104527 JVLVOGQJOAAASK-ZDUSSCGKSA-N 432.262 4.516 50 10 IJGE CN(C[C@@]1(C)CSCCO1)c1c(CBr)ccc(Br)c1Cl 2201245706 QNWCDYTWVKGXBT-AWEZNQCLSA-N 443.632 4.956 50 10 IJGE Cc1cc(C(=O)N2CCC(CBr)(C(F)F)CC2)sc1Br 2289932883 CFKVHLNUZFZXHO-UHFFFAOYSA-N 431.140 4.701 50 10 IJGE N#CC(=CNc1ccc(Br)cn1)C(=O)NC(c1ccccc1)c1ccccc1 2324837750 IOSHNMGHQKEFES-UHFFFAOYSA-N 433.309 4.569 50 10 IJGE CN(CC1(CBr)CC(C)(C)C1)[C@@H]1CCN(C(=O)OC(C)(C)C)CC12CC2 2345007654 DKYKIQNALWMODE-MRXNPFEDSA-N 429.443 4.909 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@H]1CCl 2362373677 PZPKWIPSMRAJBB-NXEZZACHSA-N 438.058 4.794 50 10 IJGE C[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2I)[C@H]1CCCl 2365593190 SNYCBVXOYVHZMF-YGRLFVJLSA-N 426.125 4.814 50 10 IJGE CCOc1ccc(/C=C2\CN(C)CC3=C2OC(N)=C(C#N)[C@H]3c2ccc(OCC)cc2)cc1 19898852 IMALPVYECIGASW-FECOFQHFSA-N 443.547 4.575 50 10 IJGE C[C@H](Oc1ccc(F)cc1)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccc(F)cc1 38652815 YELBSFLTWXFIEP-LFVRLGFBSA-N 448.425 4.556 50 10 IJGE Cc1ccccc1C(=O)NNc1ncnc(Nc2cc(C(F)(F)F)ccc2Cl)c1N 40682676 KCPTXNORYYPQNV-UHFFFAOYSA-N 436.825 4.540 50 10 IJGE Cc1occc1C(=O)N/N=C1\CCCc2oc(C(=O)NCc3ccccc3Cl)c(C)c21 40823359 GRLKAOCEDHYNDR-NLRVBDNBSA-N 439.899 4.543 50 10 IJGE CCOc1cc(/C=N/NC(=O)COc2cc(C)c(Br)cc2C(C)C)ccc1O 40910686 UUMKKDXKQPJGJF-FOKLQQMPSA-N 449.345 4.514 50 10 IJGE COc1ccc(/C=N/NC(=O)c2ccc(-n3c(C)ccc3-c3ccccc3)cc2)cc1O 59304895 SKJMFEZXYODONY-WPWMEQJKSA-N 425.488 4.931 50 10 IJGE CCN(CC)c1ccc(/C=N/NC(=O)CCCNc2ccc(Br)cc2)cc1 59507545 GNTMYRWZHCZYHN-LFVJCYFKSA-N 431.378 4.638 50 10 IJGE [C-]#[N+][C@@H](c1cc(Br)ccc1Br)S(=O)(=O)c1ccc(C)cc1 138944995 FFMQACPADAVUQK-OAHLLOKOSA-N 429.133 4.912 50 10 IJGE Cc1cc(S(=O)(=O)N(CCBr)C2CCCCC2)sc1Br 147341967 KZCALXSIWZNENF-UHFFFAOYSA-N 445.242 4.537 50 10 IJGE Cc1ccc(Cl)cc1NC(=O)/C(C#N)=C\Nc1ccc(I)cc1 217214841 ORUPPXVHJATVOO-BENRWUELSA-N 437.668 4.711 50 10 IJGE CCC(CC)(CBr)NC(=O)c1ccc(I)c(Cl)c1 232349314 YUHNSCMEDSHVCK-UHFFFAOYSA-N 444.538 4.628 50 10 IJGE CCn1c(SCC(=O)NN=Cc2ccc(-c3ccccc3)cc2)nnc1-c1ccccc1 254743125 NUDQITUAOWTWLJ-UHFFFAOYSA-N 441.560 4.874 50 10 IJGE C[C@@H](Br)c1cnnn1-c1c(Br)cc(Cl)cc1Br 310434622 NZZLMYZKFPOSDS-RXMQYKEDSA-N 444.352 4.902 50 10 IJGE CN(C[C@@H](Br)C1CC1)C(=O)c1cc(Br)sc1Br 690269511 ZEEXJAGSLVRLND-MRVPVSSYSA-N 446.002 4.519 50 10 IJGE Cc1sc(Br)cc1[C@H](Br)c1nn(C)cc1Br 693101979 QHGULFZHELKTDN-VIFPVBQESA-N 428.975 4.799 50 10 IJGE ClCc1cc(Br)ccc1N1CC[C@]2(CN(Cc3ccccc3)CCO2)C1 717596577 YUNQGZQZZVEBIV-NRFANRHFSA-N 435.793 4.669 50 10 IJGE O=C(NNC(=O)[C@@H](Sc1ccc(F)cc1F)c1ccccc1)c1cccc2cccnc12 729972332 WQXGABBBPNAUFP-QFIPXVFZSA-N 449.482 4.808 50 10 IJGE O=C(NNc1nc(-c2ccc(Cl)cc2)no1)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 741220004 OSSUTURYNGWBOS-KGLIPLIRSA-N 438.793 4.535 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)Nc1ccc(-c2nnc3n2CCCCCC3)cc1 769941075 BUFGKAAUMJCVJL-UHFFFAOYSA-N 430.434 4.628 50 10 IJGE C[C@@H](OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)c1nc2ccccc2o1 781831154 CRLTTYIGJLFDKH-GMYFBSLISA-N 437.459 4.816 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1S[C@H](C)C(=O)NN=C(C)CC(C)C 1083891729 BBBBZQWOHRLHRW-MRXNPFEDSA-N 449.024 4.748 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2sc3cccc(F)c3c2Cl)c1C 1306591010 QAUZMKKKFDDDLT-UHFFFAOYSA-N 427.892 4.920 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(F)cc2)[C@@H]1c1ccc(Cl)cc1 1865684359 XKKDBDXAZQLPML-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE CC(C)c1nc(Nc2ccc(SC#N)cc2)cc(N2CCO[C@@H](c3cccnc3)C2)n1 1868231318 CFZNMTXNFRVNFU-HXUWFJFHSA-N 432.553 4.890 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C(=O)NC[C@@H]2C[C@H]2Br)cc1C(F)(F)F 1887785008 XUDQMKGSKSUMMQ-CMPLNLGQSA-N 437.256 4.566 50 10 IJGE O=C(NC1(C(F)(F)F)CCC(Br)CC1)c1sccc1Br 1924694248 MXZHNHBGPJGDML-UHFFFAOYSA-N 435.103 4.879 50 10 IJGE BrCC[C@@H]1CCCN1Cc1ccc(Br)cc1Br 1943840742 DKDBWWDGQRPVRB-LBPRGKRZSA-N 425.990 4.961 50 10 IJGE FC(F)COCOc1c(Br)cc(CBr)cc1Br 1944235089 IIOMZDZAJOTZFY-UHFFFAOYSA-N 438.888 4.725 50 10 IJGE CN(Cc1ccccc1)C1CN(c2cc(Br)cc(F)c2CBr)C1 1980878158 VBCLAXXHFUTENY-UHFFFAOYSA-N 442.170 4.804 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1Br)c1c(Br)cccc1Br 2033081484 FXGSIJFOQDKLHJ-KWQFWETISA-N 439.973 4.648 50 10 IJGE CCC[C@@](C)(CBr)NC(=O)c1c(Br)cccc1Br 2033091054 MQSGIXANTXJTCM-ZDUSSCGKSA-N 441.989 4.895 50 10 IJGE O=C(NC1CC2(C1)CN(C[C@H](CBr)c1ccccc1)C2)OCc1ccccc1 2044705024 IETZIKRLMXUYMA-FQEVSTJZSA-N 443.385 4.556 50 10 IJGE CC[C@@H](Cl)CCCNC(=O)c1ccc(Br)cc1I 2086150424 BAZYNMQWTXWWAX-SNVBAGLBSA-N 444.538 4.581 50 10 IJGE CCC(CC)(CBr)CN1C[C@@H](CNC(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1 2106783774 COBWLEDGNFHTNF-KGLIPLIRSA-N 445.364 4.823 50 10 IJGE BrC[C@]12CCC[C@@H]1N(C[C@@H]1CC1(Br)Br)CCC2 2213093260 YSMAEBBLLOSYPH-SDDRHHMPSA-N 430.022 4.522 50 10 IJGE COCC1([C@@H](Br)Cc2cc(Br)cc(Br)c2)CC1 2252836896 HYLVRHGJWVIVHN-LBPRGKRZSA-N 426.974 4.944 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 2274219770 ICCPFUBNWXOVFU-ZWKOTPCHSA-N 425.411 4.742 50 10 IJGE CC(C)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCN(CC1(CBr)CC(F)C1)CC2 2280360376 UEBNVCUICIFVKD-GNZRSQJKSA-N 447.433 4.857 50 10 IJGE CCOc1ccc(C=C2CN(C)CC3=C2OC(N)=C(C#N)[C@H]3c2ccc(OCC)cc2)cc1 2296910953 IMALPVYECIGASW-RUZDIDTESA-N 443.547 4.575 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)c(I)c2)[C@H]1CBr 2300240119 IIFMWZOPXGXZNS-LBPRGKRZSA-N 428.539 4.550 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=Cc2ccc(-c3ccc(C)cc3[N+](=O)[O-])o2)cc1 2314571713 KRDKZECKVVJDCW-UHFFFAOYSA-N 445.431 4.886 50 10 IJGE CNC(=O)C(C#N)=C1S[C@H](Cc2ccccc2Cl)C(=O)N1c1ccc(C(C)C)cc1 2314592935 DSTMRUIZPMYUSH-HXUWFJFHSA-N 439.968 4.636 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)COc2cc(C)ccc2C(C)C)c(OC)c1 2314729012 RJZKWORQONOANL-UHFFFAOYSA-N 437.492 4.582 50 10 IJGE CCCN(C[C@@H](C)Br)C(=O)c1ccc(Cl)cc1I 2317776271 UUPOURPHZMJGAQ-SECBINFHSA-N 444.538 4.580 50 10 IJGE CC(C)(C)c1nc(C(=O)N[C@@H](CCBr)COCc2ccccc2)cs1 2320362116 SONQXPHCIASPJL-HNNXBMFYSA-N 425.392 4.541 50 10 IJGE CCc1ccc(-c2csc(C(C#N)=C(O)[C@@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1 2331245431 KWSRXCYLPROIJB-CQSZACIVSA-N 429.501 4.850 50 10 IJGE COCCCCN(Cc1ccccc1)c1c(CBr)c(C(F)(F)F)nn1C 2339729197 RFRASXJSIINEMX-UHFFFAOYSA-N 434.300 4.767 50 10 IJGE Cc1cc(C(=O)N2CC[C@H](Br)C[C@@H]2C(F)(F)F)c(Br)s1 2361459960 BIGRQGIWPJKSIQ-IONNQARKSA-N 435.103 4.749 50 10 IJGE CN(C)c1ccc(/C=N/NC(=O)c2[nH]c3ccc([N+](=O)[O-])cc3c2-c2ccccc2)cc1 3644503 JQEKTHYHDDFQGW-MFKUBSTISA-N 427.464 4.573 50 10 IJGE COc1ccc(/C(C#N)=C\c2cccc(OC(=O)Cc3ccc(OC)c(OC)c3)c2)cc1 31903199 JYQMAHIYRWKDNE-BKUYFWCQSA-N 429.472 4.925 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccco4)ccc32)cc1 38650796 IRDDCISTFNAXLN-QHCPKHFHSA-N 430.460 4.896 50 10 IJGE O=C(NNc1ncnc(Nc2ccccc2Cl)c1[N+](=O)[O-])c1cccc2ccccc12 40648158 PDWILRIBTOUJNJ-UHFFFAOYSA-N 434.843 4.692 50 10 IJGE Cc1c(C(=O)Oc2ccccc2)oc2c1/C(=N/NC(=O)c1ccc3ccccc3n1)CCC2 40825920 WYNUMYBXQDSIIK-VFCFBJKWSA-N 439.471 4.826 50 10 IJGE C#CCOc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2Cl)cc1Br 59166932 DMSNICDZMAFWGX-UFFVCSGVSA-N 426.097 4.532 50 10 IJGE O=C(CBr)c1nc(NCc2ccccn2)c2c(-c3ccccc3)cccc2n1 116369512 LIPDHGYREMQKBP-UHFFFAOYSA-N 433.309 4.882 50 10 IJGE O=C(N[C@H](CBr)Cc1ccccc1)c1cc(Br)ccc1Cl 122470325 JPHXFRRQRGTRNZ-ZDUSSCGKSA-N 431.555 4.839 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2ccc(OC)cc2)sc2c1CC[C@H](CC)C2 209406520 NFTPQYXLHDZGNG-ZKMNFCBKSA-N 438.549 4.994 50 10 IJGE O=C(c1cc(Cl)ccc1I)N(CCCl)Cc1ccccc1 236023983 MYCGFUSUKGFZIL-UHFFFAOYSA-N 434.104 4.826 50 10 IJGE O=C(NN=Cc1c(O)ccc2ccccc12)c1cc(-c2ccc3c4c(cccc24)CC3)n[nH]1 254735859 AEOHOPYJFLNMTK-UHFFFAOYSA-N 432.483 4.951 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCC[C@@H]1CCBr 304570211 OZYGNVBGMZXGEH-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE CC[C@H](Br)[C@@H](CC)NC(=O)c1ccc(I)c(Cl)c1 313081025 ILBPJNOFDALHJM-JOYOIKCWSA-N 444.538 4.627 50 10 IJGE ClCCc1nc2cc(Br)ccc2n1[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 398475425 YSPDUNMBHMWYGK-LFUKPOHLSA-N 430.777 4.883 50 10 IJGE CC(C)(C)OC(=O)NCCN1CCN[C@@H](c2ccc(CO[Si](C)(C)C(C)(C)C)cc2)C1 616656908 UZLNYMAURFQPIX-OAQYLSRUSA-N 449.712 4.679 50 10 IJGE COC(=O)[C@@]1(C2CC2)C[C@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 688654894 SKCMDIFLVOEBIE-CVDCTZTESA-N 433.621 4.741 50 10 IJGE N#Cc1ccc(NNC(=O)c2csc(COc3ccc(F)cc3)n2)c(C(F)(F)F)c1 799746859 KUWXCOCYIAIXSF-UHFFFAOYSA-N 436.390 4.509 50 10 IJGE C=CCc1cc(CNC(=O)/C(C#N)=C/c2cc(C)n(CC(C)C)c2C)cc(OC)c1OC 1264831298 SGWHKAAZJUUHRQ-YDZHTSKRSA-N 435.568 4.730 50 10 IJGE CC(=O)c1ccc(CCNC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C)c3)c2C)cc1 1446729925 KAIAJAAXZAQORR-PCLIKHOPSA-N 425.532 4.871 50 10 IJGE COc1ccc(CC(=O)Oc2ccc(/C=C(\C#N)c3ccccc3OC)cc2)cc1OC 1615099310 AZTAUKVETFJSMW-XSFVSMFZSA-N 429.472 4.925 50 10 IJGE Cc1ccc(O)c([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccc(Cl)cc2)c1 1865687395 QHHHYHZSWZLTKX-MRXNPFEDSA-N 446.816 4.777 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNC(=O)CCCSc2ccc(C)cc2)c(C)n1 1865760485 ZZIJODGYDVWXOQ-UHFFFAOYSA-N 449.576 4.708 50 10 IJGE CC(C)n1nc(Br)nc1N(Cc1ccccc1)C1(CBr)CCC1 1905494509 HYFWTAKMUMCPEB-UHFFFAOYSA-N 442.199 4.946 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2cccnc12 1915109416 GKBZGEQUOPKSDY-INIZCTEOSA-N 433.371 4.599 50 10 IJGE C[C@@H]1C[C@H](CBr)CN1Cc1cc(Br)ccc1Br 2006503205 LKAAKSLPPMKNEB-NXEZZACHSA-N 425.990 4.817 50 10 IJGE BrC[C@H]1[C@H]2CN(Cc3c(Br)cccc3Br)CC[C@H]21 2033087875 XVDPSXGEYARWJJ-AXFHLTTASA-N 438.001 4.674 50 10 IJGE ClC[C@@]1(CNc2ncc(I)cc2Br)CC12CCC2 2069534706 YVVCYQLUHRZWLG-CYBMUJFWSA-N 441.538 4.660 50 10 IJGE CSc1ccncc1-n1nc(CBr)c(Br)c1C(F)(F)F 2078913685 GCXLBURYTPRYEV-UHFFFAOYSA-N 431.075 4.665 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]23CCC[C@@]2(CN(CC2(CBr)CCCC2)C3)C1 2106782569 RLIBIYUSAYWVHB-OYRHEFFESA-N 427.427 4.665 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@H](c2ccccc2)[C@@H](NC(=O)OC(C)(C)C)C1 2106784061 FQQSYFHSRMWOEQ-QRVBRYPASA-N 425.411 4.646 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]12CC[S@@](=O)(=NCC1(CBr)CCCC1)C2 2106788326 ORSWQJCOGVIPSG-SIBVEZHUSA-N 449.455 4.583 50 10 IJGE O=C(N[C@@H](CCl)c1cccs1)c1cc(Cl)ccc1I 2119046937 AZMJFVPLLGZFMN-NSHDSACASA-N 426.106 4.716 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2Cc1ccn(Cc2ccccc2)n1 2128519341 SWAUDOOPJHUZHE-UHFFFAOYSA-N 430.737 4.534 50 10 IJGE CC(C)(C)OC(=O)NCCN(C(=O)[C@H](Br)C1CCCC1)C1CCCCC1 2130058862 WFSVNNGTMYIVNR-QGZVFWFLSA-N 431.415 4.626 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@@H]2NC(=O)[C@@H](Br)C2CCCC2)C1 2167033045 PJZVICLIPAEIAZ-XGHQBKJUSA-N 443.426 4.626 50 10 IJGE C[C@H]1[C@@H](C)N(c2cc([N+](=O)[O-])ccc2CBr)C[C@@H](C)N1Cc1ccccc1 2176905496 XPTQDWDJIQBONV-IXDOHACOSA-N 432.362 4.977 50 10 IJGE CCCN(C[C@@H](C)Br)C(=O)c1ccc(Br)cc1Br 2259758499 VJBUFBROGHABIG-SECBINFHSA-N 441.989 4.847 50 10 IJGE O=C(N[C@@H]1C[C@H]2CC[C@H]1[C@@H](Br)C2)c1scc(Br)c1Cl 2264503452 GHDIENPPGPHGBW-AZQAYCESSA-N 427.589 4.846 50 10 IJGE Cc1ncc2nc(CCl)n(Cc3scc(Br)c3Br)c2n1 2286627526 BFFZCMVGLQARLA-UHFFFAOYSA-N 436.560 4.508 50 10 IJGE O=S(=O)(CCC(CCl)CCl)Nc1cc(Cl)c(Br)cc1Cl 2295467608 NAQGNVBPPULFGU-UHFFFAOYSA-N 444.005 4.982 50 10 IJGE CC[C@@H]1CN(Cc2ccc(Cl)cc2I)C[C@H]1Br 2302327124 WINVVLQEIVGGIC-BXKDBHETSA-N 428.539 4.550 50 10 IJGE C[C@@H]1CO[C@](CBr)(Cc2cc(I)ccc2Cl)C1 2307276458 WSJMWYSYPFGPAJ-ZANVPECISA-N 429.523 4.677 50 10 IJGE CC(C)(C)c1nc(C(=O)N[C@H](CCBr)COCc2ccccc2)cs1 2320362118 SONQXPHCIASPJL-OAHLLOKOSA-N 425.392 4.541 50 10 IJGE O=C(NN=Cc1cc(Br)c(O)c(Br)c1)Nc1cccc(Cl)c1 2323840334 NYQQSNUAOACMNU-UHFFFAOYSA-N 447.514 4.726 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CCC2CCN(C[C@H]3C[C@@H]3Br)CC2)CC1 2335932404 ISEDYVQYJCITEG-MOPGFXCFSA-N 429.443 4.909 50 10 IJGE Brc1ccccc1[C@@H](CI)OC[C@H]1O[C@H]2CC[C@H]1C2 2352572134 FHJBFOQEMCNFQI-UOVKNHIHSA-N 437.115 4.509 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@@H]1C[C@H]2CBr 2359285850 SNYCUBXSGZLNGL-DAROEXNTSA-N 425.523 4.630 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N(CCCCl)C1CCOCC1 2381023131 IWMFGQRHPKXNSM-UHFFFAOYSA-N 445.604 4.523 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)COc3ccccc3)ccc2[C@@H]1c1cccc(Cl)c1 38651144 UQKCYSOPXFZDCK-QHCPKHFHSA-N 432.863 4.543 50 10 IJGE Cc1c(C(=O)N2c3ccc(F)cc3CC[C@@H]2C)oc2c1/C(=N/NC(=O)c1ccco1)CCC2 40814411 YCTJNCHJPDTTJT-UIBHDDBDSA-N 449.482 4.772 50 10 IJGE N#C/C(=C/Nc1ccccc1F)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 216496142 JNAQQNOPHUUFIE-ATJXCDBQSA-N 440.522 4.579 50 10 IJGE CC[C@](C)(CCBr)NC(=O)c1cc(Br)ccc1Br 228571924 SCISZCCQTQEORV-CYBMUJFWSA-N 441.989 4.895 50 10 IJGE CCN(C[C@@](C)(CI)OCCCC(C)C)C(=O)OC(C)(C)C 231313623 PJRLFDUFEKXJSJ-QGZVFWFLSA-N 427.367 4.890 50 10 IJGE O=S(=O)(Nc1ccccc1CBr)c1c(Cl)cccc1Br 312437572 ASFZUBXILSEDAT-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE Clc1ccc(CBr)c(N2CC[C@H](N3CCN(Cc4ccccc4)CC3)C2)c1 380114085 PMFZNUMABPCZDV-NRFANRHFSA-N 448.836 4.631 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CCl)c1F)N1CCC(OCc2ccccc2)CC1 383880535 FXOZPHBWXXNBTG-UHFFFAOYSA-N 432.344 4.588 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CCC[C@@H](Br)CC1 386100186 QYHXMZJYSIZCDX-SNVBAGLBSA-N 439.973 4.601 50 10 IJGE CCC[C@@H](CCCl)NC(=O)c1cc(I)ccc1Br 716856645 UUWZSYGIOFOGMH-JTQLQIEISA-N 444.538 4.581 50 10 IJGE Cc1ccc(C(=O)NNc2ccnc3cc(Cl)ccc23)cc1I 729514801 IFMAISLKPQCHDC-UHFFFAOYSA-N 437.668 4.558 50 10 IJGE C=C(CBr)CN(CCOc1cccc(Br)c1)C[C@@H]1CCCS1 1193963274 LTFZXLNBPUZMBJ-KRWDZBQOSA-N 449.252 4.977 50 10 IJGE O=C(NNc1ccccc1Oc1ccccc1)c1ccc2nc(O)n(CC(F)(F)F)c2c1 1452919809 QQOVBRCIVHTTMT-UHFFFAOYSA-N 442.397 4.853 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2ccc3nc(O)[nH]c3c2)c(C)n1-c1cccc(Cl)c1 1466346183 UYXIGBLNWYQXBI-ZDLGFXPLSA-N 445.910 4.553 50 10 IJGE C=CCCC[C@@H](C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)c1ccccc1 1566603643 XEIAYOLXWRCYAH-GOSISDBHSA-N 426.460 4.563 50 10 IJGE C=CC[C@@]1(C(=O)NNc2c(Cl)cc(F)cc2Cl)CCCN1C(=O)OC(C)(C)C 1584026158 WNLAQTMMITZDQY-IBGZPJMESA-N 432.323 4.921 50 10 IJGE Cc1cc(C)cc(OC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2O)CCC3)c1 1772751690 JRBDZPJDICYDCG-UHFFFAOYSA-N 432.476 4.600 50 10 IJGE COc1cccc(C=NNC(=O)COc2ccc(-c3ccccc3)cc2Br)c1 1772753019 MSFIGNAGKJBNNW-UHFFFAOYSA-N 439.309 4.654 50 10 IJGE COc1ccc(C(=O)NNc2ccc(OCCOc3ccccc3Cl)cc2)cc1OC 1858080730 PVRBTBXXNPJZMI-UHFFFAOYSA-N 442.899 4.572 50 10 IJGE Cc1ccc(-c2nc(CC(=O)NC(C)(C)C(=O)Nc3ccc(SC#N)cc3)c(C)o2)cc1 1866653176 QWJXDZJTXDOJBS-UHFFFAOYSA-N 448.548 4.608 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1Cc1cccc(Br)c1Br 1943880965 MFTQJWBARYDQTP-ONGXEEELSA-N 425.990 4.959 50 10 IJGE C[C@@H]1OCC[C@]1(CBr)Cc1cccc(Br)c1Br 1943886830 YGOZOZVKUJKNBF-TVQRCGJNSA-N 426.974 4.944 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H](C3CC3)[C@@H](Br)C2)c1 2054716423 DEHDCUHFDCQANT-OCCSQVGLSA-N 438.001 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](CN(C[C@@H](CBr)CC2CC2)C2CC2)C1 2112869921 XZADFSMDOJGTTK-QZTJIDSGSA-N 429.443 4.909 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Cl)c1cc(Br)n(C)n1 2138246660 CUAXANVUHAWCMV-NSHDSACASA-N 428.939 4.935 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CC[C@@H](Cl)C(F)(F)CC1 2150038333 FDIBAUIYUORYOJ-LLVKDONJSA-N 431.502 4.690 50 10 IJGE CCC(CC)(CBr)CN(CC1CCOCC1)C1CN(C(=O)OC(C)(C)C)C1 2163058287 JHWIWVIHRRYUPS-UHFFFAOYSA-N 447.458 4.536 50 10 IJGE CN(Cc1cccc(CNC(=O)[C@@H](Br)C2CCCC2)c1)C(=O)OC(C)(C)C 2167030410 BJMUZQPQHMHGGD-SFHVURJKSA-N 439.394 4.623 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2COC[C@@H](C1)N2CCCCCCCCCBr 2204525170 KDHKOBOANGXUPN-RBUKOAKNSA-N 447.458 4.822 50 10 IJGE C[C@@H]1OCCO[C@H]1[C@@H](Br)c1cc(Br)c(Br)cc1F 2218606581 SEYMZHFHFUTAGO-HQDFOZKBSA-N 446.936 4.591 50 10 IJGE O=S1(=O)C[C@@H]2[C@H]([C@@H](Cl)c3c(Br)cc(Cl)c(Cl)c3Cl)[C@@H]2C1 2232511385 JSQHBMGVQHJOFY-YMVRNGRXSA-N 438.985 4.980 50 10 IJGE CC1(C)CCN(C(=O)c2ccc(Cl)c(I)c2)C[C@@H]1CCl 2283652425 UYHNXHTWQQRZPB-NSHDSACASA-N 426.125 4.672 50 10 IJGE Cc1nn(-c2ccccc2)c(O[C@H]2CCN(Cc3ccccc3)C2)c1CBr 2287651062 DWJNJYNVFCVWNX-FQEVSTJZSA-N 426.358 4.729 50 10 IJGE O=C(C=Cc1ccco1)Oc1ccc(C=NNC(=O)c2ccc(Cl)cc2Cl)cc1 2296737712 BUZYGKRFQQLLGP-UHFFFAOYSA-N 429.259 4.969 50 10 IJGE COc1cc(C=C(C#N)c2nc(-c3cc4ccccc4oc3=O)cs2)cc([N+](=O)[O-])c1O 2296790213 XBUUMBHSKURXKE-UHFFFAOYSA-N 447.428 4.603 50 10 IJGE Cc1ccc(SCC(=O)Oc2ccc(C=C(C#N)C(=O)NCc3ccco3)cc2)cc1 2314770819 WVVRPCDZONKOBM-UHFFFAOYSA-N 432.501 4.509 50 10 IJGE Clc1ccc(CN2C[C@@H]3C[C@H](C[C@H]3Br)C2)c(I)c1 2318558471 VLYXGVWKEGQEAS-SUZMYJTESA-N 440.550 4.550 50 10 IJGE C[C@@H]1CCc2[nH]c3ccc(C(=O)NN=Cc4ccc(O)c(Br)c4)cc3c2C1 2323166665 MULCBXDFOJQCOS-GFCCVEGCSA-N 426.314 4.525 50 10 IJGE CCc1ccc([C@@H](C)NC(=O)C(C#N)=CNc2ccc(I)cc2)cc1 2325103937 VNXIFEJLRSSVIM-CQSZACIVSA-N 445.304 4.550 50 10 IJGE CN(C[C@@]1(CBr)CC1(F)F)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 2351892391 OQZVVZFMXHEACQ-YJBOKZPZSA-N 433.337 4.605 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@H]2CC[C@H]1[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]21 2353832323 YIYXKVWNFBMQHU-QQXKLLMISA-N 429.443 4.621 50 10 IJGE CCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccccc1F 38652292 JGHRBUCKNNAMCC-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE CCOC(=O)/C(C#N)=C/c1cccc(OC(=O)/C=C/c2ccc(OCC)c(OCC)c2)c1 40927013 ANRYBALTKYHNEK-WRMRRPGHSA-N 435.476 4.573 50 10 IJGE COc1ccc(OC)c([C@@H](Br)c2cccc(I)c2)c1 109842888 ITPVLIXDAACRRZ-HNNXBMFYSA-N 433.083 4.793 50 10 IJGE C[C@H](Br)c1ccccc1NS(=O)(=O)c1sccc1Br 136604967 VXOSWNHFKWINLO-QMMMGPOBSA-N 425.167 4.767 50 10 IJGE CC1(C)CN(c2ccc(C(F)(F)F)cc2Br)C[C@H](CBr)O1 164131923 HYTQPHXKXKUVEC-JTQLQIEISA-N 431.090 4.847 50 10 IJGE COc1ccc(/C=N\NC(=O)c2c(C)ccc3ccccc23)c(Br)c1OC 169921763 JAOJYKJPNBGZES-FMCGGJTJSA-N 427.298 4.692 50 10 IJGE Cc1ccccc1NCC(=O)NN=C1C(=O)N(Cc2cccc3ccccc23)c2ccccc21 254494165 KGSYSCWPKCAGBL-UHFFFAOYSA-N 448.526 4.627 50 10 IJGE C[C@@H](CCBr)CCNC(=O)c1cc(Br)cc(Br)c1 397749478 OUEJNCRISPTMCO-VIFPVBQESA-N 441.989 4.753 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCC12CC(CO1)C2 716080466 SQGADGUHECKKPN-UHFFFAOYSA-N 440.957 4.664 50 10 IJGE Clc1cccc(CBr)c1N1CC[C@@]2(CN(Cc3ccccc3)CCO2)C1 717593709 PIKOHSTVDGEYBK-OAQYLSRUSA-N 435.793 4.716 50 10 IJGE C[C@@H]1CC[C@H](NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)[C@H](C)C1 733113886 HIFUKWCPAUMOOU-MAUDIHLGSA-N 435.959 4.965 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCCCc2nc3ccccc3s2)c1C 736693485 IQJVGXPDRHPUPU-UHFFFAOYSA-N 432.553 4.621 50 10 IJGE CC(C)c1nc(C(=O)NNc2cccc(F)c2F)nn1-c1c(Cl)cccc1Cl 743720945 HIGRNHPPACRUFC-UHFFFAOYSA-N 426.254 4.733 50 10 IJGE Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NNC(=O)c1cccc2cccnc12 756213608 ZCNAFNXNWBCBIK-UHFFFAOYSA-N 437.459 4.674 50 10 IJGE COc1ccc(OCc2ccc(C=NNC(=O)CNc3cccc4ccccc34)o2)cc1 1084422550 AGUCZTDPTVEWFL-UHFFFAOYSA-N 429.476 4.583 50 10 IJGE C=CCc1cc(/C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc(OCC)c1OC 1084436887 CRDSYQWLUKJKOA-KGENOOAVSA-N 429.520 4.570 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)Cc2csc([C@H]3CC[C@H](C)CC3)n2)c1C 1472512771 HNXIQAPFBLKXNR-CZIWCDLHSA-N 436.585 4.591 50 10 IJGE CN1C[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H](CI)C1 1614615028 LJSXDRZKHBVHIS-JOYOIKCWSA-N 437.165 4.804 50 10 IJGE Cc1c([C@@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)cccc1[N+](=O)[O-] 1614630301 QATJJLYVXRCVBI-FUHWJXTLSA-N 433.302 4.650 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2cc(C)ccc2C)c1 1865692973 KILUXOKJAUQSSC-XMMPIXPASA-N 428.536 4.864 50 10 IJGE CCc1nn(Cc2cccc(F)c2)c2c1[C@@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2 1865710988 NEHVKCCTVCDLSV-IBGZPJMESA-N 442.416 4.870 50 10 IJGE CC(C)c1nc(Nc2ccc(SC#N)cc2)cc(N2CCN(c3ccccc3)C(=O)C2)n1 1868231889 VWKKIWKHHRBOSN-UHFFFAOYSA-N 444.564 4.770 50 10 IJGE BrCCCSc1cc(I)ccc1Br 1887827718 JCTKEEKJSKBPTB-UHFFFAOYSA-N 435.950 4.931 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)CCc1c(Cl)cccc1Cl 1905342476 JJGYNLFUVWKNQX-LLVKDONJSA-N 427.125 4.986 50 10 IJGE Brc1cccc([C@H](CI)O[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1 1917453380 MIDPWRSDKJKCFZ-QPCUURQASA-N 433.127 4.986 50 10 IJGE C[Si](C)(C)O[Si@@](C)(O[Si@@](C)(O[Si](C)(C)C)c1ccccc1)c1ccccc1 1933213627 MRUHXDZUINGBFB-MKPDMIMOSA-N 434.833 4.664 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN1C(=O)c1csc(Br)c1Br 1950523253 SOLMSFDQBCDCED-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE CC1(CBr)CC(NC(=O)c2cc(Br)c(Br)s2)C1 2006992776 NAUAOPKAVPCUES-UHFFFAOYSA-N 446.002 4.567 50 10 IJGE BrC[C@@H]1[C@H]2CCN(Cc3ccc(Br)cc3Br)C[C@H]21 2032221273 YWSMVHCGQUWWMS-JHJVBQTASA-N 438.001 4.674 50 10 IJGE CCN(CC)C[C@@H](Br)CCc1cc(Cl)ccc1I 2038160007 PDSNYUWQCITFQO-LBPRGKRZSA-N 444.582 4.983 50 10 IJGE C[C@H](Cl)C12CCC(CC1)N2c1ncc(I)cc1Br 2069533369 HBXUSCZCAGVRCC-LUHBLDKBSA-N 441.538 4.577 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1C(=O)c1c(Br)cccc1Br 2073314728 IXFHXGSGFHUOLK-LDYMZIIASA-N 439.973 4.600 50 10 IJGE CC[C@@H](C)[C@H](CBr)NC(=O)c1cccc(Br)c1Br 2081239245 PUFUMGZYHJYYGP-KCJUWKMLSA-N 441.989 4.751 50 10 IJGE C[C@@H]1CCO[C@@H]1CO[C@](C)(CI)c1ccccc1Br 2096130626 XNTKDBYOWHIQCB-KCPJHIHWSA-N 439.131 4.541 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CC2(CBr)CCCCC2)C[C@@H]1C(F)(F)F 2106783006 VYUDKSFCQYTOOA-UONOGXRCSA-N 443.348 4.719 50 10 IJGE C[C@H]1[C@@H](C)N(C(=O)OC(C)(C)C)C[C@@H](C)N1C[C@H](CBr)c1ccccc1 2106788815 SVYYGBOWSDMZMZ-NTDBWNAOSA-N 425.411 4.883 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CN(C[C@H](CBr)c3ccccc3)CC[C@H]21 2163062391 LAYMKFRTRNRVAS-HSALFYBXSA-N 437.422 4.887 50 10 IJGE O=C(N[C@H](CBr)CC1CCOCC1)c1cccc(OCc2ccccc2)c1 2195481544 HVCBWQNGPCMVTI-FQEVSTJZSA-N 432.358 4.576 50 10 IJGE COc1cccc(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c1CBr 2203190747 WCWNSUPPBZDRMU-VQTJNVASSA-N 429.402 4.939 50 10 IJGE Fc1ccc(CBr)c(OC[C@H]2CC2(Br)Br)c1F 2213086423 XYXHDMOORUNUDZ-SSDOTTSWSA-N 434.900 4.745 50 10 IJGE COC1(CO[C@@H](CI)c2ccccc2Br)CCC1 2254930994 BDBDGOKZKHBCDF-ZDUSSCGKSA-N 425.104 4.511 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)COc2ccc(Cl)cc2Cl)cc1 2314777475 GUAWWMKEYYKXQG-UHFFFAOYSA-N 447.318 4.801 50 10 IJGE N#CC(=CNc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NC(c1ccccc1)c1ccccc1 2318467252 CCPLOVOGUKDXOX-UHFFFAOYSA-N 432.867 4.973 50 10 IJGE F[C@]1(CBr)CCCN(Cc2ccc(Cl)cc2I)C1 2318539070 KTMWLAXNEIDLRT-ZDUSSCGKSA-N 446.529 4.644 50 10 IJGE COc1cccc(C(=O)NN=Cc2c(C(C)C)nc3c(Cl)cc(C(F)(F)F)cn23)c1 2321260497 IHYULAIZRDZQRT-UHFFFAOYSA-N 438.837 4.902 50 10 IJGE COc1cccc(C=NNC(=O)c2ccc3nc(S)[nH]c3c2)c1OCc1cccc(C)c1 2323603742 DIGBWVPSISSSGE-UHFFFAOYSA-N 446.532 4.512 50 10 IJGE ClCC[C@H]1CCC[C@H]1NCc1ccc(I)c(Br)c1 2325207167 OOBRSQLJMMCWEH-BXUZGUMPSA-N 442.566 4.941 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](Br)[C@H](OCC2CCC(C(F)(F)F)CC2)C1 2327996741 RGPBNTGRCWAXFL-CLRIEMFWSA-N 430.305 4.755 50 10 IJGE Cc1c(CBr)ccc(NS(=O)(=O)[C@H]2C[C@H](OCc3ccccc3)C2)c1C 2342167760 WJFDTJVACHQFSB-WGSAOQKQSA-N 438.387 4.688 50 10 IJGE COc1ccc(Br)c(CCl)c1OCc1nc(Br)cs1 2342921468 HZPMIOYTTRAICG-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE CCC[C@H](CBr)CN1C[C@@H]2CC(F)(F)CC[C@@]2(NC(=O)OC(C)(C)C)C1 2344075181 CZZAEILPEZCQDD-RVKKMQEKSA-N 439.385 4.812 50 10 IJGE O=C(N[C@@H]1C[C@H](CBr)C12CCC2)c1cc(Br)c(Cl)s1 2351615743 VCMACFIZVZXGAP-GMSGAONNSA-N 427.589 4.848 50 10 IJGE COc1ccc(/C=C/C(=O)Oc2cccc(C=NNC(=O)c3ccccc3Cl)c2)cc1 8843038 AGDGLUVIZMNNPD-ZSTFBILFSA-N 434.879 4.731 50 10 IJGE C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)c1ccccc1OCc1ccccc1 14665988 GUMGIRZAAIZXBJ-IBGZPJMESA-N 446.547 4.792 50 10 IJGE CNC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1cccc(OCc2ccccc2)c1 35445973 XGMVMXSEWCJSNM-PXLXIMEGSA-N 434.499 4.771 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3[N+](=O)[O-])ccc2[C@@H]1c1ccccc1Cl 38651020 XEIJHXSKYRZHBS-NRFANRHFSA-N 447.834 4.686 50 10 IJGE CCc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(O)cc1)CCC2 40812033 PFRLCJDVDXNITO-NHFJDJAPSA-N 431.492 4.579 50 10 IJGE Cc1occc1C(=O)N/N=C1\CCCc2oc(C(=O)N3CCCc4ccccc43)c(C)c21 40823514 SZAGLBKKJUPMRO-LGUFXXKBSA-N 431.492 4.553 50 10 IJGE COc1ccc(CBr)cc1OCc1ccc(I)cc1 115098465 DTROGDXOEDBAST-UHFFFAOYSA-N 433.083 4.774 50 10 IJGE CCOC(=O)c1ccc(NC(=O)/C(C#N)=C\N[C@H](CC)c2ccc3c(c2)CCCC3)cc1 217100026 DWJJBKDMLVVCAW-IAAPFODBSA-N 431.536 4.829 50 10 IJGE BrCCCN(c1ncc(Br)cc1Br)C1CCC1 228538692 DOGUIJHYIOBDEC-UHFFFAOYSA-N 426.978 4.751 50 10 IJGE O=S(=O)(Nc1c(Br)cccc1Br)c1ccc(CCl)cc1 383287319 UPJJRUFTUCFIOW-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE COc1cc(Cl)c([C@H](Br)c2nn(C)cc2Br)cc1Cl 693120329 DFOXGXISDSFIBY-NSHDSACASA-N 428.939 4.982 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1ccc(F)cc1 1349304795 IVNKXOPQPAOTOS-PEZBUJJGSA-N 438.886 4.923 50 10 IJGE CC(=O)c1ccc2c(c1)CN(C(=O)/C(C#N)=C\c1cc(C)n(-c3ccc(F)cc3)c1C)C2 1436692839 VWBXEPXXFLNXOV-UUYOSTAYSA-N 427.479 4.885 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)Nc1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 1469491152 JSGPRKUVJRBSKW-SFHVURJKSA-N 436.434 4.757 50 10 IJGE C#C[C@H](NC(=O)NNc1nc2ccc(Cl)cc2s1)c1ccc(Br)cc1 1478896790 RHVXZEBXYRCBFT-ZDUSSCGKSA-N 435.734 4.713 50 10 IJGE Cc1ccc(Br)c2[nH]c(C(=O)NNc3nc4ccccc4[nH]c3=S)cc12 1585178507 BRLKBYPNYWKBPW-UHFFFAOYSA-N 428.315 4.602 50 10 IJGE Cc1ccc(C)c(NC(=O)c2oc3c(c2C)C(=NNC(=O)Cc2ccccc2)CCC3)c1 1772748899 OZUVYMVUZRQGQX-UHFFFAOYSA-N 429.520 4.856 50 10 IJGE COc1cccc(O[C@@H](C)C(=O)NN=Cc2ccc(OCc3ccccc3Cl)cc2)c1 1772756297 SFMZSNMXJIYCOX-KRWDZBQOSA-N 438.911 4.845 50 10 IJGE CC[C@@H](NC(=O)[C@@H](C)c1ccc(Br)cc1)C(=O)Nc1ccc(SC#N)cc1 1866945149 YRMTYICVWODDDY-SCLBCKFNSA-N 446.370 4.659 50 10 IJGE CCOc1ccc(-c2csc(/C(C#N)=C(\O)c3ccc(NS(C)(=O)=O)cc3)n2)cc1 1872747639 NDTMUVXUFKURRE-ZZEZOPTASA-N 441.534 4.530 50 10 IJGE Cc1nsc(Br)c1[C@@H](Cl)c1cc2c(cc1Br)NC(=O)C2 1912982188 JMUQCYXKHHHNJE-LBPRGKRZSA-N 436.556 4.799 50 10 IJGE CC(C)(C)OC(=O)NC1CCC([C@@]2(C)CC[C@@](C)(CI)O2)CC1 1936000428 WAQQOMDDQRBYFY-JOCCRWCTSA-N 437.362 4.833 50 10 IJGE O=C(N[C@@H]1CCC[C@H](Br)C1)c1csc(Br)c1Br 1945187600 YLLPZNNQOMLIRX-NKWVEPMBSA-N 446.002 4.709 50 10 IJGE C[C@@](CBr)(NC(=O)c1csc(Br)c1Br)C1CC1 1945189090 IUBAUUXDWNGNGL-NSHDSACASA-N 446.002 4.567 50 10 IJGE O=C(NC1(CCBr)CCC1)c1csc(Br)c1Br 1945189129 JQAPRMLHQOPRJQ-UHFFFAOYSA-N 446.002 4.711 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)C(=O)c1ccc(O)c(Br)c1 1961198578 GQCJMFOKQMWPHP-LBPRGKRZSA-N 427.136 4.581 50 10 IJGE CC(C)(C)OC(=O)NCCN(CC(F)F)CC1(CBr)CCCCCC1 2044699572 MKKQXTUPTPQEEL-UHFFFAOYSA-N 427.374 4.814 50 10 IJGE O=S(=O)(c1ccc(Cl)cc1F)N(Cc1ccccc1)[C@@H](CBr)C1CC1 2057408404 RQVXCARBICBOAY-KRWDZBQOSA-N 446.769 4.844 50 10 IJGE CC(C)[C@H](Br)c1cn(-c2cc(Cl)ccc2I)nn1 2057420668 FLJPCMALKRHNOZ-LBPRGKRZSA-N 440.510 4.617 50 10 IJGE ClCCc1nc2cccc(Br)c2n1Cc1nccn1Cc1ccccc1 2090023712 OPDBGJDHFAZNKP-UHFFFAOYSA-N 429.749 4.873 50 10 IJGE ClCc1cc(N2CC[C@H]3CCN(Cc4ccccc4)C[C@@H]3C2)ncc1Br 2092524709 SNTHLABIAOLOCR-IEBWSBKVSA-N 434.809 4.931 50 10 IJGE O=C(NC[C@@]12CCC[C@@]1(CBr)C2)c1cc(Br)c(Cl)s1 2142949503 KHRLEAMAKLPWJM-STQMWFEESA-N 427.589 4.849 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CC[C@H](Cl)C(F)(F)CC1 2150039972 RQAKQSRGJIQEDB-NSHDSACASA-N 431.502 4.690 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CCC[C@@]2(CCN(Cc3ccccc3)C2)C1 2163326288 LXDOTAGZFKNUAP-QHCPKHFHSA-N 427.386 4.710 50 10 IJGE C[C@H]1CCCC[C@@H]1N(C)S(=O)(=O)c1cc(CBr)sc1Br 2179790828 JHIGUEVGQIIRMF-ONGXEEELSA-N 445.242 4.605 50 10 IJGE BrC[C@]12CCC[C@H]1N(C[C@H]1CC1(Br)Br)CCC2 2213093257 YSMAEBBLLOSYPH-IJLUTSLNSA-N 430.022 4.522 50 10 IJGE C[C@@H](c1csnn1)n1c(CCl)nc2cc(Br)c(Br)cc21 2234077041 YMZGZEVLPRSKRB-LURJTMIESA-N 436.560 4.761 50 10 IJGE CCc1cc([C@H](Br)c2cccc(S(C)(=O)=O)c2)sc1Br 2282912812 BTMDVCVFFCMOKA-CYBMUJFWSA-N 438.206 4.961 50 10 IJGE Cl[C@H]1C[C@@H]2CN(Cc3ccc(I)c(Br)c3)C[C@@H]2C1 2325207983 FESQRYYGNRTOJZ-GDNZZTSVSA-N 440.550 4.503 50 10 IJGE ClC[C@@H]1CCCC[C@H]1NCc1ccc(I)c(Br)c1 2325210662 AJHIEDFRANAHFA-SMDDNHRTSA-N 442.566 4.941 50 10 IJGE C[C@H]1CN(Cc2cc(I)ccc2Cl)C[C@@]1(C)CBr 2327398373 CUYJRPMNZMPESJ-IINYFYTJSA-N 442.566 4.798 50 10 IJGE C[C@@H]1CN(Cc2cc(I)ccc2Cl)C[C@@H](C)C1Br 2327401446 ALRMWUJSDGEVMP-NXEZZACHSA-N 442.566 4.796 50 10 IJGE CCN(C[C@@](C)(CBr)OC[C@@H](OC)c1ccccc1)C(=O)OC(C)(C)C 2336254893 BFYBTXCIEJPDNX-YLJYHZDGSA-N 430.383 4.801 50 10 IJGE CCO[C@@H](Nc1ccc(C(=O)C(Cl)Cl)cc1)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 3609623 XDTGRQWFLSGROG-GOSISDBHSA-N 445.686 4.892 50 10 IJGE CCOc1cc(/C=C(/C#N)c2nc3ccccc3[nH]2)cc(I)c1OC 33399268 YEEWKUFAERVWAZ-JYRVWZFOSA-N 445.260 4.639 50 10 IJGE Cc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)N3CCc4ccccc4C3)c(C)c21 40811527 DMIWSJUIIUWECW-XAYXJRQQSA-N 441.531 4.565 50 10 IJGE CS(=O)(=O)c1ccc([C@@H](Br)c2cc(F)c(Br)cc2F)cc1 70474556 XZFJAGSCHPKNKM-CQSZACIVSA-N 440.103 4.615 50 10 IJGE COc1cc(N/C=C(/C#N)c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)c(C)cc1[N+](=O)[O-] 102481007 BBVNKDLJWZXLLX-UVTDQMKNSA-N 437.437 4.920 50 10 IJGE CC(C)OC(=O)c1ccsc1NC(=O)/C(C#N)=C\c1c(F)c(F)c(F)c(F)c1F 207166324 BZZWUYHRYNZDAG-YVMONPNESA-N 430.354 4.554 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CBr)OCc1ccc(Br)cc1 231319250 OVZFMRSUDAEGHL-MRXNPFEDSA-N 437.172 4.644 50 10 IJGE CN(CCCCCBr)C(=O)c1cc(Cl)ccc1I 234281561 WQNODBHTZFGPMC-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE O=S(=O)(NCCCN(Cc1ccccc1)Cc1ccccc1)c1ccccc1CCl 390519150 FHAGVIZCCBTIME-UHFFFAOYSA-N 443.012 4.796 50 10 IJGE Clc1cc(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@H]32)ccc1CBr 404156392 PVNGKUCAURVNAJ-RTWAWAEBSA-N 435.793 4.715 50 10 IJGE CO[C@]1(CC(CBr)(CBr)c2ccc(Cl)cc2)CCOC1 692459421 ZNURABVEEKUPSP-HNNXBMFYSA-N 426.576 4.563 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)c1C 726766096 LFZADOHQPNNBQO-BTZNOAQDSA-N 444.539 4.521 50 10 IJGE O=C(NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl)[C@H]1C[C@@H]1c1cc(F)ccc1F 743301051 QYPOGKBLFMVSIY-PWSUYJOCSA-N 449.832 4.758 50 10 IJGE CC[C@@H](C)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC=C(C#N)CC1 760002914 DTJWGMQSINONJA-IQGLISFBSA-N 443.547 4.622 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])c2ncccc12)c1csc(COc2ccc(F)cc2)n1 770136869 OHNKIUYYYKBEBP-UHFFFAOYSA-N 425.397 4.537 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C[C@H](C)c2ccc(Br)cc2)c1C 771022756 NWZHELFOXMMSHQ-ZDUSSCGKSA-N 440.345 4.555 50 10 IJGE O=S(=O)(Nc1cccc(N2CCOCC2)c1)c1ccc(S(F)(F)(F)(F)F)cc1 782910666 LHXHXXIRXQRDPW-UHFFFAOYSA-N 444.447 4.981 50 10 IJGE N#Cc1ccc(NNC(=O)CCCc2nc(-c3ccc(Cl)cc3)no2)c(C(F)(F)F)c1 799747225 SUJFXXZIGDPBRW-UHFFFAOYSA-N 449.820 4.746 50 10 IJGE C=CCSc1ccccc1C(=O)NNC(=O)Nc1ccc(Br)cc1Cl 1617609292 GVFGWXXYZMVDDR-UHFFFAOYSA-N 440.750 4.847 50 10 IJGE Cc1c(Cl)cccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccn1)CCC2 1772747004 KDHIPOLVESUVGC-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE CCc1nn(-c2ccc(C)cc2)c2c1[C@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 1865714566 MSEMWIPTWSOXBF-LJQANCHMSA-N 435.325 4.724 50 10 IJGE C[C@@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1Cl 1914664182 PYKGYCYYVVGWHT-GFCCVEGCSA-N 437.186 4.921 50 10 IJGE Cc1cc(C)c(S(=O)(=O)N(Cc2ccccc2)[C@@H](CBr)C2CC2)s1 1915164757 JSYIGUAFAQSDLV-KRWDZBQOSA-N 428.417 4.729 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)c1ncc(Br)cc1Br 1916347917 LTIQEYXTOQWGBM-AWEZNQCLSA-N 448.586 4.867 50 10 IJGE CC(C)[C@@H](Br)[C@@H](C)NC(=O)c1scc(Br)c1Br 1997062658 JHZJOJPMMJIBJY-HTRCEHHLSA-N 448.018 4.811 50 10 IJGE BrC[C@@H]1[C@H]2CCN(Cc3cccc(Br)c3Br)C[C@@H]21 2032219309 HRFXNGCYKFOUCA-UTUOFQBUSA-N 438.001 4.674 50 10 IJGE Brc1cnc(N2CC[C@@H](Br)CC23CCC3)c(Br)c1 2050626388 QLRDLGKNSQGFJY-SECBINFHSA-N 438.989 4.893 50 10 IJGE CC1(CBr)CC(NC(=O)c2c(Br)cccc2Br)C1 2055639988 ACMSTRFTLBABFO-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE Cc1cc(CBr)ccc1S(=O)(=O)N(Cc1ccccc1)CC(F)(F)F 2059265188 QUZBPJRUSVGJMD-UHFFFAOYSA-N 436.293 4.643 50 10 IJGE CCn1cc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)C(C)C)cc1CBr 2059268170 WCYDWNILAMETQZ-INIZCTEOSA-N 427.408 4.638 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C(F)(F)F)CCCN1C[C@@H](CBr)C(C)(C)C 2106789111 WGNMSRBDYOSJAV-CXAGYDPISA-N 445.364 4.965 50 10 IJGE COc1cc(CBr)ccc1S(=O)(=O)N(Cc1ccccc1)C1CCCC1 2123272077 WHOPPTOANZBHHY-UHFFFAOYSA-N 438.387 4.724 50 10 IJGE O=S(=O)(N1CCC[C@H](CCBr)C1)N(Cc1ccccc1)C1CCCCC1 2123362684 IOEIOCXRJIPVNZ-LJQANCHMSA-N 443.451 4.563 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CCC(F)(F)[C@@H](CCl)C1 2150492456 ADHIJWMQDRUQBV-QMMMGPOBSA-N 431.502 4.548 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CC[C@@]2(CCCN(Cc3ccccc3)C2)C1 2163319125 GNYKSBHDBSPDLV-HSZRJFAPSA-N 427.386 4.710 50 10 IJGE CN(CCC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)c1ccc(CBr)cc1 2163319370 UIIOKIAFVYSDPX-UHFFFAOYSA-N 439.394 4.691 50 10 IJGE CO[C@H]1C[C@H](Oc2c(CBr)ccc(Br)c2Cl)C[C@H]1OC 2166419627 QRACKNOSUAEKPP-WLLOZRIZSA-N 428.548 4.569 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)CN1c1ccc(CBr)c([N+](=O)[O-])c1 2188576906 KEMYSLQNMPUKEY-SJORKVTESA-N 432.362 4.837 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)Cc1cc(Cl)cc(F)c1Cl 2210044946 UQTOYEOMJSREQK-SNVBAGLBSA-N 431.088 4.735 50 10 IJGE CCCN(CCCCCI)CC(C)(C)CNC(=O)OC(C)(C)C 2211184137 BESOVZRCHWRPLQ-UHFFFAOYSA-N 440.410 4.855 50 10 IJGE Cc1ccc(C(=O)Nc2ccc(CBr)cc2)cc1I 2224618026 COUHTWUFLBDIKR-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE COc1ccc([C@@H](Br)C[C@H]2CC(C)(C)CO2)cc1I 2269557321 UFEMUXNSOJQAAY-RYUDHWBXSA-N 439.131 4.941 50 10 IJGE CCCN[C@H](c1ccc(OC)c(I)c1)[C@H]1C[C@H](Br)C1 2269589281 XNFLLBRMQBLSIG-LALPHHSUSA-N 438.147 4.514 50 10 IJGE CCOc1ccc(NC(=O)COc2ccc(C=C(C#N)C(=O)Nc3ccccc3)cc2)cc1 2294171819 AXXDPYYAQIEYCA-UHFFFAOYSA-N 441.487 4.648 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)C[C@@H](Cl)C1CC1 2306218738 DIKUOGZFBKHKQY-GFCCVEGCSA-N 428.539 4.503 50 10 IJGE C[C@H]1C[C@H](CCl)CN1Cc1ccc(I)c(Br)c1 2306227287 MHQAIGJWKLZEKC-GXSJLCMTSA-N 428.539 4.503 50 10 IJGE C[C@@]1(CCBr)CCN1Cc1cc(I)ccc1Cl 2307330292 LZMJYGLJJNMYLA-CYBMUJFWSA-N 428.539 4.694 50 10 IJGE CCc1cc(Br)cc2c1O[C@]1(C=C2)CCN(C(=O)C(C#N)=Cc2ccccc2)C1 2318734578 LLVFKZRFMYOAKW-XMMPIXPASA-N 449.348 4.995 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCC([C@H]2CCCN(C(=O)C(F)(F)F)C2)CC1 2382184983 SDOMWQFSUPQGHF-RDJZCZTQSA-N 441.376 4.557 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](CC)C(=O)NNC(=O)COc1ccc(Cl)cc1C 10683244 XBHDUGVJSSMAKI-HNAYVOBHSA-N 432.948 4.546 50 10 IJGE Cn1c(/C(C#N)=C/c2c(Oc3ccccc3F)nc3ccccn3c2=O)nc2ccccc21 35549759 OHAJNAGWTTXGDU-JQIJEIRASA-N 437.434 4.577 50 10 IJGE CCCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccc(C)o1 38659377 JLLOEPGSAUIQSF-HSZRJFAPSA-N 430.460 4.814 50 10 IJGE COc1cc(N/C=C(/C#N)c2nc(-c3ccc4c(c3)OCO4)cs2)c(C)cc1[N+](=O)[O-] 102472819 VEYWGKHKFHODIK-ZROIWOOFSA-N 436.449 4.741 50 10 IJGE O=C(NN=C/C=C\c1ccccc1)/C(=C/c1cccs1)NC(=O)c1ccccc1Cl 252607627 HDEGMMMKAFSUJO-MYXKBGHRSA-N 435.936 4.988 50 10 IJGE CC(C)C[C@@H](NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1cccc(C(F)(F)F)c1 726797622 ODAGDIXLHCOJJI-LJQANCHMSA-N 446.473 4.929 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)c2ccc(-c3cc(Cl)cc(Cl)c3)s2)cc1 748154954 WUJLRGWZUXDYMN-UHFFFAOYSA-N 441.361 4.882 50 10 IJGE O=C(O)CN(Cc1ccccc1)S(=O)(=O)c1cccc(S(F)(F)(F)(F)F)c1 790623397 HWWVATBGACVLKS-UHFFFAOYSA-N 431.404 4.620 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)[C@@H]2CCCC[C@H]2c2nc3ccccc3s2)c1 1303280411 HUSZWXQXJOEASO-QZTJIDSGSA-N 434.590 4.569 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)COc1cc(C)cc(C)c1)c1ccc(C(F)(F)F)cc1 1312342898 PHTZSOGHXAHNAD-FQEVSTJZSA-N 449.473 4.739 50 10 IJGE C/C(=C\C1CCC(C)CC1)C(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1 1472469155 NJBJLRQLFGMLNK-DTQAZKPQSA-N 436.581 4.929 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)/C(=C\c2cccc(Cl)c2)c2cccs2)c1 1633769272 PUASFNQIUGIIGE-RGEXLXHISA-N 437.977 4.941 50 10 IJGE CCOc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccoc2C)CCC3)cc1 1772750008 VBCKNYYBDDMQGY-UHFFFAOYSA-N 435.480 4.611 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3C)cc1OCC 1865686980 GRRKYHYKCWRXFN-JOCHJYFZSA-N 444.535 4.883 50 10 IJGE CCCOc1c(OC)cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CC)nn2-c1ccc(C)cc1 1865694310 WMUTUARWJLWZCI-JOCHJYFZSA-N 444.535 4.759 50 10 IJGE C[C@H](C(=O)N(C)CC1CC(Br)C1)c1ccc(NC(=O)OC(C)(C)C)cc1 1887829162 GIQDESXJXHTLPZ-HLIUYOAVSA-N 425.367 4.769 50 10 IJGE CCn1ncc(Br)c1CN(Cc1ccccc1)[C@H](CBr)C1CC1 1915187613 DDSCXACQJWSMDP-QGZVFWFLSA-N 441.211 4.841 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)c1ncc(S(C)(=O)=O)cc1Cl 1915255876 SDLIXOXXWNCLPI-QGZVFWFLSA-N 445.810 4.565 50 10 IJGE Cc1ccc(F)cc1S(=O)(=O)N(Cc1ccccc1)[C@H](CBr)C(C)C 1915296503 UYOKNFNCLCAVJV-GOSISDBHSA-N 428.367 4.745 50 10 IJGE Cc1cnc(N(C)C[C@H](Br)COCc2ccccc2)c(Br)c1 1916350445 ZFDMNFXPBYDFIG-HNNXBMFYSA-N 428.168 4.569 50 10 IJGE O=C(c1csnc1Br)N(Cc1ccccc1)[C@H](CBr)C1CC1 1925217303 SIQALDJEOLQOBM-CQSZACIVSA-N 444.192 4.722 50 10 IJGE C[C@H](Br)[C@H]1CCCN1C(=O)c1cc(Br)sc1Br 2018122706 ADOIUOIDROCOHE-POYBYMJQSA-N 446.002 4.661 50 10 IJGE Cn1cc(Br)c(C[C@H](CBr)c2cccc(Br)c2)n1 2027111486 HPICGEYWPNZDBV-SNVBAGLBSA-N 436.973 4.666 50 10 IJGE CN(CC(C)(C)CBr)C(=O)c1cc(Br)cc(Br)c1 2033566811 JUMCTWXJMOVLRA-UHFFFAOYSA-N 441.989 4.705 50 10 IJGE CC(C)N1C[C@@H](Br)[C@@H](Cc2c(Br)cccc2Br)C1 2039261356 GWOGMNADIGZCIV-IINYFYTJSA-N 440.017 4.858 50 10 IJGE CC(C)N(C[C@H](Br)C(F)(F)F)C[C@H]1CCCCN1C(=O)OC(C)(C)C 2044698759 FIDBCPAIWFVBSD-KGLIPLIRSA-N 431.337 4.812 50 10 IJGE C[C@@H]1C[C@H](CBr)CCN1Cc1cc(Cl)ccc1I 2052367779 NUDAZBYNYTZRDI-GHMZBOCLSA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(CC3(CBr)CCCCCC3)C[C@H]21 2106784480 JAOWAYFOTGFQNB-KZNAEPCWSA-N 429.443 4.957 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N(C)[C@H]1CCCCC[C@@H]1Br 2172541856 AEHUZITUDZIIQI-QWRGUYRKSA-N 445.242 4.536 50 10 IJGE COc1ccc(Br)c(CCl)c1OCc1cnsc1Br 2227741770 UWKJCFWSARPSKR-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCC[C@@H]1CCO1 2253159246 ZPBKEVANLBLWGA-JTQLQIEISA-N 428.946 4.664 50 10 IJGE O=C(NCC1(CBr)CC(F)(F)C1)c1cc(Br)ccc1Cl 2281656796 QAROPLIITAHXDA-UHFFFAOYSA-N 431.502 4.643 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@H]2C[C@H]1CC[C@H]2Br 2282975239 NUJLOKGWPMNLJX-NQMVMOMDSA-N 425.523 4.630 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](COC)C[C@@H]1CNC(=O)OC(C)(C)C 2289589271 GMIGGMUGHGGDLS-ZWKOTPCHSA-N 449.474 4.830 50 10 IJGE FC1(F)CN(c2nc3ccc(Br)cc3s2)CC[C@H]1CBr 2296517001 YDTUKIRNYTWDPY-QMMMGPOBSA-N 426.124 4.915 50 10 IJGE CCN(C)C[C@H](Br)CCc1ccc(Cl)cc1I 2302327537 ZYZYZXBPWUFHOB-LLVKDONJSA-N 430.555 4.592 50 10 IJGE CC1(C)CC(CBr)(CN=[S@@](C)(=O)CCCCNC(=O)OC(C)(C)C)C1 2321755691 WNBXOHLCMVZBLU-VWLOTQADSA-N 439.460 4.590 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=CN[C@@H](CC)c2ccc3c(c2)CCCC3)cc1 2324332055 DWJJBKDMLVVCAW-DEOSSOPVSA-N 431.536 4.829 50 10 IJGE N#CC1=C(N)C(C#N)(C#N)[C@@H](c2ccc(-c3ccc(Br)cc3)o2)[C@H]2CCC=C12 2759506 BQOLBLXVNVFLDA-OXJNMPFZSA-N 431.293 4.913 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc(Cl)cc2Cl)o1)C(=O)NNC(=O)Cc1ccccc1 33651301 LMXPHXBRGQLWOO-PTNGSMBKSA-N 440.286 4.550 50 10 IJGE Cc1c(C(=O)N2CCCC[C@H]2C)oc2c1/C(=N/NC(=O)c1cccc(Cl)c1)CCC2 40813257 WHQWYEAZIVNKGO-HUEFVVPSSA-N 427.932 4.726 50 10 IJGE O=C1NCCc2ccc([C@@H](Br)c3cc(Br)ccc3Cl)cc21 70545615 SUCDRBXOHZZCIZ-OAHLLOKOSA-N 429.539 4.873 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@H](c2ccc(Br)s2)C1 382732870 VKHWLBMXXXEZRE-NXEZZACHSA-N 425.186 4.856 50 10 IJGE FC(F)Oc1c(C(F)(F)F)ccc(I)c1CBr 575722725 FDQXIVURVKPSFB-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](O)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 616591413 YFXHWMFAYWHGCE-YCAMKHIRSA-N 444.644 4.896 50 10 IJGE COC(=O)[C@@]1(CCF)C[C@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 688653523 FEABJMIWUVCDET-PGRDOPGGSA-N 439.600 4.691 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCc2cc(Cl)ccc2OCC#N)c1C 735333363 YROHSDKIMGSFRR-DZGUVLCISA-N 441.915 4.519 50 10 IJGE CC(=O)c1ccc(S(=O)(=O)NC(=O)c2ccc(S(F)(F)(F)(F)F)cc2)cc1 760179188 HFYIGJJVUQUHDH-UHFFFAOYSA-N 429.388 4.665 50 10 IJGE CCN(CC)c1nc2sc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)cc2s1 799747335 YJBJAVFSPFQIHD-UHFFFAOYSA-N 439.488 4.851 50 10 IJGE Cc1ccc(C(=O)NN=C2C(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)cc1 1084086354 ACSLRFBXTOQRLK-UHFFFAOYSA-N 438.314 4.983 50 10 IJGE CCCCC(C)=NNC(=O)c1ccc(N(Cc2ccccc2Cl)S(C)(=O)=O)cc1 1084459142 SEWIIIGZUQTROD-UHFFFAOYSA-N 435.977 4.602 50 10 IJGE CC(=O)c1ccc(CCNC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 1623828498 OKPIWIBKAJZQJL-HAHDFKILSA-N 429.495 4.702 50 10 IJGE C=CCOc1cn(-c2ccccc2)nc1C(=O)NNc1ccc(OCc2ccccc2)cc1 1630050827 MCIWJMQMHASQBP-UHFFFAOYSA-N 440.503 4.773 50 10 IJGE Cc1ccc(C)c(N2C(=O)c3ccc(C(=O)Nc4ccc(SC#N)cc4)cc3C2=O)c1 1859466877 BLGMWKALYXIROC-UHFFFAOYSA-N 427.485 4.930 50 10 IJGE COc1ccc(/C=C(\C#N)c2nc(-c3ccc(OC)c(OC)c3OC)cs2)cc1OC 1872795325 ZESPDSGOIDVPDE-XNTDXEJSSA-N 438.505 4.917 50 10 IJGE O=C(N[C@H](CCl)[C@H]1CC=CCC1)c1scc(Br)c1Br 1885059519 AYUNOEWCKJQSKB-WCBMZHEXSA-N 427.589 4.967 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cccc(OC(F)(F)F)c1 1916355502 VJVFQYOZBCPEOE-MRXNPFEDSA-N 446.263 4.638 50 10 IJGE C[C@H](Br)c1cn(-c2ccc(Cl)c(I)c2Cl)nn1 1945187747 BEFNLNKTTJMQMC-YFKPBYRVSA-N 446.901 4.635 50 10 IJGE CC[C@@H](Br)CN(C)C(=O)c1csc(Br)c1Br 1977855899 VGGPTOTVELINQY-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc([C@@]2(C)CC[C@](C)(CI)O2)cc1 2014211375 TYCCTQMMBYDKQH-RTBURBONSA-N 445.341 4.931 50 10 IJGE C[C@@]1(CBr)CC(F)(F)CN1c1ncc(Br)cc1Br 2041121582 KQSFILYWRAUCHQ-JTQLQIEISA-N 448.931 4.606 50 10 IJGE C[C@H]1CN(Cc2cc(Cl)ccc2I)CC[C@H]1CBr 2046687348 RKIFUCSUDQEKLB-QWRGUYRKSA-N 442.566 4.798 50 10 IJGE C[C@@](CBr)(NC(=O)c1cc(Br)c(Cl)s1)C(F)(F)F 2052451516 QFLUCIWVAIJGBO-QMMMGPOBSA-N 429.483 4.610 50 10 IJGE ClC[C@H](Nc1ncc(I)cc1Br)[C@H]1CC=CCC1 2075336707 XQKUXUUYORZPKD-CABZTGNLSA-N 441.538 4.824 50 10 IJGE CCC(CC)(CBr)CN1C[C@]23CCC[C@@]2(C1)CN(C(=O)OC(C)(C)C)C3 2106782509 QWZHBIBEJIKUFR-OYRHEFFESA-N 429.443 4.911 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CC2(CBr)CCC2)CC[C@@H]1C(F)(F)F 2106785310 OOXVHGMDJKWGTF-KBPBESRZSA-N 443.348 4.577 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccccc2)CCN1Cc1ccc(CBr)cc1 2130156293 BULYISQHTGXQOF-IBGZPJMESA-N 427.308 4.830 50 10 IJGE Cc1sc(C)c(S(=O)(=O)NCC(C)(C)C[C@H](C)Br)c1Br 2143910389 KOKUFKTYARODDM-QMMMGPOBSA-N 447.258 4.605 50 10 IJGE CN(c1nc2sccn2c1CBr)[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2151242791 ZTILMNKKUMMDPD-BCDXTJNWSA-N 445.430 4.923 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@H]2NC(=O)[C@H](Br)C2CCCC2)C1 2167033042 PJZVICLIPAEIAZ-CBGDNZLLSA-N 443.426 4.626 50 10 IJGE O=C(N[C@@H](CBr)CC1CCOCC1)c1cccc(OCc2ccccc2)c1 2195481545 HVCBWQNGPCMVTI-HXUWFJFHSA-N 432.358 4.576 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1c(F)ccc(Br)c1F 2210044867 UCESSVJPSBGOER-QMMMGPOBSA-N 429.099 4.558 50 10 IJGE COc1ccc([C@H](Br)[C@@]23COC[C@@H]2C3(F)F)c(Br)c1Cl 2283563635 ZNQNQFURMGQYDA-KPXOXKRLSA-N 432.486 4.829 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3CC[C@H]2C[C@H]3Br)c1 2315486972 GPIQUXPQLPBOPS-JIMOISOXSA-N 440.550 4.692 50 10 IJGE ClCc1cc(OCc2cccc(I)c2)ncc1Br 2319107997 IOWRCCISIDLYRV-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1CC(F)F 2328525233 HGQLULMRAWFRLU-HUUCEWRRSA-N 427.374 4.620 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CC2CCN(C[C@H]3C[C@@H](Br)C3)CC2)CC1 2335933298 SSLREMZSTHPGCI-KDURUIRLSA-N 429.443 4.909 50 10 IJGE Cc1cnccc1CO[C@@H](CI)c1ccccc1Br 2340086130 YGDKDDHBCIFBKS-HNNXBMFYSA-N 432.099 4.845 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@]3(CCCN(C(=O)OC(C)(C)C)C3)C2)C1 2345012116 YRTGVSLEWLUEPU-HXUWFJFHSA-N 429.443 4.911 50 10 IJGE COc1cc(F)c(Cl)cc1[C@@H](Br)c1c(Br)nc(C)n1C 2362485007 ASUCPEBEYABABL-LLVKDONJSA-N 426.511 4.776 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2cc(I)ccc2Cl)C[C@@H]1CCl 2380521638 IYIOLAHOXYXDEP-GXSJLCMTSA-N 438.058 4.794 50 10 IJGE CC1(C)O[C@](C)([C@H]2CC[C@](C)(Cl)[C@@H](Br)C2)[C@H](O)C[C@H]1Br 30731744 ZAULPZAMCNCFDT-SYPGZIFDSA-N 432.624 4.630 50 10 IJGE in-vitro Cc1c(Br)cc(NCC(=O)N/N=C2/CCCC[C@@H]2C)cc1Br 32929274 ONZQALYADVSITK-LJTKESRTSA-N 431.172 4.614 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccc([N+](=O)[O-])cc3)ccc2[C@@H]1c1cccc(Cl)c1 38651168 LTEWQQMDYBAPTM-NRFANRHFSA-N 447.834 4.686 50 10 IJGE CCOc1ccccc1/C=N/NC(=O)COc1ccc(Br)cc1C(C)(C)C 40910775 JGDAZOABTOPNAF-YDZHTSKRSA-N 433.346 4.674 50 10 IJGE COc1cc(/C=N/NC(=O)COc2c(C)cccc2C)ccc1OCc1ccc(C)cc1 40911173 VRYIBMDQJNROIR-JFLMPSFJSA-N 432.520 4.729 50 10 IJGE O=C(NNc1ccccc1)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(Cl)cc2)c1 97039486 DVCQVJTXVJSYPL-UHFFFAOYSA-N 436.320 4.551 50 10 IJGE COc1ccc([C@@H](Br)c2csc(I)c2)cc1OC 124406265 NWTYFLCXTNJPJU-CYBMUJFWSA-N 439.112 4.854 50 10 IJGE COC(=O)/C(C#N)=C\c1cccc(OC(=O)/C=C/c2ccc(OCCC(C)C)c(OC)c2)c1 206952891 BGHPJFVLRGHZNB-HYIPRNNESA-N 449.503 4.819 50 10 IJGE COc1cc(N/C=C(/C#N)C(=O)N[C@H](C)C23CC4CC(CC(C4)C2)C3)c(OC)cc1Cl 217054713 QPVQJCGVYALJMA-RNXRYNHOSA-N 443.975 4.898 50 10 IJGE CC(=NNC(=O)COc1cc(C)cc(C)c1)c1ccc(NC(=O)c2ccccc2C)cc1 252643177 ZTBNSNGDWIDQSO-UHFFFAOYSA-N 429.520 4.783 50 10 IJGE CCCCCCCCCCCCCC(=O)NCC(=O)NN=Cc1ccccc1[N+](=O)[O-] 254813695 BCJKYMFFTUYCRC-UHFFFAOYSA-N 432.565 4.862 50 10 IJGE CC[C@@H](Br)CCCNC(=O)c1cc(Br)c(Br)s1 398591187 WXDUTBFLGQJWID-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE O=S(=O)(Nc1cc(Br)cc(Br)c1)c1ccccc1CCl 690357563 HYAKBZRLRNPWMJ-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE Cc1cc(Br)c([C@H](Br)c2cn(C)c(Br)n2)s1 698419761 QPYLXBVRPIIUFQ-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE CC(=O)N(C)c1cccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(C)c3)c2C)c1 744776881 JLSUAJHZFIITLY-HMAPJEAMSA-N 426.520 4.931 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)Nc1cccc(C(=O)Nc2ccc(Cl)cn2)c1 770029961 BVAAUSLTAAHHID-UHFFFAOYSA-N 435.793 4.553 50 10 IJGE Cc1ncsc1-c1nc2ccccc2n1CC(=O)Oc1ccc([N+](=O)[O-])c2ncccc12 770137044 QVGVJESWOPZGSE-UHFFFAOYSA-N 445.460 4.530 50 10 IJGE CC(=O)[C@H](C)CCCCC(=O)NS(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1 783123942 KXJZEGLQJWTXAP-LLVKDONJSA-N 437.452 4.934 50 10 IJGE CC1(C)CN(C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)C[C@]2(CCOC2)O1 797612151 QUJPNCCMLLMTIC-YOEHRIQHSA-N 438.899 4.708 50 10 IJGE CC(C)(C)n1ncc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1-c1ccccc1 799751667 RMWMPEWITJIRAT-UHFFFAOYSA-N 427.430 4.952 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NCCCSc2ccccc2)c(-c2ccccc2)n1 914461272 BUTWOHZEFFZEJJ-HEHNFIMWSA-N 441.560 4.669 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)Cc1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1 1478272032 HJGHMNGNOVWPJE-GOSISDBHSA-N 439.865 4.939 50 10 IJGE Cc1ccsc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2-c1ccc(Br)cc1 1865699171 MVFJGSWOEAIMLF-MRXNPFEDSA-N 427.327 4.531 50 10 IJGE COc1ccc(C2CCN(C(=O)/C(C#N)=C/c3ccc(Br)cc3)CC2)cc1 1866368040 TYPXTMWOVXDFBC-XMHGGMMESA-N 425.326 4.771 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@H]1C(F)(F)F 1892594546 YMPJTBHIFJGUIS-YNEHKIRRSA-N 430.895 4.697 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)Cc1c(Cl)ccc(Cl)c1F 1905405353 OJWHSRNOOHYJFW-SECBINFHSA-N 431.088 4.735 50 10 IJGE CC[C@@H](CBr)N(C)C(=O)c1csc(Br)c1Br 1937737134 FMVQGXURJQCYEJ-LURJTMIESA-N 433.991 4.519 50 10 IJGE CC[C@@H]1CN(Cc2cccc(Br)c2Br)C[C@H]1Br 1943885544 WSXPHAIGBBXYNR-BXKDBHETSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]([C@@]2(C)CC[C@@](C)(CI)O2)CC1 1993736345 WAQQOMDDQRBYFY-IHETXDGRSA-N 437.362 4.833 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)c1cccc(Br)c1CBr 2020231079 BUECEASOOKZCIF-MGCOHNPYSA-N 425.990 4.954 50 10 IJGE Clc1cc(CN2CC[C@H](CCBr)C2)ccc1I 2026560784 MVLIVNAAGFECOY-JTQLQIEISA-N 428.539 4.552 50 10 IJGE CC[C@@H](Br)CCCNC(=O)c1c(Br)cccc1Br 2033089463 UBGLAMPFEFMMSZ-SECBINFHSA-N 441.989 4.895 50 10 IJGE CN(C(=O)c1cc(Br)c(Cl)s1)[C@H](CCBr)C(F)F 2058234596 OSMCYHAFRVNJFQ-ZCFIWIBFSA-N 425.520 4.655 50 10 IJGE O=S(=O)([C@H]1CC[C@@H](CBr)C1)N(Cc1ccccc1)CC1CCCCC1 2059288531 ILARRYIARXMPMH-UXHICEINSA-N 428.436 4.962 50 10 IJGE CCCC(CBr)(CCC)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1COC 2106781830 LLVBHHHTBGYXRB-QGZVFWFLSA-N 435.447 4.536 50 10 IJGE CC(C)(C)OC(=O)NCCN(C[C@H](CBr)c1ccccc1)CC(F)(F)F 2106789097 WDGQMGVDYPAMIL-HNNXBMFYSA-N 439.316 4.554 50 10 IJGE Cc1cccc(Br)c1C(=O)N[C@H](C)CCCCCI 2117894948 OEZARFQQJJAAKI-GFCCVEGCSA-N 438.147 4.871 50 10 IJGE C[C@@]1(C2CC2)CN(C(=O)c2ccc(CBr)cc2)CCN1Cc1ccccc1 2151075716 GQWZOHOGJITEKA-QHCPKHFHSA-N 427.386 4.708 50 10 IJGE Cc1cccc(C(=O)N2[C@H]3CCC[C@@H](Br)[C@H]2CC3)c1I 2154106434 PJJGSOKCPDVFSC-IACUBPJLSA-N 448.142 4.520 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@]2(F)CCC[C@]2(CCl)C1 2176640913 QETYARBTZILVIF-QWHCGFSZSA-N 445.579 4.846 50 10 IJGE FC1(F)[C@@H]2CC[C@H](O[C@H](CI)c3cccc(Br)c3)[C@@H]21 2230328894 SYDVBOGKIHDCOG-YVECIDJPSA-N 443.069 4.986 50 10 IJGE CCCN(C[C@H](C)Br)C(=O)c1ccc(I)c(Cl)c1 2259758534 VUFOAKWZHZQEKL-VIFPVBQESA-N 444.538 4.580 50 10 IJGE Cc1nsc(Br)c1C(=O)N(CCC(C)(C)C)C[C@@H](C)Br 2288053515 FDYSWWMCQVTXNA-SECBINFHSA-N 426.218 4.876 50 10 IJGE COc1cc(C=CC(=O)Cl)cc(I)c1OCc1ccc(C)cc1 2293940856 JBBCGYHXYMNYLD-UHFFFAOYSA-N 442.680 4.966 50 10 IJGE CC(=O)Nc1ccc(Oc2cccc(C3CCN(C(=O)[C@H](Cl)C(C)C)CC3)n2)cc1 2296578131 LFPFYQSKZGEOCI-JOCHJYFZSA-N 429.948 4.802 50 10 IJGE CCOc1ccccc1NC(=O)C(C#N)=Cc1cn(Cc2ccccc2)nc1-c1cccnc1 2297382097 ZZKLLWYMBHCHHU-UHFFFAOYSA-N 449.514 4.938 50 10 IJGE C[C@H]1CC[C@H](Br)CN1Cc1cc(I)ccc1Cl 2307328509 NZCVMOWLFWNZIE-ONGXEEELSA-N 428.539 4.692 50 10 IJGE CCCCOc1cc(Br)c(C=C(C#N)C(=O)NCc2cccs2)cc1OC 2313540587 IXWPALQXGDFTLB-UHFFFAOYSA-N 449.370 4.921 50 10 IJGE CCOc1cc(C=C(C#N)c2nc3ccc(C)cc3[nH]2)ccc1OCC(=O)N(CC)CC 2318418005 MTVAQGXIYUATME-UHFFFAOYSA-N 432.524 4.581 50 10 IJGE COc1ccc(Br)cc1C=NNC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 2323149361 OHNRYEWCPGSYAF-UHFFFAOYSA-N 426.314 4.582 50 10 IJGE CCCCOC(=O)c1ccccc1NC=C(C#N)C(=O)Nc1ccc(OC)c(Cl)c1 2324398585 NVFVXVPXEDZZLJ-UHFFFAOYSA-N 427.888 4.764 50 10 IJGE N#CC(=CNC(c1ccccc1)c1ccccc1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 2325205717 IVSFRFFTGQQPJR-UHFFFAOYSA-N 432.867 4.973 50 10 IJGE C[C@@]12CN(Cc3cc(I)ccc3Cl)C[C@@]1(CBr)C2 2327401903 TUEMFSRGBGSDFO-KGLIPLIRSA-N 440.550 4.552 50 10 IJGE CCN(C[C@](C)(CBr)O[C@H]1CCOc2ccccc21)C(=O)OC(C)(C)C 2340299602 QEIXXLVMTZJJNP-PXNSSMCTSA-N 428.367 4.937 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1Cc2ccccc2N(C[C@]2(CBr)CC2(F)F)C1 2379985102 FKMHLIJIPJELIU-IFXJQAMLSA-N 445.348 4.610 50 10 IJGE CCC(C)(C)c1ccc(OCC(=O)NNC(=O)C(c2ccccc2)c2ccccc2)cc1 8905710 DYNNRBISFPYKFW-UHFFFAOYSA-N 430.548 4.733 50 10 IJGE CC(C)(CCl)C(=O)N1CCN(c2nc(C3CC3)nc3sc4c(c23)CCCCC4)CC1 35892180 UJNGKECDIFACHQ-UHFFFAOYSA-N 447.048 4.751 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3cccs3)ccc21 38681467 GLGKJPPNWDUUFH-QFIPXVFZSA-N 432.501 4.974 50 10 IJGE O=C(NNc1ncnc(Oc2cccc3ccccc23)c1[N+](=O)[O-])c1ccccc1Cl 40583522 ANDLXUQRQXWOBL-UHFFFAOYSA-N 435.827 4.741 50 10 IJGE O=C(NNc1ncnc(Nc2cccc3ccccc23)c1[N+](=O)[O-])c1cccc(Cl)c1 40627215 YQGICMWBOJNBRT-UHFFFAOYSA-N 434.843 4.692 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2cc(C)n(-c3cccc(F)c3)c2C)cc1 58894356 CQJRNGOBYMLQRL-GJVLPJBHSA-N 437.515 4.596 50 10 IJGE CCOCCC(CBr)(CBr)c1ccc(Br)cc1 118820473 NHNULIYPUDDBAO-UHFFFAOYSA-N 428.990 4.903 50 10 IJGE C[C@](CI)(OCC1CCOCC1)c1ccccc1Br 162319198 JJKVCGHCBWWPOR-OAHLLOKOSA-N 439.131 4.543 50 10 IJGE N#C/C(=C/NCCc1cccc(Br)c1)C(=O)Nc1cc(Cl)ccc1Cl 217136447 FYXGVMYGCBAELU-QBFSEMIESA-N 439.140 4.934 50 10 IJGE CCc1ccc([C@@H](C)NC(=O)/C(C#N)=C\Nc2ccc(I)cc2)cc1 217198057 VNXIFEJLRSSVIM-CPZHOGDASA-N 445.304 4.550 50 10 IJGE O=C(N[C@@H]1CCC[C@@H]1CBr)c1cc(Br)ccc1Br 231580491 VISUFGCJKICHGV-PRHODGIISA-N 439.973 4.505 50 10 IJGE C[C@@H](Cl)c1nnc(-c2cc(Br)ccc2I)s1 235171323 UETQSFJYPIRTFH-RXMQYKEDSA-N 429.508 4.872 50 10 IJGE CC[C@H](Br)[C@H](CC)NC(=O)c1cc(Cl)ccc1I 313086928 PNDWTOJUKHSSAQ-JQWIXIFHSA-N 444.538 4.627 50 10 IJGE O=C(CBr)c1cc(Br)cc(OC(F)F)c1OC(F)(F)F 575679678 CLZABNDOQGYJPR-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE CCCN(CCBr)C(=O)c1scc(Br)c1Br 705511580 MTYSWUMCIKCFQH-UHFFFAOYSA-N 433.991 4.520 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NC(=O)c1ccc(Br)cc1Br 716939261 ODHAULQIRACONX-SCZZXKLOSA-N 441.989 4.894 50 10 IJGE C[C@@H]1CCCC[C@@H]1O[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 725343872 LGQMFVQUMSCBDO-VKJFTORMSA-N 437.362 4.786 50 10 IJGE O=C(NNC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1)c1ccc(COc2ccccc2)o1 731185078 DNUAQLQZVFIFOR-DHIUTWEWSA-N 426.472 4.577 50 10 IJGE Cc1ccc(/C=C\C(=O)NNc2ccc(S(=O)(=O)c3ccc(C(C)C)cc3)cc2)cn1 754013555 IMGPARNQGDNZNM-UUASQNMZSA-N 435.549 4.503 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)c1ccc(Cl)cc1 794049741 DBNWIYCUWJMNOZ-WNPPMXKSSA-N 439.906 4.515 50 10 IJGE N#Cc1ccc(NNC(=O)CCc2ncc(-c3ccc(F)cc3F)o2)c(C(F)(F)F)c1 799755132 YIKRSMVKIHZAOU-UHFFFAOYSA-N 436.340 4.586 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865684502 ZKJJMXORFIPZPV-QFIPXVFZSA-N 447.970 4.821 50 10 IJGE CCCOc1c(OC)cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2-c1ccc(C)cc1 1865692360 FEMVGZBJONJBNO-JOCHJYFZSA-N 430.508 4.505 50 10 IJGE O=S1(=O)CC[C@@H]([C@H](Cl)c2c(Br)sc(Br)c2Cl)C1 1923037430 DCMDCFXWVHKFHK-XINAWCOVSA-N 443.009 4.641 50 10 IJGE CC(C)[C@](C)(CBr)NC(=O)c1csc(Br)c1Br 1945186084 AZSSFUZWEVMPGU-NSHDSACASA-N 448.018 4.813 50 10 IJGE FC(F)Oc1ccc(CBr)c(I)c1OC(F)(F)F 2060220493 WYVOLNFYURMYJG-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE CCC(CC)(CBr)CN=[S@](C)(=O)[C@H]1C[C@H](CNC(=O)OC(C)(C)C)C1 2072485610 HSIUYWMPGBCMRS-KDCSIKNMSA-N 439.460 4.589 50 10 IJGE C[C@@H](CC1CCN(C[C@H](Br)C(F)(F)F)CC1)N(C)C(=O)OC(C)(C)C 2083282379 LYZHBSBWNMBBRT-JSGCOSHPSA-N 431.337 4.670 50 10 IJGE ClC[C@H]1CCC2(CCC2)N1c1ncc(I)cc1Br 2084957007 ISJBXAKIKMRUTI-SNVBAGLBSA-N 441.538 4.579 50 10 IJGE C[C@H]1C[C@H](Br)[C@H](C)CN1Cc1ccc(I)c(Cl)c1 2086659020 SHJCNJWMTPQLKX-SCVCMEIPSA-N 442.566 4.938 50 10 IJGE Cc1nc2c(cc1Br)nc([C@@H](C)Cl)n2CC1CN(Cc2ccccc2)C1 2096813040 IXHAHILIZYYNLQ-CYBMUJFWSA-N 433.781 4.934 50 10 IJGE COc1cccc(OCc2ccc(I)cc2)c1CBr 2104436409 CNJKBHFEYVCFAL-UHFFFAOYSA-N 433.083 4.774 50 10 IJGE CC(C)[C@H](Br)C(=O)N1C[C@H](C)N(C(=O)OC(C)(C)C)Cc2ccccc21 2106773347 RQKJUKQHGWUIRX-YOEHRIQHSA-N 425.367 4.578 50 10 IJGE O=C(c1ccc(Br)c(Cl)c1)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Br)C2 2190677969 JRAVLIIZDFPSHO-YPWHJJHSSA-N 425.523 4.581 50 10 IJGE BrCCC[C@@H]1CCCN(c2ncc(Br)cc2Br)C1 2218743903 HCWHZOUPXFWSHP-SNVBAGLBSA-N 441.005 4.998 50 10 IJGE Cn1nc(Br)c([C@H](Cl)c2scc(C(F)(F)F)c2Br)n1 2226986621 KECFMQQONNHOGH-YFKPBYRVSA-N 439.482 4.749 50 10 IJGE CCCN(Cc1ccc(I)c(Cl)c1)C[C@@H](C)Br 2250510868 WNRHXEFUECNLLU-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)CC1COC1 2250746354 YDNSRELWBNUBEO-ZCFIWIBFSA-N 434.900 4.962 50 10 IJGE O=S1(=O)CCC[C@@H]1[C@H](Br)c1cc2sc(Br)cc2s1 2263560383 PZMFJFCOQINVHI-MWLCHTKSSA-N 430.208 4.739 50 10 IJGE O=C(N[C@]1(CCl)C[C@H]2CC[C@H]1C2)c1cc(Br)sc1Br 2268624632 BPJKGPSIENXBHT-UPFKWVMWSA-N 427.589 4.801 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@H](Br)[C@@H]1C1CC1 2282967965 QCWZHQUQBRWJGL-ZANVPECISA-N 425.523 4.630 50 10 IJGE CN(C[C@@H]1CCC[C@H]1Br)C(=O)c1cc(F)c(Br)cc1Cl 2282979347 YZCVZWAFGBXACJ-WCBMZHEXSA-N 427.539 4.877 50 10 IJGE CC(C)[C@H](CBr)N(C)C(=O)c1cc(Br)c(Br)s1 2302551828 NQIHGYNTQQGYDU-QMMMGPOBSA-N 448.018 4.765 50 10 IJGE CC[C@@H](Cl)[C@@H](CC)NCc1ccc(I)c(Br)c1 2306219593 NYJDIJRTHPPBSJ-DGCLKSJQSA-N 430.555 4.939 50 10 IJGE CC(=CC#N)N1C(=O)c2ccc(C(=O)Nc3ccc(-c4nc5ccccc5[nH]4)cc3)cc2C1=O 2313811572 PGZZCQQZIPCEQC-UHFFFAOYSA-N 447.454 4.506 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)NCc2ccco2)ccc1OC(=O)C=Cc1ccccc1 2314753528 AGHMINXCIRTTDA-UHFFFAOYSA-N 442.471 4.520 50 10 IJGE Cc1nc(Oc2cc(Br)cc(I)c2)ncc1CCl 2316852857 JUIUKKSAJGYQFG-UHFFFAOYSA-N 439.478 4.683 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccsc1C(F)(F)F 2320359905 CHOKNUNKYGKAOO-CYBMUJFWSA-N 436.293 4.867 50 10 IJGE CC[C@H](NC=C(C#N)C(=O)N[C@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 2325044899 DVGWFEJTONCTNB-KOSHJBKYSA-N 447.579 4.908 50 10 IJGE C[C@@](CI)(OCC1CC(F)C1)c1ccccc1Br 2327340108 FMUMOMSVGCVQMP-MGULZYLOSA-N 427.095 4.864 50 10 IJGE CN(CCN(CC(F)(F)F)CC1(CBr)CC(C)(C)C1)C(=O)OC(C)(C)C 2345004811 PJQUBPXMZOXGHB-UHFFFAOYSA-N 445.364 4.919 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3cccc(Cl)c3)ccc2[C@@H]1c1cccc([N+](=O)[O-])c1 38654101 URNXQYVYWQNLKP-NRFANRHFSA-N 447.834 4.686 50 10 IJGE COc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4cccc(C)c4)c(C)c32)c1 40822379 WZNLWPTVRRABBN-NHFJDJAPSA-N 431.492 4.628 50 10 IJGE Cc1sc(-n2c(C)cc(/C=N/NC(=O)CC[C@@H](O)c3ccccc3)c2C)c(C#N)c1C 58890536 WEVJZUOCIHAGHU-MNVTYAKESA-N 434.565 4.608 50 10 IJGE COC(=O)c1cc(-c2ccccc2)sc1NC(=O)/C(C#N)=C/c1cnc2ccccc2n1 58978753 CUAGLERUDKIVPJ-LFIBNONCSA-N 440.484 4.691 50 10 IJGE COc1cc(CBr)ccc1OCc1ccc(I)cc1 115098463 DFDYDFQYYZHCML-UHFFFAOYSA-N 433.083 4.774 50 10 IJGE CCOc1cc(/C=N\NC(=O)Cc2ccc(OC)cc2)ccc1OCc1ccc(C)cc1 169901145 SDJLTQYXFVBDJU-PKAZHMFMSA-N 432.520 4.674 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C/c2ccccc2OCCC)cc1 207161241 RWLMGFLGYFMJJD-UFSBNGCYSA-N 432.520 4.917 50 10 IJGE CC(C)n1c(CBr)nnc1-c1ccc(Br)cc1Br 232761749 DDGOGRZJCIFALL-UHFFFAOYSA-N 437.961 4.946 50 10 IJGE C/C(C=NNC(=O)c1ccc(C(=O)NN=C/C(C)=C/c2ccccc2)o1)=C/c1ccccc1 252599396 DIJFCQHYJVBWTA-CDSWEUEFSA-N 440.503 4.918 50 10 IJGE CCC(=O)Nc1ccc(C(=O)NN=Cc2ccccc2OC(=O)c2ccc(Cl)cc2)cc1 252637222 XQIGYYFADIQIGD-UHFFFAOYSA-N 449.894 4.672 50 10 IJGE ClCCc1nc2cc(I)ccc2n1CCOCc1ccccc1 389972100 WQZORMPOOSOMCJ-UHFFFAOYSA-N 440.712 4.639 50 10 IJGE CC[C@H](Br)CCCNC(=O)c1ccc(I)c(Cl)c1 398569602 PAWGLTVLLVAAMU-JTQLQIEISA-N 444.538 4.628 50 10 IJGE CC[C@@H]1[C@H](CBr)CCN1Cc1cc(Cl)ccc1I 405279669 AVAGSNBKMLUTAE-IINYFYTJSA-N 442.566 4.940 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@@]12CCC[C@@H]1OCC2 687346522 TVPXXMXOYVUYFU-NUEKZKHPSA-N 449.126 4.621 50 10 IJGE Cc1ccc([N+](=O)[O-])cc1[C@@H]1CN(Cc2ccccc2)C[C@H]1CI 725379752 JNVWRXKGYWAYJR-VQIMIIECSA-N 436.293 4.554 50 10 IJGE CCCCn1c(C)cc(/C=C(\C#N)C(=O)N[C@H](Cc2nccn2C)c2ccccc2)c1C 744350344 SDILZCPRZUJOMU-VOGGAGISSA-N 429.568 4.646 50 10 IJGE O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)Oc1ccc([N+](=O)[O-])c2ncccc12 770139609 SZABFYSSTAVLGT-UHFFFAOYSA-N 438.827 4.775 50 10 IJGE O=C1NCCc2c1ccc(NS(=O)(=O)c1cccc(S(F)(F)(F)(F)F)c1)c2F 790073500 GZIXGGYIZOHNFI-UHFFFAOYSA-N 446.394 4.570 50 10 IJGE C[C@H](NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)c1ccc(Cl)c(Cl)c1 807044898 YCXCOILZKUGDFP-ZDUSSCGKSA-N 448.306 4.871 50 10 IJGE CC(=O)Nc1cc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(F)cc3)c2C)ccc1F 875189156 GFDNGEQRPFMRIO-WOJGMQOQSA-N 434.446 4.876 50 10 IJGE O=C(CCCSc1nc2ccc([N+](=O)[O-])cc2s1)NN=Cc1ccc(Cl)cc1 1084434764 HZXYGMVKADDWDO-UHFFFAOYSA-N 434.930 4.881 50 10 IJGE Cc1sc2nc(CS[C@@H](C)C(=O)NNc3ccc(C(C)C)cc3)nc(O)c2c1C 1449547578 YJSTWOPMAUWDQM-AWEZNQCLSA-N 430.599 4.902 50 10 IJGE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NNc1ncc(Br)cc1C 1451965042 GMQXCNSTVFCFKI-XFFZJAGNSA-N 430.224 4.598 50 10 IJGE C=C(CNC(=O)NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1)c1ccccc1 1635923894 ZWQKSTGLXXSJBA-UHFFFAOYSA-N 449.576 4.982 50 10 IJGE CCCc1nn(C)c2c1[C@@H](c1ccc(N(CC)Cc3ccccc3)cc1)C(C#N)=C(N)O2 1865707351 VBVDVTAOQGSHTG-QHCPKHFHSA-N 427.552 4.617 50 10 IJGE COc1ccc(/C=C(\C#N)c2nc(-c3ccc(OC)c(OC)c3OC)cs2)c(OC)c1 1872795113 NXTWKNDVDKEHOC-XNTDXEJSSA-N 438.505 4.917 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCCCC[C@@H]1NC(=O)OC(C)(C)C 1880761483 NTZAQNKGUKUECK-SOUVJXGZSA-N 435.403 4.748 50 10 IJGE CC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1880767770 SBAICNRSXNAYJK-KFWWJZLASA-N 435.403 4.558 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1cccc(Br)c1Cl 1882086360 ASDVILQYKMJXKX-JTQLQIEISA-N 427.564 4.933 50 10 IJGE CC1(C)C[C@H](N(Cc2ccccc2)S(=O)(=O)c2cc(CCl)ccc2Cl)CO1 1915482641 WKYITVYNIWVHEK-KRWDZBQOSA-N 428.381 4.837 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cscc1C(F)(F)F 1916374491 KIGQWFYBQHKRID-ZDUSSCGKSA-N 436.293 4.819 50 10 IJGE O=S1(=O)CCC[C@H]1[C@H](Cl)c1c(Br)sc(Br)c1Cl 1923054858 LDPWINBIYXNAFQ-NJGYIYPDSA-N 443.009 4.784 50 10 IJGE C[C@@H](Br)Cc1cc(I)ccc1NC(=O)OC(C)(C)C 1951696153 PMYZCNVFADRGMN-SECBINFHSA-N 440.119 4.964 50 10 IJGE COC(CBr)(CBr)Cc1ccc(Cl)c(Br)c1 1979518686 XSDRRPDXYQFHHN-UHFFFAOYSA-N 435.381 4.820 50 10 IJGE CCN(C[C@](C)(CI)OCC1CC(C)(C)C1)C(=O)OC(C)(C)C 1989575459 HHIWVZGGYDADGY-SFHVURJKSA-N 439.378 4.890 50 10 IJGE CCC[C@H]1C[C@H]1COC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1993096496 DQEUQNPNHABYPM-GJZGRUSLSA-N 437.362 4.644 50 10 IJGE C[C@@H](CCBr)CCNC(=O)c1cccc(Br)c1Br 2031479439 XUCZZTMKASBLCE-VIFPVBQESA-N 441.989 4.753 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc([S@@](C)(=O)=NC[C@H](Br)C(F)(F)F)c1 2044693273 JIWZJEYDTODTCG-UOXLDJKESA-N 445.301 4.816 50 10 IJGE Brc1cc2c(cc1[C@@H](Br)[C@H]1C[C@H](Br)C1)OCCO2 2076182060 MTSYOYXQEHAIQW-UPFKWVMWSA-N 440.957 4.830 50 10 IJGE C[C@@H](c1cnn(Cc2ccccc2)c1)n1c(CCl)nc2cncc(Br)c21 2095439357 JCTWPAUYBNWAOB-ZDUSSCGKSA-N 430.737 4.787 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@H]2CCC[C@]2(CCl)C1 2103177296 WIICUULWBTWHTN-OQPBUACISA-N 427.589 4.754 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@H](Cl)C2(CCCC2)C1 2117744747 WKGPQOPPMXBWFT-VIFPVBQESA-N 427.589 4.897 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C[C@@H](CBr)c2ccccc2)CC2(CCC2)C1 2163061721 HSXNGTTVVQKQBQ-RTBURBONSA-N 437.422 4.934 50 10 IJGE CO[C@H]1CCN(CC2(CBr)CCCCCC2)[C@H](CNC(=O)OC(C)(C)C)C1 2163063238 PCPWZBFFJIKLLS-ROUUACIJSA-N 447.458 4.726 50 10 IJGE CC1(C)CC[C@H](NC(=O)[C@@H](Br)C2CCCC2)[C@H](CNC(=O)OC(C)(C)C)C1 2167032405 MQALBXVXYOQHIY-ULQDDVLXSA-N 445.442 4.776 50 10 IJGE Cc1cc(C(=O)N2CC[C@@](CBr)(C(F)(F)F)C2)sc1Br 2167691489 GYWCXBZWOGKFQI-NSHDSACASA-N 435.103 4.609 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]23CCC[C@@]2(CN(Cc2ccc(CBr)cc2)C3)C1 2182844671 HAVVBIWXECMLGF-SZPZYZBQSA-N 435.406 4.805 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@@]1(C)CCN(Cc2ccccc2)C1 2184940008 HIQQILLENKLLFD-NRFANRHFSA-N 447.808 4.905 50 10 IJGE CC(C)N(CCCCI)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2243586153 MDZGLPGYSJXHQR-MRXNPFEDSA-N 438.394 4.559 50 10 IJGE C[C@@](CCl)(CI)OCc1c(F)cc(Br)cc1F 2250054985 MNPXKOXDJANMDP-LLVKDONJSA-N 439.465 4.676 50 10 IJGE CN(Cc1cccc(I)c1)c1c(F)cccc1CBr 2265549551 YWGWMUCJPVNHJK-UHFFFAOYSA-N 434.090 4.962 50 10 IJGE C[C@H]1CN(C(=O)c2ccc(Cl)c(I)c2)CC[C@H]1CCCl 2283654757 FDEPOMWAMZTRET-WDEREUQCSA-N 426.125 4.672 50 10 IJGE CC(CC(=O)Nc1cccc(Cl)c1C)=NNC(=O)COc1ccc(Cl)cc1Cl 2297710180 CIIWDGHRVHEGFS-UHFFFAOYSA-N 442.730 4.855 50 10 IJGE C[C@@]1(CNCc2ccc(I)c(Br)c2)CCC[C@H]1Cl 2325228414 HSQRPGSIEWRLIT-KGLIPLIRSA-N 442.566 4.941 50 10 IJGE COc1ccc(OC)c(C=C(C#N)c2nc(-c3ccc(OC)c(OC)c3OC)cs2)c1 2331491381 AYKUFAYKAMUCCL-UHFFFAOYSA-N 438.505 4.917 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN(C[C@]2(CBr)CC2(F)F)C1 2351886687 CLWRLQLZCWIWAB-HDMKZQKVSA-N 437.369 4.518 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Br)[C@]12COC[C@H]1C2(F)F 2360166956 YSYGWCSDXCFOQD-JLLWLGSASA-N 432.486 4.829 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)NC(=O)Cc1ccc(Br)cc1Cl 2365959170 LCCBNMDPXWLJAG-CQSZACIVSA-N 425.592 4.959 50 10 IJGE O=C(CCCOc1ccc(Cl)cc1Cl)Nc1nnc(CCBr)s1 36238461 YANAVEDKSFWDEC-UHFFFAOYSA-N 439.162 4.580 50 10 IJGE Cc1cc(Br)c([C@H](Cl)[C@H]2CCCCS2(=O)=O)cc1Br 169105586 VSQLLOCAVFAPGZ-OLZOCXBDSA-N 430.589 4.767 50 10 IJGE CC(=NNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccc2c(c1)Nc1ccccc1S2 254392693 YATBOLRMQYBMHK-UHFFFAOYSA-N 449.448 4.865 50 10 IJGE C[C@H]1C[C@H](Br)CCN1C(=O)c1cc(Br)c(Br)s1 705503164 VSUPQEIHGOKQEU-NKWVEPMBSA-N 446.002 4.661 50 10 IJGE CS(=O)(=O)CCCCC(CBr)(CBr)C1CCCCCC1 706371696 JFDCAIJOCKYBDC-UHFFFAOYSA-N 432.262 4.948 50 10 IJGE COc1ccc(C(=O)NN=Cc2cn(-c3ccccc3)nc2-c2ccccc2C)c(OC)c1 729938346 MSGBMWIUNAMGMN-UHFFFAOYSA-N 440.503 4.629 50 10 IJGE Cc1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c(-c2nc(C3CC3)no2)c1 799404525 XXBBHIINKYPLPA-UHFFFAOYSA-N 442.401 4.962 50 10 IJGE C/C(=C/C(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1ccc([N+](=O)[O-])cc1 804207445 QPLBWEXTPPFVCQ-QBFSEMIESA-N 443.385 4.617 50 10 IJGE Cc1cc(NNC(=O)c2cc3cccc(C(F)(F)F)c3nc2O)ccc1Br 1137684824 DAWPVVYKOVCTAT-UHFFFAOYSA-N 440.219 4.787 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)NCc2cc3ccccc3nc2O)c1C 1540171430 RPWLOKCAYCZSBF-HMAPJEAMSA-N 436.515 4.880 50 10 IJGE O=C(Cc1csc(-c2ccccc2Cl)n1)NNc1nc2ccccc2[nH]c1=S 1640943102 GVPBNUJVWZIQRH-UHFFFAOYSA-N 427.942 4.755 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccn2)cc1 1865692473 BOEGNIVRWURSIA-QHCPKHFHSA-N 449.514 4.941 50 10 IJGE CCC[C@@H](NC(=O)[C@H](c1ccc(OC)cc1)C(C)C)C(=O)Nc1ccc(SC#N)cc1 1866981852 YZKHKPSNNKPEGN-YADHBBJMSA-N 439.581 4.932 50 10 IJGE COc1ccc(OC)c(-c2csc(/C(C#N)=C(\O)c3cc4ccccc4oc3=O)n2)c1 1873920983 ONOYAYQFRSPAPL-FXBPSFAMSA-N 432.457 4.884 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCN(Cc2ccccc2)C(C)(C)C1 1881488956 CQPNQBHHUXHHQV-ROUUACIJSA-N 425.411 4.965 50 10 IJGE COc1cccc(Br)c1C(=O)N(Cc1ccccc1)C[C@@H](C)Br 1914606725 BIMXXTRFICJPBH-CYBMUJFWSA-N 441.163 4.884 50 10 IJGE C[C@H](CCCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1F 1915069742 NWXMNXDUZVAYLZ-CYBMUJFWSA-N 434.758 4.797 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1Cc1ccc(Br)cc1Br 1943855101 ZUFQYOXOFLPYOA-CABZTGNLSA-N 425.990 4.959 50 10 IJGE C[C@H](Br)CCCNC(=O)c1c(Br)cccc1Br 1945333435 PYCLKQFBYHOXMN-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1F 2008321653 KSKLDYRUFLXQHF-CYBMUJFWSA-N 434.758 4.844 50 10 IJGE CC(C)N1C[C@H](Br)[C@H](Cc2ccc(Br)cc2Br)C1 2039262902 RTHKVHHSGJOKAZ-RISCZKNCSA-N 440.017 4.858 50 10 IJGE CC[C@H](Cl)CN(CC)C(=O)c1cc(I)ccc1Br 2044540283 AQGZFPKYXFXHCH-VIFPVBQESA-N 444.538 4.533 50 10 IJGE CC(C)[C@@H](Cl)c1cn(-c2cc(Br)ccc2I)nn1 2057428276 ZONKODQAXXNEQZ-GFCCVEGCSA-N 440.510 4.570 50 10 IJGE CN(C[C@H](Cl)C1CCCC1)c1ncc(I)cc1Br 2069526567 XSTTWPOTBMERNR-LBPRGKRZSA-N 443.554 4.683 50 10 IJGE Clc1cc(CN2C[C@H]3C[C@H](Br)C[C@H]3C2)ccc1I 2086655712 PXVMABXEGHPSNY-GDNZZTSVSA-N 440.550 4.550 50 10 IJGE Clc1cc(CN2[C@H]3CC[C@@H]2C[C@H](Br)C3)ccc1I 2086657325 DFNNPLMZBKKNLV-ZSBIGDGJSA-N 440.550 4.835 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C[C@H](CBr)c2ccccc2)CCC1(F)F 2163057415 BFYKMUHCLXSXAV-IRXDYDNUSA-N 447.364 4.790 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)c2ccccc2N1CC1(CBr)CCOCC1 2163059506 UGRSBAPMMFDBFA-MRXNPFEDSA-N 439.394 4.828 50 10 IJGE CN(Cc1ccc(Br)c(F)c1F)[C@@H](CCBr)C(F)(F)F 2178524969 UGWAQSGOKSZNMD-VIFPVBQESA-N 425.033 4.875 50 10 IJGE Cc1ccc(I)c(C(=O)Nc2ccccc2CCBr)c1 2240925043 NQLUHBCNNAHHOU-UHFFFAOYSA-N 444.110 4.789 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC[C@H](CI)O2)C[C@H]2CCCC[C@H]21 2242741016 QIYIKIPVQLAEOV-ADAWSYLGSA-N 435.346 4.539 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(CCCCCCCBr)C1 2277441002 YQJOFXHAKIPRII-OKYOBFRVSA-N 429.443 4.909 50 10 IJGE C[C@@]1(CNC(=O)c2cc(Br)c(F)cc2Cl)CCC[C@H]1Br 2286883710 QMRKCCQQJFUJFX-OCCSQVGLSA-N 427.539 4.925 50 10 IJGE COc1ccc(C=C(NC(=O)c2ccccc2)C(=O)NN=C(C)C=Cc2ccccc2)cc1 2296652637 NCHREFJEXWKMQY-UHFFFAOYSA-N 439.515 4.672 50 10 IJGE Cc1ccc(NC(=O)COc2ccc(C=C(C#N)C(=O)N[C@@H]3CCCC[C@@H]3C)cc2)cc1 2297500522 LTHDIUBJMWFOSZ-YADARESESA-N 431.536 4.614 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1Cc1ccc(Cl)c(I)c1 2300241385 YKPOEIGGHVDZJG-MWLCHTKSSA-N 428.539 4.692 50 10 IJGE CN(Cc1sccc1I)[C@@H](CCBr)C(F)(F)F 2301069640 ZEIITRMYVAEWDO-VIFPVBQESA-N 442.082 4.500 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2cccnc2)C(=O)C1=Cc1ccc(-c2ccccc2Cl)o1 2314618963 XMIMIUAJJDBLJL-UHFFFAOYSA-N 429.863 4.787 50 10 IJGE CC1(C)CC(NC=C(C#N)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC(C)(C)N1 2318462964 UGKAJKGXGGKYCP-UHFFFAOYSA-N 428.886 4.604 50 10 IJGE COc1ccc(CC(=O)NN=Cc2ccc(OCc3cc(C)ccc3C)c(OC)c2)cc1 2323332120 WMHSHKVUNWMXJG-UHFFFAOYSA-N 432.520 4.592 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)C(C#N)=CN(c1ccccc1)c1ccc(N)cc1 2324430169 RJPQRGDXNNHINM-UHFFFAOYSA-N 426.476 4.630 50 10 IJGE C[C@@H]1CCCN(C[C@]2(CBr)CC2(F)F)[C@@H]1CCCNC(=O)OC(C)(C)C 2351888099 UATYCCRTQMMPJZ-IIDMSEBBSA-N 439.385 4.812 50 10 IJGE O=C(NN=Cc1ccccc1Br)c1nc(-c2ccccc2)n2c1CCCCC2 3264600 DHZWYHUGLWRKFB-UHFFFAOYSA-N 437.341 4.803 50 10 IJGE Cc1cc(Cl)ccc1Nc1ncnc(NNC(=O)c2ccc(Cl)cc2)c1[N+](=O)[O-] 40590595 MLTYMNXNCRFLEJ-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE Cc1ccccc1C(=O)NNc1ncnc(Nc2cccc(Cl)c2Cl)c1[N+](=O)[O-] 40646704 IDXGBAUZJHBQEU-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2Cl)CCC3)nc1 40812769 LVQIXINYXHEBMF-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE COc1ccc(OC)c(/C=N/NC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)c1 40866530 GDVRGXSRCVEUQK-WPWMEQJKSA-N 432.520 4.559 50 10 IJGE O=C(CCCc1ccccc1)N/N=C/c1ccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 59156856 BYZGIBYVZGNNGG-LFVJCYFKSA-N 448.435 4.768 50 10 IJGE CCCCCOc1ccc(/C=N\NC(=O)c2cccn(Cc3ccc(C)cc3)c2=O)cc1 169920131 QJIFVQGOMUHDAJ-IMRQLAEWSA-N 431.536 4.538 50 10 IJGE COc1cc(C=NNC(=O)COc2ccc(Cl)cc2)ccc1OCc1ccc(C)cc1 252589577 AKTYGSKGHXKEER-UHFFFAOYSA-N 438.911 4.765 50 10 IJGE ClCc1c(Br)nn(-c2ccc(Br)cc2)c1Br 309201157 NNTBMNDRCOYUFX-UHFFFAOYSA-N 429.337 4.899 50 10 IJGE C[C@@H](Br)C[C@@H]1CCCCN1C(=O)c1sccc1I 311059288 JMVICAQQJSAOOQ-ZJUUUORDSA-N 442.160 4.521 50 10 IJGE CN(Cc1ccccc1)C(=O)N1CCC(C(=O)NN(c2ccccc2)c2ccccc2)CC1 727293725 XUYXLBDAPUOCEV-UHFFFAOYSA-N 442.563 4.820 50 10 IJGE Cc1ccccc1[C@H](NC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)C1CC1 732895301 ZCTWQJYHBFYLHF-XMMPIXPASA-N 447.510 4.808 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3cc(-c4cccnc4)ccc3C)n[nH]2)cc1C 797654399 ICLUJPBFJWIDDD-UHFFFAOYSA-N 440.507 4.530 50 10 IJGE C[C@H](OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)c1cc(F)ccc1F 920156131 GTCRUGPOOJXJAH-JIHKLPAASA-N 432.430 4.953 50 10 IJGE Cc1cc(C=NNC(=O)[C@@H]2COc3ccccc3O2)c(C)n1-c1cccc(Cl)c1Cl 1084348352 OYTHOMMBSNRJKN-FQEVSTJZSA-N 444.318 4.691 50 10 IJGE CC(=O)c1ccc(C(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)cc1C 1124197512 DGNNEMKOLRJKTE-UHFFFAOYSA-N 436.895 4.505 50 10 IJGE C#Cc1ccc(CNC(=O)NNC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)cc1 1682680031 JDQLSHCZAFKARZ-UHFFFAOYSA-N 449.963 4.758 50 10 IJGE CCOc1c(Br)cc(C=NNC(=O)COc2cccc(C(C)C)c2)cc1OC 1772753574 OOSWEVHHDVKHDO-UHFFFAOYSA-N 449.345 4.509 50 10 IJGE N#CSc1ccc(NC(=O)c2ccc3c(c2)C(=O)N(c2ccccc2Cl)C3=O)cc1 1859467227 RGYPFDPNYZFLFN-UHFFFAOYSA-N 433.876 4.966 50 10 IJGE O=S(=O)(c1cccc(Br)c1)N(Cc1ccccc1)[C@H](CCl)C1CC1 1915218267 ZEHHQCUWOBPTKS-GOSISDBHSA-N 428.779 4.657 50 10 IJGE CC1(C)[C@H](Br)CCN1Cc1ccc(Br)cc1Br 1943854169 YGBDXEKKYLJFHE-GFCCVEGCSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@H]2CCCCN(C[C@H](CBr)C3CCC3)C2)C1 1966480595 CKNFHIVAFWRPCS-ROUUACIJSA-N 429.443 4.767 50 10 IJGE C[C@@H]1CN(C[C@@H](CBr)C(C)(C)C)C[C@@H](C)N1C(=O)OCc1ccccc1 1977952910 SSJSABSWMOSKLH-ZHALLVOQSA-N 425.411 4.775 50 10 IJGE CC(C)(C)CC1CC(O[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2I)C1 1987833960 OLUPIGLTQPSQMC-NEXFUWMNSA-N 437.362 4.641 50 10 IJGE Clc1cc(CN2CCC[C@H](CBr)C2)ccc1I 2026565158 ZEIMHYOHDQRYAQ-LLVKDONJSA-N 428.539 4.552 50 10 IJGE CC(C)(C)OC(=O)N1CCS(=O)(=NCCCCCCCCCBr)CC1 2044704253 BCOBYRRIXRGFED-UHFFFAOYSA-N 439.460 4.831 50 10 IJGE CC[C@@H](CBr)CN(C1CC1)[C@H](CCNC(=O)OC(C)(C)C)C(F)(F)F 2044706438 UGSYAVODDZPSOI-GXTWGEPZSA-N 431.337 4.718 50 10 IJGE CC(C)N(CC1CCN(C(=O)OC(C)(C)C)CC1)C[C@@H](Br)C(F)(F)F 2044707075 ZSFUXPSSCBGIBO-CQSZACIVSA-N 431.337 4.670 50 10 IJGE CC[C@H](CBr)CN1CC[C@H](C(F)(F)F)C[C@@H]1CNC(=O)OC(C)(C)C 2045432973 YWDFPNGKVOXCFA-HZSPNIEDSA-N 431.337 4.575 50 10 IJGE FC1(F)[C@H]([C@@H](Br)c2cc(I)cc3c2OCC3)C12CC2 2095597152 RBTPIKNIKZJEGC-CMPLNLGQSA-N 441.053 4.707 50 10 IJGE COC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1CCCCCCCCCBr 2106781560 IYRHELKKIHSWLY-SFHVURJKSA-N 435.447 4.680 50 10 IJGE CCC(CC)(CBr)CN1C[C@H](CNC(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1 2106783775 COBWLEDGNFHTNF-UONOGXRCSA-N 445.364 4.823 50 10 IJGE Cc1c(Br)ccc([C@@H](Cl)[C@H]2CCCS(=O)(=O)C2)c1Br 2138873144 WMJUJEBXOKNGFC-ZANVPECISA-N 430.589 4.625 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1cc(Cl)cc(Cl)c1O 2174531190 XYQZTAXBYLBVLL-VIFPVBQESA-N 430.113 4.813 50 10 IJGE ClC[C@H](CC1CCOCC1)NCc1cccc(Br)c1Br 2195479126 OADHTSKUDYQJCX-ZDUSSCGKSA-N 425.592 4.725 50 10 IJGE COc1cc(F)c(Cl)cc1[C@@H](Br)c1c(Br)nn(C)c1C 2207379679 RIPKRQDZWMQHIZ-GFCCVEGCSA-N 426.511 4.776 50 10 IJGE Cc1sc(C(=O)N2CCC(F)(F)[C@H](CBr)C2)c(C)c1Br 2234473962 IQLKAKBRCJHCFN-SECBINFHSA-N 431.140 4.620 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@]12CCC[C@@H](CN(C(=O)[C@@H](Br)C3CCCC3)C1)C2 2234909195 KYLMLHFQWHDZRH-LDBYXDLTSA-N 443.426 4.578 50 10 IJGE Cc1ccc(N2C[C@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)c(CBr)n1 2287163826 STIYPVZNSZXXNQ-DHIUTWEWSA-N 426.402 4.777 50 10 IJGE CC[C@H](Cl)CN(CC)Cc1ccc(I)c(Br)c1 2306218611 CCTYFODJQUGWHI-NSHDSACASA-N 430.555 4.893 50 10 IJGE CC(C)(CI)CN1CCC[C@@]2(CCCN(Cc3ccccc3)C2)C1 2306809667 LMWLMEGUVJVBNH-OAQYLSRUSA-N 440.413 4.826 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@H]2[C@@H]3CCCO[C@@H]32)c1 2313495375 AIMRLQXKYUXFEA-FQUUOJAGSA-N 438.985 4.943 50 10 IJGE CCOc1cc(C=C2C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1 2314611104 QPDTYRDNUBLMAY-UHFFFAOYSA-N 444.531 4.913 50 10 IJGE Clc1ccc(CN2C[C@H]3CC[C@H]2C[C@H]3Br)c(I)c1 2318546851 WLDFOHDQCMNIQK-JIMOISOXSA-N 440.550 4.692 50 10 IJGE Clc1ccc(I)cc1COc1cc(CBr)ccn1 2327243037 ZYNKWEFKBOKVQL-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)Cc3ccc(OC)c(OC)c3)n2)c(OC)c1 2331385283 PKEKILAUVRWBAU-UHFFFAOYSA-N 438.505 4.880 50 10 IJGE F[C@]12CCC[C@]1(CCl)CN(Cc1cc(I)ccc1Cl)C2 2380527229 KMLBYEIBCXMMQS-GJZGRUSLSA-N 428.116 4.878 50 10 IJGE COc1ccc(C=NNC(=O)c2ccccc2Br)cc1COc1ccccc1 15933630 STHICRRYVCQADC-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE C/C(=N\NC(=O)Cn1c(C(F)(F)F)nc2ccccc21)c1ccc(Cl)c(Cl)c1 33957742 VUBLXLWNEUCSAI-KIBLKLHPSA-N 429.229 4.902 50 10 IJGE COc1ccc(/C=N/NC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)c(OC)c1 40910789 CAXVHLPUKNWJIT-WPWMEQJKSA-N 432.520 4.559 50 10 IJGE O=C(CSCc1ccc(Cl)cc1)N/N=C1/C(=O)N(Cc2ccccc2)c2ccccc21 59155723 MZMMNCSPDBLQLP-SLEBQGDGSA-N 449.963 4.641 50 10 IJGE Cc1ccccc1[C@H](C)NC(=O)/C(C#N)=C\c1c[nH]nc1-c1ccc(Br)cc1 96993768 DHOWSVPAUOLUNY-ZCQLHAAUSA-N 435.325 4.932 50 10 IJGE Cc1ccc(C23C[C@H]4C[C@@H](CC(NC(=O)N/N=C/c5ccc([N+](=O)[O-])cc5)(C4)C2)C3)cc1 100489889 QXPQFXKSXUZSOR-FNVNHVTFSA-N 432.524 4.827 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCC[C@H](CBr)C1 123115799 ZLOMEZHHKJIJHK-SSDOTTSWSA-N 446.002 4.520 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)N(c2cccc(C)c2C)S(=O)(=O)c2ccccc2)cc1 207129188 IDHXSDGKEPXDIC-PGMHBOJBSA-N 446.528 4.641 50 10 IJGE CCCC[C@H](CC)CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1I 231313555 VXSXVTQFBVRSGL-KKUMJFAQSA-N 425.351 4.642 50 10 IJGE CC(/C=C\c1ccccc1)=NNC(=O)c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1 254383530 ASMUQJIDNIXRLY-BKUNMLSWSA-N 433.533 4.615 50 10 IJGE CC[C@H](C)C(C)=NNC(=O)c1cccc(S(=O)(=O)Nc2cc(Cl)ccc2Cl)c1 254407499 DUXBPCCFFRCYKO-LBPRGKRZSA-N 442.368 4.946 50 10 IJGE CCCOc1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)NN=Cc2ccccc2F)cc1 254705069 MTCCMWWZFNYQNP-CLIDQISESA-N 445.494 4.536 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@@H](CI)C(C)C)cc1Cl 385099917 MHEDOZGEENXZFQ-LBPRGKRZSA-N 444.538 4.600 50 10 IJGE Clc1ccc(I)c(CN2CCCC[C@@H]2CBr)c1 405345986 QCRBYIOEQAISSO-GFCCVEGCSA-N 428.539 4.694 50 10 IJGE COC(=O)[C@]1(C2CC2)C[C@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 688654895 SKCMDIFLVOEBIE-WMZHIEFXSA-N 433.621 4.741 50 10 IJGE FC(F)(F)c1cc(N2CC3(CN(Cc4ccccc4)C3)C2)ccc1CBr 706170521 TUKSIEDOHKTIGV-UHFFFAOYSA-N 425.292 4.923 50 10 IJGE CC[C@@H](NC(=O)NNC(=O)c1ccc(C(C)(C)C)cc1)c1nc(C(F)(F)F)cs1 745935859 SOSRNXXCYPZZQD-CYBMUJFWSA-N 428.480 4.555 50 10 IJGE Cc1ccc(-n2nc(C)c(CC(=O)NNc3ccc(C#N)c(Cl)c3)c2C)cc1Cl 753303612 YDRDSGPXQFBMBW-UHFFFAOYSA-N 428.323 4.662 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c(O)c1 1084586195 GBPJSJCQIBCYSG-UHFFFAOYSA-N 444.535 4.563 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNC(=O)c1cc2c(s1)CCCCC2 1440378753 JGEPKDUMYTTZBP-UHFFFAOYSA-N 438.471 4.675 50 10 IJGE C=CCN(CC=C)C(=O)c1ccc(NC(=O)NNc2ccc(Br)cc2C)cc1 1465398777 KLTDNABBPCQNJT-UHFFFAOYSA-N 443.345 4.720 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)[C@@H](C)Oc3cccc(C)c3C)cc2)cc1 1628346766 ACFLECWWQJRUKO-LJQANCHMSA-N 446.503 4.527 50 10 IJGE COc1cccc(O[C@@H](C)C(=O)NN=Cc2ccc(OCc3ccc(C)cc3)c(OC)c2)c1 1772756215 OTRQPGCLGVNXJV-IBGZPJMESA-N 448.519 4.509 50 10 IJGE CCCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@H]2c1c(F)cccc1Cl 1865685137 GBZYHLOUAGXTPI-SFHVURJKSA-N 438.890 4.979 50 10 IJGE CCCc1nn(Cc2ccc(F)cc2)c2c1[C@H](c1cccc(OCC)c1)C(C#N)=C(N)O2 1865689508 AWYXDQGOCSDBLO-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE CC(C)C[C@H](CNC(=O)OC(C)(C)C)C[C@@H](CBr)NC(=O)OC(C)(C)C 1880731268 ZMQLZBNXJMVEKL-GJZGRUSLSA-N 437.419 4.852 50 10 IJGE CC(C)(C)[C@@](C)(CBr)CN1CCC(NC(=O)OCc2ccccc2)CC1 1904845320 QBGILOIQHSUNSS-NRFANRHFSA-N 425.411 4.825 50 10 IJGE Cc1csc(C)c1S(=O)(=O)N(Cc1ccccc1)C1(CBr)CCC1 1915750676 XBPYZSICRJLVRQ-UHFFFAOYSA-N 428.417 4.873 50 10 IJGE FC(F)CN(CCBr)Cc1c(Br)cccc1Br 1945328061 XTIRUGCGZHQJIZ-UHFFFAOYSA-N 435.932 4.674 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@H](CI)O2)[C@H]1C(C)(C)C 1987729208 ZDOYXACJADMYEF-HBUWYVDXSA-N 437.362 4.785 50 10 IJGE CO[C@@H]1C[C@@H]1COc1c(Br)cc(Br)cc1CBr 2014582838 LNZGJOWARFCBFW-LDYMZIIASA-N 428.946 4.520 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OCc2cccc(F)c2)CC1 2024641614 CCHLFMSRADWLCC-UHFFFAOYSA-N 449.304 4.547 50 10 IJGE CCC[C@H](Br)CCNC(=O)c1cc(Br)ccc1Br 2029921164 DKMPHQFLNGMWCI-VIFPVBQESA-N 441.989 4.895 50 10 IJGE CC(C)(C)C[C@@H](CBr)CNC(=O)c1sccc1I 2038695333 AHCKQRAHMVGHKV-VIFPVBQESA-N 444.176 4.530 50 10 IJGE C[C@H](CCBr)CCN1CCC[C@@H](N(CC(F)F)C(=O)OC(C)(C)C)C1 2044698708 DTVJQJQSLPGATF-HUUCEWRRSA-N 427.374 4.764 50 10 IJGE CN(C(=O)c1sccc1I)[C@H]1CCCCC[C@H]1Br 2052430058 VISIRNXKARHUHC-KOLCDFICSA-N 442.160 4.521 50 10 IJGE BrC[C@@H]1C[C@@H]2CN(Cc3cccc(Br)c3Br)C[C@H]21 2053982119 KKOBDCRZKIFNKX-TUAOUCFPSA-N 438.001 4.674 50 10 IJGE FC(F)Oc1cc(I)c(OC(F)(F)F)c(CBr)c1 2060222095 ISOBZGGVASYZBQ-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H]3CC[C@]3(CBr)C2)c1 2078145547 FFFBFEMNMWCIDR-FZMZJTMJSA-N 440.550 4.552 50 10 IJGE Cn1cc(Br)c(COc2c(Br)cc(Cl)cc2CCl)n1 2087325939 WYLBHSARFRMWMG-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE CC(C)(C)OC(=O)N(CC(F)F)[C@@H]1CCCN(C[C@@H](CBr)CC2CC2)C1 2112865631 DRBRDFSWSIUKLW-HZPDHXFCSA-N 439.385 4.764 50 10 IJGE CC(C)[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](C)C[C@H]1C(F)(F)F 2121769732 AFZRZXVZHBTBTN-KFWWJZLASA-N 445.364 4.916 50 10 IJGE C[C@@H](c1cnn(Cc2ccccc2)c1)n1c(CCCl)nc2cc(Br)cnc21 2146218640 ZXJADTDUYNWJTA-AWEZNQCLSA-N 444.764 4.829 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2Cc1cnn(Cc2ccccc2)c1 2153119915 MYOIYCFHIBYVIJ-UHFFFAOYSA-N 444.764 4.577 50 10 IJGE O=C(c1ccccc1OCc1ccccc1)N1C[C@H](CBr)[C@@H](C(F)(F)F)C1 2163359237 QUNANSMHRCZCDN-RDJZCZTQSA-N 442.275 4.911 50 10 IJGE Cc1nc([C@H](Cl)c2cc3c(cc2Br)NC(=O)C3)c(Br)s1 2169495899 ONYISAPMTIJTFE-LLVKDONJSA-N 436.556 4.799 50 10 IJGE CC(C)(C)[C@@]1(CBr)CCN(C[C@@H]2CC2(Br)Br)C1 2213091305 MMPKHOISHZNSBJ-CMPLNLGQSA-N 432.038 4.626 50 10 IJGE C[C@@H]1C[C@]1(F)CO[C@@](C)(CI)c1ccccc1Br 2219942504 LSWQOWYQPZUWKJ-SWHYSGLUSA-N 427.095 4.864 50 10 IJGE ClCCc1nc2cc(Br)c(Br)cc2n1C[C@H]1C[C@@H]1Cl 2225702271 PNYZSWHLAIIMAC-XCBNKYQSSA-N 426.967 4.970 50 10 IJGE CCN[C@H](c1c(F)cc(Br)c(F)c1Br)[C@@H]1C[C@H]1Br 2260006480 SPCQWMZLVIHLAO-YZGOCOMISA-N 447.943 4.924 50 10 IJGE CS(=O)(=O)c1csc([C@H](Br)c2cc(F)c(Br)cc2F)c1 2282135474 FQUYCPOKPKWZIS-GFCCVEGCSA-N 446.132 4.677 50 10 IJGE C[C@]1(CBr)CCCN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282976131 SQLLIBBSADSZKK-CQSZACIVSA-N 427.539 4.879 50 10 IJGE CC1=C(C#N)C(=O)N([C@@H](C)c2ccccc2)C(=O)C1=CNc1ccc([N+](=O)[O-])cc1Cl 2314585739 QUNNLHFPRGXGTO-AWEZNQCLSA-N 436.855 4.514 50 10 IJGE CC(C)C[C@H](CBr)CN=[S@]1(=O)CCN(C(=O)OC(C)(C)C)CC1(C)C 2328518707 JDDRLQOEWILHEM-BZQUYTCOSA-N 439.460 4.541 50 10 IJGE CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)C(C#N)=Cc3cccc(F)c3)c2C(N)=O)C1 2329674474 DSWQIWTWUFEHLG-OAHLLOKOSA-N 425.529 4.683 50 10 IJGE CC(C)(C)[C@H]1[C@@H](Cl)CCN1C(=O)c1ccc(Cl)cc1I 2365591196 KNTGVBYBKDLNNJ-WCQYABFASA-N 426.125 4.813 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@H]2CC[C@H]1[C@H](Br)C2 2377482698 LORNUBYPLPVOLD-NYNLCMDTSA-N 425.523 4.630 50 10 IJGE COc1cc(OC)c([C@@H]2C(C#N)=C(N)Oc3ccc4ccccc4c32)cc1Br 12575430 YHVMUFWKJGPIET-HXUWFJFHSA-N 437.293 4.838 50 10 IJGE CCc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)COc2ccccc2)CCC3)cc1 40816024 DCDZFOUDHQJLMN-SGWCAAJKSA-N 445.519 4.638 50 10 IJGE Cc1cc(OCC(=O)NNC(=O)/C=C/c2ccc(Cl)cc2Cl)cc(C)c1Cl 40844780 OUDAZQAHWRGXEK-GQCTYLIASA-N 427.715 4.503 50 10 IJGE CCCCOc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2Cl)cc1OC 40910936 XIPUIYKDNLTBJK-FSJBWODESA-N 425.312 4.710 50 10 IJGE COc1ccc(OC)c(/C=N/NC(=O)CSc2nc(-c3ccc(Cl)cc3)cs2)c1 40924754 BWZAPLNLFFVFAT-LSHDLFTRSA-N 447.969 4.723 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)/C(C#N)=C\Nc1cc(OC)c(Cl)cc1OC 217186867 OMAOOAIWPRRANU-NWCRWOLESA-N 443.931 4.761 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc3ccccc3c2C=NNC(=O)c2ccncc2)cc1 254746446 FAWVULDRUBULDM-UHFFFAOYSA-N 439.471 4.617 50 10 IJGE C[C@@H]1C[C@@H](O[C@](C)(CI)CNC(=O)OC(C)(C)C)CC(C)(C)C1 299976415 CMQDLGHMLAEVLC-HBUWYVDXSA-N 439.378 4.936 50 10 IJGE Fc1ccccc1[C@H](Br)c1cc(I)cc2c1OCC2 311601864 OLKHGFYBDHWQBS-AWEZNQCLSA-N 433.058 4.850 50 10 IJGE Oc1cc([C@H]2CN(Cc3ccccc3)C[C@@H]2CBr)ccc1Br 382676588 TZYRQJAGRHEFIY-JKSUJKDBSA-N 425.164 4.765 50 10 IJGE Cc1ccc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CI)cc1 382710620 HAXPYIGQDNGGMF-MOPGFXCFSA-N 435.305 4.782 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1C(=O)c1cc(Br)c(Br)s1 395261223 RBMDCMAHXNYWGQ-RQJHMYQMSA-N 446.002 4.661 50 10 IJGE C[C@H]1CCN(Cc2cc(Cl)ccc2I)[C@H]1CBr 405329388 FPNKRXWWMFRMAV-ZANVPECISA-N 428.539 4.550 50 10 IJGE CSc1cc(C)ccc1CNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 756995975 DSGUFKHPRDOCJR-STZFKDTASA-N 441.560 4.717 50 10 IJGE CCCN(CCC)c1ccc(C(=O)NN=Cc2c(C)nn(Cc3ccccc3)c2C)cc1 1083985414 WUFXFENSWIHLIK-UHFFFAOYSA-N 431.584 4.939 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(C)c1C=NNC(=O)[C@H](C)SCc1ccccc1 1084201125 LVKPTJYJHBCAJH-SFHVURJKSA-N 441.000 4.974 50 10 IJGE COc1ccc(OCc2cccc(Br)c2)c(C=NNC(=O)c2ccccc2)c1 1084631003 GNQPPDXJBRYZRC-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNC(=S)Nc2cccc(Cl)c2)cc1 1135740861 ZRNSLVCODKQIDC-UHFFFAOYSA-N 438.940 4.918 50 10 IJGE CC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)c1C(C)C 1538725487 SDQATIRXWSNEIZ-MRXNPFEDSA-N 443.613 4.936 50 10 IJGE COc1ccccc1/C(C#N)=C/c1ccc(OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 1615099349 IPFQNUHOKNHGDM-LICLKQGHSA-N 445.387 4.795 50 10 IJGE C=CCNC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc(-c3ccccc3)cc1)CCC2 1772748429 XGSDSPMNKXNZNY-UHFFFAOYSA-N 427.504 4.641 50 10 IJGE Cc1ccc(Cn2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2ccc(O)cc2)cc1 1865683884 KHTBQUMERQXWGP-HSZRJFAPSA-N 434.499 4.831 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2Cc1ccc(F)cc1 1865691080 IUCQGBYWTMTHSQ-HSZRJFAPSA-N 444.510 4.806 50 10 IJGE CCc1ccc(-c2ccc(C(=O)N/N=C\c3cn(C)c4ccc(OC)cc34)c(C)n2)cc1 1865760545 CNCGBOAEHJQMLG-DICXZTSXSA-N 426.520 4.884 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)CCc1ccccc1NC(=O)OC(C)(C)C 1887832984 MEGMCWZQLXAMOO-KOMQPUFPSA-N 425.367 4.598 50 10 IJGE CN(CC(C)(C)CI)[C@@H]1C[C@@H]2C[C@@H](OCc3ccccc3)C[C@H]21 1904649640 WIGPJQVCVONPEV-WJFTUGDTSA-N 427.370 4.763 50 10 IJGE C[C@H](c1cccs1)N(Cc1ccccc1)Cc1ccc(C(=O)NN)cc1Br 1915381544 JBZIHTCIDSGGTG-OAHLLOKOSA-N 444.398 4.878 50 10 IJGE C[C@@H](NC(=O)c1cc(Br)c(Br)s1)C(C)(C)CBr 1942907020 KOEHIVFRHHZFEI-ZCFIWIBFSA-N 448.018 4.813 50 10 IJGE ClCC1CCC(Nc2ncc(I)cc2Br)CC1 2015757722 WFKBAIARLUFBLD-UHFFFAOYSA-N 429.527 4.658 50 10 IJGE Clc1nc(Cl)n(C[C@@]23CC[C@@H]2CN(Cc2ccccc2)C3)c1CBr 2023079783 VXEHIRXIQULDOA-KDOFPFPSSA-N 429.189 4.997 50 10 IJGE CCCOCCCO[C@H](CI)c1ccccc1Br 2031755285 SQFWRUGPQMOPCC-CQSZACIVSA-N 427.120 4.759 50 10 IJGE CC[C@H](C)[C@@H](CI)NCc1c(F)ccc(Br)c1F 2081240354 HEOTYCLVPRCHNE-QPUJVOFHSA-N 432.090 4.667 50 10 IJGE CC(C)[C@H](Br)C(=O)N1C[C@H](NC(=O)OC(C)(C)C)CC12CCCCCC2 2106597074 NCLOKGIJTVNSBW-CVEARBPZSA-N 431.415 4.625 50 10 IJGE CCn1cc(S(=O)(=O)N(Cc2ccccc2)C2CCCCC2)cc1CBr 2123199869 ZCNHLZGDJOQCLD-UHFFFAOYSA-N 439.419 4.927 50 10 IJGE COc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)C(C)C)cc1CBr 2123270871 OTABEKQZHCBPMN-MRXNPFEDSA-N 440.403 4.826 50 10 IJGE CC1CCC(CNC(=O)[C@H](Br)C2CCCC2)(NC(=O)OC(C)(C)C)CC1 2136820204 WFTRBAJMBPVXMX-CZDRUDQFSA-N 431.415 4.530 50 10 IJGE COc1cc(Cl)c([C@H](Cl)c2nn(C)cc2Br)cc1Br 2137641694 WSNCWARQMSTQND-NSHDSACASA-N 428.939 4.935 50 10 IJGE O=C(N[C@@H]1C[C@H]2CC[C@H]1[C@@H](Cl)C2)c1scc(Br)c1Br 2139715173 RCZAEJHVZBVASX-ZRUAGYDASA-N 427.589 4.799 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CCC([C@@H](F)CCl)CC1 2163237931 HSXIJRBVVQKUDS-ZDUSSCGKSA-N 427.539 4.641 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](CNC(=O)C(F)(F)F)C2(CCC2)C1 2174053041 FUAMWARPZJSBGF-OAHLLOKOSA-N 441.376 4.749 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1N(C(=O)c2ccc(CBr)cc2)CCCC1(C)C 2184381684 OTPUTRUDXSOLEG-KRWDZBQOSA-N 439.394 4.737 50 10 IJGE Cc1c(Br)ccc(OCCCCCI)c1[N+](=O)[O-] 2220213756 FXCFZAZYYCBPDM-UHFFFAOYSA-N 428.064 4.650 50 10 IJGE CC(C)(C)OC(=O)NCc1cc(F)cc(NC(=O)[C@H](Br)C2CCCC2)c1 2265786030 FWFHUGVRYGYJBV-MRXNPFEDSA-N 429.330 4.743 50 10 IJGE CC(C)(C)OC(=O)NCc1nc2c(s1)CCN(CCCCCCCBr)C2 2277438524 LCOVRJXFEAJHJW-UHFFFAOYSA-N 446.455 4.871 50 10 IJGE COC[C@]1([C@H](Cl)c2c(F)cc(Br)c(F)c2Br)CCCO1 2288481548 XDDJHDQEKDDFMH-OLZOCXBDSA-N 434.502 4.965 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)C(C#N)=Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 2296818183 VXHXNBIZFVCTCD-UHFFFAOYSA-N 431.404 4.577 50 10 IJGE COc1ccc(C(=O)CCCC(=NNC(=O)c2ccccc2)c2ccc(OC)cc2)cc1 2297710733 MPSYPIIHNVHGPU-UHFFFAOYSA-N 430.504 4.891 50 10 IJGE CCCN(CCCBr)Cc1ccc(Cl)cc1I 2302318264 RBMZSYMQGJMLAD-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE Clc1ccc(C[C@@H](CBr)C2CCOCC2)cc1I 2315550811 IRPOUITWNBRBTN-LBPRGKRZSA-N 443.550 4.925 50 10 IJGE CC[C@H](Br)CCCNC(=O)c1ccc(Cl)cc1I 2317770412 GODIIJLNKNANMD-VIFPVBQESA-N 444.538 4.628 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NN=Cc1c(Cl)cccc1Cl 2328826248 NSWANTZZXJSZJE-SFHVURJKSA-N 436.339 4.580 50 10 IJGE COc1ccc(CCCCO[C@](C)(CBr)CNC(=O)OC(C)(C)C)cc1 2344026680 CBFLNEWDOGFEIA-HXUWFJFHSA-N 430.383 4.713 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@@H](Br)[C@@H]1OCCO[C@@H]1C 2360165167 JYCRNQWSJQJXQU-BZHVJNSISA-N 428.548 4.659 50 10 IJGE CC[C@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1 9874150 GZMKZUAEXATLDN-OALUTQOASA-N 426.557 4.854 50 10 IJGE CC(C)c1ccccc1OCC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl 13979991 ZAOSFCPZINPNGP-UHFFFAOYSA-N 439.339 4.502 50 10 IJGE CC(C)CCOc1cccc(C(=O)NNC(=O)c2ccc(OCc3ccccc3)cc2)c1 14644645 VHNAOISNXLHODZ-UHFFFAOYSA-N 432.520 4.765 50 10 IJGE CCOc1ccccc1C=NNC(=O)Cc1csc(Nc2cccc(C(F)(F)F)c2)n1 15985746 UUWRNRXRVMAYBZ-UHFFFAOYSA-N 448.470 4.997 50 10 IJGE COc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4cccc(C)c4C)c(C)c32)c1 40822156 NNWPNQNUKDJQSU-SGWCAAJKSA-N 445.519 4.936 50 10 IJGE COc1cc(/C=C2/C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1F 101334876 DLFGUPUADGKFQE-RGVLZGJSSA-N 448.494 4.662 50 10 IJGE COc1ccccc1/C=C(/C#N)C(=O)N(c1cccc(C)c1C)S(=O)(=O)c1ccccc1 207133265 COXRNFPVHRABBY-PGMHBOJBSA-N 446.528 4.641 50 10 IJGE BrCc1c(Oc2ccccc2I)nc2ccccn12 218230075 LLPNEYYWHSGXPW-UHFFFAOYSA-N 429.055 4.626 50 10 IJGE CC(C)(C)[C@@H](CCBr)NS(=O)(=O)c1ccc(Br)cc1Cl 231188199 XPGKRQYKLKDZKZ-GFCCVEGCSA-N 447.620 4.581 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)CCC(=O)Nc2ccc(Cl)cc2Cl)cc1 254438483 WDXZVGZGTNTCMG-UHFFFAOYSA-N 435.355 4.709 50 10 IJGE CC1(C)[C@@H](Br)CCN1C(=O)c1cc(Br)sc1Br 383842789 KOTFRKJMJZNIEO-ZETCQYMHSA-N 446.002 4.661 50 10 IJGE FC(F)(F)c1ccc(I)c(CBr)c1Br 575696064 RKHOUKFCGARNSD-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE Cc1ccccc1CC(=O)NNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 755947781 PBQXWJWVSDZSMP-OAQYLSRUSA-N 432.911 4.699 50 10 IJGE Cc1ccc(F)c(NNC(=O)c2cc(OCC(F)(F)F)cc(OCC(F)(F)F)c2)c1 760136832 HRUDJRPIGNACOB-UHFFFAOYSA-N 440.315 4.773 50 10 IJGE C[C@@H](OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)c1ccccc1[N+](=O)[O-] 764596253 HRHMWOWKXAVBDQ-GMYFBSLISA-N 441.447 4.583 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OC[C@H]2CCC3(CCCCC3)O2)c(-c2ccccc2)n1 786266833 DRBOUOKVHXVYML-BTZCDPCDSA-N 444.535 4.796 50 10 IJGE COc1cc(C=NNC(=O)Cc2ccc(F)cc2)ccc1OCc1ccccc1Cl 1084217032 PLHSWSHDTIOGAK-UHFFFAOYSA-N 426.875 4.760 50 10 IJGE Cc1ccc(-c2ccc(C=NNC(=O)c3ccccc3Br)o2)c([N+](=O)[O-])c1 1084584549 YITLQHURCIFIGD-UHFFFAOYSA-N 428.242 4.690 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=S)Nc3ccc(C)cc3C)cc2)cc1 1618578453 KSNJYJDYLZTWGZ-UHFFFAOYSA-N 433.533 4.930 50 10 IJGE Cc1c(C(=O)Nc2ccc(C(C)C)cc2)oc2c1C(=NNC(=O)c1ccncc1)CCC2 1772745562 FEKUUBGZTWFFHX-UHFFFAOYSA-N 430.508 4.829 50 10 IJGE CCc1cccc(CC)c1N1C(=O)c2ccc(C(=O)N(CCCl)CCCl)cc2C1=O 1866307512 UTSSDCDQUQTZHS-UHFFFAOYSA-N 447.362 4.532 50 10 IJGE COc1cc(C)c(-c2csc(/C(C#N)=C(\O)[C@H]3CC(=O)N(C(C)(C)C)C3)n2)cc1C 1872758172 OCGOONLRYWAPPS-MUNYZGMTSA-N 425.554 4.875 50 10 IJGE BrC[C@@H]1CC2(CCCC2)CN1Cc1ccc(I)cc1 1912772783 XQFIYXVFHZMVMJ-HNNXBMFYSA-N 434.159 4.821 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1F 1915765309 HIHPDUFOWLBNHK-UHFFFAOYSA-N 427.245 4.689 50 10 IJGE O=C(NC1(CCCBr)CC1)c1cc(Br)sc1Br 1942462304 YEXGJBLNZQWKFP-UHFFFAOYSA-N 446.002 4.711 50 10 IJGE BrCC1CCN(Cc2cccc(Br)c2Br)CC1 1943881040 NBVYAFYWIQMFJV-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE CCC(CC)(CCl)CNc1ncc(I)cc1Br 2015756480 GUVHZVOCJLTZBN-UHFFFAOYSA-N 431.543 4.906 50 10 IJGE CC[C@H](CBr)CN1CC[C@H](C(F)(F)F)C[C@H]1CNC(=O)OC(C)(C)C 2045432976 YWDFPNGKVOXCFA-RDBSUJKOSA-N 431.337 4.575 50 10 IJGE Cc1nn(C)c([C@@H](Br)c2ccc(F)c(Br)c2)c1Br 2072297861 DZBGMTNQXLTDHZ-NSHDSACASA-N 440.936 4.877 50 10 IJGE Fc1ccc(-n2nc(CBr)c(I)c2C(F)(F)F)cc1 2079256759 FWDPOBYZGBZTQU-UHFFFAOYSA-N 448.983 4.530 50 10 IJGE C[C@H]1C[C@@H](Br)[C@H](C)CN1Cc1ccc(I)c(Cl)c1 2086659019 SHJCNJWMTPQLKX-JFGNBEQYSA-N 442.566 4.938 50 10 IJGE Cn1nc(Br)c([C@H](Cl)c2c(Br)cc(F)c(Cl)c2F)n1 2226973393 YMHGZBRPACZBQV-SSDOTTSWSA-N 435.881 4.600 50 10 IJGE Fc1cc(Br)cc(F)c1COC1(CI)CCCC1 2259041422 FSJZBQHVPDNSLS-UHFFFAOYSA-N 431.058 4.992 50 10 IJGE Oc1nc(-c2c(Cl)cc(Br)cc2Cl)ncc1CCBr 2268070099 YIIWBZHHMYEUGN-UHFFFAOYSA-N 426.923 4.856 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CC1(CBr)CC(F)C1 2280359593 NKPQNCYMYFUEFU-UHFFFAOYSA-N 441.385 4.977 50 10 IJGE C[C@H]1CO[C@@](CBr)(Cc2ccc(Cl)c(I)c2)C1 2300240130 ILIUPKJSRPCFHJ-NOZJJQNGSA-N 429.523 4.677 50 10 IJGE CC[C@@H](C[C@H](C)Br)NCc1ccc(Cl)c(I)c1 2300241432 ZAYUDQAIRQGXLY-ONGXEEELSA-N 430.555 4.986 50 10 IJGE Brc1cccc(CN2C[C@H]3CC[C@H]2C[C@H]3Br)c1Br 2315481140 UAMKQNCQSXIFQJ-SUZMYJTESA-N 438.001 4.959 50 10 IJGE CC(C)[C@H](CBr)N(C)C(=O)c1c(Br)cccc1Br 2318840536 OJISFPYBGPUHET-NSHDSACASA-N 441.989 4.703 50 10 IJGE CC(C)Oc1cccc(C=NNC(=O)c2cccn(Cc3ccc(C(C)(C)C)cc3)c2=O)c1 2323662188 DWMZRMHDHDNBBX-UHFFFAOYSA-N 445.563 4.745 50 10 IJGE CC(C)N1C[C@H](Cc2cc(I)ccc2Cl)[C@@H](Br)C1 2327395898 WZXMVDVWQRKYCQ-AAEUAGOBSA-N 442.566 4.591 50 10 IJGE Clc1ccc(C[C@@]2(CBr)O[C@H]3CC[C@H]2C3)c(I)c1 2327576517 CUAITBOBOYJCDI-JKOKRWQUSA-N 441.534 4.820 50 10 IJGE CN(C)c1ccnc(N(C)[C@@H]2CC(C)(C)[C@H]2OCc2ccccc2)c1CBr 2377476687 GXOMDTLKMWIXQY-UXHICEINSA-N 432.406 4.863 50 10 IJGE COC(=O)/C(C#N)=C\c1ccc(OC(=O)c2ccccc2CCc2ccccc2)c(OC)c1 951061 NXSOEJNPMSWQKV-JWGURIENSA-N 441.483 4.780 50 10 IJGE CCOc1cc(/C=C(/C#N)S(=O)(=O)c2ccccc2)ccc1OC(=O)c1cccs1 33470871 RSACUUBZQOLZNC-AQTBWJFISA-N 439.514 4.704 50 10 IJGE Cc1cc(C)cc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)c1 38678194 KBIJARMXCDWBJD-RUZDIDTESA-N 444.462 4.645 50 10 IJGE Cc1c(C(=O)Nc2cccnc2)oc2c1/C(=N/NC(=O)c1cccc3ccccc13)CCC2 40813585 GAERPTDEDUSUJD-XHLNEMQHSA-N 438.487 4.859 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2ccc(OCc3ccccc3)cc2)cc1 58892681 PABYZRPXJGATLQ-MYSISXQJSA-N 432.520 4.628 50 10 IJGE O=S(=O)(c1c(Cl)cc(Br)cc1Cl)N1CCC[C@@H](CCCl)C1 109647673 GEUFNULLJFCHCF-VIFPVBQESA-N 435.598 4.786 50 10 IJGE C[C@H]1CCN(C(=O)c2cc(Br)c(Br)s2)C[C@H]1Br 230293427 DZNPMIPHIMYLQB-POYBYMJQSA-N 446.002 4.519 50 10 IJGE CC(C)OCCOc1c(Br)cc(Br)cc1CBr 310413463 XHQSVKIGGHTQJZ-UHFFFAOYSA-N 430.962 4.910 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@H](c2cc(Br)ccc2O)C1 382691391 ABKDIRUOSKOTAS-ZWNOBZJWSA-N 435.156 4.500 50 10 IJGE O=S(=O)(c1ccc(Cl)c(CCl)c1Cl)N1CC[C@@H](COCc2ccccc2)C1 383993795 JSHLIQRBVGWRRH-OAHLLOKOSA-N 448.799 4.960 50 10 IJGE O=C(CBr)c1cc(OC(F)(F)F)cc(Br)c1OC(F)F 575684836 IHOPRJWZEDVETQ-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE C[C@@H]1[C@H]2CC[C@@H](C[C@]13CC[C@](C)(CI)O3)N2C(=O)OC(C)(C)C 686235676 GEGHBTACZRFXIW-KGZKIYMESA-N 435.346 4.537 50 10 IJGE CCc1cc(Br)ccc1NNC(=O)c1ccc(F)cc1NC(=O)c1ccoc1 753171618 XJYMDORTRJOHKK-UHFFFAOYSA-N 446.276 4.753 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCc3cc(O)nc4ccccc34)c2C)c1 754313486 BUXRHFYAIOLXKG-FYJGNVAPSA-N 436.515 4.880 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)Nc2nc(C3CCC3)cs2)c(-c2ccccc2)n1 769186852 DQSWKKDTVRKFPL-LDADJPATSA-N 428.521 4.733 50 10 IJGE CCOc1ccc(NC(=S)NNC(=O)c2csc(-c3cccc4ccccc34)n2)cc1 777965551 CZMPHMOYRPNFAS-UHFFFAOYSA-N 448.573 4.993 50 10 IJGE COc1ccccc1-c1ncc(/C=C(\C#N)c2nc(O)c3c4c(sc3n2)CCCC4)cn1 792866364 LZTXIXIRKPCOCW-XNTDXEJSSA-N 441.516 4.805 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2-n2cccc2)ccc1OCc1ccccc1 1083962947 JXRABMJLUVPGGF-UHFFFAOYSA-N 425.488 4.829 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2-n2cccc2)ccc1OCc1ccccc1F 1084090516 CMBDWQXUSASLDN-UHFFFAOYSA-N 443.478 4.968 50 10 IJGE Cc1nn(-c2cccc([N+](=O)[O-])c2)c(C)c1C=NNC(=O)[C@H](C)c1ccc(CC(C)C)cc1 1084296173 RVWFHKYUUAWWBV-QGZVFWFLSA-N 447.539 4.850 50 10 IJGE C/C(=C/c1cccnc1)C(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 1523704711 XEPGEIHQDLIFQM-SSZFMOIBSA-N 437.952 4.892 50 10 IJGE C=CCc1cc(C(=O)NNc2cc(Cl)ccc2Br)cc(OC)c1OC 1651620586 WHOBJTLKKUNMIZ-UHFFFAOYSA-N 425.710 4.605 50 10 IJGE Cc1cccc(C)c1OCC(=O)Nc1cccc(C(=O)Nc2ccc(SC#N)cc2)n1 1860558053 KSUKSSGRSCAPBZ-UHFFFAOYSA-N 432.505 4.541 50 10 IJGE COc1ccc2ccccc2c1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccc(F)cc1 1865688603 WDBONCXKLTWORG-XMMPIXPASA-N 440.478 4.759 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)/C=C/c1ccc(F)cc1 1865759817 TXTMUJWEBUYUFG-NYYWCZLTSA-N 444.293 4.977 50 10 IJGE C[C@@H](C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)Nc1ccc(SC#N)cc1)C1CCCC1 1867009154 FAGCROFSSFYSTP-ZHRRBRCNSA-N 439.556 4.891 50 10 IJGE Cc1cc(Br)c([C@@H](Br)c2c(Br)ncn2C)s1 1900442246 ZYUFLWAVXRRPKP-ZETCQYMHSA-N 428.975 4.799 50 10 IJGE CN(Cc1ccc(Br)cc1Br)[C@@H]1CCC[C@@H]1Br 1943859021 LXCFZMXYPMBYLP-WCQYABFASA-N 425.990 4.959 50 10 IJGE C[C@@H]1CN(Cc2cc(Br)ccc2Br)CC[C@H]1Br 2006503417 NZONEXWRTVNIRS-BXKDBHETSA-N 425.990 4.817 50 10 IJGE C[C@@]1(NC(=O)c2csc(Br)c2Br)CCC[C@H]1Br 2011549667 UUAYGRIYEWXSLM-RDDDGLTNSA-N 446.002 4.709 50 10 IJGE ClC[C@H]1CCC[C@@H]1CNc1ncc(I)cc1Br 2015756445 FZGZDCFPRMNWBX-RKDXNWHRSA-N 429.527 4.516 50 10 IJGE Cc1cc([C@H](Br)c2cc(S(C)(=O)=O)cs2)sc1Br 2032179953 XPLXPDAFFOGILL-SNVBAGLBSA-N 430.208 4.768 50 10 IJGE CC[C@@H](C)N(CCBr)C(=O)c1c(Br)cccc1Br 2033095786 VHTAEUXJDTWMEA-SECBINFHSA-N 441.989 4.847 50 10 IJGE ClCCC[C@H]1CCCCN1c1ncc(I)cc1Br 2085683525 MHRDWYROLQPVII-LLVKDONJSA-N 443.554 4.827 50 10 IJGE C[C@@H]1CN(C[C@@H](CBr)c2ccccc2)C[C@@]1(C)CNC(=O)OC(C)(C)C 2106784573 JPPQCVCXPXQQND-HGHGUNKESA-N 425.411 4.648 50 10 IJGE O=C(NC[C@@H]1C[C@@H](Cl)C12CCC2)c1cc(Br)sc1Br 2115598891 IOBFLUPCPMTHIG-IONNQARKSA-N 427.589 4.801 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Br)c1c(Cl)cnn1C 2138248058 XPMGEQSDWKOANB-SNVBAGLBSA-N 428.939 4.982 50 10 IJGE Cc1nn(C)c(N2CCC[C@@]3(CCCN(Cc4ccccc4)C3)C2)c1CBr 2163308192 UXBHBCTXZQIWDE-JOCHJYFZSA-N 431.422 4.506 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)C[C@H]1CC1(Br)Br 2208937838 ZVFKUUWRYANRID-WCQYABFASA-N 440.017 4.778 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)[C@@]12COC[C@H]1C2 2213490826 XBJGIHHZZVJCDN-LNCSFIOASA-N 428.921 4.823 50 10 IJGE Cc1sc(C(=O)N2CC[C@H](C(F)(F)CBr)C2)c(C)c1Br 2234467919 AJMAYRATRQMNSQ-VIFPVBQESA-N 431.140 4.620 50 10 IJGE COc1ccc([C@@H](Cl)c2ccc(Br)o2)cc1I 2248888848 OWXXKOWJSMCGBM-GFCCVEGCSA-N 427.463 4.984 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@H](Br)CC2(CCC2)C1 2264509965 PDFGZMWBLMKRFE-MRVPVSSYSA-N 427.589 4.944 50 10 IJGE CC(C)N(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)CC1(CBr)CC(F)C1 2265639093 QAWGJCOTCGTGHK-ZRZPHAQCSA-N 435.422 4.857 50 10 IJGE O=S1(=O)CCC[C@H]([C@H](Br)c2cc3sc(Br)cc3s2)C1 2278111618 LKXPAKKZIMLABC-MADCSZMMSA-N 444.235 4.986 50 10 IJGE CC1(C)[C@@H](CBr)CCN1C(=O)c1cc(F)c(Br)cc1Cl 2282967436 OTRWBPRIERFPOI-MRVPVSSYSA-N 427.539 4.877 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@@H]1C[C@@H](Br)C2 2282978722 QKPUWMLXBDHCGR-PSVAKVPMSA-N 425.523 4.772 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@H](Br)[C@@H]1C1CC1 2285834941 GWMXMDQUNNGUKI-ZANVPECISA-N 425.523 4.630 50 10 IJGE O=C(Cc1cc(Br)cc(Br)c1)N[C@H](CCl)c1ccsc1 2295311813 PJTSDTHXLWGPAJ-CYBMUJFWSA-N 437.584 4.912 50 10 IJGE COc1ccc(NC(=O)C(C#N)=CN(Cc2ccccc2)Cc2ccccc2)cc1OC 2324066315 XVABGRAINXMAHC-UHFFFAOYSA-N 427.504 4.752 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@H](CN(CC3(CBr)CCCC3)C1)C2 2332630098 VRQRDZSDBGPBPU-LAUBAEHRSA-N 429.443 4.959 50 10 IJGE CC(C)[C@@H](Cl)C(C)(C)CNC(=O)c1ccc(Cl)cc1I 2366004591 FDFGLFNIYUQENZ-CYBMUJFWSA-N 428.141 4.964 50 10 IJGE CC(C)(C)OC(=O)N[C@@]1(c2ccccc2)CCN(C[C@]2(CBr)CC2(F)F)C1 2379986517 SKWJXICNFSQGBI-MOPGFXCFSA-N 445.348 4.533 50 10 IJGE ClCC(CCl)(Cc1ncc(I)cn1)c1cccc(Cl)c1 2381294299 WVPIACBCNBSZDG-UHFFFAOYSA-N 441.527 4.693 50 10 IJGE COc1cccc(/C=C(\C#N)c2ccc([N+](=O)[O-])cc2)c1OCc1cccc(C(=O)O)c1 2848337 QRCUKVSJXAVOSE-DEDYPNTBSA-N 430.416 4.945 50 10 IJGE CCOc1cccc(NC(=O)/C(C#N)=C/c2ccc(OCc3ccc(C(=O)O)cc3)cc2)c1 33409302 OPNKDCNNRMUUSA-KGENOOAVSA-N 442.471 4.908 50 10 IJGE CCCCCOc1ccc(CN2C(=O)C(=NNC(=O)c3ccccc3)c3ccccc32)cc1 252474581 HTNOYALWAIQHRI-UHFFFAOYSA-N 441.531 4.937 50 10 IJGE Cc1ccc(COc2cccc(C=NNC(=O)CSc3nc4ccccc4o3)c2)cc1 254607302 NOTPRMSBFGFYQF-UHFFFAOYSA-N 431.517 4.958 50 10 IJGE COc1ccc(Cl)cc1[C@@H]1CN(Cc2ccccc2)C[C@H]1CI 382685133 FAUYSQJURSLDAN-CRAIPNDOSA-N 441.740 4.999 50 10 IJGE ClCc1nc2cc(I)ccc2n1CCOCc1ccccc1 389972082 WONDOBLFUZYIHL-UHFFFAOYSA-N 426.685 4.597 50 10 IJGE BrCCCC1CCN(c2ncc(Br)cc2Br)CC1 400983399 UABTZCYNJJOBCJ-UHFFFAOYSA-N 441.005 4.998 50 10 IJGE Clc1cccc(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@H]32)c1CBr 404142228 GFTPJERPSINQBK-NHCUHLMSSA-N 435.793 4.715 50 10 IJGE C[C@H]1OCC[C@]1(CBr)Cc1cc(Cl)ccc1I 405500653 CDCXTNSBVZFQLL-NOZJJQNGSA-N 429.523 4.677 50 10 IJGE COc1ccc(CNC(=O)Nc2cccc(C(=O)Nc3ccc(SC#N)cc3)c2)cc1 586622482 AIDFEGZULVTHGF-UHFFFAOYSA-N 432.505 4.842 50 10 IJGE C[C@@H](CBr)[C@@H](C)Nc1ncc(C(F)(F)F)cc1I 686109202 PRBBXHWNSJIAPX-NKWVEPMBSA-N 437.041 4.536 50 10 IJGE Cc1ccccc1NNC(=O)C(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 783327668 VWAVCKDUSRPELQ-UHFFFAOYSA-N 431.279 4.571 50 10 IJGE COc1ccc(C=NNC(=O)COc2ccc(Cl)cc2Br)c2ccccc12 1084180161 NHWABSVZLBDSSP-UHFFFAOYSA-N 447.716 4.793 50 10 IJGE C=CCOc1ccc(Br)cc1C=NNC(=O)c1ccccc1Br 1084427140 JJAXHTDSMSZNPI-UHFFFAOYSA-N 438.119 4.540 50 10 IJGE COc1cccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4cccc(C)c4C)c(C)c32)c1 1772749619 NNWPNQNUKDJQSU-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE CCCc1nc(Nc2ccc(SC#N)cc2)cc(N2CCO[C@H](c3ccncc3)C2)n1 1868389232 TUPQRTSLHALUPB-FQEVSTJZSA-N 432.553 4.719 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CN(C(=O)OC(C)(C)C)[C@H]1C(C)(C)C 1881339347 KHJRFKRVDQLGRZ-MGPQQGTHSA-N 435.403 4.556 50 10 IJGE CC(C)[C@@H](CBr)CN(OCc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 1881878172 HCVWLUZOBWSJDS-SFHVURJKSA-N 441.410 4.707 50 10 IJGE CO[C@@H]1C[C@H]1COc1c(Br)cc(CBr)cc1Br 1908942544 HSHPSIFXDNPUJS-GZMMTYOYSA-N 428.946 4.520 50 10 IJGE Fc1cc(Br)c2nc(CCl)n(Cc3ncc(Br)s3)c2c1 1912655227 UDIKRRUSFZIIFZ-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE CC[C@H](Br)CN(C)C(=O)c1cc(Br)c(Br)s1 1977843175 OGVXCVIFAYFSJW-LURJTMIESA-N 433.991 4.519 50 10 IJGE CCN(C[C@](C)(CI)OC[C@@H]1C[C@@H]1C(C)C)C(=O)OC(C)(C)C 1993100340 GJOZYVZXWZYBPC-DAYGRLMNSA-N 439.378 4.746 50 10 IJGE Clc1ccc(I)c(C[C@H]2CCOCC[C@@H]2Br)c1 2001019244 YDWJYFLZEMWIRU-SKDRFNHKSA-N 429.523 4.677 50 10 IJGE CN(Cc1cc(Br)ccc1Br)C[C@@H](Br)C1CC1 2006499434 JIFGCAPTODRJQQ-CYBMUJFWSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1ccc(C#N)cc1Br 2010826666 FSJDAQWFIWEQFB-UHFFFAOYSA-N 432.409 4.639 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](OC2CC3(C2)CC2(CCC2)C3)[C@H](I)C1 2025070490 BFWJUXUDOZBRBR-CABCVRRESA-N 447.357 4.539 50 10 IJGE CC[C@@H](Br)c1cn(Cc2ccc(Br)cc2Br)nn1 2031403158 OFLMRGDLKCOJEN-SNVBAGLBSA-N 437.961 4.697 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1Br)c1cccc(Br)c1Br 2031486277 MGLKXGMFYIXLSH-GXSJLCMTSA-N 439.973 4.648 50 10 IJGE BrC[C@@]12CC[C@@H]1CN(Cc1cc(Br)ccc1Br)C2 2078148053 QYLSFTMWRGIKJP-BXUZGUMPSA-N 438.001 4.819 50 10 IJGE Cn1nc(COc2cc(Br)ccc2CCl)c(Br)c1Cl 2096683061 HQIXLUQGOIPKKJ-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2CCCN(C)Cc1ccccc1 2096784294 GABMOCFKTBSBPF-UHFFFAOYSA-N 435.797 4.806 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCN(C[C@@H](Br)C(F)(F)F)c2ccccc21 2106782858 USZCNWMVQDUCHK-SWLSCSKDSA-N 437.300 4.831 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)[C@@H](c2ccccc2)C1 2106784060 FQQSYFHSRMWOEQ-GUDVDZBRSA-N 425.411 4.646 50 10 IJGE CCCC(CBr)(CCC)CN(CCOC)C1CN(C(=O)OC(C)(C)C)C1 2106786547 VEJPGFZQRNYXGY-UHFFFAOYSA-N 435.447 4.536 50 10 IJGE C[C@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)cc(F)c1F 2123269830 KYPOYGRVLYQAIH-CYBMUJFWSA-N 444.341 4.849 50 10 IJGE Brc1cccc([C@@H](CI)OC[C@@H]2C3C[C@@H]4C2[C@@H]4C3)c1 2134516182 FKOJSISRKQDBLI-ZFCFLOGKSA-N 433.127 4.844 50 10 IJGE Brc1ccccc1[C@H](CI)OC[C@@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]32 2134544365 ZOZPKGYYFDPBLG-LPJUZPBUSA-N 433.127 4.844 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(CC3(CBr)CCCCC3)C[C@H]2C1 2141250580 UFRMZKVETFFMMD-KZNAEPCWSA-N 429.443 4.957 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](C[S@@](C)(=O)=NCCCCCCBr)C(C)(C)C 2223286922 BFMRQLDRRTZGFR-ODCWNRFASA-N 441.476 4.979 50 10 IJGE Cc1cc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)cc(CBr)n1 2288422655 NIFUGVQEKCGCEG-MSYGRNIXSA-N 426.402 4.632 50 10 IJGE C[C@@H](Br)COCc1cn(-c2cc(Cl)c(Br)cc2Cl)nn1 2295838362 XMYORCNMZYASHP-SSDOTTSWSA-N 443.954 4.637 50 10 IJGE C[C@@H](Br)CN(Cc1sccc1I)CC(C)(C)C 2301077139 UDEPCVZRBOSPFB-SNVBAGLBSA-N 430.193 4.984 50 10 IJGE CC(C)[C@H](Br)C(C)(C)CN(C)c1ccc(I)cn1 2318075167 FJSZNDQTPPOPRE-ZDUSSCGKSA-N 425.152 4.568 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)cc1OC 2321244504 FUTDYUFWVZEFRK-UHFFFAOYSA-N 425.435 4.506 50 10 IJGE CC(C)C[C@@H](CBr)CN1CC[C@@H](NC(=O)OC(C)(C)C)C(F)(F)CC1 2328520991 LMXIJDGQHMPAMW-LSDHHAIUSA-N 427.374 4.668 50 10 IJGE CC(C)(C)OC(=O)N1[C@@H](CNC(=O)[C@H](Br)C2CCCC2)C[C@H]2CCCC[C@H]21 2358977199 RHCOGNIATMOWMG-BRSBDYLESA-N 443.426 4.625 50 10 IJGE CCCn1c(-c2ccc(C(=O)NNC(=O)c3ccc(Cl)cc3)s2)nc2ccccc21 35554216 PLUGIXZNVVITNH-UHFFFAOYSA-N 438.940 4.903 50 10 IJGE CCOc1cc(/C=N/NC(=O)c2cc3ccccc3o2)cc(Br)c1OCC 59305205 OIYLALMLGDZWSB-WSDLNYQXSA-N 431.286 4.757 50 10 IJGE O=C(Cc1cccc2ccccc12)N/N=C/c1cc(Br)c2cccnc2c1O 59501293 BGBFMYAJIUMMNM-DHRITJCHSA-N 434.293 4.549 50 10 IJGE O=C(NNC(=S)NCc1ccccc1)c1cccc(Oc2cccc(C(F)(F)F)c2)c1 71811634 FWNCDRVRPMUTDW-UHFFFAOYSA-N 445.466 4.807 50 10 IJGE CCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)CCc2ccc(C(C)C)cc2)c(OC)c1 207164476 PNUMLJZPZBQGKS-JCMHNJIXSA-N 434.536 4.790 50 10 IJGE CC(=NNC(=O)c1ccc([C@@H]2SCC(=O)N2Cc2ccccc2)cc1)c1ccc(F)cc1 254386997 YVXRLYFPGFTXEX-VWLOTQADSA-N 447.535 4.754 50 10 IJGE N#Cc1ccccc1COc1ccc(C=NNC(=O)Cc2cccc(C(F)(F)F)c2)cc1 254699583 IADMESMXSYFXDF-UHFFFAOYSA-N 437.421 4.849 50 10 IJGE Cc1cccc(NC(=O)C(=O)NN=Cc2c(OCc3ccccc3)ccc3ccccc23)c1 254867104 OKSHEWWARWRXOZ-UHFFFAOYSA-N 437.499 4.816 50 10 IJGE CC(=O)[C@H](Br)[C@H](C)c1cc(Br)ccc1I 300899885 KHASSOBOJBMQOV-KSBSHMNSSA-N 445.920 4.510 50 10 IJGE CC[C@](C)(CO[C@@H](CI)c1ccccc1Br)OC 319061832 HPUWMUSDAXZJIJ-UONOGXRCSA-N 427.120 4.757 50 10 IJGE C[C@@H](Cl)c1nc2cccc(Br)c2n1C[C@@H]1CN(Cc2ccccc2)CCO1 697705907 BRULOGTVAUUVOC-WBVHZDCISA-N 448.792 5.000 50 10 IJGE Cc1cc(Br)c(S(=O)(=O)N(C[C@@H](C)Cl)C(C)C)cc1Br 709412168 ZKOVFCNCRLSNNW-SNVBAGLBSA-N 447.620 4.546 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)Nc3nc4c(s3)C(=O)CCC4)c2C)cc1 727714311 ZGBRMCQQVUQVCT-SFQUDFHCSA-N 446.532 4.624 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2cccc(-c3nc[nH]n3)c2)c(C)n1-c1ccc(F)cc1 733979741 DVQOOKQIYLJGGV-YBFXNURJSA-N 426.455 4.564 50 10 IJGE Cn1nccc1[C@H]1CCCCN1C(=O)C(=O)Nc1ccc(S(F)(F)(F)(F)F)cc1 799274334 PQVPTBNPCJGTAH-OAHLLOKOSA-N 438.422 4.770 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NCc2cccc3ccccc23)c(-c2ccccc2)n1 914478310 HJGLEHAHIBTOOV-KQWNVCNZSA-N 431.499 4.840 50 10 IJGE Cc1cc(C=NNC(=O)Cc2cccc3ccccc23)c(C)n1-c1cccc([N+](=O)[O-])c1 1084487995 KJQPJEUQPFJBPT-UHFFFAOYSA-N 426.476 4.848 50 10 IJGE Cc1cc(Nc2ccc3c(c2)CCCC3)c(C(=O)NNc2cccc([N+](=O)[O-])c2C)c(O)n1 1545923355 PNBAIOJGSHDWFB-UHFFFAOYSA-N 447.495 4.692 50 10 IJGE CC[C@H](Br)C(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3CC)c(C)s1 1859525300 LIIQIZLDRTYLQU-AWEZNQCLSA-N 436.375 4.530 50 10 IJGE CCc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699174 MYRRELHNDAFHME-JOCHJYFZSA-N 443.938 4.857 50 10 IJGE CCc1nn(CC)c2c1[C@H](c1ccc(OCc3ccccc3Cl)cc1)C(C#N)=C(N)O2 1865703575 BPGVQNLZFHONLS-OAQYLSRUSA-N 434.927 4.916 50 10 IJGE CCCc1ccc(OCC(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3)nc2C)cc1 1865755714 MVMIMQJZAMCFEK-UHFFFAOYSA-N 437.927 4.503 50 10 IJGE CCC[C@@]1(C(=O)N(C)C[C@H]2C[C@H](Br)C2)CCCCN1C(=O)OC(C)(C)C 1887832198 BAGDIHBZEJZRRJ-FTRWYGJKSA-N 431.415 4.578 50 10 IJGE Cl[C@@H](c1cc2c(cc1Br)OCCO2)c1csnc1Br 1925249887 FCRMLRIFNPNBHE-NSHDSACASA-N 425.529 4.768 50 10 IJGE C[C@@H]1C[C@H](Br)CN(Cc2cccc(Br)c2Br)C1 1943906358 PKYYXNGJVALJME-KOLCDFICSA-N 425.990 4.817 50 10 IJGE CC1(C)CN(Cc2cccc(Br)c2Br)[C@H]1CBr 1944095720 MLJYTRRONQKGQL-NSHDSACASA-N 425.990 4.817 50 10 IJGE CCOc1ccc([C@@H](Br)c2cc(I)sn2)s1 1995363697 DYVPANKDMTZUJT-JTQLQIEISA-N 430.130 4.692 50 10 IJGE C[C@H]1C[C@@H]1N(CCBr)Cc1cc(Br)ccc1Br 2006509098 YJFCYAMPMFPJRU-ZANVPECISA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1cccc(F)c1Br 2010827403 QHWHZSVYPHRVQR-UHFFFAOYSA-N 439.416 4.584 50 10 IJGE ClCc1c(Br)cccc1N1CCCN(Cc2ccccc2)CCOCC1 2088628557 PFCPEEJCTSUFRS-UHFFFAOYSA-N 437.809 4.917 50 10 IJGE CCN(CC)[C@H](C)CO[C@@H](CI)c1ccc(Br)cc1 2119219562 ROAANOMPGYBNES-DOMZBBRYSA-N 440.163 4.672 50 10 IJGE C[C@H]1[C@H](C)CC[C@@H](CNC(=O)OC(C)(C)C)N1C(=O)c1ccc(CBr)cc1 2163056328 QEFZZDPFJOKLHQ-VKJFTORMSA-N 439.394 4.735 50 10 IJGE COc1cc(CNC(=O)OC(C)(C)C)ccc1NC(=O)[C@H](Br)C1CCCC1 2167031792 JZLCHPYNTQDYQP-QGZVFWFLSA-N 441.366 4.612 50 10 IJGE Cc1csc(C(=O)N2CC[C@](CBr)(C(F)(F)F)C2)c1Br 2167676485 PJQJZXGRIBZZON-LLVKDONJSA-N 435.103 4.609 50 10 IJGE C[C@@H]1C[C@@]1(F)CO[C@@](C)(CI)c1ccccc1Br 2219942498 LSWQOWYQPZUWKJ-DDTOSNHZSA-N 427.095 4.864 50 10 IJGE CC(C=NNC(=O)c1ccc(C(=O)NN=CC(C)=Cc2ccccc2)o1)=Cc1ccccc1 2295253203 DIJFCQHYJVBWTA-UHFFFAOYSA-N 440.503 4.918 50 10 IJGE Cc1cccc(Oc2nc3ccccn3c(=O)c2C=C(C#N)C(=O)Nc2ccccc2C)c1 2314533948 VMPFZIWYXGPILN-UHFFFAOYSA-N 436.471 4.649 50 10 IJGE Cc1cccc(C[C@@H](Br)c2c(Br)c(Br)nn2C)c1 2316833779 GNZKMALLVXOJAP-SNVBAGLBSA-N 436.973 4.932 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C)CN(C[C@@H](CBr)C(C)(C)C)CC1(F)F 2326651349 ODDCBWPZALQDEK-DYVFJYSZSA-N 427.374 4.526 50 10 IJGE Cc1cc(-c2csc(C(C#N)=C(O)[C@H](C)N3C(=O)c4ccccc4C3=O)n2)ccc1F 2331320404 JVRPJGSHAQQCRM-ZDUSSCGKSA-N 433.464 4.735 50 10 IJGE COc1ccc(C=C(C#N)c2nc(-c3ccc(OC)c(OC)c3OC)cs2)c(OC)c1 2331492767 NXTWKNDVDKEHOC-UHFFFAOYSA-N 438.505 4.917 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@@]1(CBr)CC1(F)F 2379981022 CAFPGLZQQRGHTN-IBGZPJMESA-N 445.348 4.884 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCc2ccccc2N(C[C@@]2(CBr)CC2(F)F)C1 2379985838 LMFGJUBIVXKWKE-KXBFYZLASA-N 445.348 4.753 50 10 IJGE CCOc1ccc(NC(=O)[C@H](c2ccccn2)N(C(=O)CCl)c2ccc(F)cc2)cc1 4789176 BPYQLEMEXSARLO-QFIPXVFZSA-N 441.890 4.571 50 10 IJGE CCN(CC)c1ccc(/C=N/NC(=O)CCSc2ccc(Cl)cc2)cc1[N+](=O)[O-] 20072604 HVMITSMUAACVFS-HYARGMPZSA-N 434.949 4.727 50 10 IJGE COc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3cc(C)ccc3C)c(C)c21 40813160 OLAKZPTYLDVHPR-TURZUDJPSA-N 445.519 4.936 50 10 IJGE CCOc1ccc(OCC(=O)N/N=C/c2cn(Cc3ccccc3)c3ccccc23)cc1 40912301 KCDDKJMEQDNJMM-JVWAILMASA-N 427.504 4.617 50 10 IJGE O=C(N/N=C/c1cn(Cc2ccc(Br)cc2)c2ccccc12)c1cccnc1 96563670 GGFSAHATZRDJSJ-DHRITJCHSA-N 433.309 4.611 50 10 IJGE O=[N+]([O-])c1ccccc1C[C@H](Br)c1ccccc1I 110296355 AOLYQSIFZATMPZ-LBPRGKRZSA-N 432.055 4.878 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N[C@@H](C)c2cc3cccc(OC)c3o2)c1C 206424190 KCRGSGDSZGOKBC-LXGRAFHKSA-N 435.524 4.852 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)/C(C#N)=C\NCc1ccc(Br)cc1 217187580 SPKJIXUDWQJOKM-IYWFSZBXSA-N 442.357 4.531 50 10 IJGE C[C@@H]1CCc2sc(C(=O)NN=Cc3ccc(OC(F)F)cc3OC(F)F)cc2C1 254402537 AZSLCDTZYPOTBL-SNVBAGLBSA-N 430.423 4.840 50 10 IJGE COc1ccc(Cl)cc1[C@H]1CN(Cc2ccccc2)C[C@@H]1CI 382685136 FAUYSQJURSLDAN-YJBOKZPZSA-N 441.740 4.999 50 10 IJGE COC[C@@H](O[C@@H](CI)c1ccc(Br)cc1)C(C)C 404107528 HOYIRFMCIZGVOU-UONOGXRCSA-N 427.120 4.613 50 10 IJGE CN(C(=O)c1cc(Br)sc1Br)C(C)(C)CCBr 688344632 CKCQOYLCPHUJJU-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE ClCc1nc2cccnc2n1CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 705859658 BVSOIYJZQTZROZ-UHFFFAOYSA-N 432.955 4.642 50 10 IJGE COc1ccc(C[C@H](NC(=O)NNc2cccc(F)c2F)c2ccc(OC)cc2)cc1 745315402 VIMDZDGVPUKMDG-NRFANRHFSA-N 427.451 4.592 50 10 IJGE N#Cc1ccccc1Oc1ccc(NC(=O)NNC(=O)c2cccc3cccnc23)cc1F 756813199 LKRPNIRPHGCALT-UHFFFAOYSA-N 441.422 4.504 50 10 IJGE CCCCSc1ccc(C(=O)NNC(=S)Nc2ccccn2)cc1C(F)(F)F 760825017 PZRGCXHTUWDLEL-UHFFFAOYSA-N 428.505 4.624 50 10 IJGE Cc1ccc2nc(CNC(=O)C(=O)Nc3cccc(S(F)(F)(F)(F)F)c3)[nH]c2c1 762664458 IVWCSMYWVRRDQG-UHFFFAOYSA-N 434.390 4.784 50 10 IJGE COc1cc(C(=O)NN=C2CCC(O)(c3cccc(F)c3)CC2)ccc1OCCC(C)C 783809209 AMDVYFZQDIUWHE-UHFFFAOYSA-N 442.531 4.807 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)c1ccc(Cl)cc1 794049732 DBNWIYCUWJMNOZ-FIWMFUAISA-N 439.906 4.515 50 10 IJGE Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)NNc1ccc(C#N)cc1C(F)(F)F 799394422 SVAIAIRSGIXIPS-UHFFFAOYSA-N 445.445 4.707 50 10 IJGE COc1cc(Cl)c(C=NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1OC 1084233406 HOBWPEHVCYMUED-SNVBAGLBSA-N 431.703 4.582 50 10 IJGE C=CCOc1ccccc1CNC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2 1227881208 VSAVPYZSVJOBNO-GOSISDBHSA-N 441.597 4.608 50 10 IJGE CN(CC(Cl)Cl)C(=O)CSCc1nc(O)c2c(-c3ccccc3)csc2n1 1641935275 NJGGGSOGFZWDHS-UHFFFAOYSA-N 442.393 4.559 50 10 IJGE COc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)Oc3ccc(C)cc3)c(C)c21 1772746003 NQCMXNJFVASACX-UHFFFAOYSA-N 432.476 4.595 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccc(C)cc2)c1 1865690070 ICJNFBXQGCYDGK-GOSISDBHSA-N 440.425 4.816 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)NNC(=O)c1cc(Cl)cc(Cl)c1 1865759933 ZDIPMGGGWSIXMW-UHFFFAOYSA-N 436.245 4.717 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)[C@H]3CC(=O)N(Cc4ccccc4)C3)n2)cc1C 1872746442 IKPZUTDCSJIBND-HDNKBODISA-N 445.544 4.969 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(Cl)c(Cl)c1 1873795168 UXBDVLGAAAXRLT-VQXFCIMOSA-N 436.339 4.580 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1cc(Cl)cc(Br)c1 1882087498 JZCXRQVDNVBDBS-LBPRGKRZSA-N 427.564 4.933 50 10 IJGE C[C@@H](CC(=O)NC[C@H]1C[C@@H](Br)C1)c1ccc(NC(=O)OC(C)(C)C)cc1 1887793007 GFWSISWEUYWEGR-OFQRWUPVSA-N 425.367 4.817 50 10 IJGE Brc1ccc(I)cc1SC[C@@H]1C[C@H]1Br 1887827952 NKNNJJRXDPQJNP-IMTBSYHQSA-N 447.961 4.929 50 10 IJGE CC1(C)[C@@H](CBr)CCN1c1ncc(Br)cc1Br 1946257389 PYPPYFOVBISPPT-MRVPVSSYSA-N 426.978 4.606 50 10 IJGE C[C@@H](Cl)CC(=O)Nc1cc(Br)c(Br)c(Br)c1 1982340653 ONLSBYGIQXFUTA-RXMQYKEDSA-N 434.353 4.930 50 10 IJGE CCN(C[C@](C)(CI)O[C@H]1CCCC[C@@H]1F)C(=O)OC(C)(C)C 1991632822 DCUGRMFOFCSVKP-ZQIUZPCESA-N 443.341 4.734 50 10 IJGE COc1cc(Br)c([C@@H](Br)C2(Br)CC2)cc1OC 2002806569 MULJWTRMFVRDLL-LLVKDONJSA-N 428.946 4.830 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc([C@@]2(C)CCC[C@@H](CI)O2)cc1 2014210801 PGRZBGWDNSVOGY-QFBILLFUSA-N 445.341 4.931 50 10 IJGE C[C@H](CCBr)CCN1CC[C@@H](C(F)(F)F)[C@@H](NC(=O)OC(C)(C)C)C1 2044695751 GNTDZIBCFACSTL-MCIONIFRSA-N 431.337 4.575 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1cc(Br)ccc1Br 2081243011 SUFHBTFZCIJLGP-PRHODGIISA-N 441.989 4.751 50 10 IJGE COCC1(COC2(CBr)CCN(C(=O)OC(C)(C)C)CC2)CCCCC1 2094487523 SPSFQFOUHVAIKO-UHFFFAOYSA-N 434.415 4.765 50 10 IJGE C[C@]1(C(F)F)C[C@@H]1[C@H](Br)c1cc(I)cc2c1OCC2 2120824404 KBRQBUPPZFBHAA-GYSYKLTISA-N 443.069 4.953 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Br)c1nn(C)cc1Cl 2138256707 YBPYNIWYGUVKFG-SNVBAGLBSA-N 428.939 4.982 50 10 IJGE CCC(CC)N(CC)S(=O)(=O)c1ccc(Br)c(CBr)c1 2179956052 JXBWVKITPJSSGI-UHFFFAOYSA-N 427.202 4.543 50 10 IJGE BrC[C@@]12CCCC[C@H]1CN(Cc1ccc(I)cc1)C2 2230624056 QQEAUMLPPLYMGF-GOEBONIOSA-N 434.159 4.678 50 10 IJGE CCCN[C@H](Cc1cc(Br)cc(Br)c1)[C@H]1C[C@H]1Br 2263513541 OYVMJDPUYKAONC-BFHYXJOUSA-N 440.017 4.906 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2OC[C@@H]3CCC[C@H]32)cc1I 2269552874 VLTZEJVSLMFACV-IDTSFGKNSA-N 437.115 4.551 50 10 IJGE Cc1cc(C(=O)O)ccc1-c1ccc(C=C(C#N)C(=O)NCCc2c[nH]c3ccccc23)o1 2293185171 XUQWUHLGJJWPGM-UHFFFAOYSA-N 439.471 4.700 50 10 IJGE CC1(C)C[C@@H](Cl)CN1Cc1ccc(I)c(Br)c1 2306225166 CEQCMIPMAFKKGW-SNVBAGLBSA-N 428.539 4.645 50 10 IJGE Clc1ccc(I)cc1C[C@H]1CCOCC[C@@H]1Br 2307338572 SMKNBKUHSWFLLC-SKDRFNHKSA-N 429.523 4.677 50 10 IJGE COc1c(Br)cc(C)c([C@@H](N)[C@H]2C[C@@H](Br)C2)c1Br 2317411451 VGXSATWAFHCOBJ-SXMVTHIZSA-N 441.989 4.702 50 10 IJGE CCN(C=C(C#N)C(=O)Nc1ccc(I)cc1C)c1cccc(C)c1 2318463265 ZVFIIQVKJMLMNM-UHFFFAOYSA-N 445.304 4.781 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)NN=Cc1c(Cl)nc2scc(C)n12 2321215886 NUDBFMHHIZSGDC-UHFFFAOYSA-N 445.882 4.770 50 10 IJGE CCn1nc(Br)nc1C[C@@H](Br)c1cccc(Br)c1 2328475160 TVATVOXNOXLVOT-SNVBAGLBSA-N 437.961 4.502 50 10 IJGE CCCCN(C(=O)CCl)[C@H](C(=O)NC1CCCCC1)c1cccc(Br)c1 3040243 UIFIHPAYUQLFLD-IBGZPJMESA-N 443.813 4.807 50 10 IJGE COc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3cccc(Cl)c3)ccc21 38650071 HFOKUNBRNCAJDJ-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE CCCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccs2)c1 38656552 HRJIXAWTFPGMIL-QFIPXVFZSA-N 432.501 4.974 50 10 IJGE COc1cc(Br)cc(/C=C(\C#N)C(=O)Nc2ccc(C)c(Cl)c2)c1OC 58837670 AKAATFKNFQOOQI-AWNIVKPZSA-N 435.705 4.974 50 10 IJGE C[C@H](Br)C[C@H](C)NC(=O)c1cc(Br)c(Br)s1 165526992 CDUMVHADGWRLIT-WDSKDSINSA-N 433.991 4.565 50 10 IJGE CCOC(=O)/C(C#N)=C/c1cccc(OC(=O)/C=C\c2ccc(OCC)c(OCC)c2)c1 206692742 ANRYBALTKYHNEK-HAGWQPGGSA-N 435.476 4.573 50 10 IJGE C/C(C=NNC(=O)CSc1nnc(SCc2ccccc2)s1)=C\c1ccco1 254353387 XYMITIKKJQDUCP-NLRSGHBVSA-N 430.580 4.721 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1C(=O)c1cc(Br)ccc1Br 705613036 SQWQMVJELUZQJN-PSASIEDQSA-N 439.973 4.600 50 10 IJGE O=C(N[C@@H](CBr)C1CCC1)c1cc(Br)cc(Br)c1 717613529 PEGMJBLOCZTQKW-LBPRGKRZSA-N 439.973 4.505 50 10 IJGE CC[C@H](NC(=O)c1ccc(I)c(Br)c1)[C@H](Cl)CC 721601175 FIVGPDPOXKIYHJ-PWSUYJOCSA-N 444.538 4.580 50 10 IJGE COc1ccc(C(C)=NNC(=O)CSc2ccc(Cl)cc2)cc1Br 725439829 VFPHQHNZQGBLST-UHFFFAOYSA-N 427.751 4.744 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2nc3c(s2)C(=O)CCC3)c(C)n1-c1ccc(F)cc1 727713887 LSJVKCFKFZZNAF-LFIBNONCSA-N 434.496 4.754 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N[C@@H](c2cnn(C)c2)C(F)(F)F)c(C)n1C1CCCCC1 775145908 GMBNXBXDDDJDRC-PSXSOWLISA-N 433.478 4.670 50 10 IJGE O=C(NNc1ccc([N+](=O)[O-])cc1)Nc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1 775613018 JUCZYWWFSYGQEP-JOCHJYFZSA-N 445.479 4.721 50 10 IJGE N#C/C(=C\c1ccc(C(=O)O)cc1Cl)c1nc(O)c2cc(Br)ccc2n1 783688715 OBNDBRJLOJDCOL-VZUCSPMQSA-N 430.645 4.514 50 10 IJGE CCN(Cc1c[nH]c2ccccc12)C(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C 785803671 YJHNLSNLYHAMSC-RQLGBQGVSA-N 430.552 4.721 50 10 IJGE Cc1nc2ccccc2n1CC(=O)NN=Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 918709379 HCHQDCKKXWJYGZ-UHFFFAOYSA-N 443.454 4.637 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCc2cnc(-c3ccccc3)s2)c1C 1339805110 VEIKORYMZHDIJV-BYINCCNUSA-N 434.565 4.659 50 10 IJGE C=CCCN(OCc1ccccc1)C(=O)/C(C#N)=C\c1cc(C)n(C[C@H]2CCCO2)c1C 1634163763 ODIYBJGEUOSNSB-HZRUTDPJSA-N 433.552 4.727 50 10 IJGE CCOc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc(F)cc1)CCC2 1772744763 JFEOVDFQZIVORJ-UHFFFAOYSA-N 449.482 4.849 50 10 IJGE CC(=O)C(=O)CCC[C@@H]1C[C@]2(C)C(=CC1=O)[C@@H](Cl)C[C@H]1[C@H]2CC[C@@]2(C)[C@H](O)CC[C@H]12 1857787857 WFQUYBYCFZVLQH-RHMLRVFRSA-N 435.004 4.651 50 10 IJGE C[C@@H](NC(=O)c1cccc(OCc2ccccc2)c1)c1nnc(CBr)s1 1877569961 FSKSCCGETGKROI-CYBMUJFWSA-N 432.343 4.503 50 10 IJGE BrC[C@H]1CC2(CCCC2)CN1Cc1ccc(I)cc1 1912772784 XQFIYXVFHZMVMJ-OAHLLOKOSA-N 434.159 4.821 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] 1915095981 DFYCWWBFZPZHNG-ZDUSSCGKSA-N 427.245 4.689 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1ncccc1Br 1915288355 IYDHQGDLOIDSOX-INIZCTEOSA-N 440.179 4.906 50 10 IJGE O=C(N[C@@H](CCCl)C(F)(F)F)c1scc(Br)c1Br 1918524850 ICXOHIUAOGVGQC-YFKPBYRVSA-N 429.483 4.563 50 10 IJGE CC1([C@H](CBr)NCc2cc(Br)ccc2Br)CC1 2006499455 JSAHTMBIJJMAKH-LBPRGKRZSA-N 425.990 4.865 50 10 IJGE CC[C@@H](CCCBr)NC(=O)c1cc(Br)cc(Br)c1 2036512973 DTAGBUODQRXRQN-LBPRGKRZSA-N 441.989 4.895 50 10 IJGE CC(C)N(C[C@@H]1CCCN(C[C@H](Br)C(F)(F)F)C1)C(=O)OC(C)(C)C 2044698086 ZGHZXFPCYIWBGT-KGLIPLIRSA-N 431.337 4.670 50 10 IJGE C[C@H](CCCCCI)NCc1ncc(Br)cc1Cl 2063685631 YTRYHEHSGSVMKZ-SNVBAGLBSA-N 445.570 4.971 50 10 IJGE CCCc1ccnc(-n2nc(CCl)c(I)c2C(F)(F)F)c1 2078881449 CBADPCGYHLCCFM-UHFFFAOYSA-N 429.611 4.582 50 10 IJGE C[C@@H]1CCc2c1c(CBr)nn2-c1cc(Br)cc(C(F)(F)F)n1 2080669081 YUNIPDMPXRRNDS-SSDOTTSWSA-N 439.073 4.993 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 2106784109 GDNQZRZEIAZLPC-MOPGFXCFSA-N 425.411 4.887 50 10 IJGE COc1cc(Cl)c([C@H](Cl)c2cnn(C)c2Br)cc1Br 2137637801 QWOBLIYCEJKHRH-NSHDSACASA-N 428.939 4.935 50 10 IJGE Cc1sc(C)c(S(=O)(=O)NC[C@H](Br)CC(C)(C)C)c1Br 2143914183 NQYVUHSFNWLYOA-SNVBAGLBSA-N 447.258 4.605 50 10 IJGE C[C@@H]1C[C@H](CCNC(=O)OC(C)(C)C)CCN1C(=O)c1ccc(CBr)cc1 2162879269 ONDUHIBYAHJOLX-HZPDHXFCSA-N 439.394 4.737 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H](Br)C2CCCC2)C2(CCCCC2)C1 2167031530 ISAZWNDGSWLFGD-KRWDZBQOSA-N 443.426 4.722 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@@]12C[C@@H]1CN(Cc1ccccc1)C2 2184922620 NLVMHJQDERQYNJ-IIBYNOLFSA-N 445.792 4.515 50 10 IJGE O=C(c1ccc(Br)c(Cl)c1)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Br)C2 2190677968 JRAVLIIZDFPSHO-SKZLGDCLSA-N 425.523 4.581 50 10 IJGE CC(C)(C)OC(=O)N1CC2(CCCC[C@@]23CCC[C@H](CI)O3)C1 2211826890 YFEPRTXENRVHPL-RDTXWAMCSA-N 435.346 4.540 50 10 IJGE O=C(Cc1ccc(Br)cc1Cl)N[C@H](CBr)c1cccs1 2237442466 YRFJZCNSIQVQHG-GFCCVEGCSA-N 437.584 4.959 50 10 IJGE CC[C@H]1[C@H](Br)CCN1Cc1cc(Br)ccc1Br 2251042876 VGDHPHOUPFCVSI-OLZOCXBDSA-N 425.990 4.959 50 10 IJGE N#CC(=Cc1c(N2CCCCCC2)nc2ccccn2c1=O)c1nc2ccccc2s1 2296848568 FZSWAOBSLFBBMX-UHFFFAOYSA-N 427.533 4.749 50 10 IJGE Cc1onc(Oc2cc(Br)cc(I)c2)c1CCl 2301130256 UZDOYSGAEYMQLI-UHFFFAOYSA-N 428.451 4.881 50 10 IJGE ClCC1(CCNCc2ccc(I)c(Br)c2)CC1 2306219515 NCGSNOWHLWAWNA-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE CCCCCCOc1ccc(C=C(C#N)C(=O)Nc2ccc(C(=O)OC)cc2)cc1OC 2314729046 SIPNQUFXMGGFKC-UHFFFAOYSA-N 436.508 4.987 50 10 IJGE CCOc1cc(C=NNC(=O)CSc2nc3ccccc3s2)cc(Cl)c1OCC 2323195575 VRHVDKPCUNHPTE-UHFFFAOYSA-N 449.985 4.990 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@H]2CC[C@H](Cl)[C@@H]1C2 2330964370 RDZFBNGIKDXERR-JEZHCXPESA-N 427.589 4.895 50 10 IJGE CC(C)[C@@H](Cl)C(C)(C)CNC(=O)c1ccc(I)c(Cl)c1 2365855416 LGBVQJVTMSNXOK-CYBMUJFWSA-N 428.141 4.964 50 10 IJGE ClCCCN(Cc1cc(Br)ccc1Br)C1CCOCC1 2381143954 OGQNVIXPPZIZPR-UHFFFAOYSA-N 425.592 4.822 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)c3cccc(Cl)c3)cc2)cc1 14004961 XSRIZBINHAWRCL-UHFFFAOYSA-N 449.938 4.965 50 10 IJGE Cc1ccc(OCC(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2C(C)(C)C)c(C)c1 14661615 FDJAPBOVLODDTO-UHFFFAOYSA-N 440.584 4.504 50 10 IJGE N#CC1=C(N)N2C(=C(C#N)[C@@H]1c1ccc(-c3ccc([N+](=O)[O-])cc3)o1)Sc1ccccc12 39794222 OTYLLCZGIRMPOL-OAQYLSRUSA-N 439.456 4.993 50 10 IJGE COc1cc(/C=N/NC(=O)c2ccc(-n3c(C)ccc3-c3ccccc3)cc2)ccc1O 59304025 HVBSESGQPNAGOY-WPWMEQJKSA-N 425.488 4.931 50 10 IJGE CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(CC)cc2Br)cc1OC 65000452 RBBLEVKZCNBBHF-MHWRWJLKSA-N 429.314 4.964 50 10 IJGE Cc1ccccc1C(=O)Oc1ccc(N(CCBr)CCBr)cc1 95719663 YYLJRENQBJIZGV-UHFFFAOYSA-N 441.163 4.810 50 10 IJGE Cc1nn(C)c(Cl)c1CC(CBr)(CBr)Cc1ccccc1 167847777 JJMJCGBDOKHGFQ-UHFFFAOYSA-N 434.603 4.943 50 10 IJGE COc1cc(/C=N/NC(=O)Nc2ccccc2)cc([N+](=O)[O-])c1OCc1cccc(C)c1 169885145 XTLGFEZXPDXYLY-ZVHZXABRSA-N 434.452 4.646 50 10 IJGE CCOC(=O)c1cnn(-c2cc(C)c3cc(C)cc(C)c3n2)c1NC(=O)C(C)(C)CCl 170536575 FGNAAWNFYAGOJC-UHFFFAOYSA-N 442.947 4.726 50 10 IJGE Oc1cc([C@H]2CN(Cc3ccccc3)C[C@H]2CBr)ccc1Br 382676587 TZYRQJAGRHEFIY-HZPDHXFCSA-N 425.164 4.765 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CCl)c1Cl)N1CC[C@@H](COCc2ccccc2)C1 383955047 BAMZNNGVFYWRQE-OAHLLOKOSA-N 448.799 4.960 50 10 IJGE CC(C)(C)[C@H](CBr)NC(=O)c1cc(Br)ccc1Br 393962190 TWGAVJUZVSSAMY-NSHDSACASA-N 441.989 4.751 50 10 IJGE CN(Cc1ccccc1)CC1CCN(c2ccc([N+](=O)[O-])cc2CBr)CC1 717578884 IHKDFPOVNUQRGU-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE O=C(NNc1ccnc(Br)c1)Nc1cc(Cl)ccc1OCC(F)(F)F 771105752 XIAROYWVLRPLTJ-UHFFFAOYSA-N 439.619 4.587 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)c(C(F)(F)F)c1 799382873 CDXGOMZIQGVZJZ-UHFFFAOYSA-N 437.809 4.506 50 10 IJGE CCOc1ccccc1NC(=O)NN=Cc1cccn1-c1ccc(Br)cc1 1084522501 GDUDCXFOAYUBNY-UHFFFAOYSA-N 427.302 4.794 50 10 IJGE C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccc(Cl)c(C(F)(F)F)c1 1165462749 LBTJHDWFBOXHRX-ZDUSSCGKSA-N 442.265 4.838 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2Cl)[C@@H]1c1ccc[nH]1 1865709978 LPWHEXDMGSTYBW-FQEVSTJZSA-N 427.895 4.798 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C1C[C@@H]2C[C@H](C1)CN(C(=O)OC(C)(C)C)C2 1887719653 QHLCSGVESYLMNN-VFSICIBPSA-N 447.414 4.558 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)C[C@@H](C)Br)cc1Br 1914609205 FFRLISSVWLSVHG-CYBMUJFWSA-N 441.163 4.884 50 10 IJGE C[C@H]1C[C@@H]1N(CCBr)C(=O)c1cc(Br)c(Br)s1 2002024079 OMVMCIMOBKVPQU-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)CCc1nc(-c2ccccc2)cs1 2025439304 BHADPKOYKADUGQ-OAHLLOKOSA-N 441.350 4.802 50 10 IJGE FC1CC(C[C@@H](Br)c2cc(I)cc3c2OCC3)C1 2033346750 QIISBMOFAMIVJG-QDPIBXHXSA-N 425.079 4.800 50 10 IJGE O=S(=O)(c1ccc(CBr)cc1)N(CCC(F)(F)F)Cc1ccccc1 2034733954 HNXFKHYEXVZTFH-UHFFFAOYSA-N 436.293 4.725 50 10 IJGE CC1CC(CBr)(NC(=O)c2cc(Br)ccc2Br)C1 2045118411 RJUADDFZQDZXRX-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE FC(F)(F)c1c(CBr)ccc(I)c1Br 2054870668 KEJYBYOKFPLFHF-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE Cc1cc(S(=O)(=O)N(Cc2ccccc2)CC2CC2)cc(CBr)c1F 2059313357 XOYNQDBBGCFVNQ-UHFFFAOYSA-N 426.351 4.630 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@@H]2C[C@@H](Cl)CC[C@H]21 2087666437 CBMSRTQSYNZESJ-KHQFGBGNSA-N 427.589 4.895 50 10 IJGE C[C@@]1(Cn2c(CCl)nc3cncc(Br)c32)CCN(Cc2ccccc2)C1 2095445210 DQEDYYJIJCIICS-HXUWFJFHSA-N 433.781 4.845 50 10 IJGE CC(F)(F)[C@@H]1C[C@@H]1[C@H](Br)c1cc(I)cc2c1OCC2 2108180926 FRKVWIIOCBGLKO-WCQGTBRESA-N 443.069 4.953 50 10 IJGE COCCN(C)C[C@H](Br)CCc1ccc(Cl)c(Br)c1F 2166834552 ZZPCHLUOHNPWPE-LLVKDONJSA-N 431.571 4.516 50 10 IJGE O=C(c1cc(Br)ccc1Cl)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Br)C2 2190678786 NNYURTWKDWDNHZ-SKZLGDCLSA-N 425.523 4.581 50 10 IJGE O=C(c1ccc(Br)cc1Cl)N1CC[C@@H](C(F)(F)CBr)C1 2197762756 JXSRDZZNDODKGQ-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE COC(=O)[C@H](Br)C1(Oc2ccc(Cl)c(Cl)c2Br)CCC1 2206359418 MTIQXLFJVOYAMM-NSHDSACASA-N 446.950 4.994 50 10 IJGE C[C@H](Br)C[C@@H]1CCCCCN1C[C@@H]1CC1(Br)Br 2213095567 PHEWJIFAOJFHRH-SRVKXCTJSA-N 432.038 4.911 50 10 IJGE O=S(=O)(Cc1ccc(Br)cc1)N(Cc1ccccc1)[C@@H](CCl)C1CC1 2218987602 NNTBGIDHLQPFAC-IBGZPJMESA-N 442.806 4.799 50 10 IJGE Cc1cc(Br)c([C@H](Br)c2cc(S(C)(=O)=O)cs2)s1 2221842872 DFRRUBVDFSDOQX-SNVBAGLBSA-N 430.208 4.768 50 10 IJGE Cc1cc(Cl)cc(C(=O)NCC2CC(Br)C2)c1NC(=O)OC(C)(C)C 2223986253 ZEEIREPLHDHGFV-UHFFFAOYSA-N 431.758 4.899 50 10 IJGE C[C@H]1CCCN(CCCCI)[C@H]1CCCNC(=O)OC(C)(C)C 2243585948 IZBURZGFRDVWPO-HOTGVXAUSA-N 438.394 4.607 50 10 IJGE FC1CC(CBr)(CN2CCCCN(Cc3ccccc3)CC(F)(F)C2)C1 2265633567 WZZNHYWLGKPSNR-UHFFFAOYSA-N 433.356 4.733 50 10 IJGE COc1ccc(-c2csc(C(C#N)=Cc3cc(OC)c(O)c([N+](=O)[O-])c3)n2)cc1OC 2296789922 BOVIZPBOZWYLIO-UHFFFAOYSA-N 439.449 4.514 50 10 IJGE C[C@H]1C[C@@H](CBr)CN1Cc1ccc(Cl)cc1I 2302306592 FVMVFUODBUZFLF-UWVGGRQHSA-N 428.539 4.550 50 10 IJGE Brc1cccc(CN2C[C@H]3CC[C@@H](Br)[C@H]3C2)c1Br 2308237452 MTBGMJXFWZPEPC-ADEWGFFLSA-N 438.001 4.817 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCCc2ccccc2)ccc1OCc1ccc(C)cc1 2314737025 HTVWZGCUGXAMQT-UHFFFAOYSA-N 426.516 4.849 50 10 IJGE CC(C)Oc1c(Br)cc(C=NNC(=O)c2ccccc2)cc1Br 2322999119 MPXWNNAIWQEWQR-UHFFFAOYSA-N 440.135 4.763 50 10 IJGE C[C@H](NC(=O)C(C#N)=CNCc1ccc(Br)cc1)C12CC3CC(CC(C3)C1)C2 2324904594 CAXDGWFZAZIKJR-KZZKVKKMSA-N 442.401 4.667 50 10 IJGE ClC[C@@]12CC[C@H]1CN(Cc1ccc(I)c(Br)c1)C2 2325211605 KFJFRLKHIZIYFO-SMDDNHRTSA-N 440.550 4.505 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@H](Br)[C@H]2CC[C@@H]21 2327406902 NCSLFPMEUMHIPP-DYEKYZERSA-N 440.550 4.692 50 10 IJGE Clc1ccc(I)cc1CN1[C@H]2CC[C@@H](Br)[C@H]1CC2 2327409271 MIKLMNOQFILHJP-OUCADQQQSA-N 440.550 4.835 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@H]3[C@H](CCCN3C(=O)OC(C)(C)C)C2)C1 2345010813 OIRHJXZTXKBOBG-SJORKVTESA-N 429.443 4.909 50 10 IJGE CN(C[C@@]1(CBr)CC1(F)F)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 2351892390 OQZVVZFMXHEACQ-QAPCUYQASA-N 433.337 4.605 50 10 IJGE Cc1sc2nc(CCBr)[nH]c(=O)c2c1-c1ccc(Br)cc1 36306353 GIYQZMFRVXBBFM-UHFFFAOYSA-N 428.149 4.660 50 10 IJGE O=C(NNc1ncnc(Sc2ccc(Cl)cc2)c1[N+](=O)[O-])c1ccccc1Cl 40607722 WPSUVAYJFCOOKS-UHFFFAOYSA-N 436.280 4.600 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(O)cc2)CCC3)cc1C 40812041 CGKXOHQBBUAJBN-NHFJDJAPSA-N 431.492 4.633 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc([N+](=O)[O-])cc2)CCC3)c1 40812231 YZAHUOFXAAMVEN-LGUFXXKBSA-N 446.463 4.527 50 10 IJGE CC1=C(C#N)C(=O)N(C2CCCCC2)C(=O)/C1=C/Nc1ccccc1C(=O)c1ccccc1 101235169 MNOHSWRODAAUAL-HAVVHWLPSA-N 439.515 4.755 50 10 IJGE CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)/C=C\c3ccccc3)ccc21 205642203 OWZKGJUTTLWSJP-PKLZTIHGSA-N 438.483 4.922 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C\c2ccc(OCCC)cc2)cc1 207118463 SZSACGNWJAQWLZ-QPEJOODUSA-N 432.520 4.917 50 10 IJGE CC[C@H](N/C=C(/C#N)C(=O)N[C@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 217171599 DVGWFEJTONCTNB-ZDTIEKHLSA-N 447.579 4.908 50 10 IJGE CC(=NNC(=O)COc1cc(C)ccc1C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 252622154 NPYDMBQSONPGJB-UHFFFAOYSA-N 433.483 4.614 50 10 IJGE C[C@H]1CC[C@H](Br)CN1C(=O)c1cc(Br)sc1Br 399489594 SPPCRFYVZLEPNV-BQBZGAKWSA-N 446.002 4.661 50 10 IJGE C[C@H]1CCCN(c2ncc(Br)cc2Br)[C@@H]1CBr 688692178 GRNFRGCEBPAZGE-GZMMTYOYSA-N 426.978 4.606 50 10 IJGE C[C@H](Br)[C@@H]1CCCCN1c1ncc(Br)cc1Br 688877420 ZSPGQSJICNSECX-KWQFWETISA-N 426.978 4.749 50 10 IJGE BrCC(CBr)(Cc1ccc(Br)o1)C1CCOCC1 696814654 XFQSUFOPVBAUSG-UHFFFAOYSA-N 444.989 4.787 50 10 IJGE CC(C)[C@H]1CN(c2ccc([N+](=O)[O-])cc2CBr)CCN1Cc1ccccc1 704740787 RYHRFVLXXPZNJO-OAQYLSRUSA-N 432.362 4.837 50 10 IJGE COc1cc(-c2ccccc2)sc1C(=O)NNc1nc(-c2cccnc2)nc(C)c1C 736695210 ZCJXNXYHUWAYRC-UHFFFAOYSA-N 431.521 4.649 50 10 IJGE CCOC(=O)C(CC(=O)c1ccc(C)cc1)=NNC(=O)c1ccc(-c2ccccc2)cc1 1084156963 UXGMHYUQOUUMEL-UHFFFAOYSA-N 428.488 4.584 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)Nc2ccc(-n3ccc(O)n3)cc2)c1C 1557737084 AIJMTSXYVNLAKX-RCCKNPSSSA-N 437.503 4.840 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2ccc3ccc(Br)cc3c2)c1C 1641289449 ODVLQRUGYLFROT-UHFFFAOYSA-N 448.324 4.828 50 10 IJGE CCOc1cc(C=NNC(=O)CSc2nc3ccccc3s2)ccc1OCC(C)C 1772760589 XAOWWADPNOBFFQ-UHFFFAOYSA-N 443.594 4.972 50 10 IJGE CC(C)c1csc(/C(C#N)=C(\O)[C@@H](Cc2ccccc2)N2C(=O)c3ccccc3C2=O)n1 1872750192 AVJNVSCUSGVHTI-DQVIVYRFSA-N 443.528 4.967 50 10 IJGE CN(C)CC(C)(C)CO[C@@H](CI)c1ccccc1Br 1899010472 LJUCYWPKCLWKEZ-AWEZNQCLSA-N 440.163 4.530 50 10 IJGE CCCN(CCCBr)Cc1cc(Cl)ccc1I 1944436716 LLAYHZQSXWWBPU-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE C[C@]1(CBr)CCCN1Cc1c(Br)cccc1Br 1945333947 WZDIISWMEJSTLO-CYBMUJFWSA-N 425.990 4.961 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CC[C@H]2C[C@@H]1C2)C(=O)OC(C)(C)C 1992237249 GECLQWOQRQVTTH-FSZRXZPDSA-N 437.362 4.642 50 10 IJGE CC(C)[C@@H](Br)[C@@H](C)NC(=O)c1cc(Br)c(Br)s1 1997051363 VQEFZFPMKFIXKY-HZGVNTEJSA-N 448.018 4.811 50 10 IJGE CN(C(=O)c1csc(I)c1)[C@H]1CCCCC[C@@H]1Br 2052427310 BUAYTIOINKPLKX-QWRGUYRKSA-N 442.160 4.521 50 10 IJGE CC(C)N1C[C@H](Cc2ccc(I)c(Cl)c2)[C@@H](Br)C1 2086651952 LZGNKCYBQWKHET-RYUDHWBXSA-N 442.566 4.591 50 10 IJGE CC(C)[C@H](CBr)CN1CC[C@@H](C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)C1 2106786451 UZOSVHJWNGWUKU-RBSFLKMASA-N 445.364 4.679 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](C(C)(C)C)CN(C(=O)CCCCBr)C1 2108378281 GLWKKWQQQABUJM-HOTGVXAUSA-N 433.431 4.587 50 10 IJGE CC[C@@H]1CC[C@@H]([C@H](Br)c2cc(I)cc3c2OCC3)O1 2136704935 BPYCWLKWAILPJM-KWCYVHTRSA-N 437.115 4.620 50 10 IJGE CC[C@H]1CN(C(=O)c2ccc(CBr)cc2)[C@@H](CC)CN1C(=O)OC(C)(C)C 2162914259 CZBRZGZYUOSAMZ-ROUUACIJSA-N 439.394 4.832 50 10 IJGE CC(C)CN(C[C@H]1CCCN1C(=O)OC(C)(C)C)CC1(CBr)CCOCC1 2163060452 AZHJRJSKHLAAEQ-GOSISDBHSA-N 447.458 4.536 50 10 IJGE CC1(C)CCCN(S(=O)(=O)c2cc(CBr)sc2Br)CC1 2179790502 FJROQWDNHHFPES-UHFFFAOYSA-N 445.242 4.606 50 10 IJGE CC[C@H]1CCCN(S(=O)(=O)c2cc(CBr)sc2Br)CC1 2179791854 XJKZIESMWZVRFA-JTQLQIEISA-N 445.242 4.606 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(CCCCCCBr)[C@@H](C(F)(F)F)C1 2255000972 HZXOXVWUTVYDKI-ZIAGYGMSSA-N 431.337 4.862 50 10 IJGE C[C@H]1CCN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@H]1CBr 2282976691 VZEPKTGWGIFPGK-DTWKUNHWSA-N 427.539 4.735 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)c1ncnc2cc(OC)c(OC)cc12 2294688724 MXWHIAMNWQGREP-MRXNPFEDSA-N 430.346 4.827 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@H]2C[C@H]3CC[C@H](C3)C2)C1 2299587480 RFFHPKYENXLARC-YYAJDYIMSA-N 449.373 4.786 50 10 IJGE CC1(C)[C@H](Br)CCN1Cc1ccc(Cl)c(I)c1 2300238331 JSHZHQSEYOSPGF-GFCCVEGCSA-N 428.539 4.692 50 10 IJGE C[C@H]1CCN(Cc2cc(I)ccc2Cl)C[C@@H]1Br 2307329348 ZROVBZXEQGGDDB-CABZTGNLSA-N 428.539 4.550 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)CCCOc2cc(C)ccc2C)cc1 2314785579 BGZZINYJLMKENF-UHFFFAOYSA-N 434.536 4.891 50 10 IJGE CCCO[C@@H]1[C@@H](Cl)C[C@@H]1Oc1cc(Br)cc(I)c1 2316756543 FYLPXYGNKMRONM-RWMBFGLXSA-N 445.522 4.607 50 10 IJGE Cn1cc(I)c(C[C@H]2CCC(C)(C)CC[C@@H]2Br)n1 2319208498 VYPWXDJOYNXMHQ-MNOVXSKESA-N 425.152 4.547 50 10 IJGE COc1cc(Br)cc(C=NNC(=O)c2c(C)ccc3ccccc23)c1OC 2323674694 RLAQTXQGIWIKJT-UHFFFAOYSA-N 427.298 4.692 50 10 IJGE CCc1cccc(C)c1NC(=O)C(C#N)=CNc1ccc(I)cc1 2325168643 SOLSKFITCXFKOR-UHFFFAOYSA-N 431.277 4.620 50 10 IJGE C[C@H]1C[C@H](Cl)[C@H](C)CN1Cc1ccc(I)c(Br)c1 2325225727 IJDZHHXZYDXSSZ-NRUUGDAUSA-N 442.566 4.891 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(OC[C@H]2C[C@@H](C(F)(F)F)C2)C1 2327819110 KWAYCHGTYMCBRX-ZENOOKHLSA-N 430.305 4.756 50 10 IJGE FC(F)(CCl)C(F)(F)CNCc1cc(Cl)ccc1I 2336528752 FFMILPMKDOEAOH-UHFFFAOYSA-N 430.010 4.544 50 10 IJGE CC1(C)COC[C@@H]1CO[C@H](CI)c1cccc(Br)c1 2339010725 NBGQSHKRMZNXSD-TZMCWYRMSA-N 439.131 4.614 50 10 IJGE CN(CC[C@@H](Cl)c1cccs1)C(=O)c1csc(I)c1 2340430412 TUKSHPGJGAPLRA-SNVBAGLBSA-N 425.744 4.856 50 10 IJGE FC(F)(F)[C@@H]1C[C@]1(CCl)CNCc1ccc(Cl)c(I)c1 2362371369 PTQTZARHQVTGQM-NEPJUHHUSA-N 438.058 4.842 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@H]1CCl 2362380220 PZPKWIPSMRAJBB-NXEZZACHSA-N 438.058 4.794 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)C1CC(S(C)(=O)=O)C1 2365175402 GRZFLAFIEKDYOO-WZQIAMPNSA-N 448.579 4.762 50 10 IJGE N#C/C(=C/c1ccc(OC(=O)CN2C(=O)c3ccccc3C2=O)cc1)c1cccc(Cl)c1 31901478 MHFZHPBPODKOFW-PDGQHHTCSA-N 442.858 4.606 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C\c2c(Oc3ccccc3C)nc3ccccn3c2=O)cc1 33756972 MZNNLCLQAKAYKU-CYVLTUHYSA-N 436.471 4.649 50 10 IJGE Cc1cc(Br)cc(C)c1OCC(=O)N/N=C/c1ccc(Cl)c(Cl)c1 40885028 JDDFUJKRKCJOBE-ODCIPOBUSA-N 430.129 4.902 50 10 IJGE BrCc1cc(Br)c(OC2CCOCC2)c(Br)c1 232484484 FUVXWKPHMRYSIV-UHFFFAOYSA-N 428.946 4.664 50 10 IJGE C[C@@H](Br)C(C)(C)NC(=O)c1cc(Br)sc1Br 235106688 LIBNEZBCLVCCSE-RXMQYKEDSA-N 433.991 4.565 50 10 IJGE O=C(COc1ccc(Br)cc1)NN=Cc1ccccc1OCc1ccccc1 254506462 MYHHFYFZVRASNE-UHFFFAOYSA-N 439.309 4.557 50 10 IJGE CC1(C)[C@H](Br)CCN1C(=O)c1ccc(Br)cc1Br 311145962 ZNKSIJGPQPAILA-LLVKDONJSA-N 439.973 4.600 50 10 IJGE C[C@H](NC(=O)NNC(=O)COCc1ccccc1)c1ccccc1-c1ccc(Cl)cc1 740057707 HXMKMSOBAJBEJG-KRWDZBQOSA-N 437.927 4.615 50 10 IJGE Cc1c(NNC(=O)c2cc(Oc3cccc(Br)c3)ccn2)cccc1[N+](=O)[O-] 748692624 AJEPUTKTSBTTPI-UHFFFAOYSA-N 443.257 4.610 50 10 IJGE Cn1cc([C@@H](NS(=O)(=O)c2cccc(S(F)(F)(F)(F)F)c2)C(F)(F)F)cn1 774947160 CZOZOFIXCPEODE-LLVKDONJSA-N 445.357 4.659 50 10 IJGE C=CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](O[Si](C)(C)C(C)(C)C)C1 1149156857 UWNVMDDQIIVEQJ-QZTJIDSGSA-N 426.674 4.859 50 10 IJGE CC(=O)N(C)c1ccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Cl)cc3)c2C)cn1 1436914087 WNTRDPLLUWVYOP-UNOMPAQXSA-N 447.926 4.671 50 10 IJGE C=CCNC(=S)NNC(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1 1540371676 QFVLDNVAMXCIGY-UHFFFAOYSA-N 426.394 4.581 50 10 IJGE C=C(C)C[C@@H](CO)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1636699387 KLIQMZKXBVLIFB-BHEJFATLSA-N 432.351 4.751 50 10 IJGE COc1cc(/C=C(\C#N)n2cnc3ccccc32)ccc1OC(=O)c1cccc([N+](=O)[O-])c1 1872727153 ARKBUGXXSMPXNL-YBFXNURJSA-N 440.415 4.694 50 10 IJGE N#C/C(=C(/O)[C@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2ccc(F)cc2F)cs1 1872818250 TYTLZLLMVSAGBG-YUCJCZDXSA-N 437.471 4.930 50 10 IJGE CCOc1c(C(=O)N(Cc2ccccc2)[C@@H](C)CCBr)cccc1[N+](=O)[O-] 1915091090 SPTGCCKQILUZOQ-HNNXBMFYSA-N 435.318 4.809 50 10 IJGE CC[C@@H](Br)CN(c1ncc(Br)cc1Br)C1CC1 1999961639 NDXQTWIRHGDHDT-MRVPVSSYSA-N 426.978 4.749 50 10 IJGE CC(C)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)cc(CBr)c1F 2009658467 OZJLFYYGMXGWJH-UHFFFAOYSA-N 434.758 4.973 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CCC[C@@H](Br)CC1 2031477551 CVZRUCARCZEXGY-SECBINFHSA-N 439.973 4.601 50 10 IJGE CCC[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]1C(F)(F)F 2052479128 MWBKKEBTPIRXSC-MGPQQGTHSA-N 431.337 4.670 50 10 IJGE C[C@@H]([C@@H](Br)c1cc(I)cc2c1OCC2)C(F)(F)F 2059188621 HWUZDFSETBZYCD-QUBYGPBYSA-N 435.021 4.861 50 10 IJGE CCC[C@H]1CN(c2ncc(I)cc2Br)C[C@H]1CCl 2084893742 NICSRKFNTFWTDE-VHSXEESVSA-N 443.554 4.540 50 10 IJGE CC1CC(CBr)(N(C)Cc2ccc(I)c(Cl)c2)C1 2086660851 HXJUBGKMNLTURJ-UHFFFAOYSA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CCCN2CC1(CBr)CCOCC1 2163064684 VNTYGXOLCVPAMK-UHFFFAOYSA-N 439.394 4.978 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CCN(C(=O)[C@H](Br)C1CCCC1)CC2 2167030550 CNLQRHWNFVDCOW-QGZVFWFLSA-N 443.426 4.580 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1ccc(OC(F)(F)F)cc1 2181745964 FOJZATKJXFETRJ-UHFFFAOYSA-N 426.526 4.581 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2cccc(C(F)(F)F)c2)c(Br)cc1O 2293941223 JRBHRBOQZUIPIS-UHFFFAOYSA-N 441.203 4.728 50 10 IJGE CC1(C)C[C@@H](Br)CCN(Cc2sccc2I)C1 2301074465 SDZQSAZIFVRNDV-JTQLQIEISA-N 428.177 4.738 50 10 IJGE ClC[C@H](NCc1ccc(I)c(Br)c1)C1CCC1 2306222122 QEDGSVJYFMLRFQ-ZDUSSCGKSA-N 428.539 4.551 50 10 IJGE CCC[C@H](CCBr)NCc1cc(I)ccc1Cl 2307327899 HGNACEVMAVYMKU-GFCCVEGCSA-N 430.555 4.988 50 10 IJGE CN(Cc1cc(I)ccc1Cl)C1CC(CBr)C1 2307329501 APNPATDKWSVGKW-UHFFFAOYSA-N 428.539 4.550 50 10 IJGE CN(C[C@]1(CBr)CC1(F)F)[C@H]1CCCC[C@H]1N(C)C(=O)OC(C)(C)C 2326920466 ZZUJMAASZYKGFT-JJRVBVJISA-N 425.358 4.517 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)C1 2345004513 LSDVTRQIECAYGW-FQEVSTJZSA-N 429.443 4.911 50 10 IJGE Clc1nccc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)c1CBr 2370824608 LCKOKICTIHSVCQ-AFYVEPGGSA-N 446.820 4.977 50 10 IJGE CCOc1cc(/C=N/NC(=O)COc2cc(C)ccc2C(C)C)cc(Br)c1O 3192647 IWSBVTLGCSVKSX-FOKLQQMPSA-N 449.345 4.514 50 10 IJGE Cc1ccc[n+]([C@H]2C(=O)N(CCc3ccccc3)C(O)=C(C#N)[C@H]2c2ccc(Cl)cc2)c1 20407928 YBZMNNWTJUAKIP-DNQXCXABSA-O 444.942 4.639 50 10 IJGE CCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(OC)c2)c1 38650215 LJZLPWVYSQVWSU-XMMPIXPASA-N 442.471 4.531 50 10 IJGE CC(C)c1ccc(OCC(=O)Oc2ccc(C=C(C#N)C#N)cc2)c(Br)c1 40992955 OQXTXFTZMHFSIM-UHFFFAOYSA-N 425.282 4.987 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Cl)Cc3ccc(Br)cc3)cc2[nH]1 109884021 GLTQKMQKQKZDEH-GFCCVEGCSA-N 430.527 4.904 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc(C)cc2)cc([N+](=O)[O-])c1OCc1ccc(C)cc1 169885826 AZNFOSXEDSPIDK-QFEZKATASA-N 433.464 4.563 50 10 IJGE CCCCOc1ccc(/C=C\C(=O)Oc2ccc(/C=C(/C#N)C(=O)OC)cc2OC)cc1 206272475 GRRJRDJHMBRNNS-UZNKBILISA-N 435.476 4.573 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)/C(C#N)=C\N1CCC(Cc2ccccc2)CC1 217183277 ZRBKBAYQJVPKET-GHIWRQRASA-N 431.580 4.933 50 10 IJGE Clc1cccc(CBr)c1N1CC[C@@H](N2CCN(Cc3ccccc3)CC2)C1 312712776 TVQRBDBPLWRSFA-HXUWFJFHSA-N 448.836 4.631 50 10 IJGE Nc1cc([C@@H]2CN(Cc3ccccc3)C[C@H]2CI)ccc1Cl 382710511 GYAUUSMNOKRUQV-CVEARBPZSA-N 426.729 4.573 50 10 IJGE Brc1ccccc1[C@H](CI)OCCOCC1CCC1 400699403 LVCREWOGQYUTCF-HNNXBMFYSA-N 439.131 4.759 50 10 IJGE O=C(NNC(=O)N[C@@H]1CCCOc2ccc(F)cc21)Nc1ccc(-c2ccccc2)cc1 743613288 GELCRIFOJSRYHP-OAQYLSRUSA-N 434.471 4.742 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2ccccc2OCc2cccc(C)c2)cc1 1083984123 XHQKQEHYJPQRSE-VWLOTQADSA-N 446.547 4.937 50 10 IJGE C=C[C@@H]1OCC[C@H]1CNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1129928570 YQUPXKQPUWFFCT-DNCUJKMVSA-N 443.469 4.727 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C)[C@H]1CCCO1 1459223783 JFDCTZXBHAXILF-UGIGKFKASA-N 442.346 4.605 50 10 IJGE Cc1c(C(=O)N2CCCc3ccccc32)oc2c1C(=NNC(=O)c1ccc(F)cc1)CCC2 1772744216 BHJZGSOZRSBTRO-UHFFFAOYSA-N 445.494 4.791 50 10 IJGE CCCCCN1C(=O)C(=NNC(=O)/C=C/c2ccccc2)c2cc(Br)ccc21 1772752352 ZAEUFQOQIMEYCH-ORWPSOHFSA-N 440.341 4.520 50 10 IJGE Cc1cccc(OCCOc2cccnc2NC(=O)Oc2ccc([N+](=O)[O-])cc2F)c1 1858691448 VVWRQPQREULSOR-UHFFFAOYSA-N 427.388 4.506 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccccc2F)c1 1865693870 MHBMBLMGVKDTQD-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C1 1882088957 VUTUVIVYJCZODR-KLHDSHLOSA-N 447.414 4.558 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1cncc(Br)c1 1915110562 OKHRUEGZNDPPJT-ZDUSSCGKSA-N 426.152 4.660 50 10 IJGE Cc1ccc(F)cc1S(=O)(=O)N(Cc1ccccc1)[C@@H](CBr)C(C)C 1915296504 UYOKNFNCLCAVJV-SFHVURJKSA-N 428.367 4.745 50 10 IJGE O=C(N[C@H](CCCl)C(F)(F)F)c1cc(Br)sc1Br 1918553485 DHKNOIMSLGQQCF-RXMQYKEDSA-N 429.483 4.563 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@H](CBr)C2CCC2)CC[C@H]1C(F)(F)F 1966375848 YVOBXVUMXPSYFC-RBSFLKMASA-N 443.348 4.575 50 10 IJGE BrCc1c(Br)cccc1OCCOCCOCc1ccccc1 1983395025 KAZUIDSDDCMMLB-UHFFFAOYSA-N 444.163 4.956 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ncc(C)cc1Br 1992739650 ZOKGIJQPKKUGAW-OAHLLOKOSA-N 440.179 4.968 50 10 IJGE CC(C)[C@H](Br)[C@H](C)NC(=O)c1scc(Br)c1Br 1997062661 JHZJOJPMMJIBJY-XPUUQOCRSA-N 448.018 4.811 50 10 IJGE CCCN(CCCCl)C(=O)c1ccc(I)c(Br)c1 2032100901 LBSUCCNFLDNKHM-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)Cc1c(Cl)cccc1Cl 2042866301 RGNIEKDZVSZWCO-OAHLLOKOSA-N 445.184 4.975 50 10 IJGE CC1(C)CO[C@H]1COc1c(Br)cc(Br)cc1CBr 2043109106 PEDGBOQETIRLRV-NSHDSACASA-N 442.973 4.910 50 10 IJGE CC(C)CN(C[C@H](Br)C(F)(F)F)C[C@H]1CCCN1C(=O)OC(C)(C)C 2044705000 IAPPOALKHQBAFS-KGLIPLIRSA-N 431.337 4.670 50 10 IJGE BrC[C@H]1C[C@@]2(CCN2Cc2c(Br)cccc2Br)C1 2061793230 NVOMYARDPFPHJQ-YPFXGUDJSA-N 438.001 4.961 50 10 IJGE Brc1cccc(CN2C[C@@H]3CC(Br)C[C@H]3C2)c1Br 2065397100 LVSSHZLPHHUTSC-QWRGUYRKSA-N 438.001 4.817 50 10 IJGE Cc1ccc(Cn2nc(CCl)c(I)c2C(F)(F)F)cc1C 2079210686 XULZHXMWKLFRID-UHFFFAOYSA-N 428.623 4.910 50 10 IJGE Clc1cc(CN2CC[C@@H](Br)C3(CC3)C2)ccc1I 2086658706 PSGAZFAKEBYLCL-CYBMUJFWSA-N 440.550 4.694 50 10 IJGE O=C(N[C@@H]1C[C@H]2CC[C@H]1[C@@H](Cl)C2)c1cc(Br)c(Br)s1 2139718996 LNJWTCZECUITQO-ZRUAGYDASA-N 427.589 4.799 50 10 IJGE Cc1nn(-c2nc3ccccc3cc2CBr)c(C)c1I 2150310463 BMTMZQABJRJDNQ-UHFFFAOYSA-N 442.098 4.537 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)[C@@H](Br)C2CCCC2)CC12CCCCC2 2167034752 YATJRCIJLBNTKL-SJORKVTESA-N 443.426 4.769 50 10 IJGE CCC1(C)CC(N(C)S(=O)(=O)c2cc(CBr)sc2Br)C1 2179792491 HBRCGUCEDGVAFS-UHFFFAOYSA-N 445.242 4.605 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@H]1CCCCN1CCCCCCBr 2223278388 LPWLWHFJWHZEHX-OAHLLOKOSA-N 427.374 4.956 50 10 IJGE COc1ccc([C@H](Br)c2cc(Cl)n(C)n2)c(Br)c1Cl 2268280093 QQPRSAPBBWCSOD-JTQLQIEISA-N 428.939 4.982 50 10 IJGE CS(=O)(=O)c1cscc1[C@@H](Br)c1ccc(F)c(Br)c1F 2288500771 KZFRUBXBRHSZRT-JTQLQIEISA-N 446.132 4.677 50 10 IJGE C[C@@H]1CN(Cc2sccc2I)CC[C@H]1CCBr 2301072457 YCFSCHLCGMDEKD-GHMZBOCLSA-N 428.177 4.596 50 10 IJGE Clc1ccc(I)cc1CN(CCBr)C1CCC1 2307323593 AYFZRBVXDZXNBU-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE Cc1ccccc1Oc1nc2ccccn2c(=O)c1C=C(C#N)c1nc2ccccc2n1C 2314437011 ZSFAAOIVKAARRK-UHFFFAOYSA-N 433.471 4.746 50 10 IJGE CCCCOc1ccc(C=C(C#N)C(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C)C3)cc1 2314734981 LPYWLVSRMUSQDE-OAHLLOKOSA-N 437.565 4.696 50 10 IJGE N#CC(=Cc1ccc(OC(=O)C=Cc2ccccc2Cl)cc1)C(=O)NCc1ccco1 2314754713 ZBORFTJUEXPCCY-UHFFFAOYSA-N 432.863 4.775 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)C=Cc2cccc(Cl)c2)c(OC)c1 2314789571 HLJBARDEQPYTEM-UHFFFAOYSA-N 438.911 4.791 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCN(CCCCBr)[C@@H](C(F)(F)F)C1 2315835033 TXQZSYPZXSZKSI-UONOGXRCSA-N 431.337 4.719 50 10 IJGE N#CC1=C2N=C(N)c3ccccc3N2C2=C(C(=O)CCC2)[C@@H]1c1cccc(Br)c1 2500589 SMSGKNKAABPRAN-HXUWFJFHSA-N 445.320 4.514 50 10 IJGE CCCC(=O)Nc1ccc(C(=O)NNC(=O)[C@H](CC)Oc2ccccc2[C@@H](C)CC)cc1 10683367 NRCQEHMKZYSOQL-UWJYYQICSA-N 439.556 4.557 50 10 IJGE CCN(c1ncnc(NNC(=O)c2ccc(C)cc2)c1[N+](=O)[O-])c1cccc2ccccc12 40589256 QTCWEPPKHGGJHU-UHFFFAOYSA-N 442.479 4.761 50 10 IJGE IC[C@@H](I)Sc1cccc2cccnc12 95882219 XQMJSFFIXSGXMI-JTQLQIEISA-N 441.075 4.523 50 10 IJGE CCC(=O)[C@H](Br)Cc1cc(OC)c(Br)cc1Br 232841456 ITBYNYPWZDUKCT-SECBINFHSA-N 428.946 4.505 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3sccc3C)n2-c2ccccc2)cc1 254907322 XTZUZFLFRVUKQN-UHFFFAOYSA-N 447.589 4.855 50 10 IJGE CCc1nnc(COc2c(Br)cc(Br)cc2CCl)s1 702681870 YHISOVJAXDLZPQ-UHFFFAOYSA-N 426.561 4.943 50 10 IJGE ClCc1nc2cc(Br)cnc2n1CC[C@@H]1CCN(Cc2ccccc2)C1 723978252 ZWKXXJOBCBRFNG-INIZCTEOSA-N 433.781 4.845 50 10 IJGE O=C(NNc1cccc(F)c1F)c1nn(-c2ccc(Br)cc2)c2c1CCCC2 743724495 KYQLRZUGCYMPOT-UHFFFAOYSA-N 447.283 4.549 50 10 IJGE Cc1cccc(-n2ncc(C(=O)NNc3nc4ccccc4[nH]c3=S)c2C(F)(F)F)c1 1301148346 NTLIGHFFDNLIBB-UHFFFAOYSA-N 444.442 4.562 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(C)c(-c3ccsc3)c2)cc1 1674685536 BQWGKTPCEWRHMK-MRXNPFEDSA-N 437.521 4.546 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@H]1c1ccc(O)cc1 1865683622 GIDOYIYETNEZAJ-INIZCTEOSA-N 446.816 4.527 50 10 IJGE COc1ccc(-c2ccc(C(=O)N/N=C\c3ccc(C(F)(F)F)cc3)c(C)n2)cc1OC 1865760930 XIYBWDDENGVZKG-WKIKZPBSSA-N 443.425 4.857 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CCl)Cc1scc(Br)c1Br 1880731401 AJLJUUBHAVOTCM-SSDOTTSWSA-N 433.593 4.948 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@]23CCOC[C@@H]2C3)s1 1900919392 OYGAWJJGYZBCSL-NRZXQICZSA-N 433.536 4.869 50 10 IJGE BrCC1CCN(Cc2ccc(Br)cc2Br)CC1 1943845508 KSSOYAPIRONFLH-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE ClC1([C@@H](Br)c2cc(I)cc3c2OCC3)CCC1 2020450377 QDIMMPUFKSTPFP-LBPRGKRZSA-N 427.507 4.824 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)CC1CC(Br)C1 2026560390 JQSYTRYKZFVORN-UHFFFAOYSA-N 428.539 4.550 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1Cc1ccc(I)c(Cl)c1 2026563695 MLDSDCHBBGGVBX-GXSJLCMTSA-N 428.539 4.692 50 10 IJGE CC(C)N1C[C@H](Cc2c(Br)cccc2Br)[C@@H](Br)C1 2039261355 GWOGMNADIGZCIV-HZMBPMFUSA-N 440.017 4.858 50 10 IJGE Cl[C@H]1CCC[C@H]2CC[C@H]1N2c1ncc(I)cc1Br 2069534614 XRBHVMLRRZUWHT-ZMLRMANQSA-N 441.538 4.577 50 10 IJGE Clc1cc(CN2C[C@@H]3CC[C@@]3(CBr)C2)ccc1I 2086654956 KFABHNAOWXCJNW-SMDDNHRTSA-N 440.550 4.552 50 10 IJGE Clc1cc(CN2CCCC[C@H](CBr)C2)ccc1I 2086658379 MYDAJXGIKDUUEF-GFCCVEGCSA-N 442.566 4.942 50 10 IJGE Clc1cc(CN2C[C@H]3C[C@H]2CC[C@H]3Br)ccc1I 2086660208 CDJYCTHWMLCFIN-IJLUTSLNSA-N 440.550 4.692 50 10 IJGE Brc1cccc([C@H](CI)OC[C@H]2CCCCCO2)c1 2096322257 NJCJVRHJHUABTH-CABCVRRESA-N 439.131 4.901 50 10 IJGE CN(C[C@H]1CCCCN1C[C@@H](CBr)c1ccccc1)C(=O)OC(C)(C)C 2106785240 NWRZSTADIMWZRY-RTBURBONSA-N 425.411 4.887 50 10 IJGE Cc1nn(C)c2sc(C(=O)N(Cc3ccccc3)C3(CBr)CCC3)cc12 2118613084 FXNBYNQGJVJNAV-UHFFFAOYSA-N 432.387 4.903 50 10 IJGE C[C@@H](C(=O)N(C)CC1CC(Br)C1)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 2196906618 HLBLTTPJGGXVQV-VSVYTNTFSA-N 439.394 4.520 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@@]1(F)CN(C[C@@H](CBr)c1ccccc1)C2 2198086869 OPFGTJIIFQTCNO-UIFIKXQLSA-N 441.385 4.636 50 10 IJGE O=C(N[C@]1(CBr)C[C@H]2CC[C@H]1C2)c1scc(Br)c1Cl 2268605139 BTSDYQHGIYELPA-UPFKWVMWSA-N 427.589 4.848 50 10 IJGE COc1ccc([C@H](Br)[C@@]23CC[C@@](C)(C2)OC3)cc1I 2269545625 MMXUBOOCYBCOFZ-KKUMJFAQSA-N 437.115 4.695 50 10 IJGE O=C(NCC[C@@H]1CCC[C@H]1Br)c1cc(Br)c(F)cc1Cl 2285846176 LAQKANCIHVSLOM-WCBMZHEXSA-N 427.539 4.925 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)ccc1OCc1cccc(C(=O)O)c1 2313562201 IZPJDXAPJSQIAM-UHFFFAOYSA-N 442.471 4.827 50 10 IJGE CCCCOc1ccc(C=CC(=O)Oc2ccc(C=C(C#N)C(=O)OCC)cc2OC)cc1 2314734496 BRECDANOPXUCHT-UHFFFAOYSA-N 449.503 4.963 50 10 IJGE Br[C@@H]1CCC2(CCN(Cc3sccc3I)CC2)C1 2316756809 APJNNTUZWPJFIX-LLVKDONJSA-N 440.188 4.882 50 10 IJGE C[C@H](NC=C(C#N)C(=O)Nc1ccc(Br)cc1)C12CC3CC(CC(C3)C1)C2 2324082625 VZOQWTUJJRQFLM-HIGJEIRPSA-N 428.374 4.990 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)C(C#N)=CNc1ccc(Cl)c([N+](=O)[O-])c1 2325072311 LEMHRMGQYRLQDS-AWEZNQCLSA-N 428.876 4.652 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Cl)c1c(Br)ncn1C 2337273317 TVNMPPGXNCIWLA-VIFPVBQESA-N 428.939 4.935 50 10 IJGE C[C@@H]1CCC[C@H](CO[C@H](CI)c2ccc(Br)cc2)O1 2338705043 JSHATHXYXXUHIB-KCPJHIHWSA-N 439.131 4.899 50 10 IJGE Clc1ccc(Br)c(CN(CCCBr)C2CCOCC2)c1 2381153877 BWVLSNOOXJZGMG-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE CC(C)COc1ccc(Br)cc1C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 14667006 RKTPDMPEMQCSMN-UHFFFAOYSA-N 447.373 4.856 50 10 IJGE CCCCOc1ccc(OCC(=O)N/N=C/c2cc(Br)ccc2OCC)cc1 20594795 PULSGPRXYMJRCY-OEAKJJBVSA-N 449.345 4.556 50 10 IJGE CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccccc3F)ccc21 38650547 SIXMYFSRVKQWSN-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE Nc1c(NNC(=O)c2ccccc2Cl)ncnc1NC(c1ccccc1)c1ccccc1 40783663 XTGKBIUMZYTWKN-UHFFFAOYSA-N 444.926 4.671 50 10 IJGE COc1cc(CBr)cc(Br)c1OCCCOCC(F)(F)F 49312733 HZCGCUUXOBPYFT-UHFFFAOYSA-N 436.062 4.700 50 10 IJGE BrCCC[C@@H]1CCCN1c1ncc(Br)cc1Br 129138104 ZUAYIGQSLGCCGW-SNVBAGLBSA-N 426.978 4.751 50 10 IJGE O=S(=O)(Nc1cccc(CCCBr)c1)c1sccc1Br 139459359 JAYBWGPOGQRXQE-UHFFFAOYSA-N 439.194 4.639 50 10 IJGE O=C(N/N=C\c1ccc(Cl)cc1Cl)c1cccn(Cc2ccc(Cl)cc2)c1=O 169920372 FVVHEJSOSJZHPL-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE O=C(N/N=C\c1ccc(Cl)cc1Cl)c1cccn(Cc2ccccc2Cl)c1=O 169920855 BEFRYVXPDVMXSG-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1Br)c1cc(Br)sc1Br 232461110 JBQQBYDCNBRPEZ-JGVFFNPUSA-N 446.002 4.709 50 10 IJGE CC[C@@H]1[C@@H](CBr)CCN1c1ncc(Br)cc1Br 385841490 VXSLLNCODAHWFY-LDYMZIIASA-N 426.978 4.606 50 10 IJGE CCN(C[C@](C)(CI)OC[C@H](C)C1CCC1)C(=O)OC(C)(C)C 398383439 NYKJDKDIRUFGGH-KSSFIOAISA-N 439.378 4.890 50 10 IJGE BrCC1(CN2CCO[C@@H]3CCN(Cc4ccccc4)C[C@@H]32)CCCCCC1 404261205 RNBRBQAJRRBTMC-FCHUYYIVSA-N 435.450 4.697 50 10 IJGE CCCC[C@H](Cl)CC[C@@H](COC(=O)CCc1ccccc1)C(=O)CCCNC(C)=O 585667013 NMCYRDUXKPNNTK-VXKWHMMOSA-N 438.008 4.842 50 10 IJGE ClCc1nc2cc(Br)cnc2n1CCc1sccc1Br 713034119 FSETZIRJMOSJPS-UHFFFAOYSA-N 435.572 4.999 50 10 IJGE O=C(NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1cc(Cl)sc1Cl 734257576 GFDCPZZLUXMMGI-UHFFFAOYSA-N 434.230 4.683 50 10 IJGE N#Cc1ccc(NNC(=O)c2c(-n3cccc3)sc3c2CCSC3)c(C(F)(F)F)c1 799753102 NQLSUDBFYDUECS-UHFFFAOYSA-N 448.495 4.975 50 10 IJGE Cc1ccc(C)n1-c1ccc(C(=O)NN=Cc2cccn2-c2ccc(N(C)C)cc2)cc1 1084637288 AMMXPIXLKRZQIW-UHFFFAOYSA-N 425.536 4.715 50 10 IJGE CC(C)Sc1ccc([C@@H](C)NC(=O)NNC(=O)c2ccc(Br)cc2)cc1 1251636868 USAXYHATXFCDOD-CYBMUJFWSA-N 436.375 4.655 50 10 IJGE C=CCCC[C@H](NC(=O)NNC(=O)c1ccc(OC(C)C)c(OC)c1)c1ccccc1 1313217983 BWFFBZWIHWCCPN-FQEVSTJZSA-N 425.529 4.524 50 10 IJGE CCc1nn(Cc2cccc(F)c2)c2c1[C@@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865701457 WACSEOSHRUXTKK-QHCPKHFHSA-N 445.542 4.697 50 10 IJGE COCCOc1ccc(/C=C(\C#N)C(=O)Nc2cccc(OCc3ccccc3)c2)cc1 1866213878 ICGOKDQJPWRZKI-CJLVFECKSA-N 428.488 4.836 50 10 IJGE CC(C)N(C[C@@H]1CCCN1C(=O)OC(C)(C)C)CC(C)(C)CI 1904653486 MJDFQKOKMNBOEK-HNNXBMFYSA-N 438.394 4.558 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1Cl 1914354445 YVDQLETYBVDDMJ-LBPRGKRZSA-N 437.186 4.968 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H](Br)[C@H](C3CC3)C2)c1 2030226633 LUZHZLVCTIKPHD-QWHCGFSZSA-N 440.550 4.550 50 10 IJGE CC[C@H](C)[C@H](CBr)NC(=O)c1ccc(Br)cc1Br 2081239065 NPBOCIFIHFJWON-UFBFGSQYSA-N 441.989 4.751 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCCCN1C[C@H](CBr)c1ccccc1 2106781557 IXIXHGIKZONTMK-RBUKOAKNSA-N 425.411 4.934 50 10 IJGE CCCN(C(=O)[C@H](Br)C1CCCC1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2110716091 UHMFMXYWPHWEOX-DLBZAZTESA-N 431.415 4.578 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CN(CCCCCCCCCBr)CCO1 2119486519 GERAWEAUSHAYCG-SFHVURJKSA-N 435.447 4.728 50 10 IJGE CC(C)(C)OC(=O)N1CC(C2CCN(CC3(CBr)CCCCC3)CC2)C1 2120422055 SCLUKRXPAVYVFJ-UHFFFAOYSA-N 429.443 4.911 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC2(CBr)CCC1CC2 2122352412 XCTOEUPTFDNTEC-UHFFFAOYSA-N 427.589 4.944 50 10 IJGE COCCOCCN(Cc1ccccc1)c1nc2ccccc2cc1CBr 2152217658 KFNZPJHKJHDQJY-UHFFFAOYSA-N 429.358 4.799 50 10 IJGE CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)N3CCC(Br)CC3)ccc21 2162494134 FIRYODGKPASSFT-UHFFFAOYSA-N 438.366 4.766 50 10 IJGE ClCCOCC1CCN(Cc2cc(Br)ccc2Br)CC1 2175155725 VBEJTRKTGJQKBG-UHFFFAOYSA-N 425.592 4.679 50 10 IJGE O=[N+]([O-])c1ccc(CBr)c(N2CCN(Cc3ccccc3)C3(CCC3)C2)c1 2176905876 CPKHEHBXFPOOQK-UHFFFAOYSA-N 430.346 4.735 50 10 IJGE Cc1sc(Br)c(C(=O)N2[C@H]3CC[C@H]2[C@H](F)[C@H](Br)C3)c1C 2190680963 ZZRDHKVLURTZTI-MIZYBKAJSA-N 425.161 4.606 50 10 IJGE Cl[C@H]1COC[C@@H]1c1sc(Br)c(Br)c1Br 2209977223 QAHSQHZNAAOIHI-IMJSIDKUSA-N 425.367 4.757 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCI)[C@@H](C(C)(C)C)C1 2211186695 XCIGGCZDYFJFLD-OAHLLOKOSA-N 438.394 4.559 50 10 IJGE C[C@H](Br)C[C@H]1CCCCCN1C[C@@H]1CC1(Br)Br 2213095566 PHEWJIFAOJFHRH-SDDRHHMPSA-N 432.038 4.911 50 10 IJGE CC(C)(C)[C@H]1C[C@H](S(=O)(=O)N(Cc2ccccc2)C2(CBr)CCC2)C1 2223712517 LJRRUZGVQVTJIN-IYARVYRRSA-N 428.436 4.961 50 10 IJGE CCC1(CC)[C@@H](Br)C[C@@H]1OCCOCCOCCOCc1ccccc1 2227781649 ZRGPUVUKJWVPLW-PMACEKPBSA-N 429.395 4.595 50 10 IJGE CC(C)[C@H](CCl)N(Cc1ccccc1)C(=O)c1cc(Br)c(O)cc1O 2256018410 MUXNCOIKZVGQNG-INIZCTEOSA-N 426.738 4.766 50 10 IJGE Cc1cc(Br)c([C@H](Cl)C2CC(S(C)(=O)=O)C2)cc1Br 2269788242 IUDQTVPFJZJSHF-KJHLLKJSSA-N 430.589 4.623 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](O)[C@H]1C[C@H](Br)C1 2301506906 CFGPTMKCKVGBTD-WSFZALMZSA-N 430.937 4.866 50 10 IJGE CC(C)[C@H]1C[C@@H](Br)CN1c1ncc(Br)cc1Br 2304240420 WVZQMKYZQHLMDE-MWLCHTKSSA-N 426.978 4.605 50 10 IJGE C[C@H]1[C@@H](CBr)CCN1Cc1cc(I)ccc1Cl 2307327540 BTQMMOLYAIEKEE-VHSXEESVSA-N 428.539 4.550 50 10 IJGE Clc1ccc(I)cc1CN1CCCC[C@@H](Br)C1 2307331422 FPPVQNYMDIKWPV-LLVKDONJSA-N 428.539 4.694 50 10 IJGE CCCCOC(=O)c1ccccc1NC=C(C#N)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 2318462163 CQKCARPBKJLQMI-UHFFFAOYSA-N 442.859 4.663 50 10 IJGE Cc1c(CBr)ccc(NS(=O)(=O)c2sccc2Br)c1C 2367935346 CJLZQHHMELGGOL-UHFFFAOYSA-N 439.194 4.823 50 10 IJGE O=C(CCC(=O)Nc1ccc(Cl)cc1)N/N=C/c1ccccc1OCc1ccccc1 20522840 IIPFNQGJBDCPEF-WGOQTCKBSA-N 435.911 4.788 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)Nc2cc(C(F)(F)F)ccc2Cl)c(OC)c1OC 33499294 UVJUULHKYWRZAT-WQLSENKSSA-N 440.805 4.930 50 10 IJGE CCCCCOc1ccc(/C=C2/C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)cc1OC 38606919 KZLXRKGWQCUCPK-DEDYPNTBSA-N 434.492 4.650 50 10 IJGE CCCCc1ccc(Nc2ncnc(NNC(=O)c3cccc(Cl)c3)c2[N+](=O)[O-])cc1 40581294 HUFCLYIOPWCBIR-UHFFFAOYSA-N 440.891 4.881 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1S[C@H](C)C(=O)N/N=C(\C)CCCC 59915326 SRVZZPFQXNNDHA-DTVDJLOLSA-N 449.024 4.893 50 10 IJGE O=C(CCCc1cccs1)Nc1cccc(C(=O)NNc2ccc(F)c(F)c2F)c1 110963134 DOTVNECNUYMFTG-UHFFFAOYSA-N 433.455 4.884 50 10 IJGE CCn1c(C)c(/C=N\NC(=O)c2cccn(Cc3ccccc3Cl)c2=O)c2ccccc21 169920875 JFSSFFFMLHLFJP-DICXZTSXSA-N 446.938 4.597 50 10 IJGE CCN(CCCBr)C(=O)c1cc(Br)sc1Br 233468325 PGWJZZLICUBSSJ-UHFFFAOYSA-N 433.991 4.520 50 10 IJGE CS(=O)(=O)CCCCC(CBr)(CBr)c1ccc(Cl)cc1 706358599 OBGZWRKYRPEDMM-UHFFFAOYSA-N 446.632 4.583 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)c1C 743462562 JSOCEPZATHFBBS-QZTJIDSGSA-N 428.323 4.709 50 10 IJGE CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N1CCC[C@H](O[Si](C)(C)C(C)(C)C)C1 1527931174 CZGVUZRKSNNCSF-RBBKRZOGSA-N 428.649 4.963 50 10 IJGE C=CCC[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2)c1C)C(=O)OCC 1635699396 VXEDMCFCJZFSRY-JJEHFPDLSA-N 439.943 4.669 50 10 IJGE CCCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)cc1OC 1865695089 JMTQPQRXBAKFND-XMMPIXPASA-N 444.535 4.977 50 10 IJGE CCCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccncc1)C(C#N)=C(N)O2 1865700258 OAKWJHUVAZFCSC-IBGZPJMESA-N 440.334 4.804 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCN(Cc2ccccc2)CC1(C)C 1880767446 PLDOIBADXOSTDM-ROUUACIJSA-N 425.411 4.823 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)CCc1ccccc1NC(=O)OC(C)(C)C 1887823323 MEGMCWZQLXAMOO-FZNQNYSPSA-N 425.367 4.598 50 10 IJGE Cc1cc([C@@H](Br)c2c(Br)ncn2C)sc1Br 1900441550 UOKUTNNPYCBCBH-SSDOTTSWSA-N 428.975 4.799 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1c(F)ccc([N+](=O)[O-])c1F 1915274598 SIXBNTCLFXBYFD-MRXNPFEDSA-N 441.272 4.935 50 10 IJGE O=S(=O)(c1cc(CCl)ccc1Br)N(Cc1ccccc1)C1CCC1 1946851061 KHHWBMGSHLHZLD-UHFFFAOYSA-N 428.779 4.931 50 10 IJGE O=C(NCCNC(=O)c1cccc(CCl)c1)OCC1c2ccccc2-c2ccccc21 1956261662 FFAZHULIBGVHAA-UHFFFAOYSA-N 434.923 4.694 50 10 IJGE CC(C)(C)OC(=O)N1CCC(C2CCN(C[C@H](CBr)C3CC3)CC2)CC1 1962826766 MKQNUMHZQPFLEF-IBGZPJMESA-N 429.443 4.767 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)C(=O)Cc1ccc(O)c(Br)c1 1980631747 GQCXXHIYJIJZEC-CYBMUJFWSA-N 441.163 4.509 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]3(CCC[C@@H](CI)O3)C[C@H]21 2001949852 IHTRXGZPLWAVEL-YYAJDYIMSA-N 449.373 4.929 50 10 IJGE CCC[C@@H](Br)CCNC(=O)c1cc(Br)cc(Br)c1 2029925000 WFWRNRSPACWSNK-SNVBAGLBSA-N 441.989 4.895 50 10 IJGE C[C@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)ccc1F 2059264410 FOGBXYIEXIJERJ-CQSZACIVSA-N 426.351 4.710 50 10 IJGE CN(C[C@@H]1CCCCN1C[C@@H](CBr)c1ccccc1)C(=O)OC(C)(C)C 2106782098 NWRZSTADIMWZRY-MOPGFXCFSA-N 425.411 4.887 50 10 IJGE COc1cc(NC(=O)[C@@H](Br)C2CCCC2)ccc1NC(=O)OC(C)(C)C 2110721794 IRCICDBKHOCEGU-INIZCTEOSA-N 427.339 4.934 50 10 IJGE O=C(NC[C@H]1C[C@H](Cl)C12CCC2)c1csc(Br)c1Br 2115610677 SWZAYIXUPGJXRB-APPZFPTMSA-N 427.589 4.801 50 10 IJGE ClCc1nc2ncccc2n1-c1cc(I)ccc1Br 2119397979 NTABZUVKRAMPEI-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE FC1(F)CCC2(CC1)[C@@H](Br)C[C@@H]2OCCOCCOCc1ccccc1 2121105084 MPFHPRHRIBNTBN-ROUUACIJSA-N 433.333 4.968 50 10 IJGE C[C@@H](N(Cc1ccccc1)S(=O)(=O)N1CCC[C@@H](CCBr)C1)C(C)(C)C 2123368100 BDDQILOQNQLOKJ-MJGOQNOKSA-N 445.467 4.665 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@@H]1C[C@@H](C(C)(C)C)CN(C(=O)OC(C)(C)C)C1 2196908339 XFGRECCYHAZLPH-JCCCHCCOSA-N 445.442 4.538 50 10 IJGE COC1(CO[C@H](CI)c2ccccc2Br)CCC1 2254930992 BDBDGOKZKHBCDF-CYBMUJFWSA-N 425.104 4.511 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@@H](Br)[C@H]1[C@H]2COC[C@H]21 2259998712 GXHKSPZWQIISJB-DDAZSXFFSA-N 446.911 4.818 50 10 IJGE CC1CCC([C@@H](CBr)NC[C@H]2CC2(Br)Br)CC1 2306825760 LJFINHKRGJGBME-KIDURHIOSA-N 432.038 4.672 50 10 IJGE CNC(=O)C(C#N)=C1S[C@@H](Cc2cccc(Cl)c2)C(=O)N1c1ccc(C(C)C)cc1 2314593464 NDYPJOILHSMYBB-FQEVSTJZSA-N 439.968 4.636 50 10 IJGE COc1ccc(C=NNC(=O)c2cc3ccccc3n2C)cc1OCc1ccc(C)cc1 2323732906 GVBKVTXULDRHMZ-UHFFFAOYSA-N 427.504 4.838 50 10 IJGE CN(Cc1cc(I)ccc1Cl)C[C@@H]1CCC[C@@H]1Br 2327398475 FCFDIZXLYBBBLY-GWCFXTLKSA-N 442.566 4.940 50 10 IJGE CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1cccc(Oc2ccccc2)c1 2328822755 PUNVHDOGGVTKMY-NRFANRHFSA-N 425.529 4.868 50 10 IJGE Cc1cc(C(=O)NC(C)(C)[C@H](Br)C(C)C)ccc1I 2340403740 WFEZLJSVTHQUAQ-CYBMUJFWSA-N 438.147 4.528 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCCCN2C[C@@]2(CBr)CC2(F)F)CC1 2351891479 HHYOAQOSFFJJME-KRWDZBQOSA-N 437.369 4.662 50 10 IJGE CCN1C(=O)C(C#N)=C(C)/C(=C\c2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)C1=O 38603180 AZWQKOLPNXPNOI-FYJGNVAPSA-N 448.482 4.898 50 10 IJGE C=CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(C)c4)ccc32)cc1 38657990 JWEDXNBETYHIMX-RUZDIDTESA-N 438.483 4.997 50 10 IJGE O=[N+]([O-])c1ccc(C[C@@H](Br)c2ccc(I)cc2)cc1 110298182 QXZJIUVGNCPURG-CQSZACIVSA-N 432.055 4.878 50 10 IJGE O=C(N/N=C/c1c(Cl)ccc(Cl)c1Cl)c1cc(-c2ccc(F)cc2)nc(O)n1 169924134 HEVGEVCHAXIWTP-LIMNOBDPSA-N 439.661 4.712 50 10 IJGE Cc1cccc(N2CCN(/C=C(/C#N)C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)c1C 217006112 KCVXHSMRVAPASB-VKAVYKQESA-N 429.351 4.778 50 10 IJGE COc1ccc(OC)c(N/C=C(/C#N)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c1 217249451 VMYAEMXLRMHVMS-KHPPLWFESA-N 425.794 4.834 50 10 IJGE O=[N+]([O-])c1ccc(Oc2ccccc2I)cc1CBr 232485266 TVFFPMPTBPSSRY-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE CCCO[C@@H]1[C@@H](Br)C[C@@H]1Oc1ccc(Br)cc1Br 233234545 BNMCYLXNMXOXPO-WCFLWFBJSA-N 442.973 4.921 50 10 IJGE C[C@H]1CCN(C(=O)c2cc(Br)sc2Br)C[C@H]1Br 235617229 UDWRGNICOHUIJA-POYBYMJQSA-N 446.002 4.519 50 10 IJGE COc1ccc(OC)c(C=NNC(=O)c2cc(-c3ccc(C)cc3)nc3ccccc23)c1 254843142 AXZWAGDEZPBSPC-UHFFFAOYSA-N 425.488 4.991 50 10 IJGE O=C(c1cc(Br)ccc1Cl)N1CCC(F)(F)[C@H](CBr)C1 403969421 MNMONYDYDBJKDW-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE COc1ccc(Cl)cc1COC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 729344237 DDNPSRSALHHNRS-LDADJPATSA-N 446.894 4.776 50 10 IJGE C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F 732491597 HAZRBABCGQXLRL-CYXMAGCYSA-N 442.890 4.894 50 10 IJGE Cc1cccc(C)c1NC(=O)COC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(F)cc2)c1C 786605170 DREXBGXYGZZLFO-BKUYFWCQSA-N 445.494 4.939 50 10 IJGE Cc1c(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cnc(Cl)c1Br 799412418 ZAMIDVBUFUOZKO-UHFFFAOYSA-N 448.630 4.845 50 10 IJGE C#CCSCCNC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1293737349 JHBCMEGFSNWABM-PDGQHHTCSA-N 431.483 4.503 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cc3c(nc2O)CCCC3)c(C)n1-c1ccccc1F 1437411901 ROBHLALCWDFLOF-UNOMPAQXSA-N 430.483 4.758 50 10 IJGE C=CCOc1ccc(C(=O)NNC(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1OC 1448306927 YRCDWUTWWKOGAW-UHFFFAOYSA-N 444.702 4.687 50 10 IJGE C=C[C@@H]1OCC[C@H]1CNC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc3ccccc23)c1C 1529258427 QUCDJRAQOAKUSC-OBUZJGBGSA-N 425.532 4.862 50 10 IJGE C[C@H](Cl)C(=O)Nc1ccc(Oc2ccc(NC(=O)[C@H]3CCCC[C@H]3C(=O)O)cc2)cc1 1859505272 SCUYKLBZWZHYOR-PNHOKKKMSA-N 444.915 4.874 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CC(C)C)cc1 1865694944 GGICRNDRJHAXAS-JOCHJYFZSA-N 444.535 4.832 50 10 IJGE CC(C)[C@@H]1[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C 1881095384 SYUGTMSYAMLDOU-RBSFLKMASA-N 435.403 4.556 50 10 IJGE O=S(=O)(c1ccc2c(c1)CCCC2)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915185479 BILQEAIGDGFBDQ-JOCHJYFZSA-N 448.426 4.930 50 10 IJGE O=C(c1ccccc1I)N(Cc1ccccc1)[C@@H](CCl)C1CC1 1915207456 IFGJSYXENMYXGR-SFHVURJKSA-N 439.724 4.951 50 10 IJGE Cc1nn(C)c(CN(Cc2ccccc2)[C@H](CBr)C2CC2)c1Br 1915212863 YYXYBYXDGJSALT-MRXNPFEDSA-N 441.211 4.667 50 10 IJGE O=C(c1occc1Br)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915313428 NONNHWHANPLWLT-HNNXBMFYSA-N 427.136 4.858 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1Cc1csnc1Br 1925106083 REICOPBYIXLSOC-LURJTMIESA-N 436.560 4.761 50 10 IJGE C[C@H]1C[C@@H](CBr)CN1Cc1c(Br)cccc1Br 1950540220 YYQOBJIWVGDHDX-UWVGGRQHSA-N 425.990 4.817 50 10 IJGE C[C@@H]1C[C@@H]1N(CCBr)C(=O)c1cc(Br)c(Br)s1 2002024078 OMVMCIMOBKVPQU-SVRRBLITSA-N 446.002 4.519 50 10 IJGE C[C@H]1OCC[C@@]1(CBr)Cc1ccc(I)c(Cl)c1 2026569923 ODKKYBPNSDMUSJ-RNCFNFMXSA-N 429.523 4.677 50 10 IJGE BrC[C@H]1[C@H]2CN(Cc3ccc(Br)cc3Br)CC[C@H]21 2032221275 YWSMVHCGQUWWMS-XQQFMLRXSA-N 438.001 4.674 50 10 IJGE BrC[C@@H]1C[C@@H]2CN(Cc3ccc(Br)cc3Br)C[C@H]21 2053979285 DMDHFDYIXMUSMU-LOWVWBTDSA-N 438.001 4.674 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)C(C)(C)C)C[C@H]1CC(F)F 2057192329 GCEXOOXQLVVDET-ZIAGYGMSSA-N 427.374 4.620 50 10 IJGE Brc1cc2c(cc1[C@H](Br)C1CC(Br)C1)OCCO2 2076167451 MTSYOYXQEHAIQW-KTRLOWJHSA-N 440.957 4.830 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Cl)c2)CC[C@@H]1CBr 2086661467 MRAFYMYFESKFHE-CMPLNLGQSA-N 442.566 4.798 50 10 IJGE C[C@@H]1CCN(C[C@@H](CBr)c2ccccc2)C[C@@H]1CNC(=O)OC(C)(C)C 2106781276 GMWNAHXLIDOQOZ-QRQLOZEOSA-N 425.411 4.648 50 10 IJGE CC[C@H]1CN(C(=O)OC(C)(C)C)[C@H](CC)CN1C(=O)[C@@H](Br)C1CCCC1 2110715449 NLZHAXAACNTQOI-BBWFWOEESA-N 431.415 4.577 50 10 IJGE Cl[C@H]1Cc2ccccc2[C@H]1Nc1ncc(I)cc1Br 2133370369 ACZQYCJNORXCLD-QWHCGFSZSA-N 449.517 4.765 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Cl)c1cnn(C)c1Br 2138243779 WIWMFNAPWODCTH-JTQLQIEISA-N 428.939 4.935 50 10 IJGE O=C(NC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(CBr)cc1 2145445076 ADSLFXHHOWMOAO-FRIKZZABSA-N 427.386 4.897 50 10 IJGE C[C@H](Cl)c1nc2cc(I)c(F)cc2n1CCP(C)(C)=O 2194061159 FIXVRHLLXFQHOK-QMMMGPOBSA-N 428.613 4.703 50 10 IJGE ICCCCCN1C[C@]23CCC[C@@]2(C1)CN(Cc1ccccc1)C3 2214705322 QFICAVMLHHYZTB-OYRHEFFESA-N 438.397 4.580 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CCC[C@H](C)O2)cc1I 2257355483 PDYJQQOQCHFTSE-HERUPUMHSA-N 425.104 4.693 50 10 IJGE COc1ncc(C(=O)N(Cc2ccccc2)[C@@H](CBr)C(C)C)cc1Cl 2259093167 BNGUGPHFIUVPEK-KRWDZBQOSA-N 425.754 4.806 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@@H]2CCC[C@H](Br)[C@H]2C1 2264506381 IHGWPSMTAGMHHY-CIUDSAMLSA-N 427.589 4.800 50 10 IJGE COc1cc(NC=C(C#N)c2nc(-c3ccc4c(c3)OCO4)cs2)c(C)cc1[N+](=O)[O-] 2296056387 VEYWGKHKFHODIK-UHFFFAOYSA-N 436.449 4.741 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@H]1Cc1ccc(Cl)c(I)c1 2300267034 FGDRHODQSCGQMA-GBIKHYSHSA-N 429.523 4.676 50 10 IJGE Cl[C@H]1CCCN(Cc2ccc(I)c(Br)c2)CC1 2306219390 LMZKKJYAQMFWJY-NSHDSACASA-N 428.539 4.647 50 10 IJGE CN[C@@H](c1c(C)cc(Br)c(OC)c1Br)[C@@H]1C[C@H]1Br 2317422005 GPLJDFMKDYREMF-DNSOKLHBSA-N 441.989 4.573 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)C(C#N)=CNc1ccc(Br)cc1 2318462240 FCLGREAMHIERTK-UHFFFAOYSA-N 442.313 4.864 50 10 IJGE Clc1ccc(CN2C[C@H]3CC[C@H]2[C@@H](Br)C3)c(I)c1 2325461190 YFJBHMQAUZZASK-WFBYXXMGSA-N 440.550 4.692 50 10 IJGE N#CC(=C(O)CCN1C(=O)c2ccccc2C1=O)c1nc(-c2ccc(F)cc2F)cs1 2331286511 CBYLMMXWRNQENV-UHFFFAOYSA-N 437.427 4.567 50 10 IJGE CC(C)C[C@H](CBr)CN1CC[C@@H](C(F)(F)F)[C@@H](NC(=O)OC(C)(C)C)C1 2353835441 SKDJTDCMEXWBFF-KFWWJZLASA-N 445.364 4.821 50 10 IJGE CCCCCOc1ccc(C(=O)NNC(=O)c2ccccc2OCc2ccccc2)cc1 14030830 YXDOTNXRFVDBOE-UHFFFAOYSA-N 432.520 4.909 50 10 IJGE C[C@H](Cl)C(=O)Nc1ccc(N(C)C)c(CN(Cc2ccco2)C(=O)c2cccs2)c1 34921555 SQPWXBWMQMLYPH-HNNXBMFYSA-N 445.972 4.816 50 10 IJGE C=CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4C)ccc32)c1 40529784 IOBOWRKHKVUOQB-VWLOTQADSA-N 438.483 4.997 50 10 IJGE Cc1ccc(C)c(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2O)CCC3)c1 40826391 COOKRRMCKRCUIT-OVVQPSECSA-N 431.492 4.633 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N[C@H](C)c3ccc4c(c3)OCO4)c2C)cc1 97074822 AOYWSSWXWWLCJJ-CTPANLQCSA-N 443.503 4.616 50 10 IJGE CCOC(=O)COc1ccc(/C=C(/C#N)c2nc(-c3cccs3)cs2)cc1OC 102973274 XNMBNHGFDWZPPU-DHDCSXOGSA-N 426.519 4.886 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)c2cccc3ccccc23)c(OC)c1 207161387 VVJNORIQSRGGRV-HKWRFOASSA-N 428.488 4.891 50 10 IJGE CCOc1cc(/C=C2\C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1 214252644 GAXUACDHPHLEPJ-BKUYFWCQSA-N 430.504 4.665 50 10 IJGE O=C(COc1cccc2ccccc12)NN=Cc1ccc(OC(=O)c2cccs2)cc1 254297320 OGNNKJSRIMRERX-UHFFFAOYSA-N 430.485 4.650 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21 383294321 XBXXSJHBQHUUDL-CICLBPROSA-N 445.138 4.954 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CCl)[C@H](c2cc(I)ccc2F)C1 394695187 SLTGYLUNGZXWMP-GXFFZTMASA-N 439.696 4.620 50 10 IJGE CC[C@H](Br)CCCNC(=O)c1cc(Cl)ccc1I 398570613 PJVKGMBLKFGBCJ-VIFPVBQESA-N 444.538 4.628 50 10 IJGE ClCc1cc(Br)c(OCCOC[C@H]2CCCO2)c(Br)c1 693115139 GNFSBIZXNIBRCW-LLVKDONJSA-N 428.548 4.525 50 10 IJGE Cc1cc(C=NNC(=O)[C@H]2COc3ccccc3O2)c(C)n1-c1ccc(Cl)cc1Cl 725431633 WXCPMGCAIGKPLB-OAQYLSRUSA-N 444.318 4.691 50 10 IJGE CC[C@@H](C)c1ccc([C@H](NC(=O)NNC(=O)c2ccc(OC)cc2OC)C(C)C)cc1 730021029 GMOCITROQKTEGF-OPAMFIHVSA-N 427.545 4.559 50 10 IJGE CC(C)(C)OC(=O)Nc1ccccc1CCC(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 790487512 NSYOPRSBLKDVTB-UHFFFAOYSA-N 439.556 4.725 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(Cl)cc2)ccc1Oc1ccccc1[N+](=O)[O-] 1083956010 XCBMXSPJEKBRPZ-UHFFFAOYSA-N 425.828 4.813 50 10 IJGE Cc1ccc(-n2c(C)c(Br)c(C=NNC(=O)c3cccnc3)c2C)cc1C 1084076032 VXCHPLBRBDTXPB-UHFFFAOYSA-N 425.330 4.632 50 10 IJGE CC(=O)c1cccc(OCCCC(=O)NNc2c(Cl)cccc2Br)c1 1457900109 DRXMIIRUJPDJAT-UHFFFAOYSA-N 425.710 4.607 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)cc2)cc1 1463643076 PFVBLYZYBWPCCD-HNNXBMFYSA-N 448.544 4.943 50 10 IJGE C=CCNC(=O)c1ccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccccc3C)c2C)cc1 1527701044 RGYVFJREUVCGMO-KQWNVCNZSA-N 438.531 4.864 50 10 IJGE C=CCOc1ccc(/C=C\C(=O)NNc2ccc(Br)cc2CC)cc1OC 1631496833 VUGMTOZABQOUAI-XFFZJAGNSA-N 431.330 4.741 50 10 IJGE COc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2c(OC)ccc3ccccc23)cc1 1865688539 UOFLAAKUNPCKGR-XMMPIXPASA-N 438.487 4.569 50 10 IJGE CCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1cccc(OC)c1)C(C#N)=C(N)O2 1865711805 IIQJDZRDDZKBME-LJQANCHMSA-N 441.318 4.968 50 10 IJGE Cc1ccc(S(=O)(=O)NC/C(O)=C(\C#N)c2nc(-c3ccc(C)c(C)c3)cs2)cc1 1872755684 ZWFHVLQMDZTNDB-VZCXRCSSSA-N 439.562 4.507 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)C[C@H](C)Br)cc1Br 1914609206 FFRLISSVWLSVHG-ZDUSSCGKSA-N 441.163 4.884 50 10 IJGE Cc1nsc(Br)c1C(=O)N(CCCBr)Cc1ccccc1 1914627699 JEAWXHSJUXGNDM-UHFFFAOYSA-N 432.181 4.641 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1ccc(C)c2ncccc12 1915078414 PXEKISXZOLNMHP-GOSISDBHSA-N 447.398 4.908 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(Br)cn1 1915128789 ZOTWACIGVWSWJS-AWEZNQCLSA-N 426.152 4.660 50 10 IJGE CCCCOc1ccc(C(=O)N(C)C[C@@H](Br)COCc2ccccc2)cc1 1916354913 NIVWDNDQWPUXDJ-HXUWFJFHSA-N 434.374 4.918 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1ccc(Br)s1 1916369626 HYVLJYWQUIMFKA-ZDUSSCGKSA-N 447.192 4.563 50 10 IJGE CC[C@H]1CN(C(=O)c2csc(Br)c2Br)C[C@@H]1Br 1945187636 YOJHLHXJDVCKAP-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE Clc1nc(N2CC[C@H]3CN(Cc4ccccc4)C[C@H]3C2)sc1CBr 2003091802 ZSASBWVCFNRNOZ-GJZGRUSLSA-N 426.811 4.650 50 10 IJGE O=S(=O)(c1cc(CBr)ccc1Cl)N(Cc1ccccc1)CC(F)F 2009622808 VWDXXHUXGUAHQH-UHFFFAOYSA-N 438.721 4.691 50 10 IJGE CC1(C)OCCO[C@H]1[C@H](Br)c1sc(Br)cc1Br 2013734246 NGVZPHXZLKYIMJ-SCZZXKLOSA-N 449.002 4.903 50 10 IJGE FC1(F)C[C@]1(Br)COc1ccc(Br)c(CBr)c1 2023780418 UJANSDRBSICOCC-JTQLQIEISA-N 434.900 4.896 50 10 IJGE C[C@H](Br)CN(C(=O)c1c(Br)cccc1Br)C1CC1 2033089316 RQRVKMBYGBQHLZ-QMMMGPOBSA-N 439.973 4.600 50 10 IJGE Brc1ccc(Br)c(CN2C[C@@H](Br)[C@@H](C3CC3)C2)c1 2054716427 DEHDCUHFDCQANT-TZMCWYRMSA-N 438.001 4.817 50 10 IJGE C[C@@H](CCBr)CCN1CCCC[C@H]1C(F)(F)CNC(=O)OC(C)(C)C 2065451876 DSWSWUCTXXUITD-GJZGRUSLSA-N 427.374 4.812 50 10 IJGE CN(CC[C@@H](Br)c1ccccc1)c1ccc(I)cn1 2111804547 GHYMGQYVTNYQRK-CQSZACIVSA-N 431.115 4.649 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Cl)C2 2190670684 MJHQPIZVQCRSQU-ZDEQEGDKSA-N 425.523 4.534 50 10 IJGE C[C@@H]1[C@H](NC(=O)OC(C)(C)C)CC[C@@H](C(=O)N(C)CC2CC(Br)C2)C1(C)C 2196906453 DZNBBBUSGFIMGW-HPDBWDTBSA-N 445.442 4.584 50 10 IJGE Cc1sc(C(=O)N2CC[C@H](Br)C(F)(F)CC2)c(Br)c1C 2237631076 DQSDYUSQXMLYFY-VIFPVBQESA-N 431.140 4.762 50 10 IJGE Cc1sc(C(=O)N2CC[C@H](C(F)(F)CBr)C2)c(Br)c1C 2237633620 NZRYZVBQSKXVSH-VIFPVBQESA-N 431.140 4.620 50 10 IJGE C=CC[C@@]1(CCl)CCN(C(=O)c2csc(Br)c2Br)C1 2272179269 LWSVPMYRBBNUAY-ZDUSSCGKSA-N 427.589 4.920 50 10 IJGE Cc1cccc(C(=O)N(C[C@H](C)Br)C(C)(C)C)c1I 2272481013 YQWUIQZPZKQJDD-NSHDSACASA-N 438.147 4.624 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)CC[C@@H]1CBr 2285845704 DSNKRDHEGZBFLD-RKDXNWHRSA-N 427.539 4.735 50 10 IJGE Clc1ccc(CN2C[C@H](Br)CC23CCC3)cc1I 2315551099 MGUUNZRJEZYIRR-LLVKDONJSA-N 440.550 4.837 50 10 IJGE CCN(C(=O)c1ccc(Cl)cc1I)C(C)(C)CBr 2317768471 JPFBJFCVHFABJS-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE CC[C@H](Br)C(=O)N1CCC(CCC2CCN(C(=O)OC(C)(C)C)CC2)CC1 2361052514 IKWKWRGTYCVCBF-SFHVURJKSA-N 445.442 4.826 50 10 IJGE C=CCn1c(SCC(=O)C(C#N)=C2Nc3ccccc3N2)nnc1-c1ccc(Cl)cc1 21673299 XEKJICCYURAZFJ-UHFFFAOYSA-N 448.939 4.718 50 10 IJGE CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccc(OC)cc3)ccc21 38650434 UPCFKGHETSUEBI-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE Cc1cc(C)cc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2[N+](=O)[O-])c1 40583056 RRJSXEHIZGMDGE-UHFFFAOYSA-N 447.282 4.809 50 10 IJGE Cc1ccc(Cl)cc1Nc1ncnc(NNC(=O)c2ccc(Cl)cc2)c1[N+](=O)[O-] 40592829 PBUDXRFVUBVKBI-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE COc1ccc(/C=N/NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)cc1Br 40961274 JINRNUTXHYYBMW-JMKVTYIUSA-N 433.346 4.673 50 10 IJGE CCOc1ccc(NC(=O)/C(C#N)=C\c2c[nH]nc2-c2ccc(Br)cc2)cc1 98063484 DHISOKMUVKKBLC-PTNGSMBKSA-N 437.297 4.784 50 10 IJGE COc1ccccc1OCCCOc1c(C=NNC(=O)Nc2ccccc2)cccc1OC 254490087 FTAWARMMHBNTNN-UHFFFAOYSA-N 449.507 4.707 50 10 IJGE CC(=NNC(=O)COc1ccc(OCc2ccccc2)cc1)c1ccc(OC(F)F)cc1 254823530 MWDUEXGXRUJJPY-UHFFFAOYSA-N 440.446 4.786 50 10 IJGE O=[N+]([O-])c1ccc(C[C@H](Br)c2sccc2I)cc1 311225499 PMHSQJIAGOGTTM-JTQLQIEISA-N 438.084 4.940 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)cnc2n1Cc1ccn(Cc2ccccc2)n1 389615060 UQEXGMRKKXQOIB-CYBMUJFWSA-N 430.737 4.787 50 10 IJGE O=C(c1ccc(Cl)cc1Br)N1CCC(F)(F)[C@H](CBr)C1 403944871 DRIGRIUUUOIIDT-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE C[C@@H]1CCCN(C(=O)c2cc(Cl)ccc2I)[C@H]1CCCl 697192866 FFKMJRMLPNUXFM-YGRLFVJLSA-N 426.125 4.814 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2cccc(NC(=O)c3ccccc3)c2)c(C(F)(F)F)c1 799387338 JKOKVNBCBAJDGT-UHFFFAOYSA-N 439.397 4.978 50 10 IJGE O=C(COc1ccc(Br)cc1Cl)NN=Cc1cccc(Cl)c1Cl 1083941263 BXNNBOJWSLUKMV-UHFFFAOYSA-N 436.520 4.938 50 10 IJGE COc1ccc(NC(=O)NN=Cc2cc(C)n(-c3ccc(C(=O)O)c(Cl)c3)c2C)cc1 1084014064 BFRNHWSPBHIHDP-UHFFFAOYSA-N 440.887 4.610 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNC(=O)c1cc(-c2ccc(C)c(C)c2)[nH]n1 1153205912 VDCOKUZGWBVKTA-UVTDQMKNSA-N 443.334 4.865 50 10 IJGE O=C(/C=C/c1ccc(F)cc1)N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21 1860822428 DLXNNBKFAUPIBZ-KFBJJFSISA-N 433.870 4.560 50 10 IJGE CCc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699258 ORVYVDMYHUCUSY-JOCHJYFZSA-N 443.938 4.857 50 10 IJGE Cc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2ccc([N+](=O)[O-])cc2)cc1 1865713373 XMDGDMLBALFFBY-QFIPXVFZSA-N 449.470 4.974 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)COc3ccc(C)cc3C(C)(C)C)c(C)n2)cc1 1865757519 GWZXDXQEHPDFHN-UHFFFAOYSA-N 445.563 4.811 50 10 IJGE Cc1cc([C@H](CC(=O)N[C@H](C)C(=O)Nc2ccc(SC#N)cc2)C(C)C)ccc1F 1866758419 VYUBCPGQGNXGLZ-OXQOHEQNSA-N 427.545 4.980 50 10 IJGE COc1ccc(Br)cc1/C=N/NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 1873498464 OHNRYEWCPGSYAF-FSJBWODESA-N 426.314 4.582 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)Cc1ccc(Cl)cc1I 1892995664 RRZDXPUZKBHUCL-NSHDSACASA-N 430.113 4.619 50 10 IJGE CC[C@@H]1C[C@H]1CCO[C@](C)(CI)CN(CC)C(=O)OC(C)(C)C 1902803926 RUYMNUCLRFUJRS-IIDMSEBBSA-N 439.378 4.890 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)C1CC2(CCCO2)C1 1912574639 QZPWLQIECKSBGB-WMEQCIOUSA-N 449.126 4.621 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H]1Br)c1csc(Br)c1Br 1945189509 RYEOCAKRGNQBDK-XPUUQOCRSA-N 446.002 4.567 50 10 IJGE CC1([C@@H](CBr)NC(=O)c2scc(Br)c2Br)CC1 1945360144 FLQWZXKHGDJIFN-SSDOTTSWSA-N 446.002 4.567 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1cc(Br)sc1Br 2023037252 IUGWOKGGXDRCRD-POYBYMJQSA-N 448.018 4.813 50 10 IJGE O=C(NC[C@@H]1CC[C@H](Br)C1)c1cccc(Br)c1Br 2031487122 QSZGHBWVURWMEM-BDAKNGLRSA-N 439.973 4.505 50 10 IJGE O=C(NC1(CCBr)CCC1)c1c(Br)cccc1Br 2033092005 YAULFBNNXWQIGR-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE CN(C[C@H](Br)CCc1cc(Cl)ccc1I)C1CC1 2038113646 ZTPNITMBBLSBBE-LLVKDONJSA-N 442.566 4.735 50 10 IJGE O=C(CBr)c1c(C(F)(F)F)ccc(Br)c1OC(F)(F)F 2054797771 ITPLLCOUCWFYBH-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE CN(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C[C@H](CBr)c1ccccc1 2106786971 WRUSNVMEMAZHHS-OALUTQOASA-N 425.411 4.887 50 10 IJGE CC(C)[C@@H](CBr)CN(C1CC1)[C@@H](CCNC(=O)OC(C)(C)C)C(F)(F)F 2106788303 ONHRJESCGAKGGL-ZFWWWQNUSA-N 445.364 4.964 50 10 IJGE C[C@@H]1[C@@H](Br)C[C@H]2CC[C@H]1N2C(=O)c1cc(Br)c(Cl)s1 2115941798 DQGZTGUNNWKZFH-BDNRQGISSA-N 427.589 4.941 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 2163057294 AFUWIXNZVOOGJH-RNQOJCNYSA-N 437.422 4.885 50 10 IJGE C[C@@H](C(=O)N(C)CC1CC(Br)C1)[C@H](NC(=O)OC(C)(C)C)c1ccccc1 2196906617 HLBLTTPJGGXVQV-RYKRPPSOSA-N 439.394 4.520 50 10 IJGE Clc1cc(Br)ccc1CN1CCC(OCCCBr)CC1 2207533564 SZOMIIATKDJLFR-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@H]2C[C@H]1CC[C@H]2Br 2285843607 AXWAVDHVBBBKPY-NQMVMOMDSA-N 425.523 4.630 50 10 IJGE Cc1cc(-n2c(C)cc(C=C(C#N)C(=O)NCc3ccco3)c2C)ccc1Br 2293715975 CFFZVCSBIHTHKS-UHFFFAOYSA-N 438.325 4.981 50 10 IJGE C[C@H](CCCCBr)NC(=O)c1ccc(Cl)cc1I 2317770483 HGTJLOZKQZQNDW-SECBINFHSA-N 444.538 4.628 50 10 IJGE Cc1cccc(N2CCN(C=C(C#N)C(=O)N[C@H](C)C34CC5CC(CC(C5)C3)C4)CC2)c1C 2318467640 DZQHPNHIQJQZHB-JDVXYAFFSA-N 446.639 4.554 50 10 IJGE COC[C@H]1C[C@@H](Cc2ccc(I)c(Br)c2)[C@H](Cl)C1 2325204647 QOKMUTWKFDTFCA-DMDPSCGWSA-N 443.550 4.876 50 10 IJGE ClCc1cccc(OCc2ccc(I)c(Br)c2)n1 2325386534 MZDBFQULOFUVFV-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE C[C@@H]1CCC[C@H](CO[C@H](CI)c2ccccc2Br)O1 2338810472 QUUSRXBUEHVIDO-LALPHHSUSA-N 439.131 4.899 50 10 IJGE O=C(N[C@@H]1C[C@H](CBr)C12CCC2)c1scc(Br)c1Cl 2351615017 SIWUPVMKHGCGFY-VXNVDRBHSA-N 427.589 4.848 50 10 IJGE CC(C)C[C@@H](CBr)CN1C[C@H](CCNC(=O)C(F)(F)F)c2ccccc21 2382184206 IQQVIXMCFWAIAM-GJZGRUSLSA-N 435.328 4.716 50 10 IJGE CCCCOc1ccccc1/C=N/NC(=O)CSc1nnc(-c2ccccc2)s1 40947834 SOJPHOCUMYRLFT-HYARGMPZSA-N 426.567 4.626 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)CSc2ccc(C)cc2)c(OC)c1 40994495 MPABDJUMLYXQEA-CPNJWEJPSA-N 438.549 4.525 50 10 IJGE CCOc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4O)nc3c2)cc1Cl 169926482 JNGDUVZDWYYPBF-DHRITJCHSA-N 434.883 4.752 50 10 IJGE CCOc1cc(/C=C(/C#N)c2nc3ccccc3n2CC)ccc1OCC(=O)N(CC)CC 169940335 ZFWZYYFNOYDYGZ-HKWRFOASSA-N 446.551 4.766 50 10 IJGE C[C@H]1CN(C(=O)c2cc(Br)sc2Br)CC[C@H]1Br 235649294 VEAPBBUHMXVCCN-POYBYMJQSA-N 446.002 4.519 50 10 IJGE Cc1ccc(-n2c(SCC(=O)NN=Cc3ccc(F)cc3)nnc2-c2ccccc2)cc1 254620122 KTAGILKGNXVXTG-UHFFFAOYSA-N 445.523 4.624 50 10 IJGE Clc1cccc(N2CC[C@H](N3CCN(Cc4ccccc4)CC3)C2)c1CBr 312603352 FZLBHNOVGSEFPD-IBGZPJMESA-N 448.836 4.631 50 10 IJGE O=C(NNC(=O)[C@H](Sc1ccc(F)cc1F)c1ccccc1)c1cccc2cccnc12 729972331 WQXGABBBPNAUFP-JOCHJYFZSA-N 449.482 4.808 50 10 IJGE CCc1cccc(CC)c1NC(=O)/C(C#N)=C\c1ccc(OC)c2oc(C(=O)OC)cc12 748994101 FTROKHWLAVFPCJ-PDGQHHTCSA-N 432.476 4.898 50 10 IJGE CC[C@H]1CCCC1=NNC(=O)COc1c(C)cc(Br)cc1Br 1083994770 OBBZSPMYKYLWLU-NSHDSACASA-N 432.156 4.581 50 10 IJGE COc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)Nc3ccc(C)cc3C)c(C)c21 1772746017 NWGSUIRMCGBECL-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE CCCOc1ccc(/C=C/C(=O)N2CCC(C(=O)Nc3ccc(SC#N)cc3)CC2)cc1 1860600544 GTMVJBJMPKKUMQ-LFYBBSHMSA-N 449.576 4.939 50 10 IJGE Cc1nc(C(=O)N(Cc2ccccc2)C[C@@H](C)Br)c(Br)s1 1956719183 GVAQSZUZYAFOGU-SNVBAGLBSA-N 432.181 4.640 50 10 IJGE CCC[C@@H](CBr)CNC(=O)c1csc(Br)c1Br 2008109181 QVMLPHCBSAHXRE-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE C[C@@]1(NC(=O)c2cc(Br)sc2Br)CCC[C@@H]1Br 2011553900 AMZDSRUOCYZBBX-WRWORJQWSA-N 446.002 4.709 50 10 IJGE CC[C@H](C[C@H](C)Br)NC(=O)c1cccc(Br)c1Br 2031478972 UUQPBYDPJBXGJL-DTWKUNHWSA-N 441.989 4.894 50 10 IJGE C[C@@H](CCBr)CCN1CCN(C(=O)OC(C)(C)C)CC[C@H]1C(F)(F)F 2044701992 XRYHYCRGLZZVPK-KBPBESRZSA-N 431.337 4.671 50 10 IJGE BrC[C@@H]1[C@H]2CCN(Cc3cc(Br)ccc3Br)C[C@H]21 2054718412 NDKWZRDQNVXNBM-JHJVBQTASA-N 438.001 4.674 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C[C@H](CBr)c2ccccc2)C(C)(C)C1 2106784102 FZUZPMZSEJVPOJ-ROUUACIJSA-N 425.411 4.933 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C(F)(F)F)N(C[C@@H](CBr)CC2CC2)CC1 2112870430 CPHQKSGINMRYQL-CABCVRRESA-N 443.348 4.671 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1ccc(F)c(Br)c1 2117892894 GHROKYJJSJJPNF-SNVBAGLBSA-N 442.110 4.702 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)C2CCC2)C[C@@H]1CC(F)(F)F 2119514974 MXRNDGGGSFXHMR-GJZGRUSLSA-N 443.348 4.671 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@H](CBr)c2ccccc2)CC2(CCC2)C1 2163061718 HSXNGTTVVQKQBQ-MOPGFXCFSA-N 437.422 4.934 50 10 IJGE CCc1nc(Br)c(Br)n1CC1(c2nc(CCl)cs2)CC1 2166304990 CHSLWQZPNGWHAY-UHFFFAOYSA-N 439.604 4.898 50 10 IJGE Cn1nc([C@H](Br)c2ccc([C@@H]3CCOC3)s2)c(Br)c1Cl 2240422638 XAHOGNIXSJDURH-GMSGAONNSA-N 440.588 4.886 50 10 IJGE CC(C)C(O[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1)C(C)C 2244285904 NLRXRXMCVWFJGM-GOSISDBHSA-N 439.378 4.888 50 10 IJGE Fc1cccc([C@H](CI)O[C@H]2CCN(Cc3ccccc3)C2)c1 2244768828 CVDBIPRHEZHKJQ-OALUTQOASA-N 425.285 4.593 50 10 IJGE CCN[C@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@@H]1Br 2260006479 SPCQWMZLVIHLAO-WPOIXZHQSA-N 447.943 4.924 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@H]2CC[C@@]1(CBr)C2 2285957747 JECCKTANPFBART-RTHLEPHNSA-N 425.523 4.631 50 10 IJGE Clc1ccc(COc2ccc(CBr)cn2)c(I)c1 2317812026 OKQZLBJDSRHRIS-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE Clc1ccc(CN2CCCC[C@H](CBr)C2)c(I)c1 2318525656 BBIPWBYCNVEYAH-LLVKDONJSA-N 442.566 4.942 50 10 IJGE COc1ccc(C(C#N)=Cc2ccc(OC(=O)c3ccc4c(c3)OCO4)cc2)cc1OC 2320507343 QTYCGDXLXOUVCL-UHFFFAOYSA-N 429.428 4.716 50 10 IJGE CCOc1cc(C=NNC(=O)Nc2ccc(Cl)cc2)cc(Br)c1OC 2323872899 OEBXSLBESJKKGR-UHFFFAOYSA-N 426.698 4.665 50 10 IJGE CC1(C)COC[C@]1(CCl)Cc1ccc(I)c(Br)c1 2325222084 QFQIXZJAWYTIIF-CQSZACIVSA-N 443.550 4.878 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@@H](Br)C2(CC2)C1 2327406670 VMJAQPDTODNBDR-CYBMUJFWSA-N 440.550 4.694 50 10 IJGE COc1ccccc1-c1csc(C(C#N)=C(O)CCCN2C(=O)c3ccccc3C2=O)n1 2331282051 XTSRHWNAOYCVKL-UHFFFAOYSA-N 445.500 4.688 50 10 IJGE COc1ccccc1CC(O)=C(C#N)c1nc(-c2ccc(OC)c(OC)c2OC)cs1 2331411914 QEDFIJLRDYWJAT-UHFFFAOYSA-N 438.505 4.880 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CCCC[C@@]3(NC(=O)OC(C)(C)C)C2)C1 2345010089 JKZVVCRQWXTMAL-IIBYNOLFSA-N 429.443 4.957 50 10 IJGE CN(Cc1sccc1Br)c1c(CBr)c(C(F)F)nn1C 2365277688 FCXPAXSMZGZXBU-UHFFFAOYSA-N 429.128 4.713 50 10 IJGE Cc1scc(C(=O)NC[C@]2(CBr)C[C@H]2C(F)(F)F)c1Br 2369609016 URXLQGWMEIUWQS-LDYMZIIASA-N 435.103 4.512 50 10 IJGE CCN(CC)c1ccc(/C=N/NC(=O)COc2ccc(C(C)C)cc2Br)cc1 5947236 XCSHJSFFACMJQH-ZVHZXABRSA-N 446.389 4.948 50 10 IJGE CC(C)COc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(-c3ccccc3)cc2)cc1 14038805 DMVASSKKUXFSEC-LJQANCHMSA-N 432.520 4.617 50 10 IJGE CCN(c1ncnc(NNC(=O)c2ccccc2C)c1[N+](=O)[O-])c1cccc2ccccc12 40589260 LDLZRFGZTHAUND-UHFFFAOYSA-N 442.479 4.761 50 10 IJGE CCOC(=O)c1oc2c(c1C)/C(=N/NC(=O)C(c1ccccc1)c1ccccc1)CCC2 40815604 FLUTUVWEWKQXLX-NHFJDJAPSA-N 430.504 4.753 50 10 IJGE CCCCCCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc3c(c2)OCCO3)cc1OC 40841262 OPMAHMXOPDAUIM-XMHGGMMESA-N 436.508 4.971 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc(C)cc2)cc([N+](=O)[O-])c1OCc1cc(C)ccc1C 169885822 NTWFPINMGIXYON-WGARJPEWSA-N 447.491 4.872 50 10 IJGE ClCc1nc2ccc(Br)cc2n1C[C@H]1CN(Cc2ccccc2)CCCO1 390647463 UOLKJJQMOZWDPF-GOSISDBHSA-N 448.792 4.829 50 10 IJGE FC(F)(F)c1cc(I)c(CBr)cc1Br 575692658 YCAHGOKUJIDPMG-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE FC(F)(F)c1c(I)ccc(Br)c1CBr 575694527 HCXOEDWTROSYGM-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE COc1ccccc1[C@@H](NC(=O)NNC(=O)c1ccc(C(C)(C)C)cc1)c1ccccc1 731119216 ZMGTVJYYCOPLJA-QHCPKHFHSA-N 431.536 4.726 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)c(-c2ccccc2)n1 817222877 BCCFBGRWNAXOII-DSCCOOJJSA-N 439.494 4.572 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NCc2ccc3ccccc3c2)c(-c2ccccc2)n1 914482584 GHPAAZGZLGEMRW-JLPGSUDCSA-N 431.499 4.840 50 10 IJGE CC(C)c1ccc([C@H](NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2cccs2)cc1 916207504 FLRDNZQPCYSRCR-FQEVSTJZSA-N 438.509 4.513 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)Nc2ccc(F)cc2)ccc1OCc1cccc(C(=O)O)c1 1084562631 SRKOXQSLMYRPPN-YBFXNURJSA-N 446.434 4.657 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1 1142560156 XNESJFDESUMRMX-DHZHZOJOSA-N 446.256 4.946 50 10 IJGE C#C[C@H]1CCCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1 1643854231 JYUHHIVAJVCTGH-HRVJUDJTSA-N 425.454 4.892 50 10 IJGE CCCCCCOc1ccc(C=NNC(=O)COc2ccccc2Br)cc1 1772753786 ITNDPIBLQQFVNG-UHFFFAOYSA-N 433.346 4.937 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccc(Cl)cc2)[C@@H]1c1ccccn1 1865700094 KXXSRYBBVYNRFP-FQEVSTJZSA-N 425.879 4.806 50 10 IJGE COc1ccc(/C(C)=N/NC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)cc1OC 1865763224 AZTVDLAJDYNSRL-UVHMKAGCSA-N 425.435 4.506 50 10 IJGE O=C(Nc1c(Br)cc(Br)cc1Br)C(Cl)Cl 1865988126 AWGKVDQQIJWARJ-UHFFFAOYSA-N 440.744 4.716 50 10 IJGE COc1ccccc1-c1csc(/C(C#N)=C(\O)CNC(=O)c2ccc(Cl)cc2)n1 1872747245 UOSRPZIFJWQNGN-VLGSPTGOSA-N 425.897 4.695 50 10 IJGE Cc1cc(F)cc(C)c1S(=O)(=O)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915171710 GRKKCXZXFSGMMV-IBGZPJMESA-N 440.378 4.807 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@H]2CC[C@H]3CC[C@H]2C3)CC1 1947123003 HEGKHKYJVNIWRZ-PMPSAXMXSA-N 449.373 4.786 50 10 IJGE CCC[C@@H](CBr)CN(Cc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 1953585895 YZNBLULNFWEWFU-SFHVURJKSA-N 425.411 4.919 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@@H]1CCCN(C[C@@H](CBr)C2CC2)C1 1966339756 SWKPNBWNWFVFSJ-GUDVDZBRSA-N 429.443 4.909 50 10 IJGE CCC[C@@H]1C[C@@H]1CO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1993097193 OEIWAAXXSZAOAK-IIDMSEBBSA-N 437.362 4.644 50 10 IJGE O=C(N[C@H]1C[C@H](CCBr)C1)c1scc(Br)c1Br 2021791129 FJOSNZIRNOBJNN-LJGSYFOKSA-N 446.002 4.567 50 10 IJGE O=C(NCC[C@H](Br)C1CC1)c1ccc(Br)cc1Br 2029910949 FBWUPDFVGSBMPI-NSHDSACASA-N 439.973 4.505 50 10 IJGE CCCOCCCO[C@@H](CI)c1ccccc1Br 2031755284 SQFWRUGPQMOPCC-AWEZNQCLSA-N 427.120 4.759 50 10 IJGE C[C@](CCl)(NC(=O)c1cc(Br)c(Br)s1)C(F)(F)F 2043176412 KMXYQYTTZRMDHO-MRVPVSSYSA-N 429.483 4.563 50 10 IJGE C[C@H](N(Cc1ccccc1)S(=O)(=O)c1ccc(CBr)cn1)C(C)(C)C 2059276489 COIUKBMELLCCPQ-HNNXBMFYSA-N 425.392 4.602 50 10 IJGE COc1cc(F)cc(Cn2nc(CBr)c(Br)c2C(F)(F)F)c1 2079230493 PUDBFMKYPRXIAO-UHFFFAOYSA-N 446.036 4.755 50 10 IJGE C[C@@H]1CCc2nn(Cc3cc(F)ccc3I)c(CBr)c21 2080646207 CPJOFRNKGRLECV-SECBINFHSA-N 449.105 4.620 50 10 IJGE CC[C@@H]1CCOC[C@@H]1O[C@@H](CI)c1ccc(Br)cc1 2096206486 IHWRSSDSJJDEMW-UGFHNGPFSA-N 439.131 4.757 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1cc(F)cc(Br)c1 2117894140 KBBPOLVMZCTZRI-JTQLQIEISA-N 442.110 4.702 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1cc(F)cc(Br)c1 2117894142 KBBPOLVMZCTZRI-SNVBAGLBSA-N 442.110 4.702 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@H](Br)c2cc(Cl)c(Br)s2)C1 2137224444 BGFAHVSJLXOYHU-HNBZJPLGSA-N 448.629 4.815 50 10 IJGE ClCCc1nc2cncc(Br)c2n1C[C@@H]1CCCN(Cc2ccccc2)C1 2151785774 YYAZBYCPUNRREI-QGZVFWFLSA-N 447.808 4.887 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2C1[C@H]2C[C@H]1CN(Cc1ccccc1)C2 2153122429 HZKZSJZDFTVZDG-HOTGVXAUSA-N 445.792 4.934 50 10 IJGE CC(C)(C)[C@@H]1C[C@@H](CCl)CN(C(=O)c2sccc2I)C1 2165006881 IOEPOSPCNLXFDG-WDEREUQCSA-N 425.763 4.716 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(CCCCCI)C2(CCC2)C1 2211191677 RLTHFAHSUCCFGP-HNNXBMFYSA-N 436.378 4.504 50 10 IJGE CC(C)(C)C[C@@H](CBr)NC(=O)Cc1ccc(Br)cc1Cl 2237441211 PNPRJHYRCMYWEO-LBPRGKRZSA-N 425.592 4.961 50 10 IJGE Cc1cc(N(C)Cc2cccc(I)c2)ncc1CBr 2265545921 MDXAAUBZKRJFHF-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE C[C@]12CO[C@](CO[C@@H](CI)c3ccc(Br)cc3)(C1)C2 2266256606 MSEKLLLQUDNGGC-SOUVJXGZSA-N 437.115 4.511 50 10 IJGE CC(C)[C@H](Cl)[C@@H](C)NCc1ccc(I)c(Br)c1 2306224459 QFXXURWHGCILEL-RNCFNFMXSA-N 430.555 4.795 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@](C)(CBr)C(C)(C)C)C[C@@H]1C(F)(F)F 2352091615 OJUDENYMBFBDCN-OGHNNQOOSA-N 445.364 4.821 50 10 IJGE COc1cc(/C=C(/C#N)c2ccccc2OC)ccc1OC(=O)c1ccc([N+](=O)[O-])cc1 31902009 DXVGMXSZMAQGPR-AQTBWJFISA-N 430.416 4.895 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)COc3ccccc3)ccc2[C@H]1c1ccc(Cl)cc1 38651305 POZKWCHGQBJPFZ-HSZRJFAPSA-N 432.863 4.543 50 10 IJGE COc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4ccccc4C)c(C)c32)c1 40822371 ZBPCPGVJCFZRAJ-NHFJDJAPSA-N 431.492 4.628 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1cc(Br)c(Br)s1 125646863 ICUKKXPKBVJZTG-UHFFFAOYSA-N 446.002 4.519 50 10 IJGE Cc1ccccc1-n1nc(C)c2c(C(=O)NN=Cc3ccccc3)cc(-c3ccncc3)nc21 254396077 HYGJMCHZOPXXMG-UHFFFAOYSA-N 446.514 4.863 50 10 IJGE CC[C@H](C[C@@H](C)Cl)NC(=O)c1cc(Br)ccc1I 716924903 LRXBJTDFUKLOBX-PSASIEDQSA-N 444.538 4.580 50 10 IJGE Cc1cccc([C@@H](C)NC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)c1C 734691598 DNZUARICMAYYOM-GOSISDBHSA-N 435.499 4.727 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(-c3ccccc3)cc(Cl)c2O)c1C 769117098 MWBLWMKMQVLMQJ-UHFFFAOYSA-N 445.910 4.938 50 10 IJGE CCCc1ccc(-c2ccc(NC(=O)C(=O)NNc3ccc(C(F)(F)F)cn3)cc2)cc1 773666840 SQJCXAQVHDHZRO-UHFFFAOYSA-N 442.441 4.802 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1 1270896418 CZCLWFMADLAXPT-UCQJPZFISA-N 427.715 4.665 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)NCc2cnc(O)c3ccccc23)c1C 1471924035 XOZGKVREOSAJOV-FYJGNVAPSA-N 436.515 4.880 50 10 IJGE C=CCNC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(F)cc2)c1C 1523430747 SROONFZZTTZIEZ-HMMYKYKNSA-N 442.494 4.695 50 10 IJGE Cc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)Nc3ccc(F)cc3F)c(C)c21 1772743439 ALECMWMWNWLSSX-UHFFFAOYSA-N 437.446 4.897 50 10 IJGE Cc1ccccc1NC(=O)COc1cccnc1NC(=O)Nc1ccc(SC#N)cc1 1858831895 IOIUQPFCTIERSG-UHFFFAOYSA-N 433.493 4.625 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2cc(C)ccc2C)cc1 1865694875 DOJYCMFRVOWQRQ-QHCPKHFHSA-N 428.536 4.728 50 10 IJGE CCc1nn(Cc2ccc(C)cc2)c2c1[C@@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 1865714598 MWZPZFZOQLLPNS-FQEVSTJZSA-N 449.352 4.783 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](NC(=O)[C@H]2C[C@@H]2c2ccccc2)c2ccccc2)cc1 1867051716 FFRHISWFNFRRMI-XPWALMASSA-N 427.529 4.859 50 10 IJGE N#C/C(=C(/O)[C@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2ccc(F)c(F)c2)cs1 1872751512 LLVFXWQXWDQFFD-UDWOFDDZSA-N 437.471 4.930 50 10 IJGE Cc1nc(N(Cc2ccccc2)[C@@H](CBr)C2CC2)ncc1Br 1915193795 QUKWGRCAFKEFER-INIZCTEOSA-N 425.168 4.728 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1Cc1cccc(Br)c1Br 1943880964 MFTQJWBARYDQTP-MWLCHTKSSA-N 425.990 4.959 50 10 IJGE C[C@H]1C[C@@H](Br)CN(C(=O)c2csc(Br)c2Br)C1 1945186977 PAQXOWJQYRCRBC-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE CC1(C)CN(Cc2c(Br)cccc2Br)C[C@@H]1Br 1945332349 BMADOMXAFRQARA-LBPRGKRZSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(I)c(CCBr)c1 1951614509 OCQIBXBNYDHFBE-UHFFFAOYSA-N 426.092 4.576 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCCC[C@H](Br)C1 2003417528 OVFZVVXLIQTBBR-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE ClC[C@@H]1CCCC[C@@H]1Nc1ncc(I)cc1Br 2015756819 LDUDJUXEPOTEPJ-KWQFWETISA-N 429.527 4.658 50 10 IJGE Cl[C@H]1CCCCC[C@@H]1Nc1ncc(I)cc1Br 2015757140 PCSAHTVZDXFZLU-QWRGUYRKSA-N 429.527 4.801 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC2CC3(CCCC3)C2)C1 2017965274 HYZLKEQTUMJLMC-IBGZPJMESA-N 449.373 4.931 50 10 IJGE O=C(NC1(CCCBr)CC1)c1ccc(Br)cc1Br 2029621946 OSUZCYIBJNDDIY-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE O=C(NC[C@@H]1CC[C@@H](Br)C1)c1cccc(Br)c1Br 2031487125 QSZGHBWVURWMEM-RKDXNWHRSA-N 439.973 4.505 50 10 IJGE C[C@H]1Cc2cc([C@@H](Br)c3cc(I)sn3)ccc2O1 2056486980 GVZYXSKDALDZON-WPPNPWJKSA-N 436.112 4.555 50 10 IJGE CC(C)[C@@H](Br)c1cn(-c2cc(I)ccc2Cl)nn1 2057430354 ZNCQZSCEUCRYRT-GFCCVEGCSA-N 440.510 4.617 50 10 IJGE C[C@@H](CCCCCBr)NC(=O)c1cccc(F)c1I 2117888119 SMHVRLPGMATNAY-JTQLQIEISA-N 442.110 4.504 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(CBr)cc2)[C@@H]2CCCC[C@@H]21 2162912293 TZLDJPHXSZRHQS-MSOLQXFVSA-N 437.378 4.586 50 10 IJGE CC(C)(C)OC(=O)N1CC2(CCCC[C@]23CC[C@@](C)(CI)O3)C1 2211826476 SYLXDBAQHKRGOQ-WMZOPIPTSA-N 435.346 4.540 50 10 IJGE O=[N+]([O-])c1ccc(CBr)c(N2[C@H]3CCC[C@@H]2CN(Cc2ccccc2)C3)c1 2234690396 PZXCZTQVHAERBJ-BGYRXZFFSA-N 430.346 4.733 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc(NC(=O)N2CCC(Br)CC2)cc1Cl 2266917706 PVCSNMKIJWRTMZ-UHFFFAOYSA-N 446.773 4.756 50 10 IJGE COc1ccc([C@H](Br)C2CC3(CCOC3)C2)cc1I 2269555066 ZNPZNJXJSZEGSC-WPBUFGDCSA-N 437.115 4.553 50 10 IJGE Brc1cccc([C@@H](CI)OC2(C3CCC3)COC2)c1 2272930524 PVYDDUOFIMPBQG-CQSZACIVSA-N 437.115 4.511 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H]3CC[C@@H](CN3CCCCCCCBr)[C@H]2C1 2277441003 YQJOFXHAKIPRII-RDGPPVDQSA-N 429.443 4.909 50 10 IJGE CCN(C[C@](C)(CBr)OCc1cc(OC)cc(OC)c1)C(=O)OC(C)(C)C 2283529148 OCLZOVLWZWZRQH-FQEVSTJZSA-N 446.382 4.631 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@H](Cc2ccc(C)c(C)c2)C(=O)N1c1ccc(C)c(C)c1 2314592758 BDFNCEUHSILGCK-HSZRJFAPSA-N 445.588 4.649 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2ccc(C(=O)OC3CCCCC3)cc2)cc1OC 2329703035 WZZSZLGICNCSIY-UHFFFAOYSA-N 434.492 4.739 50 10 IJGE N#CC(=Cc1cc2c(cc1[N+](=O)[O-])OCCO2)c1nc(-c2ccc(F)c(F)c2)cs1 2331464052 UJXNCUMAWUNCNW-UHFFFAOYSA-N 427.388 4.832 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)[C@@]1(C(=O)O)CCC(C)(C)C[C@@H]1OCc1ccccc1 2379102706 QPUWQBALYRUTLC-OZIGNCPNSA-N 438.406 4.711 50 10 IJGE CC(C)C[C@H](CBr)CN1CCC[C@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2382173609 FQWHVPVIHOLZAR-CVEARBPZSA-N 443.430 4.993 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3[N+](=O)[O-])ccc2[C@H]1c1cccc(Cl)c1 38651183 QRECVAYWJGJAIG-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE Cc1c(C(=O)N2CCCc3ccccc32)oc2c1/C(=N/NC(=O)c1ccccc1F)CCC2 40812437 STFSZWZCKPKXMC-VFCFBJKWSA-N 445.494 4.791 50 10 IJGE COc1cc(/C=N/NC(=O)COc2cccc(Cl)c2)ccc1OCc1ccc(C)cc1 40911161 PNPDYMYCLIZNFI-VULFUBBASA-N 438.911 4.765 50 10 IJGE O=C(Nc1ccccc1C(=O)N/N=C/c1ccccc1F)c1ccc(Br)cc1 72231288 OFCODPMAIOFOKU-ZMOGYAJESA-N 440.272 4.604 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Cl)c3cc(F)ccc3Br)cc2[nH]1 109883742 LMXSMBFZEKLJTP-ZDUSSCGKSA-N 434.490 4.849 50 10 IJGE CCCCOCCO[C@@H](CI)c1ccc(Br)cc1 162119020 SWZOERUPLQHEFE-AWEZNQCLSA-N 427.120 4.759 50 10 IJGE CCCOc1c(OC)cc(/C=N/NC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)cc1[N+](=O)[O-] 169889311 AACRTWSRDCKDMW-RCVWNDJPSA-N 443.544 4.839 50 10 IJGE CCOc1cc(/C=N\NC(=O)Cc2ccc(OC)cc2)ccc1OCc1ccccc1F 169901142 JQHCCMXLDWVTOT-YUMHPJSZSA-N 436.483 4.505 50 10 IJGE C[C@@H]1CCC[C@@H](OC2(CI)CCN(C(=O)OC(C)(C)C)CC2)C1 231314440 LSGDJJZKFHUSNX-HUUCEWRRSA-N 437.362 4.786 50 10 IJGE CC[C@H](CCBr)CNC(=O)c1cc(Br)sc1Br 234004720 WHTGXKMFZZUZOM-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE O=C(NN=Cc1c(Cl)cccc1Cl)/C(=C\c1ccccc1)NC(=O)c1ccccc1 252588392 ABWWNTYHQDSKEH-GGASWYGPSA-N 438.314 4.915 50 10 IJGE C=CCn1c(SCC(=O)NNc2ccc(F)cc2)nnc1-c1ccc2ccccc2c1 253573752 RUERWORSBLXRIO-UHFFFAOYSA-N 433.512 4.659 50 10 IJGE C[C@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1cc(CCl)oc1Br 385374329 SLQUJOKZJBYVSZ-GFCCVEGCSA-N 432.767 4.770 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1C(=O)c1cc(Br)ccc1Br 399441777 WJLFPDPZQYAKDE-SCZZXKLOSA-N 439.973 4.600 50 10 IJGE FC(F)Oc1cc(Br)c(I)cc1CBr 575682658 XNPSRWXXKDHKOS-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1[C@H]1CN(Cc2ccccc2)C[C@H]1CI 725418562 QICHPAZBIHGYDP-APWZRJJASA-N 436.293 4.554 50 10 IJGE COc1ccc(CC(=O)NN=Cc2ccc(-c3cc(Cl)cc(Cl)c3)o2)cc1OC 1084561300 AINHKSOJRJJDNE-UHFFFAOYSA-N 433.291 4.963 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)/C(C#N)=C\c2cc(C)n(C3CCCCC3)c2C)c1 1154050662 TUFSTNUYUXPHPK-QNGOZBTKSA-N 445.592 4.516 50 10 IJGE Cc1cc(C(=O)NNc2nc3ccccc3[nH]c2=S)nn1-c1ccc(Cl)cc1Cl 1167430724 PFNKJRHLAHNFIR-UHFFFAOYSA-N 445.335 4.850 50 10 IJGE Cc1cccc(C(=O)NN=C2CCCc3oc(C(=O)N4CCc5ccccc5C4)c(C)c32)c1 1772745379 ZMSWKOFHWPOABI-UHFFFAOYSA-N 441.531 4.565 50 10 IJGE COc1ccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4ccc(C)cc4)c(C)c32)cc1 1772746712 YXGUPPQVOPRZMB-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CC(C)C)cc1 1865709064 MSQBYSGYKMILAZ-JOCHJYFZSA-N 428.536 4.995 50 10 IJGE COc1cc2sc(NC(=O)/C(C#N)=C/c3ccc(OC)c(OC)c3)nc2cc1Cl 1866133031 KTVYYBGGAIFTDU-WUXMJOGZSA-N 429.885 4.521 50 10 IJGE CC(C)[C@@H]1C[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)CN1Cc1ccccc1 1880755937 RJWDDVIDVRYIPQ-FHWLQOOXSA-N 425.411 4.821 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1ccc(Br)cn1 1915112251 ZOOOOUJEZPNVCA-CYBMUJFWSA-N 426.152 4.660 50 10 IJGE CCc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@H](CBr)C2CC2)s1 1915167790 XVDKUJABCCRBRF-QGZVFWFLSA-N 428.417 4.675 50 10 IJGE CC(C)(CCBr)NC(=O)c1csc(Br)c1Br 1937737100 DGUVFXKYCDDXQD-UHFFFAOYSA-N 433.991 4.567 50 10 IJGE CC[C@@H](C)[C@H](Br)CNC(=O)c1cc(Br)cc(Br)c1 2029977043 ILGDGQZSEBOVDJ-PRHODGIISA-N 441.989 4.751 50 10 IJGE O=C(N[C@H]1CCC[C@@H](Br)C1)c1c(Br)cccc1Br 2033089436 SWMKAIUGCXEBON-BDAKNGLRSA-N 439.973 4.648 50 10 IJGE FC(F)(F)c1cc(Br)cc(-n2nc(CBr)c3c2C[C@H]2C[C@H]32)n1 2080742929 WZIFRFNZSCOREU-SVRRBLITSA-N 437.057 4.603 50 10 IJGE O=S1(=O)CCC[C@H]([C@@H](Br)c2cc(Cl)c(Br)cc2F)C1 2089859817 FJZAWZQZFSIFEE-JVXZTZIISA-N 434.552 4.502 50 10 IJGE Cn1ncc(COc2c(Br)cc(CCl)cc2Br)c1Cl 2111944075 FCXWCMSRYWOVBS-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE CCN(C[C@](C)(CBr)OCCCN1CCCCCC1)C(=O)OC(C)(C)C 2119265416 XDQPSRFVZRCTHI-FQEVSTJZSA-N 435.447 4.680 50 10 IJGE C[C@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(CBr)c1F 2123269341 IGVCGPLGLRRYFG-CYBMUJFWSA-N 444.341 4.849 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](N(C(=O)c2ccc(CBr)cc2)C2CC2)C1 2162875356 BKNNEKHVVNRKAY-GOSISDBHSA-N 437.378 4.586 50 10 IJGE Brc1cccc([C@H](CI)OC2CC(n3ccnc3)C2)c1 2183689874 WHQWPWXATVDYFS-NRXISQOPSA-N 447.114 4.542 50 10 IJGE COc1ccc([C@@H](Cl)c2cc(Br)sn2)cc1I 2248881713 ANHTYYGNDCUGTF-LLVKDONJSA-N 444.519 4.847 50 10 IJGE CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)C21CC[C@@](C)(CI)O1 2249320884 VCNYSHGQBLHFEA-PWCTWUGBSA-N 449.373 4.833 50 10 IJGE Cc1c(Cl)cc(CN2CCOC(C)(C)[C@H]2CBr)cc1Br 2282820854 WKXYGQBGSKGBBX-CQSZACIVSA-N 425.592 4.785 50 10 IJGE O=S1(=O)CC[C@@H]([C@@H](Cl)c2cc(Br)ccc2OCc2ccccc2)C1 2299504319 MHRHHYCYUGFZEQ-RDTXWAMCSA-N 429.763 4.743 50 10 IJGE C[C@]1(CBr)CCCN1Cc1ccc(Cl)c(I)c1 2300241590 ACHRMZKZAZATKT-CYBMUJFWSA-N 428.539 4.694 50 10 IJGE CCO[C@@H]1[C@@H](Br)C[C@H]1Oc1cc(Br)cc(Br)c1 2301115262 OJKRTZOZDJPANW-QJPTWQEYSA-N 428.946 4.531 50 10 IJGE C[C@H]1CCN(Cc2ccc(I)c(Br)c2)C[C@@H]1Cl 2306231478 JYRCJKVSHHZTQV-CABZTGNLSA-N 428.539 4.503 50 10 IJGE CCCOc1ccc(C=C(C#N)C(=O)Nc2cc(OC)c(C(=O)OCC)cc2Cl)cc1 2314792726 DINLMSLFANTQEK-UHFFFAOYSA-N 442.899 4.860 50 10 IJGE C[C@@H](c1ccncc1Br)[C@H](Br)c1c(Br)ncn1C 2315592688 ZSCSVCGUWHCARN-XVKPBYJWSA-N 437.961 4.580 50 10 IJGE Cl[C@H]1CCC[C@H]1CCNCc1ccc(I)c(Br)c1 2325217189 BMCDYVQJUUNUON-AAEUAGOBSA-N 442.566 4.941 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](CC(F)F)C1 2328522772 JRNYLDOTRIJLSY-GJZGRUSLSA-N 427.374 4.620 50 10 IJGE C[C@@H](Cl)C[C@H]1CCCCN1C(=O)c1ccc(Cl)cc1I 2365589206 SKXPBLDKSISDDU-ZYHUDNBSSA-N 426.125 4.957 50 10 IJGE O=C(COc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2Cl)cc1)Nc1ccccc1 28215386 MOASTNRHQITOMJ-DHRITJCHSA-N 442.302 4.775 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccncc2)CCC3)cc1Cl 40813973 AHVJPKFGWNYCNE-OVVQPSECSA-N 436.899 4.668 50 10 IJGE Cc1c(C(=O)Nc2cccc3ccccc23)oc2c1/C(=N/NC(=O)c1ccccn1)CCC2 40814300 SROTVUJDALIRGT-ZTKZIYFRSA-N 438.487 4.859 50 10 IJGE C=CCc1cc(/C=C(\C#N)c2ccc(Br)cc2)cc(OC)c1OCC(=O)O 59301848 ODAZCZWBERQPKX-LICLKQGHSA-N 428.282 4.714 50 10 IJGE C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC/C2=N\NC(=O)c1ccc([N+](=O)[O-])cc1 59502063 KEQULFQWPVKPAT-KWTNDFLNSA-N 433.508 4.943 50 10 IJGE COc1ccc([C@@H](C)NC(=O)/C(C#N)=C\NC(c2ccccc2)c2ccccc2)cc1OC 217171192 REVBFFCHQQZQCW-UPHPNCSHSA-N 441.531 4.668 50 10 IJGE O=S(=O)(Nc1ccc(Br)c(Cl)c1)c1ccc(CBr)cc1 232180747 CHWSBVKZUMOHNW-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE CC[C@H]1CN(C(=O)c2cc(Br)c(Br)s2)C[C@H]1Br 399999729 MHANCYXZBKSAKX-POYBYMJQSA-N 446.002 4.519 50 10 IJGE C[C@](CI)(OCCOC1CCC1)c1ccccc1Br 400686224 XHSSDPPEAHHMLE-OAHLLOKOSA-N 439.131 4.685 50 10 IJGE Cc1cc(C=NNC(=O)C(=O)Nc2ccc(F)cc2)c(C)n1-c1cc(Cl)cc(Cl)c1 725419165 RUACBWTXHHASKL-UHFFFAOYSA-N 447.297 4.629 50 10 IJGE Cc1nn(-c2ccc(Cl)c(Cl)c2)c(C)c1CC(=O)NNc1cccc(F)c1F 743725893 UTFYJRVZHLPKKV-UHFFFAOYSA-N 425.266 4.760 50 10 IJGE N#Cc1ccc(NNC(=O)C2CCN(c3nc4ccccc4s3)CC2)cc1C(F)(F)F 746893931 IINDMRDOHYEJDG-UHFFFAOYSA-N 445.470 4.546 50 10 IJGE O=C(NNc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 775469245 BVELNSAWWOATTF-UHFFFAOYSA-N 449.345 4.608 50 10 IJGE N#Cc1ccc(COc2cccc(C=NNC(=O)c3ccccc3Br)c2)cc1 1083998460 JOWFXFKWWVMBAD-UHFFFAOYSA-N 434.293 4.664 50 10 IJGE Cc1cc(Cl)ccc1NC(=O)C(=O)NN=Cc1cc(C)n(-c2c(C)cccc2C)c1C 1084082085 HSXMOTIIYZAPBW-UHFFFAOYSA-N 436.943 4.762 50 10 IJGE C=C[C@@H]1OCC[C@H]1NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1129009213 SAHFYWPRDYVNOC-BKTAVVLMSA-N 430.335 4.768 50 10 IJGE O=C(NNc1c(Cl)cc(Br)cc1Cl)c1cc(C(F)(F)F)cnc1O 1148165260 NFGUDIMMRGVSET-UHFFFAOYSA-N 445.022 4.632 50 10 IJGE C=CC[C@H](Cc1ccccc1)NC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1 1673577579 HUBHTDFADIISHR-JOCHJYFZSA-N 447.510 4.536 50 10 IJGE COc1c(C)cc(C)cc1-c1csc(/C(C#N)=C(\O)[C@@H]2CC(=O)N(C(C)(C)C)C2)n1 1872754833 KZTCFHQMCFGPLN-JXLCAQNNSA-N 425.554 4.875 50 10 IJGE CCC[C@]1(C(=O)N(C)C[C@H]2C[C@H](Br)C2)CCCCN1C(=O)OC(C)(C)C 1887832199 BAGDIHBZEJZRRJ-JXXFODFXSA-N 431.415 4.578 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@H]2C[C@@]23CCOC3)s1 1900920734 XQAKBTOFJIOLSL-KNBVPPQFSA-N 433.536 4.869 50 10 IJGE CC(C)(C)OC(=O)NCc1cc(C(=O)NN(Cc2ccccc2)Cc2ccccc2)co1 1923611907 QSCDYTPYSHHRJT-UHFFFAOYSA-N 435.524 4.652 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1csnc1Br 1925210753 IOHJGQNSBDQZBG-LLVKDONJSA-N 432.181 4.722 50 10 IJGE CC[C@H](C)[C@H](CBr)NC(=O)c1scc(Br)c1Br 2023038791 ACYKXZXZZUBRBT-XPUUQOCRSA-N 448.018 4.813 50 10 IJGE C[C@@H]1CCO[C@H]1COc1c(Br)cc(Br)cc1CBr 2034995992 QTCVYCQOQOLTBS-PELKAZGASA-N 442.973 4.910 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)CCc2ccccc21 2106782153 OIXBDTKEAVUSOF-MSOLQXFVSA-N 425.411 5.000 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)C1CCN(C[C@H](CBr)c2ccccc2)CC1 2106789551 ZGHFCVOKVZQGNY-APWZRJJASA-N 425.411 4.790 50 10 IJGE CC[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CN1CC1(CBr)CCCCC1 2106789563 ZHVSBBYSKXKFAV-FGTMMUONSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCCC2)[C@H](CC(F)F)C1 2127049006 YSLRVLHLSCYMGR-OAHLLOKOSA-N 439.385 4.908 50 10 IJGE CO[C@@H]1CC(Oc2c(Br)cc(Br)cc2CCl)C[C@H]1OC 2187175886 BPIZFQJYYOXSFQ-CHWSQXEVSA-N 428.548 4.522 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Cl)C2 2190670681 MJHQPIZVQCRSQU-CYDGBPFRSA-N 425.523 4.534 50 10 IJGE Cc1csc(C(=O)NC[C@]2(CBr)C[C@@H]2C(F)(F)F)c1Br 2192583153 BLHMVNOUWBUIRA-WRWORJQWSA-N 435.103 4.512 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Br)[C@@H]1CCCCS1(=O)=O 2203005682 XAJHNOFWQZXOAH-RYUDHWBXSA-N 446.588 4.514 50 10 IJGE ICCCCN1CCC2(CC1)CCN(Cc1ccccc1)CC2 2243585598 DFWJJQIINHHLEU-UHFFFAOYSA-N 426.386 4.580 50 10 IJGE COC[C@@]1(C)C[C@@]1(CBr)Cc1ccc(I)c(Cl)c1 2257085896 QJTQMUITIUZRFV-ZIAGYGMSSA-N 443.550 4.925 50 10 IJGE COc1cc(F)c(CBr)c(N2C[C@@H]3CN(Cc4ccccc4)C[C@@]3(C)C2)c1 2283391740 JZFJTEOZOMXDRP-JTSKRJEESA-N 433.365 4.688 50 10 IJGE C[C@H](Br)[C@H]1CCCN1Cc1ccc(Cl)cc1I 2302309555 NZARHRSWXFQQMW-TVQRCGJNSA-N 428.539 4.692 50 10 IJGE CCN(Cc1cc(I)ccc1Cl)C(C)(C)CBr 2307328830 RTZAADTZVAOPNN-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE CC(=O)c1ccc(-c2ccc(C=C3C(=O)N(Cc4ccccc4)C(=O)C(C#N)=C3C)o2)cc1 2314611068 PSPNOFQAKSZIOS-UHFFFAOYSA-N 436.467 4.942 50 10 IJGE ClC[C@H]1CC2(CC2)CN1Cc1ccc(I)c(Br)c1 2325219180 WHWWVSUTELQJTR-LLVKDONJSA-N 440.550 4.647 50 10 IJGE Clc1ccc(I)cc1COc1cccc(CBr)n1 2327241430 CAUAABYAHYPIEB-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1 2328520349 DJVROPFAVCHMKN-KGLIPLIRSA-N 431.337 4.527 50 10 IJGE FC(F)(F)[C@@H]1C[C@H](Br)CCN1Cc1ccc(I)cc1 2336292824 XJNLLHCLDRZBNW-PWSUYJOCSA-N 448.064 4.581 50 10 IJGE O=C1c2ccccc2C(=O)N1CCCc1nccn1-c1cc(Cl)c(F)cc1CCl 2337235391 NNLUJRLFVPSVON-UHFFFAOYSA-N 432.282 4.632 50 10 IJGE CC(C)(C)OC(=O)N[C@@]1(c2ccccc2)CCN(C[C@@]2(CBr)CC2(F)F)C1 2379986518 SKWJXICNFSQGBI-OALUTQOASA-N 445.348 4.533 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C\c2cn(-c3ccccc3)nc2-c2ccc(F)cc2)C1=O 101332751 QTEQNRSJOVUAAG-HYARGMPZSA-N 440.478 4.681 50 10 IJGE N#C/C(C(=O)Nc1ccc(F)cc1)=C1\S[C@@H](Cc2ccccc2)C(=O)N1c1ccccc1 102694469 WFBDMLGIYWDYGW-SCIJIFGBSA-N 443.503 4.891 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1Br)c1cc(C(F)(F)F)ccc1Br 123004206 GRLSEJJDTNWHQF-NWDGAFQWSA-N 429.074 4.904 50 10 IJGE Cc1cccc(N2CCN(/C=C(/C#N)C(=O)Nc3ccc(Oc4ccccc4)cc3)CC2)c1 217211795 RGERJBCTAGAWCA-XDOYNYLZSA-N 438.531 4.956 50 10 IJGE COc1ccc(OCCN/C=C(/C#N)C(=O)NC2CCCCCCCCCCC2)cc1 217260057 IVGALCDXCLFSNE-MRCUWXFGSA-N 427.589 4.861 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OCC1CCCCCC1 300888157 OARVIAIMKFWPHQ-KRWDZBQOSA-N 425.351 4.692 50 10 IJGE COc1cc(Br)c([C@@H]2CC[C@](C)(CI)O2)cc1OC 311903452 BIPXIZNYPSXVRL-SMDDNHRTSA-N 441.103 4.512 50 10 IJGE Cc1cc(C)c(C)c([C@H](Br)c2cnn(C)c2I)c1C 394370125 WVMBKPSHCBMBRF-CQSZACIVSA-N 433.131 4.743 50 10 IJGE O=C(c1scc(Br)c1Br)N(CCBr)CC1CC1 688401454 BLTWRKUKHPOHLR-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE CCC[C@H](CCBr)NC(=O)c1ccc(Br)cc1Br 716856219 RHTJCOKTQPDESP-SNVBAGLBSA-N 441.989 4.895 50 10 IJGE C[C@]1(CBr)CCCN1C(=O)c1ccc(Br)cc1Br 723028460 ZRTSOPGZVBLMEC-CYBMUJFWSA-N 439.973 4.601 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)c(C)n1CC(C)C 741605405 KFFHGBLKBSSPFS-ITKURVPMSA-N 438.641 4.929 50 10 IJGE O=C(NN=Cc1ccc(Oc2cnccn2)cc1)c1ccccc1OCc1ccc(F)cc1 743425378 IPDPYXMBOCBQDK-UHFFFAOYSA-N 442.450 4.751 50 10 IJGE O=C(COc1ccc(Br)cc1Cl)NN=Cc1ccc(Cl)cc1Cl 1084006278 UWAPXQBIOPHTAQ-UHFFFAOYSA-N 436.520 4.938 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2ccccc2OCc2ccccc2)cc1 1084528161 SRPRDUGOKFQMAX-XMMPIXPASA-N 432.520 4.628 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNc1nc2ccc(OC)cc2cc1C 1546235552 GUACQHXOZCGJKK-UHFFFAOYSA-N 431.414 4.892 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1cccs1)CCC2 1772748092 ABJDPWYJOHHACR-UHFFFAOYSA-N 437.521 4.689 50 10 IJGE O=C(CSc1nc2ccccc2s1)NN=Cc1ccc(OC(=O)c2ccccc2)cc1 1772760509 IGSHOLDAEKBVSP-UHFFFAOYSA-N 447.541 4.758 50 10 IJGE CSCc1ccc(C(=O)N2CCC(C(=O)Nc3ccc(SC#N)cc3)CC2)cc1 1860602200 VKTRNNBXAIXRKP-UHFFFAOYSA-N 425.579 4.614 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2)[C@@H]1c1ccccc1Cl 1865685542 KEEYYFNXPMNJGQ-MRXNPFEDSA-N 430.817 4.822 50 10 IJGE CCCc1nn(-c2ccc(Cl)cc2)c2c1[C@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865710175 QCBKXHHWIHEODX-LJQANCHMSA-N 435.871 4.605 50 10 IJGE CCC[C@H](NC(=O)C[C@@H](C)c1cccc(OC)c1)C(=O)Nc1ccc(SC#N)cc1 1867113356 NRPRKBDOUZXVJC-IERDGZPVSA-N 425.554 4.686 50 10 IJGE COc1cccc(-c2nc(Nc3ccc(SC#N)cc3)cc(N3CCC[C@H](CO)C3)n2)c1 1868505850 LRHLXMCZXXYXQI-KRWDZBQOSA-N 447.564 4.678 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2(CBr)CCC2)OCc2ccccc2)C1 1881879179 WLMVEIMPBJFDQE-UHFFFAOYSA-N 439.394 4.605 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C1(C)C 1882086271 AARLRZZRWDBISQ-LJISPDSOSA-N 447.414 4.556 50 10 IJGE C[C@@H]1CCN(Cc2cccc(Br)c2Br)C[C@@H]1Br 1943880796 KEAPXVAIJIJPGF-SKDRFNHKSA-N 425.990 4.817 50 10 IJGE C[C@@H]1CCN(C(=O)c2csc(Br)c2Br)C[C@@H]1Br 1945188873 DDPSJZULIAEYML-SVRRBLITSA-N 446.002 4.519 50 10 IJGE COc1cc(C(=O)N(Cc2ccccc2)[C@H](C)CBr)ccc1Br 1989502585 RWWYXVXUKORORW-CYBMUJFWSA-N 441.163 4.884 50 10 IJGE CC[C@@H](C)[C@H](CBr)NC(=O)c1csc(Br)c1Br 2023036644 BSIRZXMEFMVRKD-SVRRBLITSA-N 448.018 4.813 50 10 IJGE Clc1c(Br)sc(Br)c1[C@H](Cl)[C@@H]1CO[C@H]2COC[C@H]12 2040325989 OKHHADRTWKEMMJ-MNCSTQPFSA-N 436.980 4.868 50 10 IJGE CCC[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](CC(F)(F)F)C1 2055949139 RYWDPEYSSGBSRT-KBPBESRZSA-N 431.337 4.671 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1Cc1nccn1Cc1ccccc1 2090022423 WGFBIYGUYDUWDJ-ZDUSSCGKSA-N 430.737 4.787 50 10 IJGE CCN(C(=O)OC(C)(C)C)[C@H]1CCCN(C[C@H](CBr)c2ccccc2)C1 2106781364 HDXZEUJZOKTFKV-OALUTQOASA-N 425.411 4.887 50 10 IJGE C[C@@H]1CN(C[C@H](CBr)c2ccccc2)C[C@@H]1CCNC(=O)OC(C)(C)C 2106788176 NNKGCMSPEYGWPP-NEWSRXKRSA-N 425.411 4.648 50 10 IJGE COc1ccc(Br)c(CBr)c1OC[C@H]1C[C@H]1Br 2214869730 IDCJDEYWXHCUGX-GMSGAONNSA-N 428.946 4.515 50 10 IJGE COc1ccc([C@@H](Cl)c2cc(Br)co2)cc1I 2249400533 COUWJJGCBIUERY-GFCCVEGCSA-N 427.463 4.984 50 10 IJGE Fc1ccccc1[C@@H](CI)OC1CCN(Cc2ccccc2)CC1 2250387072 NQPHEFLAENNOKM-HXUWFJFHSA-N 439.312 4.983 50 10 IJGE COc1ccc([C@@H](Br)C2C[C@@H]3CC[C@H](C2)O3)cc1I 2269533535 FUKZHWOIOAJRRK-UKAJUAJCSA-N 437.115 4.693 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@H]2C[C@H](Br)C2)cc1C(F)(F)F 2277811119 YKVBUMZHLRYFGJ-XYPYZODXSA-N 437.256 4.708 50 10 IJGE C[C@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@H](C)[C@@H]1Br 2282978530 OGSBDOITQWXBCR-BWPRHRIFSA-N 427.539 4.733 50 10 IJGE CC(=O)Nc1cccc(Oc2cc(C)nc(C3CCN(C(=O)[C@@H](Cl)C(C)C)CC3)n2)c1 2296578201 NMYDBQVMMMYKCZ-NRFANRHFSA-N 444.963 4.505 50 10 IJGE C=CCN1C(=O)C(=Cc2ccc(OCc3ccc(F)cc3)c(OCC)c2)C(C)=C(C#N)C1=O 2314617285 VIYHOZLWQYWQHR-UHFFFAOYSA-N 446.478 4.582 50 10 IJGE C[C@H]1CC[C@H](CBr)N(Cc2ccc(Cl)c(I)c2)C1 2315554535 GHTCVEZICLSEHV-CMPLNLGQSA-N 442.566 4.940 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Br)[C@H]1[C@H]2COC[C@H]21 2317423088 NBKGETAOAXXVAW-LRMGWDNHSA-N 442.948 4.988 50 10 IJGE CC(C)[C@H]1[C@@H](Br)CCN1Cc1ccc(Cl)cc1I 2318521906 MYDKHWYIZNTZPO-JSGCOSHPSA-N 442.566 4.938 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)Cc3ccc(NC(C)=O)cc3)n2)cc1OC 2331241388 DHTIKDWQQNZIHZ-UHFFFAOYSA-N 435.505 4.821 50 10 IJGE CN(C[C@H]1CN(CC2(CBr)CC(C)(C)C2)CC12CC2)C(=O)OC(C)(C)C 2345005607 AZRHLNGUDZQNQL-INIZCTEOSA-N 429.443 4.767 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@]3(C)CN(C(=O)OC(C)(C)C)C[C@@]3(C)C2)C1 2345011951 XSDIGNNKCPZULY-WOJBJXKFSA-N 429.443 4.767 50 10 IJGE O=C(N/N=C/c1ccc(OCc2ccccc2)cc1)[C@H]1COc2cc3ccccc3cc2O1 1207655 YGUPPHNVAZHTDW-BGUYBBADSA-N 438.483 4.709 50 10 IJGE CCCC(=O)Nc1ccc(C(=O)NNC(=O)[C@@H](CC)Oc2ccccc2[C@@H](C)CC)cc1 10683364 NRCQEHMKZYSOQL-LAUBAEHRSA-N 439.556 4.557 50 10 IJGE CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccc(F)cc3)ccc21 38650448 AGABIIDEGFWGFE-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE CNC(=O)/C(C#N)=C1\S[C@H](Cc2ccc(C(C)C)cc2)C(=O)N1c1ccc(C)c(C)c1 101240702 UWXZJTWEJZXHRD-CKVBZJJFSA-N 433.577 4.599 50 10 IJGE O=C1NCCc2ccc([C@H](Br)c3ccc(Br)c(Cl)c3)cc21 129193891 IDIIMQMQXAVULN-HNNXBMFYSA-N 429.539 4.873 50 10 IJGE CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](O)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 196218004 YFXHWMFAYWHGCE-CJRSTVEYSA-N 444.644 4.896 50 10 IJGE CCOC(=O)c1ccc(NC(=O)/C(C#N)=C\NC(c2ccccc2)c2ccccc2)cc1 217099353 MEDRTOHPTZZGKY-PYCFMQQDSA-N 425.488 4.588 50 10 IJGE O=C1NCCc2ccc([C@H](Cl)c3cc(Br)sc3Br)cc21 236038962 BUUPVLXOCHQFHO-LBPRGKRZSA-N 435.568 4.887 50 10 IJGE CC[C@@H](Oc1cccc(Br)c1)C(=O)NN=Cc1ccc(N(CC)CC)cc1 252617604 KWXLXTCLQLFSRA-HXUWFJFHSA-N 432.362 4.603 50 10 IJGE CCCCCC[C@H](C)O[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1I 299983704 XFMALKGUUOGLDL-ZNMIVQPWSA-N 425.351 4.785 50 10 IJGE ClCc1cc2ccc(I)c(I)c2s1 307531128 SVTIBQGWTQWVRA-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE COc1cc(OCc2ccccc2)c(CBr)cc1I 398576132 RHBNDYLYVBMGIK-UHFFFAOYSA-N 433.083 4.774 50 10 IJGE COc1cccc(-c2nn(C(C)(C)C)cc2C=NNC(=O)c2cn(C)c3ccccc23)c1 759648043 HIGPAQBBCUYFQY-UHFFFAOYSA-N 429.524 4.569 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N2CCC(C(=O)C(F)(F)F)CC2)c(C)n1-c1ccc(F)cc1 775437324 BKEWIBHTWCCSAN-PDGQHHTCSA-N 447.432 4.510 50 10 IJGE CCCc1ccc(-c2ccc(NC(=O)C(=O)NNc3nccc4sccc34)cc2)cc1 783438238 PNZPIDJYXQEJCW-UHFFFAOYSA-N 430.533 4.998 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2cc(Cl)c(OCC)c(OCC)c2)cc1 1083923283 WFMYZGBQHVPXRZ-HXUWFJFHSA-N 448.947 4.500 50 10 IJGE N#C/C(=C\c1ccccc1OCc1cccc(F)c1)C(=O)N1CCN(c2ccccc2)CC1 1084370501 DTUMYQMBOBGZMV-PTGBLXJZSA-N 441.506 4.660 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNc2ccc([N+](=O)[O-])cc2Cl)s1 1630981361 QYCBUGUFDWYIOX-UHFFFAOYSA-N 433.342 4.544 50 10 IJGE C/C(=C\C(=O)NNc1ccccc1I)c1ccc(C(F)(F)F)cc1 1644637524 OIPAIISUYANCGV-ZHACJKMWSA-N 446.210 4.857 50 10 IJGE CC(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)cc1 1649387606 DIGVPDWESBJOFI-UHFFFAOYSA-N 443.890 4.833 50 10 IJGE CCCc1nn(-c2ccc(OC)cc2)c2c1[C@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 1865682330 MCVFHHRNSRBNIO-IBGZPJMESA-N 438.890 4.844 50 10 IJGE CCCc1nn(Cc2ccccc2)c2c1[C@@H](c1cccc(Br)c1)C(C#N)=C(N)O2 1865684724 WRMDHBFWTPUNDK-FQEVSTJZSA-N 449.352 4.865 50 10 IJGE CCCn1nc(CC)c2c1OC(N)=C(C#N)[C@H]2c1ccc(OCc2ccccc2)c(OC)c1 1865687392 QFKYRXUNVGALGP-HSZRJFAPSA-N 444.535 4.661 50 10 IJGE CCc1nn(Cc2ccc(F)cc2)c2c1[C@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865705214 OWJMKPUFZWAVOF-JOCHJYFZSA-N 432.499 4.638 50 10 IJGE CC[C@](C)(NC(=O)[C@@H](c1ccc(OC)cc1)C(C)C)C(=O)Nc1ccc(SC#N)cc1 1866978897 GDLSPVIGACSGMO-QPPBQGQZSA-N 439.581 4.932 50 10 IJGE O=S(=O)(c1cc(Cl)c(Br)s1)N(CCCCl)Cc1ccccc1 1914613242 OORNIRSDTDDFKZ-UHFFFAOYSA-N 443.215 4.984 50 10 IJGE O=S(=O)(c1ccsc1Cl)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915188135 WHZSQHDFJMTLMJ-CQSZACIVSA-N 434.808 4.766 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)C1CCC(C(F)(F)F)CC1 1916348280 NAMVFCJOLSLCMO-OFLPRAFFSA-N 436.312 4.794 50 10 IJGE C[C@H]1CN(Cc2cccc(Br)c2Br)CC[C@H]1Br 1943881444 QYEYUKDANHDIMY-GXSJLCMTSA-N 425.990 4.817 50 10 IJGE C[C@@H](c1ccncc1Br)[C@H](Cl)c1cc(I)sn1 2007643150 HNLQLOQUVHBQMC-KGFZYKRKSA-N 443.535 4.989 50 10 IJGE O=C(Nc1c(Br)cc(Cl)cc1Br)[C@H]1C[C@@H](Br)C1 2020159145 KNLOUMSYZSGMHB-OLQVQODUSA-N 446.364 4.977 50 10 IJGE CC(C)c1cc(CBr)n(Cc2cc(F)ccc2I)n1 2070165466 SAQIXCXJSYJVDP-UHFFFAOYSA-N 437.094 4.693 50 10 IJGE FC(F)(F)c1cc(Br)nc(-n2nc(CBr)c3c2C[C@@H]2C[C@H]32)c1 2080741194 RXSZLMGVBRMTOD-XPUUQOCRSA-N 437.057 4.603 50 10 IJGE C[C@H]1[C@@H](C(F)(F)F)N(CC2(CBr)CCCC2)CCN1C(=O)OC(C)(C)C 2115980180 OUGWGLYDARNRRE-KBPBESRZSA-N 443.348 4.814 50 10 IJGE Brc1ccccc1[C@@H](CI)O[C@H]1C[C@H](n2ccnc2)C1 2183661255 UIRTUCYWJUIFDW-LALPHHSUSA-N 447.114 4.542 50 10 IJGE Cc1nnc(Cn2c(CCl)nc3cc(Br)c(Br)cc32)s1 2234070237 CUTIOLCDBRLLEU-UHFFFAOYSA-N 436.560 4.508 50 10 IJGE O=C(c1scc(Br)c1Cl)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Br)C2 2264500974 IASDRTJLIAUWJS-NVGOVIIQSA-N 431.552 4.643 50 10 IJGE CC(C)[C@H]1[C@H](Br)CCN1C(=O)c1cc(F)c(Br)cc1Cl 2282968346 VDWQDBMTMYNVIC-RNCFNFMXSA-N 427.539 4.876 50 10 IJGE O=C(N[C@H]1CCC[C@@H](CBr)C1)c1cc(Br)c(F)cc1Cl 2285843990 GZYYYFCUXZLUAQ-BDAKNGLRSA-N 427.539 4.925 50 10 IJGE COc1ccc(CNC(=O)C(C#N)=Cc2ccc(OCc3ccc(F)cc3)c(OC)c2)cc1 2313671142 IUEHQWHLXNNDOP-UHFFFAOYSA-N 446.478 4.645 50 10 IJGE CN(C[C@@H](Br)CCc1ccc(Cl)cc1I)C1CC1 2318532113 UJUHNGFZLKIAML-NSHDSACASA-N 442.566 4.735 50 10 IJGE CCCOc1c(C=NNC(=O)c2ccc3nc(Cc4ccccc4)[nH]c3c2)cccc1OC 2323721423 STPPTGZAGWYEMG-UHFFFAOYSA-N 442.519 4.715 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC(=O)C(C#N)=CNc1ccc(Oc2ccccc2)cc1 2325216930 XHNXHLWMMDHTDH-UHFFFAOYSA-N 430.420 4.854 50 10 IJGE Cc1nc(CCl)n(Cc2ccc(I)c(Br)c2)c1C 2325221404 GICMCTTZTBXRBK-UHFFFAOYSA-N 439.522 4.654 50 10 IJGE O=C(NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21)c1c(F)cccc1Cl 2326840047 MOVYTMYKHSBLRM-UHFFFAOYSA-N 442.277 4.813 50 10 IJGE CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccccc3C)ccc21 38650429 XHHKCRDCYLALPV-XMMPIXPASA-N 426.472 4.831 50 10 IJGE Cc1c(C(=O)NCc2ccccc2)oc2c1/C(=N/NC(=O)c1ccccc1Cl)CCC2 40812648 XWMFCXQDESZVEL-ZXVVBBHZSA-N 435.911 4.642 50 10 IJGE CCOc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)Cc2ccccc2)CCC3)cc1 40815846 ZEIVYAKCXIOVDN-SGWCAAJKSA-N 445.519 4.638 50 10 IJGE O=C(CCCC(=O)Nc1ccc(Br)cc1)N/N=C/c1c(F)cccc1Cl 58951305 IRKOCTQSEFZPND-SSDVNMTOSA-N 440.700 4.501 50 10 IJGE N#C/C(=C/NCc1cccc(Br)c1)C(=O)Nc1cccc(Cl)c1Cl 217129950 NELBYTXGGAPCOS-BENRWUELSA-N 425.113 4.892 50 10 IJGE CCN(CC)c1ccc(N/C=C(/C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c(C)c1 217234695 SXSKSWRXJKJPDP-SQFISAMPSA-N 427.892 4.861 50 10 IJGE C[C@@H](Cl)c1nnc(-c2cc(I)ccc2Br)s1 235171911 SCQHKRUYSISUEN-RXMQYKEDSA-N 429.508 4.872 50 10 IJGE Cc1ccc(OCC(=O)NN=C2C(=O)N(Cc3cccc4ccccc34)c3ccccc32)cc1 254699407 POIUUECFVRJXLT-UHFFFAOYSA-N 449.510 4.594 50 10 IJGE C[C@H](C=NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(Cl)c2)c1)c1ccccc1 254795587 SDXUUOSWCNMHLH-MRXNPFEDSA-N 441.940 4.660 50 10 IJGE O=C(NC[C@@]12CCC[C@@H]1CN(Cc1ccccc1)C2)c1ccc(CBr)cc1 312894526 XHUYYRGMCWQIDS-FYYLOGMGSA-N 427.386 4.614 50 10 IJGE Oc1c(Br)cccc1[C@H]1CN(Cc2ccccc2)C[C@H]1CBr 382694365 WWEJURUDFAPOPH-ZBFHGGJFSA-N 425.164 4.765 50 10 IJGE Fc1ccc([C@@H](Br)c2cc(I)cc3c2OCC3)cc1 388582054 WLTLXEMADDOMRQ-CQSZACIVSA-N 433.058 4.850 50 10 IJGE CN(CCCCCCCCCBr)C[C@@]1(O)CCN(Cc2ccccc2)C1 711756586 MNSDASQEXYDPNA-QFIPXVFZSA-N 425.455 4.681 50 10 IJGE CC(C)n1ncc2cc(NC(=O)/C(C#N)=C\c3cn(CCC#N)nc3-c3ccccc3)ccc21 735290796 DXCWUFBPQJWCNN-MOSHPQCFSA-N 449.518 4.940 50 10 IJGE N#Cc1ccc(NNC(=O)C(=O)Nc2ccc(SC3CCCC3)cc2)c(C(F)(F)F)c1 799841032 UFGOAHQEZRVBBK-UHFFFAOYSA-N 448.470 4.694 50 10 IJGE Cc1ccc(-c2ccc(C)c(NC(=O)C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c2)o1 799841793 OVQMLARNKUYEPJ-UHFFFAOYSA-N 442.397 4.536 50 10 IJGE CCc1cccc(C)c1NNC(=O)c1c[nH]c2c(Cl)cc(Br)cc2c1=O 799853025 GSGPGMCEGUMRDI-UHFFFAOYSA-N 434.721 4.572 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(C)c1C=NNC(=O)c1cc2ccccc2cc1O 1084265548 CSTCSJAKAUVXPL-UHFFFAOYSA-N 432.911 4.824 50 10 IJGE C#Cc1cccc(CNC(=O)NNC(=O)c2ccc(COc3ccc4ccccc4c3)cc2)c1 1681995889 MRDOOPKMTIVNLI-UHFFFAOYSA-N 449.510 4.544 50 10 IJGE O=C(Nc1ncccc1OCCOc1ccc(Cl)cc1)Oc1ccc([N+](=O)[O-])cc1F 1858690502 DUEDPSZKJQFQOD-UHFFFAOYSA-N 447.806 4.851 50 10 IJGE CSCC[C@@H](/C(O)=C(\C#N)c1nc(C(C)(C)C)cs1)N1C(=O)c2ccccc2C1=O 1872748946 UDYZCHJAUGRWBX-UKJPIOLTSA-N 441.578 4.651 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)[C@H]3CC(=O)N(C(C)(C)C)C3)n2)c(C)c1C 1872753992 XPCRDBPXJZWZKY-MUNYZGMTSA-N 425.554 4.875 50 10 IJGE CN(C[C@@H]1C[C@H]1Br)C(=O)CC[C@H](CCNC(=O)OC(C)(C)C)C(C)(C)C 1887829439 JOEQOEDYMCONGE-ARFHVFGLSA-N 433.431 4.586 50 10 IJGE COc1ccc(Br)c(C(=O)N(Cc2ccccc2)[C@H](C)CBr)c1 1914228663 OBMJSYHJKUZKBB-CYBMUJFWSA-N 441.163 4.884 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(OCc2ccccc2)C(=O)c2cccc(CCl)c2)C1 1982826326 DXMXHUJGUHDJGC-UHFFFAOYSA-N 430.932 4.619 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CCCC12CC2)C(=O)OC(C)(C)C 1986117870 CLMBGZCKBIMQFE-PBHICJAKSA-N 437.362 4.786 50 10 IJGE Clc1cc(CN2CCCC[C@H](Br)C2)ccc1I 2026567415 RSYVVNSFFJQJHI-NSHDSACASA-N 428.539 4.694 50 10 IJGE C[C@@H](CCBr)CCN1CCN(C(=O)OC(C)(C)C)CC[C@@H]1C(F)(F)F 2044701994 XRYHYCRGLZZVPK-UONOGXRCSA-N 431.337 4.671 50 10 IJGE CC(C)[C@H](Cl)c1cn(-c2ccc(Br)c(I)c2)nn1 2057426450 FNCJKTZFHJLNHA-LBPRGKRZSA-N 440.510 4.570 50 10 IJGE CC[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)C[C@@H]1C(F)(F)F 2058048458 DWBHFDQSJAUIGZ-BFHYXJOUSA-N 431.337 4.670 50 10 IJGE O=S(=O)(c1cc(CBr)cc(F)c1F)N(Cc1ccccc1)C1CCC1 2059312050 FVNDHMZQEYRUGS-UHFFFAOYSA-N 430.314 4.603 50 10 IJGE FC(F)Oc1cc(OC(F)(F)F)c(CBr)cc1I 2060222309 NDGZLPKMOLAASU-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE Cc1ccc(N2C(=O)C(=CNNC(=O)c3ccc4ccccc4c3)c3ccccc3C2=O)cc1 2069639859 DUBOPVZDNKWLIP-UHFFFAOYSA-N 447.494 4.611 50 10 IJGE Brc1ccc(CN2CC[C@H](Br)[C@@H]3CC[C@@H]32)c(Br)c1 2069994626 AFDRPZSZPVYKLS-OBJOEFQTSA-N 438.001 4.959 50 10 IJGE CCN(C[C@@H](CBr)c1ccccc1)C1CCN(C(=O)OC(C)(C)C)CC1 2106787382 IPAQMHUDPRDZBL-GOSISDBHSA-N 425.411 4.887 50 10 IJGE Sc1nc2cc(Br)c(Br)cc2n1[C@H]1C[C@@H](Br)C1 2213498699 MOMUCTKEIDHVTR-OLQVQODUSA-N 440.986 4.948 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](OCC[C@H]2CCCCC23CC3)C1 2246605884 HUQUJNZTNJMDQQ-OWCLPIDISA-N 449.373 4.786 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C(F)(F)C23CC3)cc1I 2257359085 WNWZEQKMXQMWJA-QWRGUYRKSA-N 429.042 4.781 50 10 IJGE CCCC1(O[C@@H](CI)c2ccc(Br)cc2)COC1 2260091222 IYEQMLIUXFOGEU-ZDUSSCGKSA-N 425.104 4.511 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C[C@]23CCCOC3)cc1I 2269547761 DRKLWIYNSFCWKT-CQDKDKBSSA-N 437.115 4.553 50 10 IJGE CC1(C)[C@@H](OCc2ccc(I)c(Br)c2)C[C@H]1Cl 2306296868 CAJXNKOBFVLVBL-NEPJUHHUSA-N 429.523 4.976 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1Cc1cc(I)ccc1Cl 2307328508 NZCVMOWLFWNZIE-MWLCHTKSSA-N 428.539 4.692 50 10 IJGE Clc1ccc(CN2C[C@@H](Br)CCC23CC3)cc1I 2315550059 ZECIKQVAIVAFBH-NSHDSACASA-N 440.550 4.837 50 10 IJGE FC(F)(F)[C@@H]1[C@@H](Br)CCCN1Cc1ccc(I)cc1 2344184054 IKFJFBNSKNQVFN-RYUDHWBXSA-N 448.064 4.581 50 10 IJGE CCOC(=O)C1=C(C)NC(SCC(=O)c2cccs2)=C(C#N)[C@@H]1c1ccc(F)cc1 20609353 CWKGENYWVHLKTM-FQEVSTJZSA-N 442.537 4.762 50 10 IJGE O=C(N/N=C/c1cccs1)c1cccc(NC(=O)c2cccc(Br)c2)c1 27520102 YUEBHFIKYGMLBH-CIAFOILYSA-N 428.311 4.527 50 10 IJGE CN(C)c1ccc(NC(=O)CCSSCCC(=O)Nc2ccc(N(C)C)cc2)cc1 38360177 YGUFXZYLSAJSEE-UHFFFAOYSA-N 446.642 4.557 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)COc3cccc(Cl)c3)ccc2[C@H]1c1cccs1 38656689 YFXWNMRQZDNAEJ-OAQYLSRUSA-N 438.892 4.604 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)N[C@H](C)c2ccccc2)c(Br)cc1OC 59281685 UJRDRPMHOUQAJB-NGWPFTMJSA-N 429.314 4.641 50 10 IJGE CN(C(=O)c1cc(Br)c(Br)s1)C(C)(C)CBr 134158683 BZJBWWIKNAMRPO-UHFFFAOYSA-N 433.991 4.519 50 10 IJGE N#Cc1ccccc1COc1ccc(C=NNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 254765368 LGKIYTTUWPPWON-UHFFFAOYSA-N 440.415 4.556 50 10 IJGE C[C@H](Cl)C[C@@H]1CCCCN1C(=O)c1ccc(I)c(Cl)c1 380181179 AFHRDGXYSCRRNC-JQWIXIFHSA-N 426.125 4.957 50 10 IJGE Cc1c(C=NNC(=O)CC[C@H](O)c2ccccc2)c2ccccc2n1Cc1ccccc1 725435511 RJQICWFYFZZRAU-SANMLTNESA-N 425.532 4.962 50 10 IJGE Cc1ccc(-c2ncc(C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)s2)c(C)c1 736694708 CSOZZVDULYQOIV-UHFFFAOYSA-N 430.537 4.653 50 10 IJGE C=CCc1cc(C(=O)NNc2c(Cl)cccc2Br)cc(OC)c1OC 1472593460 ZMBGYLWDGKKFDB-UHFFFAOYSA-N 425.710 4.605 50 10 IJGE C=CC[C@@H](Cc1ccccc1)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 1642542232 VXDBFDWPNRMNTK-LDCGKNLRSA-N 435.531 4.674 50 10 IJGE Cc1c(C(=O)NCc2ccccc2)oc2c1C(=NNC(=O)c1ccccc1Cl)CCC2 1772744597 XWMFCXQDESZVEL-UHFFFAOYSA-N 435.911 4.642 50 10 IJGE COc1ccc(-n2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2cccc(Cl)c2)cc1 1865683546 MIOTWPDYIQCQSA-INIZCTEOSA-N 446.816 4.771 50 10 IJGE CCCc1nn(-c2cccc(Cl)c2)c2c1[C@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865683725 NUOKEFUOHPBPBI-OAQYLSRUSA-N 433.943 4.762 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@H]1c1cccs1 1865698279 PGANLKPFAAMLNK-CQSZACIVSA-N 436.846 4.883 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2-c1ccc(OC)cc1 1865704613 ZYDDPGGCLDJHDD-QHCPKHFHSA-N 444.535 4.840 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1 1882089194 XUOBEDDVDLTEKH-OAHLLOKOSA-N 447.414 4.702 50 10 IJGE Clc1nc(N2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)sc1CBr 1906887347 ZSASBWVCFNRNOZ-HUUCEWRRSA-N 426.811 4.650 50 10 IJGE C[C@H](CCCl)N(Cc1ccccc1)C(=O)c1ccc(I)c(O)c1 1915092491 JZBCYPFGEXAWGP-CYBMUJFWSA-N 443.712 4.657 50 10 IJGE CN(Cc1cc(Cl)ccc1I)CC1(CBr)CC1 1915547049 IITBZUZNWUQEFU-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE Brc1ccc(CN2CCC[C@H](Br)CC2)c(Br)c1 1943854559 YWKDZXHSCYRRSH-NSHDSACASA-N 425.990 4.961 50 10 IJGE BrCC[C@H]1CCCN1Cc1c(Br)cccc1Br 1945333742 UNYYRRJLMALMEP-SNVBAGLBSA-N 425.990 4.961 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC[C@@H]2C[C@H]3CC[C@H]2C3)C1 1997929607 MGJUTUZILHAWSG-FPXQBCRKSA-N 449.373 4.644 50 10 IJGE CCCCN(CCBr)C(=O)c1c(Br)cccc1Br 2033092983 FIAVFWCBXDQYPN-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE CN1C(=CC=NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)C(C)(C)c2ccccc21 2042446292 DZKHGAIBWYBQSY-UHFFFAOYSA-N 438.746 4.651 50 10 IJGE Brc1ccc(CN2C[C@@H](Br)C3(CCC3)C2)c(Br)c1 2046461184 ABYAAAWNJPTPSO-CYBMUJFWSA-N 438.001 4.961 50 10 IJGE O=C(CBr)c1cc(Br)cc(Br)c1OC(F)(F)F 2054919330 OEWRQXXJAUPXKR-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE O=C(CCl)c1ccc(I)c(OC(F)(F)F)c1C(F)(F)F 2055116812 BGDZCOSIAXFNQG-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE C[C@@H]1C[C@H](O[C@@H](CI)c2cccc(Br)c2)CCO1 2084725838 RTXPSHQUIMUQIP-HONMWMINSA-N 425.104 4.509 50 10 IJGE Clc1cc(CC[C@@H](Br)CN2CCCC2)ccc1I 2086649756 SYWPEXIKIFNAHI-GFCCVEGCSA-N 442.566 4.737 50 10 IJGE C[C@H]1[C@@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1csc(Br)c1Br 2093947864 JLZVNSDZPLYMCJ-WPYKOPORSA-N 427.589 4.894 50 10 IJGE CCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@H](CBr)c1ccccc1 2106782946 VKSGQJUQIZMCHN-OALUTQOASA-N 425.411 4.887 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C[C@@H](CBr)c2ccccc2)C(C)(C)C1 2106784100 FZUZPMZSEJVPOJ-MSOLQXFVSA-N 425.411 4.933 50 10 IJGE O=C(c1cc(Br)sc1Br)N1[C@H](CCl)C[C@@H]2CCC[C@@H]21 2108398110 ZMAOCJZCAUCFQH-NRPADANISA-N 427.589 4.895 50 10 IJGE CN(Cc1ccccc1NC(=O)[C@H](Br)C1CCCC1)C(=O)OC(C)(C)C 2110723278 NDSGVKBPEKYPLK-QGZVFWFLSA-N 425.367 4.946 50 10 IJGE O=C(c1ccc(Br)c(Cl)c1)N1CC[C@H](CBr)C(F)(F)C1 2146375704 QRHXXQUWUBJPPQ-SECBINFHSA-N 431.502 4.595 50 10 IJGE O=C(c1ccc(Br)cc1Cl)N1CCC([C@H](F)CBr)CC1 2163244378 HKOZJIUKBDEZAG-CYBMUJFWSA-N 427.539 4.688 50 10 IJGE CO[C@H]1C[C@H](Oc2c(Br)cc(CCl)cc2Br)C[C@H]1OC 2187172488 QPWGXOSFVRZWTC-CGJHYDBRSA-N 428.548 4.522 50 10 IJGE C[C@H]1O[C@@]2([C@H](Br)c3cc(I)cc4c3OCC4)CC[C@H]1C2 2199182276 DDWNYEZFDCIGDR-VDODNRGGSA-N 449.126 4.620 50 10 IJGE O=C(NCC1(CBr)CC(F)(F)C1)c1cc(Cl)ccc1Br 2281656189 HNNCOEHMFVQHHF-UHFFFAOYSA-N 431.502 4.643 50 10 IJGE Clc1ccc(CN2CCC(CBr)CC2)cc1I 2300238506 LWAPRSKGVMCNQZ-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(c2ncc(Br)cc2Br)[C@H]1C 2304182217 JUICMIGICUVHSS-NRPADANISA-N 426.978 4.605 50 10 IJGE C[C@H](Cl)CCCN(C)Cc1ccc(I)c(Br)c1 2306230689 ADJYBSAPTQQONN-JTQLQIEISA-N 430.555 4.893 50 10 IJGE Clc1ccc(I)cc1COc1ncc(CBr)s1 2307204445 ZSSKEWFVGCCSKL-UHFFFAOYSA-N 444.519 4.875 50 10 IJGE COc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(F)c2)cc1 2314634450 UDMPWYMVBARZDE-VWLOTQADSA-N 442.446 4.671 50 10 IJGE C[C@H](Br)C1CCN(Cc2ccc(Cl)c(I)c2)CC1 2315551932 XOXZKAWCVGWUFU-JTQLQIEISA-N 442.566 4.940 50 10 IJGE CC1(C)CCC(C)(C)[C@@H](Cc2ncc(I)cn2)[C@H]1Br 2353064508 MNSHASMSJCWNKW-WCQYABFASA-N 437.163 4.850 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](NC(=O)OC(C)(C)C)C[C@]1(C)COC 2364208792 MCFZBCOOHOQPCX-FXAWDEMLSA-N 449.474 4.972 50 10 IJGE COc1ccc([C@H](C)[C@H](Br)C(=O)N2C(=O)OC[C@@H]2c2ccccc2)c(C)c1 15777690 YPXLYMRZNMNZGG-KYNGSXCRSA-N 432.314 4.591 50 10 IJGE CN(C)c1ccc(NC(=O)CCCl)cc1CN(Cc1ccco1)C(=O)c1cccs1 34921553 DUNUSKCELHCTGA-UHFFFAOYSA-N 445.972 4.817 50 10 IJGE O=C(CCCc1c(-c2ccccn2)[nH]c2ccccc12)NNC(=O)c1ccc(Cl)cc1 39846645 UWOAKFXEVXUAMC-UHFFFAOYSA-N 432.911 4.667 50 10 IJGE Cc1cc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccnc2)CCC3)ccc1Cl 40814207 BYADMOJFLCRSIZ-NLRVBDNBSA-N 437.883 4.634 50 10 IJGE CC(C)Cc1ccc([C@@H](C)C(=O)NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1 66199273 LLTGOVZLJRSFSW-HUUCEWRRSA-N 437.367 4.910 50 10 IJGE COc1cc(N/C=C(/C#N)c2nc(-c3cccc([N+](=O)[O-])c3)cs2)c(C)cc1[N+](=O)[O-] 102479813 NTNSNYBBSDNSMU-UVTDQMKNSA-N 437.437 4.920 50 10 IJGE CCCCCCCCCC[C@H](Oc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)Cl 205171308 VYWXKUCFWXEDLQ-NRFANRHFSA-N 444.037 4.965 50 10 IJGE CO[C@H]1[C@@H](Oc2c(Br)cc(Br)cc2Br)C[C@H]1Cl 229266670 ZNWVUAWDIOUXAI-WCABBAIRSA-N 449.364 4.748 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CBr)OCc1ccccc1Br 231319557 PZOALGZEZYEEOK-INIZCTEOSA-N 437.172 4.644 50 10 IJGE BrCc1cnc(-c2ncc(Br)cc2Br)nc1C1CC1 305958360 WHJBZBVYGQXNTL-UHFFFAOYSA-N 447.956 4.836 50 10 IJGE Oc1ccc(Cl)cc1[C@@H]1CN(Cc2ccccc2)C[C@H]1CI 382700396 NXPKONZKPJYNDU-RHSMWYFYSA-N 427.713 4.696 50 10 IJGE FC(F)Oc1ccc(I)c(C(F)(F)F)c1CBr 575723681 SSMPVIWXJWRLGX-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE O=C(NC1(CCCl)CCSCC1)c1ccc(Br)cc1Br 719666592 VECPEALFJHIEIR-UHFFFAOYSA-N 441.616 4.836 50 10 IJGE C[C@H](Br)[C@H]1CCN(C(=O)c2cc(Br)c(Br)s2)C1 719965879 DDAHDOVGJMOBJB-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE C=CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1c(Cl)cccc1Br 1457902474 LMBVRVWPIJNDFH-AWEZNQCLSA-N 446.773 4.795 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(C(C)C)nc3O)c3ccccc3n2)cc1 1638072065 IIBFDBJJNQREIY-UHFFFAOYSA-N 440.503 4.509 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(N=Nc3ccccc3)cc2)cc1 1672393067 PZIIHKAUFNZULQ-QGZVFWFLSA-N 445.479 4.925 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699675 ZVLMJZRIMRQRNQ-QFIPXVFZSA-N 429.911 4.603 50 10 IJGE COc1ccc([C@@H](CC(=O)N[C@H](C)C(=O)Nc2ccc(SC#N)cc2)C(C)C)cc1C 1866763087 YWHWCKBEQBCQPD-UTKZUKDTSA-N 439.581 4.850 50 10 IJGE COc1ccc([C@H](C(=O)N[C@H](C)C(=O)Nc2ccc(SC#N)cc2)C2CCCC2)cc1 1867003359 FHFDMOUNRYHHQY-OPAMFIHVSA-N 437.565 4.686 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)CCc1cc(F)ccc1C(F)F 1900674679 VPHLKZFQVCSAGO-GFCCVEGCSA-N 426.232 4.756 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(CC(=O)NN(Cc2ccccc2)Cc2ccccc2)nc1 1923597567 BNFVDTJDUKXWIR-UHFFFAOYSA-N 446.551 4.705 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@]2(CC[C@](C)(CI)O2)C1 1939622037 XZAGPEWGANENJW-QGTPRVQTSA-N 437.362 4.834 50 10 IJGE C[C@H]1[C@H](Br)CCCN1C(=O)c1csc(Br)c1Br 1945190071 GDIONRFBMCECBI-POYBYMJQSA-N 446.002 4.661 50 10 IJGE BrCC[C@H]1CCN(Cc2c(Br)cccc2Br)C1 1945332447 CJLWWGJZBRUGSH-JTQLQIEISA-N 425.990 4.819 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN1C(=O)c1cc(Br)c(Br)s1 1950507824 INPOYPNANZQMSP-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C[C@H](CBr)C(C)(C)C)CCC1(F)F 2044695858 HNQUNCYLHRYZNU-KBPBESRZSA-N 427.374 4.668 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3C[C@H]2CC[C@H]3Br)c1 2054714847 SUVKNTSLHIZOOY-MPKXVKKWSA-N 438.001 4.959 50 10 IJGE C[C@@]1(CCBr)CCN1C(=O)c1cc(Br)cc(Br)c1 2084699428 HBHWTEUOUQOPQB-CYBMUJFWSA-N 439.973 4.601 50 10 IJGE C[C@@]1(CCl)CC(F)(F)CN1C(=O)c1csc(Br)c1Br 2102800518 DIMODRWBLJDECZ-JTQLQIEISA-N 437.531 4.752 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](C(F)(F)F)CCN1CC1(CBr)CCC1 2107584185 MQPOQPMSTKBFCT-ZIAGYGMSSA-N 443.348 4.719 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc2c(c1)CCCN2C(=O)N1CCC(Br)CC1 2163056338 QHRQNSKMPBZVDC-UHFFFAOYSA-N 438.366 4.766 50 10 IJGE Fc1cccc(CBr)c1N1CCOCC12CCN(Cc1ccccc1)CC2 2163146010 FQBJGVXJWHHVAP-UHFFFAOYSA-N 433.365 4.592 50 10 IJGE Cc1c(Cl)cc(C(=O)N2CCC[C@](F)(CBr)C2)cc1Br 2167385013 MHDUOWZZYLWLGE-AWEZNQCLSA-N 427.539 4.750 50 10 IJGE FC(F)(F)[C@@]1(CCl)CCN(Cc2cc(Cl)ccc2I)C1 2167681950 ZFALVSPKXZYWSS-GFCCVEGCSA-N 438.058 4.938 50 10 IJGE O=C(c1cc(Cl)ccc1I)N1CCC[C@@H](CCCCl)C1 2234183893 OQXPUDQFIDPHKE-LLVKDONJSA-N 426.125 4.816 50 10 IJGE C[C@H](CC1CCN(CCCCI)CC1)N(C)C(=O)OC(C)(C)C 2243589007 JEMDBWHPCIMJEI-OAHLLOKOSA-N 438.394 4.559 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)C2CCOCC2)c1 2252836209 ZLSYWIWYWASWIS-CYBMUJFWSA-N 426.974 4.944 50 10 IJGE C=CC[C@]1(CBr)CCCCN1C(=O)c1ccccc1I 2287754086 SLTZQXJYHIOHQF-MRXNPFEDSA-N 448.142 4.627 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)[C@H]1CCC[C@H]1Br 2300241303 XJASLUYEANKFFY-MFKMUULPSA-N 428.539 4.692 50 10 IJGE C[C@@H](Cl)c1nc2cc(I)ccc2n1C[C@@H]1C[C@@H]1Br 2311267727 HAQXLAJKUBZBSB-WEDXCCLWSA-N 439.522 4.724 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@@H](Cc2ccccc2F)C(=O)N1c1ccc(C(C)C)cc1 2314593441 MXSMVMPYFGKAKB-QFIPXVFZSA-N 449.551 4.678 50 10 IJGE CCCCCOc1ccc(C=CC(=O)Oc2cccc(C=C(C#N)C(=O)OC)c2)cc1OC 2314754495 TZSJAYFVCLENOD-UHFFFAOYSA-N 449.503 4.963 50 10 IJGE COc1ccc(CC(=O)Oc2ccc(C=C(C#N)c3ccccc3)cc2OC)cc1OC 2320506216 DZUXUPZVMQUPMZ-UHFFFAOYSA-N 429.472 4.925 50 10 IJGE C[C@H]1[C@H](C)N(Cc2ccc(I)c(Cl)c2)CC[C@H]1Br 2321326628 RLRGQJCSMFRDCP-JBLDHEPKSA-N 442.566 4.938 50 10 IJGE CCCCOc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4O)[nH]c3c2)cc1 2323739702 GWAIXGGNULAPRJ-UHFFFAOYSA-N 428.492 4.878 50 10 IJGE CO[C@H](CO[C@@]1(CBr)CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1 2336212984 TZBKKXBAJXMGOF-YLJYHZDGSA-N 428.367 4.555 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@]2(CBr)CC2(F)F)C2(CCCCC2)C1 2351884996 COGFIJNJCURWRC-WMLDXEAASA-N 437.369 4.709 50 10 IJGE C[C@H](O[C@@H](CCl)[C@@H](I)CCl)c1cccc(OC2CC2)c1 2368478130 APPUQEVKIUDZTM-LKTVYLICSA-N 429.125 4.955 50 10 IJGE O=C(c1cccc(OCc2ccccc2)c1)N(CCCBr)C1CCOCC1 2381012277 ORQFXQWUFKFOKO-UHFFFAOYSA-N 432.358 4.672 50 10 IJGE COc1cc(/C=N/NC(=O)[C@@H](C)c2ccc(CC(C)C)cc2)cc(Br)c1O 20468772 OYMHQBZVJAERGE-XMTZNVEYSA-N 433.346 4.616 50 10 IJGE CC/C(C)=N/NC(=O)COc1ccc2cc(Br)ccc2c1Br 33467770 UDBMORSRYCNUTL-VXLYETTFSA-N 428.124 4.646 50 10 IJGE Cc1c(C(=O)Oc2ccc3ccccc3c2)oc2c1/C(=N/NC(=O)c1cccnc1)CCC2 40814112 ZAZCBLSNGFROEA-SGWCAAJKSA-N 439.471 4.826 50 10 IJGE Cc1cc(C)c(OCC(=O)N/N=C/c2c(C)nn(Cc3ccccc3Cl)c2C)c(C)c1 59146543 RGQFLDPMLXFBMU-RPPGKUMJSA-N 438.959 4.656 50 10 IJGE C[C@@](CI)(OC[C@H]1CCCCO1)c1ccccc1Br 161961137 SMNUBASHXIIXIA-DOMZBBRYSA-N 439.131 4.685 50 10 IJGE C[C@@H](Br)c1ccccc1NS(=O)(=O)c1ccc(Br)cc1F 162310248 FVJLISANTIIJCT-SECBINFHSA-N 437.128 4.845 50 10 IJGE CCCCCOc1c(OC)cc(/C=N\NC(=O)Nc2cccc(Cl)c2)cc1[N+](=O)[O-] 169942004 VRIJLGNUVXERLO-XKZIYDEJSA-N 434.880 4.981 50 10 IJGE COc1ccc([C@@H](C)NC(=O)/C(C#N)=C\N(Cc2ccccc2)c2ccccc2)cc1OC 217173586 ADDDTXPBRXKUEU-LBMWUGKUSA-N 441.531 4.995 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\Nc1ccc(OC)c(Cl)c1 217240133 NQFIXINGFGLBJB-PFONDFGASA-N 427.888 4.764 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\Nc1ccccc1Br 217241010 DRJXKLFKEJUUHX-PFONDFGASA-N 442.313 4.864 50 10 IJGE ClCc1nc2cnccc2n1-c1ccc(I)cc1Br 302457685 WMGSJMQMWRDDDP-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE CC(=O)C(=O)CCC[C@@H]1C[C@@]2(C)C(=CC1=O)[C@@H](Cl)C[C@H]1[C@@H]3CC[C@H](O)[C@@]3(C)CC[C@@H]12 328578070 WFQUYBYCFZVLQH-QGYIKEIGSA-N 435.004 4.651 50 10 IJGE CO[C@@H](CO[C@](C)(CI)c1ccccc1Br)C(C)C 389316797 RZJFCRBMSOXUEK-LSDHHAIUSA-N 441.147 4.787 50 10 IJGE C[C@@H]1[C@H]2CC[C@@H](C[C@]13CCC[C@@H](CI)O3)N2C(=O)OC(C)(C)C 686237939 UODORMZWPHZNQH-SUKQMUEJSA-N 435.346 4.537 50 10 IJGE CN(C(=O)c1scc(Br)c1Br)[C@H]1CCC[C@H]1Br 709228355 OGYKKGKTTIPRFC-SVRRBLITSA-N 446.002 4.661 50 10 IJGE C[C@H](Br)[C@@H]1CCN(C(=O)c2cc(Br)c(Br)s2)C1 719965884 DDAHDOVGJMOBJB-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE Cc1cccc2sc(NC(=O)/C(C#N)=C\c3cn(CCC#N)nc3-c3ccccc3)nc12 731598295 GCMXFMAKYRNTEN-AQTBWJFISA-N 438.516 4.928 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)O[C@H]2CCc3ccc(F)cc32)c(-c2ccccc2)n1 749061916 AHXLKXBSLBOAKA-FMTUWFKASA-N 426.451 4.741 50 10 IJGE Cn1cc(C=NNC(=O)c2ccccc2OCc2ccc(F)cc2)c(-c2cccs2)n1 769566571 FHLHZYSTYXXBBT-UHFFFAOYSA-N 434.496 4.631 50 10 IJGE CC(C)(C(=O)NNc1cccc(F)c1F)[C@H](O)c1ccc(OCc2ccccc2)cc1 778931847 GECZXHLBRAHJFG-JOCHJYFZSA-N 426.463 4.747 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2ccc(Cl)c(C(N)=O)c2)c(C)n1-c1ccc(F)cc1 913010845 GMVFVVKZFBRQGW-YBEGLDIGSA-N 436.874 4.531 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc(CN3CCC(Cc4ccccc4)CC3)cc2)cc1 1083921737 RSFXQFLORKAJNV-UHFFFAOYSA-N 441.575 4.914 50 10 IJGE CC(=O)c1ccc(Br)c(NC(=O)NNc2cc(Br)ccc2F)c1 1311142068 XLJHKBIRYSTNNF-UHFFFAOYSA-N 445.086 4.702 50 10 IJGE C#CCOc1cccc(OC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(OC)cc3)c2C)c1 1352969649 RJQQFESQIUIACR-QNGOZBTKSA-N 426.472 4.627 50 10 IJGE C=CCN(CC(=O)OCC)C(=O)/C(C#N)=C/c1cc(C)n(-c2cccc3ccccc23)c1C 1535635029 DITMUOQNYPGYRJ-XQNSMLJCSA-N 441.531 4.732 50 10 IJGE CSc1ccc(NNC(=O)[C@@H](C)SCc2nc(O)c3c(C)c(C)sc3n2)cc1 1636990896 MRJHJHUXKMHKDM-GFCCVEGCSA-N 434.612 4.501 50 10 IJGE Cc1ccc(CNC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(C)cc2)CCC3)cc1 1772744352 BZTGSYZEEXLVNA-UHFFFAOYSA-N 429.520 4.605 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)c1ccc(F)c(F)c1 1865759725 PDZRUSYODXJZIM-UHFFFAOYSA-N 436.245 4.717 50 10 IJGE O=C(O)c1ccc(-c2ccc(/C=N/NC(=O)c3ccc4[nH]c5c(c4c3)CCCC5)o2)cc1 1873498638 ZQDXGDKJABHXLJ-VULFUBBASA-N 427.460 4.769 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1sncc1Br 1915116218 QWPKENXBLXLVPL-NSHDSACASA-N 432.181 4.722 50 10 IJGE C[C@H]1C[C@H](Br)CN(C(=O)c2csc(Br)c2Br)C1 1945186976 PAQXOWJQYRCRBC-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE FC(F)(F)[C@H](CBr)NCc1cc(Br)ccc1Br 2006501135 SFBGJBCTPYNUSF-VIFPVBQESA-N 439.895 4.627 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H](Br)CC3(CC3)C2)c1 2054720268 WZMPGXWFBFAKEV-GFCCVEGCSA-N 438.001 4.961 50 10 IJGE CCCN1CC[C@@H]([C@@H](Br)c2ccccc2OCc2ccccc2)S1(=O)=O 2089515872 TUDGOGYSCQWWNE-PMACEKPBSA-N 438.387 4.516 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@H]1CN(CC1(CBr)CCCCC1)C2 2106786680 VSUAVBMQAKZYHA-UWJYYQICSA-N 429.443 4.959 50 10 IJGE O=C(c1csc(Br)c1Br)N1[C@H]2CC[C@@H]1C[C@H](CCl)C2 2128158607 IDYAIDOJGCAWLI-AYMMMOKOSA-N 427.589 4.895 50 10 IJGE O=C(c1cc(Br)ccc1Cl)N1CCC([C@H](F)CBr)CC1 2163243446 CHKCTXBEXBHGTR-CYBMUJFWSA-N 427.539 4.688 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)C[C@@H]2CCOC2)c1 2252840557 YRTCDZHDWDZQMD-GXSJLCMTSA-N 426.974 4.944 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Cl)c1cn(C)c(Br)n1 2264356455 MPHSMABPFDGXEG-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@@H](Br)c1cnn(C)c1Br 2264366167 FGMXSZYZQIAEFI-LLVKDONJSA-N 428.939 4.982 50 10 IJGE ClC[C@@H]1CCC[C@@H]1NCc1ccc(I)c(Br)c1 2306232378 TZGWIFYKOJRWBF-GWCFXTLKSA-N 428.539 4.551 50 10 IJGE Clc1ccc(I)cc1C[C@@]1(CBr)CCCOC1 2307334244 OFCBPRMUHCTPGU-CYBMUJFWSA-N 429.523 4.679 50 10 IJGE C[C@]12CN(Cc3ccc(Cl)c(I)c3)C[C@]1(CBr)C2 2315555383 QEIKIHGXRIQDOU-UONOGXRCSA-N 440.550 4.552 50 10 IJGE C[C@@H](c1ccccn1)[C@H](Br)c1c(Br)c(Br)nn1C 2316718523 USXNRZFXXBFURM-CBAPKCEASA-N 437.961 4.580 50 10 IJGE Cc1c(Nc2ccc(C=C(C#N)C(=O)Nc3ccccc3)cc2)c(=O)n(-c2ccccc2)n1C 2319694880 ZTMLPMOSGIBKFC-UHFFFAOYSA-N 449.514 4.774 50 10 IJGE CCOc1ccc(CCNC=C(C#N)C(=O)Nc2cccc(Cl)c2C)cc1OCC 2324331471 LPWRZPQWJKTUGN-UHFFFAOYSA-N 427.932 4.624 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)C(C#N)=CNc1ccc(Br)cc1 2325068610 NHJOZYMPROQZBR-HNNXBMFYSA-N 428.330 4.853 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CCC2CCN(C[C@@H]3C[C@@H]3Br)CC2)CC1 2335932405 ISEDYVQYJCITEG-OALUTQOASA-N 429.443 4.909 50 10 IJGE Cn1nc(C(F)F)c(CBr)c1N1CC[C@@]1(C)CCOCc1ccccc1 2339775608 PHSHMJPXKAUYKN-IBGZPJMESA-N 428.321 4.828 50 10 IJGE COc1ccc(Oc2cc(CBr)c(C)cn2)cc1I 2352404500 VQVSTSRULXCBGE-UHFFFAOYSA-N 434.071 4.690 50 10 IJGE Cc1cc(Br)cc(C)c1OCC(=O)N/N=C\c1ccc(Cl)cc1Cl 36093651 CLYTZOVQUSBHMX-WNFQYIGGSA-N 430.129 4.902 50 10 IJGE O=S(=O)(NC[C@@H]1CCC[C@@H]1CCl)c1c(Cl)cc(Br)cc1Cl 91375703 CHHSZQZZUULLBC-BDAKNGLRSA-N 435.598 4.689 50 10 IJGE COc1ccc([C@H](Br)c2ccc(I)cc2)c(OC)c1 104045228 QACFWPFYTIXXTI-OAHLLOKOSA-N 433.083 4.793 50 10 IJGE CCOC(=O)c1ccc(N/C=C(/C#N)C(=O)N[C@@H](CC)c2ccc3c(c2)CCCC3)cc1 217188417 RYXYSYOVCWKATR-JFARUEAUSA-N 431.536 4.829 50 10 IJGE CN(CCCOCc1ccccc1)S(=O)(=O)c1ccc(Cl)c(CCl)c1Cl 383952094 APLWBALZNTYOSX-UHFFFAOYSA-N 436.788 4.960 50 10 IJGE CC[C@H](C)N(CCCl)C(=O)c1cc(I)ccc1Br 385176313 ZOCLCXQRCFPLCZ-VIFPVBQESA-N 444.538 4.533 50 10 IJGE Fc1cc2c(cc1Br)nc(CCCl)n2-c1cnn(Cc2ccccc2)c1 389707905 QAEUNZWCUVPFCR-UHFFFAOYSA-N 433.712 4.953 50 10 IJGE FC(F)Oc1c(CBr)ccc(I)c1C(F)(F)F 575722423 BSLCEFCFAGLSNQ-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE Cc1cc(CBr)cnc1N1C[C@H]2CC[C@H]1[C@H]1CN(Cc3ccccc3)C[C@@H]21 705875529 PEIQTZFFBKXURU-MLNNCEHLSA-N 426.402 4.632 50 10 IJGE CC(=NNC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(OCc2ccc(Cl)cc2)cc1 1084438764 OTAVMOLAJFXGBN-UHFFFAOYSA-N 437.883 4.910 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C(C)(C)c2ccc(Cl)c(Cl)c2)c1C 1319340324 HFVUYVHWESXSJE-UHFFFAOYSA-N 430.339 4.883 50 10 IJGE C=CC[C@@H]1CCCC[C@@H]1NC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1 1470785775 DGAZPDDNPQEEKZ-XXBNENTESA-N 443.551 4.618 50 10 IJGE CC(C)c1ccccc1NC(=S)NNC(=O)c1ccc(-c2cccc(Cl)c2)nc1O 1568234235 OKKOGUZEUXKPQD-UHFFFAOYSA-N 440.956 4.862 50 10 IJGE Cc1ccc(C(=O)NNc2nc3ccccc3[nH]c2=S)cc1NC(=O)OC(C)(C)C 1633439939 PWFWTALKOMUELH-UHFFFAOYSA-N 425.514 4.705 50 10 IJGE Cc1c(Cl)cccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccncc1)CCC2 1772745486 BQHYBWVIIAJCBP-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE CCOc1cc(C=NNC(=O)COc2cc(C)c(Br)cc2C(C)C)ccc1O 1772754775 UUMKKDXKQPJGJF-UHFFFAOYSA-N 449.345 4.514 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1cc(C)ccc1O)C(C#N)=C(N)O2 1865687212 MBFKHAKIYJZBTR-NRFANRHFSA-N 434.927 4.770 50 10 IJGE CCCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3C)cc1OC 1865695753 SKNSRBOREMVECU-JOCHJYFZSA-N 444.535 4.883 50 10 IJGE CCCc1nn(-c2cccc(Cl)c2)c2c1[C@@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865713312 WIYAVSZJPHGLTJ-IBGZPJMESA-N 435.871 4.605 50 10 IJGE CC[C@H](Br)CCCNC(=O)c1csc(Br)c1Br 1945186701 KQGBOMPRPMSXTQ-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE O=S(=O)(c1ccc(CBr)cc1Cl)N(Cc1ccccc1)CC(F)F 2009622053 MUQPEBNJOUKLHF-UHFFFAOYSA-N 438.721 4.691 50 10 IJGE BrC[C@@H]1CC2(CC2)CN1Cc1c(Br)cccc1Br 2037825262 NTFWQFWJJBQYPX-JTQLQIEISA-N 438.001 4.961 50 10 IJGE CN(C[C@@H](Br)CCc1cc(Cl)ccc1I)C1CC1 2038113647 ZTPNITMBBLSBBE-NSHDSACASA-N 442.566 4.735 50 10 IJGE CC[C@H](Br)CN(CC)C(=O)c1ccc(I)c(Cl)c1 2044549495 AOLZQLYPKASFOU-JTQLQIEISA-N 444.538 4.580 50 10 IJGE BrC[C@@H]1C[C@H]2CN(Cc3c(Br)cccc3Br)C[C@@H]12 2053980537 HKCQCAJBTUVTJR-DCAQKATOSA-N 438.001 4.674 50 10 IJGE COc1cc(Cn2nc(CBr)c(Br)c2C(F)(F)F)ccc1C 2079232953 JCEPAPHVFRTNTC-UHFFFAOYSA-N 442.073 4.925 50 10 IJGE CS(=O)(=O)c1csc([C@H](Br)c2ccc(F)c(Br)c2)c1 2093074475 MFKIQYXKKLMPNL-GFCCVEGCSA-N 428.142 4.538 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CCN(CC3(CBr)CCCCC3)CC[C@H]2C1 2106783671 BWUMTZQIORIWOQ-HDICACEKSA-N 429.443 4.911 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC2(CC[C@H]1CBr)CC2 2115926520 UKYIOZIYIIAIJY-QMMMGPOBSA-N 427.589 4.944 50 10 IJGE O=C(NC12CCC(CCl)(CC1)C2)c1scc(Br)c1Br 2132783498 ZRGBCKHYDDJZDX-UHFFFAOYSA-N 427.589 4.945 50 10 IJGE O=C(N[C@@H]1C[C@H]2CC[C@H]1[C@@H](Cl)C2)c1csc(Br)c1Br 2139711441 BKFLMBXOZPBNMT-ZRUAGYDASA-N 427.589 4.799 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2151243312 KRJVCDPRAASVPP-ZBYYUNFXSA-N 427.386 4.849 50 10 IJGE CC(C)N(C[C@@H]1CCCN(C(=O)[C@H](Br)C2CCCC2)C1)C(=O)OC(C)(C)C 2167033378 QYFPZRUSXJTZDU-SJLPKXTDSA-N 445.442 4.824 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1C1CCN(C(=O)[C@@H](Br)C2CCCC2)CC1 2167034460 RXMIDRKDPWJQSP-MSOLQXFVSA-N 443.426 4.578 50 10 IJGE CN(Cc1ccccc1)CC1CCN(c2ccc(CBr)c([N+](=O)[O-])c2)CC1 2188575276 YPDBAFLIVFFVHD-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE Cc1sc(Br)c(C(=O)N2[C@H]3CC[C@H]2[C@@H](F)[C@@H](Br)C3)c1C 2190680962 ZZRDHKVLURTZTI-GMOBBJLQSA-N 425.161 4.606 50 10 IJGE Cc1c(N2C[C@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)ccnc1CBr 2205638213 SALYZDUBQULDFU-DHIUTWEWSA-N 426.402 4.777 50 10 IJGE Cc1sc(C(=O)N2CCC(F)(F)[C@H](CBr)C2)c(Br)c1C 2237623543 KLOCNKSYLWFPTA-SECBINFHSA-N 431.140 4.620 50 10 IJGE COc1ccc([C@H](Br)CC[C@H]2CCOC2)cc1I 2257367813 ODVPGGDUDBWSAM-CMPLNLGQSA-N 425.104 4.553 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1C(=O)c1ccc(Br)cc1Br 2260376563 AMLHQKQNQCYLPW-JQWIXIFHSA-N 439.973 4.600 50 10 IJGE C[C@@](CI)(OCc1cccnc1)c1ccccc1Br 2279027998 DYDJTFCPBXWGJH-HNNXBMFYSA-N 432.099 4.711 50 10 IJGE CC(=Cc1ccccc1)C=C(NC(=O)c1ccccc1)C(=O)NN=C(C)c1ccccc1O 2297455724 IAVPMFYZZSHZEZ-UHFFFAOYSA-N 439.515 4.650 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)COc2cc(C)ccc2C(C)C)cc1 2314777898 ZPMVDCXLJZCGLE-UHFFFAOYSA-N 434.536 4.926 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccc(C(F)(F)F)s1 2320357160 WZHURAOSFRJUMD-ZDUSSCGKSA-N 436.293 4.867 50 10 IJGE CC[C@H]1[C@@H](CCl)CCN1Cc1ccc(I)c(Br)c1 2325211664 AHHABFWIJMAEOW-RISCZKNCSA-N 442.566 4.893 50 10 IJGE CCCc1sc(Br)cc1[C@@H](Br)[C@H]1C[C@H](S(C)(=O)=O)C1 2338016861 GHWXPJFKTOZNCV-RVBZMBCESA-N 430.227 4.722 50 10 IJGE Cc1cccc(C(=O)NC(C)(C)[C@@H](Br)C(C)C)c1I 2340407066 RFYFPNYIXWHJMV-ZDUSSCGKSA-N 438.147 4.528 50 10 IJGE CCC(CBr)(CBr)NC(=O)c1c(Cl)cc(C)cc1Cl 2353134296 UXYXLAULHNMKHK-UHFFFAOYSA-N 431.983 4.970 50 10 IJGE FC(F)(F)c1sccc1CNCC(F)(F)C(F)(F)CI 2361682474 STDBRHQJKPBFDC-UHFFFAOYSA-N 435.146 4.562 50 10 IJGE F[C@@]12CCC[C@@]1(CCl)CN(Cc1cc(I)ccc1Cl)C2 2380527230 KMLBYEIBCXMMQS-HUUCEWRRSA-N 428.116 4.878 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2ccc(OCC)cc2)sc2c1CC[C@H](C)C2 1965194 QXBFSGIKYGFNIP-SUCHYCSPSA-N 438.549 4.994 50 10 IJGE CCc1cc(C)cc(OCC(=O)N/N=C/c2cccn2-c2ccc(Br)cc2)c1 59250070 SKMNWRHAVDECSS-ZVHZXABRSA-N 440.341 4.640 50 10 IJGE CCC/C(=N/NC(=O)[C@@]1(C)CC1(Br)Br)c1ccc(Cl)cc1 96438422 PRRIMQPMYSKYET-VCRXTVNUSA-N 436.575 4.857 50 10 IJGE CCCOc1c(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4)nc3c2)cccc1OC 169926857 FELFUHVGTHKOOB-WGOQTCKBSA-N 428.492 4.791 50 10 IJGE COc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4)nc3c2)c(Cl)c1OC 169926962 KAPSCTBTMVHPAF-DHRITJCHSA-N 434.883 4.664 50 10 IJGE CCCOc1ccc(/C=N/NC(=O)c2cc(-c3ccccc3)nc(N3CCCCC3)n2)cc1 169927436 KMKOIEZZFQELSE-ZXVVBBHZSA-N 443.551 4.687 50 10 IJGE CC(C)C[C@@H](Br)CNC(=O)c1cc(Br)sc1Br 232583777 JUNDFCLNQMUNNN-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE CC(=NNC(=O)c1ccccc1[N+](=O)[O-])c1ccc(NC(=O)c2ccc(Cl)cc2)cc1 252616904 KIEJWYUEGQFEEZ-UHFFFAOYSA-N 436.855 4.655 50 10 IJGE O=C(CN(Cc1ccccc1)Cc1ccccc1)NN=Cc1cc(Cl)cc(Cl)c1O 254303985 RMCIQZDBPGZZDM-UHFFFAOYSA-N 442.346 4.852 50 10 IJGE O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)NN=C/C=C\c1ccccc1 254515692 LCZAOQXPIKJIQX-NOKLIFBQSA-N 439.544 4.842 50 10 IJGE O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)NN=C/C=C/c1ccccc1 254515693 LCZAOQXPIKJIQX-NPXJLPTFSA-N 439.544 4.842 50 10 IJGE C[C@H](CNC(=O)c1cc(Br)cc(Br)c1)C[C@@H](C)Br 397814910 FGPLPCLPGXVHLS-DTWKUNHWSA-N 441.989 4.751 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1C(=O)c1cc(Br)c(Br)s1 705503168 VSUPQEIHGOKQEU-RQJHMYQMSA-N 446.002 4.661 50 10 IJGE CCC[C@H](CCBr)NC(=O)c1cc(Br)sc1Br 716962605 RUJWNFVGFKFIBO-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE CCc1c(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cnn1-c1ccc(Cl)cc1 799753744 QDWVVKIETISTEY-UHFFFAOYSA-N 433.821 4.735 50 10 IJGE C[C@H](CBr)[C@@H]1CCCCN1c1ncc(Br)cc1Br 829246447 LJNHJXNVENQVLV-SKDRFNHKSA-N 441.005 4.997 50 10 IJGE Cc1ccccc1SCC(=O)NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21 1084015369 CMKVKKBQCKKQAN-UHFFFAOYSA-N 449.963 4.808 50 10 IJGE C#CCCCC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccc(-c2ccccc2)cc1 1178772740 FPACZEGXCBLGHN-UHFFFAOYSA-N 448.526 4.771 50 10 IJGE C=CCNC(=O)c1ccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 1356379559 HSUYQBLWZQFRLB-QNGOZBTKSA-N 442.494 4.695 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)Nc1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 1469491151 JSGPRKUVJRBSKW-GOSISDBHSA-N 436.434 4.757 50 10 IJGE COc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)Nc3cc(C)cc(C)c3)c(C)c21 1772746184 RGQJQSDCSSROGJ-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE CCOc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccs2)CCC3)cc1 1772750098 XLURKHGCSZNZET-UHFFFAOYSA-N 437.521 4.771 50 10 IJGE COc1ccc(-n2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2ccc(Cl)cc2)cc1 1865683773 PFDDHXDQOAFVID-MRXNPFEDSA-N 446.816 4.771 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(Br)cc1 1865714125 DEMLRQPQDKZJHW-SFHVURJKSA-N 435.325 4.941 50 10 IJGE COc1ccc([C@@H](C(=O)N[C@H](C)C(=O)Nc2ccc(SC#N)cc2)C2CCCC2)cc1 1867003360 FHFDMOUNRYHHQY-ZHRRBRCNSA-N 437.565 4.686 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cccc(C(F)(F)F)c1 1914341590 MEALYDCZEAIXOT-CYBMUJFWSA-N 436.293 4.680 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1ccc(Br)cc1O 1915133309 SDMJMWFEWWUJDS-CYBMUJFWSA-N 441.163 4.971 50 10 IJGE Cc1cc(Br)sc1[C@@H](Br)c1cn(C)nc1Br 1981646364 IRNGMWAJNUMUCN-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE BrCc1cc(Br)ccc1OCCOCCOCc1ccccc1 1983395643 UJUKDISDUCETMN-UHFFFAOYSA-N 444.163 4.956 50 10 IJGE C[C@H]1C[C@H](Br)CCN1Cc1cc(Br)ccc1Br 2006498635 FBCMLJYWUPTMPY-JOYOIKCWSA-N 425.990 4.959 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@@H]1Cc1cc(Cl)ccc1I 2007129384 TUBRMFDYOZXYJQ-OUJBWJOFSA-N 429.523 4.676 50 10 IJGE COc1ccc([C@H](Br)c2cc(I)sn2)c(Cl)c1 2007646401 XMQJAWOSWVUGDJ-NSHDSACASA-N 444.519 4.894 50 10 IJGE CC1(C)OCCO[C@H]1[C@H](Br)c1cc(Br)sc1Br 2013744698 OGEKLESEQJBWTC-BDAKNGLRSA-N 449.002 4.903 50 10 IJGE CN(C(=O)c1cccc(Br)c1Br)[C@H]1CCC[C@H]1Br 2031477427 LULKMHDYRUVTBF-KOLCDFICSA-N 439.973 4.600 50 10 IJGE CC(C)[C@H](Br)CN(C)C(=O)c1c(Br)cccc1Br 2048728460 QQDGELSCPKCFIU-LLVKDONJSA-N 441.989 4.703 50 10 IJGE COCCOc1ccc([C@H](Br)[C@@H]2C[C@H]2Br)cc1Br 2076168618 ALBVFINHVCAWDX-BREBYQMCSA-N 442.973 4.694 50 10 IJGE COc1ccc(Cn2nc(CBr)c(Br)c2C(F)(F)F)cc1 2079231064 VPGXEZUCMFSZHK-UHFFFAOYSA-N 428.046 4.616 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2C1[C@@H]2CN(Cc3ccccc3)C[C@@H]12 2096805021 ZVJRBCQFGMUSHB-HUUCEWRRSA-N 431.765 4.544 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1N(C)C[C@@H](CBr)c1ccccc1 2106780612 AHWUYWIMJAOCIK-QRQLOZEOSA-N 425.411 4.742 50 10 IJGE Br[C@@H]1CC[C@@H]2CCCN(Cc3ccc(I)cc3)[C@@H]2C1 2110680850 XACHFHSISIPHHY-SQWLQELKSA-N 434.159 4.819 50 10 IJGE CCC[C@@H](CBr)CN1CCC[C@@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2129045861 WTFFIOPWRSBMAP-LSDHHAIUSA-N 429.403 4.747 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@H]1Cl)c1csc(Br)c1Br 2150344915 WIRBUVKPRLQCGR-ZYHUDNBSSA-N 435.568 4.908 50 10 IJGE CN(c1nc2ccccn2c1CBr)[C@H]1CN(Cc2ccccc2)C(C)(C)C1 2154829625 IDQDAYCVFVXDMZ-GOSISDBHSA-N 427.390 4.719 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(CBr)cc2)[C@H]2CCCC[C@@H]21 2162912295 TZLDJPHXSZRHQS-ROUUACIJSA-N 437.378 4.586 50 10 IJGE C[C@H]1CN(c2cc([N+](=O)[O-])ccc2CBr)[C@H](C)[C@H](C)N1Cc1ccccc1 2176905497 XPTQDWDJIQBONV-YESZJQIVSA-N 432.362 4.977 50 10 IJGE CN[C@H](c1c(Br)cc(C)c(Br)c1C)[C@@H]1C[C@@H]1Br 2214654183 ZGQHTYQVBPUNJZ-ZDMBXUJBSA-N 425.990 4.872 50 10 IJGE C[C@@H]1[C@H](C(F)(F)F)N(CCCCCCBr)CCN1C(=O)OC(C)(C)C 2223289498 IQQYXMIJIUWUIV-ZIAGYGMSSA-N 431.337 4.814 50 10 IJGE Cc1nc(-c2ccc(I)cc2)nc(C)c1C[C@H](C)CBr 2237092202 FXOWCMPCAYYGJJ-JTQLQIEISA-N 445.142 4.939 50 10 IJGE CSCC[C@H](Br)CCNC(=O)Cc1ccc(Br)cc1Cl 2237448407 LBTSENUHEHFISH-LLVKDONJSA-N 443.632 4.668 50 10 IJGE O=c1c(Br)cc(Br)cn1CCCCCCCBr 2252647977 VLWQHNZHRCFVNP-UHFFFAOYSA-N 429.978 4.719 50 10 IJGE CC(C)[C@H]1[C@@H](Br)CCN1C(=O)c1cc(F)c(Br)cc1Cl 2282968348 VDWQDBMTMYNVIC-ZANVPECISA-N 427.539 4.876 50 10 IJGE COCc1ccccc1[C@H](Br)c1ccc(OC)c(I)c1 2285004577 UEGPBLLEMRUFRI-MRXNPFEDSA-N 447.110 4.931 50 10 IJGE O=C(N[C@@H]1CC[C@H]2C[C@@]21CBr)c1cc(Br)c(F)cc1Cl 2285963905 RAVSBVAIYTZLSY-AAAAQAOESA-N 425.523 4.535 50 10 IJGE C[C@@H]1C[C@@H]1N(CCBr)Cc1ccc(Cl)c(I)c1 2300242105 GTRIWODMGLMVDC-RNCFNFMXSA-N 428.539 4.550 50 10 IJGE CC(C)(CI)CN(CCCNC(=O)OC(C)(C)C)c1ccccc1 2306819629 WKQODJJIEXFOPC-UHFFFAOYSA-N 446.373 4.869 50 10 IJGE CC(C)N1C[C@@H](C(O)=C(C#N)c2nc(-c3ccc(Br)cc3)cs2)CC1=O 2331260564 OLPRDXVNNTUPER-ZDUSSCGKSA-N 432.343 4.622 50 10 IJGE CC1(C)CCC[C@@]1(CCl)NC(=O)c1ccc(Cl)cc1I 2365591751 IMKMYZDSNMIRMI-HNNXBMFYSA-N 426.125 4.862 50 10 IJGE O=C(NNc1ccccc1)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F 107061274 LWAJKDYXZMHCIM-UHFFFAOYSA-N 436.196 4.571 50 10 IJGE COc1ccc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)cc1Br 169890023 XFRQEBVBWFXNBB-FMCGGJTJSA-N 426.314 4.582 50 10 IJGE CCCn1c(CBr)nnc1-c1ccc(Br)cc1Br 233394789 WDWNQNOPOZKFDE-UHFFFAOYSA-N 437.961 4.775 50 10 IJGE CCC(CC)N(CCBr)S(=O)(=O)c1c(Cl)cccc1Br 380133783 TYTXZPPKEWVDCD-UHFFFAOYSA-N 447.620 4.677 50 10 IJGE Oc1cc(Cl)ccc1[C@@H]1CN(Cc2ccccc2)C[C@H]1CI 382677830 ZYZQZCJQPCHLQR-RHSMWYFYSA-N 427.713 4.696 50 10 IJGE CC(C)(C)C[C@@H](CBr)NS(=O)(=O)c1ccc(Br)cc1Cl 393484189 KBDSRYOXDQEKQP-JTQLQIEISA-N 447.620 4.581 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)/C=C(/c2ccc(Cl)cc2)C(F)(F)F)c1C 771023066 PUDYVMSRTVEUTE-YVLHZVERSA-N 447.848 4.898 50 10 IJGE O=C(COc1ccccc1-c1ccccc1)NN=C1CCC(O)(c2cccc(F)c2)CC1 783798753 MFCSNXCIJFFCHW-UHFFFAOYSA-N 432.495 4.806 50 10 IJGE O=C(NNc1ccc(OCc2ccccc2)cc1)c1cc2c(C(F)(F)F)cc(O)nc2o1 1453859476 VYMOOKVVIRUMJA-UHFFFAOYSA-N 443.381 4.888 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1 1622854499 HFIOSRWFGMFFGE-KRWDZBQOSA-N 425.529 4.756 50 10 IJGE Cc1cc(C)cc(OC(=O)c2oc3c(c2C)C(=NNC(=O)Cc2ccccc2)CCC3)c1 1772747999 HNMNACMIRQQXGT-UHFFFAOYSA-N 430.504 4.823 50 10 IJGE C[C@@H](Br)C(=O)c1cc(I)ccc1SC(F)(F)F 1848425820 DOLSGTXUJHAHJF-RXMQYKEDSA-N 439.034 4.869 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]3(CCC[C@H](CI)O3)CC[C@@H]21 1935705000 BJUPSZIDYHZWDY-BSXFFOKHSA-N 435.346 4.539 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1Cc1cc(Cl)ccc1I 2018105820 YJBUUSLWJHPKQX-ZANVPECISA-N 428.539 4.692 50 10 IJGE CC1(C)[C@@H](CBr)CCN1Cc1cc(Cl)ccc1I 2034137777 PFWWOVYMYGYFDL-LLVKDONJSA-N 442.566 4.940 50 10 IJGE C=CCC[C@H](CBr)NC(=O)c1c(Br)cccc1Br 2075336566 WLWDNCDDSJFTMP-SECBINFHSA-N 439.973 4.671 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCCN1C[C@H](CBr)c1ccccc1 2106786544 VEBMUCKHVKVALD-YTQUADARSA-N 425.411 4.933 50 10 IJGE Br[C@H](Cc1ccc2c(c1)CCO2)c1cccc(I)c1 2112337414 FHUKJPDCWQDSIT-OAHLLOKOSA-N 429.095 4.905 50 10 IJGE O=C(c1cc(Cl)cc(Br)c1)N1CC[C@H](Br)C(F)(F)CC1 2150019964 WQFSXFQWYYXWLW-NSHDSACASA-N 431.502 4.737 50 10 IJGE CC(C)(C)OC(=O)N1Cc2ccc(CNC(=O)[C@@H](Br)C3CCCC3)cc2C1 2167040437 RKQOUNFRAKUTNJ-SFHVURJKSA-N 437.378 4.507 50 10 IJGE CC[C@H](Br)[C@H]1CCCCN1S(=O)(=O)c1cc(C)c(Br)s1 2170612130 GSHWBNCSKFGWHI-WDEREUQCSA-N 445.242 4.536 50 10 IJGE CC(C)(C)C[C@H]1CCN1S(=O)(=O)c1cc(CBr)sc1Br 2179786397 ZYNZNLSKVOILNV-SECBINFHSA-N 445.242 4.605 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CCC(OCCCBr)CC1 2207532992 ZDHVEVNQLZGLLJ-UHFFFAOYSA-N 445.604 4.570 50 10 IJGE CC(F)(F)C[C@H](CBr)NC(=O)Cc1ccc(Br)cc1Cl 2237436287 JHNFOSVDGUKHLE-SNVBAGLBSA-N 433.518 4.570 50 10 IJGE Cc1sc(C(=O)N2CCC([C@@H](F)CBr)CC2)c(Br)c1C 2237619134 BDVYPXCIPYNYNO-NSHDSACASA-N 427.177 4.713 50 10 IJGE O=C(Nc1ccc(CCBr)cc1)c1c(F)cccc1I 2282801213 IFZJEYTYSGNITR-UHFFFAOYSA-N 448.073 4.620 50 10 IJGE Cc1ccc(N2C[C@@]34CCC[C@]3(CN(Cc3ccccc3)C4)C2)c(CBr)n1 2287163827 STIYPVZNSZXXNQ-GOTSBHOMSA-N 426.402 4.777 50 10 IJGE CC[C@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@H]1Br 2300237889 DKCPJRLZGAKZQI-WDEREUQCSA-N 428.539 4.550 50 10 IJGE C[C@@H](Br)[C@H]1CCN(Cc2ccc(Cl)c(I)c2)C1 2300240692 PCHAVQDRFXYJAS-KOLCDFICSA-N 428.539 4.550 50 10 IJGE Cc1ccc(Sc2ccc(C=C(C#N)C3=NN(c4ccccc4)[C@@H](N)[C@H]3C#N)o2)cc1 2313560457 UGDYPXUFXOKCTA-XUZZJYLKSA-N 425.517 4.947 50 10 IJGE Cc1cccc(COc2ccc(C=C(C#N)C(=O)NCc3ccc4c(c3)OCO4)cc2)c1 2313671206 QGEZQGFFUNHTEE-UHFFFAOYSA-N 426.472 4.526 50 10 IJGE N#CC(=Cc1ccc(OC(=O)CCCN2C(=O)c3ccccc3C2=O)cc1)c1ccccc1 2320507351 RVQOPYMDSKFJOJ-UHFFFAOYSA-N 436.467 4.733 50 10 IJGE CCn1c(C)c(C=NNC(=O)c2cccn(Cc3cccc(Cl)c3)c2=O)c2ccccc21 2323652765 YKNRXZUGPFIKEX-UHFFFAOYSA-N 446.938 4.597 50 10 IJGE COCCOc1ccc(C=C(C#N)C(=O)NC2CCC(c3c[nH]c4ccccc34)CC2)cc1 2331119004 WOVJNKIBEGYAGW-UHFFFAOYSA-N 443.547 4.943 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](CC(F)(F)F)C1 2353826448 MTFXUUCGOBTUPY-CABCVRRESA-N 445.364 4.917 50 10 IJGE Cc1cc(C(=O)N2CC[C@@H](Br)C[C@H]2C(F)(F)F)sc1Br 2361454283 HWAOMOGNPJBVTR-APPZFPTMSA-N 435.103 4.749 50 10 IJGE Cc1cnc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)cc1CBr 2380364282 CPSZGYWDTUQFFN-ZDFPQIBNSA-N 426.402 4.632 50 10 IJGE Cc1cccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2F)c1C 38652175 SLLKAGVGOZRVNY-VWLOTQADSA-N 444.462 4.645 50 10 IJGE COc1cccc(O[C@H](C)C(=O)N/N=C/c2ccc(OCc3ccccc3Cl)cc2)c1 40960632 SFMZSNMXJIYCOX-CIRUFVMISA-N 438.911 4.845 50 10 IJGE C[C@@H](CCCBr)NC(=O)c1cc(Br)cc(Br)c1 235065702 MJPWSUIQSFBUNR-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE O=C(NCCCCCCI)c1cccc(Br)c1Cl 236026042 BETWHETYGPLMNT-UHFFFAOYSA-N 444.538 4.828 50 10 IJGE CCN(C[C@](C)(CBr)OC[C@@H]1C[C@H]2CCCC[C@@H]2O1)C(=O)OC(C)(C)C 380803942 LCFWSTZHXZUGIB-YLAKUSLOSA-N 434.415 4.761 50 10 IJGE CO[C@@H](CO[C@@H](CI)c1ccccc1Br)C(C)C 380979445 YLCZXUYJWMFHRG-KBPBESRZSA-N 427.120 4.613 50 10 IJGE Nc1cccc(Cl)c1[C@@H]1CN(Cc2ccccc2)C[C@H]1CI 382715608 KBPPUJIBYCQNOH-HUUCEWRRSA-N 426.729 4.573 50 10 IJGE C[C@H]1[C@@H](C)N(c2nc3ccccn3c2CBr)C[C@@H](C)N1Cc1ccccc1 404261075 DMOJEVTVAJCZBA-FGTMMUONSA-N 427.390 4.717 50 10 IJGE FC(F)C1([C@H](Br)c2cc(I)cc3c2OCC3)CC1 697572076 FJMVBXACDQWHDD-LLVKDONJSA-N 429.042 4.707 50 10 IJGE O=C(NNC(=O)c1ccc(COc2ccccc2)o1)NC(C1CCCC1)C1CCCC1 735512041 KUEJRWRMFNPLKF-UHFFFAOYSA-N 425.529 4.552 50 10 IJGE COc1ccc(Cl)cc1[C@H](CC(C)C)NC(=O)NNC(=O)c1cn(C)c2ccccc12 738449989 IVOHXQMVTPPMJR-IBGZPJMESA-N 442.947 4.572 50 10 IJGE Cc1ccc(-n2nc(C)c(CC(=O)NNc3cccc(C(F)(F)F)n3)c2C)cc1Cl 740141823 PXVRYRHTYLBKKN-UHFFFAOYSA-N 437.853 4.551 50 10 IJGE CCc1c(C)nn(-c2cccc(C(=O)NNc3ccc(F)cc3Br)c2)c1C 767083623 ANDBMQCQLCQCMT-UHFFFAOYSA-N 431.309 4.710 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccccc2Oc2ccccc2C#N)c1C 778506027 KNESUTSJNUGLLC-UHFFFAOYSA-N 436.475 4.576 50 10 IJGE CC[C@H](NC(=O)NNc1ccc(C#N)cc1C(F)(F)F)c1nc(C(F)(F)F)cs1 799598008 WFDSLKFUPGFXMC-JTQLQIEISA-N 437.369 4.830 50 10 IJGE O=C(NN=Cc1ccc(Br)c2cccnc12)c1ccc(Br)cc1 1116489195 KYOPEPLZLCZRIH-UHFFFAOYSA-N 433.103 4.524 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2ccc(-n3ccc(O)n3)cc2)c(C)n1-c1ccccc1F 1470668932 BBEPEVRBDAAHTP-XMHGGMMESA-N 441.466 4.670 50 10 IJGE CC(=O)c1ccc(CCNC(=O)NNc2cc(C(F)(F)F)ccc2Br)cc1 1479621078 CCEVIJMBTXLZDZ-UHFFFAOYSA-N 444.251 4.539 50 10 IJGE C#C[C@H](NC(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1)c1ccccc1 1682351865 CGORNXFOSJRPAQ-QHCPKHFHSA-N 447.922 4.546 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccccc2Cl)[C@H]1c1ccccc1F 1865682896 ADVNHGATDWXHFY-HNNXBMFYSA-N 434.780 4.902 50 10 IJGE CCCc1nn(Cc2ccccc2)c2c1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865705993 LKUGGCLCUZLUPF-HXUWFJFHSA-N 449.898 4.664 50 10 IJGE C[C@@H]1[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 1882087938 NGMLOKVVBLHXRC-DGXTUMSLSA-N 447.414 4.699 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)[C@H]1CCCN(C(=O)OC(C)(C)C)[C@H]1C(F)(F)F 1892594543 YMPJTBHIFJGUIS-JHJVBQTASA-N 430.895 4.697 50 10 IJGE C[C@@H](Br)C(C)(C)CNC(=O)c1c(Br)cccc1Br 1913833703 MJGVJWUKMLATEH-MRVPVSSYSA-N 441.989 4.751 50 10 IJGE CC(C)(C)OC(=O)NCCN(Cc1ccccc1)CC1(CBr)CCCC1 1953585069 SLUVMNADUQTLJF-UHFFFAOYSA-N 425.411 4.969 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1ccc(Br)c2cccnc12 1984040994 UZGRXAPMQAVNPF-GFCCVEGCSA-N 444.167 4.828 50 10 IJGE O=C(NC1CCN(C[C@@H](CBr)c2ccccc2)CC1)OCc1ccccc1 1999493904 IKKNXXFQDNZCLP-HXUWFJFHSA-N 431.374 4.556 50 10 IJGE CC(C)N(C[C@@H](C)Br)C(=O)c1cccc(Br)c1Br 2031477374 LCRVARFPIDKZAM-SECBINFHSA-N 441.989 4.846 50 10 IJGE O=C(NC[C@H]1CCC[C@@H]1Br)c1c(Br)cccc1Br 2033094259 NPFIZTUVWUXGSO-BDAKNGLRSA-N 439.973 4.505 50 10 IJGE Oc1nc2cc([C@H](Br)C3(Br)CCC3)c(Br)cc2[nH]1 2049230417 UHHVAEQLOGPXLP-JTQLQIEISA-N 438.945 4.785 50 10 IJGE Cc1c([C@@H](Br)Cc2ccc(Br)cc2)nn(C)c1Br 2049255490 JMIXQRJXEDYZEL-NSHDSACASA-N 436.973 4.932 50 10 IJGE CN(C(=O)c1scc(Br)c1Br)[C@H](CCCl)C(F)F 2058229432 PGTCSBPANKXBCU-ZCFIWIBFSA-N 425.520 4.608 50 10 IJGE O=C(N[C@H]1C[C@H](CCBr)C1)c1cc(Br)ccc1Br 2078354669 RDJXERMFLHHCSB-CZMCAQCFSA-N 439.973 4.505 50 10 IJGE CC[C@H](NC(=O)c1ccc(Br)cc1I)[C@H](Cl)CC 2086152269 ZFDSVPJYRMDKDD-PWSUYJOCSA-N 444.538 4.580 50 10 IJGE Brc1cccc([C@H](CI)OCCOC2CCCC2)c1 2087343489 CIJPYXUKQTULIU-HNNXBMFYSA-N 439.131 4.901 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCCC2)C[C@@H](CBr)C2CCC2)C1 2106783666 BUKYVTCRHCBLDS-GOSISDBHSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCCC2)C[C@H](CBr)C2CCC2)C1 2106783667 BUKYVTCRHCBLDS-SFHVURJKSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)NCCN(C[C@@H](CBr)c1ccccc1)C1CCCC1 2130068711 XSIWTBNHYAGCHY-GOSISDBHSA-N 425.411 4.934 50 10 IJGE CCN(CC1(CBr)CCOCC1)[C@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2163058837 OCLWODKORBLTTP-ROUUACIJSA-N 447.458 4.584 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C(=O)[C@@H](Br)C2CCCC2)C2(CCCCC2)C1 2167035004 ZMNZFBVDZKSSHH-SJORKVTESA-N 443.426 4.769 50 10 IJGE CN(CC1CC(Br)C1)C(=O)CC[C@@H](CCNC(=O)OC(C)(C)C)C(C)(C)C 2196907110 NPPJXHUIIGBMFZ-CGZBRXJRSA-N 447.458 4.976 50 10 IJGE CCn1cc([C@@H](Cl)c2cc(Br)c(OC)cc2F)nc1Br 2202910053 ITHXNAFZMCDLAI-LBPRGKRZSA-N 426.511 4.904 50 10 IJGE Cc1cc([C@@H](Br)c2ccc3c(c2)CC(=O)N3)ccc1I 2207106334 XDOITOOCYJWSRG-MRXNPFEDSA-N 442.094 4.579 50 10 IJGE Cc1c(CBr)cccc1NC(=O)c1csc(I)c1 2256328193 XNBLXLSJXSBLQZ-UHFFFAOYSA-N 436.112 4.808 50 10 IJGE COc1ccc([C@@H](Br)[C@@]23CCC[C@@H](C2)OC3)cc1I 2269554380 XXRMDQAQTQFXEC-GLQYFDAESA-N 437.115 4.695 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@@]1(C)CBr 2285844977 UBHNSIGDSPXTST-XLKFXECMSA-N 427.539 4.735 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC=C(C#N)c1nc(-c2cc3ccccc3oc2=O)cs1 2297321253 WPRPZINVPNGQJH-UHFFFAOYSA-N 446.444 4.810 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2F)ccc1OCc1ccccc1 2297551676 YRPOVSVMWNOLLT-UHFFFAOYSA-N 447.422 4.867 50 10 IJGE Clc1ccc(CN[C@@H](CCBr)C2CC2)c(I)c1 2302337655 ZLGOWOLGYBJYIP-ZDUSSCGKSA-N 428.539 4.598 50 10 IJGE CCOc1cc(Br)c(C=C(C#N)C(=O)Nc2ccc(CC)cc2)cc1OC 2313667730 UFHJUGDXSNCVNO-UHFFFAOYSA-N 429.314 4.964 50 10 IJGE C=CC[C@H](Br)[C@@H]1CCN1Cc1cc(Cl)ccc1I 2314264720 CJPLICBTMJPERN-JSGCOSHPSA-N 440.550 4.859 50 10 IJGE Cc1c(CBr)ccc(NS(=O)(=O)CCCOCc2ccccc2)c1C 2319470170 QDRILLSCZVHFGI-UHFFFAOYSA-N 426.376 4.547 50 10 IJGE C[C@H](C(O)=C(C#N)c1nc(-c2ccc(F)c(F)c2)cs1)N1C(=O)c2ccccc2C1=O 2331351736 UGEPUPRHUCIFKP-LLVKDONJSA-N 437.427 4.566 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CN(C[C@]1(CBr)CC1(F)F)CC2 2351889357 UKKWJOHNLPEWNB-GOSISDBHSA-N 431.321 4.812 50 10 IJGE CC(C)Oc1ccc(Br)cc1C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 14668055 GJQUGZFBHYDJIY-UHFFFAOYSA-N 433.346 4.609 50 10 IJGE CCCCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1OC 35519667 OPFABGOVBWSYKE-XNTDXEJSSA-N 429.860 4.981 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4cc(C)cc(C)c4)ccc32)cc1 38649255 OETSDOQUTIPSAF-SANMLTNESA-N 440.499 4.814 50 10 IJGE Cc1cc(C)cc(Nc2ncnc(NNC(=O)C(c3ccccc3)c3ccccc3)c2N)c1 40682113 HEDPOPMDNWABGH-UHFFFAOYSA-N 438.535 4.694 50 10 IJGE CCc1ccc(Oc2ncnc(NNC(=O)C(c3ccccc3)c3ccccc3)c2N)cc1 40794996 CKOLPAMHPROIPN-UHFFFAOYSA-N 439.519 4.689 50 10 IJGE COc1cc(CBr)c([N+](=O)[O-])cc1OCc1cc(Br)cs1 43687902 DLIKYQQHTTWNBF-UHFFFAOYSA-N 437.109 4.901 50 10 IJGE C#CCOc1ccc(/C=N/NC(=O)[C@@H](C)c2ccc(CC(C)C)cc2)cc1Br 59146975 LASFMARCWQNLCZ-STPJHCLOSA-N 441.369 4.913 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H]1Br)c1cc(Br)c(Br)s1 124331876 VRPZWHFWJSDCHT-BQBZGAKWSA-N 446.002 4.567 50 10 IJGE O=[N+]([O-])c1ccccc1C[C@H](Br)c1csc(I)c1 124510852 HUCRSUCKUQGDLO-JTQLQIEISA-N 438.084 4.940 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccccc4)nc3c2)cc(Cl)c1OC 169925700 LDTNKEJNIFJZIP-WGARJPEWSA-N 448.910 4.588 50 10 IJGE N#C/C(=C/N1CCN(c2cccc(Cl)c2)CC1)C(=O)Nc1ccc(Cl)cc1Cl 217177780 XUDZUPPPVRTYFW-YPKPFQOOSA-N 435.742 4.815 50 10 IJGE CCc1ccc(N/C=C(/C#N)C(=O)Nc2ccc(I)cc2C)cc1 217253995 WSKHCGZLKRSUCZ-QINSGFPZSA-N 431.277 4.620 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H](CCl)C1)c1cc(Cl)ccc1I 312524993 USAQMUONRFYAOE-GHMZBOCLSA-N 426.125 4.720 50 10 IJGE C[C@H](Cl)C[C@H]1CCCCN1C(=O)c1cc(Cl)ccc1I 312800217 ITSPXMFGTUGBIS-CMPLNLGQSA-N 426.125 4.957 50 10 IJGE Clc1cc(CBr)ccc1N1CCO[C@H]2CCN(Cc3ccccc3)C[C@@H]21 404143988 GZPMCDLQORLUCV-SFTDATJTSA-N 435.793 4.715 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@@H]2CC[C@H](Cl)C[C@H]2C1 705436556 AIOITVOGIBOPTC-CIUDSAMLSA-N 427.589 4.753 50 10 IJGE CN(Cc1cc(Cl)ccc1I)[C@@H]1CCC[C@H]1Br 709295045 BMXSNFKIMQDHLG-DGCLKSJQSA-N 428.539 4.692 50 10 IJGE CC(C)(C)n1cc(C(=O)NNC(=O)c2cccc3cccnc23)c(-c2ccccc2Cl)n1 731005705 SBBUCZHFTIAMQQ-UHFFFAOYSA-N 447.926 4.582 50 10 IJGE Cc1c(CNC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)oc2ccccc12 734445502 KQALDSFWBDNZJF-XSFVSMFZSA-N 435.487 4.742 50 10 IJGE CC(C)c1ccc([C@H](NC(=O)NNC(=O)COCc2ccccc2)c2cccs2)cc1 738496994 IFOVIYNMKVZWQK-QHCPKHFHSA-N 437.565 4.508 50 10 IJGE CC(=C/c1ccc(Cl)cc1)/C=C(\C#N)c1nnc(N2CCOCC2)n1-c1ccccc1 753714014 LLLYUMKUCOTIJE-LROFUHNISA-N 431.927 4.768 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)OCc2ncccn2)c(C)n1-c1cccc(C(F)(F)F)c1 791287217 DOHPBQKQVFXUFJ-LICLKQGHSA-N 426.398 4.553 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OCc2cc(-c3ccccc3)on2)c(-c2ccccc2)n1 800723274 FQSLDYJNDGJKFQ-STZFKDTASA-N 449.470 4.769 50 10 IJGE C=CCOc1ccc(C(=O)NNc2cc(C(F)(F)F)ccc2Br)cc1OC 1161992856 BEEVFPBOGKDYKW-UHFFFAOYSA-N 445.235 4.798 50 10 IJGE CCSc1cnc(O)c(C(=O)NNc2c(Cl)cc(Br)cc2Cl)c1 1444850154 LASIKZMOBXTOAZ-UHFFFAOYSA-N 437.146 4.725 50 10 IJGE CC(=O)N(C)c1ccc(CNC(=O)/C(C#N)=C/c2cc(C)n(-c3ccccc3C)c2C)cc1 1529209563 BRVKUZRQAIUAJH-BUVRLJJBSA-N 440.547 4.609 50 10 IJGE Cc1c(C(=O)NNc2ccc(Br)cc2C(F)(F)F)nc(O)c2ccccc12 1565586552 XLFDUMJBKOASEX-UHFFFAOYSA-N 440.219 4.787 50 10 IJGE C=CCCC[C@@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)c1ccccc1 1651058081 VMHKKKTUHMJQKB-JOCHJYFZSA-N 442.563 4.871 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(C(C)C)cc2C(C)C)cc1 1667461796 XRESAXMHMCCZST-KRWDZBQOSA-N 425.529 4.756 50 10 IJGE N#CSc1ccc(NC(=O)C2CCN(C(=O)c3ccccc3Br)CC2)cc1 1860587835 ZEHXTMZMBOJKTO-UHFFFAOYSA-N 444.354 4.513 50 10 IJGE Cc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)CCBr)c2cccnc12 1915100376 FTGLXUDYZJPQJI-QGZVFWFLSA-N 447.398 4.908 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)CCCC(F)(F)F 1915290741 HDDYZCCAUSJFOS-HNNXBMFYSA-N 430.330 4.580 50 10 IJGE CCCN(CCCBr)C(=O)c1csc(Br)c1Br 1945186352 FREDSGLKDHZINT-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE CC(C)[C@H](Br)CCNC(=O)c1csc(Br)c1Br 1945189155 KDAWIXFQSASYJY-MRVPVSSYSA-N 448.018 4.813 50 10 IJGE C[C@@]1(NC(=O)c2cc(Br)c(Br)s2)CCC[C@@H]1Br 2011556957 VMVAAXMPVNLRNL-GZMMTYOYSA-N 446.002 4.709 50 10 IJGE FC(F)C1CC(O[C@@H](CI)c2ccccc2Br)C1 2035655296 QDAYRLBMPBTUFZ-KWPJZBAWSA-N 431.058 4.986 50 10 IJGE Cc1cc(Br)sc1[C@H](Br)c1ccsc1S(C)(=O)=O 2038512638 YZVCWGKXUIKZNA-SECBINFHSA-N 430.208 4.768 50 10 IJGE Cn1nc(C[C@H](CBr)c2ccccc2Br)cc1Br 2049248837 KBYFUOWXZPABNX-SECBINFHSA-N 436.973 4.666 50 10 IJGE Brc1cc2c(cc1[C@H](Br)[C@@H]1C[C@@H]1Br)OCCCO2 2076174833 XQSFLEITDXWPIM-BZTNIEFMSA-N 440.957 4.830 50 10 IJGE CN(C[C@H]1CN(CCCCCCCCCBr)CCO1)C(=O)OC(C)(C)C 2106780791 BODMNARULWNMAX-SFHVURJKSA-N 435.447 4.680 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1Cc2ccccc2N(C[C@@H](CBr)C(C)(C)C)C1 2106787898 LIZLYIJSSFJWPM-IAGOWNOFSA-N 425.411 5.000 50 10 IJGE C[C@]1(CBr)CC(F)(F)CN1C(=O)c1ccc(Br)c(Cl)c1 2159050907 WEFLYJZXBOYBDZ-GFCCVEGCSA-N 431.502 4.737 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 2163057291 AFUWIXNZVOOGJH-FFGOWVMKSA-N 437.422 4.885 50 10 IJGE CCCC(CBr)(CCC)CN(C1CN(C(=O)OC(C)(C)C)C1)[C@@H]1CCOC1 2163063714 QZNXFEQOHKHGHN-QGZVFWFLSA-N 447.458 4.678 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CCC([C@H](F)CCl)CC1 2163241476 BYBPJAMHZOGYGW-GFCCVEGCSA-N 427.539 4.641 50 10 IJGE BrC[C@H]1CCc2nc([C@H]3C[C@@H]4CC[C@H](C3)N4Cc3ccccc3)ncc2C1 2187368131 KSKFHLXIAGUNPY-JYAXBFRTSA-N 426.402 4.887 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@@H](CNC(=O)OC(C)(C)C)CC1CCCCC1 2196907221 OWCWBHWREAIJEH-KZNAEPCWSA-N 445.442 4.730 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2N1C(=O)OC(C)(C)C 2196913245 CNCQUVONXAFDIT-ZKXLYKBJSA-N 443.426 4.577 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CBr)OCc1ccccc1C(F)(F)F 2220472917 NJANSXILLVWAOB-INIZCTEOSA-N 426.273 4.900 50 10 IJGE ClCCc1ccccc1Nc1ncc(I)cc1Br 2222897234 NKXDLLOZUJGXCX-UHFFFAOYSA-N 437.506 4.974 50 10 IJGE CCOCc1cc(Br)c([C@@H](Cl)c2cn(C)nc2Br)s1 2224792953 WYXDWFLJUWEVNG-JTQLQIEISA-N 428.577 4.871 50 10 IJGE CS[C@H]1COC[C@H]1n1c(CCl)nc2cc(Br)c(Br)cc21 2234076125 UWLRJUNIPSAQHZ-NEPJUHHUSA-N 440.588 4.603 50 10 IJGE CCOc1cc(Cl)c([C@@H](Br)c2nn(C)nc2Br)cc1Cl 2235269108 KKFZQJRKDYYCHT-SNVBAGLBSA-N 443.954 4.767 50 10 IJGE CC(C)N(C[C@@H]1CCCN(CCCCI)C1)C(=O)OC(C)(C)C 2243591427 UHFAAKUTKGTFHP-MRXNPFEDSA-N 438.394 4.559 50 10 IJGE COc1ccc(Cn2c(Cl)nc(Cl)c2CBr)cc1Br 2278714013 PFXOMXZRATUAGM-UHFFFAOYSA-N 428.939 4.904 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]2CCCN(CC3(CBr)CC(F)C3)C2)C1 2280360820 WVMBUBKRQITOKC-WVNPWQTNSA-N 447.433 4.859 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@@H](Br)[C@@H]1C1CC1 2285834939 GWMXMDQUNNGUKI-RNCFNFMXSA-N 425.523 4.630 50 10 IJGE C[C@]1(CCBr)CCN1Cc1ccc(Cl)cc1I 2302327274 XLULSHAVVZGEOZ-ZDUSSCGKSA-N 428.539 4.694 50 10 IJGE C[C@H](Cl)CN(Cc1ccc(I)c(Br)c1)C1CC1 2306218613 CDZHZRUQAHDKGD-VIFPVBQESA-N 428.539 4.645 50 10 IJGE Cc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2F)cc1 2314634126 OMBCEEXOFXSFPP-VWLOTQADSA-N 426.447 4.971 50 10 IJGE N#CC(=Cc1ccccc1)C(=O)N=c1nc2scc(-c3cc(Cl)ccc3Cl)n2[nH]1 2322391259 CZLSKDCJTMVZCS-UHFFFAOYSA-N 440.315 4.732 50 10 IJGE CC[C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CN1CC1(CBr)CC(C)(C)C1 2345009457 DWCUKJCUEJZORF-BRWVUGGUSA-N 429.443 4.765 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Cl)c1ccc([C@H]2CCOC2)s1 2364049002 ALGQIAHTXCBLNW-CPCISQLKSA-N 440.588 4.839 50 10 IJGE C[C@H]1CN(C(=O)c2ccc(Cl)cc2I)CC[C@@H]1CCCl 2365582993 XUPKLPHLAGLYFG-QWRGUYRKSA-N 426.125 4.672 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)CCc2cccc(Cl)c2)c(OCC)c1 1285223 OXFUXCYXQCCAQL-LDADJPATSA-N 427.884 4.747 50 10 IJGE CCCCCCCOc1ccc(C(=O)NC(=S)NNC(=O)c2ccccc2Cl)cc1 100154387 HDEHKUVHWGDFPM-UHFFFAOYSA-N 447.988 4.639 50 10 IJGE N#C/C(=C/Nc1cc(Br)ccn1)C(=O)NC(c1ccccc1)c1ccccc1 216980571 MSGPOEDLJYZLSP-SDXDJHTJSA-N 433.309 4.569 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1Br)c1cc(Br)sc1Br 232486882 JBQQBYDCNBRPEZ-HTQZYQBOSA-N 446.002 4.709 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N=CN3CCCC3)Oc3c2c(C)nn3-c2ccccc2)cc1 254434910 RTSROBOITGWNOH-XMMPIXPASA-N 439.519 4.573 50 10 IJGE CC(=NNC(=O)c1ccccc1C)c1ccc(C(C)=NNC(=O)c2ccccc2C)cc1 254500262 UGIJVCFTYUXFQR-UHFFFAOYSA-N 426.520 4.611 50 10 IJGE COc1ccc2nc(C)cc(SCC(=O)NN=Cc3c(OC)ccc4ccccc34)c2c1 254518523 BWUKOBODZHJCND-UHFFFAOYSA-N 445.544 4.956 50 10 IJGE O=C(/C=C\c1ccco1)Oc1cccc(C=NNC(=O)c2cc3ccccc3cc2O)c1 254822783 MDFRDBCJVGIHGA-ZDGNKQTFSA-N 426.428 4.521 50 10 IJGE O=C(NN=Cc1cn(-c2ccccc2)nc1-c1cccnc1)c1cc2c(s1)CCCC2 254866469 KBTOHUURHMLBNV-UHFFFAOYSA-N 427.533 4.639 50 10 IJGE O=C(NC[C@H]1CCC[C@@H](CCl)C1)c1cc(Cl)ccc1I 312524994 USAQMUONRFYAOE-MNOVXSKESA-N 426.125 4.720 50 10 IJGE CCCOc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CI)cc1 725401827 WGJJLMMERJTPAA-RDJZCZTQSA-N 445.341 4.861 50 10 IJGE CO[C@@H]1CCCC(=NNC(=O)c2ccc(CN3C(=O)c4cccc5cccc3c45)cc2)C1 794465953 RHRZIHIRRHOXQQ-OAQYLSRUSA-N 427.504 4.675 50 10 IJGE Cc1nc(C2(NC(=O)C(=O)Nc3cccc(S(F)(F)(F)(F)F)c3)CCCC2)no1 810416502 AADKXFSNSQWQKG-UHFFFAOYSA-N 440.394 4.560 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cccc(N3CCOC3=O)c2)c(C)n1-c1ccc(F)cc1 914726879 GTRYUCHFFCKLHC-UYRXBGFRSA-N 444.466 4.736 50 10 IJGE COc1cc(C=NNC(=O)COc2cc(C)ccc2C)ccc1OCc1ccccc1C 1772753808 JWPLGSIFAHRXHQ-UHFFFAOYSA-N 432.520 4.729 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)CCC(=O)c3ccc(C)cc3C)c(C)n2)cc1 1865758506 DIJZBWZCKWKZBZ-UHFFFAOYSA-N 443.547 4.660 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)cc1 1865996604 SMRRAHDEGMQPIM-QFIPXVFZSA-N 431.517 4.736 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)Cc1cc(F)c(Cl)c(Cl)c1 1893682557 ZIMFKAYSECPPLU-JTQLQIEISA-N 431.088 4.735 50 10 IJGE Brc1ccc(OCc2ccccc2)c([C@@H](Br)[C@@H]2COCCO2)c1 1899856846 MEQASXNYTRTATK-ZWKOTPCHSA-N 442.147 4.880 50 10 IJGE C[C@@H]1[C@@H](O[C@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)CC1(C)C 1901820165 PXABLPRWYGJTGF-GLJUWKHASA-N 437.362 4.642 50 10 IJGE O=C(c1ccc(Br)o1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915315608 XNKMYLMQBKNGDC-AWEZNQCLSA-N 427.136 4.858 50 10 IJGE COC[C@@]1([C@H](Br)c2sc(Br)cc2Br)CCCO1 1922895038 QRMSPUHBDBNJJX-GHMZBOCLSA-N 449.002 4.905 50 10 IJGE O=C(NCC[C@H](Br)C1CC1)c1cc(Br)c(Br)s1 1942740274 CAZWKASJKOPWDT-ZETCQYMHSA-N 446.002 4.567 50 10 IJGE C[C@H]1CO[C@@](CBr)(Cc2cccc(Br)c2Br)C1 1943885431 FRIXRYSLOCFPBL-NOZJJQNGSA-N 426.974 4.944 50 10 IJGE O=C(NCC1(CBr)CCC1)c1csc(Br)c1Br 1945183967 RXSDZEBAZKAHDF-UHFFFAOYSA-N 446.002 4.568 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1Cc1c(Br)cccc1Br 1945333843 VTDPYMMOUTXBRN-KOLCDFICSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Br)cc(Br)cc1CC(=O)CCl 1952632870 ONQFEXAGZOSSCN-UHFFFAOYSA-N 441.547 4.909 50 10 IJGE O=C(NC[C@@H]1CCCN(CC2(CBr)CCCCC2)C1)OCc1ccccc1 1999498457 YRWSLZZKBCLFNR-FQEVSTJZSA-N 437.422 4.970 50 10 IJGE CN[C@H](c1c(C)c(Br)cc(C)c1Br)[C@H]1C[C@@H]1Br 2022971193 BLLCRPUVCUQDSC-FWDPORAESA-N 425.990 4.872 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)Cc1nnc(C2CCCCCC2)s1 2025440374 IONJWSSSKAHSHV-CQSZACIVSA-N 448.386 4.578 50 10 IJGE CN(C(=O)c1c(Br)cccc1Br)[C@H]1CCC[C@H]1Br 2033088315 GYKXYQLAIJFBGH-KCJUWKMLSA-N 439.973 4.600 50 10 IJGE O=C(NC[C@@H]1CC[C@H](Br)C1)c1c(Br)cccc1Br 2033093806 KNILKWLWOKKOQH-BDAKNGLRSA-N 439.973 4.505 50 10 IJGE FC1(F)C[C@@H](CBr)N(Cc2c(Br)cccc2Br)C1 2041126401 DOAKTDAXHXWXKU-QMMMGPOBSA-N 447.943 4.816 50 10 IJGE N#CC(C(=O)CSc1nnc(C2CC2)n1C1CC1)=C1Nc2cc(Cl)ccc2S1 2042450977 AUZZJMJRZWYIFH-UHFFFAOYSA-N 429.958 4.758 50 10 IJGE C[C@H]1C[C@H](CBr)CN(Cc2ccc(I)c(Cl)c2)C1 2086652361 OSXXZCIWCSOWFR-CMPLNLGQSA-N 442.566 4.798 50 10 IJGE C[C@H](CCBr)CCN1CC[C@@H](C(F)(F)F)C[C@H]1CNC(=O)OC(C)(C)C 2107584857 NUYVLALBNLAOAN-KFWWJZLASA-N 445.364 4.965 50 10 IJGE Cc1nc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)sc1CBr 2108213688 OHIIOHXGUBQUAV-MKXGPGLRSA-N 432.431 4.693 50 10 IJGE O=C(NC12CCC(CCl)(CC1)C2)c1csc(Br)c1Br 2132805197 TVVWBGBLRMBWRG-UHFFFAOYSA-N 427.589 4.945 50 10 IJGE C[C@]1(CBr)CC(F)(F)CN1C(=O)c1cc(Br)ccc1Cl 2159048679 GWOWUZKIWVGROG-GFCCVEGCSA-N 431.502 4.737 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CCN(C(=O)[C@@H](Br)C1CCCC1)C2 2167035344 XYEQNYMBKFNNHE-SFHVURJKSA-N 437.378 4.872 50 10 IJGE ClCCOCC1CCN(Cc2ccc(Br)cc2Br)CC1 2167399798 HWQUTIKAOCRXFD-UHFFFAOYSA-N 425.592 4.679 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@@]12C[C@H]1CN(Cc1ccccc1)C2 2184922618 NLVMHJQDERQYNJ-HRAATJIYSA-N 445.792 4.515 50 10 IJGE Fc1cc(F)c(OC[C@@H]2CC2(Br)Br)c(CBr)c1 2213084770 PMDXGRHERNSDBJ-ZETCQYMHSA-N 434.900 4.745 50 10 IJGE Cc1ccc(C(=O)N[C@H](CCBr)C(C)(C)C)cc1I 2224619059 SWFLDMGQXVVRTG-CYBMUJFWSA-N 438.147 4.529 50 10 IJGE O=C(Nc1ccc(OC[C@H]2C[C@H](Br)C2)cc1C(=O)O)OCc1ccccc1 2248251245 WEZQBQWBXCJMCM-SHTZXODSSA-N 434.286 4.686 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCS[C@H](CCBr)C1 2285844782 RCUDQJKXUWWINO-MRVPVSSYSA-N 445.579 4.584 50 10 IJGE CCOc1cccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3cccc([N+](=O)[O-])c3)c2C)c1 2294193481 SVVLFRFBFZWQRA-UHFFFAOYSA-N 430.464 4.947 50 10 IJGE CC(C)(CCl)CCCNC(=O)Cc1cc(Br)cc(Br)c1 2295313214 GXNRRLKCBLRORQ-UHFFFAOYSA-N 425.592 4.916 50 10 IJGE CC(C)(C)[C@H](CCCl)NC(=O)Cc1cc(Br)cc(Br)c1 2295314939 FKTMYMPMZGESSI-ZDUSSCGKSA-N 425.592 4.914 50 10 IJGE N#CC(=CNc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1nc2cc(Cl)ccc2o1 2297320292 WVGGXZVNKBWEOC-UHFFFAOYSA-N 442.928 4.632 50 10 IJGE Clc1ccc(C[C@@H]2CCOCC[C@H]2Br)cc1I 2300265707 OLIFYQGSMVZBLJ-WDEREUQCSA-N 429.523 4.677 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)CCCOc2ccc(CC)cc2)cc1 2314785648 HAQXVIZIELSIDT-UHFFFAOYSA-N 434.536 4.837 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3CC[C@H]2C[C@@H]3Br)c1 2315486971 GPIQUXPQLPBOPS-ICCXJUOJSA-N 440.550 4.692 50 10 IJGE FC(F)C(F)(F)CO[C@@H](CI)c1cccc(Br)c1 2315994524 SHRPNKUICNQEKX-VIFPVBQESA-N 441.000 4.842 50 10 IJGE Br[C@@H]1CC[C@@H]2CCCN(Cc3sccc3I)[C@@H]2C1 2316761322 CWGINHWQIKSRJZ-DMDPSCGWSA-N 440.188 4.881 50 10 IJGE CCCCOc1ccc(C=C(C#N)c2nc(O)c3cc(OC)c(OC)cc3n2)cc1OCC 2331039570 SAIOYTVICLTYDF-UHFFFAOYSA-N 449.507 4.994 50 10 IJGE CC1=C(C(=O)OCc2ccccc2)[C@H](c2cncc(-c3ccc(F)cc3)c2)C(C#N)=C(N)O1 664508 MBWHPESITUNXKX-XMMPIXPASA-N 441.462 4.713 50 10 IJGE CC[C@@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)COc1ccccc1-c1ccccc1 9871195 QGFQIWPSOWBSHS-UXHICEINSA-N 446.547 4.861 50 10 IJGE COc1ccc(C(=O)N/N=C/c2ccccc2OCc2ccccc2)cc1Br 12579633 ULGRWAPRRRFZIF-ZVHZXABRSA-N 439.309 4.801 50 10 IJGE O=C(NN=Cc1cccnc1)c1cc(-c2ccc(Br)cc2)nc2ccccc12 15933725 FFDDOWCKFPDEPQ-UHFFFAOYSA-N 431.293 4.823 50 10 IJGE COc1ccc(/C(C#N)=C\c2cccc(OC(=O)c3cccc([N+](=O)[O-])c3)c2)cc1OC 31902978 WZOCESGWGAHYDQ-ODLFYWEKSA-N 430.416 4.895 50 10 IJGE C/C(CC(=O)NCc1ccc(Cl)cc1)=N\NC(=O)Cc1ccc(-c2ccccc2)cc1 103604345 OPCSRKXKASFCCR-MTDXEUNCSA-N 433.939 4.748 50 10 IJGE CCCCCCCOc1ccc(/C=C2\C(=O)N(C[C@H]3CCCO3)C(=O)C(C#N)=C2C)cc1 214329835 AFNGADLKZWDVLB-LEYFIJQKSA-N 436.552 4.807 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@H]1Br)c1cccc(Br)c1Cl 228459423 YFKIDHVUDWKJBJ-HIFRSBDPSA-N 429.539 4.893 50 10 IJGE CCN(CC)c1c(/C=N/NC(=O)c2ccc3ccccc3c2)c(C)nn1-c1ccccc1 253575988 VGWMAQQEOLJNMU-OVVQPSECSA-N 425.536 4.944 50 10 IJGE C/C(=N\NC(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1)c1cc(O)ccc1O 253578482 YKIANUZNKSRLHY-LQKURTRISA-N 445.519 4.802 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCc1cnsn1 399748544 FIGQFBWLECWVFQ-UHFFFAOYSA-N 442.958 4.537 50 10 IJGE O=C(c1cccc(Br)c1Cl)N1CCC(F)(F)[C@H](CBr)C1 403948813 FYCMGJDSIYYHLQ-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE Cc1cc(S(=O)(=O)NC2(CCBr)CCCCC2)sc1Br 687284060 ONXOBKIBGBEKDS-UHFFFAOYSA-N 445.242 4.585 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@]12CCC[C@@H]1OCC2 687346521 TVPXXMXOYVUYFU-IMJJTQAJSA-N 449.126 4.621 50 10 IJGE O=C(c1scc(Br)c1Br)N(CCCl)CC(F)(F)F 705404873 GHXTYOJTFTYHBP-UHFFFAOYSA-N 429.483 4.516 50 10 IJGE C[C@@H]1CCN(C(=O)c2scc(Br)c2Br)[C@@H]1CBr 705518939 SYWADLBOGKPHDY-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE Cc1ccc(Sc2ccc(Cl)cc2)c(C(=O)NNc2ccc(S(C)(=O)=O)cc2)c1 759971794 YBCGXAHDBONJIO-UHFFFAOYSA-N 446.981 4.960 50 10 IJGE C[C@H](OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)c1nc2ccccc2o1 781831150 CRLTTYIGJLFDKH-FJSNCCPHSA-N 437.459 4.816 50 10 IJGE CCOc1cccc(CCNS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)n1 782986143 WCFOFCJJISTDGI-UHFFFAOYSA-N 432.436 4.659 50 10 IJGE O=C(CSCc1ccccc1)NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21 1084148480 VNVVOOVQDNQRAG-UHFFFAOYSA-N 449.963 4.641 50 10 IJGE CCN(CC)c1c(C=NNC(=O)c2ccc3ccccc3c2)c(C)nn1-c1ccccc1 1084651483 VGWMAQQEOLJNMU-UHFFFAOYSA-N 425.536 4.944 50 10 IJGE C=C[C@@H]1OCC[C@H]1NC(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1525975373 ZQZSCDQBDXATIJ-OGNTWVNXSA-N 430.335 4.768 50 10 IJGE CC(=O)c1ccc(OCCCC(=O)NNC(=O)c2sc3cc(F)ccc3c2Cl)cc1 1558911934 VUSORHDXZPFUPC-UHFFFAOYSA-N 448.903 4.517 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccc([N+](=O)[O-])c2)CCC3)c1 1772745751 GHPZMKAOSSVZMB-UHFFFAOYSA-N 446.463 4.527 50 10 IJGE COc1cccc(-c2ccc(C(=O)NNC(=O)CCCSc3ccc(C)cc3)c(C)n2)c1 1865758696 MQMQDVTWYFBHFW-UHFFFAOYSA-N 449.576 4.708 50 10 IJGE CC1(C)C[C@@H]([C@H](CBr)NC(=O)OC(C)(C)C)CN(C(=O)OC(C)(C)C)C1 1880760550 HLZQJGQNYXHUOL-KGLIPLIRSA-N 435.403 4.558 50 10 IJGE C[C@@H]1[C@H](O[C@@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)CC1(C)C 1901820166 PXABLPRWYGJTGF-HBUWYVDXSA-N 437.362 4.642 50 10 IJGE C[C@H](Oc1cccc(Cl)c1)C(=O)N(C)C[C@@H](Br)COCc1ccccc1 1916346360 BVGSCWVOUYIGPL-DOTOQJQBSA-N 440.765 4.546 50 10 IJGE IC[C@H]1CCC[C@]2(CN(Cc3ccccc3)C3(CCCC3)C2)O1 1939534594 CYHWHSYVHRKIOY-QUCCMNQESA-N 425.354 4.948 50 10 IJGE CC(C)c1nc(Br)c(Br)n1C[C@H](CBr)C1CC1 1940509664 ZJBSRSQKWGSZEX-VIFPVBQESA-N 428.994 4.953 50 10 IJGE CC(C)CN(CCBr)C(=O)c1cc(Br)c(Br)s1 1948648936 JUPPUKVDPYVJOI-UHFFFAOYSA-N 448.018 4.766 50 10 IJGE COc1ccc([C@@H](Br)c2cc(I)sn2)c(Cl)c1 2007646400 XMQJAWOSWVUGDJ-LLVKDONJSA-N 444.519 4.894 50 10 IJGE FC1(F)C[C@@]1(Br)COc1ccc(CBr)cc1Br 2023774347 IZRIZESEIPLLGG-SNVBAGLBSA-N 434.900 4.896 50 10 IJGE O=C(NC1CC(CCBr)C1)c1c(Br)cccc1Br 2033090356 DMAAYIMYTWSOTB-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE CCCC(CBr)(CCC)CN=[S@@](C)(=O)C[C@@H](C)NC(=O)OC(C)(C)C 2044700047 PEVPUJDDSROZHR-BZQUYTCOSA-N 441.476 4.979 50 10 IJGE CCC[C@H](Cl)c1cn(-c2ccc(I)c(Br)c2)nn1 2057421469 NZPVOOJUCGZOQS-JTQLQIEISA-N 440.510 4.714 50 10 IJGE COc1c(CBr)cc(Cl)cc1S(=O)(=O)N(Cc1ccccc1)C1CC1 2059287019 SDVBBSFTZOSHLJ-UHFFFAOYSA-N 444.778 4.597 50 10 IJGE FC1(F)C(O[C@H](CI)c2ccccc2Br)C1(F)F 2062577184 BODPTPDKNYYMQR-MRVPVSSYSA-N 438.984 4.595 50 10 IJGE CN(Cc1ccc(NC(=O)OC(C)(C)C)cc1)C(=O)[C@H](Br)C1CCCC1 2110714162 ARJFYDVJQLNLOW-QGZVFWFLSA-N 425.367 4.946 50 10 IJGE C[C@H](NC(=O)c1ccc(CBr)cc1)c1csc(NC(=O)OC(C)(C)C)n1 2114351392 LZOBBXSYCWKIBS-NSHDSACASA-N 440.363 4.876 50 10 IJGE C[C@H](Cl)CCc1cn(-c2ccc(Cl)c(I)c2Cl)nn1 2132766633 ZYBHUYAWVSXHPE-ZETCQYMHSA-N 430.504 4.739 50 10 IJGE COc1cc(Cl)c([C@@H](Br)c2cc(Cl)n(C)n2)cc1Br 2137655515 MIXXOMPFMOYELU-GFCCVEGCSA-N 428.939 4.982 50 10 IJGE O=C(NC[C@]12CCC[C@@]1(CCl)C2)c1cc(Br)c(Br)s1 2142939676 IRBWKIJOYSFCFP-QWHCGFSZSA-N 427.589 4.802 50 10 IJGE O=C(NC[C@]12CC[C@@H]1CCCN2Cc1ccccc1)c1ccc(CBr)cc1 2145607687 OTGPCWGUGUSALT-JTHBVZDNSA-N 427.386 4.756 50 10 IJGE O=C(c1cc(Cl)cc(Br)c1)N1CC[C@@H](CBr)C(F)(F)C1 2146375720 QXWNKWISKXURNI-VIFPVBQESA-N 431.502 4.595 50 10 IJGE COc1ccc(C[C@H](Br)c2nn(C)c(Cl)c2Br)cc1F 2168412112 IKTAKOOCSCAZRT-QMMMGPOBSA-N 426.511 4.662 50 10 IJGE C[C@H](NC(=O)c1ccc(CBr)cc1)[C@@H](NC(=O)OC(C)(C)C)c1ccco1 2172878618 VSLFRDHUSPONQW-SUMWQHHRSA-N 437.334 4.559 50 10 IJGE CCC1(CC)CCN(S(=O)(=O)c2cc(CBr)sc2Br)C1 2179791695 VCPCCKBBGPZAOY-UHFFFAOYSA-N 445.242 4.606 50 10 IJGE COc1cc(F)c([C@H](Cl)c2c(Br)nn(C)c2C)cc1Br 2202902643 SYGDAFQTLJQNTR-LBPRGKRZSA-N 426.511 4.729 50 10 IJGE CN(CCCCCI)[C@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 2211188801 GEUPYZWLVYOWHA-HNNXBMFYSA-N 438.394 4.559 50 10 IJGE CCc1cc([C@@H](Cl)c2cnn(C)c2I)sc1Br 2248006049 YDYABBAUJVFRCH-VIFPVBQESA-N 445.551 4.739 50 10 IJGE CCC[C@@](C)(CBr)NC(=O)c1ccc(Cl)c(I)c1 2256375495 ONGMYVDRKLJYRC-ZDUSSCGKSA-N 444.538 4.628 50 10 IJGE C=CC[C@@]1(CCl)CCN(C(=O)c2scc(Br)c2Br)C1 2272152938 FKPBVYGXEBHOKY-ZDUSSCGKSA-N 427.589 4.920 50 10 IJGE C[C@H](Br)CN(CCC(C)(C)C)S(=O)(=O)c1ccc(Br)s1 2288021488 ZMIBNUAPKHZNEG-JTQLQIEISA-N 447.258 4.721 50 10 IJGE CC[C@@H](C)N(CCBr)Cc1cc(I)ccc1Cl 2307323917 GEONHGDKRWDJMQ-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccccc2)C(=O)C1=Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 2314610136 CYEVOIQYRDTXBM-UHFFFAOYSA-N 439.427 4.647 50 10 IJGE CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)C=Cc3ccccc3)ccc21 2314634128 OWZKGJUTTLWSJP-SANMLTNESA-N 438.483 4.922 50 10 IJGE COc1ccccc1C=C(C#N)C(=O)N(c1cccc(C)c1C)S(=O)(=O)c1ccccc1 2314777402 COXRNFPVHRABBY-UHFFFAOYSA-N 446.528 4.641 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@H]2CC(Br)C3)cc1I 2315551807 WDVBATLSBNXPMU-RYUDHWBXSA-N 440.550 4.835 50 10 IJGE CC1(C)C[C@H](CBr)CN1Cc1ccc(Cl)cc1I 2318541144 SNPJWZLFYYSFRG-SNVBAGLBSA-N 442.566 4.940 50 10 IJGE C[C@@H]1[C@H](Br)CCN(Cc2cc(Cl)ccc2I)[C@@H]1C 2321330049 LQCJYLDNCWFYIE-OPQQBVKSSA-N 442.566 4.938 50 10 IJGE COc1ccc(-c2csc(C(C#N)=Cc3cc(OC)c(OC)cc3OC)n2)c(OC)c1 2331473585 KUDYIPNTIVMSMA-UHFFFAOYSA-N 438.505 4.917 50 10 IJGE COc1c(F)c(F)cc(C(=O)N(Cc2ccccc2)[C@@H](C)CCBr)c1F 2336107693 YRLZHQHYTITWPP-LBPRGKRZSA-N 430.264 4.928 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCN(C[C@H]2C[C@H](Br)C2)[C@H](C(F)(F)F)C1 2337684739 BGHUALQPXGHHBK-TUVASFSCSA-N 443.348 4.718 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)Nc3cc([N+](=O)[O-])ccc3F)o2)cc1 867529 WHNDJRMKBNBGTK-WJDWOHSUSA-N 449.394 4.716 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3cccc([N+](=O)[O-])c3)ccc2[C@H]1c1ccc(Cl)cc1 38651435 UVKAJEPNXXWXDL-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE CCc1cc(Br)ccc1OCC(=O)N/N=C/c1c(Cl)cccc1Cl 40959781 VCESTQLMYQJBGQ-ZVBGSRNCSA-N 430.129 4.847 50 10 IJGE COc1cc(/C=N/NC(=O)c2cc3ccccc3o2)c([N+](=O)[O-])cc1OCc1ccccc1 59303690 RLOOVMWIPDEXCQ-AFUMVMLFSA-N 445.431 4.693 50 10 IJGE CC1CCC(NC(=O)[C@H](c2ccc(F)cc2)N(Cc2ccccc2)C(=O)CCl)CC1 97914698 NNAJEAXDCLPWSV-WJXHAUQLSA-N 430.951 4.829 50 10 IJGE N#C/C(=C/NC(c1ccccc1)c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 217234098 TVEWZNLHKYBVAI-SDXDJHTJSA-N 432.867 4.973 50 10 IJGE Cc1ccc(NCC(=O)NN=C2C(=O)N(Cc3cccc4ccccc34)c3ccccc32)cc1 254484527 DTMZYJLCAOBRNF-UHFFFAOYSA-N 448.526 4.627 50 10 IJGE CCOc1cc(C=NNC(=O)NC2CCCCC2)ccc1OCCOc1ccccc1 254819093 QFIOKUSJTYOBFH-UHFFFAOYSA-N 425.529 4.509 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1Cc1cc(Cl)ccc1I 405325035 BRFQLVLZZUYEJM-CABZTGNLSA-N 428.539 4.692 50 10 IJGE O=C(N[C@@H]1CCC[C@@H](Br)C1)c1scc(Br)c1Br 705449097 XPMUMNVDAGNWRF-RNFRBKRXSA-N 446.002 4.709 50 10 IJGE COc1cc(C=NNC(=O)[C@H](C)c2ccc(CC(C)C)cc2)cc(Br)c1O 1084370565 OYMHQBZVJAERGE-CQSZACIVSA-N 433.346 4.616 50 10 IJGE Cc1cc(Br)ccc1NNC(=O)c1cc2ccc(C(F)(F)F)cc2nc1O 1151480636 OXMQGJUXHAERNR-UHFFFAOYSA-N 440.219 4.787 50 10 IJGE Cc1sc2nc(CS[C@@H](C)C(=O)NNc3ccc(F)cc3Cl)nc(O)c2c1C 1472216512 OLJBSZAJNUHJNC-JTQLQIEISA-N 440.953 4.571 50 10 IJGE C=CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=S)Nc1ccc(CCCC)cc1 1540393261 FIPNWMYCFRBXFJ-IBGZPJMESA-N 448.633 4.596 50 10 IJGE CC(C)(Oc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1 1554647812 ZAXLISGJNMAEKG-YDZHTSKRSA-N 427.844 4.816 50 10 IJGE CCN(C(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccc1O)CCC2)c1cccc(C)c1 1772751784 MVKRARCHYANVJT-UHFFFAOYSA-N 445.519 4.739 50 10 IJGE Cc1ccc(Cn2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2ccccc2O)cc1 1865707782 GDMPEWBAKNIRAK-HSZRJFAPSA-N 434.499 4.831 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OCC[C@H]1CC[C@@H]1C1CC1 1902509136 RCBJNEOWWNZXMI-RKVPGOIHSA-N 437.362 4.548 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cc(Br)cs1 1961678939 NIVWBXZFGZPJBH-CQSZACIVSA-N 447.192 4.563 50 10 IJGE CC(C)[C@@H](Br)[C@@H](C)NC(=O)c1csc(Br)c1Br 1997051482 WGVBYRPYCCXHDB-HTRCEHHLSA-N 448.018 4.811 50 10 IJGE O=C(NCCCCCCBr)c1cccc(Br)c1Br 2031485534 IMLHQXOUTQEZGA-UHFFFAOYSA-N 441.989 4.897 50 10 IJGE Cc1nn(-c2ccc(F)c(Cl)c2CBr)c(C)c1I 2032920477 QGIKBRUOIUPDHY-UHFFFAOYSA-N 443.485 4.781 50 10 IJGE CC[C@H](Br)CN(CC)C(=O)c1cccc(Br)c1Br 2044542763 CDDBFXXUSGZYTK-VIFPVBQESA-N 441.989 4.847 50 10 IJGE N#CC(=Cc1ccc(OC(F)F)cc1OC(F)F)S(=O)(=O)c1ccc(Cl)cc1 2053614981 RYHGTKCWIKJONG-UHFFFAOYSA-N 435.782 4.881 50 10 IJGE CC(C)(C)[C@@H]1[C@H](Br)CCN1c1ncc(Br)cc1Br 2065423894 WZEOMVCWDCXMAQ-KOLCDFICSA-N 441.005 4.995 50 10 IJGE Brc1cccc(CN2CC[C@H](Br)[C@H]2C2CC2)c1Br 2067016705 NHJBFLASAMHFSN-GXTWGEPZSA-N 438.001 4.959 50 10 IJGE O=[N+]([O-])c1cc(Br)c(OC[C@H]2C[C@@H](Br)C2)c(Br)c1 2076257088 HDADJSNAORISSH-KNVOCYPGSA-N 443.917 4.672 50 10 IJGE C[C@H](CCCCCBr)NC(=O)c1ccc(F)cc1I 2117891670 AJJRMOKGFOWMEE-SNVBAGLBSA-N 442.110 4.504 50 10 IJGE O=C(c1cc(Br)ccc1Cl)N1CC[C@H](Br)C(F)(F)CC1 2150019309 QPIVKLLNGWEFIS-NSHDSACASA-N 431.502 4.737 50 10 IJGE Cc1sc(CCl)cc1S(=O)(=O)N(C)[C@@H]1CC(C)(C)[C@@H]1OCc1ccccc1 2156441972 KHDXXMUVGITLSE-IEBWSBKVSA-N 428.019 4.800 50 10 IJGE CC(C)C(CC(CBr)(CBr)[C@@H]1CCS(=O)(=O)C1)C(C)C 2189104526 JVLVOGQJOAAASK-CYBMUJFWSA-N 432.262 4.516 50 10 IJGE Fc1ccc2nc(CCl)n(C[C@]3(Br)CC3(F)F)c2c1Br 2202507232 VKGXGQXKSXLRFB-LLVKDONJSA-N 432.465 4.849 50 10 IJGE CCN(C(=O)c1ccc(Cl)c(I)c1)C(C)(C)CBr 2256380597 ARDPQIZHHHDPJV-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE COc1c(C)cc(C)cc1[C@H](Br)c1cc(I)sn1 2263459192 UXYQNAINLHJORR-LBPRGKRZSA-N 438.128 4.857 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1Cc1cc(I)ccc1Cl 2307325696 CUXYIVOXAKIUAA-CABZTGNLSA-N 428.539 4.692 50 10 IJGE N#CC(=CNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccc(C(=O)O)cc1 2324319140 GVVFAVSKDXJZFZ-UHFFFAOYSA-N 443.303 4.880 50 10 IJGE COc1ccc(CNC(=O)C(C#N)=CNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1 2324845124 WHBWSMRGQVMBBW-UHFFFAOYSA-N 443.347 4.869 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H]2CC[C@H](Br)[C@H]2C1 2327404270 UAALJRBJBCTIKW-XDTLVQLUSA-N 440.550 4.550 50 10 IJGE COc1cc2sc(NC(=O)C(C#N)=Cc3ccc(OC)c(OC)c3)nc2cc1Cl 2329703499 KTVYYBGGAIFTDU-UHFFFAOYSA-N 429.885 4.521 50 10 IJGE O=C(c1scc(Br)c1Cl)N1[C@H]2CCC[C@H]2C[C@@H]1CBr 2333996978 YSOIHRJSRJQHKC-XKSSXDPKSA-N 427.589 4.942 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@@H]1CC12CCC(F)(F)CC2 2343416829 TYOWYFCIKUAPQX-SJORKVTESA-N 430.333 4.689 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@H]3CCC[C@@]32CNC(=O)OC(C)(C)C)C1 2345008335 NOXAHXXFVPKXOA-HRAATJIYSA-N 429.443 4.957 50 10 IJGE CCN(C[C@]1(CBr)CC1(F)F)[C@@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2351888373 WPFBGJDUADTSFN-IIDMSEBBSA-N 439.385 4.812 50 10 IJGE Cc1c(Br)csc1C(=O)N1CC[C@@H](Br)C[C@H]1C(F)(F)F 2361461919 BNQVMBQJCWSMEA-APPZFPTMSA-N 435.103 4.749 50 10 IJGE CC(C)c1ccc(OCC(=O)N/N=C/c2c(F)cccc2Cl)c(Br)c1 14014340 FXTURGGKPUBFBL-LSFURLLWSA-N 427.701 4.894 50 10 IJGE Cc1ccc2cccc(OC(=O)c3oc4c(c3C)/C(=N/NC(=O)c3ccco3)CCC4)c2n1 40814491 BMUDMGQNJZWRAC-WPWMEQJKSA-N 443.459 4.727 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@H]2C)oc2c1/C(=N/NC(=O)c1cccs1)CCC2 40823680 HILMBUSTZOFXBC-HFBWXFSASA-N 433.533 4.711 50 10 IJGE CCCCOc1cccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4O)nc3c2)c1 169926519 CVTGUGADAABTEN-WGOQTCKBSA-N 428.492 4.878 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C\Nc1ccc(Cl)c([N+](=O)[O-])c1)C12CC3CC(CC(C3)C1)C2 217035997 YZPZRCQQAHTFCI-LSXFSIBFSA-N 428.920 4.789 50 10 IJGE CCCC(=NNC(=O)[C@]1(C)CC1(Br)Br)c1ccc(Cl)cc1 254501386 PRRIMQPMYSKYET-AWEZNQCLSA-N 436.575 4.857 50 10 IJGE CC(C)OCC(CBr)(CBr)c1cccc(Br)c1 310062473 ADMITQVROQOFCD-UHFFFAOYSA-N 428.990 4.902 50 10 IJGE O=C(Nc1cccc(CCBr)c1)c1ccc(F)cc1I 313143635 BNYAEVDIYZRSEH-UHFFFAOYSA-N 448.073 4.620 50 10 IJGE C[C@@H](CCn1c(CCCl)nc2cc(Br)cnc21)N(C)Cc1ccccc1 379606936 DKWSLBVFXFAXRN-HNNXBMFYSA-N 435.797 4.886 50 10 IJGE C[C@H]1[C@H](CBr)CCN1C(=O)c1cc(Br)c(Br)s1 395201793 MLKKOBSIQFLDOL-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE C[C@@](CI)(OCCOC1CCC1)c1ccccc1Br 400686220 XHSSDPPEAHHMLE-HNNXBMFYSA-N 439.131 4.685 50 10 IJGE Fc1c(Br)ccc(CNCCCCCCI)c1F 701007793 NXPQMAQHLYGFAO-UHFFFAOYSA-N 432.090 4.812 50 10 IJGE CC(C)c1ccccc1NC(=S)NNC(=O)c1cc2c(Br)cccc2[nH]1 727174072 FGNOIAVVEAFJER-UHFFFAOYSA-N 431.359 4.685 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCc3cc(O)nc4ccccc34)c2C)cc1 748331586 RIVMQTKCIOOJMQ-BKUYFWCQSA-N 436.515 4.880 50 10 IJGE COc1cc(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)ccc1Cl 790145394 DKLCOWYAWVPFTJ-SFQUDFHCSA-N 431.883 4.671 50 10 IJGE O=C(/C=C(\c1ccc(Cl)cc1)C(F)(F)F)NNC(=O)Nc1ccc(OC(F)F)cc1 802045861 ZOYMYULWUMURKA-NTEUORMPSA-N 449.763 4.740 50 10 IJGE C=C(C)COc1cccc(NC(=O)NNC(=O)c2ccc(Br)cc2Cl)c1 1199787152 NIHQJOFALQYGBR-UHFFFAOYSA-N 438.709 4.524 50 10 IJGE CC(=O)N(Cc1ccc(NC(=O)NNc2nc3ccc(Cl)cc3s2)cc1)C(C)C 1200372436 KOMGMRDQPZIQAR-UHFFFAOYSA-N 431.949 4.855 50 10 IJGE C=CCOc1ccc(/C=C/C(=O)NNc2ccc(Br)cc2CC)cc1OC 1631496834 VUGMTOZABQOUAI-YRNVUSSQSA-N 431.330 4.741 50 10 IJGE O=C(NNc1nc(O)c2ccccc2n1)c1cnc(-c2c(Cl)cccc2Cl)s1 1638450981 ZWEPULNILDCSCR-UHFFFAOYSA-N 432.292 4.523 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2cccc(Cl)c2)[C@@H]1c1ccncc1 1865699751 BMWOHFXGDMTJTK-OAQYLSRUSA-N 439.906 4.865 50 10 IJGE Cc1nn(-c2ccc(Cl)cc2)c2c1[C@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 1865714780 PZKJRQVNCILFNP-GOSISDBHSA-N 441.716 4.815 50 10 IJGE C[C@H](C(=O)N(C)C[C@H]1C[C@@H](Br)C1)c1ccc(NC(=O)OC(C)(C)C)cc1 1887829163 GIQDESXJXHTLPZ-OFQRWUPVSA-N 425.367 4.769 50 10 IJGE Cc1cccc(S(=O)(=O)N(Cc2ccccc2)[C@@H](CBr)C(C)C)c1F 1915300984 QQPNEEOEVGXGAM-KRWDZBQOSA-N 428.367 4.745 50 10 IJGE CC(C)[C@H](Br)CCNC(=O)c1cc(Br)c(Br)s1 1942760878 AJYLDVOLTQNKFS-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE O=C(N[C@@H]1CCC[C@H]1CBr)c1csc(Br)c1Br 1945189135 JVGNCHJBFAVNFX-POYBYMJQSA-N 446.002 4.567 50 10 IJGE CC1([C@H](CBr)NCc2cc(Cl)ccc2I)CC1 1945358901 ULGNXLGTAKNEKE-LBPRGKRZSA-N 428.539 4.598 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)Cc1cc(Br)n(C)n1 1960909897 GMJLGADNVCXUTG-INIZCTEOSA-N 429.200 4.604 50 10 IJGE CC(C)(C)OC(=O)N1C[C@](C)([C@H]2CCC[C@@H](CI)O2)CC1(C)C 1992813516 JVYVRSCWHQEKFG-PMUMKWKESA-N 437.362 4.785 50 10 IJGE CN(c1ncc(I)cc1Br)[C@@H](CCl)C(C)(C)C 2015761982 FMRWJXKXLVMHAM-JTQLQIEISA-N 431.543 4.538 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@H]1Cc1ccc(I)c(Cl)c1 2026564481 UEUHSWOLXXQQHL-GBIKHYSHSA-N 429.523 4.676 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@@H](Cl)C(F)(F)CC1 2093612928 FZBNXVKMULXVQW-MRVPVSSYSA-N 437.531 4.752 50 10 IJGE ClCc1ccc(Br)c(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)n1 2120532278 SIQWZUCQVHIPJH-ROUUACIJSA-N 434.809 4.931 50 10 IJGE CC(C)[C@@H](Br)c1cn(Cc2ccc(Cl)c(Br)c2F)nn1 2177556998 CINRNHYTSMUVRC-LLVKDONJSA-N 425.527 4.973 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@H]1C[C@H](C(C)(C)C)CN(C(=O)OC(C)(C)C)C1 2196908341 XFGRECCYHAZLPH-LUKYLMHMSA-N 445.442 4.538 50 10 IJGE C[C@H]1[C@H](NC(=O)OC(C)(C)C)CC(C)(C)CN1CCCCCI 2211183084 BSCZHSKMRRDONF-LSDHHAIUSA-N 438.394 4.605 50 10 IJGE CN(CCCCC1CC1)S(=O)(=O)c1cc(CBr)sc1Br 2234091176 YJCYUAMZCJPEQW-UHFFFAOYSA-N 445.242 4.606 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C[C@@H]2C(F)(F)F)cc1I 2257353548 HUJMBIBYOABKKU-FYBVGQRMSA-N 435.021 4.934 50 10 IJGE Cc1cccn2c(=O)c(C=C(C#N)c3nc4ccccc4n3C)c(Oc3ccccc3)nc12 2296624945 KOHGWXZATSGULB-UHFFFAOYSA-N 433.471 4.746 50 10 IJGE CC(C)[C@@H](CCl)N(C)Cc1ccc(I)c(Br)c1 2306219047 HWALWRYMURGVQA-CYBMUJFWSA-N 430.555 4.749 50 10 IJGE CN(CCCCCCl)Cc1ccc(I)c(Br)c1 2306219694 PCNMQDZNIWVBPC-UHFFFAOYSA-N 430.555 4.895 50 10 IJGE CC[C@H](C)[C@H](CBr)NCc1cc(I)ccc1Cl 2307330059 JJTFRSHPEZBXJQ-ZANVPECISA-N 430.555 4.844 50 10 IJGE CCOc1cc(C=NNC(=O)Cc2ccc(OC)cc2)ccc1OCc1ccccc1F 2323331753 JQHCCMXLDWVTOT-UHFFFAOYSA-N 436.483 4.505 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@@H](Br)[C@H]1C1CC1 2327406805 MNLXPKXYCLRNDP-TZMCWYRMSA-N 440.550 4.692 50 10 IJGE CCOC(=O)c1cnn(-c2cc(C)c3ccccc3n2)c1NC(C=O)=Cc1ccccc1C 2329813905 AOOZHWHTLAXCBD-UHFFFAOYSA-N 440.503 4.866 50 10 IJGE COc1ccc([C@@H](Br)[C@]23C[C@H](CO2)C3(C)C)cc1I 2334828711 RCIQHGULUXMZDW-YVLXSGLVSA-N 437.115 4.551 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@H]1CCC[C@@H](C(F)(F)F)C1 2343414617 QCAQKYUXQBNMKO-GVDBMIGSSA-N 436.312 4.842 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@@]2(CBr)CC[C@H]1C2 2361615606 CAHCOXASOAAVQL-RTHLEPHNSA-N 425.523 4.631 50 10 IJGE CC(C)CO[C@H]1[C@@H](OCc2ccc(Cl)cc2I)C[C@H]1Cl 2365647027 GEIKBYVLAGFLBR-VHDGCEQUSA-N 429.125 4.882 50 10 IJGE C/C(=N\NC(=O)CCC(=O)Nc1ccc(Br)cc1)c1ccc2ccccc2c1 12379225 FXABIHTYNARYSV-MFKUBSTISA-N 438.325 4.861 50 10 IJGE CC(C)CCOc1ccccc1C(=O)NNC(=O)c1ccc(OCc2ccccc2)cc1 14033769 IEZJACQKYIUBMZ-UHFFFAOYSA-N 432.520 4.765 50 10 IJGE Cc1ccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1NC(=O)c1ccccc1 43830548 QIMKTVSYGQOPRV-UHFFFAOYSA-N 445.563 4.615 50 10 IJGE CCCCCCCOc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(C)c(C)c2)cc1 100272191 PGPUTWIAEWHZEU-FQEVSTJZSA-N 426.557 4.881 50 10 IJGE CCCCCOc1ccc(/C=N/NC(=O)c2cc(-c3ccccc3)nc(O)n2)cc1OCC 169923186 PJIBREWOULCFDZ-YZSQISJMSA-N 448.523 4.581 50 10 IJGE CC[C@@H](C)N1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccc(F)cc3)c(OC)c2)C1=O 214269859 RCJISSJMJNRJIA-YQODDJSKSA-N 448.494 4.804 50 10 IJGE COc1ccc(C(=O)NN=C(C)CC(=O)Nc2ccc(Nc3ccccc3)cc2)cc1OC 254744035 LHEFGGOTTCOBRM-UHFFFAOYSA-N 446.507 4.582 50 10 IJGE O=C(Oc1cccc(C=NNC(=O)c2cc3ccccc3cc2O)c1)c1cccc(F)c1 254823874 ABJXXYGMSAUZFJ-UHFFFAOYSA-N 428.419 4.668 50 10 IJGE C[C@@H](CCBr)CCNC(=O)c1cc(Br)sc1Br 397772597 QMQHTCSUFFRQFZ-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE FC(F)(F)c1cc(I)c(Br)c(CBr)c1 575694535 HGCYRHOXWDNNCO-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE Clc1ccc(I)c(CNCC2(CBr)CCC2)c1 717692440 UBUWOZQQCUCXEW-UHFFFAOYSA-N 428.539 4.599 50 10 IJGE Cc1ccc(Oc2ccc(NC(=O)NNC(=O)c3cccc4cccnc34)cn2)cc1C 755918583 GZQGXIUZTAQLRC-UHFFFAOYSA-N 427.464 4.505 50 10 IJGE CCn1c(O)nc2cc(C(=O)NNc3c(Cl)cc(Br)cc3Cl)ccc21 1620440386 LYXDEGMTTOPNCV-UHFFFAOYSA-N 444.116 4.588 50 10 IJGE Cc1ccc(COc2ccccc2C=NNC(=O)CSc2nc3ccccc3[nH]2)cc1 1772760573 VQCIMLNHGFJEQJ-UHFFFAOYSA-N 430.533 4.693 50 10 IJGE CC(=O)[C@H](Br)c1cccc(I)c1SC(F)(F)F 1848425894 OVVMPBIFOSLHAB-QMMMGPOBSA-N 439.034 4.928 50 10 IJGE COc1ccc(-n2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2cccc(Cl)c2)cc1 1865683547 MIOTWPDYIQCQSA-MRXNPFEDSA-N 446.816 4.771 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccn2)[C@@H]1c1c[nH]c2ccccc12 1865700079 KRUIYUYONVUMSP-QFIPXVFZSA-N 430.471 4.634 50 10 IJGE C[C@H]1COC[C@@H](C)N1c1cc(Nc2ccc(SC#N)cc2)nc(Cc2ccccc2)n1 1868207853 QOJABEJUYRGMFC-HDICACEKSA-N 431.565 4.998 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1(C)C 1881456380 TUDYBADABYGPHP-KBPBESRZSA-N 435.403 4.700 50 10 IJGE CCN(C[C@](C)(CI)O[C@H]1CC(C)(C)[C@@H]1C)C(=O)OC(C)(C)C 1901847543 DXQSJPWYGIUVCF-GLJUWKHASA-N 439.378 4.888 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Cl)CCc1ccc(Cl)cc1Br 1905438377 MXKUPCMZZDBDBK-CYBMUJFWSA-N 427.125 4.939 50 10 IJGE CN[C@H](c1c(C)c(Br)cc(C)c1Br)[C@@H]1C[C@H]1Br 1910989927 BLLCRPUVCUQDSC-JQEORGNBSA-N 425.990 4.872 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)c1ccc(S(=O)(=O)C(F)F)cc1 1915086628 KPLBROKWIHGIQN-AWEZNQCLSA-N 432.330 4.863 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)Cc1nn(C)cc1Br 1915299269 CCZULULWMUDRBU-KRWDZBQOSA-N 429.200 4.604 50 10 IJGE COC[C@]1([C@@H](Br)c2cc(Br)c(Br)s2)CCCO1 1943035468 CQYBVJVCUZPARY-ONGXEEELSA-N 449.002 4.905 50 10 IJGE BrC[C@]1(Cc2cccc(Br)c2Br)CCCOC1 1943883887 LMELVNZDKKDUPF-CYBMUJFWSA-N 426.974 4.946 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@H]2CC[C@H]3CC[C@H]2C3)C1 1947124338 RLGDHLKHQCFEJR-PASDCYSWSA-N 449.373 4.786 50 10 IJGE C[C@@H](c1ccncc1Br)[C@@H](Cl)c1cc(I)sn1 2007643152 HNLQLOQUVHBQMC-UPONEAKYSA-N 443.535 4.989 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1Cc1c(Br)cccc1Br 2018114919 JXWPCVHTGKYFDE-RNCFNFMXSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CCCCCBr)CC[C@@H]1C(F)(F)F 2044695171 AZTAPTWWOCFQBJ-KGLIPLIRSA-N 431.337 4.577 50 10 IJGE C[C@H](Br)CCCc1cn(-c2c(Cl)cc(F)cc2Br)nn1 2189284546 LLNRWKOUZHJYFD-QMMMGPOBSA-N 425.527 4.928 50 10 IJGE ClC[C@@H](CC1CCOCC1)NCc1cc(Br)ccc1Br 2195484778 BQIXRSNTPBHXNV-CQSZACIVSA-N 425.592 4.725 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@@H](Br)[C@@H]1[C@H]2COC[C@H]21 2213491741 ICCPIPVVMUGZFA-RQJHRRTKSA-N 428.921 4.679 50 10 IJGE C[C@@H]1CCC[C@](CBr)(OCCOCCOCCOCc2ccccc2)C1 2227775430 AOGVXPCSSVWIEM-CTNGQTDRSA-N 429.395 4.597 50 10 IJGE Cc1cc(Br)cnc1C(=O)N(Cc1ccccc1)[C@@H](C)CCBr 2243966445 MDJGZYXORHFUBG-AWEZNQCLSA-N 440.179 4.968 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@H](Br)C1CC(S(C)(=O)=O)C1 2269880019 NULBWHAAYBKYOS-KJHLLKJSSA-N 430.589 4.670 50 10 IJGE Brc1ccccc1[C@H](CI)OC1(C2CCC2)COC1 2272932589 ZPIGNFKDJKEKGS-AWEZNQCLSA-N 437.115 4.511 50 10 IJGE O=C(NCC1(CBr)CC(F)(F)C1)c1cc(Cl)cc(Br)c1 2281663651 OGPDOGYVESEWMR-UHFFFAOYSA-N 431.502 4.643 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H]2CC[C@@H]1C[C@@H](Br)C2 2285960971 WPENQKGLSBDQLG-PSVAKVPMSA-N 425.523 4.772 50 10 IJGE CCCC(CBr)(CCC)CN1CCC[C@@](O)(CN(C)C(=O)OC(C)(C)C)C1 2286343980 CBKUFNKCLBSVGB-OAQYLSRUSA-N 449.474 4.662 50 10 IJGE C[C@@H](Cl)CN(C(C)(C)C)S(=O)(=O)c1cc(Br)ccc1Br 2288067562 FVSYBJAAOKYWHG-SECBINFHSA-N 447.620 4.628 50 10 IJGE COc1cc(C=C2C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1F 2314610177 DLFGUPUADGKFQE-UHFFFAOYSA-N 448.494 4.662 50 10 IJGE Cc1nc(Br)c(C[C@H](Br)c2ccc(Br)cc2)n1C 2315671574 GDGWZZVGAMAAQA-NSHDSACASA-N 436.973 4.932 50 10 IJGE N#CC(=CN1CCN(c2cccc(Cl)c2)CC1)C(=O)Nc1cccc(C(F)(F)F)c1 2324412730 VCISFSQXQCCTPI-UHFFFAOYSA-N 434.849 4.527 50 10 IJGE ClC[C@H]1CCN(Cc2ccc(I)c(Br)c2)C12CC2 2325208992 KKJPXPHUOFKZIW-LLVKDONJSA-N 440.550 4.647 50 10 IJGE CC(C)N(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2351887533 AIAMEXUODOVFAZ-YJBOKZPZSA-N 439.385 4.907 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C)CN(C[C@](C)(CBr)C(C)(C)C)CC1(F)F 2352107322 MXWBFVBKHHPCNS-ROUUACIJSA-N 441.401 4.916 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]2CN(C[C@@H](CBr)c3ccccc3)C[C@@H]2C1 2358235045 DBGXSTWZSRQNFE-WCIQWLHISA-N 437.422 4.790 50 10 IJGE COc1cccc(OCC(=O)Oc2ccc(/C=C(/C#N)c3ccccc3OC)cc2OC)c1 31901976 VIOYUSXFIPSXIU-UYRXBGFRSA-N 445.471 4.761 50 10 IJGE Cc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4cccc([N+](=O)[O-])c4)c(C)c32)c1 40811388 KBHHSKUYUNBFHA-LGUFXXKBSA-N 446.463 4.527 50 10 IJGE COc1ccc(COC(=O)N/N=C2/C(=O)N(Cc3ccccc3Cl)c3ccccc32)cc1 59153772 HYZGDHNFQWXALH-XTCLZLMSSA-N 449.894 4.526 50 10 IJGE O=C1[C@@H](I)CCCCCCCCC[C@@H]1I 100486893 LBWPQSVNTNSWKP-QWRGUYRKSA-N 434.099 4.687 50 10 IJGE COc1cc(/C=C2/C(=O)N(C3CCCC3)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1 101338751 PCZOOXSHFAIDLF-HYARGMPZSA-N 442.515 4.809 50 10 IJGE CCSc1ccc(Cl)cc1CC(=O)N/N=C\c1cc(Cl)c(OC)c(OC)c1 169922299 WSRNVJDUJTUXHI-JJFYIABZSA-N 427.353 4.815 50 10 IJGE COc1ccc([C@H](C)N/C=C(/C#N)C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)cc1OC 217200748 JKBSTEFYNKKDKT-KHQGJTGOSA-N 433.552 4.518 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CCCC[C@@H]1CBr 232460115 MABYBKRPEPBKFR-SNVBAGLBSA-N 439.973 4.601 50 10 IJGE Cc1cccc(OCC(=O)NN=Cc2ccc(OC(=O)c3cccc4ccccc34)cc2)c1 254450317 MSFLYXHDJHBUQX-UHFFFAOYSA-N 438.483 4.897 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@H](c2cc(Br)cs2)C1 382700732 CKEJEEJCJFVVCC-MWLCHTKSSA-N 425.186 4.856 50 10 IJGE Clc1ccc(I)c(CN2CCCC[C@H]2CBr)c1 405345987 QCRBYIOEQAISSO-LBPRGKRZSA-N 428.539 4.694 50 10 IJGE FC(F)Oc1cc(Br)c(I)c(CBr)c1 575682579 VAKGZVVHSGVYNZ-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE CCC[C@@H](Br)CNC(=O)c1scc(Br)c1Br 705509747 FYNZARFFYPWPPY-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE CN([C@H](CBr)C(C)(C)C)S(=O)(=O)c1ccc(Br)cc1Cl 708347815 QEQIUNSDIGOCGT-GFCCVEGCSA-N 447.620 4.533 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1[C@@H]1CN(Cc2ccccc2)C[C@@H]1CI 725418564 QICHPAZBIHGYDP-QFBILLFUSA-N 436.293 4.554 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C[C@H](C)c2ccc(C(F)(F)F)cc2)c1C 736694905 LVYOZYJZKLLSTA-ZDUSSCGKSA-N 429.446 4.811 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2CCC(C3CCCC3)CC2)c(-c2ccccc2)n1 742790702 GJRXJOGXUKMCNU-HAVVHWLPSA-N 427.552 4.800 50 10 IJGE CC(=NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1)c1nc(C(F)(F)F)cs1 767365651 AFDKFEMZBYCHTI-UHFFFAOYSA-N 444.438 4.620 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)C[C@@H](C)c2ccc(Br)cc2)c1C 771014643 BJJXYXUZWLQHFA-CYBMUJFWSA-N 440.345 4.555 50 10 IJGE Cn1nc(-c2ccc(Cl)s2)cc1NC(=O)NNc1ccc(C#N)cc1C(F)(F)F 799425656 NTOJFNBYXAAQNI-UHFFFAOYSA-N 440.838 4.841 50 10 IJGE COc1cccc(C(=O)NN=Cc2c(Br)c(C)n(-c3ccccc3)c2C)c1 1083946145 NMOIJKADSSRKFE-UHFFFAOYSA-N 426.314 4.629 50 10 IJGE C=CC[C@@]1(C(=O)NNc2c(C)cccc2Br)CCCN1C(=O)OC(C)(C)C 1469852803 ZDQSPEGQAMMEGL-FQEVSTJZSA-N 438.366 4.546 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2ccc3nc(O)[nH]c3c2)c(C)n1-c1ccc(Cl)cc1 1623792632 BDVOEMRZHTXFBL-WOJGMQOQSA-N 445.910 4.553 50 10 IJGE Cc1c(C(=O)NCCC(C)C)oc2c1C(=NNC(=O)c1cccc3ccccc13)CCC2 1772748106 NKQBXKFDFWKBHU-UHFFFAOYSA-N 431.536 4.988 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)c3c2[C@@H](c2cccc(F)c2)C(C#N)=C(N)O3)cc1 1865711341 VWMXSRQSYCITNQ-QFIPXVFZSA-N 438.462 4.905 50 10 IJGE CCC[C@@H](NC(=O)CCCC(=O)c1cccs1)C(=O)Nc1ccc(SC#N)cc1 1866794611 WIAQLGBSIXXYPY-QGZVFWFLSA-N 429.567 4.598 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1 1916346741 DOEZHSKLDYUHRI-IKGGRYGDSA-N 436.312 4.794 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)Nc1ccc(F)c(CBr)c1 1924907109 MJZYSWAGWGYCCW-UHFFFAOYSA-N 443.157 4.654 50 10 IJGE C[C@]1([C@@H](Br)c2cc(Br)sc2Br)COCCO1 1992639928 YQQAQYIJISOQIY-WCBMZHEXSA-N 434.975 4.515 50 10 IJGE CC(C)[C@@H](Br)[C@@H](C)NC(=O)c1cc(Br)sc1Br 1997050942 SEYNMVROECZHMU-HZGVNTEJSA-N 448.018 4.811 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC[C@H]2CC23CCCC3)C1 2021267937 SSBNDZIEGMSZMA-DNVCBOLYSA-N 449.373 4.788 50 10 IJGE CCC[C@H](CBr)CN=[S@](=O)(C(C)C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2063272926 HDRADNITVXZJIW-RKPUJPDHSA-N 439.460 4.683 50 10 IJGE CN(C[C@H](Br)C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 2076788293 RHSHCDXMDJSETD-KGLIPLIRSA-N 425.289 4.510 50 10 IJGE C=CC[C@H](CBr)CNC(=O)c1cc(Br)ccc1Br 2082056525 XFFZZOOUGFYZQZ-SECBINFHSA-N 439.973 4.529 50 10 IJGE F[C@]1(CBr)CCCN(Cc2ccc(I)c(Cl)c2)C1 2086660647 GMNXSSYZWITEAE-ZDUSSCGKSA-N 446.529 4.644 50 10 IJGE O=S(=O)(C[C@H](Br)c1ccc(OCc2ccccc2)cc1)N1CCCCC1 2089397974 MGWQMVFSXMHFMX-FQEVSTJZSA-N 438.387 4.517 50 10 IJGE COc1ccc([C@H](Br)c2nn(C)c(Cl)c2Cl)cc1Br 2094338299 BWXGMWGTNNXDCY-VIFPVBQESA-N 428.939 4.982 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCCCC[C@@H]1NC(=O)c1ccc(CBr)cc1 2106199030 FKEWQKSMGCTIMI-IRXDYDNUSA-N 425.367 4.537 50 10 IJGE CC[C@@H]1CN(C[C@H](CBr)c2ccccc2)CC[C@H]1NC(=O)OC(C)(C)C 2106789513 YYOBWZFDBJYRKL-NZSAHSFTSA-N 425.411 4.790 50 10 IJGE O=C(NCC[C@H]1CN(CC2(CBr)CCCC2)c2ccccc21)C(F)(F)F 2163061952 JFDGNGKNFQUXQU-AWEZNQCLSA-N 433.312 4.614 50 10 IJGE CO[C@H]1C[C@H](Oc2c(Br)cc(Br)cc2CCl)C[C@H]1OC 2187166868 BPIZFQJYYOXSFQ-UOJUARBOSA-N 428.548 4.522 50 10 IJGE O=C(NC[C@@]1(CBr)C[C@H]1C(F)(F)F)c1cccc(OCc2ccccc2)c1 2192581192 OZMLNRVIPJQNSE-MJGOQNOKSA-N 442.275 4.959 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@]1(F)CN(C[C@@H](CBr)c1ccccc1)C2 2198086868 OPFGTJIIFQTCNO-QMMLZNLJSA-N 441.385 4.636 50 10 IJGE Cc1c(Cl)cc(CN2CC[C@@H](OCCCBr)C2)cc1Br 2207038542 NZRUKKKQJCQYHV-CYBMUJFWSA-N 425.592 4.787 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CCCCCCCBr)C[C@@H]1C(F)(F)F 2263154721 SGZQBRLYVZDWPY-UONOGXRCSA-N 431.337 4.719 50 10 IJGE Cc1ccc(-n2c(N(C)C)nc(C=C(C#N)C(=O)N[C@@H](C)c3ccccc3)c2Cl)cc1 2293046006 XRXQZZMFLQKTIZ-KRWDZBQOSA-N 433.943 4.685 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2ccc(OCc3cccc(C(=O)O)c3)cc2)cc1 2294146977 OHPXHDCQRPWRLO-UHFFFAOYSA-N 442.471 4.908 50 10 IJGE N#CC(=Cc1cc(Cl)cc(I)c1O)c1ccc([N+](=O)[O-])cc1 2294284751 QZPGYQTUKXYZTQ-UHFFFAOYSA-N 426.597 4.623 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2ccc3c(c2)OCCO3)cc1COc1ccccc1 2295670006 XREZAFDIZJPPJZ-UHFFFAOYSA-N 442.471 4.591 50 10 IJGE CC1(C)OCCC[C@@]1(CBr)Cc1sccc1I 2301052030 BTRRDDGOIRQFPO-ZDUSSCGKSA-N 429.161 4.866 50 10 IJGE CC(C)(CI)CN1CCC2(CCN(Cc3ccccc3)CC2)CC1 2306818354 JOYNIYMBVOLCRK-UHFFFAOYSA-N 440.413 4.826 50 10 IJGE CCOC(=O)c1cc(CC)sc1NC(=O)C(C#N)=Cc1ccc(Br)cc1 2329663831 ZDQQTUKBIQDSBJ-UHFFFAOYSA-N 433.327 4.795 50 10 IJGE CC(C)n1ncc(Br)c1Cn1c(Cl)nc(Cl)c1CBr 2342217408 CHGNJMFOOMUGDS-UHFFFAOYSA-N 430.959 4.673 50 10 IJGE O=C(NC[C@H]1CCCC[C@H]1CCl)c1ccc(Cl)cc1I 2365588573 LDNZQPLLUYVGRD-WDEREUQCSA-N 426.125 4.720 50 10 IJGE COc1ccc(OC)c(/C=N/NC(=O)COc2ccc(C(C)(C)CC(C)(C)C)cc2)c1 3145017 RSDDOCMRUGGXBW-CVKSISIWSA-N 426.557 4.947 50 10 IJGE N#C/C(=C/c1cn(CC(=O)Nc2ccccc2)c2ccccc12)C(=O)Nc1ccc(O)cc1 4090797 DIOVXMDIEAOUDF-JXAWBTAJSA-N 436.471 4.531 50 10 IJGE CCCCCCOc1ccccc1C(=O)NNC(=O)c1ccc(NC(=O)CCCC)cc1 14032714 FQDDWECNXRLFAE-UHFFFAOYSA-N 439.556 4.849 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)ccc1O 33285014 IQFAADTWDDWXNR-APSNUPSMSA-N 439.924 4.956 50 10 IJGE COc1ccc(Oc2nc3c(C)cccn3c(=O)c2/C=C(/C#N)c2nc3ccccc3[nH]2)cc1 34688924 AWOOPFFMOZQUSA-VKAVYKQESA-N 449.470 4.744 50 10 IJGE CCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(OC)c2)c1 38650216 LJZLPWVYSQVWSU-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE C[C@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccccc1F 38652072 MOUPILQEYJUYHS-LFVRLGFBSA-N 448.425 4.556 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccccc2Cl)ccc1OCc1ccc(C)cc1 40911159 QMGFANUNAHECIX-VULFUBBASA-N 438.911 4.765 50 10 IJGE COc1cc(/C=N/NC(=O)Nc2cccc(C)c2C)ccc1OCc1cccc(C(=O)O)c1 59250339 KNLLGDIFDKCWKS-VULFUBBASA-N 447.491 4.745 50 10 IJGE COc1cc([N+](=O)[O-])ccc1-n1c(C)cc(/C=N/NC(=O)c2cc3ccccc3o2)c1C 59304843 NQGPMHNTVIVTKE-ZMOGYAJESA-N 432.436 4.521 50 10 IJGE Cc1c(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)c2ccccc2n1Cc1ccc(Cl)cc1 59396281 VDCQQTAPNQSDBC-UBXANZILSA-N 433.939 4.854 50 10 IJGE IC[C@H](I)Sc1cccc2cccnc12 95882220 XQMJSFFIXSGXMI-SNVBAGLBSA-N 441.075 4.523 50 10 IJGE CC[C@@H](CBr)COc1c(Br)cc([N+](=O)[O-])cc1Br 96869930 YVYMECJEUJCZFU-ZETCQYMHSA-N 445.933 4.920 50 10 IJGE CC[C@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)[C@H](C)Oc1ccc(C)c(C)c1 251374797 RRKFUUNEEZNTSM-WVBUVRCRSA-N 426.557 4.589 50 10 IJGE Cc1ccccc1OCC(=O)NN=Cc1cc([N+](=O)[O-])ccc1N(CC(C)C)CC(C)C 263625534 PXHWUCVCJLZLAN-UHFFFAOYSA-N 440.544 4.551 50 10 IJGE CCc1occc1[C@H](Br)c1cc(I)cc2c1OCC2 311621520 SSJKVRPYFRUAAU-AWEZNQCLSA-N 433.083 4.866 50 10 IJGE C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1[C@@H](Br)c1cc(I)cc2c1OCC2 716444322 OGAQKQRVTFCCSD-JDRMZHCHSA-N 433.127 4.954 50 10 IJGE CN(C[C@H]1CCCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1CBr 720016911 NKOQOBUEGSOLMH-GOSISDBHSA-N 432.362 4.838 50 10 IJGE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NNc1cc(C(F)(F)F)ccc1F 754154190 SRJNVGKAIICXPD-UHFFFAOYSA-N 449.433 4.769 50 10 IJGE N#Cc1ccc(NNC(=O)NCc2ccnc(Oc3ccccc3)c2)c(C(F)(F)F)c1 799537952 SJNHOXZQVGLTRF-UHFFFAOYSA-N 427.386 4.591 50 10 IJGE Cn1c(SCC(=O)N/N=C2\C[C@H]3CC[C@@]2(C)C3(C)C)nnc1-c1ccccc1Cl 1087755202 PRTRNFQWBPWDCZ-SCYZSXQJSA-N 431.993 4.546 50 10 IJGE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NNc1nc(-c2cccnc2)nc(C)c1C 1648578070 HUMNOPHTNCHMHD-QBFSEMIESA-N 443.429 4.601 50 10 IJGE C#Cc1ccccc1CC(=O)NNC(=O)c1cc(-c2ccccc2Cl)nc2ccccc12 1649390426 ZXIAVTJUMCGYCU-UHFFFAOYSA-N 439.902 4.540 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)cc1 1666462122 XKFPLHZCUKDTLU-GOSISDBHSA-N 447.491 4.610 50 10 IJGE Cc1occc1C(=O)NN=C1CCCc2oc(C(=O)Nc3cccc4ncccc34)c(C)c21 1772749817 SGWXKPXOWBWGSF-UHFFFAOYSA-N 442.475 4.760 50 10 IJGE COc1ccc2ccccc2c1C=NNC(=O)COc1c(C)cc(Br)cc1C 1772753418 DGRZBIXYUYSATA-UHFFFAOYSA-N 441.325 4.757 50 10 IJGE CCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@H]2c1ccc(OC(C)C)c(OC)c1 1865696113 CKVALKLRHDBCHU-OAQYLSRUSA-N 430.508 4.584 50 10 IJGE CCCc1nn(Cc2ccccc2F)c2c1[C@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865700223 NIPMTONTTABNGV-QFIPXVFZSA-N 427.483 4.722 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)[C@@H](C)Oc3ccc(Cl)cc3)c(C)n2)cc1C 1865756091 FWWDGQZGEXAODE-QGZVFWFLSA-N 437.927 4.556 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1ccc(Cl)cc1Br 1882088112 OOFWUXJMRRXNLG-LLVKDONJSA-N 427.564 4.933 50 10 IJGE CC(C)(CI)CN1CCc2cccc(NC(=O)OC(C)(C)C)c21 1904651852 UWPZMHJFGRQZHA-UHFFFAOYSA-N 430.330 4.857 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CC[C@@](C)(CI)O2)C12CCC2 1991817462 GFODWXQVXNVGEK-FUHWJXTLSA-N 435.346 4.683 50 10 IJGE Cc1cnc(C(=O)N(Cc2ccccc2)C(C)(C)CBr)c(Br)c1 1992737011 HFPSGUOOUNCVTB-UHFFFAOYSA-N 440.179 4.968 50 10 IJGE O=C(NC[C@H](Br)C1CCC1)c1cccc(Br)c1Br 2031476293 AHZRNGIEDPLNAJ-NSHDSACASA-N 439.973 4.505 50 10 IJGE C[C@@H](CCBr)CCN1CCCCN(C(=O)OC(C)(C)C)CC(F)(F)C1 2046339874 RLUNLUMLFLBZFH-HNNXBMFYSA-N 427.374 4.766 50 10 IJGE CCOc1c(Br)cc(Br)cc1CN[C@H]1C[C@@H](Br)C1 2063144763 XUTMJBLTHICVSC-PHIMTYICSA-N 441.989 4.626 50 10 IJGE Cc1c([C@H](Br)c2ccc(F)c(Br)c2)c(Br)nn1C 2067860532 NRJARCNCGSTAJB-LLVKDONJSA-N 440.936 4.877 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1cccc(Br)c1Cl 2081237491 YDGRBGJBGJYOCS-KWQFWETISA-N 444.538 4.682 50 10 IJGE CC(C)[C@@H](Br)C(=O)N[C@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21 2106200736 RTVVIEFLZWBVPZ-DLBZAZTESA-N 425.367 4.947 50 10 IJGE CN(C[C@H]1CCCN(C[C@H](CBr)c2ccccc2)C1)C(=O)OC(C)(C)C 2106788670 RQFZYKVCBMIGPH-MJGOQNOKSA-N 425.411 4.744 50 10 IJGE CO[C@@H]1CC(Oc2c(Br)cc(CCl)cc2Br)C[C@H]1OC 2187178026 QPWGXOSFVRZWTC-CHWSQXEVSA-N 428.548 4.522 50 10 IJGE CCN(CCCCCI)[C@H]1CCC[C@H]1CNC(=O)OC(C)(C)C 2211184546 DUILBHGCFXDUQH-HOTGVXAUSA-N 438.394 4.607 50 10 IJGE CCCN(CCCCCI)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2211187432 UFECNMOPYOFTOY-MRXNPFEDSA-N 438.394 4.703 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CCC[C@@]23CC[C@@](C)(CI)O3)C1 2213351915 DOTMMIBUZMOBDZ-VVWQDTPRSA-N 449.373 4.786 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CCCCCCBr)CC[C@H]1C(F)(F)F 2223283276 QYCWJXVVZVSYED-ZIAGYGMSSA-N 431.337 4.719 50 10 IJGE Cc1cc(Br)c(CBr)c(N(C)C2CSCCSC2)c1 2228717791 BMDSQQKMMNMHTB-UHFFFAOYSA-N 425.255 4.937 50 10 IJGE Cc1cc(Br)c([C@@H](Br)[C@@H]2CCCS(=O)(=O)C2)c(C)c1Cl 2232511290 PUGWKOYHRLRMSR-MFKMUULPSA-N 444.616 4.980 50 10 IJGE CCCN(C[C@@H](C)Cl)C(=O)c1ccc(Br)cc1I 2259769239 MTAPSPMXYRSVDO-SECBINFHSA-N 444.538 4.533 50 10 IJGE COc1cc(OCc2ccc(I)cc2)ccc1CBr 2267687087 IXEDASFZFSXJOO-UHFFFAOYSA-N 433.083 4.774 50 10 IJGE CCOC(=O)C(C(=O)CCl)=C1Nc2ccccc2C(c2ccccc2)(c2ccccc2)N1 2297576985 HCLWDAXMEVVUTB-UHFFFAOYSA-N 446.934 4.576 50 10 IJGE CCC[C@@H](CCBr)NCc1ccc(Cl)c(I)c1 2300240673 OWQCKNRMSWJNDT-NSHDSACASA-N 430.555 4.988 50 10 IJGE Clc1ccc(C[C@@H]2CCOCC[C@@H]2Br)c(I)c1 2302330021 XYFNERUYMSJCOT-CABZTGNLSA-N 429.523 4.677 50 10 IJGE COc1ccc(-c2ccc(C(=O)NN=Cc3c(Cl)nc4scc(C)n34)c(C)n2)cc1 2321218611 RGVWGDGNHODWSJ-UHFFFAOYSA-N 439.928 4.501 50 10 IJGE N#CC(=Cc1cccc(Br)c1)C(=O)NCCc1ccc(-c2cccnc2)cc1 2329694388 ABVHZFLDZYQMKK-UHFFFAOYSA-N 432.321 4.777 50 10 IJGE COc1ccc(CBr)c(N(C)[C@H]2C[C@@H]3C[C@@H](OCc4ccccc4)C[C@H]23)n1 2358915784 BEQCAULSAXHUSB-YRPNKDGESA-N 431.374 4.805 50 10 IJGE COc1cc(/C=N/NC(=O)c2ccc(O)cc2O)ccc1OCc1cccc2ccccc12 20228674 KJVXZSZYXNMDSB-JFLMPSFJSA-N 442.471 4.603 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3[N+](=O)[O-])ccc2[C@H]1c1ccccc1Cl 38651019 XEIJHXSKYRZHBS-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE COc1ccc(/C(C)=N/NC(=O)CCCSc2nc3ccccc3s2)cc1OC 58989771 TVGOCILWSJKMHH-OEAKJJBVSA-N 429.567 4.726 50 10 IJGE CCOc1ccc(/C=N/NC(=O)c2cc3cc(Br)ccc3o2)c(OCC)c1 59304388 RUGVSGZWXABCTJ-WSDLNYQXSA-N 431.286 4.757 50 10 IJGE FC(F)(F)[C@@H](Br)COc1ccc(Br)cc1Br 96835005 LGPFIONHYYNJQI-QMMMGPOBSA-N 426.852 4.916 50 10 IJGE C[C@H](Br)C(C)(C)NC(=O)c1cc(Br)c(Br)s1 128784474 FQQDBPLOEOBNDB-YFKPBYRVSA-N 433.991 4.565 50 10 IJGE CCCCOc1ccc(/C=C(/C#N)C(=O)Oc2ccc3c4c(c(=O)oc3c2)CCC4)cc1 206271679 SRRVIHAWKADCKI-JXAWBTAJSA-N 429.472 4.973 50 10 IJGE CN(C)c1ccc(/C=C(/C#N)c2nc(CSc3nnnn3-c3ccccc3)cs2)cc1 207444450 JYXUZUFTVNMHGD-ATVHPVEESA-N 445.577 4.541 50 10 IJGE O=C(Cc1cccc2ccccc12)NN=Cc1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1 252604149 FXGCPSBPZWYWSW-UHFFFAOYSA-N 426.432 4.628 50 10 IJGE CC(C)(C)c1ccc(C=NNC(=O)c2ccc(NS(=O)(=O)c3cccs3)cc2)cc1 254499095 KTSLNDWSBLVWSV-UHFFFAOYSA-N 441.578 4.610 50 10 IJGE Cc1nn(-c2ccccc2)cc1C=NNC(=O)CN1c2ccccc2Sc2ccccc21 254630935 NOVQJJPFPHWIAT-UHFFFAOYSA-N 439.544 4.934 50 10 IJGE CC1(C)O[C@@H]2[C@@H](n3ccc4c(Cl)ncnc43)O[C@@H](CO[Si](C)(C)C(C)(C)C)[C@H]2O1 306146917 PTFANUVYJLNMOM-KRXQYRFLSA-N 440.016 4.524 50 10 IJGE CC[C@@H]1CN(Cc2cc(Cl)ccc2I)C[C@H]1Br 405321875 ZPSYZVRQMPFXRZ-BXKDBHETSA-N 428.539 4.550 50 10 IJGE O=C(NNc1ccc(F)cc1Br)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 748074963 QQQVZUBXJYFWHQ-NEPJUHHUSA-N 433.199 4.734 50 10 IJGE CC(C)(C)OC(=O)c1ccc(/C=C(/C#N)C(=O)Nc2nc3ccccc3nc2Cl)cc1 764889170 WZAQIPAVYOZFNM-VBKFSLOCSA-N 434.883 4.784 50 10 IJGE CCc1ccc(NC(=O)C(=O)NN=Cc2ccc(OCc3ccccc3Cl)cc2)cc1 1084307274 CZVLRSWMFBABAL-UHFFFAOYSA-N 435.911 4.570 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)c1 1154050353 LBBLEYKYSZQXLU-UHFFFAOYSA-N 438.512 4.621 50 10 IJGE Cc1cc2c(Br)ccc(C(=O)NNc3nc4ccccc4[nH]c3=S)c2o1 1453775449 ZUOHVWZSSJYRPI-UHFFFAOYSA-N 429.299 4.866 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)c(C)nc2O)cc1 1540614134 WMKJIIFBSQCAKL-UHFFFAOYSA-N 447.535 4.797 50 10 IJGE CC(=O)c1ccc(-c2ccc(C(=O)NNC(=O)c3ccc(OCCC(C)C)cc3)o2)cc1 1618677426 OZCWEIHVAKXTFT-UHFFFAOYSA-N 434.492 4.649 50 10 IJGE C=CCC1(C(=O)NNC(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)CCOCC1 1650633808 XGXVCKZEMKWDJX-UHFFFAOYSA-N 449.938 4.689 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc(Oc3ccc(Cl)cc3)cn2)c1C 1650817857 OGPLBTHALQQKNE-UHFFFAOYSA-N 446.898 4.753 50 10 IJGE COc1ccc2ccccc2c1[C@@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2CC(C)C 1865688417 RLAARZVVFKVKLF-SFHVURJKSA-N 442.441 4.938 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CCC)nn3-c2ccc(OC)cc2)cc1 1865692436 BLRYZGUGOWIAAD-HSZRJFAPSA-N 444.535 4.840 50 10 IJGE CCCOc1c(OC)cccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2CCC 1865693643 PRHKIZKRDIYLOC-NRFANRHFSA-N 444.535 4.976 50 10 IJGE Cc1ccc(-n2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2c[nH]c3ccccc23)cc1 1865700567 XMHDLTXTEHARQQ-SFHVURJKSA-N 435.409 4.899 50 10 IJGE Cc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2ccc(C(=O)O)cc2)cc1 1865708572 BNDPPSPBDMETCF-JOCHJYFZSA-N 448.482 4.764 50 10 IJGE COc1ccccc1C/C(O)=C(\C#N)c1nc(-c2ccc(OC)c(OC)c2OC)cs1 1872759487 QEDFIJLRDYWJAT-VLGSPTGOSA-N 438.505 4.880 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CC[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]1C2 1882087056 HCJLIVFGFRFNAQ-FZKCQIBNSA-N 447.414 4.700 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2C[C@H]3C[C@@H]3CO2)s1 1900925238 XRQKIMVUFMBLRH-OTKUIEDOSA-N 433.536 4.867 50 10 IJGE COc1ncc(Br)c(C)c1CN(Cc1ccccc1)C[C@H](C)Br 1902508416 LKHUHKPVCKYMJP-ZDUSSCGKSA-N 442.195 4.947 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1ccc(Br)cn1 1915112252 ZOOOOUJEZPNVCA-ZDUSSCGKSA-N 426.152 4.660 50 10 IJGE C[C@]1(CI)CC[C@]2(CN(Cc3ccccc3)C3(CCCC3)C2)O1 1939538444 YHARXRWKDYGNCM-QUCCMNQESA-N 425.354 4.948 50 10 IJGE O=C(N[C@@H]1CC[C@H](CBr)C1)c1cc(Br)sc1Br 1942368062 OASPATLSFUJWLE-NKWVEPMBSA-N 446.002 4.567 50 10 IJGE C[C@@H]1CO[C@](CBr)(Cc2cc(Br)ccc2Br)C1 2006498784 GFBKZXXXQDRETQ-ZANVPECISA-N 426.974 4.944 50 10 IJGE CC(C)[C@@H](CBr)CNC(=O)c1cccc(Br)c1Br 2031479912 PDEQWJMGPJRUFL-VIFPVBQESA-N 441.989 4.609 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc([S@](C)(=O)=NC[C@H](Br)C(F)(F)F)c1 2044693274 JIWZJEYDTODTCG-VDBVYFBLSA-N 445.301 4.816 50 10 IJGE CC(C)Cc1ccnc(-n2nc(CCl)c(I)c2C(F)(F)F)c1 2078889782 ZHEXXIOFJWCLIT-UHFFFAOYSA-N 443.638 4.828 50 10 IJGE C[C@@H]1C[C@@H](O[C@@H](CI)c2ccccc2Br)CCO1 2084725647 QIDPVNKCVUHXBJ-SUNKGSAMSA-N 425.104 4.509 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Br)c2ccc(Br)cc2F)c1 2093073488 CCLHJMTVJPBYMB-LBPRGKRZSA-N 428.142 4.538 50 10 IJGE Fc1cc(CBr)ccc1N1CCOCC12CCN(Cc1ccccc1)CC2 2163147839 QIJORXVHMXGHJF-UHFFFAOYSA-N 433.365 4.592 50 10 IJGE Cn1ncc(Cl)c1CC(CBr)(CBr)c1ccc(Cl)cc1 2168230766 CDJBCZGLNRQPPE-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE C[C@H](CCCCCBr)NS(=O)(=O)c1ccc(Br)cc1Cl 2174530932 WBLSLDWXNUDJAC-SNVBAGLBSA-N 447.620 4.725 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)[C@@H]1[C@@H]2CCO[C@H]21 2213490726 VYMFIKGUJLQYMM-MRGVKNFYSA-N 428.921 4.822 50 10 IJGE Cc1sc(C(=O)N(C)[C@@H](CCBr)C(F)(F)F)c(C)c1Br 2234469097 IVBAQCMOIGRJNY-QMMMGPOBSA-N 437.119 4.915 50 10 IJGE Cc1cc(Br)c(C(=O)N2C[C@]3(F)CCC[C@@]3(CBr)C2)s1 2237633432 LMNZLKSJLJIJJF-ZIAGYGMSSA-N 425.161 4.548 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@H](Br)[C@H]2CC[C@H]21 2282990862 XTXXMDROSCBPGS-BZTNIEFMSA-N 425.523 4.630 50 10 IJGE O=C(c1cccc(Cl)c1Br)N1CC[C@H](CBr)C(F)(F)C1 2283140861 NABZBDNXCCZITH-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE O=C(N[C@H]1CC[C@@H](CBr)CC1)c1cc(Br)c(F)cc1Cl 2285846001 ISZIKTOCKFNOQE-DTORHVGOSA-N 427.539 4.925 50 10 IJGE O=C(Cc1cc(Br)cc(Br)c1)N[C@H](CCl)c1cccs1 2295311475 LCRNHGLVTMXKRH-GFCCVEGCSA-N 437.584 4.912 50 10 IJGE O=S1(=O)CCC[C@H]1[C@H](Cl)c1ccc(OCc2ccccc2)cc1Br 2299534088 ZWKSZACDBTWOJG-ZWKOTPCHSA-N 429.763 4.885 50 10 IJGE ClCCN(Cc1ccc(I)c(Br)c1)CC1CC1 2306224084 MPYMXAWYEXBZIA-UHFFFAOYSA-N 428.539 4.505 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NCc1cc(I)ccc1Cl 2307315127 DFZJSJNXLMJRED-SKDRFNHKSA-N 430.555 4.986 50 10 IJGE CCCCCOc1c(OC)cc(C=NNC(=O)Nc2cccc(Cl)c2)cc1[N+](=O)[O-] 2323858232 VRIJLGNUVXERLO-UHFFFAOYSA-N 434.880 4.981 50 10 IJGE ClC[C@H]1CCCCN(Cc2ccc(I)c(Br)c2)C1 2325212311 DKSXMTAIKWVXAE-GFCCVEGCSA-N 442.566 4.895 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C[C@](C)(CBr)C(C)(C)C)CC1(F)F 2327109891 OGQAGEVKJUSRTE-GUYCJALGSA-N 427.374 4.668 50 10 IJGE CCOc1ccc(OCC)c(-c2csc(C(C#N)=C(O)[C@H]3CC(=O)N(C(C)C)C3)n2)c1 2331376401 AHMSJDCFEOZWTG-HNNXBMFYSA-N 441.553 4.657 50 10 IJGE FC(F)(F)c1cccc(CO[C@@H](CCl)[C@H](I)CCl)c1 2353210947 OLTPSQLTNRCYJW-MNOVXSKESA-N 427.031 4.872 50 10 IJGE BrC[C@]1(Cc2ncc(I)cn2)CCCCC12CCC2 2353312339 WAHZGCGASFVQMK-OAHLLOKOSA-N 435.147 4.749 50 10 IJGE Cc1cc(C(=O)N2CCC[C@@H](Br)[C@H]2C(F)(F)F)sc1Br 2370241065 JNSIUNUGOKAHCG-APPZFPTMSA-N 435.103 4.749 50 10 IJGE O=C(N/N=C/c1ccccc1OCc1ccccc1)c1ccn(Cc2ccc(Cl)cc2)n1 20522847 BEQPXAVXUBUHNJ-JVWAILMASA-N 444.922 4.928 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(Cl)cc4)ccc32)cc1 38649167 JVWZBSGWGRQSTK-DEOSSOPVSA-N 446.890 4.851 50 10 IJGE COc1ccccc1NC(=S)NNC(=O)c1ccc(-c2cc(Cl)ccc2Cl)o1 39892600 QEXILGDEKXWLHH-UHFFFAOYSA-N 436.320 4.893 50 10 IJGE Cc1ccc(Oc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2[N+](=O)[O-])cc1C 40658837 CKKLETDNFXAXRD-UHFFFAOYSA-N 448.266 4.858 50 10 IJGE CCCCCCOc1ccc(/C=N/NC(=O)COc2cccc(Br)c2)cc1 40912110 IKHJEJBMXVDOLG-HZHRSRAPSA-N 433.346 4.937 50 10 IJGE N#C/C(=C/Nc1ccc2c(c1)OCCO2)c1nc(-c2cc3ccccc3oc2=O)cs1 102419711 WVGAKMZIBVJTIA-QINSGFPZSA-N 429.457 4.664 50 10 IJGE COc1ccc(Br)cc1C(=O)NN=Cc1ccccc1OCc1ccccc1 252486262 HHSZCUCRNFYOEM-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE CC(=NNC(=O)CSc1nnc(-c2ccc(C)cc2)n1-c1ccccc1)c1ccccc1 254416418 GCMJWYRMDBLIMA-UHFFFAOYSA-N 441.560 4.875 50 10 IJGE CN(C)c1ccc(C=NNC(=O)c2[nH]c3ccc([N+](=O)[O-])cc3c2-c2ccccc2)cc1 254668978 JQEKTHYHDDFQGW-UHFFFAOYSA-N 427.464 4.573 50 10 IJGE O=C(NN=Cc1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1)c1cccc(C(F)(F)F)c1 254706121 KYHCZQZYQFSSSE-UHFFFAOYSA-N 430.342 4.565 50 10 IJGE COc1ccc(F)cc1[C@@H](Br)c1sccc1I 383337103 WRGDCFTUFJRTBP-LLVKDONJSA-N 427.076 4.985 50 10 IJGE CC(C)(CBr)CCNC(=O)c1cc(Br)ccc1Br 385806418 PPRQHYGEXIBBMC-UHFFFAOYSA-N 441.989 4.753 50 10 IJGE COc1ccc(O[C@@H]2C[C@H](Br)C23CCCC3)cc1I 712929997 KIIQPAGQZBFCJG-UONOGXRCSA-N 437.115 4.775 50 10 IJGE ClCCc1nc2cccc(Br)c2n1Cc1sncc1Br 722795900 IKWMBMTXXVTEAW-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE N#Cc1ccc(NNC(=O)[C@H]2C[C@H]2c2ccccc2OC(F)(F)F)cc1C(F)(F)F 746891780 KCEHJZVERZINEG-KBPBESRZSA-N 429.320 4.722 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cccn2[C@@H](C)Cc2ccccc2)c1C 774307851 OHSIVIVCOJQILV-KRWDZBQOSA-N 426.524 4.518 50 10 IJGE N#Cc1ccc(NNC(=O)c2cccc(-n3nccc3C(F)(F)F)c2)c(C(F)(F)F)c1 799751432 NQZLJSXVDPISTJ-UHFFFAOYSA-N 439.319 4.538 50 10 IJGE C=CCSc1ccccc1C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1 1521294221 CJHABRBVSKNZOX-UHFFFAOYSA-N 436.508 4.758 50 10 IJGE N#CSc1ccc(NC(=O)c2ccnc(NC(=O)c3ccc(Br)o3)c2)cc1 1860510219 OGYADTAZTWPBAR-UHFFFAOYSA-N 443.282 4.515 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2F)[C@@H]1c1ccccc1Cl 1865684953 CAFIYANBZBNROF-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706467 XLWYJLPBJOGBSC-QFIPXVFZSA-N 443.507 4.627 50 10 IJGE CCN(CC)C(=O)c1cc(C)ccc1NC(=O)/C(C#N)=C/c1cccc(Br)c1 1866131901 SNBKAOSIRIRSJG-SFQUDFHCSA-N 440.341 4.785 50 10 IJGE CCCC[C@@H](NC(=O)C[C@H]1CC(=O)c2ccccc21)C(=O)Nc1ccc(SC#N)cc1 1867243861 VNPBHMIDBMAGAN-IIBYNOLFSA-N 435.549 4.634 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C2CCN(C[C@H](CBr)CC3CC3)CC2)C1 1879198038 HVXIRLVUDPOZQW-PKOBYXMFSA-N 429.443 4.767 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2C[C@@H]3C[C@H]3CO2)s1 1900925239 XRQKIMVUFMBLRH-UEGXPFIPSA-N 433.536 4.867 50 10 IJGE CC1([C@@H](Br)c2c(Cl)sc(Br)c2Cl)CS(=O)(=O)C1 1925567198 UQZCLMWODATSJB-LURJTMIESA-N 443.009 4.688 50 10 IJGE C[C@H]1C[C@@H](Br)CN(Cc2cccc(Br)c2Br)C1 1943906357 PKYYXNGJVALJME-GXSJLCMTSA-N 425.990 4.817 50 10 IJGE CCN(CC)C[C@@H](Br)Cc1c(Br)cccc1Br 1949915328 HIDLEXLOYFWATL-JTQLQIEISA-N 428.006 4.859 50 10 IJGE CC(C)(C)C[C@@H](CCl)Nc1ncc(I)cc1Br 2015758209 DWUATZQLYDUECO-VIFPVBQESA-N 431.543 4.904 50 10 IJGE C[C@H](CCCCBr)NCc1ccc(I)c(Cl)c1 2026564622 VHLUADZIYUOIGF-SNVBAGLBSA-N 430.555 4.988 50 10 IJGE C[C@H]1[C@H](CBr)CCN1Cc1ccc(I)c(Cl)c1 2026567580 SZKBRVITLNSZFL-ONGXEEELSA-N 428.539 4.550 50 10 IJGE C[C@]12CN(Cc3ccc(Br)cc3Br)C[C@@]1(CBr)C2 2046797242 IIVVJVFMMMLZKH-KBPBESRZSA-N 438.001 4.819 50 10 IJGE O=C(CBr)c1ccc(OC(F)F)c(OC(F)(F)F)c1Br 2054830317 FKPQWFJFNALIJF-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE O=C(CCl)c1cc(C(F)(F)F)cc(I)c1OC(F)(F)F 2055161831 AUTSMVJCFRPJQJ-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1ccc(Cl)c(Br)c1 2090384425 IDVMVCKIYGCYRS-SNVBAGLBSA-N 429.605 4.739 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CCC([C@H](F)CBr)CC1 2115939384 DBBVUARNJSILIN-SECBINFHSA-N 433.568 4.749 50 10 IJGE CCC[C@H](CBr)CN1CCC[C@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2129045858 WTFFIOPWRSBMAP-CABCVRRESA-N 429.403 4.747 50 10 IJGE Cl[C@@H]1COC[C@H]1c1sc(Br)c(Br)c1Br 2209977225 QAHSQHZNAAOIHI-QWWZWVQMSA-N 425.367 4.757 50 10 IJGE C[C@H]1CCC[C@@](CBr)(OCCOCCOCCOCc2ccccc2)C1 2227775445 AOGVXPCSSVWIEM-PZJWPPBQSA-N 429.395 4.597 50 10 IJGE Cc1ccc(C(=O)Nc2ccc(F)c(CBr)c2)cc1I 2232824445 ZIVYPQHZJBPWFW-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE Cc1ccc(I)c(C(=O)N2[C@H]3CCC[C@H]2CC(Br)C3)c1 2240911533 FKVYVBCOYJGJLD-STQMWFEESA-N 448.142 4.520 50 10 IJGE CN(c1ncc(C(F)(F)F)cc1Br)[C@H](CCBr)C(F)F 2240947396 XFDQCKQFTAPEFB-MRVPVSSYSA-N 426.021 4.718 50 10 IJGE CC[C@H]1[C@H](Br)CCN1C(=O)c1cc(Br)sc1Br 2251033370 JPXJMNJPVGQESU-SFYZADRCSA-N 446.002 4.661 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@H](Br)C2(CC2)C1 2282983274 KHGKYBYHHVWICR-LBPRGKRZSA-N 425.523 4.631 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)[C@H]1CCC[C@@H]1Br 2300241301 XJASLUYEANKFFY-GWCFXTLKSA-N 428.539 4.692 50 10 IJGE C[C@@H]1CCCN(Cc2sccc2I)[C@H]1CCBr 2301072790 AVZPSZPRONWYFH-PWSUYJOCSA-N 428.177 4.738 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)C1CC(CCl)C1 2306215981 AHZFCRHWDQOGRR-UHFFFAOYSA-N 428.539 4.503 50 10 IJGE CCS(=O)(=O)C[C@H](Cl)c1c(Cl)cc(Br)c(F)c1Br 2315443534 JQIFVOPXDZYKKB-ZETCQYMHSA-N 442.959 4.719 50 10 IJGE Cc1ccc(S(=O)(=O)NCC(O)=C(C#N)c2nc(-c3ccc(C)c(C)c3)cs2)cc1 2331385400 ZWFHVLQMDZTNDB-UHFFFAOYSA-N 439.562 4.507 50 10 IJGE CC(C)(C)OC(=O)N[C@@]1(C)CN(CC2(CBr)CCCCCC2)CC1(F)F 2336779748 BPHPKDDAXSCIBW-KRWDZBQOSA-N 439.385 4.956 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCCN(c2ccnc(Cl)c2CBr)C1 2344702255 QEVSUXTUBOZSMB-UHFFFAOYSA-N 444.751 4.978 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@H]3CCCN(C(=O)OC(C)(C)C)[C@H]3C2)C1 2345005085 TZGDZUDFVANYRG-SJORKVTESA-N 429.443 4.909 50 10 IJGE COc1ccc2nc(/C(C#N)=C/c3ccccc3OCC(=O)Nc3ccc(C)cc3)[nH]c2c1 33475813 JUCAHZZKFMHEKL-CPNJWEJPSA-N 438.487 4.962 50 10 IJGE C=CCOc1ccc(/C=C2/C(=O)N(Cc3ccc(F)cc3)C(=O)C(C#N)=C2C)cc1OCC 38608728 DTDIGSYHELUGAH-FYJGNVAPSA-N 446.478 4.582 50 10 IJGE CC(C)c1ccc(O[C@@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccco2)cc1 38657553 AKJFVQDIBXHEPR-UPCLLVRISA-N 444.487 4.994 50 10 IJGE COc1cc(/C=N/NC(=O)COc2c(C)cccc2C)ccc1OCc1ccccc1C 40911549 GEMNUOWBTHWBMK-JFLMPSFJSA-N 432.520 4.729 50 10 IJGE O=C1NCCc2ccc([C@@H](Cl)c3cc(Br)ccc3Br)cc21 161106196 CWTOHNSJFDUETE-OAHLLOKOSA-N 429.539 4.826 50 10 IJGE CCCCCCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc3c(c2)OCCO3)cc1OC 206179942 OPMAHMXOPDAUIM-RGEXLXHISA-N 436.508 4.971 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N(CCBr)C1CCC1 228562797 DUWZWOWPPFCVBZ-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE CC[C@H]1CN(C(=O)c2cc(Br)sc2Br)C[C@@H]1Br 400008744 MVSDFKKDXUOHRT-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE Clc1ccc(I)c(CN2CC[C@@H](CCBr)C2)c1 405342468 NTNYYIJPMJDIQG-SNVBAGLBSA-N 428.539 4.552 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@@]1(C)CN(c1ncc(Br)cc1CCl)C2 706636692 FHZXNDWSFOJIJC-SFTDATJTSA-N 434.809 4.931 50 10 IJGE C[C@@H](Br)[C@@H]1CCN(C(=O)c2cc(Br)c(Br)s2)C1 719965888 DDAHDOVGJMOBJB-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE CC(=NNC(=O)Cc1nc(O)c2c(C)c(C)sc2n1)c1ccc(-c2ccccc2)s1 744739267 QQBZZNKYEPDJRJ-UHFFFAOYSA-N 436.562 4.825 50 10 IJGE CCc1c(C)nn(-c2cccc(C(=O)NNc3ccc(OCC(F)(F)F)cc3)c2)c1C 767093760 NQYBQJBAKCGPMT-UHFFFAOYSA-N 432.446 4.750 50 10 IJGE CC(C)c1ncc(OCc2ccccc2)c(C(=O)NNc2nc3ccccc3[nH]c2=S)n1 1633443207 BRNKEGRMEKWWNH-UHFFFAOYSA-N 446.536 4.542 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2)[C@H]1c1cccc(Cl)c1 1865684388 XYPKOBXQDBSIJG-INIZCTEOSA-N 430.817 4.822 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2cccc(Cl)c2)c1 1865689932 GWZYHAIETIJIPI-NRFANRHFSA-N 434.927 4.764 50 10 IJGE CCCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccccn1)C(C#N)=C(N)O2 1865700558 XKGNAUHSMQSDIJ-GOSISDBHSA-N 426.307 4.745 50 10 IJGE COCCOc1ccc(/C=C(\C#N)C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)cc1 1866386289 RIILPHZARSBXQG-LTGZKZEYSA-N 429.520 4.506 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(Cc2ccccc2)C[C@@]2(CBr)CC2(F)F)C1 1893489419 OKGMSRKOCXCITO-IBGZPJMESA-N 445.348 4.528 50 10 IJGE Cc1ccc([C@@H](Br)c2c(Br)c(Br)nn2C)s1 1901043398 SZSLCQSPQXITKA-SSDOTTSWSA-N 428.975 4.799 50 10 IJGE CCN(C[C@@](C)(CI)O[C@H]1CC[C@@H]2C[C@@H]2C1)C(=O)OC(C)(C)C 1917431937 CNVKOIXZDYYZHY-ZXFNITATSA-N 437.362 4.642 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC12CCC1(CCC[C@@H](CI)O1)CC2 1937362661 ZINODGJPXGHBKU-DIOPXHOYSA-N 435.346 4.587 50 10 IJGE C[C@H](NC(=O)c1csc(Br)c1Br)C1(CBr)CC1 1945187281 SQCYHWHBUMYWOJ-LURJTMIESA-N 446.002 4.567 50 10 IJGE C[C@H]1CO[C@@](CBr)(Cc2cc(Br)ccc2Br)C1 2006498781 GFBKZXXXQDRETQ-NOZJJQNGSA-N 426.974 4.944 50 10 IJGE F[C@@]1(CBr)CCN(Cc2cc(Br)ccc2Br)C1 2006501368 VXYCIHPIKXHMGP-GFCCVEGCSA-N 429.953 4.521 50 10 IJGE CN[C@@H](c1cc(Br)c(C)cc1Br)[C@H]1C[C@@H](Br)C1 2020162011 SEZKDDQZNHUKCM-VYUIOLGVSA-N 425.990 4.954 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OCc2cccc(F)c2)C1 2024642780 VZTYPVIZMOIGMY-SFHVURJKSA-N 449.304 4.547 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1cc(Br)cc(Br)c1 2081239768 WPGRPYGTDKFAAM-QPUJVOFHSA-N 441.989 4.751 50 10 IJGE CC(C)[C@H](CBr)CN1CC[C@@H](C(F)(F)F)C[C@H]1CNC(=O)OC(C)(C)C 2107584928 NYTWBLDNRSSMGB-KFWWJZLASA-N 445.364 4.821 50 10 IJGE CC1(C)[C@@H](CBr)OCCN1Cc1ccc(Cl)c(Br)c1F 2166823815 OWNUWUXYNCHZKU-LLVKDONJSA-N 429.555 4.616 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ncc(Br)cc2Cl)C[C@H]1CBr 2183590800 QQSHIYVIJIHSHQ-APPZFPTMSA-N 436.497 4.503 50 10 IJGE BrC[C@@H]1CCc2nc([C@H]3C[C@@H]4CC[C@H](C3)N4Cc3ccccc3)ncc2C1 2187368134 KSKFHLXIAGUNPY-UKAVVXHISA-N 426.402 4.887 50 10 IJGE COc1cc(Br)c([C@H](Cl)[C@H]2C[C@H](Br)C2)c(OC)c1OC 2196881595 UWHCBVJUXGVJPD-DNSOKLHBSA-N 428.548 4.928 50 10 IJGE O=C(c1ccc(Br)cc1Cl)N1CC[C@H](C(F)(F)CBr)C1 2197762757 JXSRDZZNDODKGQ-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE Fc1cc(CBr)cc(F)c1OC[C@@H]1CC1(Br)Br 2213081352 CHZRAUMNUFNKTM-ZETCQYMHSA-N 434.900 4.745 50 10 IJGE CC1(C)CCN(Cc2ccccc2)CCN1c1nc2ccccn2c1CBr 2239859177 VBJBYGVUBLIJCJ-UHFFFAOYSA-N 427.390 4.720 50 10 IJGE C[C@@H]1OCC[C@@H]1[C@H](Br)Cc1cc(Br)cc(Br)c1 2252836613 DULUYPRROUIHJF-AQUOVQTQSA-N 426.974 4.943 50 10 IJGE O=C(c1cnc(C(F)(F)F)s1)N(Cc1ccccc1)[C@H](CBr)C1CC1 2260729212 CLLQPWNUYFWMON-CYBMUJFWSA-N 433.293 4.978 50 10 IJGE CN(C(=O)c1cc(F)c(Br)cc1Cl)[C@@H](CCBr)C(F)F 2282986937 XHLJQXZJYRYUPE-JTQLQIEISA-N 437.481 4.732 50 10 IJGE O=C(NC[C@H]1CCCC[C@H]1Br)c1cc(Br)c(F)cc1Cl 2285957382 GSJJVAOJMUUSJY-PSASIEDQSA-N 427.539 4.925 50 10 IJGE N#CC(=Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1nc2ccc(OC(F)(F)F)cc2s1 2297399223 QJEHSYWSBDOOAH-UHFFFAOYSA-N 434.355 4.649 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCC12CCN(C(=O)OCc1ccccc1)CC2 2308058834 XYYAESHVJOXELF-FQEVSTJZSA-N 437.422 4.921 50 10 IJGE CCOc1ccc(N2C(=O)[C@H](CC)SC2=C(C#N)C(=O)N[C@H](C)c2ccccc2)cc1 2314594059 YICHTOFEFGIBLM-IERDGZPVSA-N 435.549 4.556 50 10 IJGE CCCCc1ccc(NC(=O)C(C#N)=CNCCc2ccc(Br)cc2)cc1 2324474194 HGVFTYTUKRGCBR-UHFFFAOYSA-N 426.358 4.970 50 10 IJGE Cl[C@H]1CN(Cc2ccc(I)c(Br)c2)C[C@H]1C1CC1 2325226220 MISWZIGDHRNAEK-AAEUAGOBSA-N 440.550 4.503 50 10 IJGE Cc1ccc(S(=O)(=O)NCC(O)=C(C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 2331300891 XOYKFXTYGHEBQE-UHFFFAOYSA-N 445.953 4.543 50 10 IJGE CCCCN(CCCC)Cc1ccc(C(=O)NNC(=S)Nc2ccccc2CC)o1 4683350 OMKIIRGGVFCNNL-UHFFFAOYSA-N 430.618 4.876 50 10 IJGE CCOc1cc(/C=C2/C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(C)cc1 38604609 RZUFARYHROEHSF-LPYMAVHISA-N 444.531 4.973 50 10 IJGE Cc1ccc(C)c(N2C(=O)c3ccc(C(=O)Nc4nc(CCl)cs4)cc3C2=O)c1 170535181 WEKVJCWUECOMNQ-UHFFFAOYSA-N 425.897 4.552 50 10 IJGE CCCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(-c3ccc(C(=O)OCC)cc3)o2)C1=O 214228429 KRZHYKFAXGCVSK-ZHZULCJRSA-N 432.476 4.516 50 10 IJGE CC(C)(C)C(=O)[C@H](Br)Cc1ccc(Cl)cc1I 232218375 XJUUXCFIXTVHBP-SNVBAGLBSA-N 429.523 4.866 50 10 IJGE CC(C)N(CCCCl)C(=O)c1cc(I)ccc1Br 232632291 RNHPFYUGWKZPDL-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE CCC(CC)N(CCBr)C(=O)c1cccc(C)c1I 232897420 OPAKCLVAXICKGK-UHFFFAOYSA-N 438.147 4.625 50 10 IJGE COc1ccc(OC)c(C=NNC(=O)c2cc(-c3ccc(-c4ccccc4)cc3)n[nH]2)c1 254632481 LALCQKXUNHAZOT-UHFFFAOYSA-N 426.476 4.525 50 10 IJGE COc1ccccc1[C@H](Br)c1cc(I)cc2c1OCC2 380257790 PAJUGOWAKUWQRH-HNNXBMFYSA-N 445.094 4.719 50 10 IJGE Nc1ccc(Cl)c([C@@H]2CN(Cc3ccccc3)C[C@H]2CI)c1 382696506 SFBRBWKAFIRAND-RHSMWYFYSA-N 426.729 4.573 50 10 IJGE CCOC(=O)c1csc2c(I)ccc(CBr)c12 725276478 VRDSVEJFTDAOHD-UHFFFAOYSA-N 425.085 4.578 50 10 IJGE Cc1onc(-c2cccc(Br)c2)c1C(=O)NNc1ccc(F)c(F)c1F 752142036 BHORGUOMYZQJGF-UHFFFAOYSA-N 426.192 4.587 50 10 IJGE C[C@H]1CN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)CCC1(F)F 753016458 GHDYJHBCMHAYKR-VUVCFOEZSA-N 443.885 4.528 50 10 IJGE COc1cc(NNC(=O)c2cc(OCC(F)(F)F)c3ccccc3n2)ccc1Cl 790179591 XDVZIPMDRLBYSO-UHFFFAOYSA-N 425.794 4.595 50 10 IJGE Cc1cccc([C@@H](NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c2ccccn2)c1 799613965 SVWKYPKQHOOYJG-HXUWFJFHSA-N 425.414 4.696 50 10 IJGE Cc1[nH]c2ccccc2c1C=NNC(=O)COc1ccc2ccccc2c1Br 1084394266 REHMENXOFOUPNK-UHFFFAOYSA-N 436.309 4.921 50 10 IJGE C=CCCC[C@@H](C(=O)NNC(=O)Nc1cc(Cl)c(OC)cc1OC)c1ccccc1 1155427665 OHOUCFZZLIADHD-MRXNPFEDSA-N 431.920 4.650 50 10 IJGE C=CCCN(OCc1ccccc1)C(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C 1634163766 ODIYBJGEUOSNSB-WWNGRIQCSA-N 433.552 4.727 50 10 IJGE COc1cccc(O[C@@H](C)C(=O)NN=Cc2ccc(OCc3ccccc3C)c(OC)c2)c1 1772755855 HDTXGQQVKUSGRN-IBGZPJMESA-N 448.519 4.509 50 10 IJGE Cc1cccc(COc2cccc(C=NNC(=O)CSc3nc4ccccc4[nH]3)c2)c1 1772760633 ZWYHMKQZFHFHLK-UHFFFAOYSA-N 430.533 4.693 50 10 IJGE N#CSc1ccc(NC(=O)CNC(=O)c2ccc(-c3cc4ccccc4[nH]3)cc2)cc1 1868148374 RSLVPZGIHNHDGS-UHFFFAOYSA-N 426.501 4.777 50 10 IJGE CC(CBr)(CBr)Cc1sccc1I 1888203783 RGIFNIHUGNGPBO-UHFFFAOYSA-N 437.966 4.691 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)C(=O)c1ccc(Br)cc1Cl 1916354613 JYPNRTXAFYRAGZ-OAHLLOKOSA-N 431.157 4.999 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cccc(OC(F)(F)F)c1 1916355501 VJVFQYOZBCPEOE-INIZCTEOSA-N 446.263 4.638 50 10 IJGE CN(Cc1cccc(Br)c1Br)[C@H]1CCC[C@H]1Br 1943885499 WISIFWFQYGDRDI-PWSUYJOCSA-N 425.990 4.959 50 10 IJGE CC1(C)[C@H](Br)CCN1Cc1cc(Br)ccc1Br 2006503890 SVVJQIZANBJLQI-GFCCVEGCSA-N 425.990 4.959 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@H]2CCC[C@@]2(CCl)C1 2103164163 HHBNMZVBHLXAPV-AMIZOPFISA-N 427.589 4.754 50 10 IJGE C[C@@H]1CC[C@H](CNC(=O)C(F)(F)F)N(CCCCCCCCCBr)C1 2106786347 UOHIGLFCZVJLFG-HZPDHXFCSA-N 429.365 4.891 50 10 IJGE Cn1ncc(Cl)c1CC(CBr)(CBr)c1cccc(Cl)c1 2168231656 NCNFMBIRJDEAHS-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE O=C(c1ccccc1OCc1ccccc1)N1C[C@]2(F)CCC[C@]2(CBr)C1 2176638589 BUMZYLLFDSGLJQ-FCHUYYIVSA-N 432.333 4.995 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2C1[C@H]2CN(Cc3ccccc3)C[C@H]12 2202298193 MWGLMZOYFVIDRA-GJZGRUSLSA-N 446.776 4.849 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Br)[C@@H]1OCCOC1(C)C 2203000381 NXEKWJZRUJWDRY-YPMHNXCESA-N 428.548 4.741 50 10 IJGE C[C@@H]1CN(CCCCI)c2ccccc2CN1C(=O)OC(C)(C)C 2248246453 BKWDTJJJOXTZMH-OAHLLOKOSA-N 444.357 4.847 50 10 IJGE COc1ccc([C@@H](Cl)c2cocc2Br)cc1I 2249413972 ONBATBOBFADVCH-GFCCVEGCSA-N 427.463 4.984 50 10 IJGE CC(C)(C)OC(=O)N(CC1CC1)C1CCN(CC2(CBr)CC(F)C2)CC1 2265631695 GJVNMYOUZTYSTR-UHFFFAOYSA-N 433.406 4.611 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CC3(CCC3)CO2)cc1I 2269557242 SXAALVYGLMQUFS-KGLIPLIRSA-N 437.115 4.695 50 10 IJGE Cc1ccc(NC(=O)C(C#N)=Cc2ccc(-c3ccc(C)cc3[N+](=O)[O-])o2)c([N+](=O)[O-])c1 2314572191 VQYVYILRKZYBMO-UHFFFAOYSA-N 432.392 4.926 50 10 IJGE Cc1c(F)ccc(C(=O)N(C)C[C@@H](Br)COCc2ccccc2)c1Cl 2316780453 QNSOJNOVWWMRAW-OAHLLOKOSA-N 428.729 4.840 50 10 IJGE COc1cccc(OCC(=O)Oc2cccc(C=C(C#N)c3ccc(OC)c(OC)c3)c2)c1 2318356262 HSZADZDRWQPHKG-UHFFFAOYSA-N 445.471 4.761 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(C(=O)N/N=C/c3ccc(Br)s3)cc2)c1 12577339 OUJAJLBIOHZDJS-WSDLNYQXSA-N 442.338 4.835 50 10 IJGE CC[C@H](C)c1ccccc1OCC(=O)NNC(=O)c1ccc(OCCc2ccccc2)cc1 14041569 UHOPQUPPAATTGR-FQEVSTJZSA-N 446.547 4.662 50 10 IJGE COc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cccc(Cl)c1 38651126 WQZLEIUTFUAFLK-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE Cc1ccccc1SCC(=O)N/N=C1\C(=O)N(C/C=C/c2ccccc2)c2ccccc21 59166576 CUHQAGXZJPLLRX-ZSFHLVSASA-N 441.556 4.668 50 10 IJGE C/C(=N/NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(OCc2ccc(Cl)cc2)cc1 59384099 OTAVMOLAJFXGBN-XYGWBWBKSA-N 437.883 4.910 50 10 IJGE C=CCNC(=O)/C(C#N)=C1\S[C@H](Cc2ccccc2F)C(=O)N1c1ccc(C(C)C)cc1 101241541 MXSMVMPYFGKAKB-IVYNLYIOSA-N 449.551 4.678 50 10 IJGE CC[C@H](Br)c1cn(-c2c(Br)cc(C)cc2Br)nn1 163051612 AUKVEPQJADMVAA-QMMMGPOBSA-N 437.961 4.947 50 10 IJGE CCn1c(C)c(/C=N\NC(=O)c2cccn(Cc3cccc(Cl)c3)c2=O)c2ccccc21 169920702 YKNRXZUGPFIKEX-DICXZTSXSA-N 446.938 4.597 50 10 IJGE CCOc1cc(/C=N/NC(=O)Cc2cc(OC)ccc2Cl)cc(Cl)c1OC(C)C 169922048 LCVNIFYNYYBSAC-WYMPLXKRSA-N 439.339 4.881 50 10 IJGE O=C(N/N=C\c1cc(Br)c(O)c(Br)c1)Nc1cccc(Cl)c1 169940230 NYQQSNUAOACMNU-WSVATBPTSA-N 447.514 4.726 50 10 IJGE CCc1cccc(C)c1N/C=C(/C#N)C(=O)Nc1ccc(I)cc1C 217253852 AVBXBGXGZLSZPY-VBKFSLOCSA-N 445.304 4.929 50 10 IJGE CC[C@](C)(CCBr)NC(=O)c1ccc(I)c(Cl)c1 228570038 NVFTUHOVHFRORX-CYBMUJFWSA-N 444.538 4.628 50 10 IJGE CC(=O)[C@@H](Br)[C@@H](C)c1cc(I)ccc1Br 300889916 DLYGKXKEFOOPSQ-KGFZYKRKSA-N 445.920 4.510 50 10 IJGE COCCn1c(C)cc(/C=C(/C#N)C(=O)NCc2ccc(-c3cccc(OC)c3)cc2)c1C 304028979 MKQSMJCHDAPWJK-MYYYXRDXSA-N 443.547 4.650 50 10 IJGE ClCc1c(I)ccc2scc(I)c12 307431758 XOAUVDONIBRGPB-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE Cc1cc([C@@H](Br)c2cnn(C)c2I)c(C)cc1Cl 393608459 AQZFDXFKMYDNDW-GFCCVEGCSA-N 439.522 4.779 50 10 IJGE Clc1ccc(I)c(CN2CCC[C@@H]2CCBr)c1 405351680 VCDSKQKTLIHEAX-GFCCVEGCSA-N 428.539 4.694 50 10 IJGE O=C(N[C@@H]1CCC[C@H](Br)C1)c1scc(Br)c1Br 705449096 XPMUMNVDAGNWRF-NKWVEPMBSA-N 446.002 4.709 50 10 IJGE CC[C@@H](CCBr)NC(=O)c1scc(Br)c1Br 705517593 ZBUVOSNXCGYQIU-LURJTMIESA-N 433.991 4.567 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N[C@@H]2CC23CCCCC3)c(-c2ccc(Cl)cc2)n1 770822547 BWMGRHGEIQHVML-DILWRCETSA-N 433.943 4.863 50 10 IJGE CN(C[C@@H]1CC=CCC1)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 784316494 ASXPKPPGLVYRIZ-SQVRNEIYSA-N 433.943 4.839 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(OCC(F)(F)F)c(F)c2)c(C(F)(F)F)c1 800572008 SCYVXMXTBGGIQG-UHFFFAOYSA-N 436.287 4.806 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)Nc2ccc(-c3cnco3)cc2)c(-c2ccccc2)n1 918626561 BESLBYHNXNESPE-DEDYPNTBSA-N 434.459 4.664 50 10 IJGE O=C(CCC(=O)Nc1ccccc1Cl)NN=Cc1cccc(OCc2ccccc2)c1 1084102546 WQOIAFIDYHJJLE-UHFFFAOYSA-N 435.911 4.788 50 10 IJGE Cc1ccc(COc2ccc(C=NNC(=O)CSc3nc4ccccc4[nH]3)cc2)cc1 1084249528 VJYPPJMLVIEQCI-UHFFFAOYSA-N 430.533 4.693 50 10 IJGE C=CCNC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccccc3F)c2C)cc1 1351101471 BRZTXEGJQJBTCC-RCCKNPSSSA-N 442.494 4.695 50 10 IJGE C/C(=C/C(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1)c1ccc(C(F)(F)F)cc1 1641071648 OXIMROGKJUCJIC-UGEDRFTOSA-N 442.437 4.877 50 10 IJGE CCCCCN1C(=O)C(=NNC(=O)/C=C\c2ccccc2)c2cc(Br)ccc21 1772752350 ZAEUFQOQIMEYCH-AGPVYWDCSA-N 440.341 4.520 50 10 IJGE CC(=O)[C@H](Br)c1ccc(I)c(SC(F)(F)F)c1 1848425827 FNJGEDFGJFFYRD-VIFPVBQESA-N 439.034 4.928 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1ccccc1Cl 1865690905 DTOXCBQNKOCXGV-QFIPXVFZSA-N 446.938 4.930 50 10 IJGE Cc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2cccc([N+](=O)[O-])c2)cc1 1865706053 MKWQDQZRMAXXSL-QFIPXVFZSA-N 449.470 4.974 50 10 IJGE COc1ccc(/C=C(\C(=O)NNC(=O)CCCSc2ccccc2)c2ccccc2)cc1 1865757497 FYSCNTAUHWHZHK-CLCOLTQESA-N 446.572 4.956 50 10 IJGE COc1ccc(Br)cc1C(=O)N(Cc1ccccc1)C[C@@H](C)Br 1914609094 CYTJJNITUOZFBD-CYBMUJFWSA-N 441.163 4.884 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(Br)cc1O 1915079376 BEOQPMWVJAQUHV-AWEZNQCLSA-N 441.163 4.971 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1ncsc1Br 1915111722 WDNXUOBZSKGOTD-LBPRGKRZSA-N 432.181 4.722 50 10 IJGE C[C@H]1C[C@H](Br)CCN1Cc1ccc(Br)cc1Br 1943855102 ZUFQYOXOFLPYOA-JOYOIKCWSA-N 425.990 4.959 50 10 IJGE C[C@H]1CCN(C(=O)c2csc(Br)c2Br)C[C@@H]1Br 1945188874 DDPSJZULIAEYML-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE C[C@H]1C[C@H](CBr)CN1C(=O)c1cc(Br)c(Br)s1 1950507822 INPOYPNANZQMSP-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE CN(Cc1cc(Br)ccc1Br)[C@H]1CCC[C@@H]1Br 2006498101 AXIHQQBLYUZXNW-STQMWFEESA-N 425.990 4.959 50 10 IJGE Cc1cccc([C@H](CI)OCCOCCOCc2ccccc2)c1 2007814355 OLLPUAARAZRSSU-FQEVSTJZSA-N 440.321 4.721 50 10 IJGE O=C(NC[C@@H]1CCCN(Cc2ccc(CBr)cc2)C1)OCc1ccccc1 2011642110 VOYAJZBVQMYLMO-NRFANRHFSA-N 431.374 4.720 50 10 IJGE C[C@@]1(CBr)CC(F)(F)CN1C(=O)c1cscc1OCc1ccccc1 2041122036 OZMDATAHWCBSFM-KRWDZBQOSA-N 430.314 4.962 50 10 IJGE CC[C@H](CBr)CN(C1CC1)[C@H](CCNC(=O)OC(C)(C)C)C(F)(F)F 2044706441 UGSYAVODDZPSOI-TZMCWYRMSA-N 431.337 4.718 50 10 IJGE O=C(CBr)c1ccc(OC(F)F)c(Br)c1OC(F)(F)F 2054828078 PHZZILVCPKBWCI-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE C[C@@H]1COc2ccc([C@H](Br)c3cc(I)sn3)cc21 2056489772 GRBNTOMTNNDPBC-UHLUBPPHSA-N 436.112 4.728 50 10 IJGE C[C@H](Br)[C@H]1CCCN1C(=O)c1c(Br)cccc1Br 2073314727 IXFHXGSGFHUOLK-GZMMTYOYSA-N 439.973 4.600 50 10 IJGE Cn1ncc(-n2c(CCl)nc3cc(Br)c(Cl)cc32)c1Br 2159862784 BLXOYEWZNQKFHA-UHFFFAOYSA-N 438.938 4.676 50 10 IJGE CC[C@]1(CNC(=O)c2ccc(CBr)cc2)CCCCN1C(=O)OC(C)(C)C 2162494132 FHYAMKPSZPSJIS-OAQYLSRUSA-N 439.394 4.881 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@@H]2NC(=O)[C@H](Br)C2CCCC2)C1 2167033043 PJZVICLIPAEIAZ-CSODHUTKSA-N 443.426 4.626 50 10 IJGE O=C(c1cccc(I)c1)N1CCCC12CCC(Br)CC2 2202251592 YYZMZDBYLKGCJV-UHFFFAOYSA-N 448.142 4.604 50 10 IJGE Cc1c([C@H](Cl)c2c(F)cc(F)c(Br)c2F)nn(C)c1Br 2236107251 GKKIUHOCQBOINZ-SECBINFHSA-N 432.465 4.999 50 10 IJGE COCCCCCO[C@H](CI)c1cccc(Br)c1 2258909985 UEURLNXYAGREQC-CQSZACIVSA-N 427.120 4.759 50 10 IJGE CCN[C@H](Cc1cc(Br)cc(Br)c1)C1CC(Br)C1 2263519525 SQANLMRKDWJQGL-UZANAETPSA-N 440.017 4.906 50 10 IJGE CC1([C@H](Br)c2cc3sc(Br)cc3s2)CS(=O)(=O)C1 2263632960 MSSVWGXMUMZUQE-SNVBAGLBSA-N 430.208 4.596 50 10 IJGE C[C@]12CO[C@](CO[C@H](CI)c3ccc(Br)cc3)(C1)C2 2266256605 MSEKLLLQUDNGGC-KFWWJZLASA-N 437.115 4.511 50 10 IJGE O=C(N[C@@]1(CBr)C[C@H]2CC[C@H]1C2)c1scc(Br)c1Cl 2268605140 BTSDYQHGIYELPA-UVPNAGLESA-N 427.589 4.848 50 10 IJGE O=C(N[C@]1(CCl)C[C@H]2CC[C@H]1C2)c1scc(Br)c1Br 2268626515 NNAARCJKJLXPKX-UPFKWVMWSA-N 427.589 4.801 50 10 IJGE CC(C)(C)OC(=O)NCCCOC1CCN(CCCCCCCBr)CC1 2277438477 KSGHPMKLKSDVTH-UHFFFAOYSA-N 435.447 4.728 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)[C@H](C)C[C@H]1Br 2285845166 WPJDMBCJAAMDDX-NQMVMOMDSA-N 427.539 4.876 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2Cc1cnn(Cc2ccccc2)c1 2286085629 XOQGWMAJMFSCMS-UHFFFAOYSA-N 445.748 4.839 50 10 IJGE Clc1ccc(CC[C@@H](Br)CN2CCCC2)c(I)c1 2318536702 BGHRGKDZVAPUDV-GFCCVEGCSA-N 442.566 4.737 50 10 IJGE COc1cccc(-c2ccc(C(=O)NNC(=O)C=Cc3ccc(C(C)C)cc3)c(C)n2)c1 2321126163 ZZGOAQJHUQPCGE-UHFFFAOYSA-N 429.520 4.663 50 10 IJGE C[C@@H]1C[C@@H](Cl)CCN(Cc2ccc(I)c(Br)c2)C1 2325223229 WQESIQPSZKYYPA-PWSUYJOCSA-N 442.566 4.893 50 10 IJGE C[C@@H]1CC[C@H](CBr)CN1Cc1cc(I)ccc1Cl 2327402296 GQUHSIKFDYTHJW-GHMZBOCLSA-N 442.566 4.940 50 10 IJGE C[C@]1(CCBr)CCN(Cc2cc(I)ccc2Cl)C1 2327407893 WRDXYQOOPWRANS-AWEZNQCLSA-N 442.566 4.942 50 10 IJGE Cc1c(Br)csc1C(=O)N1CC[C@@H](Br)C[C@@H]1C(F)(F)F 2361461922 BNQVMBQJCWSMEA-VXNVDRBHSA-N 435.103 4.749 50 10 IJGE N#C/C(=C/c1cn(CC(=O)Nc2ccccc2)c2ccccc12)C(=O)Nc1ccc(F)cc1 1211530 MTQLFDCSTHIUGN-JXAWBTAJSA-N 438.462 4.965 50 10 IJGE CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c(O)c1 12578647 GBPJSJCQIBCYSG-WPWMEQJKSA-N 444.535 4.563 50 10 IJGE COC(=O)c1c(NC(=O)c2cc(=O)c3cc(C)c(C)cc3o2)sc(/C(C)=C\C#N)c1C 103006521 YQTFNTHFXHWHHD-WDZFZDKYSA-N 436.489 4.746 50 10 IJGE COc1cc(/C=N\NC(=O)Nc2ccccc2C)cc([N+](=O)[O-])c1OCc1cccc(C)c1 169940076 HOSJVLQZDOQMSN-QFEZKATASA-N 448.479 4.955 50 10 IJGE C[C@@H]1CCC[C@](CCl)(NC(=O)c2ccc(I)c(Cl)c2)C1 232348701 JHBBEBXCRWFTAP-BMIGLBTASA-N 426.125 4.862 50 10 IJGE Fc1ccc([C@H](Br)c2ccc3c(c2)CCO3)c(I)c1 236224123 VNUBQCVLKFUIPL-OAHLLOKOSA-N 433.058 4.850 50 10 IJGE COc1ccc(OC)c([C@H](Br)c2sccc2I)c1 310799227 DBTYZWWVOOFWSS-LBPRGKRZSA-N 439.112 4.854 50 10 IJGE C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)c(CCl)c2Cl)CCN1Cc1ccccc1 396329343 DRRHGIBCEGSWLM-CQSZACIVSA-N 447.815 4.627 50 10 IJGE Clc1ccc(I)c(CN2CCC[C@@H](CBr)CC2)c1 405324286 BHTRCDZDUQJWRZ-LLVKDONJSA-N 442.566 4.942 50 10 IJGE CC(C)(C(=O)NNc1cc(Cl)ccn1)[C@@H](O)c1ccc(OCc2ccccc2)cc1 778967370 RZIFZZNUYNKBTN-NRFANRHFSA-N 425.916 4.517 50 10 IJGE O=C(NNc1nc2ccccc2s1)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1 810390197 CCTOEFFTNHUTSB-UHFFFAOYSA-N 438.896 4.824 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2Cl)ccc1Oc1ccccc1[N+](=O)[O-] 1083956698 OHIKTSNJGBZONI-UHFFFAOYSA-N 425.828 4.813 50 10 IJGE Cc1ccc(NC(=O)C(=O)NN=Cc2cc(C)n(-c3cc(Cl)cc(Cl)c3)c2C)cc1 1083997853 WDVQYCRVLNPFRJ-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE C/C(=C\C(=O)NNC(=O)Nc1ccc(Br)cc1)c1ccccc1C(F)(F)F 1138899545 NODSIQYEGICQTC-ZHACJKMWSA-N 442.235 4.724 50 10 IJGE C=Cc1ccc(CCNC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)cc1 1312740741 WEVFLSYJXGSAGP-IBGZPJMESA-N 425.598 4.729 50 10 IJGE C#Cc1cccc(NC(=O)NNC(=O)c2ccc(COc3ccc(Cl)c(C)c3)cc2)c1 1464983074 YXPTVDOFUYBZOK-UHFFFAOYSA-N 433.895 4.675 50 10 IJGE CCOc1cccc([C@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)c1O 1614623997 VOOLCAIJSHQBAD-AEFFLSMTSA-N 434.330 4.538 50 10 IJGE Cc1ccc([C@@H]2CN(Cc3ccccc3)C[C@H]2CI)cc1[N+](=O)[O-] 1614691904 JRMKCIQWMPTELL-MSOLQXFVSA-N 436.293 4.554 50 10 IJGE CCN(CC)c1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CBr)c(O)c1 1614704397 LMDXZGCFYRBLCI-RHSMWYFYSA-N 427.383 4.584 50 10 IJGE CCN(CC)c1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CBr)c(O)c1 1614704400 LMDXZGCFYRBLCI-YOEHRIQHSA-N 427.383 4.584 50 10 IJGE CCCc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1cccc(O)c1)C(C#N)=C(N)O2 1865681724 UZLNHKHNHHFBRO-FQEVSTJZSA-N 438.890 4.600 50 10 IJGE CCCc1nn(Cc2ccccc2)c2c1[C@@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 1865715056 UPNJAVYUGASYNR-FQEVSTJZSA-N 449.352 4.865 50 10 IJGE O=C(Nc1c(Br)cc(Cl)cc1Br)[C@@H]1C[C@@H]1Br 1897160864 ABXSVQVHHDREPG-RITPCOANSA-N 432.337 4.587 50 10 IJGE O=S(=O)(c1cc(Br)cs1)N(Cc1ccccc1)[C@@H](CCl)C1CC1 1915211144 VBAPUYUHAOYLRW-HNNXBMFYSA-N 434.808 4.719 50 10 IJGE CCO[C@H](C)C(CBr)(CBr)c1ccccc1Br 1941147273 BCELPPAUCCAHQF-SNVBAGLBSA-N 428.990 4.902 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCc2cc(Br)ccc2C1 1975076822 OAKJXDVACNZIKJ-ZFWWWQNUSA-N 433.184 4.842 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1C(=O)c1scc(Br)c1Br 2018115859 VYUOPUACMFUXEG-XPUUQOCRSA-N 446.002 4.661 50 10 IJGE CC(C)(C)[C@H](Br)CNC(=O)c1c(Br)cccc1Br 2033088013 YQODNLUXRGWRSM-SNVBAGLBSA-N 441.989 4.751 50 10 IJGE CCN(CCCOCc1ccccc1)S(=O)(=O)c1cc(CBr)sc1C 2059284624 NPIBLEOTESPWRS-UHFFFAOYSA-N 446.432 4.569 50 10 IJGE CC1(C)CCCN(c2ncc(I)cc2Br)[C@@H]1CCl 2069531602 KJPDNCDUTLIRCH-LLVKDONJSA-N 443.554 4.683 50 10 IJGE O=C(N[C@H]1C[C@@H](CCBr)C1)c1cccc(Br)c1Br 2078363526 IOUWFOFCIRKJOL-DTORHVGOSA-N 439.973 4.505 50 10 IJGE COc1ccc(Cn2nc(CCl)c(I)c2C(F)(F)F)cc1C 2079209968 FNEHLEQCAPPOEP-UHFFFAOYSA-N 444.622 4.611 50 10 IJGE Fc1ccc(-n2nc(CCl)c(I)c2C(F)(F)F)c(F)c1F 2079210112 IQLDYCVOQHSQIF-UHFFFAOYSA-N 440.512 4.652 50 10 IJGE ClC[C@]12CCC[C@]1(CNc1ncc(I)cc1Br)C2 2086659248 UVYLBMLLLJOBCM-CHWSQXEVSA-N 441.538 4.660 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC2(CCC2)C[C@H]1CCl 2095167706 FVTBCQNCQBPREE-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE CN(Cc1ccccc1)[C@@H](Cn1c(CCl)nc2cncc(Br)c21)C1CC1 2095436243 GSWJQLWTYFPDBH-SFHVURJKSA-N 433.781 4.843 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCCN(C[C@@H](CBr)c2ccccc2)C1 2106781073 FCWHHNPANBHLCW-PKOBYXMFSA-N 425.411 4.792 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Cl)c1cn(C)nc1Br 2138256102 RRNUULNCLRBGPS-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE FC(F)(F)c1csc([C@H](Br)[C@@H]2CO[C@@H]3COC[C@H]32)c1Br 2158065994 CZSAEAQZRZANAI-HIORRCEOSA-N 436.087 4.627 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@@H](CBr)c2ccccc2)C2(CCC2)C1 2174539778 HVOZCPOLNFCGBC-IEBWSBKVSA-N 437.422 4.934 50 10 IJGE CC1(C)CCC(CNC(=O)[C@@H](Br)C2CCCC2)(NC(=O)OC(C)(C)C)CC1 2201481306 BXKFJSLTWVZEJA-INIZCTEOSA-N 445.442 4.920 50 10 IJGE CC(C)(C)[C@@H]1C[C@@H](CBr)CN(C[C@H]2CC2(Br)Br)C1 2218004263 BLQRCNMSLGRRNF-QJPTWQEYSA-N 446.065 4.872 50 10 IJGE CCOCc1cc(Br)c([C@H](Br)[C@]23COC[C@H]2C3(F)F)s1 2233017399 XJOHFQODAUTSHF-USWWRNFRSA-N 432.124 4.765 50 10 IJGE CC(F)(F)C[C@@H](CBr)NC(=O)Cc1ccc(Br)cc1Cl 2237436286 JHNFOSVDGUKHLE-JTQLQIEISA-N 433.518 4.570 50 10 IJGE CC12COC(CO[C@H](CI)c3ccccc3Br)(C1)C2 2266244067 YWKLQXMXVCZOMZ-WLYUNCDWSA-N 437.115 4.511 50 10 IJGE CCN(CC)c1cc(OC)c(C=C(C#N)C(=O)NC2CCCCC2)cc1Br 2297560055 HDAFUGCQCVFXSN-UHFFFAOYSA-N 434.378 4.660 50 10 IJGE Clc1ccc(CN2CCCC[C@@H](Br)C2)cc1I 2300242610 MICTYDRRBOGJEM-LLVKDONJSA-N 428.539 4.694 50 10 IJGE CCOc1ccc(C=C(C#N)C(=O)Nc2ccc(C)cc2)cc1I 2313568934 ZHXJCGLUQZLLEM-UHFFFAOYSA-N 432.261 4.544 50 10 IJGE N#CC(=Cc1cc(Br)ccc1OCc1ccccc1)C(=O)NC1CCCC1 2313724664 RLIRMEHVJGAMDC-UHFFFAOYSA-N 425.326 4.994 50 10 IJGE Cc1cccc(N2CCN(C=C(C#N)C(=O)Nc3cccc(Cl)c3Cl)CC2)c1C 2320902026 ZIZNSKBFEBCVEE-UHFFFAOYSA-N 429.351 4.778 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H]2CC[C@@H](Br)[C@H]2C1 2327404269 UAALJRBJBCTIKW-TVYUQYBPSA-N 440.550 4.550 50 10 IJGE CC(C)[C@@H](CBr)N(CCCS(=O)(=O)c1ccccc1)Cc1ccccc1 2343235560 LEDPSPOOCOMKNO-OAQYLSRUSA-N 438.431 4.772 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@@H]2CC(F)(F)CC[C@]2(NC(=O)OC(C)(C)C)C1 2344076743 KYEWAMXMLVSLHE-VKJFTORMSA-N 439.385 4.668 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@]2(CBr)CC2(F)F)c2ccccc2C1 2351887073 ISXWCVMJDWOYPA-SFHVURJKSA-N 431.321 4.664 50 10 IJGE CSc1ccc(/C=N/NC(=O)COc2ccc3ccccc3c2Br)cc1 12575741 FVAMHSBPGAUNCO-WSDLNYQXSA-N 429.339 4.853 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2O)CCC3)c1C 40826322 NLGNIMXHDKTTDX-ZXVVBBHZSA-N 431.492 4.633 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C/c2ccccc2OCCC)cc1 40994151 RWLMGFLGYFMJJD-HNVSCKTLSA-N 432.520 4.917 50 10 IJGE CC[C@H](CCBr)CNC(=O)c1cc(Br)ccc1Br 161229188 WPDLPZYFCYSECX-SECBINFHSA-N 441.989 4.753 50 10 IJGE CCCC[C@@H](CC)CO[C@](C)(CI)CNC(=O)OC(C)(C)C 231313505 QCLPPRFTYRYEEO-RHSMWYFYSA-N 427.367 4.938 50 10 IJGE COc1ccccc1C(=O)NN=C(C)CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 252460077 BLUHDMJTXKAKPN-UHFFFAOYSA-N 427.810 4.502 50 10 IJGE Cc1ccc(Cn2c(SCC(=O)NN=C/C=C\c3ccco3)nc3ccccc32)cc1 254383028 OCTXKYUBUAROHS-QBSWHLQBSA-N 430.533 4.894 50 10 IJGE Cc1c(C(F)(F)F)cccc1S(=O)(=O)N(CCBr)Cc1ccccc1 310590461 LHINFRFDLDFIJA-UHFFFAOYSA-N 436.293 4.600 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CCC(F)(F)[C@@H](CCl)C1 403966235 CRHLAJJQXWZKCY-QMMMGPOBSA-N 431.502 4.548 50 10 IJGE Fc1ccc2nc(CCl)n(Cc3cnc(Br)s3)c2c1Br 718882311 QUSQKPCZRDAUEA-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE C[C@](O)(CNC(=O)C(=O)Nc1ccc(S(F)(F)(F)(F)F)cc1)C1CCCCC1 773729571 FWEBZEFCTYDZJT-KRWDZBQOSA-N 430.439 4.730 50 10 IJGE Cc1c(O)nc2ccccc2c1C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2 1538732185 YIEDCYYBNYGRCD-OAHLLOKOSA-N 437.565 4.536 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)Cc1ccccc1F 1865759932 YZIARTLGLXZABJ-UHFFFAOYSA-N 432.282 4.507 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1cc(Cl)cc(Br)c1 1882087497 JZCXRQVDNVBDBS-GFCCVEGCSA-N 427.564 4.933 50 10 IJGE CN(C)CC(C)(C)CO[C@H](CI)c1ccccc1Br 1899010474 LJUCYWPKCLWKEZ-CQSZACIVSA-N 440.163 4.530 50 10 IJGE Cc1cccc2c1N(CCCCI)CCN2C(=O)OC(C)(C)C 1905180826 FYBBGTWAHXIOBU-UHFFFAOYSA-N 430.330 4.772 50 10 IJGE COc1cc(Br)c([C@H](Br)C2(Br)CC2)cc1OC 2002806570 MULJWTRMFVRDLL-NSHDSACASA-N 428.946 4.830 50 10 IJGE CO[C@H]1C[C@@H]1COc1c(Br)cc(CBr)cc1Br 2014581952 HSHPSIFXDNPUJS-KCJUWKMLSA-N 428.946 4.520 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1cc(Br)ccc1Cl 2081235480 GPIVCYKPMACNHC-PELKAZGASA-N 444.538 4.682 50 10 IJGE Clc1cc(CN2CC[C@H](Br)[C@@H]3CC[C@H]32)ccc1I 2086656015 SHTGRVROTYVGOM-COPLHBTASA-N 440.550 4.692 50 10 IJGE O=S1(=O)CCC([C@@H](Br)c2cc(Br)c(Cl)cc2F)CC1 2097825490 WLBLOEGXVBKXJO-GFCCVEGCSA-N 434.552 4.502 50 10 IJGE CC(C)(C)OC(=O)NCCCN(C(=O)C(C)(C)CCl)c1cccc(Br)c1 2106780123 VHFRTQFNCHFTSB-UHFFFAOYSA-N 447.801 4.962 50 10 IJGE CC(C)(C)OC(=O)N1CCCCN(C[C@H](CBr)CC2CC2)CC(F)(F)C1 2112861290 LGBMATGSIYBDFX-INIZCTEOSA-N 439.385 4.766 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C(F)(F)F)N(C[C@@H](CBr)CC2CC2)CC1 2112870432 CPHQKSGINMRYQL-HUUCEWRRSA-N 443.348 4.671 50 10 IJGE Cc1cc(C(=O)N(CCCBr)C(C)(C)C)ccc1I 2142141764 YQJCLPOQXDXGOD-UHFFFAOYSA-N 438.147 4.625 50 10 IJGE Cc1sc(Br)c(C(=O)N2[C@H]3CC[C@H]2[C@H](F)[C@@H](Br)C3)c1C 2190680964 ZZRDHKVLURTZTI-QFOLPQNPSA-N 425.161 4.606 50 10 IJGE O=C(c1cc(Cl)ccc1Br)N1CC[C@H](C(F)(F)CBr)C1 2197762918 KREMCVDNRUXMHP-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE COc1cc(Cl)c([C@@H](Br)[C@H]2OCCOC2(C)C)cc1Br 2202353968 SRGDNGBLVJQJFQ-CHWSQXEVSA-N 428.548 4.741 50 10 IJGE FC(F)(F)c1cnc(N2CCS[C@H](CCBr)C2)c(Br)c1 2240947025 UNYZVQLTZDPENE-SECBINFHSA-N 434.119 4.570 50 10 IJGE C=CC[C@@]1(CBr)CCCN(C[C@H]2CC2(Br)Br)C1 2250410372 WSSUSXKYVZZMIH-NEPJUHHUSA-N 430.022 4.546 50 10 IJGE COc1ccc([C@@H](Br)[C@@]23CC[C@@H](C2)[C@H](C)O3)cc1I 2269545125 MGEKIJPYWVIBRG-YZENIEGJSA-N 437.115 4.693 50 10 IJGE O=C(NCC[C@H]1CCCC[C@H]1Cl)c1ccc(Cl)c(I)c1 2283671084 WXNHXQKFTZGYIX-ZYHUDNBSSA-N 426.125 4.862 50 10 IJGE COc1cc(C=C(C#N)c2nc3ccccc3[nH]2)ccc1OCc1cccc(C(=O)O)c1 2293024404 HWMRMLKNUHAEBP-UHFFFAOYSA-N 425.444 4.913 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)cc2C=C(C#N)C(=O)NCc2ccco2)c(C)c1 2296709072 OAIOADBELAZXSG-UHFFFAOYSA-N 438.487 4.673 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)NCCOC)ccc1OCc1ccc(Cl)c(Cl)c1 2297500567 ZGGDALLPAFEJGA-UHFFFAOYSA-N 449.334 4.641 50 10 IJGE CC1(C)CCCN(Cc2sccc2I)[C@@H]1CBr 2301073194 GHAOZGOLFWMBNN-GFCCVEGCSA-N 428.177 4.738 50 10 IJGE CC1(C)CC(CBr)(CN2CCC(CNC(=O)OCc3ccccc3)CC2)C1 2304513267 BTVVBMPBEFZPHF-UHFFFAOYSA-N 437.422 4.826 50 10 IJGE Cl[C@H](CNCc1ccc(I)c(Br)c1)C1CCC1 2306219407 LWTSPSWISNMXBY-GFCCVEGCSA-N 428.539 4.551 50 10 IJGE Cl[C@@H](CCNCc1ccc(I)c(Br)c1)C1CC1 2306224561 RMYZDCVPEIEIOA-LBPRGKRZSA-N 428.539 4.551 50 10 IJGE CC[C@@H]1[C@H](Cl)CCN1Cc1ccc(I)c(Br)c1 2306232755 YKJIOVLGCGTUKW-DGCLKSJQSA-N 428.539 4.645 50 10 IJGE COc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)C=Cc4ccc(C)cc4)ccc32)c1 2314634249 NERVJLNDTKMNAS-SANMLTNESA-N 438.483 4.841 50 10 IJGE N#CC(=CNc1cccc(F)c1)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 2324608470 WVGKRKQBCXMHFZ-UHFFFAOYSA-N 440.522 4.579 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Br)c2)[C@H](C)C[C@@H]1Cl 2325225724 IJDZHHXZYDXSSZ-BREBYQMCSA-N 442.566 4.891 50 10 IJGE CCCCCCOc1ccc(C=NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc1OC 2328833137 HZIMSJBGINRZAB-NRFANRHFSA-N 449.592 4.654 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCN(C[C@H]2C[C@H](Br)C2)[C@@H](C(F)(F)F)C1 2337681804 BGHUALQPXGHHBK-KBUPBQIOSA-N 443.348 4.718 50 10 IJGE CCCN(C[C@@]1(CBr)CC1(F)F)C1CCC(NC(=O)OC(C)(C)C)CC1 2351892754 TXRFKLNPACJLIQ-JMLCCBQJSA-N 439.385 4.955 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)C1CC2(C1)C(F)(F)C21CCC1 2369433204 LHGMBCFBSLKNIX-GNZRSQJKSA-N 442.344 4.689 50 10 IJGE CC(/C=N/NC(=O)c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1)=C\c1ccccc1 6490810 PRDGDBGSUYWLHU-ZNRHCXQYSA-N 433.533 4.615 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4C)ccc32)cc1 38685600 ODCBZHVBBBKRNW-XMMPIXPASA-N 426.472 4.831 50 10 IJGE Cc1ccc2c(CC(=O)N/N=C3\CCCc4oc(C(=O)NC(C)(C)C)c(C)c43)coc2c1C 40826618 LEBDWUVEOCESPY-TURZUDJPSA-N 449.551 4.879 50 10 IJGE COC(=O)c1cc(C(C)C)sc1NC(=O)/C(C#N)=C\c1c(F)c(F)c(F)c(F)c1F 96438545 WQMFYYRFRSMYKF-YWEYNIOJSA-N 444.381 4.899 50 10 IJGE O=C(N/N=C\c1ccc(OCc2ccccc2)c(Cl)c1)c1ccc2nc(S)[nH]c2c1 169917559 KPGZOYZFKIZGIH-MSXFZWOLSA-N 436.924 4.848 50 10 IJGE C[C@H](Cl)C[C@@H]1CCCCN1C(=O)c1cc(Cl)ccc1I 312800219 ITSPXMFGTUGBIS-JQWIXIFHSA-N 426.125 4.957 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)C1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12 383294328 XBXXSJHBQHUUDL-OETUXUCNSA-N 445.138 4.954 50 10 IJGE CC[C@H](NC(=O)c1cc(Br)sc1Br)[C@@H](C)Br 386959733 YVVJDVGXMINKPX-VDTYLAMSSA-N 433.991 4.565 50 10 IJGE N#CSc1ccc(NC(=O)c2ccc(NC(=O)NCCCCN3CCCC3)cc2)cc1 586615812 HIUDMCYFMNQHBZ-UHFFFAOYSA-N 437.569 4.510 50 10 IJGE O=C(N[C@@H]1CCC[C@H]1CBr)c1scc(Br)c1Br 705515158 HXZUHVCTIQMIOD-POYBYMJQSA-N 446.002 4.567 50 10 IJGE Cc1cc(S(=O)(=O)NC2(CBr)CCCCCC2)sc1Br 713450792 BJJAPLWJFGWYSJ-UHFFFAOYSA-N 445.242 4.585 50 10 IJGE O=C(NNc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 775556248 VHSOLFHMIBCSBE-UHFFFAOYSA-N 425.832 4.649 50 10 IJGE O=C(NN=Cc1ccccc1Oc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1 1084512819 YDFHMSPRUDOKJN-UHFFFAOYSA-N 440.253 4.914 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2cccc(-n3ccnc3O)c2)c(C)n1-c1ccccc1F 1355098581 BSCUTOURHLBVRE-CPNJWEJPSA-N 441.466 4.670 50 10 IJGE C#C[C@H](NC(=O)NNc1ccc(Br)cc1C)c1ccc(Br)cc1 1478897316 XQWHJCYDICWFJQ-HNNXBMFYSA-N 437.135 4.521 50 10 IJGE CC(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)c1 1649390206 WVOKWWGFTHTKMR-UHFFFAOYSA-N 443.890 4.833 50 10 IJGE Cc1ccc2c(CC(=O)NN=C3CCCc4oc(C(=O)OC(C)C)c(C)c43)coc2c1C 1772751771 MKAOXTMVVUJKDR-UHFFFAOYSA-N 436.508 4.916 50 10 IJGE Cc1ccc(OCC(=O)NCc2ccc(OC(=O)Nc3ccc(SC#N)cc3)cc2)cc1 1858900978 YFJCRDSVWAAIRW-UHFFFAOYSA-N 447.516 4.874 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@H]1c1cccc(O)c1 1865681390 MBDQXAWUIRJWJO-INIZCTEOSA-N 446.816 4.527 50 10 IJGE Cc1nc(Cc2ccccc2)sc1C(=O)NNC(=O)C(c1ccccc1)c1ccccc1 1865845854 WDDSDRNNMXWIEG-UHFFFAOYSA-N 441.556 4.635 50 10 IJGE CCN(C[C@](C)(CI)OC[C@H]1CC12CCC2)C(=O)OC(C)(C)C 1902102928 VIWAXXIPARWFSE-PBHICJAKSA-N 437.362 4.644 50 10 IJGE CC[C@@H]1C[C@@H]1CCO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1902818121 TVGMXCVINSJREX-VKJFTORMSA-N 437.362 4.644 50 10 IJGE N#C[C@@H]1CN(c2cccc(Br)c2CBr)CCN1Cc1ccccc1 1914889927 GXZJJSCQMWBCBL-MRXNPFEDSA-N 449.190 4.558 50 10 IJGE O=S1(=O)CCC[C@@H]1[C@H](Cl)c1c(Br)sc(Br)c1Cl 1923054860 LDPWINBIYXNAFQ-XINAWCOVSA-N 443.009 4.784 50 10 IJGE C[C@]12CN(Cc3ccccc3)C[C@@H]1CN(c1nc(Cl)c(CBr)s1)C2 1949582911 DGKUNVVJFUCGFS-RDTXWAMCSA-N 426.811 4.650 50 10 IJGE CC(C)[C@@H](Br)[C@H](C)NC(=O)c1csc(Br)c1Br 1997051483 WGVBYRPYCCXHDB-POYBYMJQSA-N 448.018 4.811 50 10 IJGE O=C(N[C@@H](CBr)C1CCC1)c1cccc(Br)c1Br 2031476816 GNKZEZCWCLBGIL-NSHDSACASA-N 439.973 4.505 50 10 IJGE Clc1ccc(I)c(CN2CC[C@@H](Br)[C@@H]2C2CC2)c1 2067022573 WXQGATGZAUUAMG-OCCSQVGLSA-N 440.550 4.692 50 10 IJGE COC[C@H]1C[C@H]1COc1c(Br)cc(Br)cc1CBr 2069753872 PHKNEVKWFXTYLI-ZJUUUORDSA-N 442.973 4.768 50 10 IJGE ClCc1nc2cncc(Br)c2n1C[C@@H]1CCCN(Cc2ccccc2)C1 2095446558 XMOFXNPLNNNMTO-MRXNPFEDSA-N 433.781 4.845 50 10 IJGE C[C@H](CCBr)CCN1CC[C@H](C(F)(F)F)C[C@H]1CNC(=O)OC(C)(C)C 2107584853 NUYVLALBNLAOAN-ILXRZTDVSA-N 445.364 4.965 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@@H]2CCC[C@H](C1)C2Cl 2111476411 IQHMWSFDRJODEA-OQJHAAMPSA-N 427.589 4.753 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]23CCC[C@@]2(CN(C[C@@H](CBr)CC2CC2)C3)C1 2112867112 UZYGOTNILHDMDF-DUXKGJEZSA-N 427.427 4.521 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@H](Br)CC2(CCC2)C1 2115924879 NJTWTPPFYWILKN-MRVPVSSYSA-N 427.589 4.944 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2CC1CN(Cc2ccccc2)C1 2137597902 DCVZIAOKDSEVAB-UHFFFAOYSA-N 434.765 4.678 50 10 IJGE C[C@@H]1OC2(C)CC1([C@H](Br)c1cc(I)cc3c1OCC3)C2 2156697109 BIZGIMMDWALZIY-OLYBFPGYSA-N 449.126 4.620 50 10 IJGE O=C(NC[C@H]1CCCC[C@@H](Cl)C1)c1ccc(I)c(Cl)c1 2163752854 COMJBYHWXWTTAT-CMPLNLGQSA-N 426.125 4.862 50 10 IJGE Fc1c(CN2CCC(OCCBr)CC2)ccc(Cl)c1Br 2166832108 MQXSNVWZTNOORA-UHFFFAOYSA-N 429.555 4.618 50 10 IJGE O=C(c1c(Cl)cccc1Br)N1CCC([C@H](F)CBr)CC1 2169466658 RWLCSMMYJFKHEV-GFCCVEGCSA-N 427.539 4.688 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2Cc1cnn(Cc2ccccc2)c1 2184936290 VBMXALIESMFCPA-UHFFFAOYSA-N 444.764 4.577 50 10 IJGE Cc1nc(-c2ccc(I)cc2)nc(C)c1[C@H](C)CBr 2228790278 VNTFPIBKMXKWGK-SECBINFHSA-N 431.115 4.863 50 10 IJGE CC[C@@H](CCCBr)NC(=O)c1ccc(Cl)c(I)c1 2256398145 LIBQYDVFMRWPLH-JTQLQIEISA-N 444.538 4.628 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@H]1CC[C@H](C(F)(F)F)CC1 2265003604 NAMVFCJOLSLCMO-ULQDDVLXSA-N 436.312 4.794 50 10 IJGE CCO[C@@H]1CC[C@H]([C@H](Br)c2ccc(OC)c(I)c2)C1 2269535967 XLNIHQDJUFWZHF-NVBFEUDRSA-N 439.131 4.941 50 10 IJGE CS(=O)(=O)[C@H]1C[C@H]([C@@H](Br)c2cc(Cl)c(Br)cc2F)C1 2269773596 XXXNLJYUQDBXGD-NQYJQULFSA-N 434.552 4.501 50 10 IJGE CCn1nc(C)c(CBr)c1N1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1 2281295525 IWHZVNQEFLESLJ-PZJWPPBQSA-N 431.422 4.597 50 10 IJGE CC(C)CN(C[C@H](C)Br)S(=O)(=O)c1ccc(Br)cc1Cl 2288024302 PVRUAHNEMIGUFO-JTQLQIEISA-N 447.620 4.533 50 10 IJGE Cc1cccc(N2CCN(C=C(C#N)C(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)CC2)c1 2325384934 ZZNIPRYOZOTSTI-UHFFFAOYSA-N 448.876 4.835 50 10 IJGE CC(C)N1C[C@H](C(O)=C(C#N)c2nc(-c3ccc(Br)cc3)cs2)CC1=O 2331260562 OLPRDXVNNTUPER-CYBMUJFWSA-N 432.343 4.622 50 10 IJGE COc1ccccc1-c1csc(C(C#N)=C(O)CNC(=O)c2ccc(Cl)cc2)n1 2331281816 UOSRPZIFJWQNGN-UHFFFAOYSA-N 425.897 4.695 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)C12COC(C(F)(F)F)(C1)C2 2338564911 VXMBFGNJMHJCCD-ZLPCBKJTSA-N 434.296 4.546 50 10 IJGE CC(C)(C)OC(=O)N[C@@]12CCCC[C@@H]1CN(C[C@@H](CBr)c1ccccc1)C2 2355122095 OOQLNCGOWPUPJG-WOIUINJBSA-N 437.422 4.934 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)[C@@H]1CO[C@H]2COC[C@@H]12 2365229147 XBDCTFJNMHRVOG-GHSRWGRBSA-N 428.523 4.600 50 10 IJGE Cc1c(Br)csc1C(=O)N1CCC[C@@H](Br)[C@H]1C(F)(F)F 2370259863 BKIYNZAHPWKZQZ-XCBNKYQSSA-N 435.103 4.749 50 10 IJGE CCOc1cc(/C=N/NC(=O)c2ccncc2)ccc1OCc1cccc2ccccc12 59447392 QWICSSPAAHRZTG-OGLMXYFKSA-N 425.488 4.976 50 10 IJGE C[C@@H](c1nccs1)n1c(CCCl)nc2cc(I)c(F)cc21 97409365 GASSWGBURHVLEX-QMMMGPOBSA-N 435.693 4.627 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Cl)c3ccc(Br)c(F)c3)cc2[nH]1 109883657 CLXSTWOHMSFTQP-CYBMUJFWSA-N 434.490 4.849 50 10 IJGE COc1ccc(N/C=C(/C#N)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1OC 217248905 VQARRJGCEQEKPG-KHPPLWFESA-N 425.794 4.834 50 10 IJGE O=C(NC[C@@H]1CC[C@@H](Br)C1)c1cc(Br)sc1Br 227675704 RBWGEZZGVODRME-RNFRBKRXSA-N 446.002 4.567 50 10 IJGE CC(=NNC(=O)c1ccc(Br)cc1)c1cccc(NC(=O)c2ccoc2C)c1 252629704 ULTPEIBRDVQXDI-UHFFFAOYSA-N 440.297 4.757 50 10 IJGE CC(C)(C)OC(=O)N1[C@H](Br)C(=O)O[C@H](c2ccccc2)[C@H]1c1ccccc1 255990461 NOVNBQKUIAJJBO-KURKYZTESA-N 432.314 4.984 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCC[C@H](Br)CC1 378674458 NNCVIJFHVRCCQT-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE Cc1cccc(C(=O)NCC(C)(C)C[C@@H](C)Br)c1I 393558994 WAIWHDTWMQKXNC-LLVKDONJSA-N 438.147 4.529 50 10 IJGE CC[C@H](Br)CCCNC(=O)c1cc(Br)sc1Br 398533367 CDTZMQRBNGOAMF-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE CN(C(=O)c1scc(Br)c1Br)C(C)(C)CCBr 688376518 LGWQCGBJLHLURQ-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE O=C1COc2ccc([C@H](Cl)c3scc(Br)c3Br)cc2N1 705448783 WUWURXTUTMGJJR-LBPRGKRZSA-N 437.540 4.932 50 10 IJGE C/C(=C/C(=O)NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl)c1cccc(F)c1 732267292 WIASLNVPWNUDBS-YFHOEESVSA-N 431.842 4.919 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCCC[C@@H]3c3noc(C)n3)c2C)c1 737622455 GMQBGRHQBKWGCD-XOYGFPHKSA-N 429.524 4.755 50 10 IJGE C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799755041 XKKHQRGWTXEANF-AWEZNQCLSA-N 440.425 4.878 50 10 IJGE Cc1cc(C(=O)Nc2ccc(CBr)cc2)ccc1I 1186608531 CVZITSGLWVQAOF-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE COc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)Nc3ccccc3C)c(C)c21 1772745833 JOAQFGXBCNJLCH-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE Cc1c(C=NNC(=O)CSc2nc3ccccc3s2)c(Cl)nn1-c1ccccc1 1772760561 WZQFRWSXWZPQTM-UHFFFAOYSA-N 441.969 4.686 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)Cc3ccc(Cl)c(Cl)c3)c(C)n2)cc1 1865758573 HJLLRJNQXZOPPV-UHFFFAOYSA-N 442.346 4.930 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)CCc1cc(Cl)ccc1Cl 1905345123 YMSLTYOBFJYNET-GFCCVEGCSA-N 427.125 4.986 50 10 IJGE Cc1cc(Br)cnc1N(C)C[C@@H](Br)COCc1ccccc1 1916348488 OGLPKZDILQIJOO-MRXNPFEDSA-N 428.168 4.569 50 10 IJGE Clc1ccccc1C(CBr)(CBr)CC[C@@H]1COCCO1 1916658504 LYRFVVRZPHSDCV-GFCCVEGCSA-N 426.576 4.563 50 10 IJGE O=C(NC[C@H]1CC[C@H](CCl)CC1)c1ccc(I)c(Cl)c1 1922673870 CRAOSSUWKIYYRB-XYPYZODXSA-N 426.125 4.720 50 10 IJGE ClC[C@@H](CNc1ncc(I)cc1Br)C1CCC1 2015764467 BBLPSOBOOZLZPG-VIFPVBQESA-N 429.527 4.516 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC2CC3(CCCC3)C2)CC1 2017966772 YYNIJSXRGDZPFA-UHFFFAOYSA-N 449.373 4.931 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1C(=O)c1cc(Br)sc1Br 2018122705 ADOIUOIDROCOHE-HTRCEHHLSA-N 446.002 4.661 50 10 IJGE CN(CC1(Br)CC1)c1cc(Br)cc(F)c1CBr 2020229193 WYBUMOYEAGHTTH-UHFFFAOYSA-N 429.953 4.847 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1cccc(OCc2ccccc2)c1 2023034522 VNNWEXSJDHXSKE-KXBFYZLASA-N 437.321 4.845 50 10 IJGE C[C@H](CCCCBr)NC(=O)c1c(Br)cccc1Br 2033089738 WYKJOLFLSBQUAE-SECBINFHSA-N 441.989 4.895 50 10 IJGE CC(C)[C@H](CBr)CN=[S@](C)(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C 2044705870 ORFXXRWFXGZAEK-OKXMYEFYSA-N 441.476 4.691 50 10 IJGE O=C(CBr)c1cc(Br)c(C(F)(F)F)cc1OC(F)(F)F 2054795842 HGJKSLYMTOMVIK-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE FC(F)(F)c1cc(Br)cc(-n2nc3c(c2CBr)[C@@H]2C[C@H]2C3)n1 2080641457 BQRYQACDYDTSFK-POYBYMJQSA-N 437.057 4.603 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCCO2)C[C@]2(C1)C[C@@]2(CBr)C(F)(F)F 2083259146 GULBALNQZJCQIM-PMPSAXMXSA-N 428.289 4.510 50 10 IJGE CCCn1c(C)c(C)c(S(=O)(=O)c2ccccc2)c1NC(=O)C(C#N)=Cc1ccccc1 2085246058 LNTKLXLENLNWOI-UHFFFAOYSA-N 447.560 4.893 50 10 IJGE COc1cc(Cl)c([C@H](Br)c2cc(Br)n(C)n2)cc1Cl 2094083151 XWFTXNWWLJFEPR-LBPRGKRZSA-N 428.939 4.982 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](C(C)(C)C)CN(C(=O)CCCCBr)C1 2108378280 GLWKKWQQQABUJM-CVEARBPZSA-N 433.431 4.587 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Br)c1cc(Cl)n(C)n1 2138254387 GTXBTOCJDTWEAW-NSHDSACASA-N 428.939 4.982 50 10 IJGE C[C@@H]1C[C@H](O[C@@](C)(CI)c2ccccc2Br)CCO1 2140602264 MILFGSDVHVDHBZ-JMSVASOKSA-N 439.131 4.683 50 10 IJGE Cc1cc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)ncc1CBr 2151925569 OERCAADCBXLLRF-GBAJDQEWSA-N 426.402 4.632 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@@H]1CN(Cc2ccccc2)C[C@H]1C 2153119538 HMAOYVOWVAZPCR-AUUYWEPGSA-N 447.808 4.977 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc2c(c1)CCN(CC1(CBr)CCOCC1)C2 2163061358 GJZFATHWYGHHGK-UHFFFAOYSA-N 439.394 4.583 50 10 IJGE Cc1c(Cl)cc(C(=O)NC[C@H](Br)CC(F)(F)F)cc1Br 2175688881 IADFVUAIZBIJPJ-MRVPVSSYSA-N 437.481 4.857 50 10 IJGE CCCCCCN(C)S(=O)(=O)c1cc(CBr)ccc1Br 2196730499 XAFGYMLLAVZKNA-UHFFFAOYSA-N 427.202 4.545 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1C[C@@]1(Br)CC1(F)F 2202505261 LVXJIJTZFHOURB-KGFZYKRKSA-N 429.490 4.666 50 10 IJGE Cc1nn(C)c([C@H](Cl)c2c(F)cc(F)c(Br)c2F)c1Br 2236112969 XXGMPNCZLSCJPU-SNVBAGLBSA-N 432.465 4.999 50 10 IJGE CN[C@@H](Cc1cc(Br)cc(Br)c1)C1CC(Br)C1 2252836548 DCDMCNLYSAIZQB-LDUAJXOISA-N 425.990 4.516 50 10 IJGE C[C@H](COC(F)F)O[C@@](C)(CI)c1ccccc1Br 2265058178 VRMQZDDBIXSOPV-RNCFNFMXSA-N 449.073 4.744 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1CN(CC1(CBr)CC(F)C1)C1CC1 2265631651 FSSZNIJZRNZGPH-RYZJOYRSSA-N 433.406 4.754 50 10 IJGE C[C@](CBr)(NC(=O)c1cc(Br)c(F)cc1Cl)C(F)(F)F 2285958005 JUVYSRBTJWJHPR-SNVBAGLBSA-N 441.444 4.687 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)NC2CC2)ccc1OC(=O)c1ccc(Cl)cc1Cl 2295672351 OXKHDXAHRSZSFF-UHFFFAOYSA-N 445.302 4.797 50 10 IJGE CC(C)[C@H](CBr)N(C)Cc1ccc(I)c(Cl)c1 2302480856 KHMGBLVVDMLTRY-ZDUSSCGKSA-N 430.555 4.796 50 10 IJGE COc1ccc(NC(=O)C(C#N)=CNc2ccc(Cl)c(C(F)(F)F)c2)cc1OC 2318454295 OOBNLVYRNYRZQQ-UHFFFAOYSA-N 425.794 4.834 50 10 IJGE C[C@H]1C[C@H](CBr)CCN1Cc1ccc(Cl)cc1I 2318540092 OUGUADSHNLIUTQ-WDEREUQCSA-N 442.566 4.940 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCc1ccc(C)cc1 2322974841 QZKURIKJWWRHOQ-UHFFFAOYSA-N 433.464 4.645 50 10 IJGE C[C@H]1C[C@@H](CCl)CCN1Cc1ccc(I)c(Br)c1 2325205164 UXJUBBZDSGHIDT-QWRGUYRKSA-N 442.566 4.893 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)[C@@H]1CCCS1(=O)=O 2339654367 SDIVHOIGKRCLAP-GZMMTYOYSA-N 434.552 4.516 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@]12CCC[C@H](CN(C(=O)[C@@H](Br)C3CCCC3)C1)C2 2358644637 KYLMLHFQWHDZRH-WJPUGNRLSA-N 443.426 4.578 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)[C@@H]1CCCCS1(=O)=O 2365222690 GFFGZMHSINOGGS-JOYOIKCWSA-N 448.579 4.906 50 10 IJGE O=C(Cc1ccccc1I)Nc1ccc(CBr)c(F)c1 2367665610 CSWSDKXDMPPLEU-UHFFFAOYSA-N 448.073 4.506 50 10 IJGE N#C/C(=C/c1cccs1)C(=O)Nc1ccc(NC(=O)/C(C#N)=C/c2cccs2)cc1 1769797 SNWRPQHDXZMSGS-UKVBVZPVSA-N 430.514 4.901 50 10 IJGE O=C(NC1CCCCC1)[C@H](c1ccccc1F)N(CCc1ccccc1)C(=O)CCl 3033932 CLSXQNJASVGLQW-QHCPKHFHSA-N 430.951 4.626 50 10 IJGE COc1ccc([C@H](C(=O)NC2CCCCC2)N(Cc2ccc(F)cc2)C(=O)CCl)cc1 97914317 RIMDTUNVGDTATQ-HSZRJFAPSA-N 446.950 4.592 50 10 IJGE Cc1ccc(N/C=C(/C#N)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c(Br)c1 217229642 KGOFMZCANCKRKN-LUAWRHEFSA-N 435.665 4.777 50 10 IJGE CCCc1cc(=O)oc2cc(OCC(=O)NN=Cc3c(Cl)cccc3Cl)ccc12 254404539 OTWRCTKQWIREJF-UHFFFAOYSA-N 433.291 4.581 50 10 IJGE C[C@@H](Br)C[C@@H](C)CNC(=O)c1cc(Br)c(Br)s1 397720113 JNCYKQMZADKNJF-RNFRBKRXSA-N 448.018 4.813 50 10 IJGE CCC[C@@H](CCBr)NC(=O)c1cc(Br)ccc1Br 716857487 YWOABCHVWMLBKY-JTQLQIEISA-N 441.989 4.895 50 10 IJGE CC[C@H](C)NC(=O)[C@H](c1cccs1)N(C(=O)CCl)c1cccc(C(F)(F)F)c1 725238046 OZMIMVRGCJDLJJ-SJCJKPOMSA-N 432.895 4.995 50 10 IJGE Cc1ccccc1[C@@H](NC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)C1CC1 732895300 ZCTWQJYHBFYLHF-DEOSSOPVSA-N 447.510 4.808 50 10 IJGE COc1ccccc1Nc1nc2sc(C(=O)NNc3cnnc4ccccc34)cc2s1 733810653 SYJXNBGAYMJETL-UHFFFAOYSA-N 448.533 4.810 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2CC3(CCC3)[C@H]2C2CC2)c(-c2ccc(Cl)cc2)n1 793428392 AXANJSAKWVZLPW-UOCRBVKVSA-N 445.954 4.815 50 10 IJGE CCC(C)(C)C(=O)COC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 811029884 DZFVGTVKVXNDLI-ATVHPVEESA-N 438.915 4.573 50 10 IJGE O=C(NN=C1C(=O)N(C(c2ccccc2)c2ccccc2)c2ccccc21)c1ccccc1O 1084051124 LJDURAPQQKMCIH-UHFFFAOYSA-N 447.494 4.663 50 10 IJGE CCSc1ccc(CC(=O)NNc2nc3ccccc3[nH]c2=S)c(Br)c1 1629912264 RARCHPOYDSQXFR-UHFFFAOYSA-N 449.399 4.853 50 10 IJGE N#Cc1ccc(CN(C[C@@H](CBr)C2CC2)c2ccc3nc(O)[nH]c3c2)cc1 1657631832 CVGCUOIBISDFQT-QGZVFWFLSA-N 425.330 4.568 50 10 IJGE CC1=C(C#N)C(=O)N(C[C@H]2CCCO2)C(=O)/C1=C/Nc1ccc(N=Nc2ccccc2)cc1 1772742741 AANCYKFPSMORQE-HYCGULLYSA-N 441.491 4.786 50 10 IJGE CCOc1ccccc1OCC(=O)NN=Cc1ccc(OCc2ccccc2C)c(OC)c1 1772754034 NRYHECXWOAYWSA-UHFFFAOYSA-N 448.519 4.510 50 10 IJGE Cc1sc(NC(=O)/C(C#N)=C/c2ccccc2)nc1-c1ccc2c(c1)C(C)(C)C(=O)N2 1859513540 IRHIUMLUTMALIC-GZTJUZNOSA-N 428.517 4.894 50 10 IJGE Cc1ccc(-n2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2cn(C)c3ccccc23)cc1 1865699163 MTIVJDDEFNWNGK-LJQANCHMSA-N 449.436 4.909 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccccc1Cl 1865703563 BHSLLUSCDFWWIH-QFIPXVFZSA-N 434.927 4.900 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@H](c1ccc(O)c(OC)c1)C(C#N)=C(N)O2 1865706426 WJDYIMQLMRKMOB-HSZRJFAPSA-N 438.487 4.520 50 10 IJGE COc1ccc([C@@H](C(=O)N[C@@H](C)C(=O)Nc2ccc(SC#N)cc2)C2CCCC2)cc1 1867003357 FHFDMOUNRYHHQY-AOMKIAJQSA-N 437.565 4.686 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OCC[C@@H]1CC[C@@H]1C1CC1 1902509134 RCBJNEOWWNZXMI-DAYGRLMNSA-N 437.362 4.548 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)Cc1cnn(Cc2ccccc2)c1 1915128955 UPERPUZJJRUIAN-IBGZPJMESA-N 440.385 4.676 50 10 IJGE CCCCOCCOCCOCCN(Cc1ccccc1)[C@H](CBr)C(C)C 1915266564 ATPPMMZRSVKGOO-JOCHJYFZSA-N 444.454 4.758 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2ccc([N+](=O)[O-])cc2CBr)C1 1921470797 SQOUMTHLNJTRIP-IAGOWNOFSA-N 432.362 4.837 50 10 IJGE CC1(C)C[C@H](Br)CN1Cc1cccc(Br)c1Br 1949218304 IEKSQCLXUIGGOS-JTQLQIEISA-N 425.990 4.959 50 10 IJGE Cn1ncc([C@@H](Br)c2cc3sccc3s2)c1I 2025273475 ZCTLZNLZQIODLI-SNVBAGLBSA-N 439.141 4.785 50 10 IJGE COc1cccc(C=C(C#N)S(=O)(=O)c2cc(Cl)ccc2Cl)c1OC(F)F 2040447341 RJHHEIOZDKWMHZ-UHFFFAOYSA-N 434.247 4.942 50 10 IJGE BrC[C@@]12CCC[C@@H]1CN(c1ncc(Br)cc1Br)C2 2041465949 ZVXPXOPHSVNZGI-NOZJJQNGSA-N 438.989 4.608 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc([S@](C)(=O)=NC[C@@H](CBr)C2CC2)cc1 2044703533 VNYSQIPHVBBCOL-PWECECGKSA-N 431.396 4.911 50 10 IJGE Brc1cc2c(cc1[C@H](Br)[C@H]1C[C@H](Br)C1)OCCO2 2076182059 MTSYOYXQEHAIQW-OTPXZMOZSA-N 440.957 4.830 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CCCCCBr)C[C@@H]1c1ccccc1 2129066303 CTASBZUSJMRIFU-RBUKOAKNSA-N 425.411 4.792 50 10 IJGE CC[C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CN1C[C@H](CBr)c1ccccc1 2163065292 ZBJJAZGNGVDERD-MTQWCTHYSA-N 437.422 4.742 50 10 IJGE CCC[C@@]1(CNC(=O)[C@H](Br)C2CCCC2)CCCN(C(=O)OC(C)(C)C)C1 2167048146 OTDPGGYTNJKRNW-UTKZUKDTSA-N 445.442 4.874 50 10 IJGE CO[C@]1(CBr)CCCN(Cc2cc(Cl)c(C)c(Br)c2)C1 2167385959 RHHGYKGHYDOVII-HNNXBMFYSA-N 425.592 4.787 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N(C)[C@@H]1CCCCC[C@H]1Br 2172541854 AEHUZITUDZIIQI-GHMZBOCLSA-N 445.242 4.536 50 10 IJGE COc1ccc(N2CC[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c(CBr)c1 2235970540 QVTRNWZLIMPONP-CTNGQTDRSA-N 429.402 4.939 50 10 IJGE FC(F)(F)c1cnc(N2CCS[C@@H](CCBr)C2)c(Br)c1 2240947026 UNYZVQLTZDPENE-VIFPVBQESA-N 434.119 4.570 50 10 IJGE COc1ccc([C@@H](Br)CC2(OC)CCC2)cc1I 2257366367 AYGWUQPHVTYBHW-NSHDSACASA-N 425.104 4.695 50 10 IJGE O=C(c1cccc(Cl)c1Br)N1CCC(F)(F)[C@@H](CBr)C1 2283192313 VZPDJOCHPHGHFP-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE CC(C)(C)N(CCBr)Cc1ccc(Cl)c(I)c1 2300240480 MRSQERPTCVXYFS-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)Nc2ccccc2CC)cc(Br)c1OC 2313667921 YIXXVJDJCHLILN-UHFFFAOYSA-N 429.314 4.964 50 10 IJGE COc1cc(C=C2C(=O)N(Cc3ccc(F)cc3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 2314620527 PWNVAHGANWFXNY-UHFFFAOYSA-N 448.494 4.662 50 10 IJGE C[C@H](CBr)CC1CN(Cc2ccc(Cl)cc2I)C1 2318545492 JIXUKOXCDNVONM-JTQLQIEISA-N 442.566 4.798 50 10 IJGE COc1cc(C=NNC(=O)Nc2ccccc2)cc([N+](=O)[O-])c1OCc1cc(C)ccc1C 2323063530 AEQOKRVJJPNFPA-UHFFFAOYSA-N 448.479 4.955 50 10 IJGE N#CC(=CNCCc1ccc(Br)cc1)C(=O)Nc1cc(Cl)ccc1Cl 2324392599 WMANNRNKBLAFKD-UHFFFAOYSA-N 439.140 4.934 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2ccc(OCC)cc2)sc2c1CC[C@@H](C)C2 1965196 QXBFSGIKYGFNIP-WIZMWCRPSA-N 438.549 4.994 50 10 IJGE Cc1ccc(CN(C(=O)CCl)[C@H](C(=O)NC2CCCCC2)c2ccccc2F)cc1 3033934 MARYHBUHQUEBAF-QHCPKHFHSA-N 430.951 4.892 50 10 IJGE C/C(=N\NC(=O)CSCc1ccccc1Cl)c1ccc(NC(=O)C(F)(F)F)cc1 20158234 QKNLYKOZMWDPKS-BRJLIKDPSA-N 443.878 4.614 50 10 IJGE O=C(NNc1ncnc(NCc2ccccc2Cl)c1[N+](=O)[O-])c1cccc2ccccc12 40658760 RYJMNNDIBUDVLH-UHFFFAOYSA-N 448.870 4.560 50 10 IJGE COC(=O)c1cccc(Cn2cc(/C=C(\C#N)C(=O)NC3CCCCC3)c3ccccc32)c1 59292005 DUIHFHQTEFNNSG-RCCKNPSSSA-N 441.531 4.832 50 10 IJGE COc1ccccc1CN(C(=O)CCl)[C@H](C(=O)NC1CCCCC1)c1ccccc1C 97914443 CDMGAMUOZAQFBF-DEOSSOPVSA-N 442.987 4.761 50 10 IJGE ClCc1c(I)cc(I)c2sccc12 307059264 HFJCVAJZIXBTAB-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE O=S1(=O)CC[C@H](C(CBr)(CBr)CCC2CCCCC2)C1 312217261 WXOAKDVLTGHJPO-AWEZNQCLSA-N 430.246 4.558 50 10 IJGE Cc1nc(C)c(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)s1 751298213 JOVAQCFEABBWMI-YBEGLDIGSA-N 436.928 4.736 50 10 IJGE COc1ccc2nc(NNC(=O)c3cnc(-c4ccc(F)c(F)c4)s3)c(C)cc2c1 780742020 SDSDYEAAZTYCQY-UHFFFAOYSA-N 426.448 4.710 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OCCOc2ccccc2)c(-c2ccc(Cl)cc2)n1 782086881 HGNJIKMTOHFYOV-XDJHFCHBSA-N 446.894 4.646 50 10 IJGE O=C(NNC(=O)c1ccc(-c2cccc(Cl)c2)nc1O)c1cc2c(s1)CCCCC2 1135275571 BLCVCQUZKGITSZ-UHFFFAOYSA-N 441.940 4.513 50 10 IJGE C#CCN(Cc1ccc(F)cc1)C(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(OC)cc2)c1C 1527472740 KKJFOIWPFPGLFG-XQNSMLJCSA-N 441.506 4.811 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)NNc2nc3ccccc3[nH]c2=S)cc1 1629912504 XOHKCWHZYBGNMG-CYBMUJFWSA-N 439.541 4.635 50 10 IJGE Cc1c(C(=O)Nc2cccc3ncccc23)oc2c1C(=NNC(=O)c1ccccc1)CCC2 1772744809 JWYCUQPOILOYLK-UHFFFAOYSA-N 438.487 4.859 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CCC)cc1 1865694681 ZCYFBVFQZVVSJL-QFIPXVFZSA-N 444.535 4.976 50 10 IJGE CCCc1nn(-c2ccc(OC)cc2)c2c1[C@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865699357 RPAKLCAHULGWPU-QFIPXVFZSA-N 425.492 4.533 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3Cc2ccccc2)cc1 1865712887 KTSBSZPMIWPLTB-QHCPKHFHSA-N 434.499 4.825 50 10 IJGE COc1c(C)cc(Cl)cc1-c1csc(/C(C#N)=C(\O)[C@@H]2CC(=O)N(C(C)C)C2)n1 1872756773 AAIYLZYIGHADKL-KMJMQOOCSA-N 431.945 4.830 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)N(C)C[C@H]2C[C@H](Br)C2)cc1 1887822468 BTAABNPUOJPLIH-CKEIUWERSA-N 425.367 4.518 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@]1(F)CN(Cc1ccc(CBr)cc1)C2 1893715721 FBQQERTWDHPXDD-PMACEKPBSA-N 427.358 4.553 50 10 IJGE COc1cc(OC)c(C(=O)N(Cc2ccccc2)[C@@H](C)CCBr)cc1OC 1915091447 XOFKNNNNPBRLDZ-HNNXBMFYSA-N 436.346 4.528 50 10 IJGE Cc1c(Br)sc([C@@H](Br)[C@H]2OCCO[C@H]2C)c1Br 1922921424 QPBZUYFAPBEDSW-XVYDVKMFSA-N 449.002 4.821 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)CCc1ccccc1C(F)(F)F 1994836605 BRMDUDJLHMGNBI-ZDUSSCGKSA-N 426.232 4.698 50 10 IJGE CCOC(=O)[C@@]1(C[C@H]2C[C@H](Br)C2)CCCN(C(=O)OCc2ccccc2)C1 2020239851 VZXIIILGNTZBSF-DBXWQHBBSA-N 438.362 4.532 50 10 IJGE C[C@]1(CCBr)CCN1C(=O)c1cc(Br)sc1Br 2025216528 PKDWVHJSLQWLFN-NSHDSACASA-N 446.002 4.663 50 10 IJGE COc1ccc(C)c(Cn2nc(CBr)c(Br)c2C(F)(F)F)c1 2079233661 BOXSCHZCAFHKMM-UHFFFAOYSA-N 442.073 4.925 50 10 IJGE Clc1cc(Br)c(OCCS[C@@H]2CCOC2)c(CBr)c1 2092690085 RGVFGUPBQCKAFM-LLVKDONJSA-N 430.589 4.898 50 10 IJGE C[C@@H]1[C@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1csc(Br)c1Br 2093947862 JLZVNSDZPLYMCJ-KHUVANEUSA-N 427.589 4.894 50 10 IJGE FC(F)(F)c1csc([C@H](Br)[C@@H]2CO[C@H]3COC[C@@H]23)c1Br 2158065998 CZSAEAQZRZANAI-JWIUVKOKSA-N 436.087 4.627 50 10 IJGE COCC[C@H]1CN(C(=O)OC(C)(C)C)CCN1CC1(CBr)CCCCCC1 2163058321 JOVRUAUHAYOZFP-SFHVURJKSA-N 447.458 4.680 50 10 IJGE Fc1cncc(N2CCCCN(Cc3ccccc3)CC(F)(F)C2)c1CBr 2164877208 TUEKAHJMRODXEZ-UHFFFAOYSA-N 442.323 4.853 50 10 IJGE CN(C(=O)c1ccc(Br)cc1Br)[C@@H](CCCl)C(F)(F)F 2178514899 HDBTXBDJRGYSLS-JTQLQIEISA-N 437.481 4.843 50 10 IJGE O=S(=O)(c1cc(F)c(Cl)c(CCl)c1)N1CCC[C@@H](OCc2ccccc2)C1 2186388171 AWVFWXYHVGOBMV-MRXNPFEDSA-N 432.344 4.588 50 10 IJGE C[C@]1(CC(CBr)(CBr)c2ccccc2F)CSCCO1 2201228489 PYWAXKOWUVVRFT-AWEZNQCLSA-N 426.189 4.766 50 10 IJGE Cc1sc(C(=O)N2CC[C@@H](CBr)C(F)(F)C2)c(C)c1Br 2234477254 DTTRRKMUZUDIMR-VIFPVBQESA-N 431.140 4.620 50 10 IJGE CC(C)(C)N(CCBr)C(=O)c1ccc(Cl)c(I)c1 2256383857 PJSSCINRKTXBSH-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE COc1ccc([C@@H](Cl)c2cnn(C)c2Br)c(Br)c1Cl 2268259461 MBJKKEHJBDNHOX-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE CCCN[C@H](c1ccc(OC)c(I)c1)[C@H]1C[C@@H](Br)C1 2269589285 XNFLLBRMQBLSIG-TYNCELHUSA-N 438.147 4.514 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)[C@H](C)C[C@@H]1Br 2282974209 GAHOGMQXCMUXQX-MRTMQBJTSA-N 427.539 4.876 50 10 IJGE CCc1nn(C)c([C@@H](Cl)c2ccc(OC)c(I)c2)c1Cl 2285009469 MQFWORZNBLLJLF-LBPRGKRZSA-N 425.097 4.577 50 10 IJGE CC(C)(C)c1ccc(OCCOc2ccc(Br)cc2C=C(C#N)C(N)=O)cc1 2294593249 NQFGKTNXMARPNN-UHFFFAOYSA-N 443.341 4.597 50 10 IJGE C[C@@H]1CC[C@@H](CBr)CN1Cc1ccc(Cl)cc1I 2318529932 WVZQVBYWBBFMPZ-MNOVXSKESA-N 442.566 4.940 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)cc1OCC 2321244503 FOPFJSFHQOMZIM-UHFFFAOYSA-N 439.462 4.897 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)ccc1OC 2321244527 MBLHGFWTNIYBPY-UHFFFAOYSA-N 425.435 4.506 50 10 IJGE CCOc1ccc2ccccc2c1C=NNC(=O)c1cccn(Cc2ccc(C)cc2)c1=O 2323648227 JSABQTCVIYXZAF-UHFFFAOYSA-N 439.515 4.521 50 10 IJGE CC[C@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)COc1ccccc1-c1ccccc1 9871205 QGFQIWPSOWBSHS-PMACEKPBSA-N 446.547 4.861 50 10 IJGE Cc1cc(C)c(OCC(=O)N/N=C/c2c(Cl)cccc2Cl)c(Br)c1 97136569 VXMPZFNFAVNKOB-ODCIPOBUSA-N 430.129 4.902 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)[C@H]2CCCCS2(=O)=O)cc1Br 169105673 VSQLLOCAVFAPGZ-CHWSQXEVSA-N 430.589 4.767 50 10 IJGE N#C/C(=C/Nc1cccc(S(=O)(=O)O)c1)C(=O)NC1CCCCCCCCCCC1 217259470 CCXVQMHYOHPWQJ-ZCXUNETKSA-N 433.574 4.542 50 10 IJGE CC(C)[C@](C)(CBr)NC(=O)c1scc(Br)c1Br 707836266 BSWZNNLAPGIUMS-NSHDSACASA-N 448.018 4.813 50 10 IJGE Cn1c(Cl)cnc1COc1c(Br)cc(Cl)cc1CBr 708078707 YMOXQGCTQPIZBR-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE Cc1nn(C)c(COc2c(F)cc(Br)cc2CBr)c1Cl 715817944 LKDRIUALGMHYDM-UHFFFAOYSA-N 426.511 4.757 50 10 IJGE CCOc1cc(C=NNC(=O)CC[C@H](O)c2ccccc2)ccc1OCc1ccc(C)cc1 725399307 XQBKWZXHBTXYRW-DEOSSOPVSA-N 446.547 4.937 50 10 IJGE O=C(NNc1ccc(Cl)nc1)c1cccnc1Oc1ccc(F)cc1Br 743817249 VAXMHWKNUZWAKX-UHFFFAOYSA-N 437.656 4.581 50 10 IJGE C=CCOc1ccccc1C=NNC(=O)COc1ccc(C(C)C)cc1Br 1084011157 OASYYCFTZKKZNQ-UHFFFAOYSA-N 431.330 4.666 50 10 IJGE CCCc1nn(-c2ccc(C)cc2)c2c1[C@H](c1cccc(OC)c1OCC)C(C#N)=C(N)O2 1865692208 CLGHMTGWUUPSJC-JOCHJYFZSA-N 444.535 4.759 50 10 IJGE C[C@@H]1OCC[C@@]1(CBr)Cc1c(Br)cccc1Br 1945331057 PPWCAOFRXFSCQQ-ZANVPECISA-N 426.974 4.944 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCOc2ccc(Br)cc21 1975074179 WUGRLALXPVPEJQ-AAEUAGOBSA-N 435.156 4.603 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)c(F)cc1F 2008312903 KVVIEQGRPARPLJ-LLVKDONJSA-N 438.721 4.593 50 10 IJGE Cc1c(Br)c(CC(CBr)(CBr)CC(C)C)nn1C 2032836564 UJCYJVPUSHPCTM-UHFFFAOYSA-N 445.037 4.856 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCCCN(c2ncc(CBr)s2)C1 2046335558 HTCABDBHMCQMDY-UHFFFAOYSA-N 430.362 4.776 50 10 IJGE Cn1ncc(C[C@H](CBr)c2ccccc2Br)c1Br 2053031695 UPAAAVQDALSOGN-SECBINFHSA-N 436.973 4.666 50 10 IJGE CN(C(=O)c1cc(Br)sc1Br)[C@@H](CCCl)C(F)F 2058231829 LHRYLDXNGGMUBR-LURJTMIESA-N 425.520 4.608 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1cc(Cl)cc(Br)c1 2081235040 AJIJJVVBLBTFPH-QPUJVOFHSA-N 444.538 4.682 50 10 IJGE Clc1cc(CN2C[C@H]3[C@@H](Br)CC[C@H]3C2)ccc1I 2086662446 VFACIXPHLFXCFA-TUAOUCFPSA-N 440.550 4.550 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCC2(CC1)C[C@H]2CCl 2093942426 RTHFTCCMXDMASE-QMMMGPOBSA-N 427.589 4.754 50 10 IJGE Br[C@@H]1CN(Cc2ccc(I)cc2)CC12CCCCC2 2117742772 KBVWXPBEMAQYIC-OAHLLOKOSA-N 434.159 4.821 50 10 IJGE CN(Cc1cscc1Br)C[C@H](Br)COCc1ccccc1 2209665093 BGJKKPUVWBNBJU-HNNXBMFYSA-N 433.209 4.923 50 10 IJGE C[C@H](COC(F)F)O[C@](C)(CI)c1ccccc1Br 2265058174 VRMQZDDBIXSOPV-NOZJJQNGSA-N 449.073 4.744 50 10 IJGE O=C1Cc2cc([C@H](Br)c3cc(Br)co3)c(Br)cc2N1 2270465626 RWFZMCNFVUJLQH-ZDUSSCGKSA-N 449.924 4.784 50 10 IJGE O=C(N[C@@H](CBr)c1cscn1)c1cc(F)c(Br)cc1Cl 2282984388 RFNLCQKUBPBINQ-JTQLQIEISA-N 442.535 4.564 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1Cc1ccc(Cl)cc1I 2302326283 NZARHRSWXFQQMW-ZANVPECISA-N 428.539 4.692 50 10 IJGE C[C@@H]1C[C@@H](Cl)CCN1Cc1ccc(I)c(Br)c1 2306221632 KNNBADUSWQKFFA-KOLCDFICSA-N 428.539 4.645 50 10 IJGE C[C@H]1[C@H](CCl)CCN1Cc1ccc(I)c(Br)c1 2306224083 MPSZFYLMJILMBM-ONGXEEELSA-N 428.539 4.503 50 10 IJGE CCCN(CCCBr)Cc1cc(I)ccc1Cl 2307333078 XUHRWTWXYYJAQO-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE O=C(CCCSc1ccccc1)NN=Cc1cc(Cl)cc(Br)c1O 2321230119 MEZSXCXAEWPBRG-UHFFFAOYSA-N 427.751 4.831 50 10 IJGE ClC1C[C@H]2CN(Cc3ccc(I)c(Br)c3)C[C@@H]2C1 2325207985 FESQRYYGNRTOJZ-QWRGUYRKSA-N 440.550 4.503 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3CCC[C@]3(CNC(=O)OC(C)(C)C)C2)C1 2345010534 MIXPRSJCIREXIO-KKSFZXQISA-N 429.443 4.815 50 10 IJGE O=C(N/N=C/c1cc(Cl)ccc1O)c1cccc(NC(=O)c2ccccc2Cl)c1 27520229 YEVOBEFKFOPECT-WYMPLXKRSA-N 428.275 4.715 50 10 IJGE Cc1ccc(C)c(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(O)cc2)CCC3)c1 40812045 DOWWEDRYWCZPOO-ZXVVBBHZSA-N 431.492 4.633 50 10 IJGE Cc1c(C(=O)N(C)Cc2ccccc2)oc2c1/C(=N/NC(=O)c1ccccc1Cl)CCC2 40812736 BBZQHWZEGXOZAI-NHFJDJAPSA-N 449.938 4.984 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2cc(C)n(C3CCCCC3)c2C)cc1 58893225 LRPHIXMWSGSPFB-XGPRFBRNSA-N 425.573 4.973 50 10 IJGE Cn1c(/C(C#N)=C\c2cn(-c3ccccc3)nc2-c2ccncc2)nnc1-c1ccccc1 108968839 NDWVFECLADKXGK-PGMHBOJBSA-N 429.487 4.794 50 10 IJGE O=S(=O)(c1c(Cl)cc(Br)cc1Cl)N1CCCC[C@H]1CCCl 109644836 HVWKAUIVPZVZGH-JTQLQIEISA-N 435.598 4.928 50 10 IJGE CCCCOCCO[C@@H](CI)c1ccccc1Br 162122961 FRTTXVQCEOJLII-AWEZNQCLSA-N 427.120 4.759 50 10 IJGE O=C(NCCCCCCI)c1cc(Br)ccc1Cl 236056578 WVXQMPXGGCDKTI-UHFFFAOYSA-N 444.538 4.828 50 10 IJGE CC[C@@H](C)N(CCBr)C(=O)c1cc(Br)cc(Br)c1 310776250 NXVSDRMELCLAJK-SECBINFHSA-N 441.989 4.847 50 10 IJGE COc1ccc([C@H](Br)c2sccc2I)cc1OC 311199750 HNBVJXUVPNCNPB-LBPRGKRZSA-N 439.112 4.854 50 10 IJGE FC(F)c1c(I)cc(Br)cc1CBr 575685135 JJHQFQWRSCDTRR-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE FC(F)c1c(I)ccc(Br)c1CBr 575687607 UQZAJHPXGFOTQO-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE C[C@@H]1[C@@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1cc(Br)c(Br)s1 686184349 CJXOSNOUTPMAOY-GTDKDYCYSA-N 427.589 4.894 50 10 IJGE C[C@H]1C[C@H](Br)CCN1C(=O)c1scc(Br)c1Br 705491315 SGKBZXFKJBBUSB-NKWVEPMBSA-N 446.002 4.661 50 10 IJGE O=S(=O)(NC1(CBr)CCCCCCC1)c1sccc1Br 713474015 ZKWZSWFZPXUANH-UHFFFAOYSA-N 445.242 4.667 50 10 IJGE COc1ccc(C(=O)NN=C(CC(F)(F)F)c2ccc(Br)cc2)c(OC)c1 731927742 QZZVDTZEJKGSQU-UHFFFAOYSA-N 445.235 4.553 50 10 IJGE CN(Cc1ccsc1)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 818056258 BUELBQAXKSOPJO-WQRHYEAKSA-N 435.940 4.744 50 10 IJGE COc1cc(/C=C\C(=O)Cl)cc(Br)c1OCc1ccc([N+](=O)[O-])cc1 1081478571 LKQHAEZHAGUTGX-DAXSKMNVSA-N 426.650 4.724 50 10 IJGE C#CC1(F)CN(C(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Cl)c(C(F)(F)F)c3)c2C)C1 1643708622 HEFRQDJSATWRRV-PXNMLYILSA-N 449.835 4.857 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccccc2Cl)c1 1865690076 IFSREJDEOMTFTG-NRFANRHFSA-N 434.927 4.764 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)c3ccc(OCC(C)C)cc3)c(C)n2)cc1C 1865756341 SUOQEPBEJFBITQ-UHFFFAOYSA-N 431.536 4.783 50 10 IJGE CCCCOCCOCCOCCN(Cc1ccccc1)[C@H](CBr)C1CC1 1915143516 PBXOWZPMQFZLIT-JOCHJYFZSA-N 442.438 4.512 50 10 IJGE COc1c(C(=O)N(Cc2ccccc2)C2(CBr)CCC2)cccc1[N+](=O)[O-] 1915750022 RBVSMVMHTNGNPD-UHFFFAOYSA-N 433.302 4.563 50 10 IJGE C[C@@H]1OCCO[C@@H]1[C@H](Br)c1cc(Br)c(Br)s1 1935559739 RZCGAFWUBMKJAJ-NGESMGFYSA-N 434.975 4.513 50 10 IJGE CCn1ncc(Br)c1[C@H](Br)c1sccc1Br 1937908673 YTDFRCBTZHGDFS-QMMMGPOBSA-N 428.975 4.974 50 10 IJGE O=C(Cc1ccc(O)c(Br)c1)N(CCCBr)Cc1ccccc1 1980632979 UVHZQYPWCPKIJU-UHFFFAOYSA-N 441.163 4.511 50 10 IJGE CCCN1CC[C@@H]([C@H](Br)c2cscc2OCc2ccccc2)S1(=O)=O 2038675868 BMAQRCBDIYNFJO-ZWKOTPCHSA-N 444.416 4.577 50 10 IJGE COCC(C)(C)N(Cc1ccccc1)S(=O)(=O)c1cc(C)c(CBr)s1 2059285810 DHHQUCMUBSEYEI-UHFFFAOYSA-N 446.432 4.567 50 10 IJGE CC(C)(C)OC(=O)N1CCCc2cc(CNC(=O)CCCCBr)ccc21 2106203703 LHDSVVDVPMDEMG-UHFFFAOYSA-N 425.367 4.556 50 10 IJGE C[C@@H](CCBr)CCN=[S@@](=O)(CCNC(=O)OC(C)(C)C)c1ccccc1 2107394622 MJRUWDAVNONEMZ-YHAMSUFESA-N 447.439 4.849 50 10 IJGE O=C(c1csc(Br)c1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Cl)C2 2134140188 YCWUMMOYDFDWFY-WXKLWKFWSA-N 431.552 4.596 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2N1C(=O)OC(C)(C)C 2196913239 CNCQUVONXAFDIT-TXTZMMAHSA-N 443.426 4.577 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CCC[C@@H](CN1C[C@H](CBr)c1ccccc1)C2 2200724490 WIZIUALGNWMGRR-LZNRXBQRSA-N 437.422 4.934 50 10 IJGE Br[C@@H]1CC[C@@H]2CCCN(C[C@@H]3CC3(Br)Br)[C@@H]2C1 2213090378 FGXZEGDEHZEFQA-NNYUYHANSA-N 430.022 4.520 50 10 IJGE ICCCCCN1CCC[C@@]2(CCCN(Cc3ccccc3)C2)C1 2214705232 PASAIUMRJJQIFY-OAQYLSRUSA-N 440.413 4.970 50 10 IJGE C[C@@H]1CCC[C@]12[C@@H](Br)C[C@H]2OCCOCCOCCOCc1ccccc1 2236089235 PXBKKPHQDABBLJ-FVTFTPSCSA-N 441.406 4.595 50 10 IJGE CO[C@@H]1CC[C@H]1[C@H](Br)Cc1cc(Br)cc(Br)c1 2252830040 NIDKIDIXPNHEBP-YNEHKIRRSA-N 426.974 4.943 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1C(=O)c1cc(Br)ccc1Br 2260370457 CJFQGSRWRMSLIJ-VXGBXAGGSA-N 439.973 4.600 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H](Br)C1)c1cc(F)c(Br)cc1Cl 2282970432 OLMPSJANCIRCIZ-RKDXNWHRSA-N 427.539 4.925 50 10 IJGE C[C@@H]1C[C@H](CBr)CCN1C(=O)c1cc(F)c(Br)cc1Cl 2282982930 ICYOSBGABPQAMN-RKDXNWHRSA-N 427.539 4.877 50 10 IJGE O=C(NC1CCC(CBr)CC1)c1cc(F)c(Br)cc1Cl 2282983982 USSZNSQKXYNOEI-UHFFFAOYSA-N 427.539 4.925 50 10 IJGE CSc1ncc(Cn2c(CCl)nc3cc(I)ccc32)s1 2284555714 HYGONJGKNWNMML-UHFFFAOYSA-N 435.743 4.606 50 10 IJGE N#CC(=Cc1ccc(-c2ccc(C(=O)O)cc2)o1)c1nc2cc(Br)cnc2[nH]1 2293826944 YCOMFVIQOCKRGU-UHFFFAOYSA-N 435.237 4.743 50 10 IJGE CC(C)C[C@@H](Cl)CNCc1ccc(I)c(Br)c1 2306219971 RUJVQUQTNHNGPC-LLVKDONJSA-N 430.555 4.797 50 10 IJGE Cl[C@@H]1CC[C@@H](CNCc2ccc(I)c(Br)c2)C1 2306231969 OPGRWUSKIQCFSP-MWLCHTKSSA-N 428.539 4.551 50 10 IJGE Cc1cc(C=C(C#N)C(=O)NC2CCCCC2)c(C)n1-c1ccc(C(=O)O)c(Cl)c1 2313562586 YFINZUGVOBDTPQ-UHFFFAOYSA-N 425.916 4.802 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4)[nH]c3c2)cc1OCC 2318418047 ODIMOIGHKAUAAI-UHFFFAOYSA-N 428.492 4.791 50 10 IJGE CC1(C)C[C@@H](CBr)N(Cc2ccc(Cl)cc2I)C1 2318558129 RJJAXKXQHIJYLC-LBPRGKRZSA-N 442.566 4.940 50 10 IJGE CCCOc1cccc(C=NNC(=O)c2cccn(Cc3ccc(C(C)(C)C)cc3)c2=O)c1 2323662171 CQNIJSWVGUQCMG-UHFFFAOYSA-N 445.563 4.747 50 10 IJGE CCCCCOc1ccc(C=NNC(=O)c2cc(-c3ccccc3)nc(O)n2)cc1OCC 2323693698 PJIBREWOULCFDZ-UHFFFAOYSA-N 448.523 4.581 50 10 IJGE CC[C@@H]1CCCCN1C=C(C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 2324605303 AWXWFHVZAFSZBD-AREMUKBSSA-N 442.607 4.592 50 10 IJGE N#CC(=CNCc1cccc(Br)c1)C(=O)NC(c1ccccc1)c1ccccc1 2324837655 MVIUELMJGIIXAH-UHFFFAOYSA-N 446.348 4.852 50 10 IJGE ClCC1CC2(CCN2Cc2ccc(I)c(Br)c2)C1 2325219886 BYKHLICYMARXSB-UHFFFAOYSA-N 440.550 4.647 50 10 IJGE CC(C)(C)[C@](C)(CBr)Cn1ccnc1CCCN1C(=O)c2ccccc2C1=O 2327111715 DLURTLFUAUJMPO-JOCHJYFZSA-N 446.389 4.559 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@H](Br)[C@H]2CC[C@H]21 2327406903 NCSLFPMEUMHIPP-MBNYWOFBSA-N 440.550 4.692 50 10 IJGE N#CC(=C(O)C=Cc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc3c(c2)OCCO3)cs1 2331330687 BKLAAFBDEGHYFY-UHFFFAOYSA-N 433.445 4.996 50 10 IJGE CC[C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CN1CC1(CBr)CC(C)(C)C1 2345009459 DWCUKJCUEJZORF-GVDBMIGSSA-N 429.443 4.765 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](CN(C[C@@]2(CBr)CC2(F)F)C2CC2)C1 2351886984 HJOFCNFZMMLUOZ-KDOFPFPSSA-N 437.369 4.518 50 10 IJGE Cc1ccc(Cn2c(C)cc3c(c2=O)[C@@H](c2ccc(C(C)C)cc2)C(C#N)=C(N)O3)cc1 2442429 JPVSRKDQAXLBNB-DEOSSOPVSA-N 425.532 4.855 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)COc2cc(C)c(Cl)c(C)c2)cc1 14025338 FKBPGANXRZOZAH-UHFFFAOYSA-N 432.948 4.756 50 10 IJGE CCc1ccccc1Nc1ncnc(NNC(=O)c2ccc(Cl)cc2Cl)c1[N+](=O)[O-] 40587121 ZOVGJQVBOUPHKZ-UHFFFAOYSA-N 447.282 4.755 50 10 IJGE N#C/C(=C1\CCN(C(=O)OCc2ccccc2)C1)c1ccccc1I 382040448 IGOQZXIDWQGWDE-VLGSPTGOSA-N 444.272 4.611 50 10 IJGE O=C(c1cccc(Br)c1Cl)N1CCC(F)(F)[C@@H](CBr)C1 403948817 FYCMGJDSIYYHLQ-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE ClCc1cc(Br)c(OCCCO[C@@H]2CCOC2)c(Br)c1 699530597 MWAIHQVQHPDRIN-LLVKDONJSA-N 428.548 4.525 50 10 IJGE CC[C@H](C[C@H](C)Br)NC(=O)c1cc(Br)c(Br)s1 716854510 ILNDOUWHAJGNQJ-NKWVEPMBSA-N 448.018 4.955 50 10 IJGE CN(C[C@@H]1CCCCN1Cc1ccccc1)c1ccc([N+](=O)[O-])c(CBr)c1 720017646 YWQIPZHMVCACAK-FQEVSTJZSA-N 432.362 4.981 50 10 IJGE Cc1cc(CSc2ccccc2C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)on1 736693658 CXNKYPJUNCOEAX-UHFFFAOYSA-N 446.536 4.501 50 10 IJGE O=C(NCc1ccccc1-c1ccc(Cn2cccn2)cc1)NNc1cccc(F)c1F 745798967 DDNOSJADJMBSPG-UHFFFAOYSA-N 433.462 4.703 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCCn2ccc3cc(Cl)ccc32)c1C 760579582 DKFCAZMGUSGMMA-UHFFFAOYSA-N 434.931 4.687 50 10 IJGE C[C@@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CCC2=NNC(=O)c1ccc([N+](=O)[O-])cc1 1084242511 KEQULFQWPVKPAT-ILSIFQBBSA-N 433.508 4.943 50 10 IJGE O=C(NN=Cc1cc([N+](=O)[O-])ccc1O)c1[nH]c(-c2ccccc2)cc1-c1ccccc1 1084378482 MHPDQVOHJXHHQG-UHFFFAOYSA-N 426.432 4.726 50 10 IJGE C=CCOc1ccc(Br)cc1C=NNC(=O)[C@@H](C)Oc1cccc(Cl)c1 1084502753 RTNXWARWDNAZDP-CYBMUJFWSA-N 437.721 4.585 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccccc2Oc2ccc(C)cc2)cc1 1310068592 IPPPZJZUHWQUCF-SFHVURJKSA-N 447.491 4.610 50 10 IJGE COc1cccc(OCC(=O)Oc2cccc(/C=C(\C#N)c3ccc(OC)c(OC)c3)c2)c1 1615066573 HSZADZDRWQPHKG-UDWIEESQSA-N 445.471 4.761 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2ccc(-n3ccc(O)n3)cc2)c(C)n1-c1ccc(F)cc1 1630884235 MTUXRLPUZGOZGP-RGEXLXHISA-N 441.466 4.670 50 10 IJGE Cc1occc1C(=O)NN=C1CCCc2oc(C(=O)N3CCCc4ccccc43)c(C)c21 1772749854 SZAGLBKKJUPMRO-UHFFFAOYSA-N 431.492 4.553 50 10 IJGE CCc1nn(Cc2ccccc2F)c2c1[C@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 1865686661 YTZYBDZWILTXJF-SFHVURJKSA-N 426.854 4.644 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2)cc1 1865692417 BIRQMNUNDPOPJX-SFHVURJKSA-N 440.425 4.898 50 10 IJGE O=C(NC1(CCBr)CCC1)c1cc(Br)sc1Br 1942471275 LMFJXYQNMGLTNC-UHFFFAOYSA-N 446.002 4.711 50 10 IJGE C[C@@H]1C[C@@H](Br)CN(Cc2ccc(Br)cc2Br)C1 1943860179 VRTNKJHDAPZPIC-BXKDBHETSA-N 425.990 4.817 50 10 IJGE Clc1ncn(-c2ccc(Br)c(Br)c2)c1CBr 1986937742 KNFSVBFZFPXJEZ-UHFFFAOYSA-N 429.337 4.946 50 10 IJGE CN(C[C@]1(Br)CC1(F)F)c1ccc(CBr)c(Br)c1 2082521861 NPBJCJCWYQEYEL-LLVKDONJSA-N 447.943 4.953 50 10 IJGE Clc1cc(CN2C[C@H](Br)CC3(CC3)C2)ccc1I 2086657157 BSWLGXSIFUQXGV-LLVKDONJSA-N 440.550 4.694 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(C[C@@H](CBr)C(C)(C)C)C[C@@H]21 2106785797 QWVPMCSNFXQLGD-SFFUCWETSA-N 429.443 4.621 50 10 IJGE C[C@@H]1CN(C[C@H](CBr)c2ccccc2)C[C@H]1CCNC(=O)OC(C)(C)C 2106788178 NNKGCMSPEYGWPP-QRQLOZEOSA-N 425.411 4.648 50 10 IJGE COCCN(C)C[C@@H](Br)CCc1cc(Cl)c(C)c(Br)c1 2167384901 RGDLYRRKMPIVOD-ZDUSSCGKSA-N 427.608 4.685 50 10 IJGE Clc1ccc(Br)cc1CN1CCC(OCCCBr)CC1 2207531724 WRZCSVWCOADREU-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE C[C@H]1CCCN(CCCCCI)[C@H]1CCNC(=O)OC(C)(C)C 2211184283 LEBKUBFIPXGCKI-HOTGVXAUSA-N 438.394 4.607 50 10 IJGE F[C@H]1C[C@H](Br)CN(Cc2cccc(Br)c2Br)C1 2213900119 KBZABLSBPGAPDF-UWVGGRQHSA-N 429.953 4.519 50 10 IJGE O=S1(=O)CCCC[C@H]1[C@H](Cl)c1cc(Br)c(Br)cc1F 2225633501 KBWSUAWJUKUKOQ-NWDGAFQWSA-N 434.552 4.598 50 10 IJGE ClCc1nc2cccnc2n1-c1ccc(Br)cc1I 2231624168 RBKCCXIUYKGJAA-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE CC[C@H]1[C@@H](CBr)CCN1C(=O)c1cc(F)c(Br)cc1Cl 2282978014 HZWBQYOTLUZQSZ-OQPBUACISA-N 427.539 4.877 50 10 IJGE CCCOc1c(Br)cc(C=C(C#N)C(=O)Nc2ccc(O)cc2)cc1OCC 2297534008 BMOVDMOISGHGEX-UHFFFAOYSA-N 445.313 4.888 50 10 IJGE BrC[C@@H]1[C@@H]2CC[C@@H](C2)N1Cc1c(Br)cccc1Br 2310100507 BOKPGIFLSKRLLJ-ISTVAULSSA-N 438.001 4.959 50 10 IJGE Clc1ccc(COc2ccncc2CBr)c(I)c1 2317811432 LNOZGTMFGSUWDE-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE CC[C@@H]1CN(Cc2ccc(Cl)cc2I)C[C@@H]1CBr 2318542326 WKBVQODTUSQORY-PWSUYJOCSA-N 442.566 4.798 50 10 IJGE CCOc1ccc(-c2csc(C(C#N)=C(O)[C@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1 2331305260 JTJOFCNHPTVQGE-AWEZNQCLSA-N 445.500 4.686 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CCC2CCN(C[C@H]3C[C@H]3Br)CC2)CC1 2335932407 ISEDYVQYJCITEG-RTBURBONSA-N 429.443 4.909 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@@H]1CCl 2362380221 PZPKWIPSMRAJBB-UWVGGRQHSA-N 438.058 4.794 50 10 IJGE FC(F)(F)[C@@H]1C[C@@]1(CCl)CNCc1ccc(Cl)cc1I 2366715531 QVORCVSMOYJSNL-VXGBXAGGSA-N 438.058 4.842 50 10 IJGE Cc1sc(Br)cc1C(=O)N1CCC[C@H](Br)[C@@H]1C(F)(F)F 2370247773 ODXXWHKXJVPORJ-WCBMZHEXSA-N 435.103 4.749 50 10 IJGE Cc1sc(C(=O)N2CCC[C@H](Br)[C@@H]2C(F)(F)F)cc1Br 2370254785 ONUVNQYSMMESTR-OIBJUYFYSA-N 435.103 4.749 50 10 IJGE ClCCCN(Cc1cccc(Br)c1Br)C1CCOCC1 2381155066 WNUBLKSJRAGUNV-UHFFFAOYSA-N 425.592 4.822 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3)ccc2[C@@H]1c1ccccc1Br 38678434 SJHHSUATEGNFKJ-NRFANRHFSA-N 447.288 4.886 50 10 IJGE Cc1c(Cl)cccc1NC(=O)CCC(=O)NNC(=O)[C@@H](C)c1ccc(CC(C)C)cc1 66199253 QHKXBKVSCOJFFY-INIZCTEOSA-N 443.975 4.517 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)Nc2ccc3c(c2)OCCO3)cc1COc1ccccc1 96438604 XREZAFDIZJPPJZ-UYRXBGFRSA-N 442.471 4.591 50 10 IJGE CCOc1cc(/C=N/NC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)ccc1OC(C)C 169928014 SMWJPRJDPPKFEY-LIMNOBDPSA-N 445.734 4.574 50 10 IJGE CCCCOc1ccc(/C=C2\C(=O)N(Cc3ccc(F)cc3)C(=O)C(C#N)=C2C)cc1OC 214410339 ZVBGSHXYMOFOGQ-BKUYFWCQSA-N 448.494 4.806 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C\NCc1ccc(Br)cc1)C12CC3CC(CC(C3)C1)C2 217059016 CAXDGWFZAZIKJR-LJKAJTEJSA-N 442.401 4.667 50 10 IJGE O=C(N[C@H](CBr)Cc1ccccc1)c1cccc(Br)c1Cl 228459297 ZLSHDVQUFAADDM-LBPRGKRZSA-N 431.555 4.839 50 10 IJGE Fc1ccc(Br)c(F)c1CNCCCCCCI 230368012 APWFMGNHBHEXBX-UHFFFAOYSA-N 432.090 4.812 50 10 IJGE CC(C)N(CCCBr)C(=O)c1ccc(Br)cc1Br 232650082 KSUZAFRBFCIPKY-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE CC[C@H](Br)[C@H](CC)NC(=O)c1cc(Br)ccc1Br 313094314 VTXSXJMQDQFIMU-JQWIXIFHSA-N 441.989 4.894 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1 714994284 IUIMBSXRFBHHQZ-YADHBBJMSA-N 427.386 4.708 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1ccc(C(F)(F)F)cc1 749769962 SWKOILCJXJMVTJ-IBGZPJMESA-N 444.457 4.849 50 10 IJGE O=C(COc1ccc(C2SCCCS2)cc1)Oc1ccc([N+](=O)[O-])c2ncccc12 770131458 UXPQPDIZEBYSNC-UHFFFAOYSA-N 442.518 4.996 50 10 IJGE CCOC(=O)C(CC(=O)c1ccc(Cl)cc1)=NNC(=O)c1ccc(-c2ccccc2)cc1 1083910918 SWZRIZNYPKPSCQ-UHFFFAOYSA-N 448.906 4.929 50 10 IJGE C=CCC1(C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)CCCCC1 1290334703 LMDYTOAHTSOLJF-UHFFFAOYSA-N 428.536 4.827 50 10 IJGE Cc1ccc(-c2nc(C)c(C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)s2)c(F)c1 1558936575 MQNKGWZTZHFLLC-UHFFFAOYSA-N 448.527 4.792 50 10 IJGE CC(=O)c1ccccc1C(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1 1587239240 AXEFCNQGMMGOFU-UHFFFAOYSA-N 436.895 4.505 50 10 IJGE C=C(C)C[C@H](CO)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1633175920 VNQYSPCVQATLMK-KFVRLDSISA-N 432.351 4.751 50 10 IJGE CCN1C(=O)CCc2cc(-c3csc(NC(=O)/C(C#N)=C/c4ccccc4)n3)ccc21 1859513975 WHZYDCBHZKLFBE-XDHOZWIPSA-N 428.517 4.655 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865683721 NTQZMMKCQGGASN-XMMPIXPASA-N 441.579 4.785 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@@H]1c1ccccc1F 1865684425 YDGFZKFTIGECOY-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc3ccccc23)[C@@H]1c1cccnc1 1865700060 JVYVXUJQUIBFGT-GOSISDBHSA-N 433.393 4.657 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1cc(Br)sn1 1884458199 GDFDBHIZHRXDMB-LLVKDONJSA-N 432.181 4.722 50 10 IJGE CC(C)[C@H](C)[C@@H](C)OC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1901489475 BLMDYCRCFHTXKS-LSDHHAIUSA-N 439.378 4.888 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Cl)Cc1ccc(Cl)c(Br)c1F 1905344649 WCWWKSMZYLUPGW-JTQLQIEISA-N 431.088 4.688 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@]2(CCC[C@H]2Cl)C1 1918905937 ASXYVEGIXSLQAR-NOZJJQNGSA-N 427.589 4.897 50 10 IJGE Cc1ccnc(CN(C)C[C@H](Br)COCc2ccccc2)c1Br 1926833403 IKFCNINCRYDCHJ-INIZCTEOSA-N 442.195 4.565 50 10 IJGE BrCC(CBr)(Cc1cncc(Br)c1)C1CCC1 1942093924 XXACVFLKKRZNFZ-UHFFFAOYSA-N 425.990 4.963 50 10 IJGE CC(C)[C@@H](CBr)CN(Cc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 1953584378 KERMGLPOIUGYBM-SFHVURJKSA-N 425.411 4.775 50 10 IJGE O=C(NC[C@H]1CC[C@@H](Br)C1)c1cccc(Br)c1Br 2031487123 QSZGHBWVURWMEM-DTWKUNHWSA-N 439.973 4.505 50 10 IJGE FC(F)[C@@H]1C[C@@H]1[C@H](Br)c1cc(I)cc2c1OCC2 2041791475 ALTJHQICKBYXRA-NGZCFLSTSA-N 429.042 4.563 50 10 IJGE ClCCc1nc2ncccc2n1CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 2055791002 OLKXQOKTRLFOJB-UHFFFAOYSA-N 446.982 4.684 50 10 IJGE BrC[C@@H]1[C@H]2CC[C@@H](C2)N1Cc1c(Br)cccc1Br 2058369398 BOKPGIFLSKRLLJ-PKFCDNJMSA-N 438.001 4.959 50 10 IJGE C[C@H](Br)CCc1cn(-c2ccc(Br)cc2Br)nn1 2068990848 IROBYXHIFVAZBQ-QMMMGPOBSA-N 437.961 4.508 50 10 IJGE CCCC(CBr)(CCC)CN(C)[C@@]1(CNC(=O)OC(C)(C)C)CCOC1 2106784421 IMWYTLNGMUFXAK-HXUWFJFHSA-N 435.447 4.584 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1ccnn1[C@H]1CC1(F)F 2121752964 AXXXXWHHGLIWHP-IRXDYDNUSA-N 426.305 4.525 50 10 IJGE COC1(C(F)(F)F)CC(C(=O)N(Cc2ccccc2)[C@H](CBr)C(C)C)C1 2125554685 XTYAOFRFOYKOHT-UPTPFMHGSA-N 436.312 4.792 50 10 IJGE Cc1cc(Br)c(F)c([C@H](Br)c2cc(S(C)(=O)=O)cs2)c1 2149492259 HBEJYJKOXQCNOP-LBPRGKRZSA-N 442.169 4.846 50 10 IJGE CCN(CC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)c1ccc(CBr)cc1 2162911874 OQQLUBMFEVRBRH-UHFFFAOYSA-N 439.394 4.691 50 10 IJGE CC(C)(C)OC(=O)NCC1C[C@@H]2CC[C@H](C1)N2C[C@H](CBr)c1ccccc1 2163063017 OCYAALMBQCSBHF-BRLUZMBRSA-N 437.422 4.933 50 10 IJGE Cc1cc(S(=O)(=O)N2CCCC[C@H]2CCCBr)sc1Br 2206667425 MAYXUPSYWNMLKE-NSHDSACASA-N 445.242 4.537 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)[C@H]1[C@H]2COC[C@H]21 2213488777 ICCPIPVVMUGZFA-OSLXUSTOSA-N 428.921 4.679 50 10 IJGE Clc1cc(Br)ccc1C[C@]12CO[C@](CI)(C1)C2 2216256361 JHIQWARURPMUPL-BETUJISGSA-N 427.507 4.629 50 10 IJGE COc1ccc([C@@H](Br)c2c(F)cccc2I)s1 2247987877 NRTZQXNNVXJXCN-GFCCVEGCSA-N 427.076 4.985 50 10 IJGE C[C@H](CCBr)CCN1CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2255000220 AKTHADSPCJDKQO-HZSPNIEDSA-N 431.337 4.718 50 10 IJGE CC[C@@H](Br)CCCNC(=O)c1ccc(Cl)c(I)c1 2256387824 GROLIJMZCPUWEK-SNVBAGLBSA-N 444.538 4.628 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2CC[C@H]3C[C@H]2CO3)cc1I 2269556047 LAECCBRCWYEDSK-UUIJZJDISA-N 437.115 4.551 50 10 IJGE Clc1ccc(CN2CCC[C@@H](CBr)C2)cc1I 2300238490 LQQBVYVHIFCMAS-NSHDSACASA-N 428.539 4.552 50 10 IJGE COc1ccccc1[C@H](CBr)OCc1cccc(I)c1 2367344347 NTDZAGSYDVDZLI-INIZCTEOSA-N 447.110 4.953 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@H]2CC[C@H]1[C@@H](Br)C2 2377475362 UXTWBSUYJJMSEZ-TXMMPKFLSA-N 425.523 4.630 50 10 IJGE CC[C@H](C)c1ccc(OCC(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)cc1 13983235 VYNLHQLVGIYZJI-KBPBESRZSA-N 439.339 4.501 50 10 IJGE CC(C)c1cc(Br)ccc1OCC(=O)Oc1ccc(C=C(C#N)C#N)cc1 40992844 ZVSKRXBBBUYIRX-UHFFFAOYSA-N 425.282 4.987 50 10 IJGE COCCc1ccc([C@H](Br)c2ccc(I)cc2)cc1 109845003 ILWOPISLHVJUOG-INIZCTEOSA-N 431.111 4.964 50 10 IJGE CC(C)c1ccc(/C=N\NC(=O)c2ccc(Nc3nc4ccccc4c(=O)[nH]3)cc2)cc1 169927944 YPYDQQNXJINMRU-YSMPRRRNSA-N 425.492 4.554 50 10 IJGE CC(C)C[C@@H](CBr)NC(=O)c1cc(Br)cc(Br)c1 232588186 FLNRUFSDWGMRHA-LBPRGKRZSA-N 441.989 4.751 50 10 IJGE CCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)COc3ccc(C)cc3)cc2)cc1 254792404 UEBZNGACRIPVKW-UHFFFAOYSA-N 446.503 4.532 50 10 IJGE O=C(NC[C@@H]1CCC[C@H]1Br)c1scc(Br)c1Br 705396988 BEJQEJVFJCBFNP-NKWVEPMBSA-N 446.002 4.567 50 10 IJGE Cc1cc(C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)ccc1NC(=O)c1cccs1 759661619 VJRFWCAAOTYLSP-UHFFFAOYSA-N 444.438 4.956 50 10 IJGE CC(C)(C(=O)NNc1ccc(F)c(F)c1F)c1csc(-c2c(F)cccc2F)n1 815852716 GLYKTCLRUORWFB-UHFFFAOYSA-N 427.398 4.927 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cc3c(cc2F)CCC(=O)N3)c(C)n1-c1ccc(F)cc1 914747002 GORDGNQTNDABQH-ZDLGFXPLSA-N 446.457 4.803 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2ccc(OCc3ccc(C)cc3)cc2)cc1 1084310052 RIOLBBZLEDMEDM-AREMUKBSSA-N 446.547 4.937 50 10 IJGE C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccc(Cl)c(C(F)(F)F)c1 1165462748 LBTJHDWFBOXHRX-CYBMUJFWSA-N 442.265 4.838 50 10 IJGE O=C(Nc1ccc(Br)cc1Br)N1CCC(Br)CC1 1191531552 JBBRUUPJVOVRKS-UHFFFAOYSA-N 440.961 4.603 50 10 IJGE CC(=O)c1ccc(C(=O)NNC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)cc1 1352082477 MPACMLRKGLCIDN-UHFFFAOYSA-N 438.936 4.910 50 10 IJGE COc1ccc(-c2nn(Cc3cccc(F)c3)c3c2[C@H](c2ccco2)C(C#N)=C(N)O3)cc1 1865698616 YSKFKWGUVNCDRD-NRFANRHFSA-N 442.450 4.557 50 10 IJGE CN(CC(C)(C)CI)[C@H]1CCCC[C@H]1N(C)C(=O)OC(C)(C)C 1904651859 UYFRKTFNAWRTDI-LSDHHAIUSA-N 438.394 4.558 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)CCc1cc(Cl)cc(Cl)c1 1905371576 MGMQDASRIPBCEF-LBPRGKRZSA-N 427.125 4.986 50 10 IJGE Cc1ccnc(C(=O)N(Cc2ccccc2)C(C)(C)CBr)c1Br 1927093596 XQAFLBBEMMSDGN-UHFFFAOYSA-N 440.179 4.968 50 10 IJGE BrCCCN(Cc1ccc(Br)cc1Br)C1CC1 1943859691 RCCISZRJXUPQKQ-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE Cc1ccccc1COC1(CI)CCN(C(=O)OC(C)(C)C)CC1 2024648821 JBYNBVHCTAMHGC-UHFFFAOYSA-N 445.341 4.716 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)[C@@H]1CCC[C@@H]1Br 2026567339 QZWAONXCSMUUCF-GXFFZTMASA-N 428.539 4.692 50 10 IJGE CC(C)[C@H](Br)[C@@H](C)NC(=O)c1cc(Br)cc(Br)c1 2041309209 YKUSESNSTMLMFM-PELKAZGASA-N 441.989 4.749 50 10 IJGE Cc1cccc([C@@H](Br)c2ncn3ccsc23)c1I 2083981641 CNXYADDZBRJZQO-SNVBAGLBSA-N 433.112 4.793 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCCCN1C[C@H](CBr)c1ccccc1 2106781556 IXIXHGIKZONTMK-OALUTQOASA-N 425.411 4.934 50 10 IJGE O=C(NC1(CCl)CC2(CCC2)C1)c1scc(Br)c1Br 2107255424 DMMCPCKOHUINNH-UHFFFAOYSA-N 427.589 4.945 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@@H](NC(=O)[C@H](Br)C2CCCC2)C1 2110716187 VDDICGPZCSULMP-USXIJHARSA-N 431.415 4.530 50 10 IJGE CC1(C)CCN(C(=O)c2ccc(I)c(Cl)c2)C[C@@H]1CCl 2148664575 BOYUTVMPXHZAPT-NSHDSACASA-N 426.125 4.672 50 10 IJGE COc1c(Br)cc(Cl)cc1NC(=O)N1CCC(Br)CC1 2162130435 PHZMTDDZDFMJSS-UHFFFAOYSA-N 426.536 4.502 50 10 IJGE Cn1ncc(CC(CCl)(CCl)c2ccc(Br)cc2)c1Br 2173257509 HDJYSUDMSSYNMF-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE CC(C)[C@H]1CCCCN1S(=O)(=O)c1cc(CBr)sc1Br 2179775700 NNIPETAMJWABJV-LLVKDONJSA-N 445.242 4.605 50 10 IJGE Cc1csc(C(=O)NC[C@@]2(CBr)C[C@H]2C(F)(F)F)c1Br 2192583149 BLHMVNOUWBUIRA-HQJQHLMTSA-N 435.103 4.512 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CCCCCCBr)OCc2ccccc2)C1 2209379246 NZXQYMVESPLRJN-UHFFFAOYSA-N 441.410 4.995 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@H](C)CCCCCI)s1 2221839829 YBXJCWSREMEWKL-SECBINFHSA-N 444.176 4.933 50 10 IJGE Fc1ccc([C@H](CBr)OCCOCCOCCOCc2ccccc2)cc1 2236089952 VAXQNJSXMXBTAX-NRFANRHFSA-N 441.337 4.528 50 10 IJGE CC1(C)C[C@]1(Cl)Cn1c(CCl)nc2cc(I)c(F)cc21 2237920394 BIKYRWFMRADXJY-AWEZNQCLSA-N 427.088 4.926 50 10 IJGE C[C@@H]1[C@H](Br)C[C@H]2CC[C@H]1N2C(=O)c1scc(Br)c1Cl 2264510439 UIWYLGARXOLUCY-FDDDBJFASA-N 427.589 4.941 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1C1CCN(CC2(CBr)CC(F)C2)CC1 2265639283 RIEBQAHKTKBTPW-OHTSDLOESA-N 433.406 4.611 50 10 IJGE COC[C@@H]1CC[C@@H]([C@@H](Br)c2ccc(OC)c(I)c2)C1 2269541309 DHRKCFQFJPTZHR-UEKVPHQBSA-N 439.131 4.799 50 10 IJGE Cc1ccc(CBr)cc1NS(=O)(=O)c1ccc(Br)s1 2278723007 LKXKEKJCXKICEO-UHFFFAOYSA-N 425.167 4.515 50 10 IJGE CCn1nc(C)c(CBr)c1N1CCC[C@@H]1[C@H]1CCN(Cc2ccccc2)C1 2281304823 BFXXYNGWRTULNL-PZJWPPBQSA-N 431.422 4.597 50 10 IJGE C[C@@H]1C[C@H](Br)CCN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282977530 CXJDJEDVPSJWJQ-RKDXNWHRSA-N 427.539 4.877 50 10 IJGE COc1ccc(-c2csc(C(C#N)=CNc3cc4c(cc3C(C)=O)OCO4)n2)cc1OC 2295948611 WEVMWUCXGLXFNN-UHFFFAOYSA-N 449.488 4.735 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)cc1 2296655668 ZZRQFFVWRVCRTJ-UHFFFAOYSA-N 431.404 4.577 50 10 IJGE COc1cccc(NC(=O)C(C#N)=Cc2ccccc2OCc2ccc(C(=O)O)cc2)c1 2313556517 BSAQXEPTBICVLT-UHFFFAOYSA-N 428.444 4.518 50 10 IJGE Fc1ccc(C(F)F)c(CO[C@@H](CCl)[C@@H](I)CCl)c1 2338247946 AZFKVDRPYPOUKG-QWRGUYRKSA-N 427.031 4.930 50 10 IJGE CCC(C)(C)c1ccc(OCC(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)cc1 14784148 YLTHTFLOQIMEFY-UHFFFAOYSA-N 426.557 4.639 50 10 IJGE O=C(N/N=C/c1ccc(F)cc1)c1cccc(NC(=O)c2cccc(Br)c2)c1 27520180 BKZVGCBRHNYBIS-ZMOGYAJESA-N 440.272 4.604 50 10 IJGE Cc1cccc(Oc2nc3ccccn3c(=O)c2/C=C(/C#N)C(=O)Nc2ccccc2C)c1 39858612 VMPFZIWYXGPILN-CYVLTUHYSA-N 436.471 4.649 50 10 IJGE Cc1c(C(=O)Nc2ccc(Cl)cc2)oc2c1/C(=N/NC(=O)Cc1ccccc1)CCC2 40815838 TXRBCZHFTAKMTQ-ZXVVBBHZSA-N 435.911 4.893 50 10 IJGE CC(C)NC(=O)c1cc2ccc(OC(=O)/C(C#N)=C/c3ccc(C(C)C)cc3)cc2oc1=O 40894301 XUTDLZOSJWSNQP-RGVLZGJSSA-N 444.487 4.567 50 10 IJGE C/C(C=NNC(=O)c1ccn(Cc2ccc([N+](=O)[O-])cc2)n1)=C/c1ccc(C(C)C)cc1 254409239 WQHJGMTXJRPERK-OSLRKFFBSA-N 431.496 4.782 50 10 IJGE Cc1cc(S(=O)(=O)N2CCCC[C@@H]2C[C@@H](C)Br)sc1Br 383529286 ALMMOQVHDSYTKG-GHMZBOCLSA-N 445.242 4.536 50 10 IJGE BrCc1ccc(N2C[C@H]3C[C@H]2CN3Cc2ccccc2)c(Br)c1 390792282 XFZCPJMVSOQZCW-SJORKVTESA-N 436.191 4.807 50 10 IJGE C[C@@H]1CN(Cc2cc(Cl)ccc2I)CC[C@@H]1Br 405351923 VFDPKYPAKKFNIN-SKDRFNHKSA-N 428.539 4.550 50 10 IJGE CN(Cc1cc(Cl)ccc1I)C[C@H]1CCC[C@@H]1Br 708342400 RUWHNOFWARTHMX-MFKMUULPSA-N 442.566 4.940 50 10 IJGE Fc1cc2c(cc1Br)nc(CCCl)n2CC1CN(Cc2ccccc2)C1 716243438 JYOLXVGJXMFSFX-UHFFFAOYSA-N 436.756 4.851 50 10 IJGE Cc1ccc([N+](=O)[O-])c([C@@H]2CN(Cc3ccccc3)C[C@H]2CI)c1 725388270 KZECZYDFOKUHAI-SJLPKXTDSA-N 436.293 4.554 50 10 IJGE COc1cccc(Cc2cnc(NC(=O)NNc3ccc(OC(F)(F)F)cc3)s2)c1 727839092 XENOEOJHOBHAPT-UHFFFAOYSA-N 438.431 4.790 50 10 IJGE O=C(NCc1ccccc1-n1cccn1)C(=O)Nc1ccc(S(F)(F)(F)(F)F)cc1 773069190 STOSKCAOKFDNLH-UHFFFAOYSA-N 446.401 4.785 50 10 IJGE CC(C)Cn1ncc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1-c1ccccc1 799745883 NWGJYYKZZJHIBB-UHFFFAOYSA-N 427.430 4.853 50 10 IJGE O=C(NN=Cc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 1084103349 ALTBKCWZBQYUTA-UHFFFAOYSA-N 438.620 4.754 50 10 IJGE C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](O[Si](C)(C)C(C)(C)C)C1 1149155864 BXOPKCWSNYTNQD-HOTGVXAUSA-N 433.065 4.645 50 10 IJGE CC(=O)c1cc(F)c(O)c(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(C)cc3)c2C)c1 1156194099 JAENMYMNDWAUOP-KEBDBYFISA-N 431.467 4.996 50 10 IJGE C/C(=C\C1CCC(C)CC1)C(=O)NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1 1182533817 DLDSEHOGICRDQN-FBMGVBCBSA-N 427.570 4.703 50 10 IJGE C=CCNC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccccc2C)c1C 1351447394 SZELCSJBOAKZGP-JWGURIENSA-N 438.531 4.864 50 10 IJGE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2 1463643022 OUJQXRQUGHRMQV-GMCKNXKJSA-N 438.471 4.636 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2ccc(Sc3ccc(Cl)cc3)o2)c1 1644837847 CCTBHLZVXPXALR-UHFFFAOYSA-N 427.938 4.697 50 10 IJGE C=CCc1cc(CNC(=O)NNc2ccccc2Cc2ccccc2)cc(OC)c1OC 1677641089 KKPOWBLTTQPQDW-UHFFFAOYSA-N 431.536 4.849 50 10 IJGE CCCCCN1C(=O)C(=NNC(=O)COc2cccc3ccccc23)c2cc(C)ccc21 1772720084 BRJAZPOFSXDNID-UHFFFAOYSA-N 429.520 4.584 50 10 IJGE COc1cccc(C(=O)NN=C2CCCc3oc(C(=O)Oc4cc(C)cc(C)c4)c(C)c32)c1 1772749878 QTEXMRMZZSKVDY-UHFFFAOYSA-N 446.503 4.903 50 10 IJGE Cc1ccc(CC(=O)NNC(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)nc2C)c(C)c1 1865759305 SWMZHXGKHLBXOT-UHFFFAOYSA-N 442.346 4.984 50 10 IJGE CC(C)(C)OC(=O)NC1CCC([C@]2(C)CCC[C@H](CI)O2)CC1 1935996592 BAOHDOCTKBLTHA-HNFMNYKYSA-N 437.362 4.833 50 10 IJGE CCC[C@@H](Br)CNC(=O)c1cccc(Br)c1Br 1943886595 JUVCRSFRGADUAT-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NC(=O)c1csc(Br)c1Br 1945183662 KUHZQTGOBLLJSX-RQJHMYQMSA-N 448.018 4.955 50 10 IJGE C[C@@H]1C[C@H](CBr)CN1Cc1cccc(Br)c1Br 1950534090 BJCBHXRHHOEPAC-NXEZZACHSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1C1CCN(C[C@@H](CBr)C2CCC2)CC1 1966156378 KPHLIDURVNWASY-RTBURBONSA-N 429.443 4.909 50 10 IJGE CC[C@H](Br)CN(c1ncc(Br)cc1Br)C1CC1 1999961640 NDXQTWIRHGDHDT-QMMMGPOBSA-N 426.978 4.749 50 10 IJGE CN(CCN(C[C@@H](CBr)CC1CC1)CC(F)(F)F)C(=O)OC(C)(C)C 2050052994 IMWZNLHINDTUEH-CQSZACIVSA-N 431.337 4.529 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1cc(Br)c(Cl)s1 2052441086 DLGQIJQTLMJQBX-SSDOTTSWSA-N 435.634 4.801 50 10 IJGE Clc1ccc(N2CCCN(Cc3ccccc3)CCOCC2)c(CBr)c1 2088628683 QLTVJZOCQWBAHQ-UHFFFAOYSA-N 437.809 4.964 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@H]1Cn1c(CCl)nc2cncc(Br)c21 2095438908 BRUVVZIVWNFKPC-ZBFHGGJFSA-N 433.781 4.701 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C(F)(F)F)CCCN1C[C@@H](CBr)C1CCC1 2106789157 WRJNUZXRVPJTFN-PBHICJAKSA-N 443.348 4.719 50 10 IJGE Fc1c(CN2CCSC[C@@H]2CCBr)ccc(Cl)c1Br 2110525415 CRTAVRQMRMBCGN-JTQLQIEISA-N 431.596 4.944 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1CC[C@@H]2CN(Cc3ccccc3)C[C@H]2C1 2112432249 WILGEOBMXGCNPG-CVEARBPZSA-N 436.375 4.510 50 10 IJGE C[C@@H]1[C@H](C(F)(F)F)N(C[C@@H](CBr)CC2CC2)CCN1C(=O)OC(C)(C)C 2115980975 XEFDSVPBSPCODD-BPLDGKMQSA-N 443.348 4.670 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)c2ccc(CBr)cc2)n1 2138367110 XRIBBGUBMGBTNR-NSHDSACASA-N 440.363 4.876 50 10 IJGE CC1(C)CN(Cc2ccccc2)CCN(c2ccc([N+](=O)[O-])c(CBr)c2)C1 2150467208 CSPPONWLMYAMQX-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE CN(C1CC(OCc2ccccc2)C1)S(=O)(=O)c1cc(F)c(Cl)c(CCl)c1 2156449677 RJNOAWIMNFQUHQ-UHFFFAOYSA-N 432.344 4.586 50 10 IJGE CCC[C@H]1CCCCN1S(=O)(=O)c1cc(CBr)sc1Br 2179790551 GABJARSXTIKNFE-JTQLQIEISA-N 445.242 4.749 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CCCCCI)C2(CCCC2)C1 2211186174 VTWDUKYNIARPIH-HNNXBMFYSA-N 436.378 4.504 50 10 IJGE C[C@H](Br)C[C@H]1CCCCCN1C[C@H]1CC1(Br)Br 2213095565 PHEWJIFAOJFHRH-QJPTWQEYSA-N 432.038 4.911 50 10 IJGE Cc1cc(F)c(CBr)c(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@@H]32)c1 2283391096 ASJYBKSHWFITJE-FCHUYYIVSA-N 433.365 4.509 50 10 IJGE C[C@@H](CBr)CC1CN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285847998 IJEUAEQMPXZQNM-MRVPVSSYSA-N 427.539 4.735 50 10 IJGE C=CC[C@@]1(CBr)CCCCN1C(=O)c1ccc(I)cc1 2287755236 WNOCXQLAUQCURR-INIZCTEOSA-N 448.142 4.627 50 10 IJGE Cc1ccc([C@H](C)NC(=O)C(C#N)=Cc2c[nH]nc2-c2ccc(Br)cc2)cc1 2295266177 DRAPYGDIGRDRPI-HNNXBMFYSA-N 435.325 4.932 50 10 IJGE CC1(C)[C@@H](Cl)CCN1Cc1ccc(I)c(Br)c1 2306231419 JEGWQNKLSHWGFV-LBPRGKRZSA-N 428.539 4.645 50 10 IJGE CC(C)[C@H]1[C@@H](Br)CCN1Cc1ccc(Cl)c(I)c1 2315549887 XJDCXWLQISLLCQ-FZMZJTMJSA-N 442.566 4.938 50 10 IJGE Clc1ccc(CN2CCC3(CC(Br)C3)C2)c(I)c1 2318523079 CVACKCBGHPPYEV-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE CC1(C)[C@@H](NCc2ccc(I)c(Br)c2)CC[C@H]1Cl 2325213933 WOLPVBTWWZRPCL-OLZOCXBDSA-N 442.566 4.939 50 10 IJGE CCC(=CC(=O)N[C@](C)(CC)C(=O)Nc1ccc(SC#N)cc1)c1ccc(OC)cc1 2329560295 HDKHPTZIUVXNTF-XMMPIXPASA-N 437.565 4.985 50 10 IJGE ClCc1csc(CCOCc2cc(I)ccc2Cl)n1 2352269569 JPOCFTPEYPLFPC-UHFFFAOYSA-N 428.122 4.899 50 10 IJGE COc1ccc(CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(Cl)c2)cc1 38651263 FMMCFOSIYTWDMD-XMMPIXPASA-N 446.890 4.715 50 10 IJGE Cc1cccc(NC(=O)/C(C#N)=C/c2c(Oc3cccc(C)c3)nc3ccccn3c2=O)c1 39992887 XUPXOKOTZLFVKZ-XDJHFCHBSA-N 436.471 4.649 50 10 IJGE Cc1ccc(Oc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2[N+](=O)[O-])cc1 40658794 JTJRHKBKCQIUGV-UHFFFAOYSA-N 434.239 4.549 50 10 IJGE Cc1cc(OCC(=O)N/N=C/c2c[nH]c3ccccc23)c(Br)c(C)c1Cl 40950797 KQPCNYQSNLQHAB-NUGSKGIGSA-N 434.721 4.730 50 10 IJGE ClC[C@@H](I)[C@H](CCl)OCc1ccccc1Br 158548621 GRUBIWQEQJOPBV-MNOVXSKESA-N 437.930 4.616 50 10 IJGE CCCOc1c(Cl)cc(/C=N\NC(=O)CSc2nc3ccccc3[nH]2)cc1Cl 169886297 XNWLPLLCOBVOGI-YVNNLAQVSA-N 437.352 4.901 50 10 IJGE O=C(c1cc(Br)ccc1Br)N(CCBr)C1CCC1 228559822 XPQKLPPTMABXFY-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE ClCc1nc2cnccc2n1-c1cc(Br)ccc1I 302390012 NATRBYPYYQCPJX-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE Cc1c(Br)cc(CCl)cc1S(=O)(=O)N(Cc1ccccc1)C1CC1 383665351 RSBDYUNONNCDAI-UHFFFAOYSA-N 428.779 4.850 50 10 IJGE C[C@@H]1[C@@H](CBr)CCN1C(=O)c1cc(Br)sc1Br 385758166 FBQWOLUQNMIOPL-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE Clc1ccc(I)c(CN2CCC[C@H](CBr)CC2)c1 405324287 BHTRCDZDUQJWRZ-NSHDSACASA-N 442.566 4.942 50 10 IJGE O=C(N[C@@H](CCl)CC(F)(F)F)c1scc(Br)c1Br 717729321 NYBGHQGPDHHFDO-SCSAIBSYSA-N 429.483 4.563 50 10 IJGE CCN(C[C@@](C)(CI)O[C@@H](C)CC(C)C)C(=O)OC(C)(C)C 725343887 VNSWBFAULCWVQD-WMLDXEAASA-N 427.367 4.888 50 10 IJGE O=C(NNc1cc(Cl)ccn1)c1cccnc1Oc1ccc(F)cc1Br 778452891 DGKCMENNBJWBOD-UHFFFAOYSA-N 437.656 4.581 50 10 IJGE Cn1cc(C(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)c2cc(F)ccc21 804211505 SSTNALXQJXBMSQ-UHFFFAOYSA-N 429.377 4.550 50 10 IJGE COc1ccc2ccccc2c1C=NNC(=O)COc1ccc(Cl)cc1Br 1084006811 VOFIJWDXVFEVMQ-UHFFFAOYSA-N 447.716 4.793 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNc2cccc(Br)n2)cc1 1160866778 OWNNWIWPXIGOHJ-UHFFFAOYSA-N 425.286 4.547 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C[C@@H](CBr)C3CC3)CC2)C1 1307924881 WOYQDEJYAPLNGL-RBUKOAKNSA-N 429.443 4.767 50 10 IJGE C=CCOc1ccc(/C=C/C(=O)NNc2ccc(Cl)cc2Br)cc1OC 1647735448 GOHZMZZRUQASFQ-WEVVVXLNSA-N 437.721 4.832 50 10 IJGE CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NNc1cc(Cl)ccc1Br 1651620151 JKYYMYHQIKKALF-SFHVURJKSA-N 434.721 4.510 50 10 IJGE Cc1cc(C(=O)Nc2cccc(C(=O)Nc3ccc(SC#N)cc3)n2)ccc1N(C)C 1860570384 ZVPGZXSDIMVGNU-UHFFFAOYSA-N 431.521 4.534 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccc(Cl)cc1 1865703775 FLIIZMYSZHRQMX-QFIPXVFZSA-N 434.927 4.900 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@H](c1cccc(OC)c1)C(C#N)=C(N)O2 1865712283 UWJNUGUIHASYJS-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE Cc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2Cc1ccc(F)cc1 1865712641 DKHLYEZZXUJBMU-QGZVFWFLSA-N 428.389 4.616 50 10 IJGE Cc1cc([C@@H](CC(=O)N[C@H](C)C(=O)Nc2ccc(SC#N)cc2)C(C)C)ccc1F 1866758420 VYUBCPGQGNXGLZ-UZLBHIALSA-N 427.545 4.980 50 10 IJGE COc1ccc(-c2csc([C@@H](C#N)C(=O)/C(C#N)=C/c3ccccc3)n2)c(OC)c1OC 1872789042 WZKNNJMIESMSSA-FYXHJSOBSA-N 445.500 4.619 50 10 IJGE COc1ccc(CCC[C@@H](Cl)CN2C(=O)c3ccccc3C2=O)c(Br)c1 1901210116 ZYSBMMLHVYMXOR-CQSZACIVSA-N 436.733 4.684 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1ccccc1C(F)(F)F 1914341676 NGDSTUPRAPFNSL-CYBMUJFWSA-N 436.293 4.680 50 10 IJGE C[C@@H](Br)C[C@@H](C)NC(=O)c1cccc(Br)c1Br 1943887234 NSVIRFYCTPNTPO-HTQZYQBOSA-N 427.962 4.503 50 10 IJGE CC(C)(C)OC(=O)N1C[C@](C)([C@H]2CCC[C@H](CI)O2)CC1(C)C 1992813515 JVYVRSCWHQEKFG-HBUWYVDXSA-N 437.362 4.785 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1Cc1ccc(I)c(Cl)c1 2026564475 UCTMFOFJFVPYPY-ONGXEEELSA-N 428.539 4.692 50 10 IJGE O=C(CBr)c1c(Br)cc(Br)cc1OC(F)(F)F 2054922383 KZZZDZNUFGYYDM-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE CC1(C)C[C@@H](NC(=O)OC(C)(C)C)CN(C[C@@H](CBr)c2ccccc2)C1 2106787359 IKVJCLLUXOXBEO-QZTJIDSGSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)NCCCC[S@](C)(=O)=NC[C@@H](CBr)c1ccccc1 2110302295 IBTSWBJYBMNEKD-QUGAMOGWSA-N 447.439 4.568 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C(F)(F)F)N(C[C@H](CBr)CC2CC2)CC1 2112870431 CPHQKSGINMRYQL-GJZGRUSLSA-N 443.348 4.671 50 10 IJGE CN(Cc1ccccc1)[C@@H](Cn1c(CCCl)nc2cncc(Br)c21)C1CC1 2151793739 QQAVTZQQEBNEQW-IBGZPJMESA-N 447.808 4.886 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)c2ccc(CBr)cc2)CC1(C)C 2172476623 SGVRNSHCWCEAMV-MRXNPFEDSA-N 439.394 4.737 50 10 IJGE CC(C)CNCc1cc(Br)c(OC[C@@H]2C[C@H]2Cl)c(Br)c1 2196896955 TUBQKIGXPROQSQ-SMDDNHRTSA-N 425.592 4.963 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)c2ccccc2)CCC1(C)C 2231332264 UEGQQNAINMTUMD-GOSISDBHSA-N 425.411 4.887 50 10 IJGE CCCN(C[C@@H](C)Br)C(=O)c1cc(Br)cc(Br)c1 2259757459 LGAZYNOTCAVYHU-SECBINFHSA-N 441.989 4.847 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(OC[C@@H]2CC(F)(F)C23CCC3)C1 2266115901 WOZKIRJBUGFLMY-WMLDXEAASA-N 438.353 4.993 50 10 IJGE O=C(N[C@@H](CCl)c1ccsc1)c1ccc(Cl)c(I)c1 2268339971 KKPHQUFXWLUYOV-LBPRGKRZSA-N 426.106 4.716 50 10 IJGE CC(C)(C)C[C@H](CCl)CNC(=O)c1ccc(Cl)c(I)c1 2283665329 VMKQSKAATBSUGD-SNVBAGLBSA-N 428.141 4.966 50 10 IJGE N#CC(=Cc1cc(Cl)ccc1OCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(O)cc1 2293394490 JJDXAKAKOVOLIH-UHFFFAOYSA-N 448.862 4.868 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Br)[C@H]1OCCOC1(C)C 2295368540 WQWIERXLGGVOSH-DGCLKSJQSA-N 428.548 4.741 50 10 IJGE C[P@]1(=O)C[C@@H](Br)[C@H](Cc2ccc(Cl)cc2I)C1 2302317562 ITUPSIVKAOXVAK-CINOJJQCSA-N 447.478 4.873 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cc(F)c(Cl)cc1F 2320362249 UIECDTKHVNUWFI-CYBMUJFWSA-N 432.692 4.718 50 10 IJGE CCCCCCOc1ccc(C=NNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1OC 2328828110 UVJKAXWFZBKJJV-IBGZPJMESA-N 447.576 4.504 50 10 IJGE Cc1ccc(C=C(C#N)C(=O)Nc2ccc3c(c2)C(=O)N(c2c(C)cccc2C)C3=O)cc1 2329629412 IPGJOLPCDLUAGI-UHFFFAOYSA-N 435.483 4.958 50 10 IJGE Cc1ccc(C(=O)NC(C)(C)[C@H](Br)C(C)C)cc1I 2340402250 HANBEIGPQJHCTD-CYBMUJFWSA-N 438.147 4.528 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@H]2[C@H]3CC[C@@H]([C@H]2C1)N(C(=O)OC(C)(C)C)C3 2353833742 HUCGWONAUVYJQS-BCYZHJNNSA-N 429.443 4.621 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cc(C(F)(F)F)ccc1F 2369431474 RJOMAYLEAAHSFJ-OAHLLOKOSA-N 448.254 4.945 50 10 IJGE O=C(Cc1cccc2ccccc12)N[C@@H](CCBr)COCc1ccccc1 2369433689 QDMWJLVMUIWDME-NRFANRHFSA-N 426.354 4.869 50 10 IJGE Br[C@H]1c2ccccc2CCC[C@H]1Cc1ncc(I)cn1 2381287580 LDQGYDJOQZEXAL-BLLLJJGKSA-N 443.126 4.712 50 10 IJGE Cc1cc([N+](=O)[O-])c2[nH]c(C(=O)N/N=C/c3ccccc3C(=O)O)c(-c3ccccc3)c2c1 3644535 LSTBSWLNZNIPAD-DHRITJCHSA-N 442.431 4.514 50 10 IJGE O=C(O)c1ccc(Cl)c(-c2ccc(/C=N\NC(=O)c3ccc(Br)cc3)o2)c1 15932279 VNRWXGJHGOZLFR-YVNNLAQVSA-N 447.672 4.825 50 10 IJGE Cc1cc(C)cc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2F)c1 38652160 XGZMDTLRLIUZPI-VWLOTQADSA-N 444.462 4.645 50 10 IJGE Cc1c(C(=O)NCc2ccccc2)oc2c1/C(=N/NC(=O)c1ccc(Cl)cc1)CCC2 40811646 UKJYKKSOLKYAQU-ZXVVBBHZSA-N 435.911 4.642 50 10 IJGE Cc1ccc(C(=O)N/N=C2\C(=O)N(C/C=C/c3ccccc3)c3ccccc32)cc1Cl 59146586 HETOYGIHKJBIFZ-KODJXUEOSA-N 429.907 4.843 50 10 IJGE COc1cccc([C@H](C(=O)NC2CCCCC2)N(Cc2ccc(F)cc2)C(=O)CCl)c1 97915136 XZKHNRPAADRDTE-HSZRJFAPSA-N 446.950 4.592 50 10 IJGE C[C@H]1CCC[C@@H](OC2(CI)CCN(C(=O)OC(C)(C)C)CC2)C1 231314443 LSGDJJZKFHUSNX-LSDHHAIUSA-N 437.362 4.786 50 10 IJGE CCC[C@@H](Br)CNC(=O)c1ccc(Br)cc1Br 233265849 FDWRCTWBJBMFGO-SECBINFHSA-N 427.962 4.505 50 10 IJGE CC(C)(C)[C@@H](CCBr)NS(=O)(=O)c1c(Cl)cccc1Br 312315193 GJIAMMPPLKSPPB-LLVKDONJSA-N 447.620 4.581 50 10 IJGE C[C@H](Br)C[C@H](C)Nc1ncc(C(F)(F)F)cc1I 686108126 ASMQZUUOHRZFOD-BQBZGAKWSA-N 437.041 4.679 50 10 IJGE O=C(N[C@H]1CCC[C@@H](Br)C1)c1ccc(Br)cc1Br 694502449 AHBGBVXIXMSYCG-SCZZXKLOSA-N 439.973 4.648 50 10 IJGE COc1ccc(O[C@H]2C[C@@H](Br)C23CCCC3)cc1I 712929995 KIIQPAGQZBFCJG-KGLIPLIRSA-N 437.115 4.775 50 10 IJGE Cc1cccc2sc(NC(=O)/C(C#N)=C/c3cn(CCC#N)nc3-c3ccccc3)nc12 731598296 GCMXFMAKYRNTEN-QGOAFFKASA-N 438.516 4.928 50 10 IJGE CC[C@H](C(=O)NNc1nc(-c2ccccn2)nc(C)c1C)c1ccc(Br)cc1 1160812518 FYMWHYDJEXXAHN-KRWDZBQOSA-N 440.345 4.555 50 10 IJGE CC(=O)N1CCc2c(NC(=O)/C(C#N)=C\c3cc(C)n(-c4ccc(C)cc4)c3C)cccc21 1524080441 YIRGPFKZKMBATE-JCMHNJIXSA-N 438.531 4.857 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNC(=O)CCSc1ccc(F)cc1 1648380075 FSGKWLSSFHDXTE-QXMHVHEDSA-N 427.328 4.866 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@H]2C)oc2c1C(=NNC(=O)c1ccccc1)CCC2 1772745114 SISXCHIPNOWZOK-MRXNPFEDSA-N 427.504 4.650 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2OC)CCC3)cc1 1772746189 RNNVSOKWFYQBHP-UHFFFAOYSA-N 446.503 4.849 50 10 IJGE Cc1ccc2c(CC(=O)NN=C3CCCc4oc(C(=O)N5CCCC5)c(C)c43)coc2c1C 1772751959 PXUQHNSQORWQRV-UHFFFAOYSA-N 447.535 4.586 50 10 IJGE CC(C)Cn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(Cl)c([N+](=O)[O-])c1 1865706108 NUOLVJYZYHCEHJ-IBGZPJMESA-N 449.898 4.986 50 10 IJGE COc1ccc(C)cc1-c1csc(/C(C#N)=C(\O)CCN2C(=O)c3ccccc3C2=O)n1 1873920555 ILPPOVNDBRLEAC-ZZEZOPTASA-N 445.500 4.606 50 10 IJGE O=S(=O)(c1cccc(C(F)(F)F)c1)N(CCCBr)Cc1ccccc1 1914647872 LCRMDVDEDYZBLZ-UHFFFAOYSA-N 436.293 4.681 50 10 IJGE O=C(c1sncc1Br)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915264726 SSCBLZXGCXMJDN-AWEZNQCLSA-N 444.192 4.722 50 10 IJGE O=S(=O)(c1c(F)cc(F)cc1F)N(Cc1ccccc1)C1(CBr)CCC1 1915754971 GTUZIGOVDWVSLP-UHFFFAOYSA-N 448.304 4.612 50 10 IJGE Clc1c(Br)ccc(CBr)c1-n1cc(Br)cn1 1939331351 XRQVOPBACUHIRP-UHFFFAOYSA-N 429.337 4.946 50 10 IJGE C[C@@]1(CBr)CCN(Cc2ccc(Br)cc2Br)C1 1943839787 CKMONIYADWRKRG-ZDUSSCGKSA-N 425.990 4.819 50 10 IJGE O=C(NCCCCCBr)c1c(Br)cccc1Br 1945332896 JEXGAKUFELYPSQ-UHFFFAOYSA-N 427.962 4.507 50 10 IJGE CC[C@@H](Br)CN(C)C(=O)c1cc(Br)c(Br)s1 1977843176 OGVXCVIFAYFSJW-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE COc1ccc([C@@H](Br)c2cc(I)ccc2F)s1 2003649898 OQDMUESOHASQSY-LBPRGKRZSA-N 427.076 4.985 50 10 IJGE CCC[C@H](Br)CCNC(=O)c1c(Br)cccc1Br 2033091829 WBSBCTHAXLNHSF-VIFPVBQESA-N 441.989 4.895 50 10 IJGE CC(C)[C@@H](CBr)CN1CCC[C@@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2044704201 AQYWVTYSCXMNNG-XJKSGUPXSA-N 431.337 4.575 50 10 IJGE FC(F)(F)c1cc(I)cc(I)c1CCl 2060237048 BVAQVBNLDGHPSY-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE C[C@]1(NC(=O)c2cccc(Br)c2Br)CCC[C@H]1Br 2062579206 SIPOSFBIPPOYSU-MFKMUULPSA-N 439.973 4.648 50 10 IJGE Cc1cc(-n2nc(CCl)c(I)c2C(F)(F)F)cnc1Cl 2078880918 LMKPEFFSRFLNFH-UHFFFAOYSA-N 436.002 4.591 50 10 IJGE CC[C@@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@H]1CBr 2086660221 CEHVJVQBQXHLBL-VXGBXAGGSA-N 442.566 4.798 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@H]([C@H](C)NC(=O)OC(C)(C)C)C1 2106780818 BVFKWVHHZWBYMY-IRXDYDNUSA-N 435.447 4.582 50 10 IJGE CCN(CC)CCCO[C@H](CI)c1ccc(Br)cc1 2119265516 YLZQDGNDYIRKPD-OAHLLOKOSA-N 440.163 4.674 50 10 IJGE C[C@H](Cl)[C@@H](Nc1ncc(C(F)(F)F)cc1I)C(F)(F)F 2195317623 JBWUPRDMNFDACY-MHTLYPKNSA-N 432.533 4.675 50 10 IJGE CC(C)(C)C1CC(S(=O)(=O)N(Cc2ccccc2)C2(CBr)CCC2)C1 2223709224 LJRRUZGVQVTJIN-UHFFFAOYSA-N 428.436 4.961 50 10 IJGE O=C(c1ccc(I)cc1)N1C[C@H](Br)CC12CCCCC2 2241032267 SAIVDBFTGNDPHS-CYBMUJFWSA-N 448.142 4.604 50 10 IJGE CCn1nc(C)c(CBr)c1N1CCC[C@H]1[C@H]1CCN(Cc2ccccc2)C1 2281304818 BFXXYNGWRTULNL-FPOVZHCZSA-N 431.422 4.597 50 10 IJGE C[C@@H]1CO[C@](CBr)(Cc2ccc(Cl)cc2I)C1 2302315071 FLORSBXKPHIRFN-ZANVPECISA-N 429.523 4.677 50 10 IJGE COCCOc1ccc([C@@H](Br)[C@@H]2C[C@@H]2Br)cc1Br 2311266652 ALBVFINHVCAWDX-GBIKHYSHSA-N 442.973 4.694 50 10 IJGE CCc1ccc(-n2c(C)cc(C=C(C#N)C(=O)N3CCN(c4ccccc4)CC3)c2C)cc1 2313545720 AOPVCDQWSMDODF-UHFFFAOYSA-N 438.575 4.912 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(Cc2ccc(Cl)cc2I)[C@@H]1C 2321306382 YFTBTTSOKDTQCS-CWSCBRNRSA-N 442.566 4.938 50 10 IJGE CCN(CC)C[C@@H](Br)CCc1cc(I)ccc1Cl 2327408092 ZBUQLFGHSIDRKU-LBPRGKRZSA-N 444.582 4.983 50 10 IJGE Cc1ccc(CNCCCCCCI)c(O)c1Br 2327791757 FCRYXXHQOPNVOB-UHFFFAOYSA-N 426.136 4.548 50 10 IJGE CCc1nnsc1COc1c(Br)cc(Br)cc1CCl 2335914876 GOWFEWNRYIDLBN-UHFFFAOYSA-N 426.561 4.943 50 10 IJGE CC(C)CN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2351885523 LAUGMEDNIQFRMJ-YJBOKZPZSA-N 439.385 4.764 50 10 IJGE COCCc1ccc([C@@H](Br)c2ccccc2I)cc1 104051000 KQONXABWAXCVOP-MRXNPFEDSA-N 431.111 4.964 50 10 IJGE CCOCCC(CBr)(CBr)c1cccc(Br)c1 118671894 QCFHSFAXCKLCKT-UHFFFAOYSA-N 428.990 4.903 50 10 IJGE COc1ccc(Cl)c(CC(=O)N/N=C/c2ccc(OC(C)C)c(Br)c2)c1 169922057 JSZBCVUKHZGLON-SSDVNMTOSA-N 439.737 4.591 50 10 IJGE COC(=O)/C(C#N)=C\c1cccc(OC(=O)/C=C\c2ccc(OCCC(C)C)c(OC)c2)c1 206952850 BGHPJFVLRGHZNB-VMMTYSIESA-N 449.503 4.819 50 10 IJGE CCCOc1ccc(C(CC)=NNC(=O)[C@@]2(C)CC2(Br)Br)cc1 252616316 JZJCPZOBTUPRMA-MRXNPFEDSA-N 446.183 4.602 50 10 IJGE CC[C@H](NC(=O)c1cc(Br)ccc1Br)[C@@H](C)Br 386650615 BNYUKNCBOBDVLU-HQJQHLMTSA-N 427.962 4.503 50 10 IJGE C[C@@](CI)(OCCOCC1CC1)c1ccccc1Br 400748303 GNLHHKBVZCZHMC-HNNXBMFYSA-N 439.131 4.543 50 10 IJGE C[C@@H]1CCN(C(=O)c2scc(Br)c2Br)C[C@H]1Br 707788377 AAZLJULOQJWXAV-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE COCc1nc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)c(-c2ccccc2)s1 799753181 RGLBEXRBBPARMS-UHFFFAOYSA-N 432.427 4.604 50 10 IJGE CC(=O)c1cc(C(=O)NNc2c(Cl)cccc2Br)ccc1OC(C)C 1306869688 ICWQCIAAWRVWKU-UHFFFAOYSA-N 425.710 4.849 50 10 IJGE C=CCC[C@H]1CCCN1C(=O)CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C 1558671656 DLVDWGUDBAKVGQ-QHCPKHFHSA-N 435.684 4.910 50 10 IJGE C#Cc1ccc(NC(=O)NNC(=O)c2ccc(COc3ccc(Cl)c(C)c3)cc2)cc1 1563368586 WLZAYLOEZVYOAP-UHFFFAOYSA-N 433.895 4.675 50 10 IJGE CCOc1cc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)ccc1O 1614707135 YUOSZTDDEDPSGZ-ROUUACIJSA-N 434.330 4.538 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)Nc3ccc4nc(O)n(C)c4c3)c2C)cc1 1634785427 NKVQWWIKULJCNV-XDHOZWIPSA-N 425.492 4.541 50 10 IJGE CCOc1ccccc1C=NNC(=O)CCCOc1ccc(CC)cc1Br 1772755789 SFYIKVILPCENLV-UHFFFAOYSA-N 433.346 4.720 50 10 IJGE CCCCCCOc1ccc(C=NNC(=O)[C@@H](C)Oc2cccc(OC)c2)cc1OC 1772756067 KOYDDUGFTSLIRJ-GOSISDBHSA-N 428.529 4.581 50 10 IJGE CCCCCOc1ccc(C=NNC(=O)CSc2nc3ccccc3[nH]2)cc1OCC 1772760575 VVQSRHXOSHYUCD-UHFFFAOYSA-N 440.569 4.773 50 10 IJGE Cc1nn(-c2ccc(Br)cc2)c2c1[C@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865699568 XEEGZGVDAPFTEM-FQEVSTJZSA-N 446.308 4.643 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(Br)cc1O 1914609549 UVXGCABDHGOREW-GFCCVEGCSA-N 427.136 4.581 50 10 IJGE Brc1cc(Br)c([C@H](Br)[C@@H]2[C@H]3CCOC[C@@H]32)s1 1922892496 AWTSJEITKRYHBD-DWAQLAQLSA-N 430.987 4.992 50 10 IJGE O=C(NC1(CBr)CCCC1)c1csc(Br)c1Br 1945189731 YPRBTMHQRJITJG-UHFFFAOYSA-N 446.002 4.711 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@@H]1Cc1cc(Cl)ccc1I 2007129383 TUBRMFDYOZXYJQ-OPQQBVKSSA-N 429.523 4.676 50 10 IJGE CCN[C@H](c1ccc(Br)c(C)c1Br)[C@H]1C[C@@H]1Br 2024280597 ANFQLDIHMWHNLF-XHVZSJERSA-N 425.990 4.954 50 10 IJGE CC[C@](C)(CCBr)NC(=O)c1cccc(Br)c1Br 2031487847 ZLWIMKYQIDGQBH-CYBMUJFWSA-N 441.989 4.895 50 10 IJGE CCOC(C)(C)CO[C@](C)(CI)c1ccccc1Br 2094181178 JNTOXSNYPNPUJU-OAHLLOKOSA-N 441.147 4.931 50 10 IJGE ClCc1cc(Br)ccc1N1CC[C@H]2COC[C@@H](C1)N2Cc1ccccc1 2139653595 XQZJGMQCAQGDQB-VQTJNVASSA-N 435.793 4.668 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1c1ccc(NC(=O)[C@@H](Br)C2CCCC2)cc1 2167047799 LMTGBNWVOUJZNF-KURKYZTESA-N 437.378 4.959 50 10 IJGE CN(CCCC1CCC1)S(=O)(=O)c1cc(CBr)sc1Br 2179788660 FYKDVGFZGIFCLB-UHFFFAOYSA-N 445.242 4.606 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@@]12CCCC[C@@H]1N(C(=O)OC(C)(C)C)CCC2 2196915338 XNCUVYRKTWJXTN-ABLAWYLBSA-N 443.426 4.578 50 10 IJGE COc1ccc(Br)c(CBr)c1OC[C@H]1C[C@H](Br)C1 2220453905 HCEAXCGTNNZFPW-KYZUINATSA-N 442.973 4.905 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(CCCCI)c2ccccc21 2243586411 POMFZNNNBIGCHG-OAHLLOKOSA-N 430.330 4.678 50 10 IJGE Cc1c(N(C)Cc2ccccc2I)ccnc1CBr 2265531260 VUXWPUAJQXJXRU-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2C[C@@H]3CC[C@H](C2)O3)cc1I 2269542308 FUKZHWOIOAJRRK-MCYUEQNJSA-N 437.115 4.693 50 10 IJGE C[C@H](Br)[C@H]1CCN(Cc2cc(I)ccc2Cl)C1 2307315739 KKYICNWGSLRSQZ-UWVGGRQHSA-N 428.539 4.550 50 10 IJGE CCOc1c(Cl)cc(C=NNC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc1OC 2323608956 WRLXZOIAXIERAR-UHFFFAOYSA-N 446.960 4.888 50 10 IJGE Cc1cccc(CO[C@@H](CI)c2cccc(Br)c2)n1 2341710872 XIEZFZHLONPDOT-HNNXBMFYSA-N 432.099 4.845 50 10 IJGE Cc1ccc([C@H](C(=O)NC2CCC(C)CC2)N(Cc2ccccc2)C(=O)CCl)cc1 4672676 OVYQNCRALCOWQR-MXJXRJBTSA-N 426.988 4.999 50 10 IJGE CC[C@H](Oc1ccccc1[C@@H](C)CC)C(=O)NNC(=O)COc1ccccc1C(C)C 10682324 CSLVROZOCBEZMT-RXVVDRJESA-N 426.557 4.707 50 10 IJGE COc1ccc(NC(=O)[C@@H](NNC(=O)c2ccc(Cl)cc2)c2ccccc2)cc1Cl 15462468 FVTNNYWZKVWSFO-FQEVSTJZSA-N 444.318 4.616 50 10 IJGE O=C(CCCl)N1CCN(c2nc(C3CCCCC3)nc3sc4c(c23)CCCC4)CC1 35849119 VKWNONXYHXHMEZ-UHFFFAOYSA-N 447.048 4.895 50 10 IJGE C[C@@H](Cl)c1cn(-c2c(Br)cc(Br)cc2Br)nn1 163600995 UJYPNKVZIMDJQH-RXMQYKEDSA-N 444.352 4.855 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2ccc3nc(S)[nH]c3c2)ccc1OCc1ccccc1 169917410 MWKGRXNCILRDNZ-QFEZKATASA-N 446.532 4.593 50 10 IJGE COc1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)NN=C(C)/C=C\c2ccccc2)cc1 254380815 NCHREFJEXWKMQY-UUMLWGQWSA-N 439.515 4.672 50 10 IJGE COCCCCOc1c(Br)cc(Br)cc1CBr 310420680 YVXSZIGXNVGECH-UHFFFAOYSA-N 430.962 4.912 50 10 IJGE CC[C@H](Br)[C@H](CC)NC(=O)c1ccc(I)c(Cl)c1 313081022 ILBPJNOFDALHJM-CABZTGNLSA-N 444.538 4.627 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1C(=O)c1cc(Br)sc1Br 384540824 LPZPUUJGPMXDCS-SVRRBLITSA-N 446.002 4.661 50 10 IJGE BrCc1c(N2CC[C@H]3CC[C@@H](C2)N3Cc2ccccc2)nc2sccn12 399853774 SVHNKZMVCWSGEK-SJORKVTESA-N 431.403 4.534 50 10 IJGE FC(F)Oc1c(I)cc(Br)cc1CBr 575682470 RXPKFILBKFUHKM-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE CN(C(=O)c1cc(Br)cc(Br)c1)C(C)(C)CCBr 688398643 WZKODVPEBROLRG-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE CCOC(=O)c1ccc(CCCN2C(=O)CC[C@@H]2CO[Si](C)(C)C(C)(C)C)s1 725274562 UVXRIVVKLQBURI-MRXNPFEDSA-N 425.667 4.870 50 10 IJGE O=C(Cc1c[nH]c2cccc(Br)c12)Oc1ccc([N+](=O)[O-])c2ncccc12 770139596 SCHNSLRDDWXYAS-UHFFFAOYSA-N 426.226 4.535 50 10 IJGE CC(C)c1noc(Cc2ccc(NC(=O)NNc3ccc(C#N)cc3C(F)(F)F)cc2)n1 801942750 URQZJIQAWQAXQM-UHFFFAOYSA-N 444.417 4.823 50 10 IJGE C#C[C@@H](CO)NC(=O)c1cccc(O[Si](C(C)C)(C(C)C)C(C)C)c1OC(F)(F)F 1636624084 WQVMDJRSTYPVRF-INIZCTEOSA-N 445.554 4.863 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1cc(F)c(F)c(O)c1F 1915329547 RIXXLSGNYPRVQA-OAHLLOKOSA-N 430.264 4.871 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC1(CCC[C@@H](CI)O1)C2 1917625024 JQHVTASBXDRMRC-AWEZNQCLSA-N 435.346 4.540 50 10 IJGE Cc1cc(Br)sc1[C@H](Br)c1c(Br)cnn1C 1939448284 APCUGDMEDUCOMR-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE C[C@H](CCCBr)CNC(=O)c1csc(Br)c1Br 1945190524 ONRHDENLLYISKM-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE CC(C)CC(CBr)(CBr)Cc1cc(Br)n(C)n1 2002818647 SQTQMSYHTGSMID-UHFFFAOYSA-N 431.010 4.547 50 10 IJGE CC(C)c1ccc(-n2nc(CCl)c(I)c2C(F)(F)F)cn1 2078889025 IRLMELDAZKTFHV-UHFFFAOYSA-N 429.611 4.753 50 10 IJGE O=S(=O)(NC1(CBr)CCCCCCC1)[C@H]1C[C@H](OCc2ccccc2)C1 2105018900 JJHQIIMPBZXRBE-WGSAOQKQSA-N 444.435 4.532 50 10 IJGE CC(C)[C@H]1CN(C(=O)OC(C)(C)C)CCN1C[C@H](CBr)c1ccccc1 2106782662 SDRCWTRLSKRYHQ-RBUKOAKNSA-N 425.411 4.742 50 10 IJGE CN(CCCCCCCCCBr)CCOCCN(C)C(=O)OC(C)(C)C 2106787875 LEHMKOFAFGDPKI-UHFFFAOYSA-N 437.463 4.927 50 10 IJGE CN(C[C@@H]1CCCN(C[C@@H](CBr)c2ccccc2)C1)C(=O)OC(C)(C)C 2106788671 RQFZYKVCBMIGPH-PKOBYXMFSA-N 425.411 4.744 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1C1CCN(C[C@@H](CBr)CC2CC2)CC1 2112868197 HATOYQYVFVOVFT-IEBWSBKVSA-N 429.443 4.909 50 10 IJGE COc1ccc(Br)c(CN[C@H](C)CCCCCI)c1 2117883256 BDNHIAPHPGUYJV-GFCCVEGCSA-N 440.163 4.931 50 10 IJGE CC(C)(C)OC(=O)NC[C@H](NC(=O)c1ccc(CBr)cc1)C1CCCCC1 2162485289 BWAHQONFDBXDKO-SFHVURJKSA-N 439.394 4.785 50 10 IJGE Cc1sc(Br)c(C(=O)N2CCC([C@@H](F)CBr)CC2)c1C 2163245208 JABLHFBXQGCZES-NSHDSACASA-N 427.177 4.713 50 10 IJGE CN(C(=O)c1c(Br)cccc1Br)[C@@H](CCCl)C(F)(F)F 2178514016 YOPWXPQGLCCNLL-VIFPVBQESA-N 437.481 4.843 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)c(Br)c2F)C[C@H](CCBr)O1 2179383370 SNLCMUWILOPMQA-ONGXEEELSA-N 429.555 4.616 50 10 IJGE F[C@H]1C[C@@H](Br)CN(Cc2cc(Br)ccc2Br)C1 2213905861 FXTOXDYWYKSJGK-MNOVXSKESA-N 429.953 4.519 50 10 IJGE O=C(Nc1ccccc1CCBr)c1cc(I)ccc1F 2239232337 ZVVWOAGNXIBLIY-UHFFFAOYSA-N 448.073 4.620 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@@]2(CBr)CCC[C@]2(F)C1 2279176822 XTDIEIXQHWWQSD-STQMWFEESA-N 445.579 4.893 50 10 IJGE COC[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)N(CCCCCCCCCBr)C1 2289509261 UEPQSYZHJQZMHA-MOPGFXCFSA-N 449.474 4.974 50 10 IJGE COc1cc(NC=C(C#N)c2nc(-c3cccc([N+](=O)[O-])c3)cs2)c(C)cc1[N+](=O)[O-] 2296070806 NTNSNYBBSDNSMU-UHFFFAOYSA-N 437.437 4.920 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@@H](C)C1Br 2315552049 YXABYJGQXJUCIT-NXEZZACHSA-N 442.566 4.796 50 10 IJGE BrC[C@H]1CC2(CCCC2)CN1Cc1sccc1I 2316753795 BVXFZTLVTQZBTN-LLVKDONJSA-N 440.188 4.882 50 10 IJGE CCOc1ccc(C=CC(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3)nc2C)cc1 2321060320 HTUDTOJPDVZPLQ-UHFFFAOYSA-N 435.911 4.584 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CC(F)(F)CN1C[C@](C)(CBr)C(C)(C)C 2327105672 GOSHZTLDOKJQSV-DYVFJYSZSA-N 427.374 4.668 50 10 IJGE O=C([C@H](Br)Cc1ccccc1Cl)N1CCN(CC=Cc2ccccc2)CC1 2329368646 QVXGCPCDYGKHNF-HXUWFJFHSA-N 447.804 4.504 50 10 IJGE ClCCC1(NCc2ccc(Cl)c(I)c2)CCSCC1 2337222802 DIRXMLAOIBWUNO-UHFFFAOYSA-N 430.182 4.929 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCN(C[C@@]2(CBr)CC2(F)F)c2ccccc21 2379984540 MYFLZOMZNDVESQ-LIRRHRJNSA-N 445.348 4.925 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccc([N+](=O)[O-])cc3)ccc2[C@H]1c1ccccc1Cl 38651003 YGMLTEXEANCFOX-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@H]2C)oc2c1/C(=N/NC(=O)c1ccc(F)cc1)CCC2 40811890 SDSLASTZFQCAJQ-WVZIWNLSSA-N 445.494 4.789 50 10 IJGE COc1cc(Cl)c(/C=N/NC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1OC 66202187 HOBWPEHVCYMUED-VQGIZBIESA-N 431.703 4.582 50 10 IJGE CCCCOC(=O)c1ccc(NC(=O)/C(C#N)=C\c2cc(Br)ccc2O)cc1 102957545 RGQAKSDUEFPZQW-WJDWOHSUSA-N 443.297 4.657 50 10 IJGE C[C@H](Br)C[C@@H](C)NC(=O)c1cc(Br)ccc1Br 161234095 HIEDZMJJSGYNAK-JGVFFNPUSA-N 427.962 4.503 50 10 IJGE CCOC(=O)c1ccccc1N/C=C(/C#N)C(=O)N[C@H](CC)c1ccc2c(c1)CCCC2 217188526 GLISEPXPHOWBKK-FLVWFLKISA-N 431.536 4.829 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1Cl)/C(=C\c1cccs1)NC(=O)c1ccccc1 252602786 FLOGWQKFERMLIW-SAMODZKWSA-N 444.343 4.976 50 10 IJGE CC(=NNC(=O)CNC(=O)C(c1ccccc1)c1ccccc1)c1ccc(C(C)(C)C)cc1 254386328 RDZDILYZMKFILU-UHFFFAOYSA-N 441.575 4.773 50 10 IJGE aggregator O=C(c1cc(Br)c(Br)s1)N1CCC(F)(F)[C@H](CCl)C1 404025744 RFYZMHDAYTXPEM-ZCFIWIBFSA-N 437.531 4.609 50 10 IJGE CCOC1=N/C(=C(/C#N)N=Nc2ccc(OC)cc2)NC(=N)[C@H]1N=Nc1ccc(OC)cc1 1084251881 OZMQFSNQCOMIOT-ISQHFVRCSA-N 446.471 4.648 50 10 IJGE Cc1cc(NNC(=O)c2cccc3nc(O)n(CC(C)(C)C)c23)ccc1Br 1623513240 RMVWJUNXNRFAJK-UHFFFAOYSA-N 431.334 4.616 50 10 IJGE CC(C)Cn1nc(C(F)(F)F)c2c1OC(N)=C(C#N)[C@H]2c1cccc(Br)c1 1865684016 LFDUNSJRFIKUKK-CYBMUJFWSA-N 441.251 4.539 50 10 IJGE CCc1nn(-c2ccccc2)c2c1[C@@H](c1cc(Br)ccc1F)C(C#N)=C(N)O2 1865702691 ZJGBUTUINSPVDQ-SFHVURJKSA-N 439.288 4.554 50 10 IJGE CCCc1nn(-c2ccc(C)cc2)c2c1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865705946 KGNJDCKPLJBDGX-FQEVSTJZSA-N 449.898 4.913 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)CCCOc3c(C)cccc3C)c(C)n2)cc1C 1865756412 XQFMJDXCVFSPKC-UHFFFAOYSA-N 445.563 4.911 50 10 IJGE Cc1nc(Nc2ccc(SC#N)cc2)cc(N2CCC[C@H]2C(=O)NC2CCCCC2)n1 1868480821 URCANVOZJJHJOE-FQEVSTJZSA-N 436.585 4.520 50 10 IJGE O=C(N[C@@H](C[C@H]1C[C@H](Br)C1)C(=O)O)OCC1c2ccccc2-c2ccccc21 1877472989 OECLZONWYNIENY-YRVVQQKDSA-N 444.325 4.542 50 10 IJGE Cc1cc(Br)c(F)c(C[C@H](CBr)NC(=O)OC(C)(C)C)c1 1885098337 XWGYPPVRCBXFSN-LLVKDONJSA-N 425.136 4.727 50 10 IJGE CC(C)(C)OC(=O)N1Cc2nc(NC(=O)c3ccc(CBr)cc3)sc2C1 1898824412 PHJMPYRYRIMGCV-UHFFFAOYSA-N 438.347 4.541 50 10 IJGE O=C(c1cccc(I)c1)N(Cc1ccccc1)[C@@H](CCl)C1CC1 1915210699 UAUJTCANVYQGGR-SFHVURJKSA-N 439.724 4.951 50 10 IJGE O=S(=O)(c1ccc(CCl)cc1Br)N(Cc1ccccc1)CC1CC1 1946853389 ACOWTNCXXHIWEE-UHFFFAOYSA-N 428.779 4.789 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(I)cc1CCCBr 1951461116 IHRVQRMZKYMVRQ-UHFFFAOYSA-N 440.119 4.966 50 10 IJGE O=C(NCC1CCN(CC2(CBr)CCCCC2)CC1)OCc1ccccc1 1999507614 YFKGAVUONHMFIX-UHFFFAOYSA-N 437.422 4.970 50 10 IJGE O=C(N[C@@H]1CCC[C@H](Br)C1)c1c(Br)cccc1Br 2033089437 SWMKAIUGCXEBON-DTWKUNHWSA-N 439.973 4.648 50 10 IJGE BrC[C@]1(Cc2c(Br)cccc2Br)C[C@]12CCOC2 2039021404 AIEZIEDMEPGNRM-KBPBESRZSA-N 438.985 4.946 50 10 IJGE C[C@H]1C[C@H](C(F)(F)F)N(CC2(CBr)CCC2)CCN1C(=O)OC(C)(C)C 2121770471 HVFHNMSYOTWRAX-UONOGXRCSA-N 443.348 4.814 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCCC2)C(=O)[C@@H](Br)C2CCCC2)C1 2167032492 JPSOBYZQQRLTOR-SFHVURJKSA-N 443.426 4.578 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2Cc1cnc(Br)s1 2184939829 FXYCFZYMCAHAQI-UHFFFAOYSA-N 436.560 4.508 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Cl)C2 2190669251 BAIIZHUGXWZPJB-MHNYQROPSA-N 425.523 4.534 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)C1(c2ccc(NC(=O)OC(C)(C)C)cc2)CC1 2196913556 DRWRTGQMYVWRKS-FZNQNYSPSA-N 437.378 4.697 50 10 IJGE C[C@@H](C(=O)N(C)C[C@H]1C[C@H](Br)C1)[C@H](NC(=O)OC(C)(C)C)c1ccccc1 2196913797 HLBLTTPJGGXVQV-AHCXZYCDSA-N 439.394 4.520 50 10 IJGE COc1cc(N2CC[C@H]3CCN(Cc4ccccc4)C[C@@H]3C2)ccc1CBr 2204559501 PRSPMYNNOSXZPC-TZIWHRDSSA-N 429.402 4.939 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@H]1Br)c1scc(Br)c1Cl 2279183759 NUBQQYHZRWKZBW-SKDRFNHKSA-N 435.568 4.955 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2CCCCS2(=O)=O)c(Br)c1Cl 2283561114 FKCKLBJFSNYCMC-WDEREUQCSA-N 446.588 4.514 50 10 IJGE Clc1ccc(CN2CC[C@@H](CCBr)C2)cc1I 2300238838 PUACTRMEZIQLDX-SNVBAGLBSA-N 428.539 4.552 50 10 IJGE Cn1cnc(Br)c1[C@@H](Br)c1ccc(F)c(Br)c1 2300296446 MCXUCWHPDANBIK-VIFPVBQESA-N 426.909 4.569 50 10 IJGE CN(Cc1sccc1I)[C@@H]1CCCCC[C@@H]1Br 2301068285 JYQHENGUKJHHAQ-CMPLNLGQSA-N 428.177 4.881 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NCc1ccc(Cl)cc1I 2302326443 PHYVGFMWJINROM-SKDRFNHKSA-N 430.555 4.986 50 10 IJGE CC1(C)[C@@H](Cl)C[C@H]1OCc1ccc(I)c(Br)c1 2306296869 CAJXNKOBFVLVBL-NWDGAFQWSA-N 429.523 4.976 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)COc2ccccc2C(C)(C)C)cc1 2314785161 XXVNTBMIDHAQEE-UHFFFAOYSA-N 434.536 4.792 50 10 IJGE Clc1cc(CN2C[C@H]3CC[C@H]2[C@@H](Br)C3)ccc1I 2325451918 WYRFVPJNLMEVBQ-CHIMOYNISA-N 440.550 4.692 50 10 IJGE C[C@H]1C[C@H](Br)[C@H](C)CN1Cc1cc(I)ccc1Cl 2327404741 KJQTTWXXKLHBPM-NRUUGDAUSA-N 442.566 4.938 50 10 IJGE C[C@H]1CN(c2nc(C(F)(F)F)ccc2CBr)CCN1Cc1ccccc1 2343783382 DVOJVDQFUNLMAZ-AWEZNQCLSA-N 428.296 4.706 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@H](NC(=O)OC(C)(C)C)C(F)(F)CC2)C1 2345005438 YNVCYMXNNZVAFA-CQSZACIVSA-N 439.385 4.812 50 10 IJGE Cc1ccc([C@H](C)NC(=O)/C(C#N)=C/c2c[nH]nc2-c2ccc(Br)cc2)cc1 2769821 DRAPYGDIGRDRPI-LZNAANCOSA-N 435.325 4.932 50 10 IJGE COc1ccccc1/C(C#N)=C\c1ccc(OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 31900782 IPFQNUHOKNHGDM-YVLHZVERSA-N 445.387 4.795 50 10 IJGE CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccccc3OC)ccc21 38650436 OLKREXAVEPDKBT-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE O=C(c1ccc(Br)c(C(F)(F)F)c1)N1CCCC[C@@H]1CBr 124686892 XQBCQEXZVGOEDI-SNVBAGLBSA-N 429.074 4.858 50 10 IJGE COc1cc(Br)cc(-n2c(CCl)nc3cc(Br)cnc32)c1 169246249 PNUNULYAXKWTSU-UHFFFAOYSA-N 431.515 4.693 50 10 IJGE Cc1ccsc1C=NNC(=O)c1ccc(COc2c(F)c(F)c(F)c(F)c2F)o1 254532060 TVJYEATXEYDTQK-UHFFFAOYSA-N 430.354 4.688 50 10 IJGE CC(C)[C@@H](CBr)CNC(=O)c1cc(Br)sc1Br 394172518 YSGVAKWFDAHRJP-ZETCQYMHSA-N 448.018 4.670 50 10 IJGE O=C(c1ccc(Cl)cc1Br)N1CCC(F)(F)[C@@H](CBr)C1 403944891 DRIGRIUUUOIIDT-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE ClCc1ccc(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@H]32)cc1Br 404208340 VJRBOZYRWCJAGY-NHCUHLMSSA-N 435.793 4.668 50 10 IJGE CN(C(=O)c1cc(Cl)ccc1I)C(C)(C)CCBr 688398437 UCZRMEAJYLANMG-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE CC(C)S(=O)(=O)CCCC(CBr)(CBr)C1CCCCC1 696986160 IEFWYQHOSFEHFS-UHFFFAOYSA-N 432.262 4.946 50 10 IJGE C[C@@]1(CBr)CCCCN1c1ncc(Br)cc1Br 723019146 BQZKIPVVGKJUSC-LBPRGKRZSA-N 426.978 4.751 50 10 IJGE Cc1ccccc1C1(CNC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)CC1 726564325 HECOLSZIRJLCOU-JWGURIENSA-N 435.531 4.527 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccccc3S[C@H](C)CC#N)n[nH]2)cc1C 756489609 QDSRFGMAUHYUDL-MRXNPFEDSA-N 448.552 4.554 50 10 IJGE C[C@@H](SCc1ccccc1)C(=O)NN=C1C(=O)N(Cc2ccccc2F)c2ccccc21 1083998176 QPSFJZWZCDPGLV-QGZVFWFLSA-N 447.535 4.515 50 10 IJGE CCOc1cc(OCC)c([C@H](O)P(=O)(c2ccccc2)c2ccccc2)cc1OCC 1088693708 VWALWEVMDFVAEU-RUZDIDTESA-N 440.476 4.888 50 10 IJGE CC(=O)c1ccc(CCNC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(C)cc3)c2C)cc1 1546115453 GKDUGJUDUMQSFD-PCLIKHOPSA-N 425.532 4.871 50 10 IJGE O=C(CCSc1ccc(Br)cc1)NNc1nc2ccccc2[nH]c1=S 1585173965 SACMLTHQEPDLBL-UHFFFAOYSA-N 435.372 4.680 50 10 IJGE Cc1ccc(O)c([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3Cc2ccccc2)c1 1865687255 NEGRCZWVQMHYTN-QHCPKHFHSA-N 434.499 4.831 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc3ccccc23)[C@H]1c1ccccc1O 1865707802 GSPYWKQZBVYOJE-IBGZPJMESA-N 448.404 4.968 50 10 IJGE N#C/C(=C(O)\C=C\c1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc3c(c2)OCCO3)cs1 1872750312 BKLAAFBDEGHYFY-XUXROXFISA-N 433.445 4.996 50 10 IJGE CC[C@@H]1CC[C@@H]([C@H](CBr)NC(=O)OC(C)(C)C)CN1C(=O)OC(C)(C)C 1880755234 ORFMABSNMKNPHI-KFWWJZLASA-N 435.403 4.700 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1snc(Cl)c1Cl 1902777984 OKOXHJOTZXGDPF-LLVKDONJSA-N 438.174 4.550 50 10 IJGE O=C(N[C@H](CBr)CC1CC1)c1cc(Br)sc1Br 1942804861 DFHXPJHHSDSDJM-ZETCQYMHSA-N 446.002 4.567 50 10 IJGE CC1(C)[C@H](CBr)CCN1c1ncc(Br)cc1Br 1946257390 PYPPYFOVBISPPT-QMMMGPOBSA-N 426.978 4.606 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1C[C@]1(C)CC[C@](C)(CI)O1 1979567068 NFDHHZWZTFGRIY-FHLIZLRMSA-N 437.362 4.929 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1ccsc1Br 2006100484 HOUDHOKCPDCFHN-VIFPVBQESA-N 430.149 4.624 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc([S@@](C)(=O)=NC[C@@H](CBr)C2CC2)c1 2044693318 JXCRYNNXZYSUHF-DLUDVSRJSA-N 431.396 4.911 50 10 IJGE CN(CC[S@@](C)(=O)=NCC1(CBr)CCCCCC1)C(=O)OC(C)(C)C 2044706888 YAVWJXSVCKYGIX-RUZDIDTESA-N 439.460 4.687 50 10 IJGE FC(F)(F)c1ccc(CBr)c(I)c1Br 2054870628 JMYKOONQRSVRCW-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE Cc1nn(C)c(Br)c1CC(CBr)(CBr)CC(C)C 2065920069 RXIQUJYZXRUQBE-UHFFFAOYSA-N 445.037 4.856 50 10 IJGE CCc1cccc(Cn2nc(CCl)c(I)c2C(F)(F)F)c1 2079210279 MZUQTARMQUPJBW-UHFFFAOYSA-N 428.623 4.856 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2Cc1ccn(Cc2ccccc2)n1 2096814655 ZFJQBQIUBWJGET-UHFFFAOYSA-N 430.737 4.534 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC2(CC[C@H]1CCl)CC2 2097876903 JNSGVOWUGGDEDR-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE CC(C)[C@H](Br)C(=O)Nc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CCC2 2106303892 ZFOMKTAYMPRBIE-KRWDZBQOSA-N 425.367 4.728 50 10 IJGE CC(C)(C)OC(=O)NCCC[C@H]1CCCCN1C(=O)[C@H](Br)C1CCCC1 2110716718 AFFNDMVYBWBNIM-IAGOWNOFSA-N 431.415 4.626 50 10 IJGE COCCCCN(Cc1ccccc1)S(=O)(=O)c1ccc(C)c(CBr)c1 2123199273 QCDMGJYPNBGDMG-UHFFFAOYSA-N 440.403 4.507 50 10 IJGE COc1ccc([C@H](Br)c2nn(C)cc2Br)c(Cl)c1Cl 2138621861 ZPUHXZDRLJVUCL-VIFPVBQESA-N 428.939 4.982 50 10 IJGE ClCc1nc2cncc(Br)c2n1CCc1ccc(Br)s1 2151783523 JCNLKQCCNOFLRD-UHFFFAOYSA-N 435.572 4.999 50 10 IJGE CN(C)CCCN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)cc(CCl)c1Cl 2152203239 KELQZYZTDJXNJJ-UHFFFAOYSA-N 449.831 4.875 50 10 IJGE Cc1c(Cl)cc(C(=O)NC[C@]2(F)C[C@@H](CBr)C2)cc1Br 2168565984 RSJHDNYIHZYWPH-DEZZCRIOSA-N 427.539 4.654 50 10 IJGE COc1cc(NC(=O)[C@@H](Br)C2CCCC2)ccc1CNC(=O)OC(C)(C)C 2192960693 GHIOYOMIRUVLQJ-KRWDZBQOSA-N 441.366 4.612 50 10 IJGE Fc1cc(-c2ncc(CBr)c(C3CC3)n2)ccc1I 2228788318 NNFOKKQXEIMGSH-UHFFFAOYSA-N 433.062 4.660 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 2241493230 KWZHFAIHISXCKP-OWCLPIDISA-N 449.430 4.804 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OCC[C@@H]1CCCC12CC2 2243323044 UCCZZDADUKEHBT-YOEHRIQHSA-N 437.362 4.692 50 10 IJGE CN(Cc1cccc(I)c1)c1ccc(F)cc1CBr 2265545828 LCRGCRUARFLNJX-UHFFFAOYSA-N 434.090 4.962 50 10 IJGE COc1ccc([C@@H](Br)C[C@@H]2CC(C)(C)CO2)cc1I 2269557316 UFEMUXNSOJQAAY-NEPJUHHUSA-N 439.131 4.941 50 10 IJGE O=C(N[C@@H](CBr)c1cccs1)c1cc(F)c(Br)cc1F 2282148111 WUXYJRICWSTTQV-NSHDSACASA-N 425.092 4.655 50 10 IJGE C[C@]1(CBr)C=CCCN1C(=O)c1cc(Br)c(F)cc1Cl 2285956859 BLCSZKBSSBKYLJ-CQSZACIVSA-N 425.523 4.797 50 10 IJGE CCOc1ccc(C=C2CN(C)CC3=C2OC(N)=C(C#N)[C@@H]3c2ccc(OCC)cc2)cc1 2296910954 IMALPVYECIGASW-VWLOTQADSA-N 443.547 4.575 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1Cc1cc(I)ccc1Cl 2307320780 WIMCSEBZMSAEAV-RNCFNFMXSA-N 428.539 4.692 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=C3C(=O)N([C@H](C)CC)C(=O)C(C#N)=C3C)o2)cc1 2314610476 ISWGCTDWMRYHAF-OAHLLOKOSA-N 432.476 4.514 50 10 IJGE CCCOc1ccc(C=C(C#N)C(=O)Nc2sc3c(c2C(=O)OC)CC[C@@H](C)C3)cc1 2314736612 QAZWLLKETFBKJL-OAHLLOKOSA-N 438.549 4.994 50 10 IJGE Br[C@@H]1CCC[C@@H]2CN(Cc3sccc3I)CC[C@H]21 2316763599 CSOKFMKIAXIJGB-IJLUTSLNSA-N 440.188 4.738 50 10 IJGE N#CC(=CNc1cc(Br)ccn1)C(=O)NC(c1ccccc1)c1ccccc1 2324837767 MSGPOEDLJYZLSP-UHFFFAOYSA-N 433.309 4.569 50 10 IJGE ClCc1ccc(OCc2ccc(I)c(Br)c2)cn1 2325193508 SXVYKQNQIHMTJW-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE Cl[C@@H]1CCC[C@H]1CCNCc1ccc(I)c(Br)c1 2325217191 BMCDYVQJUUNUON-WCQYABFASA-N 442.566 4.941 50 10 IJGE C[C@@H]1CC[C@H](CBr)N(Cc2cc(I)ccc2Cl)C1 2327402152 UZYTZFMTMUXWNH-ZWNOBZJWSA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CCN(C[C@]1(CBr)CC1(F)F)C2 2351889284 SQDUHHSBAVILOX-GOSISDBHSA-N 431.321 4.812 50 10 IJGE Cc1sc(Br)c(C(=O)NCC(F)(F)C(F)(F)CBr)c1C 2361666684 ILPIYNUBPWINBB-UHFFFAOYSA-N 441.082 4.523 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)CCc1cc(Cl)cc(Cl)c1 2366852330 BCOBULSKXWGGKJ-HZMBPMFUSA-N 428.141 4.892 50 10 IJGE COc1ccc(CN(C(=O)CCl)[C@H](C(=O)NC2CCCCC2)c2ccccc2F)cc1 3033937 CYPIVPAJONUEFY-QHCPKHFHSA-N 446.950 4.592 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C/c2ccccc2Cl)c(OCC)c1 40867230 XJYIHPVDENISFI-OAQJZOFXSA-N 425.868 4.828 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2ccc(C(C)C)cc2)c(OCC)c1 40867278 FTWLTJGAEJLDNB-DEDYPNTBSA-N 437.492 4.663 50 10 IJGE O=C(CCCSc1nnc(CCc2ccccc2)n1-c1ccccc1)NN=C1CCCC1 58992322 CVHSFUPAIMFBDD-UHFFFAOYSA-N 447.608 4.971 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccccc2)C(=O)/C1=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1 101335078 CYEVOIQYRDTXBM-DEDYPNTBSA-N 439.427 4.647 50 10 IJGE CCCCOCCOCCOCCC(CBr)(CBr)CCC 127944592 TXJOFNXPJWXYGY-UHFFFAOYSA-N 432.237 4.803 50 10 IJGE CCSc1ccc(Cl)cc1CC(=O)N/N=C\c1ccc(OC)c(Br)c1 169922273 KLAIBOHQZFDZOL-NHDPSOOVSA-N 441.778 4.916 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\Nc1ccc(N(CC)CC)cc1 217240918 BTFHBZYNBNRLPY-HNENSFHCSA-N 434.540 4.948 50 10 IJGE BrCc1cc(Br)c(OC[C@H]2CCCO2)c(Br)c1 232484694 XLLHMPLSQRYOIK-SECBINFHSA-N 428.946 4.664 50 10 IJGE O=C(CCCOc1ccc(Cl)cc1Cl)NN=Cc1cc(Br)ccc1O 245284716 UHAUYNCUAFXMKL-UHFFFAOYSA-N 446.128 4.771 50 10 IJGE CC[C@H](O[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1I)c1ccccc1 403286807 RWYRVQQSCYKYQD-PMPSAXMXSA-N 431.314 4.577 50 10 IJGE CC(C)(C)OC(=O)NCCN1CCN[C@H](c2ccc(CO[Si](C)(C)C(C)(C)C)cc2)C1 616634537 UZLNYMAURFQPIX-NRFANRHFSA-N 449.712 4.679 50 10 IJGE Cc1cc(CBr)cnc1N1C[C@H]2CC[C@H]1[C@@H]1CN(Cc3ccccc3)C[C@@H]21 705875523 PEIQTZFFBKXURU-MBDNFAEBSA-N 426.402 4.632 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)N(C)C)cc(Br)c1OCc1ccc(F)cc1 1084280927 CJZKWILQAHHTFF-CXUHLZMHSA-N 447.304 4.561 50 10 IJGE C=CCC[C@@H](C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)c1ccccc1 1124216514 UMSFEEAWDOHWLO-JOCHJYFZSA-N 432.495 4.916 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 1167427224 CRGWDMBWNFXLJQ-UHFFFAOYSA-N 446.492 4.570 50 10 IJGE C#CCOc1ccc(COC(=O)/C(C#N)=C/c2cc(C)n(-c3ccccc3F)c2C)cc1 1268853819 KJFQQRAQWXZLPK-PXLXIMEGSA-N 428.463 4.896 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@H]1CCN(C(=O)c2cc3c(C(F)(F)F)cc(O)nc3o2)C1 1634077286 XLHSZZNDMYSAKK-NSHDSACASA-N 430.499 4.789 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccn2)[C@@H]1c1c(F)cccc1Cl 1865685736 MFYRHZWQERUJLP-IBGZPJMESA-N 443.869 4.945 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1cc(Br)sn1 1884457939 BZPNZYPKNFSRQC-UHFFFAOYSA-N 432.181 4.722 50 10 IJGE CC(C)[C@@H](CCNC(=O)OC(C)(C)C)CCC(=O)N(C)C[C@H]1C[C@@H](Br)C1 1887822422 AZRJJIMFZSVWPH-ZACQAIPSSA-N 433.431 4.586 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc(Br)cc1 1902790696 NWWKZGMEHAVTAD-QGZVFWFLSA-N 441.163 4.549 50 10 IJGE CC[C@@H]1C[C@@H]1CCO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1902818120 TVGMXCVINSJREX-RVKKMQEKSA-N 437.362 4.644 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCC(CBr)CC1 1945189266 MSBPPKQTUFREGP-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE C[C@H]1CCN(C(=O)c2csc(Br)c2Br)[C@H]1CBr 1945189695 XSIWVBALLQIKIK-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE C[C@H](CCBr)CCN(Cc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 1953585785 YMOHRZQIHQDGEK-QGZVFWFLSA-N 425.411 4.919 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@H](CI)O2)C[C@@H]1C1CC1 1990238799 GTDNOYDBPHDUCD-IIDMSEBBSA-N 435.346 4.539 50 10 IJGE C[C@@H]1OCC[C@@]1(CBr)Cc1ccc(I)c(Cl)c1 2026569925 ODKKYBPNSDMUSJ-ZANVPECISA-N 429.523 4.677 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](C(F)(F)F)CCN1CCCCCBr 2045430857 HGRMIZKOMFYFRF-UONOGXRCSA-N 431.337 4.719 50 10 IJGE Cc1sc(C)c(S(=O)(=O)Nc2ccccc2CBr)c1Br 2143911469 WRJHRKITKKHFQT-UHFFFAOYSA-N 439.194 4.823 50 10 IJGE CCN(CC)S(=O)(=O)C[C@H](Br)c1cc(Cl)c(C)cc1Br 2145642034 KDMIJRGHMKAVDG-LBPRGKRZSA-N 447.620 4.519 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCCC2)C(=O)[C@H](Br)C2CCCC2)C1 2167032491 JPSOBYZQQRLTOR-GOSISDBHSA-N 443.426 4.578 50 10 IJGE CC(F)(F)C[C@@H](CBr)NC(=O)c1scc(Br)c1Cl 2253554027 WYHUMXUXDBMSRP-YFKPBYRVSA-N 425.520 4.703 50 10 IJGE C=CC[C@@]1(CCl)CCN(C(=O)c2cc(Br)c(Br)s2)C1 2272171316 AIWGJTOTDZPIEV-ZDUSSCGKSA-N 427.589 4.920 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2[C@H]3CC[C@@H]([C@H]2C1)N(CCCCCCCBr)C3 2277441004 YQJOFXHAKIPRII-VJANTYMQSA-N 429.443 4.909 50 10 IJGE CCCOc1cc(Br)c(C=C(C#N)C(=O)Nc2ccc(OC)cc2)cc1OC 2313676671 QNTPKZDJOWFXQM-UHFFFAOYSA-N 445.313 4.801 50 10 IJGE CCCN1C(=O)C(=Cc2ccc(OCc3ccc(F)cc3)c(OCC)c2)C(C)=C(C#N)C1=O 2314611613 XZQAKCQJYSSUCF-UHFFFAOYSA-N 448.494 4.806 50 10 IJGE CCO[C@@H]1[C@H](Br)C[C@H]1OCc1cc(Br)cc(Br)c1 2315453498 NBHVLZBTPOGWEY-JHJVBQTASA-N 442.973 4.669 50 10 IJGE CCCOc1cccc(C=NNC(=O)c2cc(-c3ccccc3)nc(N3CCCCC3)n2)c1 2323756271 DFFYADXDQXTQDP-UHFFFAOYSA-N 443.551 4.687 50 10 IJGE C[C@H]1CC[C@](CCl)(NCc2ccc(I)c(Br)c2)C1 2325232868 GYFLPNKNLCVKEW-HZMBPMFUSA-N 442.566 4.941 50 10 IJGE C[C@@H]1CCCN(Cc2cc(I)ccc2Cl)[C@H]1CBr 2327398857 JKQXYBWFZBMSDH-YGRLFVJLSA-N 442.566 4.940 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H]2CC[C@H](C1)C2Br 2327401285 OTWXSHXQFMFQDO-XFLKPENQSA-N 440.550 4.550 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3CC[C@@](CNC(=O)OC(C)(C)C)(C3)C2)C1 2345008535 QDIAJYBUMVTDIC-UZLBHIALSA-N 429.443 4.815 50 10 IJGE CC(C)C[C@H](CBr)CN1CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2353833670 GUWPVROXWYVSGP-QLFBSQMISA-N 445.364 4.964 50 10 IJGE O=C(N/N=C/c1ccccc1Oc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1O 59500341 VLFBAFZRKWBZAG-BRJLIKDPSA-N 445.353 4.875 50 10 IJGE COc1ccc(Cl)c(CC(=O)N/N=C/c2ccc(OCc3ccccc3)c(OC)c2)c1 169921921 LNDVVDKHXMQPNN-CVKSISIWSA-N 438.911 4.629 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OCc1ccc(Cl)cc1 231317712 QYRMTXHUUCXYLF-INIZCTEOSA-N 439.721 4.575 50 10 IJGE CCOc1ccc(C=NNC(=O)COc2c(Cl)cc(Cl)cc2Cl)cc1OC 252611034 IGFGHQMPIGNLAM-UHFFFAOYSA-N 431.703 4.583 50 10 IJGE C[C@H](Br)C[C@H]1CCCCCN1S(=O)(=O)c1sccc1Br 312932755 FVYRHELYXXKIBG-WDEREUQCSA-N 445.242 4.617 50 10 IJGE CCc1ccc([C@@H](Br)c2cnn(C)c2I)cc1CC 381961097 YYOYBZUFLQDHBG-CQSZACIVSA-N 433.131 4.634 50 10 IJGE C[C@H]1CN(Cc2ccccc2)CCN1S(=O)(=O)c1cc(CCl)c(Cl)cc1Cl 382645410 JPXQSTHCZVPRAX-AWEZNQCLSA-N 447.815 4.627 50 10 IJGE Fc1cc2nc(CCl)n([C@H]3[C@@H]4CN(Cc5ccccc5)C[C@@H]43)c2cc1Br 398452117 OJMUDXRUHSWAII-IKDJWVMYSA-N 434.740 4.980 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1ncc(Br)cc1CCl)C2 706636688 FHZXNDWSFOJIJC-OYRHEFFESA-N 434.809 4.931 50 10 IJGE Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)NNC(=O)c1cccc2cccnc12 759307827 DSOZYFBZYKMJSL-INIZCTEOSA-N 445.548 4.714 50 10 IJGE CCN1C(=O)CCc2cc(NC(=O)NNc3ccc(Br)cc3Cl)ccc21 760073816 CSKTVAJUPBFVET-UHFFFAOYSA-N 437.725 4.550 50 10 IJGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 1087669076 WKIISFWOIIPCOE-IRXDYDNUSA-N 445.466 4.702 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CC)nn2-c1ccc(Cl)cc1 1865691416 RFCVKSGQBCNUQW-NRFANRHFSA-N 432.911 4.871 50 10 IJGE CCc1nn(-c2cccc(Cl)c2)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865698765 CDZMVLODUYQMED-OAQYLSRUSA-N 429.911 4.798 50 10 IJGE BrCCN(Cc1ccccc1)Cc1sccc1I 1888203706 QFDHYMKWSPFOFI-UHFFFAOYSA-N 436.156 4.750 50 10 IJGE C[C@](CCl)(CBr)OCc1ccc(Cl)cc1I 1901596978 QAPOWQNAYOKJTF-LLVKDONJSA-N 437.930 4.854 50 10 IJGE COc1cc([C@H](Br)[C@@H]2C[C@@H]2Br)c(OC)cc1Br 1910111059 CVQNDCNLQSRMTP-UTMSNSNXSA-N 428.946 4.686 50 10 IJGE Clc1cc2c(cc1[C@H](Br)c1csnc1Br)OCCO2 1925250230 IMSKIKNGRUBOQV-NSHDSACASA-N 425.529 4.815 50 10 IJGE CC[C@H]1CN(Cc2cc(Cl)ccc2I)C[C@@H]1CBr 2084891291 YJJKMSOTMNSFGC-JQWIXIFHSA-N 442.566 4.798 50 10 IJGE CCC(CC)(CBr)CN(CCOC)C[C@@H]1CCCN1C(=O)OC(C)(C)C 2106783422 ZXTBAJOEFNMUBJ-KRWDZBQOSA-N 435.447 4.536 50 10 IJGE CC(C)(C)OC(=O)N1CCC([S@@](C)(=O)=NCc2ccc(CBr)cc2)CC1 2126471435 KTKZKXUQTLYLAR-AREMUKBSSA-N 445.423 4.579 50 10 IJGE CC(C)CN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)CC1(CBr)CCOCC1 2163060453 AZHJRJSKHLAAEQ-SFHVURJKSA-N 447.458 4.536 50 10 IJGE CC1(C)C[C@](C)(CCl)CN1C(=O)c1ccc(I)c(Cl)c1 2199541909 UPCRTIZVOZXRIT-OAHLLOKOSA-N 426.125 4.814 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1c(F)cccc1F 2220335318 LXVFDZZDDMCANU-QGZVFWFLSA-N 432.330 4.575 50 10 IJGE CN(Cc1csc(NC(=O)c2ccc(CBr)cc2)n1)C(=O)OC(C)(C)C 2224610337 LDXQVWLDJHWLOS-UHFFFAOYSA-N 440.363 4.657 50 10 IJGE CCCN(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)CC1(CBr)CC(F)C1 2265632807 QCEZMHVQBWXJMG-ZRZPHAQCSA-N 435.422 4.859 50 10 IJGE O=C(NCC1CCC(Br)CC1)c1cc(F)c(Br)cc1Cl 2282973004 XBDJCDUBVJTMOB-UHFFFAOYSA-N 427.539 4.925 50 10 IJGE COc1cc(F)c(CBr)c(N2CC[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)c1 2283544967 LGYOLISWBQSQKR-MSOLQXFVSA-N 433.365 4.688 50 10 IJGE CCOC(=O)c1cccc(NC(=O)C(C#N)=Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)c1 2297298266 QLTRBTAKJSSPKJ-UHFFFAOYSA-N 431.404 4.577 50 10 IJGE CC[C@H](Br)CN(CC)Cc1ccc(Cl)cc1I 2302336082 KUUBEWRQWLYWLV-NSHDSACASA-N 430.555 4.940 50 10 IJGE C[C@@H](Br)CCCN(C)C(=O)c1ccc(Cl)c(I)c1 2314467411 OMZQQSMAVMLFSE-SECBINFHSA-N 444.538 4.580 50 10 IJGE Cc1nc(CCl)cnc1Oc1cc(Br)cc(I)c1 2316722024 NGJYMIFMRHDMCG-UHFFFAOYSA-N 439.478 4.683 50 10 IJGE Cc1nn(Cc2ccc(I)c(Br)c2)c(C)c1CCl 2325204620 QDPFCCMMLSWSQN-UHFFFAOYSA-N 439.522 4.654 50 10 IJGE COC(=O)c1ccc2c(O)nc(C(C#N)=Cc3ccc(OCc4ccccc4)cc3)nc2c1 2331045384 JMEHQIVLMKLNNL-UHFFFAOYSA-N 437.455 4.765 50 10 IJGE C[C@@H]1CCC[C@@H](CO[C@@H](CI)c2ccc(Br)cc2)O1 2338705044 JSHATHXYXXUHIB-UGFHNGPFSA-N 439.131 4.899 50 10 IJGE CC1(C)CC(CBr)(CN2CCC(C3CN(C(=O)OC(C)(C)C)C3)CC2)C1 2345009250 YWYKKOPTBLROOR-UHFFFAOYSA-N 429.443 4.767 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cccc(C(F)(F)F)c1F 2369431847 WVDNETCXJIHNSZ-AWEZNQCLSA-N 448.254 4.945 50 10 IJGE Cc1cccc(Oc2nc3ccccn3c(=O)c2/C=C(/C#N)c2nc3ccccc3n2C)c1 35549713 QSPHPMUTZKXADV-SDXDJHTJSA-N 433.471 4.746 50 10 IJGE COc1ccc(CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2Cl)cc1 38651102 RPBNDYRUFMQVRG-DEOSSOPVSA-N 446.890 4.715 50 10 IJGE Cc1cc(OCC(=O)N/N=C/c2ccc(Cl)cc2)c(Br)c(C)c1Cl 40950667 LAIVMZGNRWOQQZ-ODCIPOBUSA-N 430.129 4.902 50 10 IJGE COc1cccc(O[C@H](C)C(=O)N/N=C/c2ccc(OCc3ccc(C)cc3)c(OC)c2)c1 40960758 OTRQPGCLGVNXJV-BWJYWGHISA-N 448.519 4.509 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)Nc1cccc(CBr)c1 137105180 MARRNOIWKONTHF-UHFFFAOYSA-N 425.167 4.515 50 10 IJGE CC1(C)O[C@H]2[C@@H](CO[Si](C)(C)C(C)(C)C)O[C@@H](n3ccc4c(Cl)ncnc43)[C@@H]2O1 238809333 PTFANUVYJLNMOM-BASYENTBSA-N 440.016 4.524 50 10 IJGE in-vitro COc1ccc(C=NNC(=O)c2cc(-c3ccc(OCc4ccc(C)cc4)cc3)n[nH]2)cc1 254478052 IJHCSIZCGVNVNJ-UHFFFAOYSA-N 440.503 4.737 50 10 IJGE Cc1cccc(C(=O)Oc2ccc(C=NNC(=O)COc3ccc4ccccc4c3)cc2)c1 254741317 XSWTXLAXJZVWMB-UHFFFAOYSA-N 438.483 4.897 50 10 IJGE CCC(=NNC(=O)c1cc(-c2ccccc2OC)nc2ccccc12)c1cc(O)ccc1O 254836449 LFXBXKSKXWIQAB-UHFFFAOYSA-N 441.487 4.866 50 10 IJGE Brc1ccc([C@@H]2CC[C@@H](CI)O2)cc1Br 306380988 ROYVKSLATFYQIG-KWQFWETISA-N 445.920 4.867 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1Br)c1scc(Br)c1Br 707811812 PQTMEJHTKNJEPA-XPUUQOCRSA-N 446.002 4.709 50 10 IJGE CCCCCCOc1ccc(CC(=O)NNc2nc(-c3cccnc3)nc(C)c2C)cc1 736693747 NUCDKJDNMBACKA-UHFFFAOYSA-N 433.556 4.800 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)n3ccc(=NCC(F)(F)F)cc3)c2C)cc1 764944887 BFSOUKZYLHTZFL-DEDYPNTBSA-N 438.453 4.914 50 10 IJGE C[C@@H](C(=O)NNc1nc2ccccc2[nH]c1=S)c1cccc(C(=O)c2ccccc2)c1 1585173506 HCRJXRHBVKUJAA-OAHLLOKOSA-N 428.517 4.770 50 10 IJGE CN1C[C@@H](CI)[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 1614615029 LJSXDRZKHBVHIS-SKDRFNHKSA-N 437.165 4.804 50 10 IJGE Cc1cc([C@@H]2CN(Cc3ccccc3)C[C@@H]2CI)ccc1[N+](=O)[O-] 1614640812 FYNWHKDXQZPYFG-ROUUACIJSA-N 436.293 4.554 50 10 IJGE COc1cccc(C(=O)COc2cccnc2NC(=O)Nc2ccc(SC#N)cc2)c1 1858861897 UAEINURYLHFUEA-UHFFFAOYSA-N 434.477 4.569 50 10 IJGE CCCc1nn(-c2cccc3ccccc23)c2c1[C@@H](c1ccc(O)cc1O)C(C#N)=C(N)O2 1865681285 JLDNMZKNRDJLBG-QHCPKHFHSA-N 438.487 4.607 50 10 IJGE CCCc1nn(-c2ccccc2Cl)c2c1[C@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865683371 KFIBSSNDLIGBET-OAQYLSRUSA-N 433.943 4.762 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)c1ccccc1C(F)(F)F 1865755809 RAAOFLLFRUIEAN-UHFFFAOYSA-N 433.817 4.804 50 10 IJGE Clc1cc(OCCOCCI)c(Cl)cc1Br 1904659042 GTLWOZQVAIASOI-UHFFFAOYSA-N 439.902 4.586 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1ncsc1Br 1915099679 WMGJORFUGIQUHV-NSHDSACASA-N 432.181 4.722 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] 1915274644 SSXNTAOROAMTAB-SFHVURJKSA-N 441.272 4.935 50 10 IJGE O=C(C(C(F)(F)F)C(F)(F)F)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915315819 YSUHOVJBDJOUIN-GFCCVEGCSA-N 432.202 4.930 50 10 IJGE C[C@]1(CBr)CCCN1Cc1cccc(Br)c1Br 1943883294 ZBHSXPGANNVPAX-CYBMUJFWSA-N 425.990 4.961 50 10 IJGE CN(C(=O)c1csc(Br)c1Br)[C@@H](CCCl)C(F)F 2058235169 UGSFPNCNMVBYGO-LURJTMIESA-N 425.520 4.608 50 10 IJGE FC1(F)[C@@H]2COC[C@@]21[C@H](Br)c1ccc(Br)cc1Br 2083331237 XDUYFOWUOBZVPV-MXWKQRLJSA-N 446.911 4.929 50 10 IJGE BrCC1(CN2CCOCC23CCN(Cc2ccccc2)CC3)CCCCC1 2163147723 ORRBHJLLDOMMEQ-UHFFFAOYSA-N 435.450 4.699 50 10 IJGE Cn1ncc(CC(CBr)(CBr)c2ccccc2Cl)c1Cl 2168230787 CHRUXIYNGNVMJA-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE COc1cc(F)c([C@H](Br)c2nc(C)sc2Br)cc1OC 2169497573 ZTCRBCKUBYOMIT-NSHDSACASA-N 425.117 4.855 50 10 IJGE CC(C)(C)C1CC(S(=O)(=O)N(Cc2ccccc2)[C@H](CBr)C2CC2)C1 2223711186 GBIYCVVYSOXATC-CTWPCTMYSA-N 428.436 4.817 50 10 IJGE Fc1ccc([C@H](CI)O[C@@H]2CCN(Cc3ccccc3)C2)cc1 2244800347 LYLOIEAXECLVRO-MOPGFXCFSA-N 425.285 4.593 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1Cc1ccc(Br)cc1Br 2251034412 VQAQUSIQPUBQTO-WCQYABFASA-N 425.990 4.959 50 10 IJGE CC1CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)[C@H](CC(F)(F)F)C2)C1 2265307046 AUWVZCXCXNEMNK-XOYHFGRZSA-N 443.348 4.671 50 10 IJGE COC[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)N(CC2(CBr)CCCCCC2)C1 2289590994 YHXZSHOTYUQZJT-MSOLQXFVSA-N 447.458 4.584 50 10 IJGE C=CCc1cc(C=C(C#N)C(=O)Nc2cccc(Cl)c2Cl)ccc1OCC(=O)O 2313571557 YXRCFFULQAEOAL-UHFFFAOYSA-N 431.275 4.731 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Cl)c(I)c2)C[C@H]1CBr 2315551338 PNOVDJFVBBOGGV-ZYHUDNBSSA-N 442.566 4.798 50 10 IJGE COC1CC2(C1)CC(CBr)(Cc1sccc1I)C2 2316736598 NIYFXDCTDRXHHE-UHFFFAOYSA-N 441.172 4.866 50 10 IJGE COC[C@@H]1C[C@@H](Br)[C@@H](Cc2ccc(Cl)cc2I)C1 2318528866 KALFIMZSKDCAIN-UFGOTCBOSA-N 443.550 4.923 50 10 IJGE C[C@H](Br)CN(C(=O)c1csc(I)c1)C1CCCC1 2320003933 BYHGYDYPHMUJFV-VIFPVBQESA-N 442.160 4.521 50 10 IJGE CCc1nn(CC)c(CN[C@H](CCCl)COCc2ccccc2)c1Br 2320514398 GJPXCOWETBYBRP-MRXNPFEDSA-N 428.802 4.532 50 10 IJGE COc1ccc(-c2ccc(C(=O)NN=Cc3ccc(Br)cc3F)c(C)n2)cc1 2321218452 QQNKNYUWEPYRIN-UHFFFAOYSA-N 442.288 4.731 50 10 IJGE CC(C)Oc1c(Cl)cc(C=NNC(=O)CSc2nc3ccccc3[nH]2)cc1Cl 2323081426 MSKIQZPKDMQSFG-UHFFFAOYSA-N 437.352 4.899 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C[C@](C)(CBr)C(C)(C)C)CC(F)(F)C1 2327080857 QSEVDSOMLSIWRS-DYVFJYSZSA-N 427.374 4.668 50 10 IJGE CC(C)(C)[C@](C)(CBr)Cn1cc(Br)cc(Br)c1=O 2327112371 JSMQNOIRTYNWFV-CYBMUJFWSA-N 444.005 4.821 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@H]3C[C@H]2CN(Cc2ccccc2)C3)c1 2340260719 CVYDXJGUUMEYJO-IRXDYDNUSA-N 435.793 4.954 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@H]2CC[C@H]1C[C@@H]2Br 2362207832 UXHFNTUUSOCIIS-WEDXCCLWSA-N 425.523 4.630 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)COc1ccccc1[C@H](C)CC 9871268 XMLIQPCEBUCTLO-CEXWTWQISA-N 426.557 4.707 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(OC)c2)cc1 38650168 QWHWOZCKCCQFLS-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE C#CCOc1ccc(/C=N/NC(=O)c2ccccc2OCCCCC)cc1Br 59165892 MTFJYVVNMDCHMF-LFVJCYFKSA-N 443.341 4.794 50 10 IJGE O=C1COc2ccc([C@H](Br)c3ccc(Br)c(Cl)c3)cc2N1 129174553 XUKYMKVAEGMSOG-OAHLLOKOSA-N 431.511 4.918 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)/C(C#N)=C\Nc1ccc(Br)cc1 217182399 NHJOZYMPROQZBR-WSTOHFRZSA-N 428.330 4.853 50 10 IJGE CC[C@@](C)(CBr)NC(=O)c1cc(Br)cc(Br)c1 233945690 WOPPYJWTWHRAFZ-LBPRGKRZSA-N 427.962 4.505 50 10 IJGE Cc1cccc(C(=O)Oc2ccc(C=NNC(=O)COc3ccc(C(C)C)cc3)cc2)c1 254737622 UOMZZVRLTJCIAM-UHFFFAOYSA-N 430.504 4.867 50 10 IJGE CCn1c(SCC(=O)NN=Cc2ccc(C)s2)nnc1-c1ccc(C(C)(C)C)cc1 254852698 KXAUKBMVMGMSQR-UHFFFAOYSA-N 441.626 4.875 50 10 IJGE CC(C)(C)[C@H](CBr)NCc1cc(Cl)ccc1I 405292029 ICEBSSGUWVOXHY-LBPRGKRZSA-N 430.555 4.844 50 10 IJGE BrCc1cc(Br)c(O[C@H]2CCSC2)c(Br)c1 405344895 FQMBYHDBCZQCHY-QMMMGPOBSA-N 430.987 4.991 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1scc(Br)c1Br 705401501 RDSDEITZGPJKCV-UHFFFAOYSA-N 446.002 4.519 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1C(=O)c1scc(Br)c1Br 705491311 SGKBZXFKJBBUSB-BQBZGAKWSA-N 446.002 4.661 50 10 IJGE CCC[C@@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1cccc(C(F)(F)F)c1 726798762 DNLKNPKODBNEGB-GOSISDBHSA-N 430.430 4.739 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCCOc2cccc3ccccc23)c1C 736693748 HCKPKLHTYQTYEF-UHFFFAOYSA-N 427.508 4.611 50 10 IJGE CCc1cccc(CC)c1NC(=O)/C(C#N)=C/c1cccc(Cl)c1S(=O)(=O)CC 774121153 PGDDHGZOILQCMR-QGOAFFKASA-N 430.957 4.804 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)OCc2noc(-c3ccccc3O)n2)c(C)n1CCC(C)C 782428621 YHTUDIINZLCLSC-XDHOZWIPSA-N 434.496 4.557 50 10 IJGE CO[C@@H](C(=O)NN=Cc1cc(C)n(-c2cccc(Br)c2)c1C)c1ccccc1 1084151370 TZZWNEQXSPLCQN-OAQYLSRUSA-N 440.341 4.694 50 10 IJGE O=C(NN=Cc1ccccc1C(F)(F)F)C(=O)Nc1ccc(Oc2ccccc2)cc1 1084459729 ZNQUEKRNMOXKTI-UHFFFAOYSA-N 427.382 4.587 50 10 IJGE C=C1CCC(CNC(=O)CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)CC1 1177326779 LUKLJNYKBNYDPI-UHFFFAOYSA-N 435.684 4.816 50 10 IJGE CC(=O)CCc1ccc(O[C@@H](C)C(=O)NNc2ccc(Cl)c(Br)c2)cc1 1178799683 NPFBMWXBMNQCIQ-ZDUSSCGKSA-N 439.737 4.535 50 10 IJGE C#CCN(Cc1ccc(F)cc1)C(=O)/C(C#N)=C\c1cc(C)n(-c2ccccc2F)c1C 1264870996 AMHVGTDKUNPCPF-JCMHNJIXSA-N 429.470 4.941 50 10 IJGE Cc1nn(-c2ccc(Cl)cc2)c2c1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865705647 AVCZVYSXGXYYBM-SFHVURJKSA-N 442.262 4.614 50 10 IJGE CCOC(=O)c1cnn(-c2cccc(Cl)c2)c1NC(=O)/C(C#N)=C/c1ccc(C)cc1 1866127294 VINPDJQGPMTSDL-GZTJUZNOSA-N 434.883 4.557 50 10 IJGE CCCC[C@H](NC(=O)c1n[nH]c(C)c1-c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1867277762 WNTQKGHFXMSPRG-FQEVSTJZSA-N 447.564 4.886 50 10 IJGE C[C@@H]1CCN(C(=O)c2csc(Br)c2Br)C[C@H]1Br 1945188871 DDPSJZULIAEYML-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN1C(=O)c1scc(Br)c1Br 1950513269 QUCNSSFWMUSNDW-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1C[C@@]1(C)CCC[C@@H](CI)O1 1979567885 RXORHTWRONTICE-RVKKMQEKSA-N 437.362 4.929 50 10 IJGE CC1([C@H](CBr)NC(=O)c2cc(Br)cc(Br)c2)CC1 2033128965 AKRJZQIBMUIOLH-NSHDSACASA-N 439.973 4.505 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@H](CBr)C(C)(C)C)CCC1(F)F 2044695860 HNQUNCYLHRYZNU-UONOGXRCSA-N 427.374 4.668 50 10 IJGE C[C@@H]1OCC[C@H]1COc1c(Br)cc(CBr)cc1Br 2057463457 GDODAWVGMLHCGE-WPRPVWTQSA-N 442.973 4.910 50 10 IJGE Brc1ccc(CN2C[C@H]3CC(Br)C[C@@H]3C2)c(Br)c1 2065396864 JUPFYHCLZBLYTB-GHMZBOCLSA-N 438.001 4.817 50 10 IJGE BrC[C@@H]1CCN(Cc2c(Br)cccc2Br)C12CC2 2070107435 UMIQTUFARCMDNJ-JTQLQIEISA-N 438.001 4.961 50 10 IJGE Oc1cc(-n2nc(C3CC3)c(CBr)c2C(F)(F)F)nc(C(F)(F)F)c1 2078966884 INPDOSWTJRHSCJ-UHFFFAOYSA-N 430.146 4.783 50 10 IJGE CCCN(C[C@H](Br)C(F)(F)F)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2106784138 GKZBWQDQSKSWMF-IXXDHKBRSA-N 443.348 4.955 50 10 IJGE CN(C[C@H]1CCCCN1C[C@H](CBr)c1ccccc1)C(=O)OC(C)(C)C 2106785239 NWRZSTADIMWZRY-RBUKOAKNSA-N 425.411 4.887 50 10 IJGE Cc1ccc(Br)cc1C(=O)N[C@H](C)CCCCCI 2117894151 KCYJELQHWMSKQZ-GFCCVEGCSA-N 438.147 4.871 50 10 IJGE CN(C(=O)[C@H](Br)C1CCCC1)[C@H]1CCCC[C@H]1N(C)C(=O)OC(C)(C)C 2138777483 JTKFULLKKWWNJU-GVDBMIGSSA-N 431.415 4.577 50 10 IJGE BrC[C@]12CCCC[C@@H]1N(C[C@@H]1CC1(Br)Br)CCC2 2218007185 QZQUBPIDIXSMNO-RWMBFGLXSA-N 444.049 4.912 50 10 IJGE CCN(CCCCI)[C@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2243591492 VCKSCCAJKSIXFQ-HOTGVXAUSA-N 438.394 4.607 50 10 IJGE COc1ccc([C@@H](Cl)c2occc2Br)cc1I 2248893355 KLVYVPYXBSRNLV-LLVKDONJSA-N 427.463 4.984 50 10 IJGE COc1ccc([C@H](Br)c2cscc2OC)cc1I 2257370965 VXZFGBJKXYQMNV-ZDUSSCGKSA-N 439.112 4.854 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@H](Br)[C@@H]2CC[C@H]21 2285962986 KJBUCHVNRRJHQB-DXVIDONBSA-N 425.523 4.630 50 10 IJGE O=C(C=Cc1cccc2ccccc12)NNC(=O)c1ccc(NC(=O)C2CCCCC2)cc1 2293358529 BJIOMWZECOJSQO-UHFFFAOYSA-N 441.531 4.833 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)cc2I)[C@@H]1CBr 2302337362 WWJAEUVSYOYGRM-GFCCVEGCSA-N 428.539 4.550 50 10 IJGE CCN(CC)C[C@@H](Br)CCc1ccc(Cl)cc1I 2318532349 XJLMSWUUSPXFCJ-LBPRGKRZSA-N 444.582 4.983 50 10 IJGE CSCc1ccc(C(=O)NN=C2C(=O)N(Cc3ccccc3Cl)c3ccccc32)cc1 2326843761 CJKSWSUKVZEXDK-UHFFFAOYSA-N 449.963 4.884 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](CC(F)F)C1 2328522778 JRNYLDOTRIJLSY-LSDHHAIUSA-N 427.374 4.620 50 10 IJGE N#CC(=Cc1cc(Br)cc(Br)c1O)c1nc(O)c2ccccc2n1 2331029303 XJBXOQONMZZDLA-UHFFFAOYSA-N 447.086 4.630 50 10 IJGE COCCOc1ccc(C=C(C#N)C(=O)NCC2(c3ccc(Cl)cc3Cl)CC2)cc1 2331117818 OQCQDMURCZPAGS-UHFFFAOYSA-N 445.346 4.774 50 10 IJGE N#CC(=C(O)CCCN1C(=O)c2ccccc2C1=O)c1nc(-c2ccc(F)cc2)cs1 2331343585 DKQJCGJCYMNIRJ-UHFFFAOYSA-N 433.464 4.818 50 10 IJGE C[C@@H]1CCC[C@H](CO[C@@H](CI)c2ccc(Br)cc2)O1 2338705042 JSHATHXYXXUHIB-DFBGVHRSSA-N 439.131 4.899 50 10 IJGE CCOc1ccccc1/C=N/NC(=O)COc1ccc(C(C)(C)C)cc1Br 12403444 POANCQIAJPSWJB-YDZHTSKRSA-N 433.346 4.674 50 10 IJGE N#C/C(=C/c1cn(CCOc2ccccc2Cl)c2ccccc12)C(=O)NC[C@H]1CCCO1 33932571 JVEGPGLMYWFXSW-BKHFDQEPSA-N 449.938 4.576 50 10 IJGE CCCCCOc1ccc(/C=N/NC(=O)COc2ccccc2Br)cc1OC 40910996 IBQTUJUVVFKKDL-OEAKJJBVSA-N 449.345 4.556 50 10 IJGE Cc1ccc(C(=O)N/N=C/c2cc(Br)cc(Br)c2O)cc1Cl 59158282 ISAAFOFFWXZMAQ-FBCYGCLPSA-N 446.526 4.643 50 10 IJGE Cl[C@@H](c1ccccc1)c1nc(-c2ncc(Br)cc2Br)no1 139784729 BKQIPQGZJOXYRV-NSHDSACASA-N 429.499 4.985 50 10 IJGE O=C(N/N=C/c1cc(Cl)c(O)c(Cl)c1)c1ccc2[nH]c(-c3ccccc3O)nc2c1 169926505 SAMIEQYJYBAEHF-YSURURNPSA-N 441.274 4.712 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C\Nc1ccccc1Br)C12CC3CC(CC(C3)C1)C2 217053737 RDVXKXXMKZACSS-ZTNMFLNZSA-N 428.374 4.990 50 10 IJGE N#C/C(=C/NC[C@H]1COc2ccccc2O1)C(=O)NC1CCCCCCCCCCC1 217260097 ZYHBMZODJOQESY-DBJZRZIFSA-N 425.573 4.613 50 10 IJGE O=C(NC[C@H]1CCC[C@@H]1Br)c1cc(Br)cc(Br)c1 232462145 HEUBIBGWOGJFFU-PELKAZGASA-N 439.973 4.505 50 10 IJGE Cc1ccccc1OCC(=O)NN=Cc1c(OC(=O)c2ccccc2)ccc2ccccc12 254899455 XFHMPHDYDASIBC-UHFFFAOYSA-N 438.483 4.897 50 10 IJGE CCn1c2ccccc2c2cc(NC(=O)CC(C)=NNC(=O)c3ccccc3OC)ccc21 254902483 QTEUSWQQPHCJMD-UHFFFAOYSA-N 442.519 4.958 50 10 IJGE CC(=O)[C@H](Br)[C@@H](C)c1cc(Br)ccc1I 300899889 KHASSOBOJBMQOV-UPONEAKYSA-N 445.920 4.510 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CBr)[C@H](c2ccc(Br)cc2F)C1 382701730 OWVVUSAQDFMDSU-GXFFZTMASA-N 437.147 4.934 50 10 IJGE CC[C@H](Br)[C@@H](C)NC(=O)c1cc(Br)sc1Br 386686631 JLNRZDIQCFORCO-VDTYLAMSSA-N 433.991 4.565 50 10 IJGE C[C@H](CCBr)CCNC(=O)c1cc(Br)sc1Br 397772595 QMQHTCSUFFRQFZ-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE CCn1cc([C@H](Br)c2sccc2Br)nc1Br 698483129 UHXVJWNIHYSHBV-QMMMGPOBSA-N 428.975 4.974 50 10 IJGE O=C(NCC1(N(Cc2ccccc2)Cc2ccccc2)COC1)[C@@H](Cl)c1ccccc1 706606364 XGOCOFHZHAGFTC-DEOSSOPVSA-N 434.967 4.554 50 10 IJGE CN(C(=O)c1cc(Br)c(Br)s1)[C@@H]1CCC[C@H]1Br 709100567 AXRKAWNXHCYVIQ-HTRCEHHLSA-N 446.002 4.661 50 10 IJGE Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)NNC(=O)c1cccc2cccnc12 759307828 DSOZYFBZYKMJSL-MRXNPFEDSA-N 445.548 4.714 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])c2ncccc12)C1CCN(c2nc3ccccc3s2)CC1 770136405 QEESRMMMURVZGU-UHFFFAOYSA-N 434.477 4.575 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N[C@H]2CC23CCCCC3)c(-c2ccc(Cl)cc2)n1 770822550 BWMGRHGEIQHVML-UHWDDTASSA-N 433.943 4.863 50 10 IJGE CCOc1ccc(NC(=S)NNC(=O)/C=C(\c2ccc(Cl)cc2)C(F)(F)F)cc1 770953727 CWDXQXUPEUABIR-LFIBNONCSA-N 443.878 4.702 50 10 IJGE O=C(NNC(=O)C(Cc1ccccc1)Cc1ccccc1)c1c(Cl)cccc1Cl 798427379 PGCFHVCOQBMHEM-UHFFFAOYSA-N 427.331 4.856 50 10 IJGE Cc1cc(NNC(=O)CCSCc2nc(O)c3c4c(sc3n2)CCC4)ccc1Cl 1558279225 RUNBXIRHSZJKTK-UHFFFAOYSA-N 449.001 4.614 50 10 IJGE C=C(CBr)CN(Cc1ccccc1)C[C@@H](O)c1cccc(OC(F)F)c1 1654210592 PXROOXBPIQWRGE-LJQANCHMSA-N 426.301 4.775 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)Cn1ccc2ccccc21)c1ccc(C(F)(F)F)cc1 1679304819 KCHNCBLVZFMDOK-LJQANCHMSA-N 444.457 4.698 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2Cl)[C@@H]1c1cccnc1 1865700417 SMSHALPOBSIOFB-OAQYLSRUSA-N 439.906 4.865 50 10 IJGE Cc1ccc(C)c(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)c1 1865708071 NICUYNHKUKGLOJ-SFHVURJKSA-N 442.416 4.924 50 10 IJGE CCCc1nn(-c2ccc(Cl)cc2)c2c1[C@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865712911 LJGCGGUYAFKEJX-LJQANCHMSA-N 435.871 4.605 50 10 IJGE Cc1nc(-c2ccc(F)cc2)ccc1C(=O)NNC(=O)c1ccc(CSC(C)C)o1 1865758127 KWJJAUKGRDXFQX-UHFFFAOYSA-N 427.501 4.506 50 10 IJGE Cc1nn(Cc2ccccc2)c2c1[C@@H](NC(=O)/C(C#N)=C/c1cccc(Cl)c1)CCC2 1866130022 WSXABTDNDSNEEF-IMEWXKHHSA-N 430.939 4.994 50 10 IJGE Brc1cccc(CN2C[C@@H](Br)CC3(CC3)C2)c1Br 1925992310 DPHLVWUOBFPFTM-NSHDSACASA-N 438.001 4.961 50 10 IJGE CC1(C)C[C@H](Br)CN1C(=O)c1cc(Br)sc1Br 1949214330 HYEQGDWCSUBLMJ-LURJTMIESA-N 446.002 4.661 50 10 IJGE Clc1nc(N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)sc1CBr 1949583774 LNGSJDLJSBEDSG-CABCVRRESA-N 426.811 4.650 50 10 IJGE Clc1ccc(-n2cnc(Cl)c2CBr)c(I)c1 1982517099 RXCSDKQNGBPRFS-UHFFFAOYSA-N 431.886 4.679 50 10 IJGE C[C@@]1([C@@H](Br)c2cc(Br)sc2Br)COCCO1 1992639929 YQQAQYIJISOQIY-WPRPVWTQSA-N 434.975 4.515 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Cl)c2)CC[C@H]1Br 2026560694 MCIZPPMRURVCIH-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE CCn1ncc(Br)c1CC(CBr)(CBr)C1CCC1 2033277892 LUEUNJBXVSTVJD-UHFFFAOYSA-N 443.021 4.784 50 10 IJGE N#CC(=C(O)NC(=O)c1ccccc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1 2038540928 FHVBTIIMYYHNOW-UHFFFAOYSA-O 449.470 4.661 50 10 IJGE COc1cc(C(=O)Oc2ccc(C=C(C#N)C(=O)c3ccoc3C)cc2)cc(OC)c1OC 2040480489 RGCZIFXCLLDQQA-UHFFFAOYSA-N 447.443 4.623 50 10 IJGE BrC[C@@H]1[C@H]2CC[C@H](C2)N1Cc1cccc(Br)c1Br 2058372256 BWBSJFBMEZZJTR-UFGOTCBOSA-N 438.001 4.959 50 10 IJGE Oc1nc2cc([C@H](Br)[C@H]3C[C@@H](Br)C3)c(Br)cc2[nH]1 2076182531 SWRYNLQBSYOWIN-LJNABYEQSA-N 438.945 4.641 50 10 IJGE O=C(N[C@H]1C[C@@H](CCBr)C1)c1cc(Br)ccc1Br 2078347974 RDJXERMFLHHCSB-WAAGHKOSSA-N 439.973 4.505 50 10 IJGE CC(=O)[C@@H](Br)[C@H](C)c1ccc(C(F)(F)F)cc1I 2083649904 NHYBMOGTFIJWLF-KBUNVGBDSA-N 435.021 4.766 50 10 IJGE CC[C@@H]1CCOC[C@H]1O[C@H](CI)c1cccc(Br)c1 2096207827 QNGNAVZQOBDORP-KCPJHIHWSA-N 439.131 4.757 50 10 IJGE CC(C)[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1c1ccccc1 2106785803 QXXGPKAXIPKNKV-MOPGFXCFSA-N 425.411 4.948 50 10 IJGE CCC(CC)(CBr)CNS(=O)(=O)c1c(C)sc(C)c1Br 2143912259 DNEHBOZBYNOTFO-UHFFFAOYSA-N 447.258 4.607 50 10 IJGE O=C(NCC[C@H]1CCCC[C@H]1Cl)c1ccc(I)c(Cl)c1 2179638862 RXWZFIXQIKXIQG-ZYHUDNBSSA-N 426.125 4.862 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]12CC[S@](=O)(=NCCCCCCBr)C2 2223291833 WIXPJRXSSXDCAJ-AVRWGWEMSA-N 437.444 4.583 50 10 IJGE CCOCc1cc(Br)c([C@@H](Br)c2cc(Cl)n(C)n2)s1 2224771155 GSDCNAQEDLZISA-NSHDSACASA-N 428.577 4.918 50 10 IJGE C[C@@H]1CCC[C@@H]([C@H](Br)c2cc(I)cc3c2OCC3)O1 2226862863 DZVYWMTVAFEIMJ-BIGNPOOSSA-N 437.115 4.620 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)C1C[C@@H]2CCC[C@H](C1)C2(F)F 2233648959 IYORMYVGIDFYTQ-XVLXNVKGSA-N 444.360 4.887 50 10 IJGE CCCN(C[C@@H](C)Br)C(=O)c1csc(Br)c1Br 2250583587 XQLGAJXFBCZKBT-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE CC1(C)CCCN(C(=O)c2ccc(Cl)c(I)c2)[C@@H]1CCl 2283670468 TYANKUQNYLXWQA-CYBMUJFWSA-N 426.125 4.814 50 10 IJGE CC[C@@]1(C)[C@H](Br)CCN1c1ncc(Br)cc1Br 2299988220 UAOVYLVYUMDXML-PWSUYJOCSA-N 426.978 4.749 50 10 IJGE C[C@H](Cl)[C@H]1CCCN1Cc1ccc(I)c(Br)c1 2306218056 WHYPROUWDJEDNE-TVQRCGJNSA-N 428.539 4.645 50 10 IJGE FC(F)(F)[C@H](Br)COCc1cc(I)ccc1Cl 2307218291 AXOZMDPUBQFJSW-SECBINFHSA-N 443.428 4.787 50 10 IJGE C[C@]1(CBr)C=CCCN1Cc1ccc(Cl)cc1I 2318541468 UAPVXDLVCJHNEL-CQSZACIVSA-N 440.550 4.860 50 10 IJGE CCN(CC)c1ccc(NC=C(C#N)C(=O)N[C@H](C)c2ccc(OC)c(OC)c2)c(C)c1 2320906742 PXUSCKUERGJOLL-GOSISDBHSA-N 436.556 4.555 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(C)cc2)cc([N+](=O)[O-])c1OCc1cccc(C)c1 2323075988 IOYRCJNEVDTOSF-UHFFFAOYSA-N 433.464 4.563 50 10 IJGE Cl[C@H]1CCN(Cc2ccc(I)c(Br)c2)[C@@H]2CC[C@H]12 2325210327 XBDHHWMVJJIKLD-SCDSUCTJSA-N 440.550 4.645 50 10 IJGE CC(C)(C)c1csc(C(C#N)=C(O)c2ccc3c(c2)C(=O)N(Cc2ccccn2)C3=O)n1 2331306313 VYGIFSMHFYAIJE-UHFFFAOYSA-N 444.516 4.582 50 10 IJGE COc1ccc(OC)c(-c2csc(C(C#N)=C(O)Cc3ccc(NC(C)=O)cc3)n2)c1 2331324475 FTWFWHHCZHFKAK-UHFFFAOYSA-N 435.505 4.821 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2COC3(C)CC2C3)cc1I 2337680683 SCOSUPAKLAPCAC-ZISVTKSWSA-N 437.115 4.551 50 10 IJGE C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1 14665998 NYJWMWLPUVBAKJ-MSOLQXFVSA-N 434.536 4.520 50 10 IJGE O=S(=O)(c1c(Cl)cc(Br)cc1Cl)N(CCCl)C1CCCC1 109642715 GFNJFUZXXMWPTP-UHFFFAOYSA-N 435.598 4.928 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1Br)c1cc(C(F)(F)F)ccc1Br 123004639 GRLSEJJDTNWHQF-VXGBXAGGSA-N 429.074 4.904 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@H]1Br)c1ccc(Br)cc1Cl 123839438 FHNLBEXOWJRGEA-HIFRSBDPSA-N 429.539 4.893 50 10 IJGE CCCOc1ccc(/C=N\NC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc1OC 169917843 OHGUYXDLSUGYCT-QRVIBDJDSA-N 426.542 4.625 50 10 IJGE Cc1cc(N/C=C(/C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)ccc1Br 217234735 CLHSFRFULSUJRG-LUAWRHEFSA-N 435.665 4.777 50 10 IJGE O=[N+]([O-])c1ccc(Oc2ccc(I)cc2)cc1CBr 232485192 HAWLEWPLQUIKNH-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE C[C@@H]1CN(S(=O)(=O)c2cc(CCl)c(Cl)cc2Cl)CCN1Cc1ccccc1 396341701 NQYXXSGUYJAFMR-CQSZACIVSA-N 447.815 4.627 50 10 IJGE Clc1ccccc1C(CBr)(CBr)CCO[C@H]1CCOC1 724983981 FFXOBPARRZYLQT-LBPRGKRZSA-N 426.576 4.563 50 10 IJGE O=C(COC(=O)c1ccc(S(F)(F)(F)(F)F)cc1)Nc1ccc2nc(O)[nH]c2c1 759723971 HFBAWFWNKKQGEO-UHFFFAOYSA-N 437.346 4.721 50 10 IJGE O=C(NNc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 784831377 KYUQHWIGJCAMJZ-UHFFFAOYSA-N 445.262 4.650 50 10 IJGE COc1cccc(/C(C)=C/C(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)c1 804211553 PVBQZMYREFTIHF-SDNWHVSQSA-N 428.414 4.718 50 10 IJGE COc1ccc(COC(=O)NN=C2C(=O)N(Cc3ccccc3Cl)c3ccccc32)cc1 1084068529 HYZGDHNFQWXALH-UHFFFAOYSA-N 449.894 4.526 50 10 IJGE CCC(CC)(COCc1ccccc1)C(=O)NNc1nc(-c2ccccn2)nc(C)c1C 1182729308 LQUYGZVHLGYXCD-UHFFFAOYSA-N 433.556 4.622 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C)c1ccccc1OC(F)F 1290210155 BVRKXIIHFLCKDE-FYWRMAATSA-N 439.462 4.560 50 10 IJGE CCc1nn(Cc2ccc(C)cc2)c2c1[C@@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865701670 BFAIAILMDOMLLG-DEOSSOPVSA-N 441.579 4.867 50 10 IJGE CC[C@@H](NC(=O)[C@@H](c1ccc(OC)cc1)C(C)C)C(=O)Nc1ccc(SC#N)cc1 1866980735 RFAYLYKQRSGWGG-NHCUHLMSSA-N 425.554 4.541 50 10 IJGE CC1(C)C[C@@H](Br)CN(c2ncc(Br)cc2Br)C1 1923180427 ONDHSEOZIPVAAL-SECBINFHSA-N 426.978 4.606 50 10 IJGE C[C@H](CCBr)CCN=[S@](C)(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C 2044705060 IJBGHXUOOCKYIS-OKXMYEFYSA-N 441.476 4.835 50 10 IJGE CC1(C)CCCN(c2ncc(I)cc2Br)[C@H]1CCl 2069531603 KJPDNCDUTLIRCH-NSHDSACASA-N 443.554 4.683 50 10 IJGE Cc1cc(-n2nc(CBr)c(Br)c2C(F)(F)F)c(C)cc1O 2079234811 GTNQKPVNNITJKS-UHFFFAOYSA-N 428.046 4.871 50 10 IJGE C[C@@H]1CCN(C[C@H](CBr)c2ccccc2)[C@H](CNC(=O)OC(C)(C)C)C1 2106783319 ZAFIGGFRNDOXRH-NEWSRXKRSA-N 425.411 4.790 50 10 IJGE O=C(c1ccc(I)c(Cl)c1)N1CCC[C@@H](CCCl)CC1 2149744990 XYRKYNUKGKKKRL-NSHDSACASA-N 426.125 4.816 50 10 IJGE O=C(c1ccc(Cl)c(Br)c1)N1CC[C@@H](Br)C(F)(F)CC1 2150020027 XGBUQJKRAWLNQW-LLVKDONJSA-N 431.502 4.737 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2C1[C@H]2CN(Cc3ccccc3)C[C@H]12 2184941042 NXVHVTBJVOQZJE-HOTGVXAUSA-N 445.792 4.586 50 10 IJGE CC1CCC(CNC(=O)c2ccc(CBr)cc2)(NC(=O)OC(C)(C)C)CC1 2201481988 NIVJYPASGNKFAJ-UHFFFAOYSA-N 439.394 4.785 50 10 IJGE Cc1c(Br)csc1[C@H](Br)c1cc(S(C)(=O)=O)cs1 2219004332 CCLSFAUZFKCTDB-SNVBAGLBSA-N 430.208 4.768 50 10 IJGE ClCc1nc2ncccc2n1-c1ccc(Br)cc1I 2231447551 IYCYVADQZRNYNH-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE Cc1nscc1C[C@H](Br)c1cc(I)ccc1F 2246959903 PZETZISTJIEXAB-NSHDSACASA-N 426.092 4.874 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1Cc1c(Br)cccc1Br 2251037208 ANJPRIWNASMRRS-CHWSQXEVSA-N 425.990 4.959 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1cccc(Cl)c1Br 2256123936 SHCUIXKSAAPZOD-GZMMTYOYSA-N 444.538 4.682 50 10 IJGE COC1(CO[C@@](C)(CI)c2ccccc2Br)CCC1 2266246604 CSLHBCYNIKVLHH-AWEZNQCLSA-N 439.131 4.685 50 10 IJGE COc1ccc(C=C(C#N)c2nc(-c3cc4cc([N+](=O)[O-])ccc4oc3=O)cs2)cc1 2297321099 ONSSQLSDPRBTAN-UHFFFAOYSA-N 431.429 4.897 50 10 IJGE Cc1nc(Br)c([C@@H](Br)Cc2cccc(Br)c2)n1C 2315633188 KDLOXNFDPPNGDK-NSHDSACASA-N 436.973 4.932 50 10 IJGE Cc1cccc(N2CCN(C=C(C#N)C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)c1C 2318454975 KCVXHSMRVAPASB-UHFFFAOYSA-N 429.351 4.778 50 10 IJGE CC(C)N1C[C@@H](Br)[C@H](Cc2ccc(Cl)cc2I)C1 2318531150 IHPJNTLHYFUKDT-DGCLKSJQSA-N 442.566 4.591 50 10 IJGE CC(=O)N1CCc2cc(C(C)=NNC(=O)c3ccc(-c4ccc(C)c(C)c4)nc3C)ccc21 2321270315 ZVPJGHSWGDVKQK-UHFFFAOYSA-N 440.547 4.737 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@H]3CN(Cc4ccccc4)C[C@@H]3C2)c1 2340273493 WUFJSNYPYUYFRD-IAGOWNOFSA-N 435.793 4.812 50 10 IJGE C[C@H]1CN(Cc2ccccc2)CCN1c1nc(C(F)(F)F)ccc1CBr 2343781865 NMMGSIOUKBTBLQ-AWEZNQCLSA-N 428.296 4.706 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)[C@@]1(C(=O)O)CCC(C)(C)C[C@@H]1OCc1ccccc1 2378156738 QPUWQBALYRUTLC-WEMPKCCASA-N 438.406 4.711 50 10 IJGE Cc1cc(N2CCCC2)ccc1/C=N/NC(=O)c1cc2cc(Br)ccc2o1 9265651 IMMHBPNPHSELDN-YDZHTSKRSA-N 426.314 4.868 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@@H](C)Oc4ccccc4F)ccc32)cc1 38649233 APOSYHRWVLVFDU-GYCJOSAFSA-N 444.462 4.725 50 10 IJGE C[C@H]1CCc2[nH]c3ccc(C(=O)N/N=C\c4cc(Br)ccc4O)cc3c2C1 169891193 SDBBTLYAJIEIFW-QNEYSMKTSA-N 426.314 4.525 50 10 IJGE COCCO[C@@H]1[C@@H](Br)C[C@H]1Oc1cc(Cl)c(Br)cc1Cl 300481704 YONWPCOBPPNMRT-ZEGGKSINSA-N 448.966 4.702 50 10 IJGE Clc1cccc(CBr)c1N1CC[C@H](N2CCN(Cc3ccccc3)CC2)C1 312712774 TVQRBDBPLWRSFA-FQEVSTJZSA-N 448.836 4.631 50 10 IJGE ClCc1cnc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)c(Br)c1 705844950 KRDYCYLQTHAVJB-BNDYYXHWSA-N 446.820 4.930 50 10 IJGE COc1ccc(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)c2cccnc12 733138081 DDTNHASESUOYGC-XDJHFCHBSA-N 448.486 4.566 50 10 IJGE CCCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@@H](Cc2nccn2C)c2ccccc2)c1C 744350346 SDILZCPRZUJOMU-ZBDCHNAPSA-N 429.568 4.646 50 10 IJGE O=C(NNc1cccc(F)c1F)c1cc(I)c(Cl)cc1Cl 787467456 ZUNUUHBWOKNEDX-UHFFFAOYSA-N 443.018 4.633 50 10 IJGE Cc1ccc([C@@H](NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c2ccccn2)cc1 799633365 ZSPPEGLWVRLSEY-HXUWFJFHSA-N 425.414 4.696 50 10 IJGE C=CCC[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(=O)OCC 1158280885 LXFBMNOYUZJFHM-SLTDHEAWSA-N 439.943 4.669 50 10 IJGE C=Cc1ccccc1NC(=O)NNC(=O)c1ccc(COc2ccc(OCC)cc2)cc1 1219814321 CIVKEBYCXAAGKJ-UHFFFAOYSA-N 431.492 4.774 50 10 IJGE C=CC(=O)Nc1cccc(C(=O)NNc2c(Cl)cc(Br)cc2Cl)c1 1465464355 SMSDHDHKEGGUCT-UHFFFAOYSA-N 429.101 4.637 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2ccc3nc(O)n(C)c3c2)c(C)n1-c1ccc(Cl)cc1 1467381984 AFBWKNXMSNCXIZ-GZTJUZNOSA-N 445.910 4.886 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)Cc3ccc4ccccc4c3)cc2)cc1 1558912864 JQJDQJVVRTYROY-UHFFFAOYSA-N 438.483 4.838 50 10 IJGE Cc1c(C(=O)NCc2ccccc2Cl)oc2c1C(=NNC(=O)Cc1ccccc1)CCC2 1772749112 QITHLELALJDPJC-UHFFFAOYSA-N 449.938 4.571 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccc(F)cc2)cc1 1865686002 PVQJQLDLYWPFGW-KRWDZBQOSA-N 428.389 4.616 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865713142 RSCCHUOUUUMKKJ-FQEVSTJZSA-N 449.898 4.664 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)[C@H](C)Oc1ccc(Cl)cc1 1865755481 AOBQIINEGVGYRO-AWEZNQCLSA-N 444.318 4.592 50 10 IJGE COCCOc1ccc(/C=C(\C#N)C(=O)Nc2nc3cc(Cl)c(OC)cc3s2)cc1 1866215161 FKFDGUFIUWBCJG-NTEUORMPSA-N 443.912 4.529 50 10 IJGE CCC[C@H](NC(=O)CCCC(=O)c1cccs1)C(=O)Nc1ccc(SC#N)cc1 1866794610 WIAQLGBSIXXYPY-KRWDZBQOSA-N 429.567 4.598 50 10 IJGE COc1ccc(OC)c(-c2csc(/C(C#N)=C(\O)Cc3ccc(OC)c(OC)c3)n2)c1 1873920564 IRGGUNYCICJGKV-ZPHPHTNESA-N 438.505 4.880 50 10 IJGE Ic1cccc(CO[C@H]2CCCC[C@@H]2I)c1 1902241700 UTIOICLQYZQIRS-STQMWFEESA-N 442.078 4.554 50 10 IJGE CN(CCN(Cc1ccccc1)CC1(CBr)CCOCC1)Cc1ccccc1 1931960848 FHJHQSPNFXLEDC-UHFFFAOYSA-N 445.445 4.812 50 10 IJGE CC1CC(CBr)(NC(=O)c2cc(Br)c(Br)s2)C1 1999812226 IPRNNJBOYSOSGA-UHFFFAOYSA-N 446.002 4.567 50 10 IJGE Brc1cccc(CN2C[C@@H](Br)C3(CCC3)C2)c1Br 2046462453 PDVGDEQXYUKKLY-GFCCVEGCSA-N 438.001 4.961 50 10 IJGE Brc1cccc(Br)c1CN1C[C@@H](Br)C2(CCC2)C1 2046462712 SALIQUNDRGUBJB-CYBMUJFWSA-N 438.001 4.961 50 10 IJGE Cc1c(F)cc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)C1CCC1 2059314115 HBGCWSTWNNAYPX-UHFFFAOYSA-N 426.351 4.772 50 10 IJGE Brc1ccc(CN2CC[C@H](Br)[C@@H]3CC[C@H]32)c(Br)c1 2069994627 AFDRPZSZPVYKLS-SGMGOOAPSA-N 438.001 4.959 50 10 IJGE C=CCC[C@H](CBr)NC(=O)c1ccc(Br)cc1Br 2075330684 QVNXPMILWKIACG-SNVBAGLBSA-N 439.973 4.671 50 10 IJGE O=[N+]([O-])c1c(CBr)nn(Cc2ccccc2C(F)(F)F)c1C(F)(F)F 2079258098 USYANQBBECIMCZ-UHFFFAOYSA-N 432.118 4.772 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@@H]2C[C@@H](Cl)CC[C@H]21 2087663183 HVZZYQREJPNWBP-KHQFGBGNSA-N 427.589 4.895 50 10 IJGE CC(C)(C)OC(=O)N1CCC(C2CCN(CC3(CBr)CCC3)CC2)CC1 2106953585 AAGJKNYZELIRNS-UHFFFAOYSA-N 429.443 4.911 50 10 IJGE CN(C(=O)c1csc(Br)c1Br)C1(CCl)CCSCC1 2114718994 MJZSHYGFWKISBD-UHFFFAOYSA-N 447.645 4.850 50 10 IJGE O=C(c1ccc(Br)c(Cl)c1)N1CC[C@@H](Br)C(F)(F)CC1 2150018211 HIKJCJCZISSJRP-LLVKDONJSA-N 431.502 4.737 50 10 IJGE CCCN(C(=O)c1ccc(CBr)cc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2162914244 CYQMZHKFPIBQJA-GOSISDBHSA-N 439.394 4.833 50 10 IJGE CCC(CC)(CBr)CN1C[C@H](NC(=O)OC(C)(C)C)CCC12CCOCC2 2193498792 XRIKTVUUTYWZDT-QGZVFWFLSA-N 447.458 4.726 50 10 IJGE CCN(C[C@@](C)(CI)O[C@H]1C[C@H]2CC[C@H]1C2)C(=O)OC(C)(C)C 2212690725 OGTHHNSKLDEBPI-YRBFXIGRSA-N 437.362 4.642 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CCC2(CC1)C[C@@H]2CBr 2264512883 FDCPVYKIYZBWPZ-MRVPVSSYSA-N 427.589 4.801 50 10 IJGE CC[C@H]1[C@H](CBr)CCN1C(=O)c1cc(F)c(Br)cc1Cl 2282978015 HZWBQYOTLUZQSZ-SDBXPKJASA-N 427.539 4.877 50 10 IJGE CC(C)CN(C[C@H](C)Br)S(=O)(=O)c1c(Cl)cccc1Br 2288062975 WZTXPBNTVYAYOR-JTQLQIEISA-N 447.620 4.533 50 10 IJGE C[C@H](CCl)CCCNCc1ccc(I)c(Br)c1 2306220145 UPSBNIXMIAYCRZ-JTQLQIEISA-N 430.555 4.798 50 10 IJGE C[C@@H](Cl)C1CCN(Cc2ccc(I)c(Br)c2)CC1 2325214004 XHCVUAPHKXOOJD-SNVBAGLBSA-N 442.566 4.893 50 10 IJGE CC1(C)[C@@H](CNCc2ccc(I)c(Br)c2)C[C@H]1Cl 2325218122 LNBVTGFISHWDII-ZWNOBZJWSA-N 442.566 4.797 50 10 IJGE CC(C)(C)OC(=O)NC1CCS(=O)(=NC[C@](C)(CBr)C(C)(C)C)CC1 2327112756 MOEHVOVYMDZEPN-WTWXRILOSA-N 439.460 4.589 50 10 IJGE COCCOc1ccc(C=C(C#N)C(=O)Nc2cccc(OCc3ccccc3)c2)cc1 2331122769 ICGOKDQJPWRZKI-UHFFFAOYSA-N 428.488 4.836 50 10 IJGE C[C@@H](C(O)=C(C#N)c1nc(-c2cccc(Cl)c2)cs1)N1C(=O)c2ccccc2C1=O 2331293828 IAGFYIVYSDJBTF-LBPRGKRZSA-N 435.892 4.941 50 10 IJGE CN(Cc1cn(C)nc1Br)c1cc(Cl)c(F)cc1CBr 2362410942 BLHGPQBQHZNWKH-UHFFFAOYSA-N 425.527 4.506 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)[C@@H]1CO[C@@H]2COC[C@@H]21 2365229149 XBDCTFJNMHRVOG-ISDYYCSASA-N 428.523 4.600 50 10 IJGE N#C/C(=C/c1ccc(OCC(=O)Nc2ccc(F)cc2F)cc1)c1nc2ccccc2[nH]1 33549092 WTEJTWJQMWRHJH-WJDWOHSUSA-N 430.414 4.923 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1Cl)c1ccnc(C23CC4CC(CC(C4)C2)C3)c1 35553566 JPNQKPXAXSVDNE-UHFFFAOYSA-N 444.362 4.931 50 10 IJGE CCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccc(Cl)cc3)c(OC)c2)C1=O 38603334 QNUKDFVPTNOIGI-YBFXNURJSA-N 436.895 4.540 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2ccc(OCc3ccc(C)cc3)cc2)cc1 58893705 RIOLBBZLEDMEDM-ZABXAGCJSA-N 446.547 4.937 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)c(Br)cc1OCC#N 59335631 FJQMKUXEWQUDEP-YBEGLDIGSA-N 440.297 4.604 50 10 IJGE O=C(c1ccc(Br)c(C(F)(F)F)c1)N1CC[C@@H](CCBr)C1 125079438 DODPWFXJGQBPLD-SECBINFHSA-N 429.074 4.715 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccccc4)nc3c2)ccc1OC(C)C 169925728 NZVKUWYNHCLBPY-YUMHPJSZSA-N 442.519 4.713 50 10 IJGE COc1cccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4Cl)nc3c2)c1OC 169926648 CULZOTQVGPHXCZ-DHRITJCHSA-N 434.883 4.664 50 10 IJGE Cc1cc(N/C=C(/C#N)C(=O)Nc2ccc(Br)cc2)ccc1Br 216793826 AJIPNNIXYPUVOD-BENRWUELSA-N 435.119 4.978 50 10 IJGE O=C(NC[C@H]1CC[C@H](Br)C1)c1cc(Br)cc(Br)c1 227678409 KCXUKOODNNSTRL-WPRPVWTQSA-N 439.973 4.505 50 10 IJGE CCn1nc(C)c(C=NNC(=O)c2ccc3c(c2)c(C)c(C)n3Cc2ccccc2)c1C 252636110 XEFWFPZSPGGVAZ-UHFFFAOYSA-N 427.552 4.904 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2ccn(Cc3ccc(Cl)cc3Cl)n2)cc1 254761309 OZNUTNIVEIUINC-UHFFFAOYSA-N 444.366 4.848 50 10 IJGE C[C@H]1[C@H](Br)C[C@H]2CC[C@H]1N2c1ncc(Br)cc1Br 686175211 DPFFOHBFKAUJBZ-CKIYVRPFSA-N 438.989 4.747 50 10 IJGE Cn1c(Cl)cnc1CC(CBr)(CBr)c1cccc(Cl)c1 700227183 HTLSMMBWOKAVIU-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE C[C@@H](C[C@@H](C)Br)NC(=O)c1scc(Br)c1Br 705513510 PUWFRTSYXNGITC-RITPCOANSA-N 433.991 4.565 50 10 IJGE Cn1nc(COc2c(Br)cc(Br)cc2CCl)cc1Cl 706166160 IXMXRNSCGUQHLX-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)c1C 736694217 QUHBVPYXAGPAMM-HOTGVXAUSA-N 428.323 4.709 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)N(C)C)cc(Br)c1OCc1ccc(Cl)cc1 1084513414 KJUOOODIDANORM-OVCLIPMQSA-N 449.732 4.685 50 10 IJGE Cc1cnc(O)c(CNC(=O)/C(C#N)=C\c2cc(C)n(-c3cccc4ccccc34)c2C)c1 1538943940 OVWWUXXPZAKMIL-XKZIYDEJSA-N 436.515 4.880 50 10 IJGE N#C/C(=C\c1ccc(F)cc1)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 1587111609 XTIMLBIXGLINJC-LYBHJNIJSA-N 425.507 4.666 50 10 IJGE COc1ccc(C=NNC(=O)CSc2nc(-c3ccc(Cl)cc3)cs2)c(OC)c1 1772755253 XIXUYVIHWDHCTO-UHFFFAOYSA-N 447.969 4.723 50 10 IJGE CCc1nn(Cc2cccc(F)c2)c2c1[C@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 1865684940 BXBBZRUFLSPURQ-SFHVURJKSA-N 426.854 4.644 50 10 IJGE Cc1ccc(-n2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2ccc(F)cc2F)cc1 1865701911 HYQFHUGLOVXIKP-MRXNPFEDSA-N 432.352 4.696 50 10 IJGE CCCOc1ccc(/C=C/C(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3)nc2C)cc1 1865755951 YKYUJQOIYVRIEN-GIDUJCDVSA-N 449.938 4.974 50 10 IJGE Cc1nnc([C@@H](CC(=O)Nc2ccc(SC#N)cc2)c2cccc(Br)c2)o1 1868180923 ATHIENNVLCCOOV-KRWDZBQOSA-N 443.326 4.874 50 10 IJGE CC[C@]1(C)[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C 1887218561 YRADNODIOLYJEW-CKFHNAJUSA-N 435.403 4.700 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)C1CC2(CCCO2)C1 1912574638 QZPWLQIECKSBGB-OFWKBQFLSA-N 449.126 4.621 50 10 IJGE BrC[C@@]1(Cc2c(Br)cccc2Br)CCCOC1 1945330194 JWRSJZRJQVCKED-ZDUSSCGKSA-N 426.974 4.946 50 10 IJGE O=C(c1ccc(OCc2ccccc2)cc1)N1CCC(CI)CC1 1949196644 GAYARWLRRMUMNR-UHFFFAOYSA-N 435.305 4.553 50 10 IJGE Brc1cc2c(cc1[C@@H](Br)C1(Br)CC1)OCCO2 2002807846 WYPADDHGIPQAAC-LLVKDONJSA-N 426.930 4.584 50 10 IJGE C[C@H](Nc1ncc(I)cc1Br)[C@@H]1CCC[C@H]1Cl 2015759070 QEKUSUOABRHZKB-OVYXKVPISA-N 429.527 4.657 50 10 IJGE CCCN1CC[C@H]([C@H](Br)c2cscc2OCc2ccccc2)S1(=O)=O 2038675866 BMAQRCBDIYNFJO-QZTJIDSGSA-N 444.416 4.577 50 10 IJGE CCN(CCCCBr)C(=O)c1cc(Cl)ccc1I 2041183071 APLOMTXHAHECPP-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1cc(Cl)cc(Br)c1 2081235039 AJIJJVVBLBTFPH-PRHODGIISA-N 444.538 4.682 50 10 IJGE CCCN1CC[C@H]([C@H](Br)c2cccc(OCc3ccccc3)c2)S1(=O)=O 2089515991 UQPDUIQEPZUBQY-WOJBJXKFSA-N 438.387 4.516 50 10 IJGE Brc1ccc([C@H](CI)OC[C@@H]2[C@H]3C[C@@H]4[C@H]2[C@@H]4C3)cc1 2134537919 KAVAGYWYUXTZBU-IYOGYMKFSA-N 433.127 4.844 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(CBr)cc2)[C@H](C(C)(C)C)C1 2163051173 QQHJPRRBPNRECJ-KRWDZBQOSA-N 439.394 4.689 50 10 IJGE Cc1cc(C(=O)NC[C@]2(CBr)C[C@@H]2C(F)(F)F)c(Br)s1 2192582195 ACWLKYNREXPJFX-GZMMTYOYSA-N 435.103 4.512 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCC(OCCCCl)CC1 2207518835 GFINHQLKNACGGC-UHFFFAOYSA-N 445.604 4.523 50 10 IJGE COc1ccc(CBr)c(N(C)[C@@H]2C[C@@H]3C[C@@H](OCc4ccccc4)C[C@@H]32)n1 2239875666 BEQCAULSAXHUSB-ZGXWSNOMSA-N 431.374 4.805 50 10 IJGE C=CCC1(CBr)CCN(C[C@@H]2CC2(Br)Br)CC1 2250411891 ZOGQJXHUQWKBFV-NSHDSACASA-N 430.022 4.546 50 10 IJGE CCCN(Cc1cc(Cl)ccc1I)C[C@@H](C)Br 2250505836 WXJBXVJMWPXKGY-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE Fc1cccc(I)c1[C@H](Br)c1ccc2c(c1)CCO2 2267658924 JILFZBJUFLXYTQ-OAHLLOKOSA-N 433.058 4.850 50 10 IJGE COc1ccc([C@@H](Br)C2(OC)CC(CF)C2)cc1I 2269555587 XPQCYTHHTDHUTI-JRZRUSQNSA-N 443.094 4.501 50 10 IJGE CC1=C(C#N)C(=O)N(C)C(=O)C1=Cc1cn(-c2ccccc2)nc1-c1ccc2ccccc2c1 2314617541 BNFOHKFNNHTZIM-UHFFFAOYSA-N 444.494 4.915 50 10 IJGE C[C@H](Br)C1CCN(Cc2ccc(Cl)cc2I)CC1 2318527846 YQPRZFOXJWJTKW-JTQLQIEISA-N 442.566 4.940 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2ccc(-c3ccccc3OC)nc2C)cc1OC 2321251741 RLRJPSAGDSJAJO-UHFFFAOYSA-N 433.508 4.627 50 10 IJGE Cc1cc2c(c(C)c1Cl)C(=O)CC1(CCN(C(=O)C(C#N)=Cc3ccccc3)CC1)O2 2322177580 LOFOWVGPEKUJKI-UHFFFAOYSA-N 434.923 4.890 50 10 IJGE COc1cc(NC=C(C#N)C(=O)N2CCC(Cc3ccccc3)CC2)c(OC)cc1Cl 2324765479 WWPQTRISRRHQEW-UHFFFAOYSA-N 439.943 4.658 50 10 IJGE Cc1ccc(NC=C(C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c(Br)c1 2325255448 NBDVZUZUDKMTCL-UHFFFAOYSA-N 435.665 4.777 50 10 IJGE CN(Cc1cc(I)ccc1Cl)C[C@@H]1CCC[C@H]1Br 2327398476 FCFDIZXLYBBBLY-GXFFZTMASA-N 442.566 4.940 50 10 IJGE Cn1cc(I)c(C[C@]2(CBr)CCCCC23CCC3)n1 2341761016 RRQVLBIFSZXOGB-HNNXBMFYSA-N 437.163 4.693 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3CCCC[C@@]3(NC(=O)OC(C)(C)C)C2)C1 2345004347 JKZVVCRQWXTMAL-HRAATJIYSA-N 429.443 4.957 50 10 IJGE Cc1cc(C(=O)N[C@H](CCBr)COCc2ccccc2)c2ccccc2n1 2369433704 QLLVZKLOIKXXNU-GOSISDBHSA-N 427.342 4.643 50 10 IJGE CC(C)(C)[C@@](C)(CBr)CN1CCC[C@@]2(CN(Cc3ccccc3)CCO2)C1 2380175700 LZXADVYEONFSLJ-XZOQPEGZSA-N 437.466 4.801 50 10 IJGE CC[C@H](Oc1ccccc1[C@@H](C)CC)C(=O)NNC(=O)c1ccc(C)c(Br)c1 10683604 SNRSZNVBEPSPRM-LIRRHRJNSA-N 447.373 4.890 50 10 IJGE COc1cccc(NC(=O)[C@@H](NNC(=O)c2ccc(C(C)(C)C)cc2)c2ccccc2)c1 15474802 GVGFYJRTMCXNNT-QHCPKHFHSA-N 431.536 4.607 50 10 IJGE COc1cc(C(=O)NNC(=O)c2cc(Cl)sc2Cl)ccc1OCCC(C)C 24300095 TZTRBWFRKNJLDH-UHFFFAOYSA-N 431.341 4.563 50 10 IJGE Cc1c(C(=O)NCCc2ccccc2)oc2c1/C(=N/NC(=O)c1cccc(Cl)c1)CCC2 40813322 FOBAZAJJYOUTGN-VFCFBJKWSA-N 449.938 4.684 50 10 IJGE C=CCOc1c(Br)cc(/C=N/NC(=O)c2cc3ccccc3o2)cc1OC 59303689 HCQGXQWMVXZWCP-WSDLNYQXSA-N 429.270 4.533 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2cccnc2)C(=O)/C1=C/c1ccc(-c2ccc(Cl)cc2)o1 101336546 DESDBGWVJBBPID-RGVLZGJSSA-N 429.863 4.787 50 10 IJGE CN(c1ncc(Br)cc1Br)[C@@H]1CCCC[C@@H]1Br 157647583 KVBUUFLXPFGINV-GXSJLCMTSA-N 426.978 4.749 50 10 IJGE Cc1ccc(N/C=C(/C#N)C(=O)Nc2ccc(Br)cc2)c(Br)c1 216793711 QNYYDSXULFBSPP-BENRWUELSA-N 435.119 4.978 50 10 IJGE CC[C@H](Br)[C@H](C)NC(=O)c1cc(Br)sc1Br 386686628 JLNRZDIQCFORCO-FSPLSTOPSA-N 433.991 4.565 50 10 IJGE BrCC1(CN2CCO[C@@H]3CCN(Cc4ccccc4)C[C@H]32)CCCCCC1 404261210 RNBRBQAJRRBTMC-FGZHOGPDSA-N 435.450 4.697 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1 404298896 PETWHVLGBKYHSN-JKSUJKDBSA-N 436.375 4.510 50 10 IJGE CC[C@H](Br)[C@H](CC)NC(=O)c1scc(Br)c1Br 705438840 LSZUGILNOSKDNF-XPUUQOCRSA-N 448.018 4.955 50 10 IJGE CC[C@@H](C[C@H](C)Br)NC(=O)c1ccc(Br)cc1Br 716939263 ODHAULQIRACONX-WPRPVWTQSA-N 441.989 4.894 50 10 IJGE Cc1ccc([N+](=O)[O-])c([C@@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)c1 725405155 HOJNCBDLQGGCPZ-SJLPKXTDSA-N 433.302 4.650 50 10 IJGE Cc1n[nH]cc1C1CCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 803636800 GGVZDPYKFRZDPB-BKUYFWCQSA-N 431.515 4.578 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)ccc1OCc1ccc2c(c1)OCO2 1083911697 FSKHWTOZTIDABI-RGVLZGJSSA-N 442.471 4.857 50 10 IJGE O=C(Cc1ccccc1)Nc1ccc(C(=O)NN=Cc2ccc(Cl)cc2Cl)cc1 1084128569 ULKCTKREMJIWPG-UHFFFAOYSA-N 426.303 4.939 50 10 IJGE COc1ccc(Br)cc1C=NNC(=O)[C@H](C)Sc1ccc(Cl)cc1 1084229174 KEQWXTOXMWQJDZ-NSHDSACASA-N 427.751 4.742 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCN(c4ccccc4)CC3)c2C)c(C)c1 1084283312 NDJHSTZUKWGYCV-XIEYBQDHSA-N 438.575 4.967 50 10 IJGE C=C(C)COc1cccc(NC(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)c1 1668203412 OKCQCAUKUVOUBB-UHFFFAOYSA-N 431.920 4.615 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccn2)[C@@H]1c1cc(Cl)ccc1O 1865689623 UPEAPPLOUGXQOB-HXUWFJFHSA-N 441.878 4.511 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccccc2Cl)cc1 1865694043 OGYZCSMKNWXVSI-QFIPXVFZSA-N 434.927 4.900 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@@H](C(F)(F)CCl)C1 1892719531 HAFKHHFEOVEDDU-ZCFIWIBFSA-N 437.531 4.609 50 10 IJGE C[C@H](Br)C(C)(C)CNC(=O)c1cccc(Br)c1Br 1913831446 DMHUGPVFWBPQIJ-QMMMGPOBSA-N 441.989 4.751 50 10 IJGE O=C(c1cc(Br)ccc1O)N(CCCBr)Cc1ccccc1 1914628064 OHXIKJWADBWOFM-UHFFFAOYSA-N 427.136 4.582 50 10 IJGE O=C(c1nscc1Br)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915265428 OZNBUOCWAXWJAI-CQSZACIVSA-N 444.192 4.722 50 10 IJGE CC(=O)N(CCCC(=O)NN(Cc1ccccc1)Cc1ccccc1)Cc1ccccc1 1923711383 KDDFTEASQJFHGD-UHFFFAOYSA-N 429.564 4.549 50 10 IJGE Cc1nn(-c2ccc(CBr)cc2Cl)c(C)c1I 1945161850 JHIQKXCNBCNZFK-UHFFFAOYSA-N 425.495 4.642 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCc2cc(Br)ccc2C1 1975076816 OAKJXDVACNZIKJ-HIFRSBDPSA-N 433.184 4.842 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1ccc(O)c(Br)c1 1980634365 JXQOCUMMRDEGMN-ZDUSSCGKSA-N 441.163 4.971 50 10 IJGE C[C@H](Br)C[C@@H](C)CNC(=O)c1cccc(Br)c1Br 2031477789 NVUQHAYURJJOLA-BDAKNGLRSA-N 441.989 4.751 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NC(=O)c1c(Br)cccc1Br 2033085720 GGPBETQPBUQHPX-BDAKNGLRSA-N 441.989 4.894 50 10 IJGE CC[C@H](CCCBr)NC(=O)c1cc(Cl)ccc1I 2036513550 KTGSBTULLWMILK-SNVBAGLBSA-N 444.538 4.628 50 10 IJGE Cc1oc(C)c(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)C2CC2)c1CBr 2059265262 SAKXQGGDMPIRBU-ZDUSSCGKSA-N 426.376 4.781 50 10 IJGE COc1cc(CBr)cc(Br)c1OCC1CC(Br)C1 2076261730 MEWHHROPUZWSTE-UHFFFAOYSA-N 442.973 4.905 50 10 IJGE CC(C)c1cccc(-n2nc(CCl)c(I)c2C(F)(F)F)n1 2078880647 FEXUNHKEUKVNGH-UHFFFAOYSA-N 429.611 4.753 50 10 IJGE Cc1cc(F)c(Cl)cc1[C@H](Br)c1cnn(C)c1I 2081923442 BIVNWLGKFURAQR-NSHDSACASA-N 443.485 4.610 50 10 IJGE Brc1cccc([C@H](CI)OC[C@@H]2CCCCCO2)c1 2096322258 NJCJVRHJHUABTH-GJZGRUSLSA-N 439.131 4.901 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1[C@H](CBr)C[C@@H]2CCC[C@H]21 2115940082 LCCKJKDOWAXFIF-OYNCUSHFSA-N 427.589 4.942 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCCN(c2nc(CCl)ccc2Br)C1 2120532467 UYTCAKCWFLIEPS-UHFFFAOYSA-N 444.751 4.931 50 10 IJGE C[C@@H]1C[C@@H](C(F)(F)F)N(C[C@H](CBr)C2CC2)CCN1C(=O)OC(C)(C)C 2121769789 ASSPKMRJQWOOMD-SNPRPXQTSA-N 443.348 4.670 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@@H](Br)c2cc(Br)c(Cl)s2)C1 2137224885 DZZKFFAPCLSRAO-VIRWGQHYSA-N 448.629 4.815 50 10 IJGE Cc1ccc(I)c([C@H](Br)c2ccc3c(c2)CC(=O)N3)c1 2241000323 GXQNQCYMTFGWNA-MRXNPFEDSA-N 442.094 4.579 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1C[C@H]([S@@](C)(=O)=NCCCCCCCBr)C1 2263156748 YGNWPQQZAHFMNY-WHEFHEQHSA-N 439.460 4.733 50 10 IJGE CC(C)(C)OC(=O)NCc1cc(F)ccc1NC(=O)[C@@H](Br)C1CCCC1 2268580747 TVBWRIMVWKWULA-INIZCTEOSA-N 429.330 4.743 50 10 IJGE COc1cc(Cl)c([C@H](Cl)c2cc(I)sn2)c(OC)c1 2277608239 GAUIMGSTSRSNPT-GFCCVEGCSA-N 430.094 4.747 50 10 IJGE Cc1ccc(CBr)cc1NS(=O)(=O)c1sccc1Br 2278722149 FVZRHYJQAASHGO-UHFFFAOYSA-N 425.167 4.515 50 10 IJGE CCc1cc([C@@H](Br)c2ccc(S(C)(=O)=O)cc2)sc1Br 2283058607 MJQKUMKPQVYDBU-ZDUSSCGKSA-N 438.206 4.961 50 10 IJGE CN(C[C@H]1CCC[C@@H]1Br)C(=O)c1cc(Br)c(F)cc1Cl 2285843587 ATMLBSHXPDGAOS-SCZZXKLOSA-N 427.539 4.877 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCC2(CC(Br)C2)C1 2285960740 ZTQMLVJERVCWID-UHFFFAOYSA-N 425.523 4.631 50 10 IJGE CC[C@H](C)N(CCCl)Cc1ccc(I)c(Br)c1 2306232219 RLVCUKSRUJAJFQ-JTQLQIEISA-N 430.555 4.893 50 10 IJGE CCCOc1c(Cl)cc(C=NNC(=O)CSc2nc3ccccc3[nH]2)cc1OCC 2318413852 YHTNKZUPBBRBPN-UHFFFAOYSA-N 446.960 4.646 50 10 IJGE C[C@H]1[C@@H](Br)C[C@@H](C)CN1Cc1ccc(Cl)cc1I 2318545805 MMFBEARLSUFTAA-NRUUGDAUSA-N 442.566 4.938 50 10 IJGE C[C@@H](NC(=O)C(C#N)=CNc1ccccc1Br)C12CC3CC(CC(C3)C1)C2 2324904481 RDVXKXXMKZACSS-XSXQVXRUSA-N 428.374 4.990 50 10 IJGE CC(C)(C)OC(=O)NCc1cccc2c1N(C[C@@]1(CBr)CC1(F)F)CCC2 2379986745 WPMXJLGBNNXPJY-IBGZPJMESA-N 445.348 4.884 50 10 IJGE Cc1ccc(COc2ccc(/C=C(\C#N)C(=O)N3CCN(c4ccccc4)CC3)cc2)cc1 22347403 AMHQPTAKWDHROL-NCELDCMTSA-N 437.543 4.830 50 10 IJGE CCCC[C@H](CC)CO[C@](C)(CI)CNC(=O)OC(C)(C)C 231313508 QCLPPRFTYRYEEO-WMLDXEAASA-N 427.367 4.938 50 10 IJGE CC(=NNC(=O)c1ccco1)c1ccc(NC(=O)[C@H](C)Oc2ccc(C)cc2Cl)cc1 252636491 XIYVPRKDFRPREQ-INIZCTEOSA-N 439.899 4.801 50 10 IJGE O=C(CNc1cccc(C(F)(F)F)c1)NN=C/C(Br)=C/c1ccccc1 254842582 ORIODVFGPXVZSX-RYVLYWNHSA-N 426.236 4.655 50 10 IJGE CSc1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CI)cc1 382700831 YJEHPILNCCOHBA-UKRRQHHQSA-N 433.355 4.794 50 10 IJGE COc1ccc(OC[C@@H](CBr)c2ccccc2)cc1I 712913064 CISPPFHIRABFTI-CYBMUJFWSA-N 447.110 4.857 50 10 IJGE CCOC(=O)c1ccc(OCC(=O)NN=C(C)C(c2ccccc2)c2ccccc2)cc1 1084251877 NYMDUKSSYXSAHP-UHFFFAOYSA-N 430.504 4.566 50 10 IJGE CC(=O)c1cc2c(cc1NC(=O)/C(C#N)=C/c1cc(C)n(-c3ccc(F)cc3)c1C)OCO2 1124454965 MBXAUJLKRKBCHP-GIJQJNRQSA-N 445.450 4.710 50 10 IJGE CC(=O)N(C)c1ccc(CNC(=O)/C(C#N)=C\c2cc(C)n(C3CCCCC3)c2C)cc1 1539472092 LFXAQBLSIDLDAB-HAHDFKILSA-N 432.568 4.816 50 10 IJGE Cc1ccc(Cl)cc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccncc1)CCC2 1772745887 NBMMKTBIHNUMBU-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE CCc1ccc(OCCCC(=O)NNC(=O)c2ccc(-c3ccc(C)cc3)nc2C)cc1 1865758518 DWZLKVKKWGJFLG-UHFFFAOYSA-N 431.536 4.548 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)Cc1ccccc1F 1865758980 BXVVXPACWGVIBE-UHFFFAOYSA-N 432.282 4.507 50 10 IJGE COc1c(Br)cc(Br)cc1/C=C(\C#N)c1ncccc1[N+](=O)[O-] 1872728910 AJSALKKARDWCJB-BJMVGYQFSA-N 439.063 4.588 50 10 IJGE C[C@H]1C[C@H](Br)CCN1Cc1cccc(Br)c1Br 1943881055 NEJLYMLDUOIXGY-GXSJLCMTSA-N 425.990 4.959 50 10 IJGE C[C@H]1C[C@H](CBr)CN1Cc1cc(Br)ccc1Br 2006503207 LKAAKSLPPMKNEB-VHSXEESVSA-N 425.990 4.817 50 10 IJGE CC[C@@H](C)[C@H](CBr)NC(=O)c1ccc(Br)cc1Br 2081239062 NPBOCIFIHFJWON-PELKAZGASA-N 441.989 4.751 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@H](Cl)C(F)(F)CC1 2093614050 NAYSCPPHCJPWLC-ZETCQYMHSA-N 437.531 4.752 50 10 IJGE C[C@H](CCBr)CCN1C[C@H](NC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2106786178 STLZHRWOFRZHEM-NEWSRXKRSA-N 425.411 4.790 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@@H](Br)C(F)(F)CC1 2115928348 HPXFXZBMTLFJFS-MRVPVSSYSA-N 437.531 4.799 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@]1(C)CCN(Cc2ccccc2)C1 2184940012 HIQQILLENKLLFD-OAQYLSRUSA-N 447.808 4.905 50 10 IJGE COc1cc(Br)c([C@@H](Cl)C2CC(Br)C2)c(OC)c1OC 2196891641 UWHCBVJUXGVJPD-TYAJBCFHSA-N 428.548 4.928 50 10 IJGE CO[C@@H]1CC[C@H]1[C@@H](Br)Cc1cc(Br)cc(Br)c1 2252830039 NIDKIDIXPNHEBP-RWMBFGLXSA-N 426.974 4.943 50 10 IJGE COc1ccc([C@@H](Br)[C@]2(C)CCCCO2)cc1I 2257364851 MBRBOBUCGHDPBH-KGLIPLIRSA-N 425.104 4.695 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCCN1CC1(CBr)CC(F)C1 2265638165 JPLGGEVSXMLWJC-MUZJZNNISA-N 433.406 4.754 50 10 IJGE C[C@@H](CCBr)CCNCc1cc(I)ccc1Cl 2307325757 DYOITXCLHFPOEJ-JTQLQIEISA-N 430.555 4.845 50 10 IJGE Clc1ccc(CN2C[C@H]3[C@@H](Br)CC[C@H]3C2)cc1I 2315553882 YHFUGLYPNLPBCG-TUAOUCFPSA-N 440.550 4.550 50 10 IJGE Clc1ccc(C[C@]2(CBr)C[C@@]23CCOC3)c(I)c1 2318528326 DMSZMGKQBKUVAD-ZIAGYGMSSA-N 441.534 4.679 50 10 IJGE CN(Cc1ccc(Cl)cc1I)C[C@H]1CCC[C@@H]1Br 2318529639 SJEXDYKCEBTZEZ-MFKMUULPSA-N 442.566 4.940 50 10 IJGE N#CC(=CN1CCN(c2cccc(Cl)c2)CC1)C(=O)Nc1ccc(Cl)cc1Cl 2324494538 XUDZUPPPVRTYFW-UHFFFAOYSA-N 435.742 4.815 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCN(CC2(CBr)CC2)[C@H](C(F)(F)F)C1 2337587348 JLNJOAQTNHFDTI-KGLIPLIRSA-N 443.348 4.719 50 10 IJGE Cc1c(Br)csc1C(=O)N1CC[C@H](Br)C[C@@H]1C(F)(F)F 2361461921 BNQVMBQJCWSMEA-IONNQARKSA-N 435.103 4.749 50 10 IJGE COc1cc(/C=C(/C#N)c2nnc3n2CCCCC3)ccc1OC(=O)c1ccc(C)cc1 33526166 MYNURCNZRZAWRT-ZHZULCJRSA-N 428.492 4.605 50 10 IJGE Cc1cccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)c1C 38652977 YBHBIFYEIUJFFT-VWLOTQADSA-N 444.462 4.645 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2cc(C)c(Cl)c(C)c2)cc1 40987323 VRUNHSRZFWHZII-CPNJWEJPSA-N 440.927 4.765 50 10 IJGE CN(Cc1csc(Br)c1)S(=O)(=O)c1cc(CCl)ccc1Cl 91271171 UTQWXDNTPKGFBG-UHFFFAOYSA-N 429.188 4.724 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1Br)c1ccc(Br)c(C(F)(F)F)c1 123003799 LTZCKBYRXMMYFO-VXGBXAGGSA-N 429.074 4.904 50 10 IJGE CC[C@@H](Br)c1nc(-c2ncc(Br)cc2Br)no1 139785555 YBLVTYMBCJSTMJ-ZCFIWIBFSA-N 425.906 4.503 50 10 IJGE CC(C)([C@H](Br)c1csc2c(Br)cccc12)S(C)(=O)=O 163387146 ICSOZVVPTNDRKF-GFCCVEGCSA-N 426.195 4.923 50 10 IJGE CC(=NNC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1)c1ccc(Cl)s1 254288359 DSXACJQJAYZSOK-GJZGRUSLSA-N 447.988 4.724 50 10 IJGE CCn1c2ccccc2c2cc(NC(=O)CC(C)=NNC(=O)COc3ccccc3)ccc21 254572005 AJZNSMCMGACEFX-UHFFFAOYSA-N 442.519 4.714 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CI)[C@H](c2ccc(CCl)cc2)C1 382696253 BBLABJHBLXIWAV-GJZGRUSLSA-N 435.733 4.811 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1C(=O)c1cc(Br)c(Br)s1 399471286 MOXIEHQGSQFOFR-RNFRBKRXSA-N 446.002 4.661 50 10 IJGE Cn1c(Cl)cnc1CC(CBr)(CBr)c1ccccc1Cl 700228259 SWRAALCLHYJNLC-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE CC[C@@H](C)NC(=O)[C@@H](c1cccs1)N(C(=O)CCl)c1cccc(C(F)(F)F)c1 725238051 OZMIMVRGCJDLJJ-SJKOYZFVSA-N 432.895 4.995 50 10 IJGE Cc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)c2cc(Br)c[nH]2)cc1 725840529 JDSIPMFZAFWPNR-UHFFFAOYSA-N 448.324 4.702 50 10 IJGE CC(=O)c1ccc(NC(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)cc1Cl 783559932 BDQSRVUMVXYAGN-JYWRCUDFSA-N 425.916 4.686 50 10 IJGE CCCOc1c(Br)cc(C=NNC(=O)c2ccc(OCC)cc2)cc1OCC 1084022854 BGTFGTQRMKJOHE-UHFFFAOYSA-N 449.345 4.799 50 10 IJGE COc1cc(Cl)c(C=NNC(=O)c2ccc(NC(=O)C3CCCCC3)cc2)cc1OC 1084325470 DMXBRALEVUMKNT-UHFFFAOYSA-N 443.931 4.640 50 10 IJGE C/C(=C/c1ccccc1Cl)C(=O)NNC(=O)c1ccc(Br)cc1Cl 1520969909 OFMZUGCUQSIUPK-NTMALXAHSA-N 428.113 4.620 50 10 IJGE Cc1cc(OCc2ccccc2)c(C(=O)NNc2nc(-c3ccccn3)nc(C)c2C)s1 1641289386 LLMUXAZDMWVAFB-UHFFFAOYSA-N 445.548 4.861 50 10 IJGE CCOC(=O)c1c(NC(=O)NN=Cc2ccc(Cl)cc2Cl)sc2c1CCC2 1772752388 CPEIRHJLXNWBNU-UHFFFAOYSA-N 426.325 4.876 50 10 IJGE CCc1cc(Br)cc2c1O[C@@]1(C=C2)CCN(C(=O)/C(C#N)=C/c2ccccc2)C1 1859497768 LLVFKZRFMYOAKW-NNDWLSIRSA-N 449.348 4.995 50 10 IJGE Cc1nn(-c2ccc(Cl)cc2)c2c1[C@H](c1cccc(Br)c1)C(C#N)=C(N)O2 1865683202 AFNQXTPEWSGFCW-GOSISDBHSA-N 441.716 4.815 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@H]1c1ccccc1O 1865707978 LACAUGQTMLTRTM-INIZCTEOSA-N 446.816 4.527 50 10 IJGE CC(C)(NC(=O)[C@H](Cc1ccccn1)c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1866688317 IOHVRQFOWILWKE-JOCHJYFZSA-N 444.560 4.515 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CN(C(=O)OC(C)(C)C)[C@@H]1C(C)(C)C 1881339345 KHJRFKRVDQLGRZ-MCIONIFRSA-N 435.403 4.556 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Cl)CCc1cccc(Cl)c1Br 1905407314 YADJZAXHBJWFNM-GFCCVEGCSA-N 427.125 4.939 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCCC2(CCC2)[C@]12CC[C@@H](CI)O2 1924804163 ZVJMHHSRMMWSMF-DOXZYTNZSA-N 449.373 4.834 50 10 IJGE CCC[C@H](Br)CCNC(=O)c1csc(Br)c1Br 1945189423 QEALJWJTGWMBPD-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE CCCCCC[C@H]1C=C2[C@@]3(C)CC4=C(C(=O)OC4=O)[C@@H]([C@@H]1CCCCCC)[C@@]2(O)OC3=O 2080449537 MOBNKYGKVWHWSM-BQDSQZDASA-N 444.568 4.751 50 10 IJGE C[C@H]1C[C@@H](Br)CCN(Cc2ccc(I)c(Cl)c2)C1 2086652304 OLYMQZPQEKQFLV-JQWIXIFHSA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@@H]2CCN(CC3(CBr)CCCCCC3)C2)C1 2106784356 IBWSKXXKULADAN-QGZVFWFLSA-N 429.443 4.911 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](C(F)(F)F)CCN1CC1(CBr)CCC1 2107584179 MQPOQPMSTKBFCT-KBPBESRZSA-N 443.348 4.719 50 10 IJGE Cc1c(Br)ccc([C@H](Cl)[C@@H]2CCCCS2(=O)=O)c1Br 2138862146 FUQJKFGIPSJPBD-AAEUAGOBSA-N 430.589 4.767 50 10 IJGE BrCCCN(Cc1ccccc1)C[C@H]1CC1(Br)Br 2208936570 AJCDNPYOXGXASU-CYBMUJFWSA-N 440.017 4.780 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC(CCCBr)C1 2216700594 XHYSIFGCOUTDGF-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE CO[C@H]1C[C@@H]([C@@H](Cl)Cc2cc(Br)cc(Br)c2)C[C@H]1OC 2295332506 XSMUUHUUSDRZCL-HPEDKQMDSA-N 426.576 4.802 50 10 IJGE COc1ccc(C=C(C#N)C(=O)NC[C@H]2CCCO2)cc1COc1ccc(C(C)(C)C)cc1 2295672407 VIXRYCONVCDEJH-XMMPIXPASA-N 448.563 4.774 50 10 IJGE CC(C)(C)[C@@H]1[C@H](Br)CCN1Cc1sccc1I 2301073417 IKPNHSVNQZETGH-SKDRFNHKSA-N 428.177 4.737 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@@H]2CCCC3(CC3)C2)CC1 2302706832 LKXHIBBLXUNTOH-OAHLLOKOSA-N 449.373 4.931 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccc(Cl)cc2)cc(Br)c1OC(C)=O 2313631093 KLRHRRWCXYYVRL-UHFFFAOYSA-N 449.688 4.582 50 10 IJGE C[C@@H](CC1CCN(C[C@@]2(CBr)CC2(F)F)CC1)N(C)C(=O)OC(C)(C)C 2351892752 TXNRFEVAXKVJFS-KSSFIOAISA-N 439.385 4.764 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@H]1C[C@@H]2CCC[C@H](C1)C2(F)F 2369432903 IGWVSHRYELABCM-AKHDSKFASA-N 444.360 4.935 50 10 IJGE CN(C)c1ccnc(N(C)[C@H]2CC(C)(C)[C@@H]2OCc2ccccc2)c1CBr 2377476689 GXOMDTLKMWIXQY-VQTJNVASSA-N 432.406 4.863 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)/C(C#N)=C\Nc1cccc(Br)c1 217186209 ABEXBBVZCJVPPE-WSTOHFRZSA-N 428.330 4.853 50 10 IJGE O=C(NC[C@H]1CC[C@H](Br)C1)c1cc(Br)ccc1Br 227672430 SMNWVWINOSMCHL-IUCAKERBSA-N 439.973 4.505 50 10 IJGE Cc1onc(-c2ccccc2)c1C(=O)NN=Cc1ccc(OC(=O)/C=C/c2ccco2)cc1 252620281 MBAVPOCZVRHVMN-HXHPNBQFSA-N 441.443 4.626 50 10 IJGE Cc1ccc(Cn2c(SCC(=O)NN=Cc3ccccc3C)nc3ccccc32)cc1 254872113 GZMPPCJZWXZMJK-UHFFFAOYSA-N 428.561 4.944 50 10 IJGE O=C1Cc2cc([C@@H](Br)c3ccoc3Br)c(Br)cc2N1 306047953 UEGXCUCMAADTPC-LBPRGKRZSA-N 449.924 4.784 50 10 IJGE CC(C)(CBr)CCNC(=O)c1cc(Br)c(Br)s1 385643148 DESWQAYIRDHBJT-UHFFFAOYSA-N 448.018 4.814 50 10 IJGE C[C@@]1(n2c(CCCl)nc3cc(Br)cnc32)CCN(Cc2ccccc2)C1 405999667 YIRNDQVNJKRDGP-HXUWFJFHSA-N 433.781 4.596 50 10 IJGE O=C(NC1(CCCl)CCSCC1)c1cc(Cl)ccc1I 719666934 XWWCKPTZOOLPKJ-UHFFFAOYSA-N 444.165 4.569 50 10 IJGE O=C(NCC1CC1)[C@@H](c1cccs1)N(C(=O)CCl)c1cccc(C(F)(F)F)c1 725240269 UQCSANNORIUPTA-QGZVFWFLSA-N 430.879 4.606 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)O[C@H]2CCc3ccc(F)cc32)c(-c2ccccc2)n1 749061917 AHXLKXBSLBOAKA-FOYGFLCZSA-N 426.451 4.741 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCc2cccc(Br)c2)c1C 768746942 IJOKLXYIZFVHIS-RPJLVFAOSA-N 431.330 4.725 50 10 IJGE CSc1ccccc1[C@H](C)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 799741134 FYLBNGQDIUPSBP-XTFSCAMASA-N 441.560 4.970 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2ccc(NC(=O)c3cccc(C)c3)cc2)c(O)c1 1084458227 MHQHVQQVRUPLQU-UHFFFAOYSA-N 444.535 4.563 50 10 IJGE CC(=O)c1ccc(CCNC(=O)/C(C#N)=C/c2cc(C)n(-c3ccccc3C)c2C)cc1 1137784126 XAXOCEAIQKEJSV-PCLIKHOPSA-N 425.532 4.871 50 10 IJGE C#CCN(CC#C)C(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Cl)c(C(F)(F)F)c2)c1C 1456730903 CHCUWWIHQPUGBK-PDGQHHTCSA-N 443.856 4.768 50 10 IJGE C=CCCC[C@H](C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)c1ccccc1 1566603644 XEIAYOLXWRCYAH-SFHVURJKSA-N 426.460 4.563 50 10 IJGE CCCc1nn(Cc2cccc(F)c2)c2c1[C@H](c1ccc(OCC)cc1)C(C#N)=C(N)O2 1865693362 IZTZXJTWUJDDPO-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3CC)cc1OC 1865697483 ULTNRXRIWSBCGI-QFIPXVFZSA-N 444.535 4.976 50 10 IJGE O=S(=O)(c1ccc(Br)s1)N(Cc1ccccc1)[C@H](CCl)C1CC1 1915212843 YXOKKNYBAQMIOY-CQSZACIVSA-N 434.808 4.719 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@@]2(CCC[C@@H]2Cl)C1 1918905949 ASXYVEGIXSLQAR-ZANVPECISA-N 427.589 4.897 50 10 IJGE C[C@H]1C[C@H](C)CC[C@@H]1O[C@](C)(CI)CNC(=O)OC(C)(C)C 1932262665 XHINTQMTUNXDMU-XJIUQZFPSA-N 425.351 4.546 50 10 IJGE CN(Cc1ccc(Br)cc1Br)CC(F)(F)CBr 1945723556 AIOITLZYPPKXOP-UHFFFAOYSA-N 435.932 4.674 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Cl)c(Cl)nc(C[C@@H](O)CBr)c1Cl 1952709978 RWPZDHZUCQKYJH-ZCFIWIBFSA-N 434.545 4.687 50 10 IJGE Fc1cc(Br)cc(N2CC(OCc3ccccc3)C2)c1CBr 1961320514 HCTAVQWUURJWLU-UHFFFAOYSA-N 429.127 4.889 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCC[C@H](CI)O2)[C@H]2CCCC[C@@H]21 1984438289 BKAJCQLHBOTHIY-LDDOYCOJSA-N 435.346 4.539 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@H]1Cc1cccc(Br)c1Br 2007137380 OUOSSSZXPWVNOO-CKYFFXLPSA-N 426.974 4.943 50 10 IJGE COc1cc(Br)c([C@H](Br)[C@H]2C[C@@H]2Br)cc1OC 2020149622 GGRDCVKGNKEMLM-DCUMQYTISA-N 428.946 4.686 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OCc2ccc(F)cc2)C1 2024643741 MAUIUTQCNIMTAW-GOSISDBHSA-N 449.304 4.547 50 10 IJGE Cn1cc(Br)c(C[C@@H](CBr)c2ccc(Br)cc2)n1 2027112335 SPSURYOMVRYFHR-JTQLQIEISA-N 436.973 4.666 50 10 IJGE CC(C)(C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)cc(F)c1F 2059312372 KIZJRNGVILMFSD-UHFFFAOYSA-N 432.330 4.849 50 10 IJGE CC(C)[C@H]1[C@H](Br)CCN1Cc1cc(Cl)ccc1I 2062184841 WQCBHMWTGUSQBC-OCCSQVGLSA-N 442.566 4.938 50 10 IJGE CC[C@H](Cl)[C@H]1CCCCN1c1ncc(I)cc1Br 2069530440 XDJJMJVVMUTLKO-NWDGAFQWSA-N 443.554 4.825 50 10 IJGE Clc1ccc(I)c(CN2CC[C@@H](CBr)C23CC3)c1 2070147440 TTXAWUJYTUDHNG-NSHDSACASA-N 440.550 4.694 50 10 IJGE Clc1cc(CN2[C@H]3CC[C@H]2[C@@H](CBr)C3)ccc1I 2086660544 FUPATEVZXUMENC-SUNKGSAMSA-N 440.550 4.692 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1[C@H]2CC[C@H]1CC(CBr)C2 2115945718 RAFBUFSHBZNMJZ-IUCAKERBSA-N 427.589 4.942 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@@H]1CCCCN1C[C@H](CBr)CC1CC1 2128727780 ZDMFFFOIEASYIU-HOTGVXAUSA-N 439.385 4.812 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(C[C@@H](CBr)c2ccccc2)C(C)(C)C1 2132466688 HGZHMSOODNQJJC-FUHWJXTLSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CC[C@H]1CN(CC1(CBr)CCCCCC1)C2 2136690958 FTHDTAXNCUEGDP-UWJYYQICSA-N 429.443 4.959 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Br)c2c(F)cc(Br)cc2F)c1 2149489232 CMQBXCXWYAYYTJ-GFCCVEGCSA-N 446.132 4.677 50 10 IJGE CC[C@@H](CCCCl)NS(=O)(=O)c1cc(Br)c(C)cc1Br 2154035065 FSQMUHOOJIMQQR-JTQLQIEISA-N 447.620 4.596 50 10 IJGE Cc1nn(Cc2ccccc2)c(C)c1Cn1c(CCl)nc2cc(Br)cnc21 2187791075 ASLQEMUEYOFXDM-UHFFFAOYSA-N 444.764 4.843 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@H]1C[C@@H](C(C)(C)C)CN(C(=O)OC(C)(C)C)C1 2196908347 XFGRECCYHAZLPH-NXOAAHMSSA-N 445.442 4.538 50 10 IJGE COc1ccc([C@@H](Br)c2cc(I)sn2)c(C)c1C 2256994231 AREXSBGGJYJGNT-CYBMUJFWSA-N 438.128 4.857 50 10 IJGE CC[C@@]1([C@H](Br)c2ccc(OC)c(I)c2)CCCO1 2257353226 CEZRFJVGXFBAFZ-KGLIPLIRSA-N 425.104 4.695 50 10 IJGE CC1CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)CC[C@@H]2C(F)(F)F)C1 2265304825 UVJSMSPFOSRNCR-XOYHFGRZSA-N 443.348 4.671 50 10 IJGE COc1ccc([C@H](Br)Cc2ccccc2I)c(OC)c1 2287081980 IEBRTYZQZNJFOS-CQSZACIVSA-N 447.110 4.987 50 10 IJGE N#CC(=Cc1ccc(OC(=O)CN2C(=O)c3ccccc3C2=O)cc1)c1ccc(Cl)cc1 2320506132 CGCCNFUXJKKQKD-UHFFFAOYSA-N 442.858 4.606 50 10 IJGE CCCOc1c(OC)cc(C=NNC(=O)c2nc(-c3ccccc3)sc2C)cc1OC 2323746175 WRMHONLXKZOEHV-UHFFFAOYSA-N 439.537 4.688 50 10 IJGE FC(F)(F)[C@@H]1C[C@@H](Br)CCN1Cc1ccc(I)cc1 2336292823 XJNLLHCLDRZBNW-JQWIXIFHSA-N 448.064 4.581 50 10 IJGE CN(Cc1cc(I)ccc1Cl)[C@@H](CCCl)C(F)(F)F 2352414366 SRQCYKYOCAAJPH-NSHDSACASA-N 426.047 4.936 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@](C)(F)[C@](C)(Br)C2)c1 2365819765 SDUOLLNLNJQELG-KGLIPLIRSA-N 429.555 4.945 50 10 IJGE CN(C)c1ccnc(N2CCN(Cc3ccccc3)CCC2(C)C)c1CBr 2377461114 UULRQSQMEORHQF-UHFFFAOYSA-N 431.422 4.533 50 10 IJGE CCOc1cc(/C=C(/C#N)S(=O)(=O)c2ccccc2)ccc1OC(=O)C1CCCCC1 33389118 YLOLXWHFQLREBJ-QNGOZBTKSA-N 439.533 4.909 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2ncc(Cc3ccc(Cl)cc3)s2)ccc1O 35352062 QUVVZMVXALPESA-NVNXTCNLSA-N 425.897 4.647 50 10 IJGE Cc1c(C(=O)N(C)c2ccccc2)oc2c1/C(=N/NC(=O)c1ccc(Cl)cc1)CCC2 40811661 UWNTWIDNURYSEP-LGUFXXKBSA-N 435.911 4.988 50 10 IJGE CCOc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccoc1C)CCC2 40823381 PMFIZWKPSMRXFL-NLRVBDNBSA-N 435.480 4.611 50 10 IJGE COCCCC(CBr)(CBr)c1cccc(Br)c1 118671931 IWWWSLAYXDWMHN-UHFFFAOYSA-N 428.990 4.903 50 10 IJGE Cc1ccc(OCCCC(=O)Oc2ccc(/C=C(/C#N)C(=O)NCc3ccco3)cc2)cc1 206739947 VMUNLEHQVUCSGY-PGMHBOJBSA-N 444.487 4.576 50 10 IJGE C[C@H]1C[C@H](O[C@@H](CI)c2ccc(Br)cc2)C[C@@H](C)O1 253115292 FNYCRCULNQUCNT-JLUCKKNBSA-N 439.131 4.898 50 10 IJGE CC(CC(=O)Nc1cc([N+](=O)[O-])ccc1C)=NNC(=O)Cc1ccc(-c2ccccc2)cc1 254738471 DDOUUOKAWNDQDD-UHFFFAOYSA-N 444.491 4.634 50 10 IJGE C[C@@H]1C[C@H](Br)CN(Cc2cc(Cl)ccc2I)C1 405309623 SJWAOCBWKZFLHG-KOLCDFICSA-N 428.539 4.550 50 10 IJGE O=C(NNc1nc(-c2cccnc2)no1)/C(=C\c1ccc(Cl)cc1)c1ccc(F)cc1 732110822 PCFMGWXIGFIDGQ-UNOMPAQXSA-N 435.846 4.608 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2CCC(Cc3ccccc3)CC2)c(-c2ccccc2)n1 914456423 HKTBSWPTIGEHKQ-PLRJNAJWSA-N 449.558 4.852 50 10 IJGE O=C(NN=C(CSc1nc2ccccc2s1)c1ccc([N+](=O)[O-])cc1)c1cccnc1 1084040809 IQJKUKVBSKKHBI-UHFFFAOYSA-N 449.517 4.526 50 10 IJGE C#C[C@H]1CCCCN1C(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Br)cc2)c1C 1134915944 QQHJBIHASHIUMU-CURYZJDOSA-N 436.353 4.778 50 10 IJGE C=CCn1nc(C)c(-c2cc(C(=O)NNc3ccc(Cl)c(C(F)(F)F)c3)n[nH]2)c1C 1644571935 DJJKFBZKXSUYIP-UHFFFAOYSA-N 438.841 4.505 50 10 IJGE COCCOC(=O)CCc1cc2c(C)cc(=O)oc2cc1OCc1ccc(CCl)cc1 1871436999 VVPGOTJDIQUBAL-UHFFFAOYSA-N 444.911 4.541 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)C(=O)Cc1ccccc1I 1915082240 JBGTVRFTMVVYSL-KRWDZBQOSA-N 441.740 4.880 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@H]2CCCC23CC3)C1 1986119053 PFMXMISCEUFGJP-KBXCAEBGSA-N 435.346 4.540 50 10 IJGE Cc1sc(Br)c([C@@H](Cl)c2cnn(C)c2I)c1C 2024020948 PIGOHZDPUKXMSM-VIFPVBQESA-N 445.551 4.794 50 10 IJGE BrCC12CCC(CC1)N(c1ncc(Br)cc1Br)C2 2058526659 FLISFCJQGUFTLZ-UHFFFAOYSA-N 438.989 4.751 50 10 IJGE CC(C)(C)CCn1nc(CBr)c(I)c1C(F)(F)F 2079261088 WKQSRRRISSZEHI-UHFFFAOYSA-N 439.057 4.838 50 10 IJGE CCCC1(NC(=O)[C@H](Br)C2CCCC2)CCN(C(=O)OC(C)(C)C)CC1 2110715011 JHKUAGROGCAZOZ-MRXNPFEDSA-N 431.415 4.626 50 10 IJGE O=C(NC[C@@]12CCC[C@@]1(CCl)C2)c1cc(Br)sc1Br 2142941676 XKAYSWDOUZHAGE-STQMWFEESA-N 427.589 4.802 50 10 IJGE Cc1sc(C)c(S(=O)(=O)NCC(C)(C)C[C@@H](C)Br)c1Br 2143910388 KOKUFKTYARODDM-MRVPVSSYSA-N 447.258 4.605 50 10 IJGE CC[C@H](Cl)CN(CC)S(=O)(=O)c1cc(Br)c(C)cc1Br 2162888378 FBUBFMBWYQZMKS-JTQLQIEISA-N 447.620 4.548 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@@H](CCBr)C(F)(F)F)cc1Br 2167385555 OZDLZLNNIKWNGW-JTQLQIEISA-N 437.481 4.857 50 10 IJGE FC(F)(F)C(F)(F)CCCO[C@@H](CCl)[C@H](I)CCl 2223707397 MKQGGCCZWSDLFN-RQJHMYQMSA-N 428.994 4.631 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Br)c1cnc(Cl)n1C 2264356379 LSYCXGUFJMYURS-SNVBAGLBSA-N 428.939 4.982 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@H](Br)C(F)(F)CC1 2264505592 AAQOOIQYQJUOGT-ZETCQYMHSA-N 437.531 4.799 50 10 IJGE O=C(c1ccc(Cl)c(I)c1)N(CCCl)Cc1ccsc1 2283665561 WJLJJRCXYUNGNV-UHFFFAOYSA-N 440.133 4.887 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H](Br)C1)c1cc(Br)c(F)cc1Cl 2285956926 CCXNOLSZAGDMEU-RKDXNWHRSA-N 427.539 4.925 50 10 IJGE CCOC(=O)c1c(-c2ccc(OC)cc2)csc1NC(=O)C(C#N)=Cc1ccccc1O 2296500440 PVKFAEKANQYCRN-UHFFFAOYSA-N 448.500 4.852 50 10 IJGE CC[C@H](NC(=O)C(C#N)=CNc1ccc(Br)cn1)c1ccc2c(c1)CCCC2 2318468209 KKZFYLUFYNAVGX-FQEVSTJZSA-N 439.357 4.810 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2cccn(Cc3ccc(C(C)(C)C)cc3)c2=O)cc1 2323662154 BLVOGVSEXVZBGL-UHFFFAOYSA-N 445.563 4.747 50 10 IJGE COc1ccc(CCNC=C(C#N)C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1OC 2325129764 VHVXGGSTASZWLN-UHFFFAOYSA-N 443.503 4.674 50 10 IJGE BrC[C@H]1C[C@@H]2CCCC[C@@H]2N1Cc1ccc(I)cc1 2333964841 KNASCRFVGUYHQI-IMJJTQAJSA-N 434.159 4.819 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Cl)c1c(F)c(F)cc(F)c1F 2364226737 PSLXQVJPLUKMEJ-ZETCQYMHSA-N 436.428 4.830 50 10 IJGE C[C@H]1CCC[C@](CCl)(NC(=O)c2ccc(Cl)cc2I)C1 2365587072 SRQPXCXPIAIGBG-BONVTDFDSA-N 426.125 4.862 50 10 IJGE N#C/C(=C/c1cn(CCOc2ccccc2Cl)c2ccccc12)C(=O)NC[C@@H]1CCCO1 33932570 JVEGPGLMYWFXSW-BXWQOUMASA-N 449.938 4.576 50 10 IJGE Cc1ccc2c(c1)/C(=N\NC(=O)COc1ccc(Cl)cc1Cl)C(=O)N2CCC(C)C 33959335 XLHONZJHRNTYOX-YYADALCUSA-N 448.350 4.594 50 10 IJGE CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccc(F)cc3)ccc21 38650447 AGABIIDEGFWGFE-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE CCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2F)c1 38652180 AXQHEJWFAPUUCB-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE CCOc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccc1F)CCC2 40812318 AYLRBWRARWGNAS-TURZUDJPSA-N 449.482 4.849 50 10 IJGE [C-]#[N+][C@H](c1cc(Br)ccc1Br)S(=O)(=O)c1ccc(C)cc1 138944877 FFMQACPADAVUQK-HNNXBMFYSA-N 429.133 4.912 50 10 IJGE CC[C@](C)(CBr)NC(=O)c1cc(Br)ccc1Br 161224129 ZUIFRHWASCKUHM-GFCCVEGCSA-N 427.962 4.505 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C\NCc1ccc(Br)cc1)C12CC3CC(CC(C3)C1)C2 217059048 CAXDGWFZAZIKJR-JNDLRXIJSA-N 442.401 4.667 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)cc1 254699043 GONUBVJEXQSOLD-UHFFFAOYSA-N 426.520 4.601 50 10 IJGE O=C(NC[C@@H]1CCC[C@H](CCl)C1)c1ccc(I)c(Cl)c1 312858106 YZQBOTHKQQTUKJ-WDEREUQCSA-N 426.125 4.720 50 10 IJGE CC1(C)C[C@H](Cl)CCN(C(=O)c2cc(Cl)ccc2I)C1 395367000 ZUGYVQNTQICAOX-LLVKDONJSA-N 426.125 4.814 50 10 IJGE O=C(CBr)c1ccc(Br)c(OC(F)F)c1OC(F)(F)F 575681434 ZMXCQZYBRBDBDC-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE FC(F)(F)c1cc(CBr)c(Br)cc1I 575693756 AFHVKKAUYNIKOD-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE O=C(NNc1c(Cl)cccc1Cl)c1cc(O)nc2ccc(Br)cc12 763614865 IXZUYBZERJQMRF-UHFFFAOYSA-N 427.085 4.767 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H]3CCCC(F)(F)C3)c3ccccc3n2)cc1 769184369 LLMZIMOEMWAWCC-QGZVFWFLSA-N 438.478 4.732 50 10 IJGE COc1ccc(NNC(=O)c2cc(-c3ccccc3)nc3cc(Br)ccc23)nc1 781517115 UOHBDDFGVDCNHK-UHFFFAOYSA-N 449.308 4.825 50 10 IJGE CC(C)c1nnc2n1CCN(S(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1)[C@@H]2C 784043046 PRHBSEQUIRKZHH-LLVKDONJSA-N 446.467 4.824 50 10 IJGE CC(C)Oc1ccc(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cc1 918595866 DCSQXZYNKUDDNJ-HKWRFOASSA-N 425.492 4.797 50 10 IJGE C/C=N/NC(=O)CC[C@H](C)[C@@H]1CC[C@@H]2[C@H]3[C@H](O)C[C@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@@]12C 1085895346 JACKUUJOKIRMRC-QNYRQMTRSA-N 432.649 4.515 50 10 IJGE C#CC[C@H](NC(=O)NNC(=O)c1cc(-c2ccc(C)cc2)nc2ccccc12)c1ccccc1 1230565182 FSALWNQBINMGIP-DEOSSOPVSA-N 448.526 4.919 50 10 IJGE C=CCCC[C@@H](NC(=O)NNC(=O)Nc1cc(Cl)c(OC)cc1OC)c1ccccc1 1684894164 NHBDFRSJTSKUGK-QGZVFWFLSA-N 446.935 4.791 50 10 IJGE CCCCCOc1ccc(C=NNC(=O)CSc2nc3ccccc3o2)cc1OC 1772760346 DXYDAQZCXVFAKX-UHFFFAOYSA-N 427.526 4.648 50 10 IJGE CC(=O)[C@@H](Br)c1ccc(SC(F)(F)F)cc1I 1848425808 AYHXGDLWODPENM-SECBINFHSA-N 439.034 4.928 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)[C@H](C)Oc3ccc(C(C)C)cc3)c(C)n2)cc1 1865758655 LFTRUDUZTJQWCJ-IBGZPJMESA-N 431.536 4.717 50 10 IJGE CN(C(=O)c1scc(Br)c1Br)C1(CBr)CCC1 1914975702 CCPTZVUTTKQSDE-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE Cc1ccnc(C(=O)N(Cc2ccccc2)[C@@H](C)CCBr)c1Br 1927120612 DAPPMQAVEJLSOT-AWEZNQCLSA-N 440.179 4.968 50 10 IJGE Brc1cc([C@H](Br)[C@@H]2[C@@H]3CCOC[C@H]32)sc1Br 1937556819 AKHMXLFZNNIWPR-QLSQZMLOSA-N 430.987 4.992 50 10 IJGE BrC[C@@H]1CCCN(Cc2c(Br)cccc2Br)C1 1945332418 CEPPKZFUNGGBNS-JTQLQIEISA-N 425.990 4.819 50 10 IJGE C[C@]1(CI)CCC2(O1)[C@H]1CCC[C@H]2CN(Cc2ccccc2)C1 1979910727 UFKVKZOIONOSEC-GBESFXJTSA-N 425.354 4.661 50 10 IJGE Cc1cccc(NC(=O)C(C#N)=C2SCC(=O)N2c2ccccc2C(F)(F)F)c1C 2042449096 PRAMFXXIJGBPEJ-UHFFFAOYSA-N 431.439 4.776 50 10 IJGE O=S1(=O)CCC[C@@H]([C@@H](Br)c2cc(Cl)c(Br)cc2F)C1 2089859816 FJZAWZQZFSIFEE-JMCQJSRRSA-N 434.552 4.502 50 10 IJGE CC(C)(C)[C@H]1C[C@H](CBr)CN(C(=O)NCCCOCc2ccccc2)C1 2116471414 VBEWFQSBJRLXMS-MOPGFXCFSA-N 425.411 4.682 50 10 IJGE O=C(NC[C@]12CCC[C@]1(CCl)C2)c1cc(Br)sc1Br 2142941673 XKAYSWDOUZHAGE-CHWSQXEVSA-N 427.589 4.802 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]2CC[C@H](C1)N2C[C@H](CBr)c1ccccc1 2163058844 OCYAALMBQCSBHF-FRYIKTPZSA-N 437.422 4.933 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(c2ccccc2)CCN(C[C@H](CBr)CC2CC2)C1 2169167153 UQJZLNFMWKDYJN-PGRDOPGGSA-N 437.422 4.924 50 10 IJGE CN(CCCCCI)C1CCC(N(C)C(=O)OC(C)(C)C)CC1 2211187914 WULIQDWSZASGGZ-UHFFFAOYSA-N 438.394 4.702 50 10 IJGE O=C(NC1(CBr)CC2(CCC2)C1)c1scc(Br)c1Cl 2264515457 QRYFJVGUJJJKLQ-UHFFFAOYSA-N 427.589 4.992 50 10 IJGE CC(C)(C)OC(=O)NC1(C2CCN(CC3(CBr)CC(F)C3)CC2)CCC1 2265632658 OWVURZVXQZEQNY-UHFFFAOYSA-N 433.406 4.659 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCC[C@@H](CCBr)C1 2282973059 XSTCPXGBXKIBRE-VIFPVBQESA-N 427.539 4.879 50 10 IJGE Clc1ccc(CN2CCCC[C@@H]2CBr)cc1I 2300238312 JLILDMXHMYSMPL-LLVKDONJSA-N 428.539 4.694 50 10 IJGE C[C@@H](Br)CCCN(C)C(=O)c1c(Br)cccc1Br 2314577493 WELQIKPNCWGJEE-SECBINFHSA-N 441.989 4.847 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Br)[C@H]1COCCO1 2317395528 JGSNJZXITGNGSJ-SCZZXKLOSA-N 446.936 4.511 50 10 IJGE C[C@H](NC(=O)C(C#N)=CNc1ccc(Br)cc1)C12CC3CC(CC(C3)C1)C2 2324895275 QQWDLEVBDRKKOI-HIGJEIRPSA-N 428.374 4.990 50 10 IJGE Cc1ccc(C)c(-c2csc(C(C#N)=C(O)c3ccc(NS(C)(=O)=O)cc3)n2)c1 2331319562 JSEOSVIPSANOII-UHFFFAOYSA-N 425.535 4.748 50 10 IJGE O=C(Cc1ccc2ccccc2c1)N[C@@H](CCBr)COCc1ccccc1 2369433211 LIVXXICHIMBTRQ-QFIPXVFZSA-N 426.354 4.869 50 10 IJGE O=C(N/N=C/c1cc([N+](=O)[O-])ccc1Cl)c1ccc(NC(=O)C2CCCCC2)cc1 12487525 LJMIRSNSFFILSW-YDZHTSKRSA-N 428.876 4.531 50 10 IJGE Cc1ccc2c(Nc3ncnc(NNC(=O)c4cccc5ccccc45)c3N)cccc2n1 40793389 DKJDNDITWVKZNN-UHFFFAOYSA-N 435.491 4.569 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2cccc(Cl)c2)cc1 98084259 AOMVWQVUZBDLRG-INIZCTEOSA-N 446.816 4.771 50 10 IJGE Cc1cscc1Cn1c(CCCl)nc2cc(I)c(F)cc21 122667169 YPLAMQUSHZDELQ-UHFFFAOYSA-N 434.705 4.980 50 10 IJGE C[C@@H]1CCc2[nH]c3ccc(C(=O)N/N=C\c4cc(Cl)c(O)c(Cl)c4O)cc3c2C1 169891417 CMQYGSXFDYTBLE-LRAQNNFBSA-N 432.307 4.775 50 10 IJGE Cc1ccc(-n2c(C)cc(C=NNC(=O)C(=O)Nc3cccc4ccccc34)c2C)c(C)c1 254751912 IDLMSUVSDOHMSB-UHFFFAOYSA-N 438.531 4.953 50 10 IJGE CN([C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(CCl)c(Cl)cc1Cl 381225071 WYOBNJHAVHLELB-INIZCTEOSA-N 447.815 4.627 50 10 IJGE Cc1c(CCl)cc(Cl)cc1S(=O)(=O)N1CC[C@@H](COCc2ccccc2)C1 383695066 BINLPJFNPQZICU-QGZVFWFLSA-N 428.381 4.615 50 10 IJGE CC[C@H](COc1c(Br)cc(CBr)cc1Br)OC 397068431 KHUXFHSLOOKMJV-SECBINFHSA-N 430.962 4.910 50 10 IJGE CC1(C)OC[C@H](Cc2cc(Cl)ccc2I)[C@@H]1Br 405540281 RMYOJPTYBICSLN-CABZTGNLSA-N 429.523 4.676 50 10 IJGE Cc1cc(Br)c(C(=O)N2CCS[C@@H](CCBr)C2)cc1Cl 720060203 HVZQMHHQDRBRHZ-JTQLQIEISA-N 441.616 4.754 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCc2ccc(-c3ccccc3F)o2)c1C 736693435 GUCXDTZXELXEFY-UHFFFAOYSA-N 431.471 4.630 50 10 IJGE COc1ccc([C@@H](CNC(=O)NNc2cccc(F)c2F)c2c[nH]c3ccccc23)cc1 745270463 CHHBVDCEYXQXJT-GOSISDBHSA-N 436.462 4.913 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)Nc2ccc3c(c2)C(=O)CCC3)c(-c2ccccc2)n1 750086393 COVPDHFRNNNONE-XSFVSMFZSA-N 435.487 4.528 50 10 IJGE N#Cc1cccc(NNC(=O)C(=O)Nc2ccc(-c3nc4cccc(Cl)c4s3)cc2)c1 773689082 MVQICOOOWWBKFH-UHFFFAOYSA-N 447.907 4.570 50 10 IJGE C=CCc1cc(C=NNC(=O)c2cc3ccccc3o2)cc(Br)c1OCC#N 1084274829 LKHNKDCDUOFGSA-UHFFFAOYSA-N 438.281 4.590 50 10 IJGE C[C@H](NC(=O)C(=O)NN=Cc1ccc(-c2ccc(Cl)c(Cl)c2)o1)c1ccccc1 1084334493 OJCFUTGOXGMDTO-ZDUSSCGKSA-N 430.291 4.581 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1 1138915040 KHNHVEOWKYFDKG-MDZDMXLPSA-N 430.238 4.851 50 10 IJGE C=CCCC[C@@H](C(=O)NNC(=S)Nc1cccc(Br)c1)c1ccccc1 1440682641 JCZGIEYIARFRNJ-GOSISDBHSA-N 432.387 4.907 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1ccnc(Oc2ccc(F)cc2F)c1 1557584238 NPXVMCUCYUAZPM-UHFFFAOYSA-N 425.420 4.515 50 10 IJGE COc1ccc(C(=O)NCc2ccc(OC(=O)Nc3ccc(SC#N)cc3)cc2)cc1 1858896863 VWWRSMXANALZIM-UHFFFAOYSA-N 433.489 4.809 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCN(C[C@@H](Br)C(F)(F)F)C2)C1 1879197715 CPXODZHUQFKXJI-SOUVJXGZSA-N 443.348 4.671 50 10 IJGE Clc1ccc(C(CBr)(CBr)CC[C@H]2COCCO2)cc1 1916660871 UVOGJEUJKDFLLG-AWEZNQCLSA-N 426.576 4.563 50 10 IJGE CC1(C)C[C@@H](CBr)N(c2ncc(Br)cc2Br)C1 1945909189 WWCBZMJYNSCQCA-VIFPVBQESA-N 426.978 4.606 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CCC[C@H](CI)O2)C12CCC2 1991821663 SROLOEFCGUGCDQ-KDOFPFPSSA-N 435.346 4.683 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@@]2(C)COCCO2)cc1Br 2078515407 CCWVSHHVRQIUTJ-QWHCGFSZSA-N 442.973 4.762 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1cc(Cl)cc(Br)c1 2090386408 ZOHZSEPFDLWWTI-JTQLQIEISA-N 429.605 4.739 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N[C@@H]2CCCCC[C@@H]2Br)c1Br 2143909774 CRLHSXHNQPXRLS-WDEREUQCSA-N 445.242 4.502 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)C1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2151243303 KRJVCDPRAASVPP-CBQGHPETSA-N 427.386 4.849 50 10 IJGE CN(Cc1ccccc1)[C@H]1CCN(S(=O)(=O)c2cc(CCl)c(Cl)cc2Cl)C1 2152159496 QPAFFPLNYRJQPR-INIZCTEOSA-N 447.815 4.627 50 10 IJGE C[C@]1(CBr)CC(F)(F)CN1C(=O)c1ccc(Br)cc1Cl 2159049097 KUYSAJGKCWJNPK-GFCCVEGCSA-N 431.502 4.737 50 10 IJGE Cc1c(CCl)cc(Cl)cc1S(=O)(=O)N1CCC[C@@H](OCc2ccccc2)C1 2186389871 OPBHPHZIAQHQFH-LJQANCHMSA-N 428.381 4.757 50 10 IJGE C[C@H](Cl)c1nc2ccc(Br)cc2n1C[C@H]1COCCN1Cc1ccccc1 2194650402 RNSNEDHQHGFHEG-YJBOKZPZSA-N 448.792 5.000 50 10 IJGE CC(C)(C)OC(=O)N1CC2(CCCC[C@]23CCC[C@@H](CI)O3)C1 2211826889 YFEPRTXENRVHPL-KSSFIOAISA-N 435.346 4.540 50 10 IJGE Sc1nc2cc(Br)c(Br)cc2n1C[C@H]1C[C@H]1Br 2213495311 CJTDMPIOFZYFIX-PHDIDXHHSA-N 440.986 4.633 50 10 IJGE C[C@H](Cl)c1nc2cncc(Cl)c2n1C[C@H]1CC1(Br)Br 2224802183 CMHXGKPMZNAUMQ-NKWVEPMBSA-N 427.955 4.891 50 10 IJGE Br[C@H]1CN(Cc2ccc(I)cc2)C2(CCCCC2)C1 2232248168 KNMLIGICJGPIBT-CQSZACIVSA-N 434.159 4.963 50 10 IJGE O=C(N[C@@H]1CCC[C@@H]1CCBr)c1cc(F)c(Br)cc1Cl 2282973994 FMPIUWONJFUBCQ-AMIZOPFISA-N 427.539 4.925 50 10 IJGE CC1([C@@H](Cl)c2ccc(OCc3ccccc3)cc2Br)CS(=O)(=O)C1 2299489950 URORNSYFAWWLDU-KRWDZBQOSA-N 429.763 4.743 50 10 IJGE C[C@@H](Br)C[C@@H]1CCCCN1Cc1sccc1I 2301076973 RPCVRBNMWAIZIG-MNOVXSKESA-N 428.177 4.881 50 10 IJGE C[C@@H](CCl)CCCNCc1ccc(I)c(Br)c1 2306220146 UPSBNIXMIAYCRZ-SNVBAGLBSA-N 430.555 4.798 50 10 IJGE C[C@@H]1C[C@H](CBr)CN1Cc1cc(I)ccc1Cl 2307322846 SXLZZOYSRWEGGS-NXEZZACHSA-N 428.539 4.550 50 10 IJGE C[C@H]1CCCN(Cc2ccc(Cl)c(I)c2)[C@H]1CBr 2315551757 VTJJWNVPRASOKG-HZMBPMFUSA-N 442.566 4.940 50 10 IJGE Clc1ccc(CN2C[C@@H](Br)[C@@H](C3CC3)C2)cc1I 2315552673 HNKIYQIDIGJKJV-VXGBXAGGSA-N 440.550 4.550 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3nc(Cc4ccccc4)[nH]c3c2)cc1OC(C)C 2323723787 DYEZLCDSGAOCSB-UHFFFAOYSA-N 442.519 4.713 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC=C(C#N)C(=O)Nc1ccc(Br)cc1 2324084625 WAZUHJNWNWSORX-HNNXBMFYSA-N 428.330 4.853 50 10 IJGE CCCN1C[C@H](Cc2ccc(I)c(Br)c2)[C@@H](Cl)C1 2325210079 VDPWMCLKKZXSGU-AAEUAGOBSA-N 442.566 4.545 50 10 IJGE C[C@@H](Cl)[C@@H]1CCCN(Cc2ccc(I)c(Br)c2)C1 2325214133 NNUSJNXLNFOHBX-ZYHUDNBSSA-N 442.566 4.893 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@@H](Br)CC12CC2 2327401565 QTSHOYKGCLKMHL-LLVKDONJSA-N 440.550 4.837 50 10 IJGE C[C@@H]1CN(c2nc(C(F)(F)F)ccc2CBr)CCN1Cc1ccccc1 2343783383 DVOJVDQFUNLMAZ-CQSZACIVSA-N 428.296 4.706 50 10 IJGE CC1(C)CC(CBr)(CN2CC(F)(F)[C@@](C)(CNC(=O)OC(C)(C)C)C2)C1 2351602192 BLIGMNIRTYDMDZ-KRWDZBQOSA-N 439.385 4.670 50 10 IJGE CC(C)C[C@H](CBr)CN1CCCC[C@@H]1[C@H]1CCCN(C(=O)C(F)(F)F)C1 2382185446 YQQFEDYGYRPDNX-IXDOHACOSA-N 441.376 4.699 50 10 IJGE CC[C@@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)COc1ccc2ccccc2c1 10682931 VTTATCKEERUFMV-WZONZLPQSA-N 434.536 4.737 50 10 IJGE CCOCCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccc(C)cc3)cc2)C1=O 38606618 VULVRQFSADAVLE-LFVJCYFKSA-N 444.531 4.593 50 10 IJGE COC(=O)c1sc(N/C=C(\C#N)c2nc(-c3cccs3)cs2)c(C(=O)OC)c1C 102628379 DHRSLUKUDMQIRS-DHZHZOJOSA-N 445.547 4.791 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCC[C@@H](CBr)C1 123116050 ZLOMEZHHKJIJHK-ZETCQYMHSA-N 446.002 4.520 50 10 IJGE CC(C)COCCO[C@](C)(CI)c1ccccc1Br 232712649 SVJLLEHSXRGLEJ-OAHLLOKOSA-N 441.147 4.789 50 10 IJGE CCCCOc1cccc(C=NNC(=O)CSc2nnc(-c3ccccc3)s2)c1 256028410 KJUBZFPSCPTBLU-UHFFFAOYSA-N 426.567 4.626 50 10 IJGE Cc1ccccc1CSCC(=O)NN=Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1 263626565 LFRKWLQIOFUIKJ-UHFFFAOYSA-N 449.532 4.866 50 10 IJGE Brc1ccc([C@@H]2CC[C@H](CI)O2)cc1Br 306380987 ROYVKSLATFYQIG-KCJUWKMLSA-N 445.920 4.867 50 10 IJGE Cc1cccc(C(=O)Nc2cccc(CCBr)c2)c1I 313163991 DDCRZHSXCLSOOA-UHFFFAOYSA-N 444.110 4.789 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1cccc([C@H]2CN(S(=O)(=O)c3ccccc3)CCO2)c1 616601206 ABSAYGGOAPSJKP-JOCHJYFZSA-N 447.673 4.971 50 10 IJGE CN(C(=O)c1ccc(I)c(Cl)c1)C(C)(C)CCBr 688398653 XVKYPEMSMRIZAK-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE C[C@H]1CC[C@H](CBr)CN1Cc1cc(Cl)ccc1I 688745361 GYBYZONDDKJOIC-WDEREUQCSA-N 442.566 4.940 50 10 IJGE Cn1cc(Br)c([C@H](Br)c2ccc(F)c(Br)c2)n1 693100772 RQPRVIMOPGMPKA-SNVBAGLBSA-N 426.909 4.569 50 10 IJGE Fc1cccc([C@H](Br)c2ccc3c(c2)CCO3)c1I 721683161 FURLOPNJTQATMT-CQSZACIVSA-N 433.058 4.850 50 10 IJGE CC(C)C[C@@H](C)OC1(CI)CCN(C(=O)OC(C)(C)C)CC1 725343868 FXBDDXPECWDMTE-CQSZACIVSA-N 425.351 4.642 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N(C)[C@@H](c2ccccc2)C(F)(F)F)c1C 728499468 UOIWQIAXRAZKHC-VAARHQIPSA-N 433.474 4.981 50 10 IJGE O=C(CSCc1ccc(Cl)cc1)NN=C1C(=O)N(Cc2ccccc2)c2ccccc21 1084089829 MZMMNCSPDBLQLP-UHFFFAOYSA-N 449.963 4.641 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)N(C)C)cc(Br)c1OCc1ccc(C)cc1 1084623235 PLGLOWRYNALIMF-VCHYOVAHSA-N 443.341 4.730 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C(F)(F)c2cc(Cl)ccc2Cl)c1C 1306609090 UVIQGKDUFILKQG-UHFFFAOYSA-N 438.265 4.697 50 10 IJGE C#CCN(C(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C)[C@H]1CCCc2ccccc21 1463010043 TWAWSPJXNKTCJR-GDCXASCVSA-N 441.575 4.730 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2c(F)cccc2Cl)[C@@H]1c1ccc[nH]1 1865709392 BGNGHAYDSFLHTA-FQEVSTJZSA-N 445.885 4.937 50 10 IJGE Cc1ccc(C)c(Cn2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2ccc(Br)cc2)c1 1865714329 HJKYRAWBSPURTK-OAQYLSRUSA-N 449.352 4.837 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCC2(CCC2)N(C(=O)OC(C)(C)C)C1 1882087388 JJLGRYLEHNPUCR-CABCVRRESA-N 447.414 4.844 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H]2CCCC[C@@H]12 1882180528 OCJSJBOXUOBWQA-ZJIFWQFVSA-N 447.414 4.700 50 10 IJGE CC1(CCCO[C@@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)CC1 1902022888 CHISZJLBSTWRAM-GOSISDBHSA-N 437.362 4.788 50 10 IJGE Cc1c(Br)sc([C@H](Cl)[C@H]2CCCS(=O)(=O)C2)c1Br 1922912352 MJDBMHWMFALOLV-IONNQARKSA-N 436.618 4.686 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@@H](CCBr)C1 1945189660 WUZUNWIUHGXTEC-SSDOTTSWSA-N 446.002 4.520 50 10 IJGE CC(C)(C)OC(=O)NCC[S@](C)(=O)=NCCCCCCCCCBr 1999497337 OQJRGEQHMIUBSM-DEOSSOPVSA-N 427.449 4.735 50 10 IJGE C[C@H](Br)[C@H]1CCCN1C(=O)c1scc(Br)c1Br 2018105644 VYUOPUACMFUXEG-POYBYMJQSA-N 446.002 4.661 50 10 IJGE FC1(F)CCc2c3c(cc(I)c2[C@@H](Br)C1)CCO3 2046742663 AZLYIBAHEGNJGI-VIFPVBQESA-N 429.042 4.634 50 10 IJGE CCn1cc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)C(C)C)cc1CBr 2059268171 WCYDWNILAMETQZ-MRXNPFEDSA-N 427.408 4.638 50 10 IJGE C[C@@]1(NC(=O)c2ccc(Br)cc2Br)CCC[C@H]1Br 2062573158 HBZITGVMWNJSEC-DGCLKSJQSA-N 439.973 4.648 50 10 IJGE C[C@@]1(CCBr)CCN1C(=O)c1cccc(Br)c1Br 2084701097 TYVXGZVSRDIILB-CYBMUJFWSA-N 439.973 4.601 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CN(C[C@H](Br)C(F)(F)F)c2ccccc21 2106781403 HKMHPGYPCAOCNZ-DOMZBBRYSA-N 437.300 4.831 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1Cc2ccccc2N(C[C@H](CBr)C(C)(C)C)C1 2106787899 LIZLYIJSSFJWPM-IRXDYDNUSA-N 425.411 5.000 50 10 IJGE Brc1cccc([C@@H](CI)OC[C@@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)c1 2134537843 FKOJSISRKQDBLI-LIADABEKSA-N 433.127 4.844 50 10 IJGE CC(C)(C)OC(=O)N(CCO)C1CCN(CCCCCCCCCBr)CC1 2163058034 HDWDCHQNNDSXFG-UHFFFAOYSA-N 449.474 4.806 50 10 IJGE CC(C)c1nc(-c2ccc(I)c(F)c2)ncc1CBr 2228785694 CSCBDBZGPUASDP-UHFFFAOYSA-N 435.078 4.906 50 10 IJGE O[C@@H](c1c(F)cc(Br)c(F)c1Br)C1CC(Br)C1 2250732970 SXXVMHVIYJSVOU-ZROIKLNDSA-N 434.900 4.697 50 10 IJGE CCCC1(O[C@H](CI)c2cccc(Br)c2)COC1 2260092199 OSRLSAYNGHNMLU-CYBMUJFWSA-N 425.104 4.511 50 10 IJGE COc1c(Br)cc([C@H](Br)[C@H]2C[C@H]2Br)c(OC)c1C 2263577952 ZNTCMGDIAZZPQD-JVUFJMBOSA-N 442.973 4.994 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2cc(Br)c(OCC)c(OC)c2)cc1 2293665072 AJCICKDSELEXGH-UHFFFAOYSA-N 445.313 4.801 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1Cc1ccc(Cl)cc1I 2302325815 KPPFLPQBPPFPMZ-DGCLKSJQSA-N 428.539 4.692 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4)[nH]c3c2)cc1OC 2323744495 IEHYZMJQLFNHDH-UHFFFAOYSA-N 428.492 4.791 50 10 IJGE ClCC12CCC(CC1)N2Cc1ccc(I)c(Br)c1 2325225457 GCINPRLRFVCHKP-UHFFFAOYSA-N 440.550 4.790 50 10 IJGE CC[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](CC)CN1C[C@]1(CBr)CC1(F)F 2326918556 AOZVQFAQQQWRSE-CKEIUWERSA-N 425.358 4.517 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]3C2(C)C)C1 2345004478 KZJWUKIOEWEUOM-HZPDHXFCSA-N 429.443 4.765 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1Cc2ccccc2N(C[C@@]2(CBr)CC2(F)F)C1 2379985107 FKMHLIJIPJELIU-LIRRHRJNSA-N 445.348 4.610 50 10 IJGE CN(C)c1ccc([C@H](C(=O)NC2CCCCC2)N(Cc2cccs2)C(=O)CCl)cc1 3037653 WBMLDOFYSMBTHQ-JOCHJYFZSA-N 448.032 4.572 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(OC)c2)cc1 38650167 QWHWOZCKCCQFLS-XMMPIXPASA-N 442.471 4.531 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)cc1C 38652960 LBVHPLGGGXMHSM-VWLOTQADSA-N 444.462 4.645 50 10 IJGE CCCCCCCCOc1ccc(OCC(=O)NN=Cc2ccc([N+](=O)[O-])s2)cc1 254606653 NJNGMRCOJMVZLM-UHFFFAOYSA-N 433.530 4.925 50 10 IJGE Cc1cc([C@H](Cl)c2cnn(C)c2I)c(C)cc1Br 394063324 CZMTYAYDRYGQRT-LBPRGKRZSA-N 439.522 4.732 50 10 IJGE ClCc1nc2cc(Br)cnc2n1CC1CCN(Cc2ccccc2)CC1 397579651 FCIYDZOIRJKYLL-UHFFFAOYSA-N 433.781 4.845 50 10 IJGE Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CC/C=C/c3ccccc3)cc2)n1 737468581 KCDHTHKWQCPNCF-UXBLZVDNSA-N 446.576 4.640 50 10 IJGE CC[C@@H](NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)c1ccc(F)cc1F 737934614 FOOHWQKBIINOSS-PZSRYKBRSA-N 445.473 4.916 50 10 IJGE COc1ccc(Sc2ccc(NC(=O)NNC(=O)c3cccc4cccnc34)cc2)cc1 756355832 SSUYZADRPYCGPL-UHFFFAOYSA-N 444.516 4.861 50 10 IJGE C[C@@H]1CCCCN1CCOc1ccccc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799750540 HTRAZFQSHFUPLF-MRXNPFEDSA-N 446.473 4.587 50 10 IJGE CC(=O)N1CCCc2cc(NC(=O)NNc3ccc(Cl)c(Br)c3)ccc21 1465493881 QSBOHNFTAURUMQ-UHFFFAOYSA-N 437.725 4.550 50 10 IJGE Cc1cc(C)cc(OC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(O)cc2)CCC3)c1 1772745235 UNUWMBREINTZOE-UHFFFAOYSA-N 432.476 4.600 50 10 IJGE Cc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2Cc1ccc(F)cc1 1865712640 DKHLYEZZXUJBMU-KRWDZBQOSA-N 428.389 4.616 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865715041 UFAMEGOSJVTWMU-QFIPXVFZSA-N 437.459 4.714 50 10 IJGE Cc1sc([C@H](Br)c2c(Br)ncn2C)cc1Br 1900419333 HUXLHZGAGOZVJA-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE O=S(=O)(c1cc(Cl)ccc1Cl)N(CCCBr)Cc1ccccc1 1914648166 QOEJNHHWIQHNPW-UHFFFAOYSA-N 437.186 4.969 50 10 IJGE CC1(C)CN(Cc2cc(Cl)ccc2I)[C@H]1CBr 1944098276 WXTIUCIUNOCPCC-LBPRGKRZSA-N 428.539 4.550 50 10 IJGE ClCc1c(Cl)ncn1-c1cc(Br)ccc1I 1982522222 OFFDSOKBBPRPHM-UHFFFAOYSA-N 431.886 4.632 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CC[C@@](C)(CI)O2)C12CCC2 1991817467 GFODWXQVXNVGEK-WMZOPIPTSA-N 435.346 4.683 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1ccc(F)c(Br)c1 2010825159 GUNFAPJYMBHWFT-UHFFFAOYSA-N 439.416 4.584 50 10 IJGE Cc1cc(N)c(NCCSSCCNC(=O)OC(C)(C)C)cc1Br 2010825267 IMPISNWORZTKOP-UHFFFAOYSA-N 436.441 4.658 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1Cc1ccc(I)c(Cl)c1 2026563768 MZEMDOMTOHQNAP-RNCFNFMXSA-N 428.539 4.692 50 10 IJGE CCC[C@@H](CBr)CN1CCC[C@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2044705209 JMDAWTFBGTZACO-BBRMVZONSA-N 431.337 4.719 50 10 IJGE F[C@@H]1CCO[C@H]1COc1c(Br)cc(Br)cc1CBr 2058656547 SGSHKLRRVUKHCC-MNOVXSKESA-N 446.936 4.612 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cc(F)cc(F)c1 2065844784 KYSKPFCFSIBZEH-GOSISDBHSA-N 432.330 4.575 50 10 IJGE COc1cc(Cl)c([C@H](Br)c2nn(C)cc2Cl)cc1Br 2137652737 BAMFMDJTHPAJJC-NSHDSACASA-N 428.939 4.982 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CC[C@@H](CCl)C(F)(F)C1 2146382518 IHUHITRJIBTTED-QMMMGPOBSA-N 431.502 4.548 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC2(CCC2)[C@@H]1NC(=O)[C@@H](Br)C1CCCC1 2167033561 RVYFYIRPYGYESJ-YESZJQIVSA-N 443.426 4.530 50 10 IJGE CN(C(=O)c1cccc(Br)c1Br)[C@H](CCCl)C(F)(F)F 2178513611 VAIJAFZUZRWNME-SECBINFHSA-N 437.481 4.843 50 10 IJGE CCCC[C@@H](C)N(C)S(=O)(=O)c1ccc(Br)c(CBr)c1 2179950848 OTYLPPRMCPWJCY-LLVKDONJSA-N 427.202 4.543 50 10 IJGE COc1cccc(N2CC[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1CBr 2203190744 WCWNSUPPBZDRMU-UXHICEINSA-N 429.402 4.939 50 10 IJGE CCN[C@H](c1cc(Br)c(Br)cc1F)[C@@H]1C[C@H]1Br 2213489378 LHNJTMBAEFZNFK-GFJAWQGPSA-N 429.953 4.785 50 10 IJGE COC1CC([C@@H](Br)Cc2cc(Br)cc(Br)c2)C1 2252838139 ZRIYHLCGCZULLD-LDUAJXOISA-N 426.974 4.943 50 10 IJGE CN(C[C@@H]1CC1(Br)Br)[C@@H](CBr)c1ccccc1 2253362060 BZMJWRLGCQDSPJ-RYUDHWBXSA-N 425.990 4.560 50 10 IJGE C[C@@H](Br)[C@@H](NC(=O)c1cc(F)c(Br)cc1Cl)C(F)(F)F 2282966611 HHSANAZDQUHLRF-ALFREKQPSA-N 441.444 4.686 50 10 IJGE C[C@@H](Cl)C[C@H]1CCCCN1C(=O)c1ccc(Cl)c(I)c1 2283652249 RSQFFNGVHBESQP-ZYHUDNBSSA-N 426.125 4.957 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@H]2C[C@H](S(C)(=O)=O)C2)c(C)c1Cl 2285394350 GNURVDMTTITMOA-GIPNMCIBSA-N 444.616 4.979 50 10 IJGE C[C@H](Br)CN(CC(C)(C)C)C(=O)c1ncc(Br)cc1Cl 2288047240 GGGZRYIIXGCYNP-VIFPVBQESA-N 426.580 4.769 50 10 IJGE CN(C)c1ccc(C=C(C#N)c2nc(-c3cc4cc([N+](=O)[O-])ccc4oc3=O)cs2)cc1 2297321199 ZDLBBKNKFAQXAJ-UHFFFAOYSA-N 444.472 4.955 50 10 IJGE Cc1noc(COC(=O)C(C#N)=Cc2cc(C)n(-c3cccc(Cl)c3Cl)c2C)n1 2297434696 YOJKQYQOLAITNE-UHFFFAOYSA-N 431.279 4.743 50 10 IJGE C[C@H]1C[C@H](Br)CN(Cc2ccc(Cl)c(I)c2)C1 2300237883 DJKXQCNOGPSMFO-ONGXEEELSA-N 428.539 4.550 50 10 IJGE C[C@@H](NC(=O)C(C#N)=CNCc1ccccc1Br)c1ccc2c(c1)CCCC2 2325119042 TUCJEDJUYMMKAL-MRXNPFEDSA-N 438.369 4.702 50 10 IJGE CCCN(C[C@]1(CBr)CC1(F)F)C1CCC(NC(=O)OC(C)(C)C)CC1 2351892755 TXRFKLNPACJLIQ-JTTJXQCZSA-N 439.385 4.955 50 10 IJGE COc1cccc(-c2nn(-c3ccccc3)cc2/C=C(/C#N)C(=O)NC2CCCCC2)c1 35446336 AUCWHRRWDBFMND-HKWRFOASSA-N 426.520 4.904 50 10 IJGE Cc1ccc(C(=O)NNC(=O)CCCc2c(-c3ccccn3)[nH]c3ccc(Cl)cc23)cc1 39852749 CEAZWOHPZWVLAY-UHFFFAOYSA-N 446.938 4.976 50 10 IJGE C[C@@H](CCCCBr)NCc1cc(Cl)ccc1I 405301583 NYXRNDAILBUUEQ-JTQLQIEISA-N 430.555 4.988 50 10 IJGE CCO[C@H](CO[C@@H](CI)c1ccc(Br)cc1)C1CC1 703470747 NYWNVDZCMKUYSB-LSDHHAIUSA-N 439.131 4.757 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2cc(O)nc3ccccc23)c(C)n1-c1ccc(F)cc1 748329870 LAIGGCRZCDJGRU-XDHOZWIPSA-N 440.478 4.710 50 10 IJGE C=CC[C@H](CO)CNC(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1152930137 LNSUGFSSXAFGKL-RSFAQHHSSA-N 432.351 4.609 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNc1ccc(Br)c(F)c1 1296580353 HDFJKEZDDHCCCO-UHFFFAOYSA-N 433.199 4.929 50 10 IJGE Cc1c([C@H](NC(=O)NNC(=O)c2ccc(Br)cc2)C(C)C)oc2ccccc12 1338942323 JILGPCUTHGZRIC-GOSISDBHSA-N 444.329 4.845 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NN(Cc2ccccc2)c2ccccc2)c(O)n1 1353720696 NWPWYAWIEXAFAE-UHFFFAOYSA-N 425.488 4.814 50 10 IJGE C#CCOc1ccc(CNC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1 1533412354 LTVKUWGIISLYME-PXLXIMEGSA-N 443.934 4.983 50 10 IJGE C=CC[C@@H]1CCCN(C(=O)CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)C1 1645066769 LVJOKIOYVKGHJK-HSZRJFAPSA-N 435.684 4.768 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc(C)cc1)CCC2 1772745136 SXPADKTZXBXSIB-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE Cc1ccc(NC(=O)COc2cccnc2NC(=O)Nc2ccc(SC#N)cc2)c(C)c1 1858823787 OPEAUBUNGTWKNC-UHFFFAOYSA-N 447.520 4.933 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2c(F)cccc2Cl)c1 1865689759 DZBREFCTTNIRMJ-OAQYLSRUSA-N 438.890 4.649 50 10 IJGE COc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2Cc1ccccc1 1865710223 RBMKZSVOZBVKRJ-QHCPKHFHSA-N 434.499 4.825 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCC12CCN(C(=O)OC(C)(C)C)CC2 1882757003 ZWLVBCHVDJJWKU-HUUCEWRRSA-N 447.414 4.702 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1nn(C)c(Cl)c1Cl 1915292808 DZOJEJZWNGITIC-CYBMUJFWSA-N 433.177 4.789 50 10 IJGE C[C@@H]1OCCO[C@@H]1[C@@H](Br)c1sc(Br)cc1Br 1922880500 DRHRSWFAVPOAPQ-NGESMGFYSA-N 434.975 4.513 50 10 IJGE Brc1cccnc1C[C@H](Br)c1sncc1Br 1924877836 WOUZAARYTKJEBJ-ZETCQYMHSA-N 426.959 4.742 50 10 IJGE Clc1nc(Cl)n(-c2ccccc2I)c1CBr 1982553106 JOIKZSYFFPKJLV-UHFFFAOYSA-N 431.886 4.679 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@]2(CCC[C@H](CI)O2)CC12CCC2 1986112748 SSZRSNPAETYZOM-KDOFPFPSSA-N 435.346 4.683 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1Br)c1c(Br)cccc1Br 2033081482 FXGSIJFOQDKLHJ-GZMMTYOYSA-N 439.973 4.648 50 10 IJGE Brc1cnc(N2C[C@H](Br)CCC23CCC3)c(Br)c1 2054164840 MEKWMHJQPMCPIU-SECBINFHSA-N 438.989 4.893 50 10 IJGE Cc1cc(-n2nc(CBr)c(Br)c2C(F)(F)F)cc(C)c1O 2079234838 HSUJLYUIACDLLC-UHFFFAOYSA-N 428.046 4.871 50 10 IJGE CN(c1ncc(Br)c(CCl)n1)[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2094894318 JTHFKWCDWCTCNN-BJWYYQGGSA-N 435.797 4.610 50 10 IJGE Cn1nc([C@H](Cl)c2cc(I)cc3c2OCC3)c(Cl)c1Cl 2150719290 XVXIDSKARQHPOV-SECBINFHSA-N 443.499 4.595 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CCCCCCCCCBr)[C@@]2(CCOC2)C1 2163065082 XHFKGESHXVHHSC-NQIIRXRSSA-N 447.458 4.870 50 10 IJGE Cc1sc(Br)cc1C(=O)N1C[C@@]2(F)CCC[C@@]2(CBr)C1 2176631193 WJWSBZXJNAOLMQ-KGLIPLIRSA-N 425.161 4.548 50 10 IJGE O=C(NCC[C@@H]1CCCC[C@@H]1Cl)c1ccc(I)c(Cl)c1 2179638860 RXWZFIXQIKXIQG-JQWIXIFHSA-N 426.125 4.862 50 10 IJGE CCCOc1ccc(C=CC(=O)Oc2ccc(C=C(C#N)C(=O)OCC)cc2OCC)cc1 2293190697 CVUPJRIXYJAIRS-UHFFFAOYSA-N 449.503 4.963 50 10 IJGE C[C@@H]1C[C@@H]1N(CCBr)Cc1ccc(Cl)cc1I 2302324929 BSMCCQTUTHQNRY-RNCFNFMXSA-N 428.539 4.550 50 10 IJGE C[C@H]1[C@H](CBr)CCN1Cc1ccc(Cl)cc1I 2302335128 BBRBLKRDNHHULB-UWVGGRQHSA-N 428.539 4.550 50 10 IJGE CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)C=Cc3ccccc3)ccc21 2314634127 OWZKGJUTTLWSJP-AREMUKBSSA-N 438.483 4.922 50 10 IJGE Clc1ccc(I)c(C[C@@]2(CBr)O[C@H]3CC[C@H]2C3)c1 2327567733 MAJJSLUEFJSFLB-JKOKRWQUSA-N 441.534 4.820 50 10 IJGE CC(=O)c1ccc(-c2ccc(/C=C3/C(=O)N(Cc4ccco4)C(=O)C(C#N)=C3C)o2)cc1 101336771 VRWBGVQAMIHFEX-CIAFOILYSA-N 426.428 4.535 50 10 IJGE CO[C@@H](C)CC(CBr)(CBr)c1cccc(Br)c1 228630578 AXDWHIAYADRXNF-JTQLQIEISA-N 428.990 4.902 50 10 IJGE Cc1cc(C=NNC(=O)Cc2cccc(C(F)(F)F)c2)c(C)n1-c1cccc(C(=O)O)c1 254479997 CNXNSQQQLAHJRH-UHFFFAOYSA-N 443.425 4.504 50 10 IJGE CCCOc1ccc(C(=O)NN=Cc2ccc(OC(=O)c3ccccc3)c(OCC)c2)cc1 254629714 BDUNJWIBADGEBA-UHFFFAOYSA-N 446.503 4.857 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1C[C@@H]1CCCN1Cc1ccccc1 390599807 VOPAPEKJAOVHKY-KRWDZBQOSA-N 433.781 4.640 50 10 IJGE Cc1ccccc1NNC(=O)c1cnn(-c2ncccc2Cl)c1C(F)(F)C(F)(F)F 739388081 USNLFJTXHOWKKC-UHFFFAOYSA-N 445.779 4.640 50 10 IJGE COc1cccc(Oc2ccc(NC(=O)NNC(=O)c3cccc4cccnc34)cc2)c1 756144419 BGNWKBQBFPOAIK-UHFFFAOYSA-N 428.448 4.502 50 10 IJGE C[C@@H](CCCC(F)(F)F)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 757642852 BUZRWHAJWWKVEN-HZGBGQKMSA-N 429.446 4.608 50 10 IJGE CC(C)n1ccc(COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)n1 781866841 CBVPDDKWRUTSAH-LDADJPATSA-N 448.914 4.545 50 10 IJGE CN(NC(=O)C(=O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1)c1ccccc1 783433453 RRJPVLCYKVZURO-UHFFFAOYSA-N 429.398 4.604 50 10 IJGE Cc1ccc(OCc2cccc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c2)cn1 799746952 MTHKOFUMKRULEB-UHFFFAOYSA-N 426.398 4.616 50 10 IJGE C[C@@H](CBr)[C@H]1CCCCN1c1ncc(Br)cc1Br 829246400 LJNHJXNVENQVLV-JOYOIKCWSA-N 441.005 4.997 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1)c1ccccc1C(F)(F)F 1135740357 DEGNSMMRKOQVBQ-PEZBUJJGSA-N 434.458 4.995 50 10 IJGE C/C(=C\C(=O)NNc1ccc([N+](=O)[O-])cc1Br)c1ccccc1C(F)(F)F 1296799666 RHLUUSUTONGJOH-CSKARUKUSA-N 444.207 4.923 50 10 IJGE C=C[C@](C)(CCOC)C(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12 1540613662 CBIZOIVKBSQVBC-XMMPIXPASA-N 437.927 4.545 50 10 IJGE C#CCCCC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(Cl)cc1)CC2 1558512906 LEJMUBDUESZEOJ-VLGSPTGOSA-N 443.934 4.940 50 10 IJGE O=C(CCBr)c1c(I)cccc1SC(F)(F)F 1848425867 KPKLDTVFRNCQLG-UHFFFAOYSA-N 439.034 4.871 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C2CN(CC3(CBr)CCCCCC3)C2)C1 1886875681 FOOLSDJIDIVRPH-QGZVFWFLSA-N 429.443 4.911 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2[C@@H]3CCCO[C@H]32)s1 1900923829 FKMLNWNCUULRNE-UKIQFFJBSA-N 433.536 4.867 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@H](CCl)C2(CCC2)C1 1914494997 YJUCHKFLHJBJNH-QMMMGPOBSA-N 427.589 4.754 50 10 IJGE C[C@H](Cl)CN(Cc1ccccc1)C(=O)c1ccc(F)cc1I 1914639957 VRXUSNWQCGOIMW-LBPRGKRZSA-N 431.676 4.700 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)c1ccccc1S(=O)(=O)C(F)F 1915759645 FVFCZGWENDKIDL-UHFFFAOYSA-N 432.330 4.863 50 10 IJGE C[C@H]1CN(Cc2cccc(Br)c2Br)C[C@H]1CBr 1943881542 BSSQDLLZXONMSV-GXSJLCMTSA-N 425.990 4.674 50 10 IJGE Brc1cccc(Br)c1CN1CCC[C@H](Br)CC1 1945333680 TYEJLVLPYBRWIN-JTQLQIEISA-N 425.990 4.961 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CCSC[C@@H]1CCBr 1950312823 BSGOKUPRPKIVKG-HNNXBMFYSA-N 426.401 4.670 50 10 IJGE C[C@H]1CC[C@H](Br)CN1Cc1cc(Br)ccc1Br 2006496679 KXOLIYHGXVLXOC-CABZTGNLSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc([C@]2(C)CC[C@](C)(CI)O2)cc1 2014211372 TYCCTQMMBYDKQH-MOPGFXCFSA-N 445.341 4.931 50 10 IJGE CC[C@@H](Cl)c1noc(-c2ccc(Br)cc2I)n1 2026220505 FODUSMRZEWKXRW-MRVPVSSYSA-N 427.467 4.794 50 10 IJGE CCc1nn(CC2(CBr)CCCC2)c(CC)c1I 2032918648 QVHRHQPFWGQQKA-UHFFFAOYSA-N 425.152 4.568 50 10 IJGE O=C(NC1CC2(C1)CN(C[C@@H](CBr)c1ccccc1)C2)OCc1ccccc1 2044705025 IETZIKRLMXUYMA-HXUWFJFHSA-N 443.385 4.556 50 10 IJGE FC(F)(F)c1cc(I)ccc1NC[C@H]1C[C@H](Br)C1 2076174758 XIAUDQPAJMPQJO-ZKCHVHJHSA-N 434.037 4.895 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)N2CCC(Br)CC2)cc1 2106199012 FEIFFDHYGNVNIM-CYBMUJFWSA-N 426.355 4.664 50 10 IJGE CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C[C@H](Br)C(F)(F)F)C2)CC1 2106785147 ARRYQZVFDAORSL-GJZGRUSLSA-N 443.348 4.671 50 10 IJGE CN(C[C@@H]1CCCN(C[C@H](CBr)c2ccccc2)C1)C(=O)OC(C)(C)C 2106788668 RQFZYKVCBMIGPH-HKUYNNGSSA-N 425.411 4.744 50 10 IJGE O=C(NC[C@H]1C[C@@H](Cl)C12CCC2)c1cc(Br)c(Br)s1 2115599231 LWKJSPVXUCRVMM-GMSGAONNSA-N 427.589 4.801 50 10 IJGE C[C@H](c1cscc1Br)N(C)c1ncc(Br)c(CCl)n1 2130029924 GENJNMGCBOBCIP-SSDOTTSWSA-N 425.577 4.999 50 10 IJGE O=C(c1cc(Br)sc1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Cl)C2 2134132024 XYEHSMSCYDLAQZ-LHGNLISDSA-N 431.552 4.596 50 10 IJGE Cc1cc(S(=O)(=O)N(C)[C@H]2CC(C)(C)[C@@H]2OCc2ccccc2)sc1CCl 2156441422 GLPQUJQGKLAPCV-QFBILLFUSA-N 428.019 4.800 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@H](CBr)C2CC2)C[C@H]1c1ccccc1 2185528326 HBLILFWUYYNPPS-ZCNNSNEGSA-N 437.422 4.648 50 10 IJGE COc1cc(Cl)c([C@H](Br)[C@@H]2CCCCS2(=O)=O)cc1Br 2202349317 XMJIPEOBBJZTDT-STQMWFEESA-N 446.588 4.514 50 10 IJGE CCCc1nc(-c2ccc(I)c(F)c2)ncc1CBr 2228789010 QBAXTLQDXGERJV-UHFFFAOYSA-N 435.078 4.735 50 10 IJGE CC1(C[S@@](C)(=O)=NCCCCCCCBr)CN(C(=O)OC(C)(C)C)C1 2263151772 PSJNOOJIVWMNAD-RUZDIDTESA-N 439.460 4.687 50 10 IJGE CCc1cc([C@H](Br)[C@@]23CCC[C@@H]2CS(=O)(=O)C3)sc1Br 2282915396 AKUNIHQWQUTJJK-SCDSUCTJSA-N 442.238 4.724 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2ccccc2Br)cc1Br 2297400013 VZBUSBBBXNFHNA-UHFFFAOYSA-N 436.103 4.766 50 10 IJGE Cc1cccc(NC(=O)C(C#N)=Cc2cc(Br)cc(Br)c2O)c1 2313518522 HPIQNXVPENXGPP-UHFFFAOYSA-N 436.103 4.771 50 10 IJGE N#CC(=CNc1ccc(N2CCCCC2)cc1)C(=O)N1CCC(Cc2ccccc2)CC1 2324765380 QGXHKNBHIGAPBM-UHFFFAOYSA-N 428.580 4.978 50 10 IJGE F[C@]1(CCl)CCCN(Cc2ccc(I)c(Br)c2)C1 2325225685 HWJYRCRYEKTLID-ZDUSSCGKSA-N 446.529 4.597 50 10 IJGE C[C@H]1CN(Cc2cc(I)ccc2Cl)CC[C@H]1CBr 2327402342 WBTNIRUTAPOIAH-QWRGUYRKSA-N 442.566 4.798 50 10 IJGE CCN(c1ccccc1)S(=O)(=O)c1ccccc1NC(=O)C(C#N)=Cc1cccc(F)c1 2329673828 WIAPTSPBEOQVDL-UHFFFAOYSA-N 449.507 4.587 50 10 IJGE COc1cc(C(O)=C(C#N)c2nc(-c3ccccc3OC)cs2)c([N+](=O)[O-])cc1OC 2331282351 JCPBSURCUCSCEZ-UHFFFAOYSA-N 439.449 4.694 50 10 IJGE FC(F)(CI)C(F)(F)CNCc1ccc(Cl)c(Cl)c1 2336529813 PFNSCMOJPSSZNS-UHFFFAOYSA-N 430.010 4.789 50 10 IJGE COc1ccc(CCO[C@@H]2CCCC[C@H]2I)c(Br)c1 2339257669 LUNGRQBYXCNSQA-HUUCEWRRSA-N 439.131 4.763 50 10 IJGE CN(CC[C@H](Cl)c1cccs1)C(=O)c1sccc1I 2340428998 BUKCCHYMGZYWLW-VIFPVBQESA-N 425.744 4.856 50 10 IJGE Cc1sc(C(=O)N2CC[C@H](Br)C[C@@H]2C(F)(F)F)cc1Br 2361463694 BPTBVQGNXPOPIA-OIBJUYFYSA-N 435.103 4.749 50 10 IJGE COCCOC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Cl)c(C(F)(F)F)c2)c1C 3324133 CNGQFVVREYTORG-DHDCSXOGSA-N 426.822 4.863 50 10 IJGE O=C(N/N=C/C1=C(N2CCOCC2)/C(=C\c2ccccc2)CC1)Nc1ccc(Cl)cc1 32690888 JLMWIWVRZYVAMU-HRDZTEILSA-N 436.943 4.911 50 10 IJGE CCCOC(=O)c1oc2c(c1C)/C(=N/NC(=O)Cc1coc3c(C)c(C)ccc13)CCC2 40826798 SIGOPUZZBKVZFU-LGUFXXKBSA-N 436.508 4.917 50 10 IJGE C[C@H]1[C@@H](n2c(CCCl)nc3cc(Br)cnc32)CCN1Cc1ccccc1 311901633 ALXGBJNVVVBECB-KSSFIOAISA-N 433.781 4.811 50 10 IJGE CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](O)[C@@H](OCc2ccccc2)[C@H]1OCc1ccccc1 616591415 YFXHWMFAYWHGCE-ZJZGAYNASA-N 444.644 4.896 50 10 IJGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@H]1C[C@H]1c1cccc2ccccc12 730768286 BONFQGCIHCVTTE-SFTDATJTSA-N 427.529 4.836 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)N2CCn3c(C(C)C)nnc3[C@H]2C)c1C 784695468 FFGMWGGHHUCLHG-YRXLECQKSA-N 442.567 4.628 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2nnc(-c3cc4ccccc4o3)s2)c(C(F)(F)F)c1 799424200 JXCNKLASXLCOCY-UHFFFAOYSA-N 444.398 4.990 50 10 IJGE Cc1nc(COc2cccc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c2)cs1 799746245 CEXOZLRXIXHDGK-UHFFFAOYSA-N 432.427 4.678 50 10 IJGE C=CCN(CCc1ccco1)C(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(OC)cc2)c1C 1458361708 ZBWSHBVTMMCIQW-XLNRJJMWSA-N 429.520 4.860 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccc(OC)cc1)nn2CC 1865702945 IYUYGAAOVXCMJX-OAQYLSRUSA-N 430.508 4.586 50 10 IJGE C[C@@H]1[C@H](O[C@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)CC1(C)C 1901820167 PXABLPRWYGJTGF-LBTNJELSSA-N 437.362 4.642 50 10 IJGE CCN[C@H](c1cc(Br)c(C)cc1Br)[C@@H]1C[C@@H]1Br 1910126621 VPDFRFIIYFKBSQ-JIMOISOXSA-N 425.990 4.954 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@@H]2CC[C@H]3CC[C@H]2C3)C1 1947124337 RLGDHLKHQCFEJR-OLMMMNRUSA-N 449.373 4.786 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@@H]2CCCC23CC3)C1 1986119056 PFMXMISCEUFGJP-RDTXWAMCSA-N 435.346 4.540 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@@]21CC[C@](C)(CI)O1 1987456094 OHNOMBTVSTVBAU-AEFFLSMTSA-N 435.346 4.540 50 10 IJGE CS(=O)(=O)C1([C@H](Br)c2c(Cl)sc(Br)c2Cl)CC1 2002553351 YKXHYDLJUBXIEG-ZCFIWIBFSA-N 443.009 4.831 50 10 IJGE O=C(N[C@@H]1CC[C@@H](CBr)C1)c1cc(Br)ccc1Br 2029535584 NTDNDXHVGUIROH-PSASIEDQSA-N 439.973 4.505 50 10 IJGE CC(C)[C@H](Br)CN(C)C(=O)c1ccc(Br)cc1Br 2048731575 QUDUMXGPJLHTCR-GFCCVEGCSA-N 441.989 4.703 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2C[C@H](Br)C[C@H]2C1 2065404526 VBLNJWCEANEPHM-URLYPYJESA-N 438.001 4.817 50 10 IJGE C[C@@]1(CCBr)CCN1C(=O)c1c(Br)cccc1Br 2084703096 RUWHOOZLGLMQBP-CYBMUJFWSA-N 439.973 4.601 50 10 IJGE CC(C)(C)[C@H]1C[C@@H](CBr)CN(c2ccc(I)cn2)C1 2108720062 PCBXGYVOKCRXKN-RYUDHWBXSA-N 437.163 4.570 50 10 IJGE CCN(CCCOCc1ccccc1)S(=O)(=O)c1cccc(CBr)c1C 2123202671 AXIQVGMZTSRWDE-UHFFFAOYSA-N 440.403 4.507 50 10 IJGE CN(C(=O)OC(C)(C)C)c1ccc(CNC(=O)c2ccc(CBr)cc2)cc1 2175632625 WSUHXUYESZKYNT-UHFFFAOYSA-N 433.346 4.883 50 10 IJGE O=[N+]([O-])c1cc(Cl)cc(Br)c1OCCCCI 2248212701 HBGTXYJSERZQRK-UHFFFAOYSA-N 434.455 4.605 50 10 IJGE CC1CC(CBr)(CN2CCC[C@@H](N(CC(F)F)C(=O)OC(C)(C)C)C2)C1 2265309368 FRVNBNWULGMMMC-XAUUPUKJSA-N 439.385 4.764 50 10 IJGE CN(CC[C@H](NC(=O)c1ccc(CBr)cc1)C(C)(C)C)C(=O)OC(C)(C)C 2296006012 LKHUZFOUSGNSRF-KRWDZBQOSA-N 441.410 4.983 50 10 IJGE FC1(F)CCN(c2nc3ccc(Br)cc3s2)C[C@H]1CBr 2296513037 BASGACNXCRRKDE-MRVPVSSYSA-N 426.124 4.915 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN1Cc1ccc(Cl)cc1I 2302306594 FVMVFUODBUZFLF-ZJUUUORDSA-N 428.539 4.550 50 10 IJGE COc1ccc(Br)cc1C=C(C#N)C(=O)Nc1sc2c(c1C#N)CCCC2 2313630934 WRVVLVGWBIWTMT-UHFFFAOYSA-N 442.338 4.815 50 10 IJGE Cc1nc(Br)c([C@H](Br)c2ccc(F)c(Br)c2)n1C 2315595642 JZBWPOFFJUSZDC-SNVBAGLBSA-N 440.936 4.877 50 10 IJGE CCOc1cc(C=NNC(=O)Nc2cccc(Cl)c2)cc(Br)c1OC 2318418299 VZRQQWDSGBDKMN-UHFFFAOYSA-N 426.698 4.665 50 10 IJGE COc1cc(C=NNC(=O)c2cccc(N)c2)ccc1OCc1ccc(Cl)cc1Cl 2323211688 UKXVFOZKBWEFBO-UHFFFAOYSA-N 444.318 4.927 50 10 IJGE COC(=O)c1ccccc1NC(=O)C(C#N)=CN(Cc1ccccc1)Cc1ccccc1 2325191568 SPZMEERXSYXOBN-UHFFFAOYSA-N 425.488 4.522 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCCN(C(=O)OC(C)(C)C)CC(F)(F)C1 2328519272 PXEITPKJMYTBCA-HNNXBMFYSA-N 427.374 4.622 50 10 IJGE N#CC(=C(O)CCc1nc2ccccc2[nH]c1=O)c1nc(-c2c[nH]c3ccccc23)cs1 2331348525 FIOUBTULQOPGGT-UHFFFAOYSA-N 439.500 4.953 50 10 IJGE Clc1ccc(Br)cc1CN(CCCBr)C1CCOCC1 2381149060 GOODVCMKLXILMR-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE CC(C)CCOc1ccc(C(=O)NNC(=O)c2ccc(OCc3ccccc3)cc2)cc1 14036692 NHPDVXHOZMHOMM-UHFFFAOYSA-N 432.520 4.765 50 10 IJGE Cc1cccc(C)c1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cccc(F)c1 38678041 GGQWSMQDEFFEEV-XMMPIXPASA-N 444.462 4.645 50 10 IJGE O=C(NNc1ncnc(Oc2ccc3ccccc3c2)c1[N+](=O)[O-])c1cccc(Cl)c1 40586659 ASYRIPROQQVNBL-UHFFFAOYSA-N 435.827 4.741 50 10 IJGE COc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4ccc(C)cc4)c(C)c32)c1 40822391 LMNFKNQRZNLFDD-NHFJDJAPSA-N 431.492 4.628 50 10 IJGE O=C(COc1ccc(-c2ccccc2)cc1Br)N/N=C/c1ccccc1F 40902754 LTCJHNHWGBFXSF-ZMOGYAJESA-N 427.273 4.784 50 10 IJGE COc1cccc(/C=C(/C#N)C(=O)Nc2ccc3c(c2)OCCO3)c1OCc1ccccc1 96438820 RFXAKMHSBLINAO-ZHZULCJRSA-N 442.471 4.591 50 10 IJGE CC1=C(C#N)C(=O)N(C)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1c(C)cc(C)cc1C 101332182 VMRLRLHXTUERSU-LPYMAVHISA-N 436.515 4.687 50 10 IJGE COc1cc(/C=N\NC(=O)c2cccc(N)c2)ccc1OCc1c(Cl)cccc1Cl 169894089 PTQSQKGIXQXACA-ZRGSRPPYSA-N 444.318 4.927 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CCC(F)(F)[C@@H](CCl)C1 403995306 KQRCMBHCQLWTJI-VIFPVBQESA-N 431.502 4.548 50 10 IJGE CC(C)(C)N(CCCl)C(=O)c1cc(I)ccc1Br 690964481 BLYHDYRHAZMCSW-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE Cc1nc(CNC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)oc1-c1ccc(Cl)cc1 761766862 DCZCGJSIYMQQRV-UHFFFAOYSA-N 440.931 4.745 50 10 IJGE Cc1ccc(-n2ncc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c2C(C)C)cc1 799750477 CECPWTWFPIESPH-UHFFFAOYSA-N 427.430 4.952 50 10 IJGE CC(=NNC(=O)CC1(C)OCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(F)cc1)N2 1084651802 NQBYBKQTPVNRKE-CZSZKKDXSA-N 449.526 4.646 50 10 IJGE C=CCOc1ccc(/C=C\C(=O)NNC(=S)Nc2ccc(CCCC)cc2)cc1OC 1624319656 MUHYBPUGUAVJMF-PTNGSMBKSA-N 439.581 4.634 50 10 IJGE CCn1nc(C(F)(F)F)c2c1OC(N)=C(C#N)[C@H]2c1ccc(OCc2ccccc2)cc1 1865690264 NARPAOHKXKIOSC-GOSISDBHSA-N 440.425 4.719 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccccc2Cl)cc1 1865695273 NBKJABFOLADRGE-NRFANRHFSA-N 434.927 4.764 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccc(Cl)cc1 1865703774 FLIIZMYSZHRQMX-JOCHJYFZSA-N 434.927 4.900 50 10 IJGE CCOC(=O)N1CCc2cc(NC(=O)/C(C#N)=C/c3cccc(Br)c3)ccc21 1866131885 RTANVRMVPQGGFK-MHWRWJLKSA-N 440.297 4.514 50 10 IJGE COc1ccc(C2CCN(C(=O)/C(C#N)=C/c3cccc(Br)c3)CC2)cc1 1866366340 ARUADIJFVZASGA-CPNJWEJPSA-N 425.326 4.771 50 10 IJGE COc1cc(/C(O)=C(\C#N)c2nc(-c3ccccc3OC)cs2)c([N+](=O)[O-])cc1OC 1872746990 JCPBSURCUCSCEZ-ZHZULCJRSA-N 439.449 4.694 50 10 IJGE CCOc1cc(/C=N/NC(=O)COc2ccccc2OC)ccc1OCc1ccc(C)cc1 1873497610 YLQGOOHFJXBDDQ-JVWAILMASA-N 448.519 4.510 50 10 IJGE Cc1cc(=O)oc2cc(OCC(=O)N/N=C/c3ccc(-c4ccccc4Cl)o3)ccc12 1873793945 NUZGJWYOKLNXNL-BRJLIKDPSA-N 436.851 4.544 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)c1ccc(S(C)(=O)=O)cc1F 1915322283 LFECYSYJACPBKW-LJQANCHMSA-N 428.367 4.655 50 10 IJGE CN(Cc1ccc(Br)cc1Br)C1(CCBr)CC1 2015868192 QVNJWURUPCNNRC-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE O=C(N[C@H]1CC[C@H](CBr)C1)c1c(Br)cccc1Br 2033091275 OYFCYVDNKOTMNP-IUCAKERBSA-N 439.973 4.505 50 10 IJGE O=C(NC[C@H]1CC[C@H](Br)C1)c1c(Br)cccc1Br 2033093808 KNILKWLWOKKOQH-IUCAKERBSA-N 439.973 4.505 50 10 IJGE CCC[C@@H](CBr)CNC(=O)c1cc(Br)ccc1Br 2057120169 OCOGDJZLARCGQB-VIFPVBQESA-N 441.989 4.753 50 10 IJGE Brc1cc2c(cc1[C@@H](Br)C1CC(Br)C1)OCCO2 2076167452 MTSYOYXQEHAIQW-ROKYYSGWSA-N 440.957 4.830 50 10 IJGE C[C@]1(CBr)CC(F)(F)CN1C(=O)c1cc(Br)c(Cl)s1 2115939675 GXSCCXPJLDJPFJ-SNVBAGLBSA-N 437.531 4.799 50 10 IJGE Br[C@@H]1CC[C@@H]2CCN(Cc3ccc(I)cc3)C[C@@H]2C1 2139246754 BLAOYMLCRIAQHS-QLFBSQMISA-N 434.159 4.677 50 10 IJGE Cn1nc([C@H](Br)c2cc3c(cc2Br)OCC3)c(Cl)c1Cl 2150719720 DUSAETPPFLYUEB-SNVBAGLBSA-N 440.950 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCC[C@H]2NC(=O)[C@@H](Br)C2CCCC2)CC1 2167050734 NUUJFNUNSSFKGI-SJORKVTESA-N 443.426 4.626 50 10 IJGE CN(C[C@H](Cl)C1CCCC1)C(=O)c1ccc(I)c(Cl)c1 2167648490 WJSYBIBRFOHVND-ZDUSSCGKSA-N 426.125 4.814 50 10 IJGE Clc1c(Br)ccc(CBr)c1N1CCS[C@@H]2COCC[C@@H]21 2170504235 LKMRAOBXQAVOJG-NWDGAFQWSA-N 441.616 4.708 50 10 IJGE C[C@@H](Br)CN(c1ncc(Br)cc1Br)C1CCC1 2250508773 DJDKHSKEJWSCAH-MRVPVSSYSA-N 426.978 4.749 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CC(C)(C)CO2)cc1I 2257354095 JQRFIDSNDGQKRN-STQMWFEESA-N 425.104 4.551 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@@H](Br)CC12CCC2 2285847050 WCEMVYDSAJJUKL-QMMMGPOBSA-N 425.523 4.774 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@H](Br)[C@H]2CC[C@@H]21 2285962985 KJBUCHVNRRJHQB-CERSQZSQSA-N 425.523 4.630 50 10 IJGE CC1(C)[C@@H](CBr)CCN1C(=O)c1cc(Br)c(F)cc1Cl 2285967646 XNDUPJRLSCUIDD-MRVPVSSYSA-N 427.539 4.877 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)Nc2ccc(O)cc2)cc(Br)c1OC(C)C 2297533935 CHWFTMUAYFOCQW-UHFFFAOYSA-N 445.313 4.886 50 10 IJGE F[C@]1(CNCc2ccc(I)c(Br)c2)C[C@H](CCl)C1 2325203314 CUWJFVQFRQSJCR-GSJFWJNXSA-N 446.529 4.500 50 10 IJGE C[C@@H]1CN(Cc2cc(I)ccc2Cl)[C@H](C)C[C@H]1Br 2327404740 KJQTTWXXKLHBPM-GIPNMCIBSA-N 442.566 4.938 50 10 IJGE COCCOc1ccc(C=C(C#N)C(=O)Nc2ccc(OCc3ccccc3)cc2)cc1 2331122867 WHFIDXMGTLHKHF-UHFFFAOYSA-N 428.488 4.836 50 10 IJGE CN(C[C@]1(CBr)CC1(F)F)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 2351892388 OQZVVZFMXHEACQ-CRAIPNDOSA-N 433.337 4.605 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@H](CN(C[C@H](CBr)c3ccccc3)C1)C2 2358295459 UXQKOFLOTUNIDG-JLMWRMLUSA-N 437.422 4.934 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@@H]1C[C@@H]2CBr 2359285851 SNYCUBXSGZLNGL-RBDZCENOSA-N 425.523 4.630 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)CN(C)S(=O)(=O)c1ccc(Br)s1 2365906938 FOQAEJJTTXCQDM-GFCCVEGCSA-N 447.258 4.577 50 10 IJGE CCCCCOc1ccccc1C(=O)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1 14035841 QVOSWPGDMIEAMX-UHFFFAOYSA-N 445.519 4.583 50 10 IJGE O=C(/C=C\c1ccc(Cl)cc1Cl)NNC(=O)C(c1ccccc1)c1ccccc1 96577545 TVSQWGMIUISAHV-OWBHPGMISA-N 425.315 4.986 50 10 IJGE O=C(NC1(CBr)CCCC1)c1cc(Br)sc1Br 232475969 UMFFIHZSBVOJQO-UHFFFAOYSA-N 446.002 4.711 50 10 IJGE CCCCOc1ccc(OCC(=O)NN=Cc2ccc(OC(=O)c3ccccc3)cc2)cc1 254840385 JUUZPCXGGMCJNW-UHFFFAOYSA-N 446.503 4.614 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@@H](c2ccc(Br)c(F)c2)C1 382702511 PSRWPHABJLKSKN-VXGBXAGGSA-N 437.147 4.934 50 10 IJGE Cc1ccc(O[C@@H](C)C(=O)NN=Cc2c(O)ccc3ccccc23)c(Br)c1 585656591 RDJGOFUKUFPKJR-AWEZNQCLSA-N 427.298 4.534 50 10 IJGE CC(C)N(Cc1cc(Cl)ccc1I)C[C@@H](C)Br 691366228 QBGRYDSQFIOAHG-SNVBAGLBSA-N 430.555 4.938 50 10 IJGE O=C(NCCCCCCBr)c1scc(Br)c1Br 705399476 KFNGOEVLNZJPRA-UHFFFAOYSA-N 448.018 4.958 50 10 IJGE Clc1ccc(N2CC[C@@]3(CN(Cc4ccccc4)CCO3)C2)c(CBr)c1 717596568 YRJDMPDAKNVSBW-OAQYLSRUSA-N 435.793 4.716 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)NNc1ccc(C#N)cc1C(F)(F)F)O[C@@H](C)C2 799746461 LSRPWNHGOFZLJF-YLQAJVPDSA-N 445.441 4.546 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCc3ccccc32)c(-c2ccccc2)n1 914469770 GWVQJMSMFSLULK-MWLMUJSGSA-N 435.531 4.607 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2cc(C)n(-c3ccccc3C)c2C)cc1 1084396472 GYILDGDQNBHWHI-RUZDIDTESA-N 433.552 4.765 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3cc4c(nc3O)CCCC4)c2C)cc1 1527719307 ZKTTUJPGYTXDDX-MOSHPQCFSA-N 442.519 4.628 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@H]2c1ccc(OC(C)C)c(OC)c1 1865697548 WGTIFXAMXJWNAE-JOCHJYFZSA-N 444.535 4.974 50 10 IJGE Cc1ccc(-c2ccc(C(=O)Oc3cccc4c3C(=O)OC4=O)c(C(F)(F)F)n2)cc1 1865788933 XLWARUKKGAUERN-UHFFFAOYSA-N 427.334 4.606 50 10 IJGE CC[C@@](C)(NC(=O)[C@H](c1ccc(OC)cc1)C(C)C)C(=O)Nc1ccc(SC#N)cc1 1866978899 GDLSPVIGACSGMO-XUZZJYLKSA-N 439.581 4.932 50 10 IJGE CN(N[C@H]1CCCN(C(=O)OC(C)(C)C)C12CCCCC2)C(=O)OCc1ccccc1 1903413984 VSWPHNCJJYGIFU-FQEVSTJZSA-N 431.577 4.862 50 10 IJGE CC[C@H](C)[C@H](Br)CNC(=O)c1cc(Br)sc1Br 1942803849 SBPVWAFOUSKZOW-POYBYMJQSA-N 448.018 4.813 50 10 IJGE Brc1ccc(Br)c(C[C@H]2CCOCC[C@@H]2Br)c1 2006499064 HWGYORZNZLLSPA-RNCFNFMXSA-N 426.974 4.944 50 10 IJGE O=C(N[C@H](CCBr)C1CC1)c1cccc(Br)c1Br 2031481743 KRYMYKLDVIIDCQ-LLVKDONJSA-N 439.973 4.505 50 10 IJGE O=C(CBr)c1ccc(I)c(C(F)F)c1C(F)(F)F 2060392915 XYNMJFBZSOLZGG-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE O=C(CBr)c1cc(C(F)F)c(I)c(C(F)(F)F)c1 2060393890 RIILHDBVOSKCLM-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE BrC[C@H]1C[C@@]2(CCN2Cc2cc(Br)ccc2Br)C1 2061795973 FPFUSELTOWUTKU-YPFXGUDJSA-N 438.001 4.961 50 10 IJGE C=CC[C@@H](CBr)CNC(=O)c1ccc(Br)cc1Br 2082056032 SWJVCFCDRMEZHX-VIFPVBQESA-N 439.973 4.529 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@H]2C[C@H](Cl)CC[C@H]2C1 2093941791 CGMSJIGVAJJYCE-DJLDLDEBSA-N 427.589 4.753 50 10 IJGE C[C@@H]1C[C@@H](C)N(C(=O)OC(C)(C)C)CCN1C[C@H](CBr)c1ccccc1 2108184600 DUVXXECVPAMGHM-LMMKCTJWSA-N 425.411 4.885 50 10 IJGE O=C(Nc1cccc(CBr)c1)c1cc(I)ccc1F 2113356677 XHLJCKLJXUOQHO-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1ccc(Br)cc1F 2117891663 AITPBODYJLNTST-JTQLQIEISA-N 442.110 4.702 50 10 IJGE Cc1c(CCl)cc(Cl)cc1S(=O)(=O)N(Cc1ccccc1)C[C@@H]1CCCO1 2152214886 LHKJSIGTVSWTMT-IBGZPJMESA-N 428.381 4.757 50 10 IJGE O=C(N1CCC[C@@H]([C@@H]2CCCCN2CC2(CBr)CCCC2)C1)C(F)(F)F 2163064098 SONMOPHCHVLDGL-CVEARBPZSA-N 439.360 4.597 50 10 IJGE CC1(C)CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@H]1CBr 2282983351 PHHMJBSCZNDVQK-QMMMGPOBSA-N 427.539 4.735 50 10 IJGE O=S1(=O)CCC[C@@H]1[C@@H](Cl)c1ccc(OCc2ccccc2)cc1Br 2299534085 ZWKSZACDBTWOJG-MSOLQXFVSA-N 429.763 4.885 50 10 IJGE CCOc1cc(C=NNC(=O)Cc2cc(Cl)ccc2SCC)cc(Cl)c1O 2323681140 HVFPVFMVNNIAMQ-UHFFFAOYSA-N 427.353 4.903 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(OCc2cc(C(C)(F)F)ccn2)C1 2381515448 PPASWEHHDBJDLJ-IBGZPJMESA-N 449.336 4.875 50 10 IJGE CCCCCCOc1ccccc1C(=O)NNC(=O)COc1ccc([C@@H](C)CC)cc1 7659985 NFTIKYOQVAOVNJ-IBGZPJMESA-N 426.557 4.999 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2F)ccc1OCc1ccccc1 33344065 YRPOVSVMWNOLLT-WQRHYEAKSA-N 447.422 4.867 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C/c2ccc(Cl)cc2)c(OCC)c1 40867228 GGYUGVSNOGUHNJ-NQSLGWDZSA-N 425.868 4.828 50 10 IJGE N#C/C(=C/c1cn(Cc2cccc(Cl)c2)c2ccccc12)C(=O)NCc1ccccn1 96438642 WLJQOTAKECAQKT-UYRXBGFRSA-N 426.907 4.961 50 10 IJGE O=S(=O)(NC[C@@H]1CCCC[C@H]1Cl)c1c(Cl)cc(Br)cc1Cl 96873178 FHEPLKSZQNGDRC-WCBMZHEXSA-N 435.598 4.832 50 10 IJGE COc1ccc([C@H](C(=O)NC2CCCC2)N(Cc2ccccc2Cl)C(=O)CCl)cc1 97915045 QFUHMQHFULUQKP-JOCHJYFZSA-N 449.378 4.716 50 10 IJGE O=S(=O)(c1c(Cl)cc(Br)cc1Cl)N1CCC[C@@H]1CCCCl 109648065 BQXUNIZWCKUIMF-JTQLQIEISA-N 435.598 4.928 50 10 IJGE O=C1NCCc2ccc([C@@H](Br)c3cccc(Br)c3Cl)cc21 228453368 QGZKVFNCTFCDPO-CQSZACIVSA-N 429.539 4.873 50 10 IJGE O=C(NN=Cc1ccccc1OCc1ccccc1)C(=O)Nc1ccc(Cl)c(Cl)c1 252621745 NFXPFOOGEVGHDO-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE CC(=NNC(=O)CSc1nc2ccccc2n1Cc1ccc(C)cc1)c1ccc(O)cc1 254836845 PMOGFUWJEKNLQI-UHFFFAOYSA-N 444.560 4.731 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2ccc(Br)cc2F)[C@@H](CBr)C1 382701729 OWVVUSAQDFMDSU-GWCFXTLKSA-N 437.147 4.934 50 10 IJGE COc1ccc([C@H](Br)c2sccc2I)c(F)c1 383340021 XIHYQCSMINJFRL-NSHDSACASA-N 427.076 4.985 50 10 IJGE C[C@H](Br)C[C@@H](C)CNC(=O)c1cc(Br)cc(Br)c1 397814907 FGPLPCLPGXVHLS-BDAKNGLRSA-N 441.989 4.751 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1C(=O)c1cc(Br)cc(Br)c1 399422262 NXMHRTWTIIXULN-SCZZXKLOSA-N 439.973 4.600 50 10 IJGE CN(Cc1cc(Cl)ccc1I)[C@H]1CCC[C@@H]1Br 709295044 BMXSNFKIMQDHLG-AAEUAGOBSA-N 428.539 4.692 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@H]2CC[C@H](Cl)[C@H]1C2 721564265 XNXPMPYYCXHVCX-FKTZTGRPSA-N 427.589 4.895 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NCCCn2ccc3ccccc32)c(-c2ccccc2)n1 914462632 BCWFAJRMUCOXLQ-NKFKGCMQSA-N 448.530 4.532 50 10 IJGE C/C(=C/c1ccncc1)C(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 1124293767 FTKNZYNHUKHCLA-PEZBUJJGSA-N 437.952 4.892 50 10 IJGE CCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccc(O)cc1)C(C#N)=C(N)O2 1865684666 VHJGHLVQMZBUMM-IBGZPJMESA-N 441.318 4.724 50 10 IJGE CC(C)Cn1nc(C(F)(F)F)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(C(F)(F)F)cc1 1865710719 GBUWZXDPKZWOOO-ZDUSSCGKSA-N 430.352 4.795 50 10 IJGE O=S(=O)(c1ccsc1Cl)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915188134 WHZSQHDFJMTLMJ-AWEZNQCLSA-N 434.808 4.766 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)N(C[C@H](CBr)C1CCC1)CCO2 1966311889 FYLWNSNQHVJIQU-KRWDZBQOSA-N 439.394 4.721 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](Br)[C@H](OCc2cc(Cl)cc(Cl)c2)C1 1992070467 BHFJZLIEIMWCPP-UONOGXRCSA-N 425.150 4.893 50 10 IJGE CCC[C@@H](Br)CCNC(=O)c1ccc(Br)cc1Br 2029925089 WWFWUTRSKZEURQ-SECBINFHSA-N 441.989 4.895 50 10 IJGE CCC[C@@H](CBr)CN1CCC[C@@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2044705212 JMDAWTFBGTZACO-XJKSGUPXSA-N 431.337 4.719 50 10 IJGE CC(C)[C@H](Cl)c1cn(-c2cc(Br)ccc2I)nn1 2057428277 ZONKODQAXXNEQZ-LBPRGKRZSA-N 440.510 4.570 50 10 IJGE CCOc1ccccc1Cn1nc(CCl)c(I)c1C(F)(F)F 2079210175 KPHADZPOTKCPMK-UHFFFAOYSA-N 444.622 4.692 50 10 IJGE C[C@@H]1CC[C@H](CBr)CN1Cc1ccc(I)c(Cl)c1 2086662700 WTROMBPZCPPNDX-ZYHUDNBSSA-N 442.566 4.940 50 10 IJGE O=S1(=O)CCCC[C@@H]1[C@H](Br)c1cc(Br)c(Cl)cc1F 2097835182 QNFJLAFNPLOEGB-VXGBXAGGSA-N 434.552 4.645 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C(F)(F)F)N(C[C@H](CBr)C2CCC2)CC1 2106786981 WVGOPAOENYQNGZ-LSDHHAIUSA-N 443.348 4.671 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)C2CCC2)C[C@@H]1CC(F)(F)F 2119514970 MXRNDGGGSFXHMR-CABCVRRESA-N 443.348 4.671 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Cl)c1cn(C)nc1Br 2138256101 RRNUULNCLRBGPS-JTQLQIEISA-N 428.939 4.935 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CC[C@H](CCl)C(F)(F)C1 2146383465 OIYNBDJILSOHLH-MRVPVSSYSA-N 431.502 4.548 50 10 IJGE Cc1cccc(C(=O)N2[C@H]3CCC[C@H](Br)[C@H]2CC3)c1I 2154106433 PJJGSOKCPDVFSC-FPMFFAJLSA-N 448.142 4.520 50 10 IJGE CC(C)N(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2167033293 QLHRXIWRFWWMNI-MSOLQXFVSA-N 445.442 4.967 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)ccc2n1C[C@H]1COCCN1Cc1ccccc1 2194650111 QAWZYXLPUJGHTQ-QAPCUYQASA-N 448.792 5.000 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CC[C@H](OC)C2)cc1I 2257356079 RDQTWSOMVPSYSR-OLUVUFQESA-N 425.104 4.551 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CCO[C@H](C)C2)cc1I 2257365329 QNBRUDDEYHKCLH-PUYPPJJSSA-N 425.104 4.551 50 10 IJGE CC(C)(C)OC(=O)NCC1CCS(=O)(=NCCCCCCCBr)CC1 2263154799 USAOUCBEGHIWTL-UHFFFAOYSA-N 439.460 4.735 50 10 IJGE CC(C)(C)OC(=O)N1CC[S@](=O)(=NCCCCCCCBr)C(C)(C)C1 2263164086 CXFXGPMWHRGIHS-RUZDIDTESA-N 439.460 4.829 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@H]2[C@@H]3CCOC[C@H]32)c1 2263519220 OVIPCZRMKQZRID-YIYPIFLZSA-N 438.985 4.800 50 10 IJGE CO[C@@H]1C[C@]2([C@H](Br)Cc3cc(Br)cc(Br)c3)C[C@@H]12 2263525615 NZUWAWAFMZHAHD-REWJHTLYSA-N 438.985 4.943 50 10 IJGE COc1ccc2nc(C(C#N)=Cc3ccc(OCc4cccc(C(=O)O)c4)cc3)[nH]c2c1 2297375854 SPQYAXVAUICUEC-UHFFFAOYSA-N 425.444 4.913 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@@H](CC2CC2)C2CC2)C1 2303848994 FURHZPMZBIWNQO-LPHOPBHVSA-N 449.373 4.786 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)CC1(CCl)CC1 2306224416 PYAODWRSWWKSEB-UHFFFAOYSA-N 428.539 4.505 50 10 IJGE CC1=C(C#N)C(=O)N(CCc2ccccc2)C(=O)C1=CNc1ccc(Cl)cc1Cl 2314579351 QJBUNKFPFOQJOL-UHFFFAOYSA-N 426.303 4.741 50 10 IJGE CCOc1cc(C=NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OCc1cc(C)ccc1C 2322975176 WWLKRBKQWJPUSI-UHFFFAOYSA-N 447.491 4.953 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2CO[C@]3(C)C[C@H]2C3)cc1I 2337698263 SCOSUPAKLAPCAC-UOVKNHIHSA-N 437.115 4.551 50 10 IJGE C[C@@H]1CCC[C@@H](CO[C@@H](CI)c2cccc(Br)c2)O1 2338704613 FLBQMECFUHCNDM-UGFHNGPFSA-N 439.131 4.899 50 10 IJGE COc1c(Br)cc(C)c([C@H](Cl)C(C)(C)S(C)(=O)=O)c1Br 2365223699 QAAGRJOLJRQJSA-LBPRGKRZSA-N 448.604 4.632 50 10 IJGE ClCCCN(Cc1ccc(I)c(Cl)c1)C1CCOCC1 2381142428 CZWSFDZYQBRKCD-UHFFFAOYSA-N 428.141 4.555 50 10 IJGE CCOc1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(C(=O)O)cc3)c2C)cc1 2237381 UPDXXLDIHPORPO-XSFVSMFZSA-N 429.476 4.737 50 10 IJGE CCOc1cc(/C=C2/C(=O)N(C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(Cl)cc1 38603044 SINDULGOFAHLIR-YBFXNURJSA-N 436.895 4.540 50 10 IJGE Cc1ccc(-n2nc(C)c(/C=N/NC(=O)CSCc3ccccc3Cl)c2C)cc1 59160610 ZJUGXDPPPPDEDO-WYMPLXKRSA-N 426.973 4.834 50 10 IJGE CC[C@@H](Br)CCNC(=O)c1cc(Br)ccc1Br 161243076 ASWRPWPNVQTCPJ-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE COc1cc(/C=N/NC(=O)c2cc3ccccc3n2C)ccc1OCc1ccccc1F 169926225 PRCQHEWMIUIQLE-JFLMPSFJSA-N 431.467 4.669 50 10 IJGE CC(C)COc1cccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4O)nc3c2)c1 169926515 ZLYMLSKAWWZHIQ-VULFUBBASA-N 428.492 4.734 50 10 IJGE CC[C@@H](CBr)N(C)C(=O)c1cc(Br)sc1Br 382170668 LFWJCGGUEYWDON-LURJTMIESA-N 433.991 4.519 50 10 IJGE CCCc1nn(Cc2ccc(C)cc2)c2c1[C@@H](c1ccc(O)c(OCC)c1)C(C#N)=C(N)O2 1865681713 ULCZDVJKMSEVSE-QHCPKHFHSA-N 444.535 4.515 50 10 IJGE CCCc1nn(CC)c2c1[C@@H](c1ccc(OCc3ccccc3)c(OC)c1)C(C#N)=C(N)O2 1865687479 SEOPRADLNSEXSP-QHCPKHFHSA-N 444.535 4.661 50 10 IJGE COc1ccc(-c2nn(Cc3ccc(C)cc3)c3c2[C@@H](c2ccco2)C(C#N)=C(N)O3)cc1 1865698158 LTOTYYVDBQVXDL-JOCHJYFZSA-N 438.487 4.727 50 10 IJGE CC(C)N1C[C@H](/C(O)=C(\C#N)c2nc(-c3ccc(Br)cc3)cs2)CC1=O 1872746586 OLPRDXVNNTUPER-ZLMULJHYSA-N 432.343 4.622 50 10 IJGE O=C(N[C@@H](CCl)[C@H]1CC=CCC1)c1cc(Br)c(Br)s1 1885070348 VOKSSLRTKOORED-WPRPVWTQSA-N 427.589 4.967 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)c1nccn2nc(C(F)(F)F)cc12 1915087385 UWPZTDBPEUMAGZ-ZDUSSCGKSA-N 427.268 4.928 50 10 IJGE Cc1cc(Br)sc1[C@@H](Br)c1cc(Br)n(C)n1 1939458948 QUDFKSOPNHRWOW-VIFPVBQESA-N 428.975 4.799 50 10 IJGE Clc1cc(CN2CCC[C@@H](CBr)C2)ccc1I 2026562229 ZEIMHYOHDQRYAQ-NSHDSACASA-N 428.539 4.552 50 10 IJGE CC(C)(C)CN(Cc1ccccc1)S(=O)(=O)c1cc(CBr)ccc1F 2059264771 KMJGWHKVGUFUKJ-UHFFFAOYSA-N 428.367 4.958 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H]3CC(Br)C[C@H]3C2)c1 2065402934 MBGFNMKKEMSYOC-UWVGGRQHSA-N 440.550 4.550 50 10 IJGE C[C@@H]1CCN(C[C@H](CBr)c2ccccc2)[C@@H](CNC(=O)OC(C)(C)C)C1 2106783320 ZAFIGGFRNDOXRH-NZSAHSFTSA-N 425.411 4.790 50 10 IJGE Brc1ccc(Br)c([C@H](Br)[C@H]2CCn3ncnc3C2)c1 2108964068 ANFWJJNSZCVDGW-ISVAXAHUSA-N 449.972 4.502 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1ccc(F)cc1Br 2117894807 MTZICYYPUPMELD-SNVBAGLBSA-N 442.110 4.702 50 10 IJGE CC[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1N(C)C(=O)c1ccc(CBr)cc1 2163625856 VVDMIQSFOSACDZ-WMZOPIPTSA-N 439.394 4.689 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1cc(F)cc(C(F)(F)F)c1 2181745568 CWBUZLBPNATWNY-UHFFFAOYSA-N 428.517 4.840 50 10 IJGE ICCCCCN1CCC[C@]2(CCN(Cc3ccccc3)C2)C1 2211184583 DZVKDZGSGWOJFL-FQEVSTJZSA-N 426.386 4.580 50 10 IJGE CC[C@H]1CN(CCCCCI)[C@H](CC)CN1C(=O)OC(C)(C)C 2211186074 NMBIUTJIEXVITN-CVEARBPZSA-N 438.394 4.702 50 10 IJGE Cc1cc(Br)c(C(=O)NC[C@@]2(CBr)C[C@@H]2C(F)(F)F)s1 2237621435 HMKSZNOOWWOHOK-KWQFWETISA-N 435.103 4.512 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1[C@H](CBr)NC(=O)OC(C)(C)C 2241493229 KWZHFAIHISXCKP-JYJNAYRXSA-N 449.430 4.804 50 10 IJGE CC(C)CN(C[C@@H](C)Cl)c1ncc(I)cc1Br 2250503797 MAHKTNFORBCIGJ-SECBINFHSA-N 431.543 4.538 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCCCN2CC2(CBr)CC(F)C2)CC1 2265632649 OVOBRFCDKMCDAA-UHFFFAOYSA-N 433.406 4.755 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2CCCOC2(C)C)cc1I 2269551547 ABLLCMYCZVMHMD-BXUZGUMPSA-N 439.131 4.941 50 10 IJGE O=C(N[C@@H]1CC[C@@H]2C[C@@]21CBr)c1cc(Br)c(F)cc1Cl 2285963917 RAVSBVAIYTZLSY-QVCNTJRGSA-N 425.523 4.535 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)Nc2nccs2)c(Br)cc1OC(C)C 2295672675 OOQIFYVRNYXIQV-UHFFFAOYSA-N 436.331 4.637 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@@H]2CCCC[C@@H]3C[C@H]32)C1 2302671916 NZXLAHCKYVTIQQ-YKTARERQSA-N 449.373 4.786 50 10 IJGE CCO[C@@H]1[C@@H](Br)C[C@@H]1OCc1cc(Br)cc(Br)c1 2315453499 NBHVLZBTPOGWEY-RWMBFGLXSA-N 442.973 4.669 50 10 IJGE CN(CC[C@@H](Br)c1cccs1)c1ccc(I)cn1 2318121121 VZHGUBQRNZJDBI-LLVKDONJSA-N 437.144 4.710 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc1OC 2323607550 OHGUYXDLSUGYCT-UHFFFAOYSA-N 426.542 4.625 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1cc(F)c(F)c(OC)c1F 2336103409 DRJHPUQSPFICBY-CYBMUJFWSA-N 430.264 4.928 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc2c(c1)CCN(C[C@]1(CBr)CC1(F)F)C2 2351888400 HCBIZZOUBLPMSZ-GOSISDBHSA-N 431.321 4.812 50 10 IJGE CC(C)CO[C@@H]1[C@@H](Cl)C[C@H]1OCc1cc(I)ccc1Cl 2380343035 OWBMMHKZDWFKQE-RRFJBIMHSA-N 429.125 4.882 50 10 IJGE CC[C@H](C)c1ccc(OCC(=O)NNC(=O)[C@H](C)Oc2ccccc2[C@@H](C)CC)cc1 9873896 RCXUKSVJHCWPPQ-FHWLQOOXSA-N 426.557 4.707 50 10 IJGE COc1ccc(/C(C)=N/NC(=O)COc2ccc(C(C)(C)C)cc2Br)cc1 12403467 WESIEUMPNWZVGY-OEAKJJBVSA-N 433.346 4.674 50 10 IJGE C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)c1ccc(OCc2ccccc2)cc1 14665984 XDZAIGXHNJBHTG-IBGZPJMESA-N 446.547 4.792 50 10 IJGE Cc1ccc(C)c(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2[N+](=O)[O-])c1 40592179 FJNGAZPBOGQLSA-UHFFFAOYSA-N 447.282 4.809 50 10 IJGE COc1ccc(C(=O)N/N=C/C=C(/C)CCC=C(C)C)cc1I 59449447 FKNXGOPXHPSHSN-MCXKGUMDSA-N 426.298 4.708 50 10 IJGE Cn1c2ccccc2n2c(C(=O)C(Br)Br)c(-c3ccccc3)nc12 101051430 BRYBZIINQNBOFG-UHFFFAOYSA-N 447.130 4.792 50 10 IJGE COCCCN1C(=O)C(C#N)=C(C)/C(=C\Nc2ccc(/N=N/c3ccccc3)cc2)C1=O 101233651 LCQKJECQONDHEU-DVLQTGRYSA-N 429.480 4.643 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Br)Cc3cccc(Cl)c3)cc2[nH]1 109884459 ODNULYYMUMWNKX-NSHDSACASA-N 430.527 4.951 50 10 IJGE C[C@@H]1CN(C(=O)c2ccc(Br)c(C(F)(F)F)c2)CC[C@@H]1Br 167753331 YXDZJCVAIVJALK-KCJUWKMLSA-N 429.074 4.713 50 10 IJGE N#C/C(=C/NC1CCN(Cc2ccccc2)CC1)C(=O)Nc1ccc(Cl)cc1Cl 217178058 ZYXJKSYNQFLJLH-VKAVYKQESA-N 429.351 4.594 50 10 IJGE CN([C@H]1CCCC[C@H]1Cl)S(=O)(=O)c1c(Cl)cc(Br)cc1Cl 252935027 WWBVDWNYBQLRGV-SKDRFNHKSA-N 435.598 4.926 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(CSc3ccccc3)cc2)cc(OC)c1OC 254444557 PVRWOWNJZJVGMT-UHFFFAOYSA-N 436.533 4.769 50 10 IJGE CC(=NNC(=O)c1cc(-c2ccc(OCc3ccc(C)cc3)cc2)n[nH]1)c1cccc(O)c1 254703341 SHDUSWALYYODQL-UHFFFAOYSA-N 440.503 4.824 50 10 IJGE COc1cc(Br)ccc1[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CBr 382681380 BIZZBRQVLVNZQA-BXUZGUMPSA-N 449.183 4.803 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CI)[C@H](c2ccc(F)cc2Cl)C1 382698207 MHYCZJPFNBNGNO-GXFFZTMASA-N 439.696 4.865 50 10 IJGE CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](O)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 616591411 YFXHWMFAYWHGCE-MOUTVQLLSA-N 444.644 4.896 50 10 IJGE C[C@H]1CCCN(c2ncc(Br)cc2Br)[C@H]1CBr 688692181 GRNFRGCEBPAZGE-KWQFWETISA-N 426.978 4.606 50 10 IJGE CC[C@@H](Br)CCCNC(=O)c1scc(Br)c1Br 705441569 IXGZIPJEDMHXOO-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE Clc1ccc(I)c(CN(CCBr)CC2CC2)c1 708431068 OYZLSAYJJNGMBK-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE Clc1ccc(I)c(CN2CCCC[C@H](CBr)C2)c1 711319417 KRIWWRCSRWWOMI-LLVKDONJSA-N 442.566 4.942 50 10 IJGE Clc1ccc(I)c(CN2CCCC[C@@H](CBr)C2)c1 711319424 KRIWWRCSRWWOMI-NSHDSACASA-N 442.566 4.942 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2ccc(OCc3ccccc3)cc2)cc1 1084588170 PABYZRPXJGATLQ-VWLOTQADSA-N 432.520 4.628 50 10 IJGE C=CCc1cc(CNC(=O)/C(C#N)=C\c2cc(C)n(CC(C)C)c2C)cc(OC)c1OC 1264831297 SGWHKAAZJUUHRQ-QRVIBDJDSA-N 435.568 4.730 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCc3cc4ccccc4nc3O)c2C)c1 1586632876 GDRZVZMUZMHDOX-HMAPJEAMSA-N 436.515 4.880 50 10 IJGE COc1ccc(/C(C#N)=C/c2cccc(OC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)c2)cc1 1615066837 SVMUYPBKHVBTKE-GIJQJNRQSA-N 445.387 4.795 50 10 IJGE Cc1ccc(O)c([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2cccc(Cl)c2)c1 1865686889 DLEFQWQYEDYPEG-MRXNPFEDSA-N 446.816 4.777 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2-c1ccccn1 1865691198 MHFRPRJNWPULJE-HSZRJFAPSA-N 447.498 4.717 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1ccc(Br)cn1 1915288689 MCTWJBRGUANZLH-QGZVFWFLSA-N 440.179 4.906 50 10 IJGE C[C@@H](Br)CN(Cc1ccc(Br)cc1Br)C1CC1 1943857121 CLEVGVLVFAZWQZ-SECBINFHSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]3(CC[C@H](CI)O3)C[C@H]21 1979566488 JXTHQTSGRCEHRL-ADAWSYLGSA-N 435.346 4.539 50 10 IJGE Fc1cc(Br)cc(N2CCC=C(Br)C2)c1CBr 2004045012 ATQGPKFCSCXKHW-UHFFFAOYSA-N 427.937 4.972 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1Cc1ccc(Br)cc1Br 2018114578 GDYLARCLVJXEGU-ZANVPECISA-N 425.990 4.959 50 10 IJGE BrC[C@@]1(Cc2cc(Br)ccc2Br)C[C@]12CCOC2 2054720902 ZYXFZFAZPQZGMP-UONOGXRCSA-N 438.985 4.946 50 10 IJGE C=CCC[C@H](CBr)NC(=O)c1cc(Br)ccc1Br 2075328765 JFDAYRCXOIQOIT-SNVBAGLBSA-N 439.973 4.671 50 10 IJGE CCc1nc(Br)c(Br)n1CCCc1nc(CCl)cs1 2087650272 GCPWAYAMYMMJGL-UHFFFAOYSA-N 427.593 4.799 50 10 IJGE O=C(NC[C@@H]1C[C@H](Cl)C12CCC2)c1cc(Br)c(Br)s1 2115599234 LWKJSPVXUCRVMM-XVKPBYJWSA-N 427.589 4.801 50 10 IJGE CN([C@@H]1CC[C@@H]1OCc1ccccc1)S(=O)(=O)c1cc(F)c(Cl)c(CCl)c1 2156441238 FFEGKLOHYBIMNL-MSOLQXFVSA-N 432.344 4.586 50 10 IJGE CC1(C)CC[C@H](NC(=O)[C@H](Br)C2CCCC2)[C@H](CNC(=O)OC(C)(C)C)C1 2167032406 MQALBXVXYOQHIY-YESZJQIVSA-N 445.442 4.776 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C(=O)[C@@H](Br)C2CCCC2)Cc2ccccc21 2167033093 LXKWTHIITBKNDI-MSOLQXFVSA-N 437.378 4.548 50 10 IJGE Cc1c(Cl)cc(C(=O)N2CC(F)(F)C[C@@H]2CBr)cc1Br 2167387296 FXVLVFNIPJIEMC-SECBINFHSA-N 431.502 4.656 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@H](CNC(=O)[C@H](Br)C1CCCC1)c1ccccc1 2175021217 UENZEMKJRKETQC-ZWKOTPCHSA-N 439.394 4.665 50 10 IJGE COC(=O)[C@H](Br)C1(Oc2c(Cl)cc(Br)cc2Cl)CCC1 2203006349 FGPQBIZJXRQKER-NSHDSACASA-N 446.950 4.994 50 10 IJGE C[C@@H]1C[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)[C@@H](C)N(C(=O)OC(C)(C)C)C1 2209050760 TWZCUAFNUVUMFF-KBXIAJHMSA-N 435.403 4.556 50 10 IJGE Cc1cc(Br)c([C@H](Br)C2(S(C)(=O)=O)CC2)c(C)c1Cl 2224316188 BCLAUGDTJMSDJS-LBPRGKRZSA-N 430.589 4.733 50 10 IJGE Cc1c(Br)sc(C[C@@H](CBr)NC(=O)OC(C)(C)C)c1C 2241392354 MCVXPUULXAMVOJ-JTQLQIEISA-N 427.202 4.958 50 10 IJGE CCC12COC([C@H](Br)c3ccc(OC)c(I)c3)(C1)C2 2269539280 CYDLMDFOVWXKKS-WLYUNCDWSA-N 437.115 4.695 50 10 IJGE O=C(N[C@H]1C[C@H]2C[C@H]1C[C@H]2Br)c1cc(F)c(Br)cc1Cl 2282978153 JUORDSVHTGFGKE-HQSAUTQVSA-N 425.523 4.533 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCC[C@@H](CBr)CC1 2282982716 LNOODWZOMDPNSS-SECBINFHSA-N 427.539 4.879 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@@H](Br)C2(CC2)C1 2285959182 SQQQJZWCRFGLMC-GFCCVEGCSA-N 425.523 4.631 50 10 IJGE CCCn1c(C)cc(C=C(C#N)C(=O)OCC(=O)c2cc(C)n(-c3cc(C)on3)c2C)c1C 2297356612 NLLZJYLMVUOQOU-UHFFFAOYSA-N 448.523 4.552 50 10 IJGE C[C@H]1[C@H](C)N(c2ncc(Br)cc2Br)CC[C@H]1Br 2304182218 JUICMIGICUVHSS-OYNCUSHFSA-N 426.978 4.605 50 10 IJGE CC(C)[C@H](CCl)N(C)Cc1ccc(I)c(Br)c1 2306219048 HWALWRYMURGVQA-ZDUSSCGKSA-N 430.555 4.749 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)NN=Cc1ccccc1Br 2321242870 GVYXGUJDKBABQW-UHFFFAOYSA-N 430.252 4.862 50 10 IJGE COc1ccc(C=C(C#N)C(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1 2324474700 KTBNCSMJWVGJFS-UHFFFAOYSA-N 437.543 4.536 50 10 IJGE Cn1cc(I)c(CC2(CBr)CC3(CC(C)(C)C3)C2)n1 2341759453 ABLRJXUWJCBYBG-UHFFFAOYSA-N 437.163 4.549 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)NCC(C)(C)[C@@H](Br)C(C)C 2365859392 APHOHAWREYEPAJ-LBPRGKRZSA-N 447.258 4.543 50 10 IJGE Cc1cc(I)ccc1NC(=O)/C(C#N)=C\Nc1cccc(Cl)c1 217253903 HKKXACOBWRVNOK-BENRWUELSA-N 437.668 4.711 50 10 IJGE O=C(NN=C[C@@H]1CC=CCC1)c1ccc(CN2c3cccc4cccc(c34)S2(=O)=O)cc1 254703935 XNCVPDMKJWUVKF-GOSISDBHSA-N 445.544 4.621 50 10 IJGE Brc1ccc([C@H]2CC[C@H](CI)O2)cc1Br 306380989 ROYVKSLATFYQIG-LDYMZIIASA-N 445.920 4.867 50 10 IJGE COC[C@@H](O[C@H](CI)c1ccccc1Br)C(C)C 404098857 CETVZCLLSJIIMQ-ZIAGYGMSSA-N 427.120 4.613 50 10 IJGE O=[N+]([O-])c1c(OCc2ccccc2)ccc(I)c1CBr 694948749 QZYRRABPZRNPII-UHFFFAOYSA-N 448.054 4.673 50 10 IJGE C[C@H](Br)C[C@@H](C)CNC(=O)c1scc(Br)c1Br 705442275 NNDMZUUTLIBDNU-RQJHMYQMSA-N 448.018 4.813 50 10 IJGE C[C@@H](Br)[C@H]1CCN(C(=O)c2cc(Br)sc2Br)C1 719965783 CBXNUAWTXBTBSE-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE CCCc1nc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)nn1-c1ccccc1Cl 799750193 YSLXCRCWOJVKSH-UHFFFAOYSA-N 448.836 4.521 50 10 IJGE Cc1ccoc1CN(C)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 817026481 FHRQFLXRDMSXJK-PDGQHHTCSA-N 433.899 4.584 50 10 IJGE CCCOc1c(Br)cc(Br)cc1C=NNC(=O)c1ccccc1 916248595 HGWWXDFTDWIRMQ-UHFFFAOYSA-N 440.135 4.764 50 10 IJGE CC(=O)Nc1ccc(C(C)=NNC(=O)CSC2c3ccccc3-c3ccccc32)cc1 1084026538 WFOJKAZLSFTFFV-UHFFFAOYSA-N 429.545 4.988 50 10 IJGE CC(=O)CCc1ccc(O[C@H](C)C(=O)NNc2ccc(Cl)c(C(F)(F)F)c2)cc1 1639947794 FBCCLAYSDIUDGI-CYBMUJFWSA-N 428.838 4.791 50 10 IJGE Cc1ccccc1COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3C)cc1 1865703188 PJADNFHEOMXUHE-GOSISDBHSA-N 440.425 4.545 50 10 IJGE CCCC[C@H](NC(=O)c1nc(C2CC2)n2ccccc12)C(=O)Nc1ccc(SC#N)cc1 1866859532 JJHNOODTJUFKRG-IBGZPJMESA-N 447.564 4.712 50 10 IJGE Brc1ccc(I)cc1SC[C@H]1C[C@H]1Br 1887827951 NKNNJJRXDPQJNP-HZGVNTEJSA-N 447.961 4.929 50 10 IJGE Cc1c(Br)sc([C@@H](Cl)[C@H]2CCCS(=O)(=O)C2)c1Br 1922912351 MJDBMHWMFALOLV-CBAPKCEASA-N 436.618 4.686 50 10 IJGE C[C@@H]1C[C@H](CBr)CN1Cc1c(Br)cccc1Br 1950540218 YYQOBJIWVGDHDX-NXEZZACHSA-N 425.990 4.817 50 10 IJGE C[C@H]1C[C@@H]1N(CCBr)Cc1ccc(I)c(Cl)c1 2026563362 JISYQLMFZPPKNE-ZANVPECISA-N 428.539 4.550 50 10 IJGE CN(C(=O)c1c(Br)cccc1Br)[C@@H]1CCC[C@@H]1Br 2033088314 GYKXYQLAIJFBGH-GZMMTYOYSA-N 439.973 4.600 50 10 IJGE C[C@H]1CN(C[C@@H](CBr)c2ccccc2)C[C@@H](C)N1C(=O)OCc1ccccc1 2044701309 VDAANXGEJYEOPT-XQBPLPMBSA-N 445.401 4.897 50 10 IJGE CC(C)[C@@H]1[C@@H](Br)CCN1Cc1cc(Cl)ccc1I 2062184839 WQCBHMWTGUSQBC-GXTWGEPZSA-N 442.566 4.938 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3CC(Br)C[C@@H]3C2)c1 2065402933 MBGFNMKKEMSYOC-NXEZZACHSA-N 440.550 4.550 50 10 IJGE C[C@@H](CCBr)CCN1CCCC[C@@H]1C(F)(F)CNC(=O)OC(C)(C)C 2065451878 DSWSWUCTXXUITD-LSDHHAIUSA-N 427.374 4.812 50 10 IJGE CC(C)(C)OC(=O)N1CCC12CCS(=O)(=NCC1(CBr)CCCC1)CC2 2106781681 KDBGLKWAPXPMSK-UHFFFAOYSA-N 449.455 4.583 50 10 IJGE O=[N+]([O-])c1ccc(CBr)c(Oc2cccc(I)c2)c1 2120383113 FCQCBJOYJWROLE-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE COCCCCN(Cc1ccccc1)S(=O)(=O)c1cc(CBr)ccc1C 2123198360 CEYCVYMKZOELQE-UHFFFAOYSA-N 440.403 4.507 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@H]1[C@H]2C[C@@H]3[C@H]1[C@@H]3C2 2134581732 JNXUHLJRJVSLGQ-FWLHEXGQSA-N 431.111 4.564 50 10 IJGE C[C@@]1(CBr)CC(F)(F)CN1C(=O)c1ccc(Cl)c(Br)c1 2159051522 YZPXQXZDADZZBX-LBPRGKRZSA-N 431.502 4.737 50 10 IJGE CCN(CC)S(=O)(=O)C[C@@H](Br)c1cc(Cl)c(C)c(Br)c1 2167378209 VARCYCSYMKTEDE-GFCCVEGCSA-N 447.620 4.519 50 10 IJGE CCN(C(=O)OC(C)(C)C)c1ccc(CNC(=O)N2CCC(Br)CC2)cc1 2176853837 MPDXRYHTAOCCKD-UHFFFAOYSA-N 440.382 4.517 50 10 IJGE Cc1ccc(C(=O)N2[C@H](CBr)CCC23CCC3)cc1I 2232825010 DXJVMSOALFARRZ-ZDUSSCGKSA-N 448.142 4.522 50 10 IJGE COc1ccc(CBr)c(N(C)[C@@H]2C[C@@H]3C[C@@H](OCc4ccccc4)C[C@H]32)n1 2239875664 BEQCAULSAXHUSB-MTQWCTHYSA-N 431.374 4.805 50 10 IJGE CCCCc1ccc([C@H](Br)c2cnn(C)c2I)s1 2253421608 CXWDXRNDZTWKGM-GFCCVEGCSA-N 439.160 4.913 50 10 IJGE COc1ccc([C@H](Br)C[C@H]2CC[C@@H](C)O2)cc1I 2257353797 IWANRXZLKQXHHW-YUSALJHKSA-N 425.104 4.693 50 10 IJGE O=C(N[C@H](CCl)C1CCCCC1)c1ccc(Cl)c(I)c1 2283663573 NSVMKTIKHZSPCO-CQSZACIVSA-N 426.125 4.862 50 10 IJGE CC(C)[C@H](CBr)N(C)C(=O)c1cc(Br)c(Br)s1 2302553603 NQIHGYNTQQGYDU-QMMMGPOBSA-N 448.018 4.765 50 10 IJGE CC(C)(C)[C@]1(CBr)CCN(Cc2sccc2I)C1 2316762696 TWSQATLWDQMTOC-AWEZNQCLSA-N 442.204 4.986 50 10 IJGE Cc1ccc(C=NNC(=O)CSc2nc(O)c3c(-c4ccccc4)csc3n2)cc1 2320486467 YRSRSLAWTKSRBH-UHFFFAOYSA-N 434.546 4.615 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)CCN3C(=O)c4ccccc4C3=O)n2)cc1C 2331259190 XSHWLZFQCRXIQE-UHFFFAOYSA-N 445.500 4.606 50 10 IJGE C[C@@H](CCBr)CCN1C[C@@H](NC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2331633124 STLZHRWOFRZHEM-YTQUADARSA-N 425.411 4.790 50 10 IJGE C[C@H](O[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1Br)c1cccc(OC2CC2)c1 2342607119 MKUQEYWXNKMOAK-VHSSKADRSA-N 426.351 4.688 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CN(C[C@]2(CBr)CC2(F)F)c2ccccc21 2379986455 RMEVYPDIFDNBIC-IFXJQAMLSA-N 445.348 4.925 50 10 IJGE Cc1ccc(C)c(NC(=O)CCC(=O)N/N=C/c2ccc(OCc3ccccc3)cc2)c1 12577282 SHLJATGOOGAXEM-WPWMEQJKSA-N 429.520 4.751 50 10 IJGE Cc1c(C(=O)NCc2ccccc2Cl)oc2c1/C(=N/NC(=O)Cc1ccccc1)CCC2 40815649 QITHLELALJDPJC-VFCFBJKWSA-N 449.938 4.571 50 10 IJGE CCOc1ccc2ccccc2c1/C=N/NC(=O)COc1ccc(Br)c(C)c1 40912177 AXDCEWRMSVAXHH-ZMOGYAJESA-N 441.325 4.839 50 10 IJGE C[C@H](Br)c1ccccc1NC(=O)c1ccccc1I 125453123 VVOFEDKATQALSI-JTQLQIEISA-N 430.083 4.999 50 10 IJGE O=C(N/N=C\c1cc(Cl)c(O)c(Cl)c1)c1ccc2[nH]c(Cc3ccccc3)nc2c1 169925798 WAWPBANUEUUEMJ-ROTLSHHCSA-N 439.302 4.930 50 10 IJGE O=C=NC[C@@H]1CCC[C@H](CNC(=O)N2CCC(c3cc4cc(Cl)ccc4[nH]3)CC2)C1 170288668 JDNVHLFPNWZRHW-SJORKVTESA-N 428.964 4.853 50 10 IJGE COc1ccc(OCCN/C=C(/C#N)C(=O)Nc2ccccc2Sc2ccccc2)cc1 217243852 GAWFAZFRTDUYGY-HNENSFHCSA-N 445.544 4.861 50 10 IJGE C[C@H](CBr)CCCNC(=O)c1ccc(Br)cc1Br 228274024 LKWNMLWULRZBAS-VIFPVBQESA-N 441.989 4.753 50 10 IJGE CCCO[C@H]1[C@@H](Oc2ccc(Br)cc2Br)C[C@H]1Br 233240712 BNMCYLXNMXOXPO-KGYLQXTDSA-N 442.973 4.921 50 10 IJGE CCCCCCCCCCCCCC(=O)NCC(=O)NN=Cc1cccc([N+](=O)[O-])c1 254439680 WZLQDWLTOQAAQA-UHFFFAOYSA-N 432.565 4.862 50 10 IJGE CCO[C@@H](CO[C@H](CI)c1ccccc1Br)C1CC1 703472115 VSLHKMRHWNFGOM-CABCVRRESA-N 439.131 4.757 50 10 IJGE COc1ccc([C@H](CNC(=O)NNc2cccc(F)c2F)c2c[nH]c3ccccc23)cc1 745270469 CHHBVDCEYXQXJT-SFHVURJKSA-N 436.462 4.913 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NCCCSc2ccccc2)c(-c2ccccc2)n1 914461270 BUTWOHZEFFZEJJ-FXBPSFAMSA-N 441.560 4.669 50 10 IJGE CC(=O)CCC(C)(C)C(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12 1540614110 VPGBDJJTGBYDGT-UHFFFAOYSA-N 437.927 4.712 50 10 IJGE COCCCN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)CCCC[C@H]1CCSS1 1614472314 YNUNLQRCFFUJHD-PCCBWWKXSA-N 428.708 4.830 50 10 IJGE C#CCOc1ccc(F)cc1NC(=O)NNc1cc(C(F)(F)F)ccc1Br 1669537527 XRFIRMIFYNMWCN-UHFFFAOYSA-N 446.198 4.768 50 10 IJGE Cc1ccc(C)c(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2O)CCC3)c1 1772751473 COOKRRMCKRCUIT-UHFFFAOYSA-N 431.492 4.633 50 10 IJGE CCCc1nn(CC)c2c1[C@H](c1ccc(OCc3ccccc3)c(OC)c1)C(C#N)=C(N)O2 1865687478 SEOPRADLNSEXSP-HSZRJFAPSA-N 444.535 4.661 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@H]1c1cccs1 1865698251 OIJRDMNGGHQYBK-CQSZACIVSA-N 436.846 4.883 50 10 IJGE COc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc3ccccc23)c1OC 1865701194 OTJZCXUIUWFWNX-HSZRJFAPSA-N 438.487 4.569 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccc(Cl)cc2)cc1 1865712975 NHPXWIGHIYGKNH-MRXNPFEDSA-N 446.816 4.771 50 10 IJGE CCCOc1ccc(/C=N\NC(=O)c2ccc(-c3cccc(OC)c3)nc2C)cc1OC 1865760683 KIBGTVGMYAAQTN-QQXSKIMKSA-N 433.508 4.627 50 10 IJGE COc1cc(C)c(-c2csc(/C(C#N)=C(\O)CN3C(=O)c4ccccc4C3=O)n2)cc1C 1872758133 MVRPZRQYGWXGGQ-ZZEZOPTASA-N 445.500 4.524 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CCCCCBr)OCc2ccccc2)C1 1880639798 PIHTXLBSGRNZAY-UHFFFAOYSA-N 427.383 4.605 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)C(=O)c1cc(O)cc(Br)c1 1914646856 TUNYCFVKBBTDFV-LBPRGKRZSA-N 427.136 4.581 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1cc(Br)ccc1O 1915079543 CXDLTNNAJUQQQI-CQSZACIVSA-N 441.163 4.971 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@H]1CCCC[C@@H]1C(F)(F)F 1916349718 VXADKJXIXMQIQQ-ULQDDVLXSA-N 436.312 4.794 50 10 IJGE C[C@H](CCBr)N(C)C(=O)c1scc(Br)c1Br 1917083390 BHPQKZQDBJMSPU-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE O=S1(=O)CC[C@H]([C@H](Br)c2c(Cl)sc(Br)c2Cl)C1 1925570088 AYWSGRDPSPNCHS-NJGYIYPDSA-N 443.009 4.688 50 10 IJGE C[C@@H]1CCC[C@](CI)(OCCOCCOCc2ccccc2)C1 1983390000 OJTGTPNGDIIKLD-MJGOQNOKSA-N 432.342 4.620 50 10 IJGE FC1(F)C[C@@]1(Br)COc1cccc(CBr)c1Br 2023782087 KGQSAFVXHDYOFU-SNVBAGLBSA-N 434.900 4.896 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)[C@H]1CCC[C@H]1Br 2026567340 QZWAONXCSMUUCF-MFKMUULPSA-N 428.539 4.692 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CCCC[C@@H]1CBr 2033094877 RHVRFHPFEUAUPO-SECBINFHSA-N 439.973 4.601 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCC(F)(F)[C@@H](CCl)C1 2093942621 WNBFFDURCBTIND-LURJTMIESA-N 437.531 4.609 50 10 IJGE CC(C)[C@H](Br)C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C2(CCCCC2)C1 2106203419 HLYXNYPMODREHZ-HOTGVXAUSA-N 431.415 4.625 50 10 IJGE C[C@H](CCBr)CCN=[S@@](=O)(CCNC(=O)OC(C)(C)C)c1ccccc1 2107394619 MJRUWDAVNONEMZ-AKJBCIBTSA-N 447.439 4.849 50 10 IJGE CN(Cc1ccccc1)[C@]1(Cn2c(CCl)nc3cc(Br)ccc32)CCOC1 2155118474 YVGNRXTWRWZFCU-NRFANRHFSA-N 448.792 4.829 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)c1ccc(NC(=O)N2CCC(Br)CC2)cc1 2162486471 ALUUEBPGWMRXHQ-UHFFFAOYSA-N 440.382 4.838 50 10 IJGE Cc1cc(CBr)ccc1N1CCOCC12CCN(Cc1ccccc1)CC2 2163144774 AGJYPZIGXYHANM-UHFFFAOYSA-N 429.402 4.761 50 10 IJGE C[C@]1(CC(CBr)(CBr)c2ccc(Cl)cc2)COCCO1 2174172919 ZLOWVEAABXRNHK-AWEZNQCLSA-N 426.576 4.563 50 10 IJGE C[C@H]1CN(c2cc([N+](=O)[O-])ccc2CBr)[C@H](C)[C@@H](C)N1Cc1ccccc1 2176905495 XPTQDWDJIQBONV-GVDBMIGSSA-N 432.362 4.977 50 10 IJGE O=C(c1c(Cl)cccc1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Br)C2 2190671295 RDZJFVJFFRRGEV-XSIYEUOJSA-N 425.523 4.581 50 10 IJGE Cc1cc(C(=O)NC[C@]2(CBr)C[C@H]2C(F)(F)F)sc1Br 2192584299 XCUJDRPXMQVMEO-LDYMZIIASA-N 435.103 4.512 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@H](CNC(=O)OC(C)(C)C)CC1CCCCC1 2196907219 OWCWBHWREAIJEH-BZSNNMDCSA-N 445.442 4.730 50 10 IJGE BrCC1CCC2(CC1)CCN(C[C@H]1CC1(Br)Br)C2 2218005978 KILXYBKGPDURFZ-OTTFEQOBSA-N 444.049 4.770 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@@H]1CC2(CCCC2)CCN1C(=O)OC(C)(C)C 2237000487 DFMUNNQMUSCUJB-ULQDDVLXSA-N 443.426 4.578 50 10 IJGE CN(Cc1ccccc1I)C[C@@H](CBr)c1ccccc1 2280348523 AJGCQYYROUHOHZ-MRXNPFEDSA-N 444.154 4.902 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@H](Br)CCC12CC2 2285956945 CHOBDBPXBKIKOC-MRVPVSSYSA-N 425.523 4.774 50 10 IJGE N#CC(=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 2297551407 IEDJXBCWXXHFFU-UHFFFAOYSA-N 438.783 4.962 50 10 IJGE CC(C)(CI)CN1CCC[C@]2(CCCN(Cc3ccccc3)C2)C1 2306809666 LMWLMEGUVJVBNH-NRFANRHFSA-N 440.413 4.826 50 10 IJGE Clc1ccc(I)c(CN2CC[C@@H](Br)[C@@H]3CC[C@@H]32)c1 2310807794 SUBUTDZJHCNAMM-SCRDCRAPSA-N 440.550 4.692 50 10 IJGE N#CC(=CNCc1cccc(Br)c1)C(=O)Nc1cc(Cl)ccc1Cl 2324392457 DTDCGGLKKFCTOW-UHFFFAOYSA-N 425.113 4.892 50 10 IJGE COc1ccc([C@H](C)NC(=O)C(C#N)=CN(c2ccccc2)c2ccc(N)cc2)cc1OC 2325045267 IDQUXMWUQJQGSS-SFHVURJKSA-N 442.519 4.709 50 10 IJGE CC(C)(C)OC(=O)NCCN(C[C@@]1(CBr)CC1(F)F)C1CCCCC1 2326918839 FRSDPVYHRFDKFX-KRWDZBQOSA-N 425.358 4.566 50 10 IJGE COc1ccccc1-c1csc(C(C#N)=C(O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)n1 2331282334 GEASZDMEXGXSLO-UHFFFAOYSA-N 438.421 4.893 50 10 IJGE CCCN(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@]1(CBr)CC1(F)F 2351892359 ODQGRJZWKPKWSW-MAUKXSAKSA-N 439.385 4.766 50 10 IJGE CC1(C)CC[C@H](CCl)N(C(=O)c2ccc(Cl)cc2I)C1 2365588665 MONLGXVVDRQJDB-LLVKDONJSA-N 426.125 4.814 50 10 IJGE Cn1cc(I)c(C[C@@H]2CCCc3ccccc3[C@H]2Br)n1 2367611721 RDPKIVBQZSTVBR-LRDDRELGSA-N 445.142 4.656 50 10 IJGE CC(C)[C@H]1C[C@H](Br)CN1C(=O)c1cc(F)c(Br)cc1Cl 2370880530 WUHQBDOZULQYNP-ISVAXAHUSA-N 427.539 4.876 50 10 IJGE CCOC(=O)c1ccc(OCC(=O)N/N=C/c2c3ccccc3cc3ccccc23)cc1 14027137 YVTCORPVCSXPQC-JVWAILMASA-N 426.472 4.699 50 10 IJGE CC(C)OC(=O)c1ccsc1NC(=O)/C(C#N)=C/c1c(F)c(F)c(F)c(F)c1F 20549839 BZZWUYHRYNZDAG-VMPITWQZSA-N 430.354 4.554 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)CCCOc2ccc(Cl)cc2)cc1 40990213 BCXYCKRGZGZNNV-KNTRCKAVSA-N 440.927 4.928 50 10 IJGE COc1ccc([C@@H](C(=O)NC2CCCCCC2)N(Cc2cccs2)C(=O)CCl)cc1 97914998 JMYTTYQOIRDOFF-QFIPXVFZSA-N 449.016 4.904 50 10 IJGE Cc1ccc(C[C@@H]2S/C(=C(\C#N)C(=O)N3CCC(C)CC3)N(c3ccccc3)C2=O)cc1 102438090 HTQCWUCIEFHFOG-GPSDDGMOSA-N 445.588 4.680 50 10 IJGE O=[N+]([O-])c1ccc(C[C@H](Br)c2ccccc2I)cc1 110298035 POXVPXWHDBRUHS-ZDUSSCGKSA-N 432.055 4.878 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(Br)c(Br)s2)CC[C@@H]1Br 167821175 YOSRXJCOZXOIOO-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE CCOc1ccc(Br)cc1C=NNC(=O)COc1ccc(Cl)cc1Cl 252621154 MUAHGYMOTVCJCJ-UHFFFAOYSA-N 446.128 4.684 50 10 IJGE CC[C@@H](Br)[C@@H](C)NC(=O)c1cc(Br)sc1Br 386686630 JLNRZDIQCFORCO-IYSWYEEDSA-N 433.991 4.565 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCC(F)(F)[C@@H](CCl)C1 404025742 RFYZMHDAYTXPEM-LURJTMIESA-N 437.531 4.609 50 10 IJGE C[C@H](CCl)[C@H]1CCCCN1C(=O)c1cc(Cl)ccc1I 696709567 BIHOPWFHQDBCTB-QMTHXVAHSA-N 426.125 4.814 50 10 IJGE CC[C@@](C)(CBr)NC(=O)c1scc(Br)c1Br 705517063 YCKNLALJJTYPQM-JTQLQIEISA-N 433.991 4.567 50 10 IJGE O=C(NN=Cc1c(C2CC2)nc2sccn12)c1ccccc1OCc1ccc(F)cc1 755506256 KBEQLJJHYHSQBJ-UHFFFAOYSA-N 434.496 4.755 50 10 IJGE CCOc1ccc(-c2nc(CC(=O)NNc3ccc(C#N)cc3C(F)(F)F)cs2)cc1 799747474 CBTGMQUVASDIMP-UHFFFAOYSA-N 446.454 4.785 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)OCc2cccc(C(=O)N(C)C)c2)c(C)n1-c1ccc(F)cc1 918956633 AEGXJZHDVOGKLY-HYARGMPZSA-N 445.494 4.585 50 10 IJGE COc1ccc(Cl)cc1-n1c(C)cc(C=NNC(=O)CC[C@@H](O)c2ccccc2)c1C 1084244779 ROECMROWHBBQCY-JOCHJYFZSA-N 439.943 4.720 50 10 IJGE COc1ccc(CSCC(=O)NN=Cc2cc(C)n(-c3ccccc3F)c2C)cc1 1084537485 NVXVOIRRKPTIQU-UHFFFAOYSA-N 425.529 4.625 50 10 IJGE Cc1cccc(-c2ccc(CNC(=O)NNC(=O)c3ccc(Br)cc3)cc2)c1 1329072613 AVWQPKOODLYTTA-UHFFFAOYSA-N 438.325 4.569 50 10 IJGE CC(=O)c1cc(NC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)ccc1C 1476801268 IZTGWWXFUQQQTJ-UHFFFAOYSA-N 438.487 4.879 50 10 IJGE COCCCN1C(=O)C(C#N)=C(C)/C(=C\Nc2ccc(N=Nc3ccccc3)cc2)C1=O 1772742764 LCQKJECQONDHEU-LIPVUHOBSA-N 429.480 4.643 50 10 IJGE CCOc1ccccc1C=NNC(=O)COc1cc(C)c(Cl)c(C)c1Br 1772756505 FSVSYLJEJHMTHW-UHFFFAOYSA-N 439.737 4.647 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccn2)cc1 1865694236 RMYMQNKTZDYHHM-JOCHJYFZSA-N 435.487 4.551 50 10 IJGE CC(C)[C@H](/C(O)=C(\C#N)c1nc(-c2ccccc2)cs1)N1C(=O)c2ccccc2C1=O 1872748038 FCDUNTZIKTYHAZ-HWCXCKHPSA-N 429.501 4.924 50 10 IJGE COc1cc(Br)ccc1C(=O)N(Cc1ccccc1)[C@H](C)CBr 1914215167 FUVGNJHHXWPEFV-CYBMUJFWSA-N 441.163 4.884 50 10 IJGE CC1([C@H](CBr)NCc2cccc(Br)c2Br)CC1 1945368344 JTFWSBVIUIUQGB-NSHDSACASA-N 425.990 4.865 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1ncc(Br)cc1F 1979831743 SKOZDJLRAGPCPT-LBPRGKRZSA-N 444.142 4.799 50 10 IJGE CC1(C)OCCO[C@@H]1[C@H](Br)c1cc(Br)c(Br)s1 2013745502 VHCSCDQSYQAIHJ-RKDXNWHRSA-N 449.002 4.903 50 10 IJGE CC[C@@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@@H]1Br 2026563378 JOBNCRMMKBCHIK-MNOVXSKESA-N 428.539 4.550 50 10 IJGE Clc1cc(C[C@@H]2CCOCC[C@@H]2Br)ccc1I 2026571285 YUQYUVSWUWHYIS-QWRGUYRKSA-N 429.523 4.677 50 10 IJGE CC(C)(C)N(CCBr)C(=O)c1c(Br)cccc1Br 2033091532 RTZZBTGLVJSWAF-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE O=C(CCl)c1c(I)cc(C(F)(F)F)cc1OC(F)(F)F 2055156798 ZITAXYHNRKORFE-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)n(C2CC2)c1 2059312851 QEOXXNFUGVSLMD-OAHLLOKOSA-N 425.392 4.707 50 10 IJGE FC(F)(F)c1cc(Br)cc(-n2nc3c(c2CBr)[C@@H]2C[C@@H]2C3)n1 2080641456 BQRYQACDYDTSFK-HTRCEHHLSA-N 437.057 4.603 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CC[C@@H](Cl)C(F)(F)CC1 2150504218 UDRZZVQNZPCDOW-SNVBAGLBSA-N 431.502 4.690 50 10 IJGE ClCc1nc2cc(Br)c(Cl)cc2n1Cc1cc(Br)no1 2159862648 ADXYYVGZNDHPFD-UHFFFAOYSA-N 439.922 4.990 50 10 IJGE C[C@H]1CCCC[C@@]1(CNC(=O)OC(C)(C)C)NC(=O)c1ccc(CBr)cc1 2162496108 XPSYWZFWGKUDRN-BTYIYWSLSA-N 439.394 4.785 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H](NC(=O)OC(C)(C)C)C[C@]12CCOC2 2163061697 HQWXLFJLCJWZFR-UTKZUKDTSA-N 447.458 4.726 50 10 IJGE CC(C)(C)OC(=O)N1CCc2cc(NC(=O)[C@H](Br)C3CCCC3)ccc2C1 2167033350 QUYBNPHWFGGCRJ-GOSISDBHSA-N 437.378 4.872 50 10 IJGE F[C@]12CCC[C@]1(CCl)CN(Cc1cc(Cl)ccc1I)C2 2176637282 UCUBAYSRZLIDNS-GJZGRUSLSA-N 428.116 4.878 50 10 IJGE FC(F)(F)[C@@H]1C[C@]1(CCl)CNCc1cc(Cl)ccc1I 2192573354 QHTIJTLCOYZJRT-NEPJUHHUSA-N 438.058 4.842 50 10 IJGE CC1(C)CN(c2ccc(CBr)c([N+](=O)[O-])c2)CCCN1Cc1ccccc1 2193719559 LPKNTZHKSDYQIF-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE C[C@H]1C[C@H](CCNC(=O)OC(C)(C)C)CCN1CCCCCI 2211188187 YQPKSAZTWFKYRF-JKSUJKDBSA-N 438.394 4.607 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@@H]1CCCCN1CC1(CBr)CC(F)C1 2265638095 IVCLMFUGKSZKMV-UUCFBXCCSA-N 443.348 4.514 50 10 IJGE CC(C)[C@H](CBr)N(C)C(=O)c1ccc(Br)cc1Br 2318853506 MQVRWQNFYUJVKW-LBPRGKRZSA-N 441.989 4.703 50 10 IJGE CCc1nn(CC)c(CN[C@@H](CCCl)COCc2ccccc2)c1Br 2320526936 GJPXCOWETBYBRP-INIZCTEOSA-N 428.802 4.532 50 10 IJGE Brc1cccc(CN2C[C@H]3CC[C@H]2[C@@H](Br)C3)c1Br 2325467160 XQHVOBQQDORORJ-XDTLVQLUSA-N 438.001 4.959 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)c2ccccc2Br)c(OCC)c1 40867189 NCQPKQCJGHWJQF-RVDMUPIBSA-N 444.281 4.537 50 10 IJGE C=CCc1cccc(/C=N/NC(=O)c2cccc(NC(=O)c3cccc(Cl)c3)c2)c1O 97729885 CESWOUAVIMPEQO-CVKSISIWSA-N 433.895 4.790 50 10 IJGE CNC(=O)/C(C#N)=C1\S[C@@H](Cc2ccc(Cl)cc2)C(=O)N1c1ccc(C(C)C)cc1 101240532 WXVDGBVENXTEGK-ZNCVUUBVSA-N 439.968 4.636 50 10 IJGE O=C(Nc1cccc(CBr)c1)c1ccc(F)cc1I 236180837 SYOIXIVLMABQLC-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE COc1ccc(-c2cc(C(=O)NN=Cc3ccc(-c4ccccc4)cc3)[nH]n2)cc1OC 254616414 OPKUJASQGCDTAL-UHFFFAOYSA-N 426.476 4.525 50 10 IJGE O=C(COc1ccc2ccccc2c1)NN=Cc1ccc(OC(=O)c2cccs2)cc1 254703152 OQTMSUGWBWLFOK-UHFFFAOYSA-N 430.485 4.650 50 10 IJGE CCCc1ccc(OCC(=O)NN=Cc2ccc(OC(=O)/C=C/c3ccccc3)cc2)cc1 263622530 PEZCYCWBWSKAEQ-ZDUPPTQKSA-N 442.515 4.787 50 10 IJGE O=C1Cc2cc([C@@H](Br)c3ccc(Br)o3)c(Br)cc2N1 302396087 OFTQFYGZIJNKPE-CYBMUJFWSA-N 449.924 4.784 50 10 IJGE C[C@H]1C[C@@H](CBr)CN(Cc2cc(Cl)ccc2I)C1 405311069 TWZOESHBFIOMKV-QWRGUYRKSA-N 442.566 4.798 50 10 IJGE O=C(c1ccc(OCc2ccccc2)cc1)N1C[C@@H](CBr)[C@H](C(F)(F)F)C1 709887214 HVKACYFSUASTLF-SJLPKXTDSA-N 442.275 4.911 50 10 IJGE O=C(Nc1cccc(CBr)c1)c1cccc(F)c1I 721656859 BFECPJUIRREPLG-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C(C)(C)c2cccc(C(F)(F)F)c2)c1C 769117930 SWJUNGSFMUOBMV-UHFFFAOYSA-N 429.446 4.595 50 10 IJGE Cc1ccc(OCc2nc(CC(=O)Oc3ccc([N+](=O)[O-])c4ncccc34)cs2)cc1 770130141 XREFFUCZVQBFJM-UHFFFAOYSA-N 435.461 4.635 50 10 IJGE Cc1ccccc1-n1ncc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1C(C)C 799751395 OFLNFSQFUSHCOO-UHFFFAOYSA-N 427.430 4.952 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2cc(Cl)ccc2OCc2ccccc2C#N)cc1 1084333055 TVXWGMVLBMTSSB-UHFFFAOYSA-N 433.895 4.953 50 10 IJGE CC1(C)CC(=O)c2cc(C(=O)N3CCC[C@H](O[Si](C)(C)C(C)(C)C)C3)c(O)nc2C1 1141846446 YNBSODLZJHNAQY-HNNXBMFYSA-N 432.637 4.569 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2ccc(Oc3ccc(Cl)cc3)cn2)c1C 1182729271 LGPJZFZUJCGZCT-UHFFFAOYSA-N 446.898 4.753 50 10 IJGE C=CCC1(NC(=O)CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)CCCC1 1300858345 GNCMLQMHNXKVJU-UHFFFAOYSA-N 435.684 4.958 50 10 IJGE C#Cc1ccc(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)c(Cl)c1 1558644163 XXGOHWOQPIIRHV-XMHGGMMESA-N 425.879 4.644 50 10 IJGE Cc1c(C(=O)NNc2nc3ccccc3[nH]c2=S)cnn1-c1cccc(C(F)(F)F)c1 1646013715 SIIDBNHRMACWSV-UHFFFAOYSA-N 444.442 4.562 50 10 IJGE CCOc1ccc(C=NNC(=O)CSc2nc(-c3ccccc3)cs2)cc1OCC 1772754939 AZBQEKGPPDPGAS-UHFFFAOYSA-N 441.578 4.850 50 10 IJGE CCCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(OC)cc2)cc1 1865690106 IUYSXWKXTBULEW-DEOSSOPVSA-N 444.535 4.977 50 10 IJGE C[C@@H](c1ccc(F)c(Br)c1)[C@H](CBr)NC(=O)OC(C)(C)C 1885093148 KWYIBMHSWPUJPS-ZANVPECISA-N 425.136 4.980 50 10 IJGE CCN(C[C@](C)(CI)O[C@H]1CC(C)(C)[C@H]1C)C(=O)OC(C)(C)C 1901847453 DXQSJPWYGIUVCF-DEYYWGMASA-N 439.378 4.888 50 10 IJGE COc1cc(C(=O)N(Cc2ccccc2)C[C@H](C)Br)ccc1Br 1989501478 LRCRKTHEMCZMRQ-ZDUSSCGKSA-N 441.163 4.884 50 10 IJGE CC[C@@H](C)[C@H](CBr)NCc1ccc(I)c(Cl)c1 2026564142 QJHDEJOJVYQEJR-RNCFNFMXSA-N 430.555 4.844 50 10 IJGE Brc1cccc(CN2C[C@H]3C[C@H]2CC[C@@H]3Br)c1Br 2031478460 RLBNWNRMUZBGSK-UTUOFQBUSA-N 438.001 4.959 50 10 IJGE CC(C)C[C@@H](CBr)NC(=O)c1c(Br)cccc1Br 2033092361 APKCPPYPUCDCBA-VIFPVBQESA-N 441.989 4.751 50 10 IJGE Clc1ccc(I)c(CC[C@@H](Br)CN2CCCC2)c1 2038107051 CJMBAVVUKRLUGP-GFCCVEGCSA-N 442.566 4.737 50 10 IJGE FC(F)c1cc(CBr)cc(I)c1Br 2054781026 JKXUTVWDUSHAJH-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE FC(F)Oc1ccc(CBr)c(OC(F)(F)F)c1I 2060221677 YVEWWODMKYSXTC-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE FC(F)Oc1c(OC(F)(F)F)ccc(CBr)c1I 2060222471 RBOKVYUJHVHQHV-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE Brc1cccc([C@@H](CI)OCCOC2CCCC2)c1 2087343490 CIJPYXUKQTULIU-OAHLLOKOSA-N 439.131 4.901 50 10 IJGE Cc1csc(C(=O)NC2(CCBr)CCSCC2)c1Br 2100809096 NXNDYFIABZBJSK-UHFFFAOYSA-N 427.227 4.600 50 10 IJGE CCN(CC(C)(C)CNC(=O)OC(C)(C)C)C(=O)c1ccc(CBr)cc1 2106653898 MDAKHFMLCPZXTB-UHFFFAOYSA-N 427.383 4.595 50 10 IJGE CC(C)(CCl)c1cn(-c2ccc(Cl)c(I)c2Cl)nn1 2108755678 PTAZDSIKJOLRGN-UHFFFAOYSA-N 430.504 4.695 50 10 IJGE Fc1ccc(I)cc1[C@H](Br)c1ccc2c(c1)CCO2 2113359220 ZGALKYBPINKXJB-OAHLLOKOSA-N 433.058 4.850 50 10 IJGE C[C@@H](CCBr)CCN1CCC(c2n[nH]cc2NC(=O)OC(C)(C)C)CC1 2129052655 AQRXJVNXNHEHIB-AWEZNQCLSA-N 429.403 4.747 50 10 IJGE BrCC1(CN2CCCN(Cc3ccccc3)CCOCC2)CCCCCC1 2144875379 ASDCOYKOTMBGHH-UHFFFAOYSA-N 437.466 4.946 50 10 IJGE CCCC(CBr)(CCC)CN(C)C1(CNC(=O)OC(C)(C)C)CCOCC1 2163064815 WFIZJDCGYMZWFZ-UHFFFAOYSA-N 449.474 4.974 50 10 IJGE Cc1cc(C(=O)N2CC[C@@](CBr)(C(F)(F)F)C2)c(Br)s1 2167679220 XFWSSPKJFRUNKA-NSHDSACASA-N 435.103 4.609 50 10 IJGE Fc1c(CN2CCC[C@H](OCCBr)C2)ccc(Cl)c1Br 2170215572 HBZMQXUPNMMJEI-NSHDSACASA-N 429.555 4.618 50 10 IJGE Cc1csc(C(=O)NC[C@]2(F)CC[C@@H](CBr)CC2)c1Br 2178580906 JEMJCFLUOPHTJK-WJONMLJTSA-N 427.177 4.842 50 10 IJGE COc1cc(Cl)c([C@H](Br)[C@@]23COC[C@H]2C3(F)F)cc1Br 2202364172 GSUBOJBUGZUWIJ-GRYCIOLGSA-N 432.486 4.829 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC2(CCC2)N(CCCCCI)C1 2211185926 SYJIBBHEFKVZJL-OAHLLOKOSA-N 436.378 4.504 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1 2242382839 LUAMZZPUMTWXFA-JHJVBQTASA-N 430.895 4.697 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)[C@H](C)C[C@H]1Br 2282974211 GAHOGMQXCMUXQX-NQMVMOMDSA-N 427.539 4.876 50 10 IJGE CC(C)(CCCl)C(=O)Nc1ccc(I)cc1Br 2300170943 UEAJPWUJUKFGMI-UHFFFAOYSA-N 430.511 4.647 50 10 IJGE C[C@H]1C[C@H]1N(CCBr)Cc1ccc(Cl)cc1I 2302324930 BSMCCQTUTHQNRY-TVQRCGJNSA-N 428.539 4.550 50 10 IJGE CC(C)(C)[C@@H](Cl)CNCc1ccc(I)c(Br)c1 2306220472 XXBYZLUZUGLCCK-LBPRGKRZSA-N 430.555 4.797 50 10 IJGE Clc1ccc(I)cc1CN[C@@H](CBr)C1CCC1 2307327759 FETKMFDWOWZBEN-ZDUSSCGKSA-N 428.539 4.598 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)CCCOc2ccccc2C)c(OCC)c1 2314736198 ZMOPNXKOYDBGLL-UHFFFAOYSA-N 437.492 4.628 50 10 IJGE CCO[C@H]1[C@@H](OCc2c(Br)cccc2Br)C[C@H]1Br 2318173535 XZDJUDNDRXNSEM-FRRDWIJNSA-N 442.973 4.669 50 10 IJGE CCOc1c(Cl)cc(C=NNC(=O)CSc2nc3ccccc3n2C)cc1Cl 2318413622 PMTOWWYRWHSZEW-UHFFFAOYSA-N 437.352 4.521 50 10 IJGE C[C@@]1(CBr)C=CCCN1Cc1ccc(Cl)cc1I 2318541467 UAPVXDLVCJHNEL-AWEZNQCLSA-N 440.550 4.860 50 10 IJGE N#CSc1ccc(NC(=O)C2CCN(C(=O)C=Cc3ccc(Cl)cc3)CC2)cc1 2321876787 CLNMBTXXSPBFOO-UHFFFAOYSA-N 425.941 4.804 50 10 IJGE C[C@@H](C(O)=C(C#N)c1nc(-c2ccc(F)cc2F)cs1)N1C(=O)c2ccccc2C1=O 2331286885 VXQSVOWKCKBUPC-NSHDSACASA-N 437.427 4.566 50 10 IJGE COc1cc(F)c(CO[C@H](CCl)[C@H](I)CCl)c(Cl)c1 2339215982 APDXMQLQNPEHMQ-VXGBXAGGSA-N 441.495 4.654 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Cl)[C@@H]1CCCS1(=O)=O 2339654369 SDIVHOIGKRCLAP-KWQFWETISA-N 434.552 4.516 50 10 IJGE COc1ccc([C@@H](Br)C23CC(C[C@@H](C)O2)C3)cc1I 2342244791 UOGAYOLPCKPSHU-OHGIUVIRSA-N 437.115 4.693 50 10 IJGE Fc1cc(Cl)c(Br)c(Cl)c1[C@H](Br)[C@@H]1CO[C@@H]2COC[C@@H]21 2360416737 BKIQVVPAIGSDQH-LIUHEQGWSA-N 448.941 4.992 50 10 IJGE COc1cc(CBr)cc(N(C)[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)n1 2364759135 CDVRTIVLQMHEHG-PMOLBWCYSA-N 430.390 4.617 50 10 IJGE O=C(COc1ccc(Br)cc1Cl)N/N=C/c1c(Cl)cccc1Cl 13977881 YBZJLTCRKOLENM-IFRROFPPSA-N 436.520 4.938 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)COc2ccccc2C(C)(C)C)cc1 14666863 KBVQVOKELGXEEG-UHFFFAOYSA-N 426.557 4.783 50 10 IJGE COc1ccc(-c2n[nH]cc2/C=N/NC(=O)c2ccc(-c3ccccc3)cc2)cc1OC 20259241 OHMAODVRLCRWIG-JVWAILMASA-N 426.476 4.525 50 10 IJGE CC1CCN(C(=O)/C(C#N)=C2/S[C@@H](Cc3ccc(F)cc3)C(=O)N2c2ccccc2)CC1 33931671 HZNQHBATLYLXQQ-SCIJIFGBSA-N 449.551 4.510 50 10 IJGE Cc1ccc(Cl)c(Oc2cc(N3CCN(C(=O)C(C)(C)CCl)[C@@H](C)C3)ncn2)c1 37356534 XYQQQALAGCBDKA-HNNXBMFYSA-N 437.371 4.533 50 10 IJGE Nc1c(NNC(=O)c2cccc(Cl)c2)ncnc1NN(c1ccccc1)c1ccccc1 40777861 JDXAQHRDIJXQFH-UHFFFAOYSA-N 445.914 4.634 50 10 IJGE COc1ccc([N+](=O)[O-])cc1-n1c(C)cc(/C=N/NC(=O)c2cc3ccccc3o2)c1C 59305258 NJGYUWBHCINXCS-ZMOGYAJESA-N 432.436 4.521 50 10 IJGE CC(C)NC(=O)c1cc2ccc(OC(=O)/C(C#N)=C\c3ccc(C(C)C)cc3)cc2oc1=O 206542998 XUTDLZOSJWSNQP-JAIQZWGSSA-N 444.487 4.567 50 10 IJGE CCOc1ccc(N/C=C(/C#N)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1OCC 217228819 TVHDXDVHMVWSCN-SEYXRHQNSA-N 430.848 4.504 50 10 IJGE Cc1cc(C=NNC(=O)COc2cccc3cccnc23)c(C)n1-c1ccc(Cl)cc1 252624527 PPSACNAPZFHSLR-UHFFFAOYSA-N 432.911 4.825 50 10 IJGE COc1cc(C)c(C=NNC(=O)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1C(C)C 254708778 WLBCEUILRJRLSP-UHFFFAOYSA-N 437.418 4.747 50 10 IJGE COc1cccc(C(C)=NNC(=O)CSc2nc3ccccc3n2Cc2ccccc2)c1 263628591 FCOPHHRVEARTKW-UHFFFAOYSA-N 444.560 4.726 50 10 IJGE CC1(CBr)CCN(c2ncc(Br)cc2Br)CC1 402974817 YZUTZUQZQKNWLV-UHFFFAOYSA-N 426.978 4.608 50 10 IJGE FC(F)(F)c1cc(CBr)cc(Br)c1I 575691719 NVRIXPBJOHTWBU-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE CC(C)CC(CBr)(CBr)Cc1cn(C)nc1Br 714082168 RZLHKYYTIKQBCN-UHFFFAOYSA-N 431.010 4.547 50 10 IJGE CCc1noc(COc2ccc(OC(=O)/C(C#N)=C\c3cc(C)n(CC(C)C)c3C)cc2)n1 741629138 VLNWRSCCAWBORD-NDENLUEZSA-N 448.523 4.798 50 10 IJGE C=C(CBr)COC(=O)CSc1nnc(-c2ccco2)n1C1CCCCC1 795555686 HMKIQWGCHYPGKV-UHFFFAOYSA-N 440.363 4.630 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccc(-n3ccc(C(F)(F)F)n3)cc2)c(C(F)(F)F)c1 799748214 OMOUPSDSSQZBKW-UHFFFAOYSA-N 439.319 4.538 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)N(C)C)cc(Br)c1OCc1ccccc1F 1084358884 VLMZEQWAZXSSLQ-CXUHLZMHSA-N 447.304 4.561 50 10 IJGE CCSc1cnc(O)c(C(=O)NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 1141392973 ONWBRKPORXSFIU-UHFFFAOYSA-N 425.354 4.694 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)Nc2ccc(-n3ccc(O)n3)cc2)c1C 1557737080 AIJMTSXYVNLAKX-QNGOZBTKSA-N 437.503 4.840 50 10 IJGE CC(=O)CCc1ccc(O[C@H](C)C(=O)NNc2ccc(Cl)cc2Br)cc1 1633950361 PKMPGCCOKIBUJX-CYBMUJFWSA-N 439.737 4.535 50 10 IJGE Cc1c(C(=O)NC2CCCC2)oc2c1C(=NNC(=O)c1cccc3ccccc13)CCC2 1772748589 RLTGKDOIOBYOSA-UHFFFAOYSA-N 429.520 4.884 50 10 IJGE CCCc1nn(-c2ccccc2Cl)c2c1[C@@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865709584 DEZPWONQKJIRIG-IBGZPJMESA-N 435.871 4.605 50 10 IJGE N#CSc1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)CCc2ccccc2F)cc1 1866597129 QUCQQJLBDANUEJ-HSZRJFAPSA-N 447.535 4.698 50 10 IJGE COc1ccc(OC)c(/C=C(\C#N)c2nc(-c3ccc(OC)c(OC)c3OC)cs2)c1 1872794874 AYKUFAYKAMUCCL-XNTDXEJSSA-N 438.505 4.917 50 10 IJGE CCn1cc(S(=O)(=O)N(Cc2ccccc2)Cc2ccccc2)cc1CBr 1882227105 UYEQNOTYFPVQTE-UHFFFAOYSA-N 447.398 4.794 50 10 IJGE CC(C)(C)OC(=O)NCCCCc1ccc(NC(=O)[C@H]2C[C@@H](Br)C2)cc1 1887748256 DPUTXVMWYDGZDA-IYBDPMFKSA-N 425.367 4.646 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1ncsc1Br 1915099678 WMGJORFUGIQUHV-LLVKDONJSA-N 432.181 4.722 50 10 IJGE CC1(C)CN(Cc2ccc(Br)cc2Br)[C@@H]1CBr 1944095734 MMXNMAVEOZHHHJ-GFCCVEGCSA-N 425.990 4.817 50 10 IJGE Brc1cccc(C[C@H]2CCOCC[C@H]2Br)c1Br 2001020154 AHVXOTBCMPQZEA-MWLCHTKSSA-N 426.974 4.944 50 10 IJGE O=C(N[C@@H](CCBr)C1CC1)c1cc(Br)cc(Br)c1 2029971696 MEROVYXBFZTDEV-LBPRGKRZSA-N 439.973 4.505 50 10 IJGE CCC(CC)(CBr)NC(=O)c1cccc(Br)c1Br 2031484400 BTYAENJYJMAZBA-UHFFFAOYSA-N 441.989 4.895 50 10 IJGE COC(=O)c1ccc(COc2ccccc2C=C(C#N)S(=O)(=O)c2ccc(C)cc2)cc1 2040457814 AFZKYGFTCXMNLA-UHFFFAOYSA-N 447.512 4.699 50 10 IJGE O=C(CCl)c1cc(C(F)(F)F)cc(OC(F)(F)F)c1I 2055151089 ZDPWMYQKIGBMPV-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE CC(C)[C@H](Br)c1cn(-c2ccc(I)cc2Cl)nn1 2057428472 BRUSKNFUDZZHGD-LBPRGKRZSA-N 440.510 4.617 50 10 IJGE CC(C)c1cc(-n2nc(CCl)c(I)c2C(F)(F)F)ccn1 2078890545 TVRYRVJTZQTWBL-UHFFFAOYSA-N 429.611 4.753 50 10 IJGE CC(C)(C)OC(=O)N1CCN(Cc2ccc(CBr)cc2)[C@H](C(F)(F)F)C1 2130133650 WDJQPFCBRSFRIH-HNNXBMFYSA-N 437.300 4.565 50 10 IJGE Cc1ccc(I)c(C(=O)NC[C@@H](Br)CC(C)(C)C)c1 2232158846 ZIVLRFDJPJHQMX-NSHDSACASA-N 438.147 4.529 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2CCC[C@H](C1)[C@]21CCC[C@@H](CI)O1 2249353373 DJXQVCSPTYMESE-RGQDEETRSA-N 449.373 4.833 50 10 IJGE CC1CC(CBr)(CN2CCC(N(CC3CC3)C(=O)OC(C)(C)C)CC2)C1 2265312781 YJOFXQCKPBCFAS-UHFFFAOYSA-N 429.443 4.909 50 10 IJGE COc1ccc([C@H](Br)[C@]23CCC[C@@H]2OCC3)cc1I 2269556773 RCWCIZPMSGUTEV-KKUMJFAQSA-N 437.115 4.695 50 10 IJGE C=CC[C@]1(CBr)CCCCN1C(=O)c1ccc(I)cc1 2287755238 WNOCXQLAUQCURR-MRXNPFEDSA-N 448.142 4.627 50 10 IJGE N#CC(=Cc1cc(Br)c(O)c([N+](=O)[O-])c1)C(=O)Nc1ccc2ccccc2c1 2294168585 TWEXGEYWUKGBET-UHFFFAOYSA-N 438.237 4.762 50 10 IJGE CCOC(=O)COc1ccc(C=C(C#N)c2nc(-c3cccs3)cs2)cc1OC 2296834485 XNMBNHGFDWZPPU-UHFFFAOYSA-N 426.519 4.886 50 10 IJGE CC[C@H](C)[C@H](CBr)NCc1ccc(Cl)cc1I 2302329695 UYVFZIOPEWHCJA-ZANVPECISA-N 430.555 4.844 50 10 IJGE Cc1ccc(Sc2ccc(C=C(C#N)C3=NN(c4ccccc4)[C@H](N)[C@H]3C#N)o2)cc1 2313560456 UGDYPXUFXOKCTA-URXFXBBRSA-N 425.517 4.947 50 10 IJGE N#CC(=Cc1ccc(OCc2ccc(Br)cc2)cc1)C(=O)NC1CCCC1 2313676738 YUMJZXSZYWEFLI-UHFFFAOYSA-N 425.326 4.994 50 10 IJGE Cc1[nH]c2ccccc2c1C=NNC(=O)c1cc(-c2ccccc2)nc(N2CCCCC2)n1 2323756661 RZKMOASMSQSTJQ-UHFFFAOYSA-N 438.535 4.688 50 10 IJGE ClC[C@@H]1CC2(CC2)CN1Cc1ccc(I)c(Br)c1 2325231656 WHWWVSUTELQJTR-NSHDSACASA-N 440.550 4.647 50 10 IJGE C[C@H]1CN(Cc2cc(I)ccc2Cl)C[C@]1(C)CBr 2327398372 CUYJRPMNZMPESJ-HZMBPMFUSA-N 442.566 4.798 50 10 IJGE O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/C(Br)=C\c1ccccc1 6190109 ORIODVFGPXVZSX-MXNBPABYSA-N 426.236 4.655 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)NNC(=O)COc2ccc(Cl)cc2)c(C(C)(C)C)c1 14661652 UCANTWAXWVXSFC-UHFFFAOYSA-N 446.975 4.540 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1S[C@@H](C)C(=O)N/N=C(\C)CCCC 59915329 SRVZZPFQXNNDHA-WTJYETQFSA-N 449.024 4.893 50 10 IJGE O=S1(=O)CCCC[C@@H]1[C@H](Br)c1cc(Cl)c(Br)cc1F 97896034 MCFLMJRDBHERGU-VXGBXAGGSA-N 434.552 4.645 50 10 IJGE CCOc1c(Cl)cc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)cc1OC 169890166 YDAHGKBMOXXCGC-MXAYSNPKSA-N 425.916 4.871 50 10 IJGE C[C@@H]1CCN(C(=O)c2cc(Br)c(Br)s2)C[C@@H]1Br 230293419 DZNPMIPHIMYLQB-SVRRBLITSA-N 446.002 4.519 50 10 IJGE Clc1cccc(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@@H]32)c1CBr 404142241 GFTPJERPSINQBK-SFTDATJTSA-N 435.793 4.715 50 10 IJGE O=S1(=O)CC[C@H](CCC(CBr)(CBr)C2CCCCC2)C1 697119570 NIKYOMSOYQNIOH-ZDUSSCGKSA-N 430.246 4.558 50 10 IJGE COc1ccc(C(=O)NN=Cc2cc(Cl)ccc2OCc2cccc(F)c2)cc1OC 725379556 IFZLBBBXBQVXSK-UHFFFAOYSA-N 442.874 4.839 50 10 IJGE Cc1ccc(F)c(NC(=S)NNC(=O)[C@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)c1 732576994 IESQSNXYRKNRBJ-SFTDATJTSA-N 449.551 4.834 50 10 IJGE CCCc1c(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cnn1-c1ccccc1C 799754846 TXUKXHZYXNERSK-UHFFFAOYSA-N 427.430 4.781 50 10 IJGE CC(=NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)[C@@H](C)CCCCC(=O)O 814703475 DIVVTEPUADUDOH-SFHVURJKSA-N 432.524 4.926 50 10 IJGE C#CCOc1ccc(CNC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(Cl)c3)c2C)cc1 1436299801 BWYGBSLFARPTJF-HYARGMPZSA-N 443.934 4.983 50 10 IJGE CCN(CC)c1nc(NNC(=O)C2(C3CCCCC3)CCCCC2)nc(N(CC)CC)n1 1570343474 WTVGQHQJOILAIC-UHFFFAOYSA-N 445.656 4.538 50 10 IJGE BrC[C@@H](CN1CCC(OCc2ccc(Br)cc2)CC1)C1CC1 1772509599 AZZUJJDDHVAQLY-INIZCTEOSA-N 431.212 4.851 50 10 IJGE CCOc1ccc(/C=C/C(=O)N2CCC(C(=O)Nc3ccc(SC#N)cc3)CC2)cc1 1860601580 LHHXBRMFWBKTBR-LFYBBSHMSA-N 435.549 4.549 50 10 IJGE Cc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699656 ZFGAUYCPFXZYPD-JOCHJYFZSA-N 429.911 4.603 50 10 IJGE CC(C)(CI)CN1CCN(C(=O)OC(C)(C)C)c2ccccc21 1904654641 ZLFKDHALORHNFG-UHFFFAOYSA-N 430.330 4.709 50 10 IJGE CC[C@](C)(CBr)NC(=O)c1csc(Br)c1Br 1937737482 ISRJDHXBSLDCOI-SNVBAGLBSA-N 433.991 4.567 50 10 IJGE C[C@@H](Br)C[C@@H](C)NC(=O)c1csc(Br)c1Br 1937737546 KLUPNKZWGGXMPP-PHDIDXHHSA-N 433.991 4.565 50 10 IJGE BrC[C@H]1CCCCN1Cc1c(Br)cccc1Br 1945333147 LYKDXDSHAOGOOD-SNVBAGLBSA-N 425.990 4.961 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CC12CCC1(CCC[C@@H](CI)O1)CC2 1996430043 GOYKHCZFNCGYRS-GKVPXEHWSA-N 449.373 4.834 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NCc1cc(Cl)ccc1I 2023040723 IRSPPFOLIIMJDR-NOZJJQNGSA-N 430.555 4.844 50 10 IJGE Cc1nc(Br)c(Br)n1C[C@H](CBr)c1ccccc1 2027360091 PSXGHHGGMKCMPZ-NSHDSACASA-N 436.973 4.895 50 10 IJGE O=C(NCC[C@@H](Br)C1CC1)c1cc(Br)cc(Br)c1 2029910825 CYXAWJNPWWUQFM-GFCCVEGCSA-N 439.973 4.505 50 10 IJGE CC(C)[C@](C)(CBr)NC(=O)c1c(Br)cccc1Br 2033089754 XDNMKCKIMBOSPQ-ZDUSSCGKSA-N 441.989 4.751 50 10 IJGE C[C@@H]1C[C@@H](O[C@H](CI)c2ccccc2Br)CCO1 2084725648 QIDPVNKCVUHXBJ-UHIISALHSA-N 425.104 4.509 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@@H]1CCC[C@@]2(C1)CC2(F)F 2099946174 QGFUIUDQJTWKGI-ZIFCJYIRSA-N 430.333 4.641 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CCC2(CC1)C[C@H]2CBr 2115926956 DQMAGFPXLOPWPJ-QMMMGPOBSA-N 427.589 4.801 50 10 IJGE O=C(N[C@H](CCl)c1cccs1)c1ccc(I)c(Cl)c1 2119048433 TUENTGCTJLXXTK-LLVKDONJSA-N 426.106 4.716 50 10 IJGE C[C@@]1(CBr)CC(F)(F)CN1C(=O)c1ccc(Br)cc1Cl 2159049098 KUYSAJGKCWJNPK-LBPRGKRZSA-N 431.502 4.737 50 10 IJGE O=C(c1c(Cl)cccc1Br)N1CC[C@H](Br)C(F)(F)CC1 2169452140 HMHSIOIUSAFWNB-JTQLQIEISA-N 431.502 4.737 50 10 IJGE CN(Cc1ccccc1)[C@@H]1CCCCN(c2cc([N+](=O)[O-])ccc2CBr)C1 2176905172 SMTCHXKIWCFFQW-HXUWFJFHSA-N 432.362 4.981 50 10 IJGE BrCC1(CN2CC[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)CCCCCC1 2185497216 OXODOBMXACLULM-FGZHOGPDSA-N 435.450 4.697 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@H]1CCCN(C[C@H](CBr)C2CCC2)C1 2185499688 HEAXZXPHQLWYGH-HOTGVXAUSA-N 441.414 4.747 50 10 IJGE O=C(c1cccc(Br)c1Cl)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Br)C2 2190679407 QFGRPSVJZHPYPZ-IRDCDUOOSA-N 425.523 4.581 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@H](Cl)c2cc(Br)ccc2Br)C1 2201887649 XMPIOPZXAUPVHH-CUOATXAZSA-N 442.600 4.706 50 10 IJGE CC[C@H]1CC[C@@H](N(C)S(=O)(=O)c2cc(CBr)sc2Br)C1 2206136239 IBRFWABVGUHISD-VHSXEESVSA-N 445.242 4.605 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1CBr)c1cc(F)c(Br)cc1Cl 2282982611 LBIJNZDAOQYUEN-ISVAXAHUSA-N 427.539 4.925 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@H](Cc2ccc(CC)cc2)C(=O)N1c1ccc(CC)cc1 2314593195 JCUVDOZULBYTTA-HSZRJFAPSA-N 445.588 4.540 50 10 IJGE BrCC12CC(CCN1Cc1ccc(Br)cc1Br)C2 2314868004 FNJJWYJKMNRLIK-UHFFFAOYSA-N 438.001 4.961 50 10 IJGE COc1ccc(OC)c(NC(=O)C(C#N)=CN(Cc2ccccc2)Cc2ccccc2)c1 2325161695 SDLZKZRHESTNFE-UHFFFAOYSA-N 427.504 4.752 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@H]2CC[C@@H](Cl)[C@@H]1C2 2330965384 XNXPMPYYCXHVCX-QNSHHTMESA-N 427.589 4.895 50 10 IJGE CC[C@@H](CBr)CN1C[C@@H](CNC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2331633065 QVYIODQJSIMUPT-UHOSZYNNSA-N 425.411 4.648 50 10 IJGE Cc1ccc(I)c(C(=O)NC(C)(C)[C@H](Br)C(C)C)c1 2340406845 PWUMRVOIBCQLJZ-CYBMUJFWSA-N 438.147 4.528 50 10 IJGE Brc1ccc([C@H](CI)OC[C@H]2O[C@H]3CC[C@H]2C3)cc1 2352572414 GEZZTYTXNBMFAY-CYUUQNCZSA-N 437.115 4.509 50 10 IJGE CCOC(=O)/C(C#N)=C1/S[C@H](Cc2cccc(Cl)c2)C(=O)N1c1ccc(C)cc1 33729345 BBXIIOBUOSUWJV-AZZGVMCLSA-N 426.925 4.638 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)Cc3ccc(Cl)cc3)ccc2[C@H]1c1cccc(F)c1 38678368 KIOOPRZLRRNXMK-HSZRJFAPSA-N 434.854 4.845 50 10 IJGE Cc1ccc(C)c(NC(=O)/C(C#N)=C\c2c(Oc3ccccc3)nc3ccccn3c2=O)c1 39858490 QYLHYJLURMCCPM-CYVLTUHYSA-N 436.471 4.649 50 10 IJGE Cc1ccc(C)c(OCCCC(C)(C)C(=O)NNC(=O)c2ccc(OCC(C)C)cc2)c1 66201472 IQJMLVMAYKXCKD-UHFFFAOYSA-N 440.584 4.985 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)COc2ccccc2C(C)C)c(OCC)c1 206290871 WUCHUYCAZVFCIU-UYRXBGFRSA-N 437.492 4.663 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)CCCOc2cc(C)ccc2C)cc1 207144248 BGZZINYJLMKENF-XLNRJJMWSA-N 434.536 4.891 50 10 IJGE CCN(C[C@@](C)(CI)OCC1CCCC1)C(=O)OC(C)(C)C 231318327 QFFJBHGXXKRFSV-QGZVFWFLSA-N 425.351 4.644 50 10 IJGE CCc1nc(-c2ncc(Br)cc2Br)ncc1CBr 302358121 XIZMBUHRXRXFDW-UHFFFAOYSA-N 435.945 4.521 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N1CCCC[C@@H]1C[C@@H](C)Br 312939721 HPDCDBCEPDGCFL-MWLCHTKSSA-N 445.242 4.536 50 10 IJGE Clc1ccc(I)c(CN2CCC[C@@H](CBr)C2)c1 405337559 LBCRQIUXAVKIDC-JTQLQIEISA-N 428.539 4.552 50 10 IJGE COC[C@@H]1C[C@H](Br)[C@H](Cc2cc(Cl)ccc2I)C1 698765345 JCGBFZJVSQVXPD-KWBADKCTSA-N 443.550 4.923 50 10 IJGE ClCc1cc(Br)cc(Br)c1OCCCO[C@H]1CCOC1 699529685 GKRVIPRIWDERNT-LBPRGKRZSA-N 428.548 4.525 50 10 IJGE CN(C[C@@H]1CCCCN1Cc1ccccc1)c1nc2ccccn2c1CBr 720015871 DUVDIGNOXDUZOD-IBGZPJMESA-N 427.390 4.720 50 10 IJGE Cc1ccc(-n2c(C)cc(C=NNC(=O)C(=O)Nc3cc(Cl)ccc3C)c2C)cc1C 725430292 WOOHORAORHKXJB-UHFFFAOYSA-N 436.943 4.762 50 10 IJGE Cc1cc2cc[nH]c2cc1NC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1 782088457 PWPRPTMWRCVGCF-UHFFFAOYSA-N 432.455 4.661 50 10 IJGE O=C(NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)[C@@H]1C[C@H]1c1cc(F)ccc1F 804206082 BWMUNKPPGMZQCG-GOEBONIOSA-N 434.368 4.687 50 10 IJGE CCC(CC)(COCc1ccccc1)C(=O)NNc1nc(-c2cccnc2)nc(C)c1C 1306608957 SMRFBZAEGWGVLL-UHFFFAOYSA-N 433.556 4.622 50 10 IJGE Cc1ccc([C@H]2CN(Cc3ccccc3)C[C@@H]2CI)cc1[N+](=O)[O-] 1614691909 JRMKCIQWMPTELL-ZWKOTPCHSA-N 436.293 4.554 50 10 IJGE COc1cc(/C=C(\C#N)c2ccccc2OC)ccc1OC(=O)c1cccc([N+](=O)[O-])c1 1615066018 IFXWROIDEFCZEF-LDADJPATSA-N 430.416 4.895 50 10 IJGE CCCOc1ccccc1/C=C/C(=O)NNC(=O)c1ccc(-c2ccc(CC)cc2)nc1C 1865758920 XOAKYGWUFVFRCF-SAPNQHFASA-N 443.547 4.883 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@@H]([C@H](CBr)NC(=O)OC(C)(C)C)C1 1882085891 XCFHIJWDSLCXJM-XHSDSOJGSA-N 449.430 4.996 50 10 IJGE CN(C[C@](C)(CBr)C(C)(C)C)[C@@H]1CC[C@@H]1NC(=O)OCc1ccccc1 1904843104 AKNXJQFIMSAVAN-UEXGIBASSA-N 425.411 4.823 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)C(=O)c1cc(O)cc(Br)c1 1914646855 TUNYCFVKBBTDFV-GFCCVEGCSA-N 427.136 4.581 50 10 IJGE C[C@@H](CCCl)N(Cc1ccccc1)C(=O)c1ccccc1I 1915079390 BFRUSMZTTCEXBU-AWEZNQCLSA-N 427.713 4.951 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1sncc1Br 1915116217 QWPKENXBLXLVPL-LLVKDONJSA-N 432.181 4.722 50 10 IJGE BrCC(CBr)(Cc1ccncc1Br)C1CCC1 1942094393 DIXFCXLWPMVFEB-UHFFFAOYSA-N 425.990 4.963 50 10 IJGE CN(Cc1c(Br)cccc1Br)C[C@@H](Br)C1CC1 1945323943 UWNPBFKUOYFMTP-CYBMUJFWSA-N 425.990 4.817 50 10 IJGE C[C@H]1CCN(Cc2c(Br)cccc2Br)[C@@H]1CBr 1945332688 GXRVDABUGIKGCP-TVQRCGJNSA-N 425.990 4.817 50 10 IJGE COc1ccc(Oc2nc(C)c(CBr)s2)cc1I 2045998357 RSMSYLMAEXIJBD-UHFFFAOYSA-N 440.100 4.752 50 10 IJGE C[C@@H](NC(=O)[C@@H](Br)C1CCCC1)c1csc(NC(=O)OC(C)(C)C)n1 2051203800 JPIWLELBWVIGFT-MFKMUULPSA-N 432.384 4.621 50 10 IJGE FC(F)Oc1cc(I)c(CBr)cc1OC(F)(F)F 2060221215 NIHJXNHFCUKJSY-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1C(=O)c1c(Br)cccc1Br 2073326329 IXFHXGSGFHUOLK-KCJUWKMLSA-N 439.973 4.600 50 10 IJGE COc1ccc(-n2nc(CBr)c(Br)c2C(F)(F)F)cc1OC 2079235395 VRIGXIQATVGCID-UHFFFAOYSA-N 444.045 4.566 50 10 IJGE Cc1cc([C@@H](Br)c2ncn3ccsc23)ccc1I 2086024795 WZSCOFFOTFXJAB-LLVKDONJSA-N 433.112 4.793 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@@H](CCl)C12CCC2 2133828273 QRYIYGSRGNGNQL-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE Cc1cc(C(=O)NCC(C)(C)C[C@H](C)Br)ccc1I 2142140344 IJHGSYMHVRRUTE-NSHDSACASA-N 438.147 4.529 50 10 IJGE Cc1c(Cl)cc(C(=O)N2CC(F)(F)C[C@H]2CBr)cc1Br 2167387297 FXVLVFNIPJIEMC-VIFPVBQESA-N 431.502 4.656 50 10 IJGE CCC[C@H]1CN(C(=O)c2cc(Cl)ccc2I)C[C@@H]1CCl 2205699842 ZYDFSJJBSIDMEW-QWRGUYRKSA-N 426.125 4.672 50 10 IJGE COc1cc(F)c(Cl)cc1[C@@H](Br)c1nn(C)c(Br)c1C 2207367676 GHMKDELZXOMRBX-LLVKDONJSA-N 426.511 4.776 50 10 IJGE O=C(O)C[C@@H](Br)C(=O)c1c(Br)cc(Cl)c(Cl)c1Cl 2217608909 SVPHACYHRORSIU-SCSAIBSYSA-N 439.314 4.830 50 10 IJGE O=S(=O)(c1ccc(F)c(Br)c1)N(Cc1ccccc1)[C@H](CCl)C1CC1 2224005497 PWIBOTXRNFOBDI-GOSISDBHSA-N 446.769 4.797 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCCCBr)C[C@@H]1C(F)(F)F 2263164219 FJAYLOJLHHFNLV-CQSZACIVSA-N 431.337 4.815 50 10 IJGE CC(C)N(C[C@@H]1CCCN(CC2(CBr)CC(F)C2)C1)C(=O)OC(C)(C)C 2265632181 LFNUIEVLSKLQAZ-ZRZPHAQCSA-N 435.422 4.857 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@H](CBr)C2CCC2)[C@H](C(F)(F)F)C1 2266310596 QRPKYRVZWKAWNO-ZNMIVQPWSA-N 443.348 4.718 50 10 IJGE COc1ccnc(N2[C@H]3CCC[C@H]2CN(Cc2ccccc2)CC3)c1CBr 2281111698 YDMPRLIYGXDHQP-OALUTQOASA-N 430.390 4.619 50 10 IJGE O=C(N[C@H]1CCC[C@H]1CCBr)c1cc(Br)c(F)cc1Cl 2285959754 VGSQABGLTVHBFQ-SDBXPKJASA-N 427.539 4.925 50 10 IJGE CCOc1cc(C=C(C#N)c2nc3ccccc3[nH]2)cc(I)c1OC 2296737824 YEEWKUFAERVWAZ-UHFFFAOYSA-N 445.260 4.639 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1Cc1ccc(Cl)c(I)c1 2300236688 OJYYZBVFAARIMT-NOZJJQNGSA-N 428.539 4.692 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)c(I)c2)CC[C@H]1Br 2300239165 UWCIQDMFXDEIHU-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE C[P@]1(=O)C[C@H](Br)[C@H](Cc2ccc(Cl)cc2I)C1 2302317564 ITUPSIVKAOXVAK-MIHTYCSTSA-N 447.478 4.873 50 10 IJGE C[C@]1(CBr)CCCN1Cc1cc(I)ccc1Cl 2307327966 ICPQYMFNCPHUPV-CYBMUJFWSA-N 428.539 4.694 50 10 IJGE C[C@H](Br)CCCN(C)C(=O)c1ccc(Cl)cc1I 2317773911 GCUROCQDRYOGAK-VIFPVBQESA-N 444.538 4.580 50 10 IJGE CCOc1c(Br)cc(C=NNC(=O)Nc2cccc(Cl)c2)cc1OC 2318418077 OVHFFNSGXZIAAX-UHFFFAOYSA-N 426.698 4.665 50 10 IJGE COc1cccc(-c2ccc(C(=O)NN=Cc3c(Cl)nc4scc(C)n34)c(C)n2)c1 2321239383 QJVDWFWTOGVMOL-UHFFFAOYSA-N 439.928 4.501 50 10 IJGE N#CC(=CNC1CCCCCCCCCCC1)C(=O)Nc1ccc(S(=O)(=O)O)cc1 2324191962 XPEJLUUEDIBUMH-UHFFFAOYSA-N 433.574 4.542 50 10 IJGE Cl[C@@H]1C[C@H]2C[C@H]1CN(Cc1ccc(I)c(Br)c1)C2 2325227275 YNQAYUDUAJDMNP-NTZNESFSSA-N 440.550 4.503 50 10 IJGE C[C@@H]1CC[C@@H](CBr)CN1Cc1cc(I)ccc1Cl 2327402297 GQUHSIKFDYTHJW-MNOVXSKESA-N 442.566 4.940 50 10 IJGE Cc1ccc(-c2csc(C(C#N)=C(O)CCCN3C(=O)c4ccccc4C3=O)n2)cc1 2331312441 WIXFOSCSCKXEPL-UHFFFAOYSA-N 429.501 4.988 50 10 IJGE Cn1cc(I)c(COc2c(Cl)cc(CCl)cc2Cl)n1 2341841155 OFBXQRWDRSMLJE-UHFFFAOYSA-N 431.488 4.649 50 10 IJGE CC(C)n1ncc(Br)c1CN[C@H](C)CCCCCI 2342244580 ZKXNIXRSNNGTBC-GFCCVEGCSA-N 442.183 4.700 50 10 IJGE CC[C@@H](C)c1ccc(OCC(=O)NNC(=O)[C@@H](C)Oc2ccc(-c3ccccc3)cc2)cc1 14038769 BVBRIJOLDLWGGG-WOJBJXKFSA-N 446.547 4.861 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C\c2c(Oc3cccc(C)c3)nc3ccccn3c2=O)cc1 34719824 GNRVITGQKUVSTA-CYVLTUHYSA-N 436.471 4.649 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@@H](C)Oc4ccc(F)cc4)ccc32)cc1 38649236 VWCSOQRONFYMPX-VOIUYBSRSA-N 444.462 4.725 50 10 IJGE CCCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(C)o2)c1 38659323 OSPOVNYJQGEYPJ-HSZRJFAPSA-N 430.460 4.814 50 10 IJGE CCOc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccoc2C)CCC3)cc1 40823550 VBCKNYYBDDMQGY-LGUFXXKBSA-N 435.480 4.611 50 10 IJGE COC(=O)/C(C#N)=C/c1ccc(OC(=O)c2sc3ccccc3c2Cl)c(OC)c1 41007573 IOVMNAKNQZZMNS-UKTHLTGXSA-N 427.865 4.862 50 10 IJGE CCCOc1ccc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccc(OC)cc4)nc3c2)cc1 169925541 HJURCGSILYHKGC-PKAZHMFMSA-N 442.519 4.715 50 10 IJGE O=C(N[C@H]1CCC[C@@H]1CBr)c1cc(Br)sc1Br 231543438 BXPOXWDCXFDWLN-SVRRBLITSA-N 446.002 4.567 50 10 IJGE C[C@]1(CI)CC[C@@H](c2cc(Br)c(Br)o2)O1 307717107 JASXOPKOGXLLGE-OIBJUYFYSA-N 449.908 4.850 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1cccc([C@@H]2CN(S(=O)(=O)c3ccccc3)CCO2)c1 616601208 ABSAYGGOAPSJKP-QFIPXVFZSA-N 447.673 4.971 50 10 IJGE Cc1cccc([C@@H]2CN(Cc3ccccc3)C[C@H]2CI)c1[N+](=O)[O-] 725427261 JOIAJLUHFWJDSS-SJLPKXTDSA-N 436.293 4.554 50 10 IJGE CC(C)[C@H](NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1cccc(C(F)(F)F)c1 726609983 FYSYAWJVRVFIAH-IBGZPJMESA-N 432.446 4.538 50 10 IJGE O=C(NNC(=O)c1cccc(OCc2cscn2)c1)Nc1ccc(-c2ccccc2)cc1 743825812 FSKRTNJTGXBYKY-UHFFFAOYSA-N 444.516 4.856 50 10 IJGE CCc1ccc(-n2nc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c3c2CCC3)cc1 799750053 STZSTHKJBVMNGR-UHFFFAOYSA-N 439.441 4.571 50 10 IJGE O=C(NN=Cc1c(O)ccc2ccccc12)c1ccc(NC(=O)c2ccc(F)cc2)cc1 1082753944 ZGWPAXQJLAWOGF-UHFFFAOYSA-N 427.435 4.701 50 10 IJGE C/C(=C\C(=O)NNc1ccc([N+](=O)[O-])cc1Br)c1ccc(C(F)(F)F)cc1 1467359933 HBOSZSBVPCDRRL-CSKARUKUSA-N 444.207 4.923 50 10 IJGE O=C(NNc1c(Cl)cc(Br)cc1Cl)c1ccc(C(F)(F)F)c(O)n1 1544793119 HTCUZMOFWUIYDJ-UHFFFAOYSA-N 445.022 4.632 50 10 IJGE C=C(C)CN1CCC(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 1585279478 PGSFHZXFPPKOEX-STZFKDTASA-N 436.987 4.811 50 10 IJGE Cc1cccc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)c1[N+](=O)[O-] 1614629147 GMTXNCUQXMYLNV-SJLPKXTDSA-N 433.302 4.650 50 10 IJGE O=C(NNc1ccc(Br)c(F)c1)c1cc2cccc(C(F)(F)F)c2nc1O 1616672925 QMWAEECQXOLGRN-UHFFFAOYSA-N 444.182 4.618 50 10 IJGE C=CCOc1ccc(Br)cc1NC(=O)NNc1ncc(Cl)cc1Cl 1670845372 OPPNIUSPXMXGJR-UHFFFAOYSA-N 432.105 4.864 50 10 IJGE Cc1c(C(=O)Nc2ccc(F)cc2F)oc2c1C(=NNC(=O)c1ccccc1F)CCC2 1772744592 XNSDXCWKRGZJCV-UHFFFAOYSA-N 441.409 4.728 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@H]1c1ccccc1F 1865684493 ZGBOSUOFOOOEQK-INIZCTEOSA-N 448.807 4.961 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccc(Cl)cc2)cc1 1865694827 CQZJBUSWWUHVLZ-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H]1C(C)(C)C 1881339344 KHJRFKRVDQLGRZ-IHRRRGAJSA-N 435.403 4.556 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)CCc1cccc(Cl)c1Cl 1905342936 MIAUMDKKVBPNGZ-GFCCVEGCSA-N 427.125 4.986 50 10 IJGE Cc1nc(N(C)C[C@H](Br)COCc2ccccc2)ccc1Br 1916348520 OTJSYAOXQCHBJP-HNNXBMFYSA-N 428.168 4.569 50 10 IJGE C[C@H]([C@H](Cl)c1c(Br)sc(Br)c1Cl)S(C)(=O)=O 1923049786 NQSJLHXMNFCFER-WUJLRWPWSA-N 430.998 4.640 50 10 IJGE C[C@H](NC(=O)c1scc(Br)c1Br)C(C)(C)CBr 1942913374 LEAJWCVAJAQCNJ-LURJTMIESA-N 448.018 4.813 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCC[C@@H](CI)O2)CCC12CCC2 1983724627 KTDLLRUQHWDDSS-KSSFIOAISA-N 435.346 4.683 50 10 IJGE FC(F)(CBr)CCNCc1c(Br)cccc1Br 2012617138 XFAXXTXEZSMSPI-UHFFFAOYSA-N 435.932 4.722 50 10 IJGE O=C(N[C@@H]1CC[C@@H](CBr)C1)c1ccc(Br)cc1Br 2029531651 AHMSEIRKDHSPGF-PSASIEDQSA-N 439.973 4.505 50 10 IJGE CC(C)[C@H](Br)CCNC(=O)c1c(Br)cccc1Br 2033091231 OKAVWRWFPFKVTL-SECBINFHSA-N 441.989 4.751 50 10 IJGE CC(C)[C@@H](Cl)c1cn(-c2ccc(Br)c(I)c2)nn1 2057426449 FNCJKTZFHJLNHA-GFCCVEGCSA-N 440.510 4.570 50 10 IJGE Cc1cc(Br)c([C@@H](Br)[C@]2(C)COCCO2)cc1Br 2078515405 CCWVSHHVRQIUTJ-OLZOCXBDSA-N 442.973 4.762 50 10 IJGE COc1cccc(Cn2nc(CBr)c(Br)c2C(F)(F)F)c1F 2079234066 MPGHHPPHXJHLNF-UHFFFAOYSA-N 446.036 4.755 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@@H]2C[C@@H](Br)CC[C@@H]21 2115927856 GLZNMCATBLZYIO-WEDXCCLWSA-N 427.589 4.942 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)C1(C(F)(F)F)CCCCC1 2116579042 WTOCAHTWZSLDHV-MRXNPFEDSA-N 436.312 4.938 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CC[C@@H](CCl)C(F)(F)C1 2146383472 OIYNBDJILSOHLH-QMMMGPOBSA-N 431.502 4.548 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CCCNC(=O)c2ccc(CBr)cc2)CC1 2162489733 ZOUQHWAGGBSTFV-UHFFFAOYSA-N 439.394 4.739 50 10 IJGE CC(C)CN(CC(C)C)S(=O)(=O)c1cc(CBr)sc1Br 2179791674 UUKIHLAHNPDWHZ-UHFFFAOYSA-N 447.258 4.708 50 10 IJGE COc1cc(Br)c([C@@H](Cl)[C@H]2C[C@H](Br)C2)c(OC)c1OC 2196881596 UWHCBVJUXGVJPD-UBJUHAIHSA-N 428.548 4.928 50 10 IJGE CN[C@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@@H](Br)C1 2260005162 FFOIOKDRMJSDEG-MQNJHXBQSA-N 447.943 4.924 50 10 IJGE CC1(C)CN(C(=O)c2cc(Br)c(F)cc2Cl)CC[C@H]1Br 2285844942 SXUQOPRYEFWDBB-GFCCVEGCSA-N 427.539 4.877 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)c2cccc(Br)c2)c(OCC)c1 2293190745 SFBABVBOIISFGV-UHFFFAOYSA-N 444.281 4.537 50 10 IJGE CC[C@@H](C)[C@H](CBr)NCc1ccc(Cl)c(I)c1 2300237527 ADNPBEPOLBXTAS-RNCFNFMXSA-N 430.555 4.844 50 10 IJGE C[C@@H]1[C@@H](CBr)CCN1Cc1ccc(Cl)c(I)c1 2300240294 KIFFXXABILPAQL-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE CC1(C)C[C@@](C)(CBr)CN1Cc1sccc1I 2301068320 KLLVOSCRAJDOGD-ZDUSSCGKSA-N 428.177 4.738 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](N)C1CC(Br)C1 2301490879 ZLAZINVVLFCLKW-FOEZSWGGSA-N 429.953 4.832 50 10 IJGE Cc1nc(Br)c(Br)n1CC1(CBr)CC(C)(C)C1 2304496332 NWJFJSFHHLEJMY-UHFFFAOYSA-N 428.994 4.918 50 10 IJGE C[C@@H](NC(=O)C(C#N)=CNc1cccc(Br)c1)C12CC3CC(CC(C3)C1)C2 2324904393 VEPOWYNJPYNKGU-XSXQVXRUSA-N 428.374 4.990 50 10 IJGE COc1ccc([C@H](C)NC(=O)C(C#N)=CNC(c2ccccc2)c2ccccc2)cc1OC 2325044972 REVBFFCHQQZQCW-IBGZPJMESA-N 441.531 4.668 50 10 IJGE Cc1ccc(NC=C(C#N)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c(Br)c1 2325216326 KGOFMZCANCKRKN-UHFFFAOYSA-N 435.665 4.777 50 10 IJGE N#CC(=CNc1ccc(CC(=O)O)cc1)C(=O)Nc1ccccc1Sc1ccccc1 2325338945 XIGUXMJORFGMMI-UHFFFAOYSA-N 429.501 4.923 50 10 IJGE CC1(C)CCCCCN1S(=O)(=O)c1cc(CBr)sc1Br 2360310627 BKIIGPZCPVNQJK-UHFFFAOYSA-N 445.242 4.749 50 10 IJGE O=C(CCc1cc(Cl)cc(Cl)c1)N1CCC(CI)CC1 2366884913 MHOAQKNPNPAUKV-UHFFFAOYSA-N 426.125 4.600 50 10 IJGE Cc1ccc(COc2ccccc2/C=N/NC(=O)CSc2nc3ccccc3[nH]2)cc1 32520595 VQCIMLNHGFJEQJ-AFUMVMLFSA-N 430.533 4.693 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(OC)c4)ccc32)cc1 38685625 WZQFXXFKWCGIND-XMMPIXPASA-N 442.471 4.531 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2ccc(C(C)(C)C)cc2)cc1 40987879 IBOGHITVAPWRIF-CAPFRKAQSA-N 434.536 4.792 50 10 IJGE CCN(CC)c1ccc(-n2c(C)cc(/C=N\NC(=O)CC[C@H](O)c3ccccc3)c2C)cc1 58890814 CFVPEPAKDXWMKK-FANVTVCWSA-N 446.595 4.904 50 10 IJGE O=C1[C@H](Br)CCCN1c1c(Br)cc(Cl)cc1Br 304135422 CNZZMXJEQGDNTM-SSDOTTSWSA-N 446.364 4.755 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2cc(F)ccc2Br)[C@@H](CBr)C1 382686477 FOELUJGETCSYIP-GWCFXTLKSA-N 437.147 4.934 50 10 IJGE CC[C@@H](C[C@H](C)Cl)NC(=O)c1cc(I)ccc1Br 716927256 UVXABHPBJOOFKT-WPRPVWTQSA-N 444.538 4.580 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NN(Cc2ccccc2)c2ccccc2)C1 730137538 DUJJPIZFCVHNQX-OAQYLSRUSA-N 438.572 4.555 50 10 IJGE N#Cc1ccc(NNC(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)(F)F)cc1C(F)(F)F 746891786 KCEHJZVERZINEG-KGLIPLIRSA-N 429.320 4.722 50 10 IJGE COc1cc(C=NNC(=O)CC[C@H](O)c2ccccc2)ccc1OCc1cccc(C)c1 1084009790 SDDPKHZRGHVMMJ-QHCPKHFHSA-N 432.520 4.547 50 10 IJGE CC(=O)c1cc2c(cc1NC(=O)/C(C#N)=C/c1cc(C)n(-c3ccccc3C)c1C)OCO2 1350272889 ZDHLLWOCKAZHDC-KEBDBYFISA-N 441.487 4.880 50 10 IJGE COc1cc(F)cc(NNC(=O)c2c(Nc3ccc4c(c3)CCCC4)cc(C)nc2O)c1 1566564549 IKDBWJLKGVIFHT-UHFFFAOYSA-N 436.487 4.623 50 10 IJGE O=C(NNc1cc(C(F)(F)F)ccc1Br)c1ccc(-c2ccco2)nc1O 1639275425 DQOLLEWVXZLVHP-UHFFFAOYSA-N 442.191 4.585 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@H]2c1ccc(OCC)c(OC)c1 1865694821 CLZZUHOXQUVAJD-OAQYLSRUSA-N 430.508 4.586 50 10 IJGE COC(=O)c1ccc(/C(C#N)=C/c2cc(Br)cc(Br)c2OC)o1 1872728556 IYHKAGICXOAKOF-BJMVGYQFSA-N 441.075 4.664 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)C12CCC2 1882085700 VNVBZFBMGDRUCD-SOUVJXGZSA-N 447.414 4.606 50 10 IJGE CN(C[C@@H]1C[C@H]1Br)C(=O)CC[C@@H](CCNC(=O)OC(C)(C)C)C(C)(C)C 1887829440 JOEQOEDYMCONGE-HRCADAONSA-N 433.431 4.586 50 10 IJGE Cc1ccnc(N(C)C[C@@H](Br)COCc2ccccc2)c1Br 1916348062 MAYVYUAKCSWYBI-OAHLLOKOSA-N 428.168 4.569 50 10 IJGE BrCC[C@@H](NCc1cccc(Br)c1Br)C1CC1 1943885448 VPPPHGAVOBJFFU-GFCCVEGCSA-N 425.990 4.865 50 10 IJGE O=S(=O)(c1ccc(CCl)c(Br)c1)N(Cc1ccccc1)CC1CC1 1946858445 LSVZTUUERXOQHJ-UHFFFAOYSA-N 428.779 4.789 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@@H]2CC[C@H]3CC[C@H]2C3)CC1 1947123002 HEGKHKYJVNIWRZ-OWCLPIDISA-N 449.373 4.786 50 10 IJGE CCN(C[C@](C)(CI)OCCC[C@H]1C[C@H]1C)C(=O)OC(C)(C)C 1985940276 IEMBDBSLSVJOAP-VKJFTORMSA-N 439.378 4.890 50 10 IJGE CN(CC1CC(Br)C1)c1ccc(CBr)c(Br)c1 2020226927 PUPFTUNDNDXUKB-UHFFFAOYSA-N 425.990 4.954 50 10 IJGE FC1(F)C[C@]1(Br)COc1ccc(Br)cc1CBr 2023779312 SDUFIADBBFKEDY-JTQLQIEISA-N 434.900 4.896 50 10 IJGE C[C@@H]1CC[C@@H](CBr)N(Cc2cc(Cl)ccc2I)C1 2048064053 RUEPHGMIKGAGBT-MFKMUULPSA-N 442.566 4.940 50 10 IJGE CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(CBr)cc1OC 2059311654 ABNXDCHFGNFBIO-OAHLLOKOSA-N 426.376 4.580 50 10 IJGE Cn1ncc(COc2c(Cl)cc(Cl)cc2CBr)c1Br 2116621829 TYHLXKKXXSTWKC-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCC[C@@H](NC(=O)c2ccc(CBr)cc2)CC1 2133337561 RDJWVONBPVPHQR-SJORKVTESA-N 425.367 4.537 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@@H](CCl)C12CCC2 2133822358 UJYWITKXZVGRAX-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE O=S1(=O)CCC[C@H]([C@@H](Br)c2csc3c(Br)cccc23)C1 2146094564 HVBPVBAJIHMVSY-TVQRCGJNSA-N 438.206 4.925 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCN(C[C@H](CBr)c2ccccc2)C1 2163059727 WBOHJCZUIAFWPK-SLFFLAALSA-N 437.422 4.887 50 10 IJGE CC(C)(C)OC(=O)NCCCN(C(=O)[C@@H](Br)C1CCCC1)c1ccccc1 2167033372 NHDNPBVDLVTWLP-SFHVURJKSA-N 439.394 4.888 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@H]1CN(Cc2ccccc2)C[C@H]1C 2184936328 VSNDSURDPLDEBR-KDOFPFPSSA-N 447.808 4.977 50 10 IJGE Cc1nc(C2(C)CCN(Cc3ccccc3)CC2)nc2c1C[C@@H](CBr)CC2 2187368225 LRKZOUMHUSILOA-IBGZPJMESA-N 428.418 4.839 50 10 IJGE COc1cc2c(cc1Br)nc(CCCl)n2-c1cnn(Cc2ccccc2)c1 2202310726 ZOHWXRXXXHCYLD-UHFFFAOYSA-N 445.748 4.823 50 10 IJGE CCN(c1ncc(Br)cc1Br)[C@H]1CCC[C@H]1Br 2212910296 FWYZDHCDFLCCCO-KOLCDFICSA-N 426.978 4.749 50 10 IJGE CC1(C)[C@H]2CC[C@@H](C2)[C@@]1(CI)O[C@@H]1CCN(Cc2ccccc2)C1 2250379983 DZWXRQWHWBSEQY-CTAFRAEOSA-N 439.381 4.907 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@H](Br)[C@H]1C1CC1 2285834940 GWMXMDQUNNGUKI-TVQRCGJNSA-N 425.523 4.630 50 10 IJGE COC(=O)Cn1cc(C=C(C#N)C(=O)Nc2ccc(Cl)c(Cl)c2)c2ccccc21 2294193114 UITXFVBZZVSNOR-UHFFFAOYSA-N 428.275 4.667 50 10 IJGE Cc1cccc(C)c1N1C(=O)c2ccc(NC(=O)C(C#N)=Cc3ccc(F)cc3)cc2C1=O 2329638800 SRIIACLUPQLVLN-UHFFFAOYSA-N 439.446 4.789 50 10 IJGE CC(C)[C@H]1CN(c2c(CBr)c(C(F)F)nn2C)CCN1Cc1ccccc1 2365275588 VRWUPEBGNWXMDV-QGZVFWFLSA-N 441.364 4.599 50 10 IJGE COc1cccc(NC(=O)/C(C#N)=C/c2ccc(OCc3cccc(C(=O)O)c3)cc2)c1 1083078 WJPUSIKJTWUJGT-UDWIEESQSA-N 428.444 4.518 50 10 IJGE CCCCOc1ccc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)cc1 14029911 RAKPSLCEFGEDKM-UHFFFAOYSA-N 439.339 4.793 50 10 IJGE C=CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(C)o2)cc1 38659252 PSRRVRNSSRPTRC-QHCPKHFHSA-N 428.444 4.590 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccs4)ccc32)cc1OC 38659531 PBBGSBYBAJTFOU-QFIPXVFZSA-N 448.500 4.593 50 10 IJGE O=C(N/N=C/c1cccc(/C=N/NC(=O)c2cccc(Cl)c2)c1)c1cccc(Cl)c1 59382587 JKGVGRJXURWUJI-BKHCZYBLSA-N 439.302 4.521 50 10 IJGE COc1ccc(/C(CSc2nc3ccccc3s2)=N\NC(=O)c2cccnc2)cc1 59460742 XHLMVSHSMOPZFW-PLRJNAJWSA-N 434.546 4.626 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C/c2ccc(OCC)cc2)c(OC)c1 207114572 LYPLVHWODADJOM-CFRAVMCGSA-N 448.519 4.536 50 10 IJGE C[C@@H]1CCN(C(=O)c2cc(Br)c(Br)s2)[C@H]1CBr 227178014 SQTDOBWPLOZDSV-SVRRBLITSA-N 446.002 4.519 50 10 IJGE C=CCOc1ccc(C(=O)NN=Cc2ccc(OC(=O)c3ccc(C)cc3)c(OC)c2)cc1 254288078 HGWNSQDCUKSTCL-UHFFFAOYSA-N 444.487 4.552 50 10 IJGE COc1cc(C=NNC(=O)COc2cccc3ccccc23)ccc1OCc1ccccc1 254384059 KHKCOXDALRKVBT-UHFFFAOYSA-N 440.499 4.957 50 10 IJGE Cc1ccc(COc2ccc(C=NNC(=O)C(=O)Nc3cccc4ccccc34)cc2)cc1 254391657 PIIFEGVDWUEPJN-UHFFFAOYSA-N 437.499 4.816 50 10 IJGE Cc1cc(C)n(Cc2cccc(C(=O)NN=Cc3ccccc3OCc3ccccc3)c2)n1 254744458 BONCLRYKDHSDJI-UHFFFAOYSA-N 438.531 4.891 50 10 IJGE ClCc1cc(I)c2sc(I)cc2c1 306573898 BPBVYOIVDMHSJT-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2cccc(Br)c2F)[C@@H](CBr)C1 382699831 XJJCVKPFXOJCRT-JQWIXIFHSA-N 437.147 4.934 50 10 IJGE CN([C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(Cl)cc(CCl)c1Cl 383398995 WVJRAEQJRFHTGN-QGZVFWFLSA-N 447.815 4.627 50 10 IJGE CC[C@@H](Br)[C@H](C)NC(=O)c1cc(Br)sc1Br 386686623 JLNRZDIQCFORCO-CAHLUQPWSA-N 433.991 4.565 50 10 IJGE Cc1cc([C@@H](Br)c2cc(I)cc3c2OCC3)c(C)o1 388910813 OKAPMTXPIVDPBV-CQSZACIVSA-N 433.083 4.920 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccc([C@H]2CN(S(=O)(=O)c3ccccc3)CCO2)cc1 616602384 ITHCYPQOAQGWTP-JOCHJYFZSA-N 447.673 4.971 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1ccc([C@H]2CCN(S(N)(=O)=O)c3ccccc32)cc1 616674502 DOLXLHQWRGXOKE-HXUWFJFHSA-N 446.689 4.796 50 10 IJGE C=CC[C@]1(C(=O)OC)C[C@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 688653178 DWWQFLFXOGTKEW-WMZHIEFXSA-N 433.621 4.907 50 10 IJGE C[C@H](Br)C(C)(C)NC(=O)c1scc(Br)c1Br 705509295 CHXMICMIIDQPSW-YFKPBYRVSA-N 433.991 4.565 50 10 IJGE Fc1ccc2nc(CCl)n(Cc3sncc3Br)c2c1Br 722795965 KPBAIROLAAUUPI-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)OCc2nc(C(C)(C)C)cs2)c(C)n1C[C@H]1CCCO1 756353577 UXUWWDNFDZYHSU-SZVPOVDMSA-N 427.570 4.688 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)CCCSc2nc3ccccc3s2)c(O)c1 1084123419 BJILHFWBRRFXKO-UHFFFAOYSA-N 442.610 4.871 50 10 IJGE C=CCOc1cccc(NC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)c1 1198958323 UBUMPIGAJBYDKT-INIZCTEOSA-N 427.570 4.930 50 10 IJGE C=C(Cl)C[C@@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccccc2C)c1C)C(=O)OCC 1535344763 HYWQKEYALNJOIT-DMMSUNFISA-N 439.943 4.500 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)c1cccc(F)c1 1540544761 MZTMFBCCWMGEFB-SDXDJHTJSA-N 440.478 4.543 50 10 IJGE Cc1occc1C(=O)NN=C1CCCc2oc(C(=O)N3c4ccccc4C[C@H]3C)c(C)c21 1772750115 XSFFNWMOQYPADY-CQSZACIVSA-N 431.492 4.551 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(C)cc2)cc1OCC 1865688829 CADIVPPVYVQXIQ-XMMPIXPASA-N 444.535 4.564 50 10 IJGE CCc1nn(-c2ccccc2Cl)c2c1[C@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689016 HSPJIUWCTQQSDH-GOSISDBHSA-N 427.291 4.665 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccn2)[C@H]1c1c[nH]c2ccccc12 1865700078 KRUIYUYONVUMSP-JOCHJYFZSA-N 430.471 4.634 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccccc2F)cc1 1865708772 FTPDHHCQRJXMOU-GOSISDBHSA-N 442.416 4.870 50 10 IJGE COc1ccc(-c2ccc(C(=O)N/N=C(/C)c3ccc(Br)cc3)c(C)n2)cc1 1865763168 YIHLGTBVORLFLW-QFEZKATASA-N 438.325 4.982 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)CCc3nc4ccccc4[nH]c3=O)n2)cc1C 1872746564 NQNKGBGLKPGGEN-PGMHBOJBSA-N 444.516 4.789 50 10 IJGE CC(C)CC(CC(C)C)O[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1I 1899502779 GYLGXAUOEUAWEH-CVEARBPZSA-N 439.378 4.887 50 10 IJGE F[C@@]1(CBr)CCN(Cc2ccc(Br)cc2Br)C1 1917144277 ADSLXEYMNCQXGG-GFCCVEGCSA-N 429.953 4.521 50 10 IJGE FC(F)(F)[C@@H](CBr)NCc1c(Br)cccc1Br 1945323397 RHMULJUHQJJMGC-SECBINFHSA-N 439.895 4.627 50 10 IJGE CCN(C[C@@](C)(CI)OCc1cccc(C)c1)C(=O)OC(C)(C)C 2024646648 HXMAQKHAZGZREY-LJQANCHMSA-N 447.357 4.962 50 10 IJGE Clc1cc(CN2CCCC[C@@H](Br)C2)ccc1I 2026567414 RSYVVNSFFJQJHI-LLVKDONJSA-N 428.539 4.694 50 10 IJGE Clc1cc(C[C@]2(CBr)CCCCO2)ccc1I 2026570689 UEAYYOIYRSXEKP-ZDUSSCGKSA-N 429.523 4.821 50 10 IJGE Brc1cnc(N2C[C@H]3[C@H](Br)CCC[C@H]3C2)c(Br)c1 2033547418 SILUMFLRJOFODQ-JMJZKYOTSA-N 438.989 4.606 50 10 IJGE Brc1cccc(CN2CCC3(CC(Br)C3)C2)c1Br 2053754403 JWXZRCJHGQLVDC-UHFFFAOYSA-N 438.001 4.961 50 10 IJGE CCC[C@@H](Br)c1cn(-c2ccc(Cl)cc2I)nn1 2057427028 LXCQWDMLRWTMBX-SECBINFHSA-N 440.510 4.761 50 10 IJGE CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)n(C(C)C)c1 2059313471 YYPMAZIBIGJCSH-MRXNPFEDSA-N 427.408 4.953 50 10 IJGE CC(C)(C)[C@H]1[C@@H](Cl)CCN1c1ncc(I)cc1Br 2069532821 XIJZSLUCILQLIF-WDEREUQCSA-N 443.554 4.681 50 10 IJGE Br[C@@H](Cc1ccc2ccccc2n1)c1cc(I)sn1 2120031252 HQMIRCWHQXNOQL-NSHDSACASA-N 445.123 4.975 50 10 IJGE Brc1ccccc1[C@@H](CI)OC[C@@H]1C2C[C@@H]3C1[C@@H]3C2 2134523760 ZOZPKGYYFDPBLG-FGIPUQQYSA-N 433.127 4.844 50 10 IJGE C[C@]1(CBr)CC(F)(F)CN1C(=O)c1cccc(Br)c1Cl 2159049749 QENUQCXTWQWAEZ-GFCCVEGCSA-N 431.502 4.737 50 10 IJGE CN(CCCCCI)[C@@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 2211188802 GEUPYZWLVYOWHA-OAHLLOKOSA-N 438.394 4.559 50 10 IJGE F[C@@H]1C[C@H](Br)CN(Cc2cccc(Br)c2Br)C1 2213900121 KBZABLSBPGAPDF-VHSXEESVSA-N 429.953 4.519 50 10 IJGE ClCCc1nc2c(Cl)cccc2n1C[C@@H]1CC1(Br)Br 2224805722 OCTGNYFAWQFMDE-QMMMGPOBSA-N 426.967 4.977 50 10 IJGE CC1CC(CBr)(CN(CC2CCCC2)C2CN(C(=O)OC(C)(C)C)C2)C1 2265306858 YKIPWNXNTVJGDX-UHFFFAOYSA-N 429.443 4.909 50 10 IJGE COc1cc(C=C(C#N)c2nc3ccccc3[nH]2)ccc1OCc1ccc(C(=O)O)cc1 2293429899 RGIUIELPWQZGTH-UHFFFAOYSA-N 425.444 4.913 50 10 IJGE C[P@]1(=O)C[C@@H](Br)[C@@H](Cc2cc(I)ccc2Cl)C1 2307330007 IVAUZWUGPHYRHC-VKHBWIJISA-N 447.478 4.873 50 10 IJGE COc1c(Br)cc(C)c([C@@H](N)[C@H]2C[C@H](Br)C2)c1Br 2317427352 VGXSATWAFHCOBJ-UBJUHAIHSA-N 441.989 4.702 50 10 IJGE C[C@H](NC=C(C#N)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C12CC3CC(CC(C3)C1)C2 2318462011 BJWQFQZBVZEQRZ-QRYOHXEKSA-N 428.920 4.789 50 10 IJGE Clc1ccc(CN2C[C@H]3CC[C@]3(CBr)C2)c(I)c1 2318547022 YAZWSWYKGXWFTC-RISCZKNCSA-N 440.550 4.552 50 10 IJGE COc1cc(C=NNC(=O)Cc2ccc(N)cc2)ccc1OCc1ccc(C(C)(C)C)cc1 2323317890 LTSDXZQOKOXEDK-UHFFFAOYSA-N 445.563 4.847 50 10 IJGE CCOC(=O)c1cnn(-c2ccc(Cl)cc2)c1NC(=O)C(C#N)=Cc1ccc(C)cc1 2329635223 HDHJSLZHPKKFDQ-UHFFFAOYSA-N 434.883 4.557 50 10 IJGE C/C(=N\NC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 33958725 ZHNOOYJBTCXGRY-AFUMVMLFSA-N 436.855 4.655 50 10 IJGE O=C(NNc1ncnc(NC2CCCCCC2)c1[N+](=O)[O-])c1ccc(Cl)cc1Cl 40658824 AVLYIDRWKKNJBS-UHFFFAOYSA-N 439.303 4.583 50 10 IJGE CS(=O)(=O)c1ccc(C[P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1 105375185 AARDBNPTLNFXOJ-UHFFFAOYSA-N 431.517 4.584 50 10 IJGE CCCOc1c(Cl)cc(/C=N\NC(=O)CCc2nc3ccccc3nc2O)cc1Cl 169887194 WCFIPQFNZABVPO-MSXFZWOLSA-N 447.322 4.514 50 10 IJGE COc1ccc(Br)cc1/C=N/NC(=O)c1ccc2[nH]c(-c3ccccc3)nc2c1 169926827 XSIGOVRDGZJJFU-ZMOGYAJESA-N 449.308 4.765 50 10 IJGE CC[C@@H](C)N1C(=O)C(C#N)=C(C)/C(=C/c2cn(-c3ccccc3)nc2-c2ccccc2)C1=O 214253937 HINKOWOJWQJQDD-OYADDEIPSA-N 436.515 4.930 50 10 IJGE O=C(CNc1ccc2ccccc2c1)NN=Cc1ccc(OC(=O)/C=C\c2ccco2)cc1 254623549 KVDIIRXMHFUMIU-GJSLQDSPSA-N 439.471 4.614 50 10 IJGE O=C(OCc1ccccc1)N1C[C@@H](CI)[C@H](c2cccc(F)c2)C1 382737609 XXSPAZHQRBHNGR-AEFFLSMTSA-N 439.268 4.613 50 10 IJGE N#C[C@@H](Br)c1cc(OCc2ccccc2)ccc1I 390771966 LUHCWHSSEGYHQD-CQSZACIVSA-N 428.067 4.830 50 10 IJGE CCN(C(=O)c1scc(Br)c1Br)C(C)(C)CBr 688344745 GGVMFEOOPJRMOS-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE BrCc1cnc(-c2cc(I)ccc2Br)o1 701752167 KOMKBSLBXMPGJV-UHFFFAOYSA-N 442.876 4.604 50 10 IJGE Cn1nc(CC(CBr)(CBr)c2ccccc2Cl)cc1Cl 706181883 ASMCUAXUQGRSNR-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE CN(Cc1ccccc1)CC1CCN(c2nc3sccn3c2CBr)CC1 717578892 INMCBFVJACSZHZ-UHFFFAOYSA-N 433.419 4.639 50 10 IJGE CC(=O)N(C)c1ccccc1NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(C)cc2)c1C 735640268 RATKJHKYVZVTFT-PXLXIMEGSA-N 426.520 4.931 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cncc(-c3ccc(Cl)cc3)c2)c1C 758295980 HXSUUSMYLZQHPL-UHFFFAOYSA-N 430.899 4.628 50 10 IJGE COc1cc(C)cc(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)c1C 787660726 JHKPNNDFBMLIDU-ZHZULCJRSA-N 425.492 4.635 50 10 IJGE Cc1ccc(C(=O)NN=Cc2cc(Br)cc(Br)c2O)cc1Cl 1083928727 ISAAFOFFWXZMAQ-UHFFFAOYSA-N 446.526 4.643 50 10 IJGE CC(=NNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(NC(=O)c2ccccc2)cc1 1083957430 GSVWLOBVXBHYDE-UHFFFAOYSA-N 436.855 4.655 50 10 IJGE COc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2c(Cl)cccc2Cl)cc1 1865686313 TWMMPJWWYACYBI-GOSISDBHSA-N 427.291 4.714 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccc(Cl)cc2)cc1 1865694826 CQZJBUSWWUHVLZ-NRFANRHFSA-N 434.927 4.764 50 10 IJGE CCCc1nn(Cc2ccccc2)c2c1[C@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 1865715057 UPNJAVYUGASYNR-HXUWFJFHSA-N 449.352 4.865 50 10 IJGE Brc1cnc(N2CC[C@]3(CCC[C@H]3Br)C2)c(Br)c1 1918905534 XBCFXWDECWTILT-DGCLKSJQSA-N 438.989 4.751 50 10 IJGE CC(C)(C)OC(=O)N1CCCC12CCC1(CC[C@@H](CI)O1)CC2 1979984332 QGHIVLMZWVBETI-NNGSBXSVSA-N 435.346 4.683 50 10 IJGE C[C@H]1C[C@@H]1N(CCBr)Cc1c(Br)cccc1Br 2002028817 GFQXYEOGDWDHNZ-ZANVPECISA-N 425.990 4.817 50 10 IJGE C[C@H]1C[C@@H]1N(CCBr)Cc1cc(Cl)ccc1I 2002044343 ZXFVOQWYJZZNOO-ZANVPECISA-N 428.539 4.550 50 10 IJGE ClCCCc1ncc(-c2ccc(Br)cc2I)o1 2026222060 SVDGSOSYJAFGHW-UHFFFAOYSA-N 426.479 4.880 50 10 IJGE Brc1ccc(CN2C[C@H]3[C@@H](Br)CC[C@H]3C2)c(Br)c1 2031402839 LVAIOBHNIRAOHB-BIMULSAOSA-N 438.001 4.817 50 10 IJGE C[C@H]1C[C@H](CBr)CCN1Cc1cc(Cl)ccc1I 2052367782 NUDAZBYNYTZRDI-WDEREUQCSA-N 442.566 4.940 50 10 IJGE COC[C@@H](C)CCO[C@@H](CI)c1ccccc1Br 2067238221 WELKQEHMGVWYPL-FZMZJTMJSA-N 427.120 4.614 50 10 IJGE C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1N(C)C[C@H](CBr)c1ccccc1 2107354772 BALSSNLDPIQULW-NEWSRXKRSA-N 425.411 4.742 50 10 IJGE CCN(CC)[C@@H](C)CO[C@H](CI)c1ccc(Br)cc1 2119219567 ROAANOMPGYBNES-SWLSCSKDSA-N 440.163 4.672 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@H]1CCCCN1C[C@@H](CBr)CC1CC1 2128727781 ZDMFFFOIEASYIU-HZPDHXFCSA-N 439.385 4.812 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Br)C2 2134105741 UJANCDYGDBVXGP-KRYIENNFSA-N 431.552 4.643 50 10 IJGE Fc1cc(CBr)ccc1N1CCC[C@]2(CN(Cc3ccccc3)CCO2)C1 2151740889 ULAMWNWNYSEDBU-QFIPXVFZSA-N 433.365 4.592 50 10 IJGE CN(Cc1ccccc1)[C@@H]1CCN(S(=O)(=O)c2cc(Cl)cc(CCl)c2Cl)C1 2152158040 GTEQMMBLXNZCIW-QGZVFWFLSA-N 447.815 4.627 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C(=O)[C@@H](Br)C2CCCC2)Cc2ccccc21 2167033096 LXKWTHIITBKNDI-ROUUACIJSA-N 437.378 4.548 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2OCCN(CCCCCCCCCBr)[C@@H]2C1 2185534915 XLRFJXDPNZOTBF-RTBURBONSA-N 447.458 4.822 50 10 IJGE CC(C)[C@H]1CN(c2ccc(CBr)c([N+](=O)[O-])c2)CCN1Cc1ccccc1 2188576289 GISXNDOKSDGTNZ-OAQYLSRUSA-N 432.362 4.837 50 10 IJGE CN(CC[C@@H](O)c1ccc(Br)cc1Cl)C[C@H]1C[C@@H](Br)C1 2196945372 SPADZOUKYRKVOP-IFUGULHKSA-N 425.592 4.631 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1C[C@]2(CCCCN2CCCCCI)C1 2211187454 UIHPKMZNLXJAIH-RHNCMZPLSA-N 436.378 4.504 50 10 IJGE CC(C)(CCCBr)CNC(=O)Cc1ccc(Br)cc1Cl 2237436932 QAJSIJWMKOJWOF-UHFFFAOYSA-N 425.592 4.963 50 10 IJGE COc1ccc([C@H](Br)CC2CC(OC)C2)cc1I 2257357120 WSSHFTNTQWIODN-QEWOUOOISA-N 425.104 4.551 50 10 IJGE CCCN[C@H](c1ccc(OC)c(I)c1)C1CC(Br)C1 2269589280 XNFLLBRMQBLSIG-KOHJWAIASA-N 438.147 4.514 50 10 IJGE C[C@@H]1CCCN(C(=O)c2ccc(Cl)c(I)c2)[C@@H]1CCCl 2283660258 BWIUSEPHENKKJZ-QMTHXVAHSA-N 426.125 4.814 50 10 IJGE CN(C[C@@H]1CCC[C@@H]1Br)C(=O)c1cc(Br)c(F)cc1Cl 2285843589 ATMLBSHXPDGAOS-WPRPVWTQSA-N 427.539 4.877 50 10 IJGE CCCCN(CCBr)Cc1ccc(Cl)cc1I 2302325863 KVYRKEOBKCKNLF-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE ClCC[C@H](NCc1ccc(I)c(Br)c1)C1CC1 2306222649 WZZQJQAWGPRJPR-ZDUSSCGKSA-N 428.539 4.551 50 10 IJGE CCC(CBr)(CBr)Cc1c(OC)ncc(Br)c1C 2319570813 FLWHGBBIPAJFKR-UHFFFAOYSA-N 444.005 4.890 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cc2c(s1)CCSC2 2320359213 ZFKJADLTISAIHY-MRXNPFEDSA-N 440.428 4.638 50 10 IJGE Cc1cccc(NC(=O)C(C#N)=CN2CCN(C(c3ccccc3)c3ccccc3)CC2)c1 2325370641 MNTYZSQQFCCAGE-UHFFFAOYSA-N 436.559 4.748 50 10 IJGE CCn1nc(Br)nc1C[C@@H](Br)c1ccccc1Br 2328446629 CISYUITUAMROHA-SNVBAGLBSA-N 437.961 4.502 50 10 IJGE COc1cc(OC)c(OC)cc1C=C(C#N)c1nc(-c2ccc(OC)c(OC)c2)cs1 2331417983 GTDWGSUYPXKVAX-UHFFFAOYSA-N 438.505 4.917 50 10 IJGE CCCc1sc(Br)cc1[C@@H](Br)C1CC(S(C)(=O)=O)C1 2338025331 GHWXPJFKTOZNCV-RPTIHFLNSA-N 430.227 4.722 50 10 IJGE CN(C[C@H](CBr)CC1CC1)C1C[C@@H]2C[C@H](C1)CN(C(=O)OC(C)(C)C)C2 2339978656 WDQVUIGGOBTQIK-TUVJXNFZSA-N 429.443 4.765 50 10 IJGE O=S(=O)(CCCN(Cc1ccccc1)C1(CBr)CCC1)c1ccccc1 2343343606 VWUNPBMOOFKDSZ-UHFFFAOYSA-N 436.415 4.670 50 10 IJGE C[C@@H](Br)CCCc1cn(Cc2sc(Cl)cc2Br)nn1 2346070113 KLYRITDNSLLKHD-MRVPVSSYSA-N 427.593 4.910 50 10 IJGE CC(C)[C@@H](Cl)C(C)(C)CNC(=O)c1ccc(Cl)c(I)c1 2366004647 FKQDEXUUGLPKPB-CYBMUJFWSA-N 428.141 4.964 50 10 IJGE C[C@H]1C[C@H]2C[C@]([C@H](Br)c3cc(I)cc4c3OCC4)(C2)O1 2368505245 MNKXMJGYGGRWMH-VCXDHIOWSA-N 449.126 4.620 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)[C@](C)(C(=O)O)c1ccc(OCc2ccccc2)cc1 2374415561 QFWDSVSJZLUCQY-JLMWRMLUSA-N 432.358 4.671 50 10 IJGE COc1ccc2nc(/C(C#N)=C/c3ccc(OCc4cccc(C(=O)O)c4)cc3)[nH]c2c1 33476004 SPQYAXVAUICUEC-YBFXNURJSA-N 425.444 4.913 50 10 IJGE CCOc1ccc2ccccc2c1/C=N/NC(=O)COc1ccccc1Br 40912185 VFRIJYVOOARTFS-YDZHTSKRSA-N 427.298 4.530 50 10 IJGE Cc1nn(-c2ccccc2)c(C)c1/C=N/NC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 59155284 LDDLJRVJIQXFTR-ZIFAQYRBSA-N 431.323 4.714 50 10 IJGE COc1ccc(CNC(=O)/C(C#N)=C/c2ccc(OCc3ccc(C)cc3)c(OC)c2)cc1 59266443 FGQKMUKVKLYGLJ-OEAKJJBVSA-N 442.515 4.815 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@@H]1Br)c1ccc(Br)c(Cl)c1 123770455 KEMNOWGWOCPAHI-DZGCQCFKSA-N 429.539 4.893 50 10 IJGE CCCOc1c(OC)cc(/C=N/NC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)cc1OC 169889034 CCIMSONRFGMXMB-BLGOAPBQSA-N 428.573 4.939 50 10 IJGE CCN(Cc1ccccc1)c1ccc(/C=N\NC(=O)c2ccc3nc(N)sc3c2)cc1 169916659 PZLLEHGAHYBPCB-YSMPRRRNSA-N 429.549 4.669 50 10 IJGE CC[C@@H](CCBr)NC(=O)c1cc(Br)cc(Br)c1 233873838 LDXGIPGDVGKGQL-NSHDSACASA-N 427.962 4.505 50 10 IJGE Cc1ccc(OCC(=O)NN=Cc2ccc(-c3ccc(Br)cc3)o2)cc1C 254700303 ORNOVDLXUCNWRT-UHFFFAOYSA-N 427.298 4.855 50 10 IJGE ClCc1nc2cccnc2n1-c1cc(I)ccc1Br 388500670 FYRGZQGLAPTQPG-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE ClCc1ccc(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@@H]32)cc1Br 404208337 VJRBOZYRWCJAGY-LEWJYISDSA-N 435.793 4.668 50 10 IJGE CC(C)(C)[Si](C)(C)OCCN1C[C@H](S(=O)(=O)c2ccccc2)Cc2ccccc21 616672848 OKDNRVLXDHCVHE-OAQYLSRUSA-N 431.674 4.913 50 10 IJGE CC[C@](C)(CBr)NC(=O)c1scc(Br)c1Br 705517065 YCKNLALJJTYPQM-SNVBAGLBSA-N 433.991 4.567 50 10 IJGE O=C(Nc1cc(F)ccc1C(=O)NNc1cc(C(F)(F)F)ccc1F)c1ccoc1 754149498 XNVLIPYDGWHJML-UHFFFAOYSA-N 425.313 4.586 50 10 IJGE C=CCc1cc(/C=C(\C#N)C(=O)N(C)C)cc(Br)c1OCc1ccc(F)cc1 1084263193 JFHBHQBKVQUTMV-WOJGMQOQSA-N 443.316 4.891 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc(CSCc3ccccc3)cc2)cc1[N+](=O)[O-] 1084519176 YSACHFVULTXIOE-UHFFFAOYSA-N 435.505 4.801 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C(F)(F)c2cccc(Cl)c2Cl)c1C 1638363067 PVCRNUDGADMZGI-UHFFFAOYSA-N 438.265 4.697 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccc(F)cc2)[C@@H]1c1cccc(O)c1 1865680950 AVDZDHIHTYOPEX-JOCHJYFZSA-N 438.462 4.661 50 10 IJGE CCCc1nn(C)c2c1[C@H](c1ccccc1OCc1ccccc1Cl)C(C#N)=C(N)O2 1865702456 ASSXEWXDSHGSHJ-OAQYLSRUSA-N 434.927 4.823 50 10 IJGE Cc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(C(=O)O)cc2)cc1 1865708573 BNDPPSPBDMETCF-QFIPXVFZSA-N 448.482 4.764 50 10 IJGE CC(C)c1nc2c(Cl)cc(C(F)(F)F)cn2c1/C=N/NC(=O)COc1ccccc1 1865762542 NKURTYNSZWNESH-YCPBAFNGSA-N 438.837 4.659 50 10 IJGE COc1ccccc1-c1csc(/C(C#N)=C(\O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)n1 1872747118 OBEFMMCBGRRWSA-QIDKZVQTSA-N 431.517 4.660 50 10 IJGE CN(C[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)OC(C)(C)C 1880766271 GHKSRDNVBMCJQR-KGLIPLIRSA-N 437.419 4.804 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C[C@@H]1CN(C(=O)OC(C)(C)C)CC12CCC2 1883484717 BPDKHTIHCNFSOT-HUUCEWRRSA-N 447.414 4.702 50 10 IJGE CCN(C[C@](C)(CI)O[C@H]1CC[C@@H]2C[C@@H]2C1)C(=O)OC(C)(C)C 1917431936 CNVKOIXZDYYZHY-BSXFFOKHSA-N 437.362 4.642 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2nc3ccccn3c2CBr)C1 1921468413 DTCYWSHOYFNYFY-QZTJIDSGSA-N 427.390 4.576 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@@]1(CCC[C@H](CI)O1)C2 1949545463 AGKZDVKFMWUETI-BEFAXECRSA-N 449.373 4.931 50 10 IJGE C[C@H](Br)[C@@H]1CCN(Cc2cc(Br)ccc2Br)C1 2006501895 WMFZPCHNMQSUOA-VHSXEESVSA-N 425.990 4.817 50 10 IJGE CCOc1c(Br)cc(C[C@@H](CBr)OC)cc1Br 2008748222 IXYZZLNXGDMRBZ-VIFPVBQESA-N 430.962 4.563 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1ccccc1OCc1ccccc1 2023033771 KVARUVYCFIFZEP-MAUKXSAKSA-N 437.321 4.845 50 10 IJGE COc1ccc(F)c(Cn2nc(CBr)c(Br)c2C(F)(F)F)c1 2079232738 DLPPONOAMYWNMI-UHFFFAOYSA-N 446.036 4.755 50 10 IJGE Cc1ccc(-n2nc(CBr)c(I)c2C(F)(F)F)cc1 2079257673 CCLWLWADUGJWPI-UHFFFAOYSA-N 445.020 4.699 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@@H]2C[C@H](Cl)CC[C@@H]21 2087663184 HVZZYQREJPNWBP-MRTMQBJTSA-N 427.589 4.895 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CCCN(C[C@@H](CBr)CC3CC3)C2)C1 2112868326 IRBAGDXEOAZZAM-WIYYLYMNSA-N 429.443 4.911 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc2c(c1)CCN(C(=O)[C@@H](Br)C1CCCC1)C2 2167034075 QKADNXQZTKKDQP-SFHVURJKSA-N 437.378 4.872 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2C1[C@@H]2CN(Cc3ccccc3)C[C@@H]12 2184941043 NXVHVTBJVOQZJE-HZPDHXFCSA-N 445.792 4.586 50 10 IJGE CC1(C)[C@H]2CC[C@@H](C2)[C@]1(CI)O[C@H]1CCN(Cc2ccccc2)C1 2250382563 DZWXRQWHWBSEQY-IWFBPKFRSA-N 439.381 4.907 50 10 IJGE C[C@@](CBr)(NC(=O)c1cc(F)c(Br)cc1Cl)C(F)(F)F 2282987624 GITHALFBZVLCGJ-JTQLQIEISA-N 441.444 4.687 50 10 IJGE CCCc1cc(C(=O)OC)c(NC(=O)C(C#N)=Cc2c[nH]nc2-c2ccc(F)cc2)s1 2295347898 QJPCGOVQLPSZLF-UHFFFAOYSA-N 438.484 4.562 50 10 IJGE Cc1c(C(=O)N(C)C)sc(NC(=O)C(C#N)=Cc2cn(C(C)C)c3ccccc23)c1C#N 2295672702 UTZAZUSAXLUEDB-UHFFFAOYSA-N 445.548 4.711 50 10 IJGE N#CC(=Cc1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 2314480582 JSPYZDJMDVDTHO-UHFFFAOYSA-N 435.443 4.993 50 10 IJGE CC(C)(C)OC(=O)N[C@@]12CCC(F)(F)C[C@@H]1CN(CCCCCBr)C2 2320884464 LAHBCSAYTNSNNW-RHSMWYFYSA-N 425.358 4.566 50 10 IJGE O=C(CCC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N/N=C/c1ccc(Cl)cc1 3099705 MCSUSZNXRSAUOD-YSURURNPSA-N 432.229 4.881 50 10 IJGE COc1ccc([C@@H]2CC(=O)N3CN(c4ccc(Cl)cc4)CSC3=C2C#N)cc1OC 9693118 YSXHSGGOFWWUAD-KRWDZBQOSA-N 441.940 4.577 50 10 IJGE CCCCN(CCCC)Cc1ccc(C(=O)NNC(=S)Nc2cccc(Cl)c2)o1 20734880 YXYBJROMSWXONB-UHFFFAOYSA-N 437.009 4.967 50 10 IJGE COc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccc(Cl)cc4)ccc32)c1 38650245 GPZQWASEQGDHLQ-XMMPIXPASA-N 446.890 4.715 50 10 IJGE COc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4cc(C)ccc4C)c(C)c32)cc1 40813826 FXTAWEYDFUFQEO-VFCFBJKWSA-N 445.519 4.936 50 10 IJGE Cc1occc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3ccccc3Cl)c(C)c21 40823524 OFNLFODQYPAOEU-KOEQRZSOSA-N 425.872 4.866 50 10 IJGE COc1ccc(/C=N/NC(=O)CSc2nc(-c3ccc(Cl)cc3)cs2)c(OC)c1 40924751 XIXUYVIHWDHCTO-LSHDLFTRSA-N 447.969 4.723 50 10 IJGE CCOc1ccc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccccc4)nc3c2)cc1Cl 169925768 KIGQBUMLTYJGNR-YSMPRRRNSA-N 432.911 4.970 50 10 IJGE CCOc1cc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4)nc3c2)cc(Cl)c1O 169926948 GGQOFYUPFVLFLF-DHRITJCHSA-N 434.883 4.752 50 10 IJGE CC(C)(C)c1ccc(C(=O)Oc2ccc(C=NNC(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1 254482100 GJFJCFFAGXKHFA-UHFFFAOYSA-N 445.475 4.875 50 10 IJGE CC1(C)[C@H](Br)CCN1C(=O)c1cc(Br)c(Br)s1 383922931 AIIIGHHRIRGSQY-MRVPVSSYSA-N 446.002 4.661 50 10 IJGE Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)NNc1ccc(F)c(F)c1F 728718255 CLJHGPJVCBPQCD-UHFFFAOYSA-N 427.835 4.858 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1ccc(COc2ccccc2)o1)c1ccccc1C(F)(F)F 742035712 WPTGRIXSVCAGSD-SQFISAMPSA-N 444.409 4.742 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc(Oc3ccccc3Cl)nc2)c1C 746692117 PKIUHCGMBZBWCQ-UHFFFAOYSA-N 446.898 4.753 50 10 IJGE Cc1cc(C(=O)NNc2nc(C(F)(F)F)cs2)ccc1NC(=O)c1cccs1 760166911 KOBZMBGYHVFVIB-UHFFFAOYSA-N 426.445 4.541 50 10 IJGE CC(C)Oc1cc(Br)ccc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799749459 HEUUSFLVPGSXLE-UHFFFAOYSA-N 442.235 4.884 50 10 IJGE Cc1nc(NCC(=O)NNc2ccc(F)c(F)c2)c2cc(-c3ccccc3)sc2n1 1179778219 QDMZMBMLQLHQLY-UHFFFAOYSA-N 425.464 4.500 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2 1440536443 USHZORYCCATBQZ-LBPRGKRZSA-N 438.471 4.531 50 10 IJGE C=CCCC[C@@H](C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1)c1ccccc1 1463556225 NVFGBXXWSGAMLL-OXJNMPFZSA-N 445.357 4.504 50 10 IJGE COc1cccc(O[C@H](C)C(=O)NN=Cc2cn(Cc3ccccc3)c3ccccc23)c1 1772756155 MFMVEEPXWUDUTP-LJQANCHMSA-N 427.504 4.616 50 10 IJGE COc1ccc(-c2nn(-c3cccc(Cl)c3)c3c2[C@@H](c2ccc[nH]2)C(C#N)=C(N)O3)cc1 1865710483 ZACTZZSPKHNJQK-HXUWFJFHSA-N 443.894 4.748 50 10 IJGE Cc1ccc(SCCCC(=O)NNC(=O)c2ccc(OCc3ccccc3)cc2)cc1 1865755591 HDVNSPLTECKIPU-UHFFFAOYSA-N 434.561 4.908 50 10 IJGE COc1cc(Br)c([C@H](Br)[C@@H]2C[C@H]2Br)cc1OC 1910111321 GGRDCVKGNKEMLM-SLOVDRIHSA-N 428.946 4.686 50 10 IJGE O=C(c1cc(F)cc([N+](=O)[O-])c1F)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915263637 HOGLOKZHDKQMCU-KRWDZBQOSA-N 439.256 4.689 50 10 IJGE O=C(c1c(F)ccc([N+](=O)[O-])c1F)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915265992 SYEWRDDMBPAAKY-INIZCTEOSA-N 439.256 4.689 50 10 IJGE CC1(CO[C@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)CCCC1 1938032817 LQRHNXOTXBCGKE-SFHVURJKSA-N 437.362 4.788 50 10 IJGE BrCCN(Cc1cccc(Br)c1Br)CC1CC1 1943884342 QENQTYFGAHTOIZ-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCCC[C@@H]1CBr 1945189531 SRWBFJQCDYOISN-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCC[C@@H](Br)CC1 1945190390 MGZAQLBTUBINMN-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE C[C@H]1C[C@@H](CBr)CN1C(=O)c1cc(Br)c(Br)s1 1950507821 INPOYPNANZQMSP-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE Cc1cc([C@@H](Br)c2cc(I)sn2)c(C)cc1F 2007646891 DBMYNEFSPMHLBD-GFCCVEGCSA-N 426.092 4.988 50 10 IJGE CC(C)(CCCCl)CNc1ncc(I)cc1Br 2015757248 QUICNUBXJNEYCS-UHFFFAOYSA-N 431.543 4.906 50 10 IJGE CN(C(=O)c1c(Br)cccc1Br)[C@@H]1CCC[C@H]1Br 2033088317 GYKXYQLAIJFBGH-LDYMZIIASA-N 439.973 4.600 50 10 IJGE COCCOC[C@@H](Br)CCc1c(Br)cccc1Br 2038178173 MSPNMYBQPCIMSV-JTQLQIEISA-N 444.989 4.571 50 10 IJGE C[C@H]1C[C@H](C(F)(F)F)N(CC(C)(C)CBr)CCN1C(=O)OC(C)(C)C 2058049374 MLULFDXEINGJCC-QWHCGFSZSA-N 431.337 4.670 50 10 IJGE C[C@@]1(NC(=O)c2c(Br)cccc2Br)CCC[C@@H]1Br 2062577267 CHHVBSNZKVRGBF-GXFFZTMASA-N 439.973 4.648 50 10 IJGE C[C@@H](Cl)C12CCC(CC1)N2c1ncc(I)cc1Br 2069533370 HBXUSCZCAGVRCC-NCZMNARYSA-N 441.538 4.577 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1ccc(Br)c(F)c1 2117895027 ORTFSZQJDSVAOV-SNVBAGLBSA-N 442.110 4.702 50 10 IJGE O=S(=O)(N1CCC(CCBr)CC1)N(Cc1ccccc1)C1CCCCC1 2123368019 AHASSRUTZZKSAR-UHFFFAOYSA-N 443.451 4.563 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@H](Br)c2cc(Cl)c(Br)s2)C1 2137224446 BGFAHVSJLXOYHU-KOLSJAJHSA-N 448.629 4.815 50 10 IJGE CN([C@@H]1CC[C@H]1OCc1ccccc1)S(=O)(=O)c1cc(Cl)cc(CCl)c1F 2156443217 PYYDVSQGNWTJAX-IAGOWNOFSA-N 432.344 4.586 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)c1ccc(CNC(=O)OC(C)(C)C)cc1 2162881778 VUHLSVNGYQIKDG-UHFFFAOYSA-N 433.346 4.883 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCC2)C[C@@H](CBr)c2ccccc2)C1 2163059561 UOUIIZXDNWKULS-LJQANCHMSA-N 437.422 4.887 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2CN(C[C@@H](CBr)c3ccccc3)C(C)(C)[C@@H]2C1 2163064455 UPUHKFAIPGFONE-GUDVDZBRSA-N 437.422 4.742 50 10 IJGE C[C@H](N(C)S(=O)(=O)c1cc(CBr)sc1Br)C1(C)CCC1 2179790659 HKQDCSKPKUNIQN-VIFPVBQESA-N 445.242 4.605 50 10 IJGE O=C(c1cc(Cl)ccc1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Br)C2 2190678754 NEOMXLWGRCMKHS-WTFGDDLMSA-N 425.523 4.581 50 10 IJGE Clc1c(Br)ccc(CBr)c1N1CC[C@@H](c2nncs2)C1 2196555232 RSFGOUQHTGNHDP-SECBINFHSA-N 437.588 4.843 50 10 IJGE FC1(F)[C@@H]2[C@@H](O[C@@H](CI)c3ccc(Br)cc3)CC[C@H]21 2230422051 WGWBXMWFQKVSDR-VOAKCMCISA-N 443.069 4.986 50 10 IJGE O=C(NC[C@]12CCC[C@]1(CBr)C2)c1scc(Br)c1Cl 2264504057 LVLWKVBTIWLKDM-CHWSQXEVSA-N 427.589 4.849 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@H]2CC[C@H](Br)[C@H]1C2 2264506558 JSXVTJCSKWCFMF-KHQFGBGNSA-N 427.589 4.942 50 10 IJGE C[C@@H](Br)C1CCN(C(=O)c2cc(Br)c(F)cc2Cl)CC1 2285843965 GTDNWIVKLWCGJA-MRVPVSSYSA-N 427.539 4.877 50 10 IJGE C[C@@H]1CCN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@@H]1CBr 2285959311 PQBBSOPSAXUTKP-BDAKNGLRSA-N 427.539 4.735 50 10 IJGE CCO[C@@]1(COc2c(Br)cc(Br)cc2CCl)CCOC1 2287069313 LWTQHQFOYHHMGI-AWEZNQCLSA-N 428.548 4.525 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Br)c2)C[C@H]1Cl 2306219111 IPVABHFFJKILJZ-GFCCVEGCSA-N 428.539 4.503 50 10 IJGE N#CC(=Cc1ccc(OCC(=O)Nc2ccc(F)cc2)cc1)c1nc(O)c2ccccc2n1 2314433781 SVFLCXGBCJJJMR-UHFFFAOYSA-N 440.434 4.556 50 10 IJGE C[C@]1(CCCl)CCN(Cc2ccc(I)c(Br)c2)C1 2325209941 TVRVPHDNRXLJPD-AWEZNQCLSA-N 442.566 4.895 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)Cc1nccc(OCCCOC)c1C 2364654736 GEKWLKWEJCBXPR-FQEVSTJZSA-N 435.406 4.981 50 10 IJGE CCOc1ccccc1[C@@H]1C(C#N)=C2N=C(N)c3ccccc3N2C2=C1C(=O)CC(C)(C)C2 3654532 GLFZLJCDUPPWOU-HSZRJFAPSA-N 438.531 4.786 50 10 IJGE CCCCCOc1ccc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cc1 14029469 LPUOPVKRPSSKIA-UHFFFAOYSA-N 432.520 4.763 50 10 IJGE O=C(N/N=C/c1coc2ccc(Cl)cc2c1=O)c1cc2cc(Br)ccc2o1 20494010 NWNVYSOIIZQPSK-GZIVZEMBSA-N 445.656 4.719 50 10 IJGE Cc1ccc(/C=C(/C#N)C(=O)Nc2ccc(NC(=O)/C(C#N)=C/c3ccc(C)o3)cc2)o1 33248196 LOTIUWJADRPXEQ-MJZABRMRSA-N 426.432 4.581 50 10 IJGE O=C(N/N=C/c1ccccc1OCc1ccccc1Cl)c1cccc(N2CCCC2=O)c1 58986239 GRZKAPJWZGHDDP-JVWAILMASA-N 447.922 4.810 50 10 IJGE CC(CBr)(CBr)Cc1ccc(I)cc1 118126616 WZABFBJFALHMRR-UHFFFAOYSA-N 431.937 4.630 50 10 IJGE COc1ccc([C@H](C)NC(=O)/C(C#N)=C\N(c2ccccc2)c2ccc(N)cc2)cc1OC 217173162 IDQUXMWUQJQGSS-CIJMEZBMSA-N 442.519 4.709 50 10 IJGE CCN(CC)c1c(/C=N/NC(=O)CCCNc2ccc(C)cc2)c(C)nn1-c1ccccc1 253561368 CASKLPYNKADXKB-TURZUDJPSA-N 446.599 4.678 50 10 IJGE ClCc1cn(-c2c(Br)cc(Br)cc2Br)cn1 300735483 KXRQPLNJBPROAR-UHFFFAOYSA-N 429.337 4.899 50 10 IJGE CN1/C(=C(\C#N)C(=O)CSc2nc3c(n2-c2ccccc2)CCCC3)Nc2ccccc21 302773118 CTVXDKCZHMLXCZ-HKOYGPOVSA-N 441.560 4.709 50 10 IJGE FC(F)(F)c1nc(-c2ncc(Br)cc2Br)ncc1CCl 379600038 FUFPPDCPOVMKRU-UHFFFAOYSA-N 431.437 4.821 50 10 IJGE C[C@H](Cl)c1nc2c(Br)cccc2n1C[C@H]1CN(Cc2ccccc2)CCO1 380403913 BZYFXZNOUCJUNH-DOTOQJQBSA-N 448.792 5.000 50 10 IJGE Nc1cccc(Cl)c1[C@H]1CN(Cc2ccccc2)C[C@H]1CI 382715606 KBPPUJIBYCQNOH-CABCVRRESA-N 426.729 4.573 50 10 IJGE BrCC(CBr)(Cc1coc(Br)c1)C1CCOCC1 696814834 YSGJBPCCEMJMIG-UHFFFAOYSA-N 444.989 4.787 50 10 IJGE O=C(NC[C@H]1CCC[C@H]1Br)c1scc(Br)c1Br 705396989 BEJQEJVFJCBFNP-RNFRBKRXSA-N 446.002 4.567 50 10 IJGE CC(C)C[C@@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1cccc(C(F)(F)F)c1 726799265 NBNWAIVZKVKBCW-LJQANCHMSA-N 444.457 4.985 50 10 IJGE Cc1ccc(/C=C/C(=O)NS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)cn1 774342165 FMHPUNPGUMRZIV-RUDMXATFSA-N 428.404 4.566 50 10 IJGE N#Cc1ccc(NNC(=O)NCc2cccc(COCc3ccco3)c2)c(C(F)(F)F)c1 799539506 YJDDSZGSBLFHCZ-UHFFFAOYSA-N 444.413 4.713 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2ccc(-c3ccc(Cl)c(C(=O)OC)c3)o2)cc1 1084458536 SUXUQPICYOFDRL-UHFFFAOYSA-N 426.856 4.549 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)NCc2cccs2)ccc1OCc1ccccc1C#N 1084515943 SCXGRONUPKZDAJ-MTJSOVHGSA-N 443.528 4.821 50 10 IJGE CC(=O)c1cc(C(=O)NNC(=O)c2sc3cc(F)ccc3c2Cl)ccc1OC(C)C 1650704584 PNMMMCOFQFNGOZ-UHFFFAOYSA-N 448.903 4.758 50 10 IJGE CC(=O)c1cc(Br)c(F)cc1OS(=O)(=O)c1ccc(CCCCl)cc1 1661010112 UZJQXVLWQLLQEM-UHFFFAOYSA-N 449.725 4.730 50 10 IJGE COc1ccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4cc(C)ccc4C)c(C)c32)cc1 1772745595 FXTAWEYDFUFQEO-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE CCc1nn(Cc2ccccc2)c2c1[C@@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865702716 ZYONZUBINWZUKW-QHCPKHFHSA-N 427.552 4.558 50 10 IJGE COC(=O)c1sc2cc(Br)ccc2c1NC(=O)/C(C#N)=C/c1ccccc1 1873763198 CQSFBUMZSYBHNU-UKTHLTGXSA-N 441.306 4.996 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)CCC1(NC(=O)OC(C)(C)C)CCCCC1 1887832598 HRRWEGMQXZAFIT-IYBDPMFKSA-N 431.415 4.626 50 10 IJGE C[C@@H]1OCCO[C@H]1[C@H](Br)c1cc(Br)c(Br)s1 1935543614 RZCGAFWUBMKJAJ-LQQYEPNUSA-N 434.975 4.513 50 10 IJGE CC[C@@](C)(CBr)NC(=O)c1csc(Br)c1Br 1937737481 ISRJDHXBSLDCOI-JTQLQIEISA-N 433.991 4.567 50 10 IJGE CC(C)[C@H](Br)CCNC(=O)c1cc(Br)sc1Br 1942762281 PNEWDNTZFWWILZ-MRVPVSSYSA-N 448.018 4.813 50 10 IJGE C[C@@H]1C[C@H](CBr)CN1C(=O)c1csc(Br)c1Br 1950523252 SOLMSFDQBCDCED-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE Cc1cc(Br)c([C@H](Br)c2cn(C)nc2Br)s1 1981648775 SRLCREWNTXHALJ-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE CN(Cc1c(Br)cccc1Br)C[C@H]1C[C@@H](Br)C1 2020194341 NINGGHKKOWDOGP-AOOOYVTPSA-N 425.990 4.817 50 10 IJGE CC[C@@H](Br)CN(CC)C(=O)c1ccc(Br)cc1Br 2044551465 URVDEAULRNXHHP-SECBINFHSA-N 441.989 4.847 50 10 IJGE O=C(CBr)c1c(OC(F)(F)F)cc(Br)cc1C(F)(F)F 2054794350 SNOVIFBNDCRWQO-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE Brc1ccc(CN2C[C@H]3C[C@H](Br)C[C@H]3C2)c(Br)c1 2065396865 JUPFYHCLZBLYTB-PJXYFTJBSA-N 438.001 4.817 50 10 IJGE CCC[C@@H](Cl)CCNC(=O)c1ccc(Br)cc1I 2086145572 OFXHOPHHJCYMJU-SNVBAGLBSA-N 444.538 4.581 50 10 IJGE Br[C@@H]1CC[C@H]2CCCN(Cc3ccc(I)cc3)[C@H]2C1 2110680847 XACHFHSISIPHHY-FMKPAKJESA-N 434.159 4.819 50 10 IJGE FC(F)(F)c1ccc(N2CC3(CN(Cc4ccccc4)C3)C2)cc1CBr 2124838841 KZPIPPVMIMJFBN-UHFFFAOYSA-N 425.292 4.923 50 10 IJGE O=C(NC[C@@]12CC[C@@H]1CCCN2CC1(CBr)CCCCCC1)C(F)(F)F 2163059778 WHRVKECWQYAVCE-YJBOKZPZSA-N 439.360 4.645 50 10 IJGE CCC(CC)(CBr)CN1C[C@@H](CNC(=O)OC(C)(C)C)CC12CCOCC2 2163060047 YXCQTTYSFXHALX-QGZVFWFLSA-N 447.458 4.584 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@H](CBr)C2CCC2)C[C@@H]1c1ccccc1 2163060175 ZYRDPYQGERNHID-XUVXKRRUSA-N 437.422 4.790 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC[C@H](NC(=O)[C@@H](Br)C3CCCC3)C2)CC1 2167035010 ZNOBDLQDKFTLNV-IRXDYDNUSA-N 443.426 4.626 50 10 IJGE Cc1nc(Oc2cc(Br)c(F)cc2[N+](=O)[O-])sc1CBr 2168675135 UXHAPHKAAIEHON-UHFFFAOYSA-N 426.061 4.949 50 10 IJGE BrC[C@H]1CCc2nc(C3C[C@@H]4CC[C@H](C3)N4Cc3ccccc3)ncc2C1 2187368135 KSKFHLXIAGUNPY-XAJVHEMHSA-N 426.402 4.887 50 10 IJGE FC(F)(F)c1ccccc1CO[C@H](CCl)[C@@H](I)CCl 2227755178 SRGJJIQGKAQDMO-WDEREUQCSA-N 427.031 4.872 50 10 IJGE C[C@@H](CC[S@](C)=O)n1c(CCl)nc2cc(Br)c(Br)cc21 2234063424 DHRHVKQDBGRZDV-FHZGZLOMSA-N 442.604 4.630 50 10 IJGE COc1ccc([C@H](Br)CC2CCOCC2)cc1I 2257357602 YPOWZKUFDRKZLB-GFCCVEGCSA-N 425.104 4.553 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CC2(CBr)CC(F)C2)C2(CCCCC2)C1 2265632574 NZOLTJIBLBMHME-KOHRHEQBSA-N 433.406 4.802 50 10 IJGE CC1(C)C[C@@H](CBr)N(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285843800 DSLGIWDKVFRPRB-QMMMGPOBSA-N 427.539 4.877 50 10 IJGE Clc1ccc(CN2CCC[C@@H](CCBr)C2)cc1I 2315550438 DJYJBIHLYOELBC-NSHDSACASA-N 442.566 4.942 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Br)c1ccc(F)c(F)c1 2316833133 WBTYJCZZURDYJL-MRVPVSSYSA-N 444.899 4.708 50 10 IJGE Clc1ccc(C[C@]2(CBr)O[C@H]3CC[C@H]2C3)c(I)c1 2327576518 CUAITBOBOYJCDI-VHRBIJSZSA-N 441.534 4.820 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)[C@H]3CC(=O)N(Cc4ccccc4)C3)n2)cc1F 2331336924 KROODCTUJGEUFS-KRWDZBQOSA-N 449.507 4.799 50 10 IJGE COc1c(C)cc(C)cc1-c1csc(C(C#N)=C(O)CN2C(=O)c3ccccc3C2=O)n1 2331371812 KEEYPQDQPIQSJX-UHFFFAOYSA-N 445.500 4.524 50 10 IJGE C[C@@H](CC1CCN(C[C@]2(CBr)CC2(F)F)CC1)N(C)C(=O)OC(C)(C)C 2351892750 TXNRFEVAXKVJFS-KBXCAEBGSA-N 439.385 4.764 50 10 IJGE CCOCc1cc(Br)c([C@@H](Br)[C@]23COC[C@H]2C3(F)F)s1 2358448081 XJOHFQODAUTSHF-JLLWLGSASA-N 432.124 4.765 50 10 IJGE Cc1cc(C(=O)N2CC[C@H](Br)C[C@H]2C(F)(F)F)c(Br)s1 2361459959 BIGRQGIWPJKSIQ-CBAPKCEASA-N 435.103 4.749 50 10 IJGE CCCNC(=O)c1oc2c(c1C)/C(=N/NC(=O)C(c1ccccc1)c1ccccc1)CCC2 40815487 AZMIPYGNCIFWBM-XHLNEMQHSA-N 443.547 4.717 50 10 IJGE CCC(CC)(CBr)CNS(=O)(=O)c1ccc(Cl)c(Br)c1 230255720 GGGKZPJYJQGIQX-UHFFFAOYSA-N 447.620 4.582 50 10 IJGE CCC(CC)(CCl)NC(=O)c1cc(I)ccc1Br 232861059 MFSYQIWRRVBTCU-UHFFFAOYSA-N 444.538 4.581 50 10 IJGE Cn1c(SCC(=O)NN=Cc2cccc(Oc3ccccc3)c2)nnc1-c1ccccc1 254577327 BVCACWNITUCGBJ-UHFFFAOYSA-N 443.532 4.517 50 10 IJGE CC(C)(C)[C@@H](Br)CNC(=O)c1cc(Br)sc1Br 324648335 ZRGJZDIVZKYDRJ-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE CC(C)SCCn1c(CCCl)nc2cc(I)c(F)cc21 380417512 WHDCISHFMORIJN-UHFFFAOYSA-N 426.726 4.703 50 10 IJGE CC[C@@H](Br)CCCNC(=O)c1cc(Br)cc(Br)c1 398587113 WGUXFAVNEISFDR-SNVBAGLBSA-N 441.989 4.895 50 10 IJGE Cc1cccc2c(CCNC(=O)/C(C#N)=C/c3cn(CCC#N)nc3-c3ccccc3)c[nH]c12 741704592 FYSNYLGNFFGDHJ-PXLXIMEGSA-N 448.530 4.519 50 10 IJGE Cc1onc(-c2cccc(Cl)c2Cl)c1C(=O)NNC(=O)c1cccc2cccnc12 797716778 AATUKKVSOHWUOZ-UHFFFAOYSA-N 441.274 4.580 50 10 IJGE CCCc1c(C(=O)NNc2nc3ccccc3[nH]c2=S)nnn1-c1cccc(C(C)C)c1 1585173648 IYYQGQPGFALXIC-UHFFFAOYSA-N 447.568 4.706 50 10 IJGE Cc1cc(CNC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc4ccccc34)c2C)cc(O)n1 1630338957 AUAAZASGMOZJGN-OEAKJJBVSA-N 436.515 4.880 50 10 IJGE C/C(=C/C(=O)NNc1ccccc1I)c1ccccc1C(F)(F)F 1643723409 VGVJAVUVXJWTBO-KHPPLWFESA-N 446.210 4.857 50 10 IJGE C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccccc1Oc1ccccc1 1644535337 YJXPTFQUUGJWIQ-SFHVURJKSA-N 431.920 4.958 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccc1C)CCC2 1772744431 XGSAJUVFWVPEAW-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE Cc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2Cc1cccc(F)c1 1865712931 MIADZGQPUIYRDI-QGZVFWFLSA-N 428.389 4.616 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@H]2c2ccccc2)cc1 1867059928 YMMWUPFIKJPLJD-VXNXHJTFSA-N 441.556 4.729 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1Cc1c(Br)cccc1Br 1945333844 VTDPYMMOUTXBRN-MWLCHTKSSA-N 425.990 4.959 50 10 IJGE Cl[C@@H](c1cc(I)cc2c1OCC2)C1CC(Br)C1 2020148681 QFOXKCORBJSSKS-SHVIVCPWSA-N 427.507 4.680 50 10 IJGE Cc1c(F)ccc([C@@H](Br)c2cc(I)sn2)c1C 2024312646 VIOIXATUEWNJML-GFCCVEGCSA-N 426.092 4.988 50 10 IJGE O=C(CCl)c1c(OC(F)(F)F)ccc(C(F)(F)F)c1I 2055154883 BADYPFZCRJNZDD-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE FC(F)(F)c1c(I)ccc(I)c1CCl 2060240537 OQEURJYVQIIQDZ-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1cc(Cl)c(F)cc1[N+](=O)[O-] 2125301776 KFMUBAPCAFOVSZ-UHFFFAOYSA-N 425.935 4.705 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](CCNC(=O)c2ccc(CBr)cc2)CC1 2162490120 QLFVHFJFEQPLLT-MRXNPFEDSA-N 439.394 4.739 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@H](CBr)CC(C)(F)F)cc1Br 2169536023 QWULGUAQJQSQEI-VIFPVBQESA-N 433.518 4.950 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1sc(C)c(C)c1Br 2221820990 VQNHEQFFKTXDBM-XCBNKYQSSA-N 444.176 4.707 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@H]2[C@H]3COCC[C@H]32)c1 2263519221 OVIPCZRMKQZRID-ZOBORPQBSA-N 438.985 4.800 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(CC2(CBr)CCCC2)[C@@H](C(F)(F)F)C1 2266311129 XCEBAJJPROLSPE-UONOGXRCSA-N 443.348 4.862 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CC(F)(F)CN1CC1(CBr)CCCCCC1 2278906680 GOQYEHFFQUMZTQ-HNNXBMFYSA-N 439.385 4.956 50 10 IJGE CCOC(=O)c1sc(NC(=O)C(C#N)=Cc2ccc(Cl)cc2)c(C(=O)OCC)c1C 2314729127 XCFLHJWVQWERAK-UHFFFAOYSA-N 446.912 4.609 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H]2C[C@H](Br)C3)c(I)c1 2318514698 FJRWQGKEWXKAJX-LMKPVCQUSA-N 440.550 4.835 50 10 IJGE COc1ccc([C@@H](C)NC(=O)C(C#N)=CN(c2ccccc2)c2ccc(N)cc2)cc1OC 2325045266 IDQUXMWUQJQGSS-GOSISDBHSA-N 442.519 4.709 50 10 IJGE C[C@@H](NC(=O)C(C#N)=CNCc1ccc(Br)cc1)c1ccc2c(c1)CCCC2 2325119048 UROOVRHIFHEUEU-MRXNPFEDSA-N 438.369 4.702 50 10 IJGE N#CC(=Cc1cccc(Br)c1)C(=O)NCC1(c2ccc(F)c(F)c2F)CC1 2329694606 XAFYEIHRWRQLID-UHFFFAOYSA-N 435.243 4.621 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cc(F)ccc1C(F)F 2343411177 CHWKMOYZHAXRGZ-HNNXBMFYSA-N 430.264 4.864 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@@H]3CCN(C(=O)OC(C)(C)C)C[C@H]32)C1 2345011180 QRLCKLAMQTXHGC-IAGOWNOFSA-N 429.443 4.909 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)C1CCS(=O)(=O)CC1 2365190014 AHPGSAPZPWBZCW-GFCCVEGCSA-N 448.579 4.764 50 10 IJGE CC[C@H](C)c1ccccc1OCC(=O)NNC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 13980338 YBVNWALWQPDDRT-KBPBESRZSA-N 439.339 4.501 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)C)cc2)cc1 14040291 ZGQCCMUYIYONSW-LJQANCHMSA-N 426.557 4.998 50 10 IJGE C/C(=N\NC(=O)c1ccco1)c1ccc(NC(=O)[C@@H](C)Oc2ccc(C)cc2Cl)cc1 20357134 XIYVPRKDFRPREQ-KSXCTLEASA-N 439.899 4.801 50 10 IJGE C[C@H](Br)c1ccccc1NC(=O)c1ccc(I)cc1 125398715 XHGXZBCFZKBERA-JTQLQIEISA-N 430.083 4.999 50 10 IJGE CC(C)(CCBr)NC(=O)c1cc(Br)c(Br)s1 126145378 FQMOPALZYPCTJF-UHFFFAOYSA-N 433.991 4.567 50 10 IJGE COc1ccc(CC(=O)N/N=C\c2ccc(OCc3cccc(Cl)c3)c(OC)c2)cc1 169901308 OKWWXOBEHQBAQK-YSMPRRRNSA-N 438.911 4.629 50 10 IJGE C[C@@H](CBr)CCCNC(=O)c1cc(Br)c(Br)s1 228273457 QHLKZGJUTBVBDC-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE O=C(NC1CCC(Br)CC1)c1cc(Br)sc1Br 232462002 NPHMBOAMZJBBDJ-UHFFFAOYSA-N 446.002 4.709 50 10 IJGE CC(C)[C@H](CI)NC(=O)c1ccc2cc(Br)ccc2c1 232739200 ZECWTNRMVCUUPS-HNNXBMFYSA-N 446.126 4.792 50 10 IJGE CCCOc1ccc(Br)cc1C=NNC(=O)COc1ccc2ccccc2c1 252607809 HEMGGYSOJQPIFV-UHFFFAOYSA-N 441.325 4.920 50 10 IJGE Cc1ccc(-n2c(C)cc(C=NNC(=O)C(=O)Nc3cccc(C(F)(F)F)c3)c2C)cc1 252631375 VKKHNUIAPMIHJF-UHFFFAOYSA-N 442.441 4.510 50 10 IJGE CC(=NNC(=O)CSc1nnc(SCc2ccc(C)cc2)s1)c1ccccc1 254783794 XFUZMHPWVJFOED-UHFFFAOYSA-N 428.608 4.771 50 10 IJGE CC(C)[C@H]1CN(c2cc(CBr)sc2[N+](=O)[O-])CCN1Cc1ccccc1 704742002 ZQKMWWIYSWTLNE-GOSISDBHSA-N 438.391 4.898 50 10 IJGE Cc1cc(C=NNC(=O)c2cccc(Br)c2)c(C)n1-c1cccc([N+](=O)[O-])c1 1083890358 OMUKALRLKUKKIK-UHFFFAOYSA-N 441.285 4.529 50 10 IJGE C#CCCCC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)C[C@H](C)C2 1558513251 PRKYRPALKOKPIL-HVESIFNPSA-N 427.504 4.515 50 10 IJGE O=C(NNc1ccccc1Oc1ccccc1)c1cc(Br)cc2nc(O)[nH]c12 1639911744 SKXODCAXMHMERP-UHFFFAOYSA-N 439.269 4.580 50 10 IJGE COc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccc1C)CCC2 1772744082 RXSPZIMYCOTQJS-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE CCc1nn(CC)c2c1[C@H](c1ccc(N(CC)Cc3ccccc3)cc1)C(C#N)=C(N)O2 1865707500 YCLXGJHHSINWMR-HSZRJFAPSA-N 427.552 4.710 50 10 IJGE CCc1nn(-c2ccccn2)c2c1[C@@H](c1cccc(OCc3ccccc3)c1)C(C#N)=C(N)O2 1865711764 HPIXVTPBNJGSTQ-DEOSSOPVSA-N 449.514 4.627 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C)C[C@@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1880767116 NBBLDLXAZCITHG-APIJFGDWSA-N 435.403 4.556 50 10 IJGE O=S(=O)(CCCCCCCCCBr)c1cncc(Br)c1 1921667609 LEMCMRRSKWDNPF-UHFFFAOYSA-N 427.202 4.743 50 10 IJGE O=C(NC[C@H]1CCCN(Cc2ccc(CBr)cc2)C1)OCc1ccccc1 2011642112 VOYAJZBVQMYLMO-OAQYLSRUSA-N 431.374 4.720 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)c1scc(Br)c1Br 2020201442 RDSDEITZGPJKCV-LJGSYFOKSA-N 446.002 4.519 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CCC[C@@H]1CN(CC1(CBr)CCCCC1)C2 2106786670 VSUAVBMQAKZYHA-DYESRHJHSA-N 429.443 4.959 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1CCc1cnn(Cc2ccccc2)c1 2151790174 PEJBOTURBSGIIF-AWEZNQCLSA-N 444.764 4.981 50 10 IJGE CC(C)N(CC1CCN(C(=O)OC(C)(C)C)CC1)CC1(CBr)CCOCC1 2163064222 TVWWVYIOWGKQMR-UHFFFAOYSA-N 447.458 4.536 50 10 IJGE Cn1nc([C@@H](Cl)c2cc(Br)c3c(c2)CCO3)c(Br)c1Cl 2167044487 XQEWOZRFZMWAOU-JTQLQIEISA-N 440.950 4.862 50 10 IJGE F[C@@]12CCC[C@]1(CCl)CN(Cc1cc(Cl)ccc1I)C2 2176637284 UCUBAYSRZLIDNS-LSDHHAIUSA-N 428.116 4.878 50 10 IJGE CCC[C@@H]1CCCCN1S(=O)(=O)c1cc(CBr)sc1Br 2179790552 GABJARSXTIKNFE-SNVBAGLBSA-N 445.242 4.749 50 10 IJGE CCN(CCCCCI)C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2211186979 ROOKIAZONPUYPN-INIZCTEOSA-N 438.394 4.561 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC[C@H]2CCC23CCC3)C1 2247331177 ZXAZVBSVAWNOCY-DNVCBOLYSA-N 449.373 4.788 50 10 IJGE CN(CC[C@H](NC(=O)[C@H](Br)C1CCCC1)C(C)(C)C)C(=O)OC(C)(C)C 2278545747 JXDFYJDCFMZTKE-JKSUJKDBSA-N 433.431 4.728 50 10 IJGE CCn1nc(C)c(CBr)c1N1CCC2(CCN(Cc3ccccc3)C2)CC1 2281300374 AROBBSIZZWZKMW-UHFFFAOYSA-N 431.422 4.599 50 10 IJGE N#CC(=Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(=O)Nc1ccc(C(=O)O)cc1 2294510826 OIVAJSVLGITGSM-UHFFFAOYSA-N 437.795 4.752 50 10 IJGE CCOc1cccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3ccc(NC(C)=O)cc3)c2C)c1 2297328257 JDNLURUOUOUVEJ-UHFFFAOYSA-N 442.519 4.997 50 10 IJGE Brc1cnc(N2CC[C@H]3C[C@@H](Br)CC[C@H]32)c(Br)c1 2308116776 OQEINYHFWQOWIS-HOTUBEGUSA-N 438.989 4.749 50 10 IJGE BrC[C@H]1C[C@@H]2CN(Cc3cccc(Br)c3Br)C[C@H]12 2309714795 KKOBDCRZKIFNKX-IJLUTSLNSA-N 438.001 4.674 50 10 IJGE Cc1ccc(Sc2ccc(C=C(C#N)C3=NN(c4ccccc4)[C@@H](N)[C@@H]3C#N)o2)cc1 2313560458 UGDYPXUFXOKCTA-ZJSXRUAMSA-N 425.517 4.947 50 10 IJGE ClCc1cnccc1OCc1cc(I)ccc1Br 2318981721 FTRCTYUSJZTRIX-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE CCCCCCCCCOc1ccc(C=NNC(=O)c2cccn(CC)c2=O)cc1OC 2323626572 KZKOIJGHKXJCKE-UHFFFAOYSA-N 441.572 4.770 50 10 IJGE O=C(NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21)c1ccc(Cl)cc1F 2326843776 HASKCUGVQUVCGW-UHFFFAOYSA-N 442.277 4.813 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)c3cc(OC)c(OC)c(OC)c3)n2)cc1F 2331337227 KKDDWKIPNAUIGW-UHFFFAOYSA-N 442.468 4.933 50 10 IJGE BrC[C@H]1CN(Cc2sccc2I)Cc2ccccc21 2338750001 OFVAQVSKMMWIDO-LBPRGKRZSA-N 448.167 4.847 50 10 IJGE N#CC1=C(N)C(C#N)(C#N)[C@H](c2ccc(-c3ccc(Br)cc3)o2)[C@H]2CCC=C12 2759507 BQOLBLXVNVFLDA-JXFKEZNVSA-N 431.293 4.913 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cc1 8073526 RGQSILSMYMEFCG-UHFFFAOYSA-N 426.557 4.783 50 10 IJGE COc1ccccc1OCC(=O)Oc1ccc(/C=C(/C#N)c2ccccc2F)cc1OC 31901755 XSXATTTXGGKUKQ-AQTBWJFISA-N 433.435 4.891 50 10 IJGE Cc1ccc(C)c(Nc2ncnc(NNC(=O)C(c3ccccc3)c3ccccc3)c2N)c1 40704630 PKDRZUAFCCQNOR-UHFFFAOYSA-N 438.535 4.694 50 10 IJGE CCn1c(SCC(=O)N/N=C/c2ccccc2OCc2ccccc2)nc2ccccc21 58990385 GZNSHBBYPVPRGC-WGOQTCKBSA-N 444.560 4.878 50 10 IJGE CCOCCCN(C(=O)CCl)[C@H](C(=O)N[C@@H]1CCCC[C@@H]1C)c1ccccc1Cl 97914421 ZMXUFBUKLSDQGJ-SCWSEQNSSA-N 443.415 4.570 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Cl)c3ccc(F)cc3Br)cc2[nH]1 109883889 CJQUPVRZROBVAY-ZDUSSCGKSA-N 434.490 4.849 50 10 IJGE CCCOc1ccc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccccc4)nc3c2)cc1OC 169925733 LZHPGKUZMYZKJJ-PKAZHMFMSA-N 442.519 4.715 50 10 IJGE CC(=NNC(=O)c1c(O)ccc2ccccc12)c1cccc(NC(=O)Cc2ccccc2)c1 254294478 NZODEVZISZELKR-UHFFFAOYSA-N 437.499 4.881 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=NNC(=O)CNc3ccc4ccccc4c3)o2)cc1 254738075 FUGDDLTUDSVJTH-UHFFFAOYSA-N 441.487 4.839 50 10 IJGE CCSCCCn1c(CCCl)nc2cc(I)c(F)cc21 312430889 PEKSBMYYBGPMLK-UHFFFAOYSA-N 426.726 4.705 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2Cc1cnn(Cc2ccccc2)c1 390403937 XKRKKRWMCKNVRU-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE CC[C@H]1[C@@H](CBr)CCN1Cc1cc(Cl)ccc1I 405279672 AVAGSNBKMLUTAE-YGRLFVJLSA-N 442.566 4.940 50 10 IJGE Cc1cc(Br)c(S(=O)(=O)N(C[C@H](C)Cl)C(C)C)cc1Br 709412163 ZKOVFCNCRLSNNW-JTQLQIEISA-N 447.620 4.546 50 10 IJGE O=C(N[C@H](CCl)CC(F)(F)F)c1cc(Br)c(Br)s1 717824650 RPGCAWKIWKYFAH-BYPYZUCNSA-N 429.483 4.563 50 10 IJGE O=C(Nc1ccccc1S[C@H](Cl)C(F)(F)F)N[C@@H]1CCN(c2ccccc2)C1=O 731751927 JRQAJMHAMBZITD-PBHICJAKSA-N 443.878 4.833 50 10 IJGE Cn1ccnc1C[C@H](NC(=O)NNc1c(Cl)cc(Cl)cc1Cl)c1ccccc1 745912655 RUVSENAVHRBQPQ-INIZCTEOSA-N 438.746 4.990 50 10 IJGE Cn1cc(C(=O)NNc2ccc(Br)cc2C(F)(F)F)c2cc(F)ccc21 797724122 LMLHVBVADUXYKZ-UHFFFAOYSA-N 430.199 4.856 50 10 IJGE CC(C)(C)SCC(=O)NN=C1C(=O)N(Cc2cccc3ccccc23)c2ccccc21 1084533684 XTRSCQOAHPJDHH-UHFFFAOYSA-N 431.561 4.739 50 10 IJGE Cc1ccc(Cl)cc1NNC(=O)CSCc1nc(O)c2c3c(sc2n1)CCCC3 1639926261 KLXLGOTVDBMTTP-UHFFFAOYSA-N 449.001 4.614 50 10 IJGE COc1ccccc1C1(CNC(=O)/C(C#N)=C/c2cccc(Br)c2)CCCC1 1866130558 BBNURAQVESMDEV-QGOAFFKASA-N 439.353 4.993 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)c3ccnc(Cl)c3)n2)c(OC)c1OC 1872759409 NPQKFKUBFNLLLW-LGMDPLHJSA-N 429.885 4.834 50 10 IJGE O=S(=O)(C1CCC(CBr)CC1)N(Cc1ccccc1)Cc1ccccc1 1880810695 STJXKPCTYHIYOR-UHFFFAOYSA-N 436.415 4.972 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C[C@H]1CCN(C(=O)OC(C)(C)C)C1(C)C 1881456381 TUDYBADABYGPHP-KGLIPLIRSA-N 435.403 4.700 50 10 IJGE O=C(NCC1CC2(CC[C@H]2Cl)C1)c1cc(Br)c(Br)s1 1882897361 NGLMOFUUPHELDS-OILJVLCYSA-N 427.589 4.801 50 10 IJGE O=C(N[C@H](CBr)CC1CCOCC1)c1cscc1OCc1ccccc1 1883268807 IRRBWTBVCDHRRC-KRWDZBQOSA-N 438.387 4.637 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C2CC2)C1 1883307642 YDUHXRZKZYAXIO-BZUAXINKSA-N 447.414 4.700 50 10 IJGE O[C@H](c1c(Br)sc(Br)c1Br)[C@H]1C[C@@H]1Cl 1893453266 LVNZMIRTJIAHCU-XCXIMHFFSA-N 425.367 4.696 50 10 IJGE CN(CC(C)(C)CI)[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 1904651989 WDLDGLPJWIYGLZ-REPLKXPHSA-N 426.386 4.575 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC1(CC[C@](C)(CI)O1)C2 1917625253 LYOZOWAWMYKHTA-MRXNPFEDSA-N 435.346 4.540 50 10 IJGE O=C(N[C@@H](CCl)CC1CCCC1)c1cc(Cl)ccc1I 1926738672 ZUBWCRBIGAHWKE-GFCCVEGCSA-N 426.125 4.862 50 10 IJGE BrC[C@H](CC1CC1)NCc1ccc(Br)cc1Br 1943840224 CQYWWGZUXQGHGW-LBPRGKRZSA-N 425.990 4.865 50 10 IJGE CN(Cc1ccc(Br)cc1Br)C[C@H](Br)C1CC1 1943850210 REWNBPXSIFSCJH-ZDUSSCGKSA-N 425.990 4.817 50 10 IJGE O=C(NC[C@H]1CCC[C@H]1Br)c1csc(Br)c1Br 1945189506 RYEOCAKRGNQBDK-HTRCEHHLSA-N 446.002 4.567 50 10 IJGE CC1(C)OC[C@@H](Cc2cc(Br)ccc2Br)[C@H]1Br 2006501607 USVRRMMUGULALU-BXKDBHETSA-N 426.974 4.943 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1cc(Br)c(Br)s1 2023037717 NYOZWUFIHZODIH-HTRCEHHLSA-N 448.018 4.813 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC1CC2(C1)CC1(CCC1)C2 2025072077 UBOUUQMMEWBYTP-KRWDZBQOSA-N 449.373 4.834 50 10 IJGE C[C@@]1(CBr)CCCN1C(=O)c1cccc(Br)c1Br 2031489140 JRWJBVCISMXTAY-ZDUSSCGKSA-N 439.973 4.601 50 10 IJGE CCCN(CCCCl)C(=O)c1cc(Br)ccc1I 2032094415 CCJZYHFERSGDDZ-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE Cc1sc(Br)cc1[C@@H](Br)c1ccsc1S(C)(=O)=O 2033136116 OZRYOZWUNFLXIG-JTQLQIEISA-N 430.208 4.768 50 10 IJGE CCOc1ccc(C)cc1[C@H](Br)c1cc(I)sn1 2056487183 IMEDIEBOKLYJSL-ZDUSSCGKSA-N 438.128 4.939 50 10 IJGE CC1(C)C[C@](C)(CCl)CN1c1ncc(I)cc1Br 2078800942 WMRAREVPMPMQBO-CYBMUJFWSA-N 443.554 4.683 50 10 IJGE CC1(C)C[C@@H](CBr)CN1Cc1ccc(I)c(Cl)c1 2086653949 BSULOWMQXOVHCT-NSHDSACASA-N 442.566 4.940 50 10 IJGE Clc1cc(CN2[C@H]3CC[C@@H](C3)[C@H]2CBr)ccc1I 2086662105 ROZBHFLWOJEIQS-COPLHBTASA-N 440.550 4.692 50 10 IJGE COc1ccc(Oc2cc(C)c(CBr)cn2)cc1I 2095579011 GXVTXPRUYSIJRK-UHFFFAOYSA-N 434.071 4.690 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCc2ccccc2N(C[C@@H](Br)C(F)(F)F)C1 2106781516 INWWHRCNPURBFF-UKRRQHHQSA-N 437.300 4.658 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H](OC)C[C@@H]1CNC(=O)OC(C)(C)C 2106787421 IWJPPMUBZUOVAW-IAGOWNOFSA-N 435.447 4.582 50 10 IJGE COc1cc(N2CCN(Cc3ccccc3)CC(F)(F)C2)ccc1CBr 2139711093 OPGLCDPEHQUKCM-UHFFFAOYSA-N 425.317 4.548 50 10 IJGE CN(Cc1ccccc1)[C@@]1(Cn2c(CCl)nc3cc(Br)ccc32)CCOC1 2155118475 YVGNRXTWRWZFCU-OAQYLSRUSA-N 448.792 4.829 50 10 IJGE COc1ccc(C[C@@H](Br)c2nn(C)c(Cl)c2Br)cc1F 2168412111 IKTAKOOCSCAZRT-MRVPVSSYSA-N 426.511 4.662 50 10 IJGE CC(C)(C)OC(=O)N[C@@]1(c2ccccc2)CCN(C[C@@H](CBr)CC2CC2)C1 2169167150 UQJZLNFMWKDYJN-GCJKJVERSA-N 437.422 4.924 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@@H]1CCN(C(=O)OC(C)(C)C)CC12CC2 2185893402 NAESYWDQNWRWPZ-RBUKOAKNSA-N 437.422 4.887 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OCCCCC2CC2)C1 2212363966 DLFASRLWLCOJKC-SFHVURJKSA-N 437.362 4.788 50 10 IJGE FC(F)(F)CC1(CBr)CCN(Cc2ncsc2Br)CC1 2234526423 NXWXORJXPALXNY-UHFFFAOYSA-N 436.135 4.835 50 10 IJGE CC1CC(CBr)(CN(CCCNC(=O)OC(C)(C)C)CC(F)(F)F)C1 2254144948 XDPJDRQSHOFDKM-UHFFFAOYSA-N 431.337 4.577 50 10 IJGE C[C@@H](c1ccncc1)[C@@H](Br)c1c(Br)c(Br)nn1C 2316837513 IFNMLWUHUZHLKY-IONNQARKSA-N 437.961 4.580 50 10 IJGE CC[C@H](NC(=O)C(C#N)=CN1CCN(c2ccccc2F)CC1)c1ccc2c(c1)CCCC2 2325092639 COMZEHRVBMDZEH-VWLOTQADSA-N 446.570 4.501 50 10 IJGE N#CC(=Cc1ccc(Cl)cc1)C(=O)Nc1ccc(I)cc1F 2329647441 GXKZLGAGWPFOSW-UHFFFAOYSA-N 426.616 4.629 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H]2CC[C@@H]1C[C@@H]2CBr 2359508136 XHTZBSHMCJZART-RBDZCENOSA-N 425.523 4.630 50 10 IJGE Cc1scc(C(=O)N2C[C@]3(F)CCC[C@@]3(CBr)C2)c1Br 2369603290 KCKZWMIFAIJMIN-ZIAGYGMSSA-N 425.161 4.548 50 10 IJGE Cc1cc(C(=O)N2CCC[C@@H](Br)[C@@H]2C(F)(F)F)c(Br)s1 2370247026 ISVHYPXGFDSRQT-RKDXNWHRSA-N 435.103 4.749 50 10 IJGE CCCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cccs1 38656642 YMVWLUOWLMPMAN-QFIPXVFZSA-N 432.501 4.974 50 10 IJGE N#CC1=C(N)N2C(=C(C#N)[C@H]1c1ccc(-c3cccc([N+](=O)[O-])c3)o1)Sc1ccccc12 39794223 LCLNKBYYZREVAP-NRFANRHFSA-N 439.456 4.993 50 10 IJGE Cc1ccccc1C(=O)NNc1ncnc(Nc2ccc(Cl)c(Cl)c2)c1[N+](=O)[O-] 40591501 XXEUTQWUNHNPJJ-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE O=S(=O)(NC[C@H]1CCCC[C@@H]1Cl)c1c(Cl)cc(Br)cc1Cl 96873177 FHEPLKSZQNGDRC-SCZZXKLOSA-N 435.598 4.832 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)N/C=C(/C#N)C(=O)Nc1ccc(Br)cc1 216779564 WAZUHJNWNWSORX-WSTOHFRZSA-N 428.330 4.853 50 10 IJGE CCCCOC(=O)c1ccccc1N/C=C(/C#N)C(=O)Nc1cccc2c(O)cccc12 217068115 MGUYYHILIXYGAO-MSUUIHNZSA-N 429.476 4.960 50 10 IJGE COc1ccc(C=NN(C(C)=O)c2nc(-c3ccc(Br)cc3)cs2)cc1 252611256 IIIHVWUMXSXKJG-UHFFFAOYSA-N 430.327 4.968 50 10 IJGE Cc1ccc(C)c(OCC(=O)NN=Cc2ccc(-c3ccc(Br)cc3)o2)c1 252620514 MFMYCYWLPVYLEH-UHFFFAOYSA-N 427.298 4.855 50 10 IJGE COc1cc(C=NNC(=O)Cc2ccccc2)ccc1OC(=O)c1cccc2ccccc12 254759472 NRUUIXQPMHVBNU-UHFFFAOYSA-N 438.483 4.760 50 10 IJGE CC[C@H](NC(=O)c1ccc(Br)cc1Br)[C@@H](C)Br 386698400 MGKOSQSAZZLPOH-HQJQHLMTSA-N 427.962 4.503 50 10 IJGE CN(CCc1ccncc1)C(=O)Nc1cccc(C(=O)Nc2ccc(SC#N)cc2)c1 586674126 IUHYEMFNECAABQ-UHFFFAOYSA-N 431.521 4.613 50 10 IJGE CO[C@]1(CC(CBr)(CBr)c2ccccc2Cl)CCOC1 692462193 MIMWSTDQQHTPMJ-HNNXBMFYSA-N 426.576 4.563 50 10 IJGE COc1ccc(Oc2cc(CCl)sc2[N+](=O)[O-])cc1I 712925807 QAWXBTSJNQXYML-UHFFFAOYSA-N 425.631 4.801 50 10 IJGE COc1cccc(C=NNC(=O)c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2)c1O 1084313410 HNGSYFKYEYERKE-UHFFFAOYSA-N 445.519 4.715 50 10 IJGE C#CCC1(O)CCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3cccc4ccccc34)c2C)CC1 1175853862 KCDBKZVSQNVUHF-MOHJPFBDSA-N 437.543 4.531 50 10 IJGE CC(C)Oc1cc(C(=O)NNc2nc3ccccc3[nH]c2=S)ccc1Br 1453770852 OAKIBBZVEAZORP-UHFFFAOYSA-N 433.331 4.599 50 10 IJGE C=CC[C@@H]1CCCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)C1 1469920967 QRGWSUUOHLXIKL-SQVRNEIYSA-N 433.943 4.839 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNC(=O)Nc2ccc(C)cc2Cl)s1 1556339181 QRLYBUMVAYQDQH-UHFFFAOYSA-N 445.397 4.653 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)c1C 1648570730 ZEMXSBLGZRNYTD-NVXWUHKLSA-N 425.895 4.585 50 10 IJGE N#CSc1ccc(NC(=O)c2cccc(NC(=O)c3ccc(F)c(F)c3F)n2)cc1 1860564121 CFUPNGVWLPNUIU-UHFFFAOYSA-N 428.395 4.577 50 10 IJGE Cc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 1865682334 MGTXDOZTAJQNKT-GOSISDBHSA-N 429.282 4.904 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2)c1 1865689663 CDDUTAKHYNECOR-QGZVFWFLSA-N 426.398 4.508 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1cc(C)ccc1C 1865691637 XBRSWOLQSSWZQD-XMMPIXPASA-N 426.520 4.640 50 10 IJGE Cc1ccc(C)c(Cn2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2ccccc2OC(C)C)c1 1865705207 ORWDONVJGKRVJM-XMMPIXPASA-N 428.536 4.862 50 10 IJGE CCOC(=O)c1c(-c2ccc(Br)cc2)csc1NC(=O)CBr 1866000457 ONHBGBNBCIDFIW-UHFFFAOYSA-N 447.148 4.688 50 10 IJGE CC[C@@H]1CC[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)CN1C(=O)OC(C)(C)C 1880755235 ORFMABSNMKNPHI-RBSFLKMASA-N 435.403 4.700 50 10 IJGE Cl[C@H](c1c(Br)sc(Br)c1Br)C1COC1 1884435663 XMJDVQBUBSRNAG-LURJTMIESA-N 425.367 4.962 50 10 IJGE C[C@@H](Br)C(C)(C)CNC(=O)c1scc(Br)c1Br 1913813327 GLJOKZGXJBBZDV-ZCFIWIBFSA-N 448.018 4.813 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1 1914354542 ZPQVBQNOLDMXTB-GFCCVEGCSA-N 437.186 4.968 50 10 IJGE FC(F)(F)c1cc2c(N(Cc3ccccc3)[C@@H](CBr)C3CC3)nccn2n1 1915190882 YXWDVYNOBZGRID-INIZCTEOSA-N 439.279 4.928 50 10 IJGE O=C(NC1CC(CCBr)C1)c1scc(Br)c1Br 1942862422 FJOSNZIRNOBJNN-UHFFFAOYSA-N 446.002 4.567 50 10 IJGE C[C@H](Cl)CC(=O)Nc1c(Br)cc(Br)cc1Br 1982336174 FTUFMOTZFMVXTN-YFKPBYRVSA-N 434.353 4.930 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@@H](CI)O2)C[C@@H]1C1CCC1 1990242575 UJKSWCHSZXJMSD-HDMKZQKVSA-N 435.346 4.539 50 10 IJGE C[C@@H](Br)[C@@H]1CCN(Cc2cc(Br)ccc2Br)C1 2006501891 WMFZPCHNMQSUOA-NXEZZACHSA-N 425.990 4.817 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@@H]1Cc1c(Br)cccc1Br 2007135899 FADNZKRCBZVRFN-VYUIOLGVSA-N 426.974 4.943 50 10 IJGE COCCOC[C@@H](Br)CCc1cc(Br)ccc1Br 2054719295 RICGCVKVAXFMAP-LBPRGKRZSA-N 444.989 4.571 50 10 IJGE Cc1nn(C)c(C[C@@H](Br)c2ccccc2Br)c1Br 2072279675 LIFKOFWFPNNPPX-LLVKDONJSA-N 436.973 4.932 50 10 IJGE C=CC[C@@H](CBr)CNC(=O)c1cc(Br)cc(Br)c1 2082056192 UWXAYBXXKCAQTC-VIFPVBQESA-N 439.973 4.529 50 10 IJGE C[C@@H]1C[C@@H](O[C@H](CI)c2cccc(Br)c2)CCO1 2084725837 RTXPSHQUIMUQIP-DDTOSNHZSA-N 425.104 4.509 50 10 IJGE C[C@H]1C[C@H](n2c(CCCl)nc3cncc(Br)c32)CN1Cc1ccccc1 2095436933 LAMLRKMDQVSMAX-HOCLYGCPSA-N 433.781 4.811 50 10 IJGE COc1ccc(Oc2ncc(C)cc2CBr)cc1I 2103436673 WHTZWBPHJLDTIB-UHFFFAOYSA-N 434.071 4.690 50 10 IJGE Cc1c(Br)sc([C@H](Cl)[C@H]2CCn3ncnc3C2)c1Br 2108968479 HQSZIJSWHRGJRJ-OIBJUYFYSA-N 425.577 4.716 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@H](Br)C1(S(C)(=O)=O)CCC1 2137637133 LGEGEFSUHSYBEX-LBPRGKRZSA-N 430.589 4.814 50 10 IJGE Cc1sc(C)c(S(=O)(=O)NC2(CCBr)CCCC2)c1Br 2143913551 HAPXNJVIMSAEDF-UHFFFAOYSA-N 445.242 4.504 50 10 IJGE CN(Cc1ccccc1)[C@@H]1CCN(S(=O)(=O)c2cc(CCl)c(Cl)cc2Cl)C1 2152159497 QPAFFPLNYRJQPR-MRXNPFEDSA-N 447.815 4.627 50 10 IJGE CCCC(CBr)(CCC)CN1CCC[C@@H]2CC[C@@]21CNC(=O)C(F)(F)F 2163059274 RSTGNSCYRHKLHX-CRAIPNDOSA-N 441.376 4.891 50 10 IJGE CCOCc1cc(Br)c([C@@H](Br)c2nn(C)cc2Cl)s1 2224801672 AHRAPNVLOCJJQR-JTQLQIEISA-N 428.577 4.918 50 10 IJGE C[C@H](Br)CC(C)(C)CNC(=O)Cc1ccc(Br)cc1Cl 2237441956 UDCOFSTVZONYJY-JTQLQIEISA-N 425.592 4.961 50 10 IJGE CC1CC(CBr)(CN(Cc2ccccc2)C2CN(C(=O)OC(C)(C)C)C2)C1 2241341467 BXQGUVFJAPUDCW-UHFFFAOYSA-N 437.422 4.919 50 10 IJGE O=C(NCC1(CBr)CC(F)(F)C1)c1scc(Br)c1Cl 2266908349 ABQXKTPKMLTZRA-UHFFFAOYSA-N 437.531 4.704 50 10 IJGE Cc1c(CBr)cccc1NC(=O)c1ccc(I)cc1 2268266637 VAFUYTYHFJBUTQ-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE CCCOc1ccc(C=CC(=O)Oc2ccc(C=C(C#N)C(=O)OCC)cc2OC)cc1 2293198094 KGKOWXGTTJAMNL-UHFFFAOYSA-N 435.476 4.573 50 10 IJGE Cl[C@H]1CCOCC[C@H]1Cc1ccc(I)c(Br)c1 2306200134 UHBQXCZLFLFIPD-JQWIXIFHSA-N 429.523 4.630 50 10 IJGE CCCCN(CCBr)Cc1cc(I)ccc1Cl 2307324421 LZAJRALYJWBBBO-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE COc1ccccc1NC(=O)C(C#N)=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21 2313637893 LNZHCRJROPQXQN-UHFFFAOYSA-N 443.890 4.811 50 10 IJGE Clc1ccc(CN2C[C@@H]3CC[C@@]3(CBr)C2)c(I)c1 2318547023 YAZWSWYKGXWFTC-SMDDNHRTSA-N 440.550 4.552 50 10 IJGE O=C(COc1ccccc1)NN=Cc1cn(CCOc2ccc(Cl)cc2)c2ccccc12 2321257102 BCFWRAZDYHHZPX-UHFFFAOYSA-N 447.922 4.903 50 10 IJGE C[C@@H]1[C@@H](Cl)CCN(Cc2ccc(I)c(Br)c2)[C@@H]1C 2325214240 NUAWTQREJWNBJQ-CWSCBRNRSA-N 442.566 4.891 50 10 IJGE N#CC(=CNC[C@H]1COc2ccccc2O1)C(=O)Nc1ccccc1Sc1ccccc1 2325339643 XRNSNNVJNZVIJF-IBGZPJMESA-N 443.528 4.613 50 10 IJGE C[C@@H](Cl)CN(C(=O)c1ccc(I)c(Cl)c1)C1CCCC1 2368851280 OFOKYRFHTHOUAO-SNVBAGLBSA-N 426.125 4.957 50 10 IJGE CCCC(CBr)(CBr)CCCS(=O)(=O)c1ccccc1 2369358377 FHUFHJAPENKHBP-UHFFFAOYSA-N 426.214 4.817 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CC[C@H]2[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]32)C1 2371133522 NZYCJPFZSKPZJN-OWSLCNJRSA-N 441.454 4.765 50 10 IJGE COc1cc(/C=N/NC(=O)c2sc3ccccc3c2Cl)cc(Br)c1O 13963755 WYNGQMSSEIZTCI-DNTJNYDQSA-N 439.718 4.795 50 10 IJGE COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(Cl)cc2)cc1 38651285 NIISXUSFKQRENF-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2O)CCC3)cc1 40826549 LGRXYLSILXPCTQ-LGUFXXKBSA-N 432.476 4.546 50 10 IJGE COc1cc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)ccc1OCc1ccccc1 40866751 OCHZDIYYCNXRAM-JFLMPSFJSA-N 432.520 4.729 50 10 IJGE CCOC(=O)c1cc([C@@H](C)CC)n(-c2ccc(C(=O)Oc3ccc([N+](=O)[O-])cc3)cc2)n1 97940681 NNVQSSBEZAEDSS-HNNXBMFYSA-N 437.452 4.690 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccncc2)ccc1OCc1ccc(Cl)c(Cl)c1 102466917 LAICKNROTWNLNH-ROTLSHHCSA-N 430.291 4.740 50 10 IJGE O=C1NCCc2ccc([C@H](Br)c3cccc(Br)c3Cl)cc21 228453359 QGZKVFNCTFCDPO-AWEZNQCLSA-N 429.539 4.873 50 10 IJGE C[C@@H](Br)C[C@@H](C)NC(=O)c1cc(Br)cc(Br)c1 235182455 YEOLVBNHBIJVCA-HTQZYQBOSA-N 427.962 4.503 50 10 IJGE O=C(NN=Cc1c[nH]nc1-c1ccc(Br)cc1)c1csc2ccccc12 254375655 COGKZRLWRVQOIM-UHFFFAOYSA-N 425.311 4.818 50 10 IJGE Cc1ccc(-n2c(SCC(=O)NN=Cc3ccc(C)s3)nnc2-c2ccccc2)cc1 254760649 ZIMLZEIYEFSPOS-UHFFFAOYSA-N 447.589 4.855 50 10 IJGE Cc1c(CCl)cc(Cl)cc1S(=O)(=O)N1CCC(OCc2ccccc2)CC1 383939530 XOZYBJNRCOZFOB-UHFFFAOYSA-N 428.381 4.757 50 10 IJGE FC(F)c1cc(Br)cc(CBr)c1I 575685485 LLKXXRNBEJSJSH-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE Cc1sc(Br)cc1[C@@H](Br)c1cn(C)c(Br)n1 698419722 QCLPGTFWVWYPEX-SECBINFHSA-N 428.975 4.799 50 10 IJGE C[C@H](Br)[C@@H]1CCN(C(=O)c2scc(Br)c2Br)C1 719869149 HEGDBXJGZUNOJE-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE Cc1nc(CCC(=O)NNc2cccc(F)c2F)oc1-c1ccc(Br)cc1 743722199 VJLGJKRCXGZVMR-UHFFFAOYSA-N 436.256 4.767 50 10 IJGE Cc1ccc(NC(=O)NNC(=O)c2cccc3cccnc23)c(OCc2ccccc2)c1 756093222 KHMJXHDLSQTALW-UHFFFAOYSA-N 426.476 4.589 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)N[C@H](c1cccc2ccccc12)C(F)(F)F 776007175 ALHMIQLWYGCNIT-HXUWFJFHSA-N 438.409 4.636 50 10 IJGE Cc1ccc(-n2c(C)cc(C=NNC(=O)C(=O)Nc3ccc(C(C)C)cc3)c2C)cc1C 1084161476 URCCORYBCHQCIF-UHFFFAOYSA-N 430.552 4.923 50 10 IJGE CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N1CCC[C@H](O[Si](C)(C)C(C)(C)C)C1 1275312955 BZBRXLNCZNYHAP-RBBKRZOGSA-N 430.665 4.535 50 10 IJGE C/C(=C/C(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(C)c1C)c1cccs1 1633661223 KHQZHDQBZCEWEX-PEZBUJJGSA-N 430.533 4.611 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)[C@H](OCC2CCCC2)c2ccccc2)c1C 1638346518 CITPWFITVKRGDH-JOCHJYFZSA-N 431.540 4.547 50 10 IJGE C[C@H](Cl)C(=O)Nc1ccc(Oc2ccc(NC(=O)[C@H]3CCCC[C@@H]3C(=O)O)cc2)cc1 1859505270 SCUYKLBZWZHYOR-GKCIPKSASA-N 444.915 4.874 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)CCc3nc4ccccc4[nH]c3=O)n2)cc1F 1872752685 NZKQGMNANGBXLZ-ZHZULCJRSA-N 448.479 4.620 50 10 IJGE Brc1ccccc1[C@@H](CI)O[C@H]1COC2(CCC2)C1 1889723588 UAKVVYQXRRJQSP-BXUZGUMPSA-N 437.115 4.653 50 10 IJGE O=S(=O)(c1ccc(Cl)c(CCl)c1Cl)N(Cc1ccccc1)[C@@H]1CCOC1 1915469136 BTGNILGRQZTYNF-CQSZACIVSA-N 434.772 4.712 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1ccsc1Br 1916365928 DBWLLIXYUGLOQB-ZDUSSCGKSA-N 447.192 4.563 50 10 IJGE CC[C@H](C)[C@@H](Br)CNC(=O)c1scc(Br)c1Br 1942810439 MMWLZLROTVHZMH-BQBZGAKWSA-N 448.018 4.813 50 10 IJGE C[P@]1(=O)C[C@@H](Br)[C@H](Cc2cc(Cl)ccc2I)C1 2005165374 SBEQROXFSKMNLP-CINOJJQCSA-N 447.478 4.873 50 10 IJGE COc1ccc([C@@H](Cl)c2cc(I)sn2)c(Br)c1 2007645665 TUGGDXGJUCWZMX-LLVKDONJSA-N 444.519 4.847 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](OC[C@H]2C[C@@H]2C2CCCCC2)C1 2022594684 LRSYEJWNDGURFI-WCXIOVBPSA-N 449.373 4.642 50 10 IJGE FC1(F)CCc2c3c(cc(I)c2[C@H](Br)C1)CCO3 2046742662 AZLYIBAHEGNJGI-SECBINFHSA-N 429.042 4.634 50 10 IJGE O=C(CCl)c1ccc(OC(F)(F)F)c(C(F)(F)F)c1I 2055151235 CSETYRIEGWQUAA-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE Clc1cc(CN2C[C@@H]3CC[C@H](Br)[C@H]3C2)ccc1I 2086662445 VFACIXPHLFXCFA-SRVKXCTJSA-N 440.550 4.550 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](CCCN2C[C@@H](CBr)c2ccccc2)C1 2163062149 JYNWFMNDOZVIPK-XUVXKRRUSA-N 437.422 4.887 50 10 IJGE C[C@H]1CN(c2ccc(CBr)c([N+](=O)[O-])c2)[C@H](C)[C@@H](C)N1Cc1ccccc1 2188578574 YFEUVJUFYAAGKE-GVDBMIGSSA-N 432.362 4.977 50 10 IJGE FC[C@]12C[C@](COc3c(Br)cc(Cl)cc3CBr)(CO1)C2 2202761603 GECMCSXOZBCNIF-OKILXGFUSA-N 428.523 4.895 50 10 IJGE C[C@@H](Cn1c(CCl)nc2cc(Br)c(Br)cc21)OC(F)F 2234067295 DKMSIZALPSNHFY-LURJTMIESA-N 432.490 4.928 50 10 IJGE COc1ccc([C@H](Br)[C@H]2OCCOC2(C)C)c(Br)c1Cl 2283546473 DZUQRHHPYCAAHO-WCQYABFASA-N 428.548 4.741 50 10 IJGE Clc1ccc(I)cc1CN(CCBr)CC1CC1 2307328962 UEWXYRVMSVGCRD-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE C=CCNC(=O)C(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc(OCC)c(Cl)c1 2314476521 PXUUIYVIFZJJOS-UHFFFAOYSA-N 432.911 4.801 50 10 IJGE Br[C@@H]1CN(Cc2sccc2I)CC12CCCCC2 2316759684 ZSXCBBFATBAORW-CYBMUJFWSA-N 440.188 4.882 50 10 IJGE CCN(C[C@](C)(CBr)OCC1C[C@H]2[C@H](C1)C2(F)F)C(=O)OC(C)(C)C 2320756899 FSNRJDNRNMGJKP-ZQIUZPCESA-N 426.342 4.705 50 10 IJGE CCOc1ccc(NC=C(C#N)C(=O)N[C@H](C)c2cc(C)ccc2OCC)cc1OCC 2325071411 MMTIHIYSYATMJQ-GOSISDBHSA-N 437.540 4.888 50 10 IJGE CC1(C)[C@@H](Cl)CC[C@H]1NCc1ccc(I)c(Br)c1 2325213936 WOLPVBTWWZRPCL-QWHCGFSZSA-N 442.566 4.939 50 10 IJGE CCc1nnsc1COc1c(Br)cc(Cl)cc1CBr 2335912855 CWWYQSTUVFUSLX-UHFFFAOYSA-N 426.561 4.990 50 10 IJGE BrCC1C[C@@H]2C[C@H](C1)CN(Cc1ccc(I)cc1)C2 2342524416 LKWNPQHELIYHDL-GOOCMWNKSA-N 434.159 4.534 50 10 IJGE Clc1cc(Br)c(CN2C[C@@H]3OCCC[C@]3(CBr)C2)s1 2345960210 USKRLWDGOMNSMC-AAEUAGOBSA-N 429.605 4.540 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)C1C[C@@H]2CCC[C@H](C1)C2(F)F 2369430755 IGWVSHRYELABCM-XVLXNVKGSA-N 444.360 4.935 50 10 IJGE CC[C@@H](C)c1nc(N2CCN(C(=O)[C@H](C)Cl)CC2)c2c3c(sc2n1)CCCCC3 35892446 CXMQCXPXPCXWFC-CABCVRRESA-N 435.037 4.750 50 10 IJGE N#C/C(=C/c1c(Oc2ccccc2)nc2ccccn2c1=O)C(=O)Nc1ccccc1Cl 39858495 OMHOFSYKSCWRPA-PEZBUJJGSA-N 442.862 4.686 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2ccc(OCc3cccc(C)c3)cc2)cc1 58893238 FEKFWOVNDGAJRF-JQXKRNIHSA-N 446.547 4.937 50 10 IJGE Cc1ccc(C)c(OCCCC(C)(C)C(=O)NNC(=O)COc2ccc3ccccc3c2)c1 66201404 JEODQLAKBAUTCK-UHFFFAOYSA-N 448.563 4.868 50 10 IJGE COc1cc(/C=C2/C(=O)N(Cc3ccc(F)cc3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 101340646 PWNVAHGANWFXNY-SRZZPIQSSA-N 448.494 4.662 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccccc2N)ccc1OCc1ccc(Cl)c(Cl)c1 169893774 MDMGMUFMDXOLAU-ZRGSRPPYSA-N 444.318 4.927 50 10 IJGE COc1ccc(C(C)=NNC(=O)c2ccc(NN=C(C)c3ccc(OC)cc3)cc2)cc1 254441268 MPHTYFWWYSGCFX-UHFFFAOYSA-N 430.508 4.694 50 10 IJGE Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NN=Cc3cccc4ccccc34)cc2)cc1 254490199 RPCABMNIEMDPQA-UHFFFAOYSA-N 443.528 4.713 50 10 IJGE CC[C@@](C)(CO[C@H](CI)c1cccc(Br)c1)OC 319034468 BVJASZNWMHDSLR-KGLIPLIRSA-N 427.120 4.757 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1cccc([C@H]2CN(S(=O)(=O)c3ccccc3)CCN2)c1 616655692 XLJKMFADMJXINW-JOCHJYFZSA-N 446.689 4.544 50 10 IJGE Cc1ccc(C)c(NNC(=O)CSc2nnc(-c3ccco3)n2C2CCCCC2)c1 748382066 NSQFCPDVAKPEKJ-UHFFFAOYSA-N 425.558 4.896 50 10 IJGE Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1C=NNC(=O)c1ccc(C#N)cc1 766698660 RVNURAKCFOGOFN-UHFFFAOYSA-N 439.450 4.748 50 10 IJGE COc1ccc([N+](=O)[O-])cc1-n1c(C)cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)c1C 1084462141 QWIPIRRCFNGVSH-XDHOZWIPSA-N 430.464 4.865 50 10 IJGE C#CCCCC(=O)NNC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 1304010557 UEPPBLIFASFQCC-UHFFFAOYSA-N 426.925 4.943 50 10 IJGE C=CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1c(Cl)cccc1Br 1457902481 LMBVRVWPIJNDFH-CQSZACIVSA-N 446.773 4.795 50 10 IJGE C=CCNC(=S)NNC(=O)c1ccc(Oc2cccc(Cl)c2Cl)c(Cl)c1 1463677324 WEKDGINLQIQRDY-UHFFFAOYSA-N 430.744 4.734 50 10 IJGE Cc1cc(NNC(=O)[C@H](C)SCc2nc(O)c3c(C)c(C)sc3n2)ccc1Cl 1471776214 QPBZLLFJJLTIBA-LBPRGKRZSA-N 436.990 4.741 50 10 IJGE Cc1cccc(OCC(=O)Nc2cccc(C(=O)Nc3ccc(SC#N)cc3)n2)c1C 1860558082 MJMXNOVOBSHYLL-UHFFFAOYSA-N 432.505 4.541 50 10 IJGE CCCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@H]2c1c[nH]c2ccccc12 1865700428 SRFDCGZLLLULKT-NRFANRHFSA-N 425.492 4.668 50 10 IJGE CCc1ccc(-c2ccc(C(=O)N/N=C(\C)c3ccc4c(c3)CCN4C(C)=O)c(C)n2)cc1 1865763378 JDMGEJSOLZZFLW-STBIYBPSSA-N 440.547 4.682 50 10 IJGE CCC[C@@H](NC(=O)/C=C(\CC)c1ccc(OC)cc1)C(=O)Nc1ccc(SC#N)cc1 1866688126 OTHODYGKDMIJBB-XEPMYJLFSA-N 437.565 4.985 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C[C@H]1CN(C(=O)OC(C)(C)C)CC12CCC2 1883484718 BPDKHTIHCNFSOT-LSDHHAIUSA-N 447.414 4.702 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1ncccc1Br 1915772904 CHHDKNPIZHEVBT-UHFFFAOYSA-N 426.152 4.660 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC1(CC[C@@](C)(CI)O1)C2 1917625252 LYOZOWAWMYKHTA-INIZCTEOSA-N 435.346 4.540 50 10 IJGE C[C@H]1C[C@H](Br)CN(Cc2cccc(Br)c2Br)C1 1943906360 PKYYXNGJVALJME-ONGXEEELSA-N 425.990 4.817 50 10 IJGE CC[C@@H](Br)[C@@H](C)NC(=O)c1c(Br)cccc1Br 1945331482 SMUHMMRUGWMVCX-HTQZYQBOSA-N 427.962 4.503 50 10 IJGE BrC[C@@H]1CN(Cc2cccc(Br)c2Br)CC12CC2 2031479400 XEDNBKQEBSVJGE-LLVKDONJSA-N 438.001 4.819 50 10 IJGE Cc1cc(S(=O)(=O)N(Cc2ccccc2)C2CCC2)cc(CBr)c1F 2059311752 AXGPJBRQFYYCCA-UHFFFAOYSA-N 426.351 4.772 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCCC2)C[C@H]1CC(F)F 2120812665 SZPBKUNNBBEHOZ-OAHLLOKOSA-N 439.385 4.908 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@H](Cl)c2cc(Br)c(Br)s2)C1 2137228869 QKXJNNFMNWUTHX-KOLSJAJHSA-N 448.629 4.768 50 10 IJGE CCC(CC)(CBr)CN1CCCC[C@@H]1[C@@H]1CCCN(C(=O)C(F)(F)F)C1 2163062441 LITMYFPEPKKKIN-HZPDHXFCSA-N 441.376 4.843 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CCC2(CCN(Cc3ccccc3)C2)CC1 2163334608 NELWUEGRZBRSQC-UHFFFAOYSA-N 427.386 4.710 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CN(C(=O)[C@H](Br)C1CCCC1)CC2 2167033794 PCMINUMINUPOIG-GOSISDBHSA-N 437.378 4.872 50 10 IJGE CN(Cc1ccccc1)[C@@H]1CCCCN(c2nc3ccccn3c2CBr)C1 2169166494 NAPIOIRCSZTOJJ-LJQANCHMSA-N 427.390 4.720 50 10 IJGE Cc1sc(Br)c(C(=O)N(C)[C@@H](CCBr)C(F)(F)F)c1C 2178516014 QYVRDLIBHWDVSS-QMMMGPOBSA-N 437.119 4.915 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2COC(C)(C)C2)cc1I 2257355153 NXNPZDQTKOTUHE-ZWNOBZJWSA-N 425.104 4.551 50 10 IJGE C=CC[C@]1(CCl)CCCN1c1ncc(I)cc1Br 2259480950 NURWPQXCSJLIBI-CYBMUJFWSA-N 441.538 4.603 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2CC1CN(Cc2ccccc2)C1 2270562511 PPZXZLKDZSWKQV-UHFFFAOYSA-N 434.765 4.678 50 10 IJGE CCn1nc(C)c(CBr)c1N(C)[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2281306654 OASQNPMVTCYEJT-ACDBMABISA-N 431.422 4.738 50 10 IJGE Cc1cc(Br)c([C@H](Cl)[C@H]2C[C@H](S(C)(=O)=O)C2)c(C)c1Br 2285274648 OOPCGYOQZBRIFW-GPCCPHFNSA-N 444.616 4.932 50 10 IJGE COc1ccc(CNC(=O)C(C#N)=Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)cc1 2294187416 MDEOLWJYGDZZRY-UHFFFAOYSA-N 437.839 4.740 50 10 IJGE Br[C@H]1CCN(Cc2sccc2I)C2(CCC2)C1 2301070557 DMRZBNNSKSJQEI-JTQLQIEISA-N 426.161 4.635 50 10 IJGE BrCC[C@H]1CCCN(Cc2sccc2I)CC1 2301076291 JWHQGDQEJGCBKN-LLVKDONJSA-N 428.177 4.740 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@@H]2CCCC[C@@H]3C[C@@H]32)C1 2302878309 NZXLAHCKYVTIQQ-OLMMMNRUSA-N 449.373 4.786 50 10 IJGE CN(Cc1cc(I)ccc1Cl)CC1(CBr)CC1 2307318710 ZYPDJEZWQCGNJZ-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)[C@@H]2C[C@@H]3C[C@@H]3CO2)c1 2313495503 HPPYRCWSNICRBG-PJQZNRQZSA-N 438.985 4.943 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@]2(CBr)CC2(F)F)C2(CCCCC2)C1 2351888636 JQMBAIDIZVEMAL-QGZVFWFLSA-N 437.369 4.662 50 10 IJGE Cc1[nH]c(-c2cc(Br)c(Cl)s2)nc(=O)c1CCCBr 2353855361 JMOPMRUVVASIQN-UHFFFAOYSA-N 426.561 4.550 50 10 IJGE Br[C@H]1c2ccccc2CCC[C@@H]1Cc1ncc(I)cn1 2381287582 LDQGYDJOQZEXAL-MLGOLLRUSA-N 443.126 4.712 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@@H](CCNC(=O)C(F)(F)F)c2ccccc21 2382184207 IQQVIXMCFWAIAM-HUUCEWRRSA-N 435.328 4.716 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3cccc([N+](=O)[O-])c3)ccc2[C@H]1c1ccccc1Cl 38651109 ITNRVBQZYLSIEI-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(F)cc4)ccc32)c1 38684851 WGAUNFQFOGGJJW-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE Cc1ccccc1C(=O)NNc1ncnc(Nc2ccc(Cl)cc2Cl)c1[N+](=O)[O-] 40650201 ZUIZCFSGQXBGOQ-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE COc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)Oc3cc(C)cc(C)c3)c(C)c21 40813135 WLSDDHLSTNDPOF-NHFJDJAPSA-N 446.503 4.903 50 10 IJGE COc1ccc([C@H](Br)c2ccccc2I)c(OC)c1 104045241 ZDWOKOHMBWHVBS-OAHLLOKOSA-N 433.083 4.793 50 10 IJGE C[C@H](Br)CCCNC(=O)c1cc(Br)c(Br)s1 227711831 TZRFHISVEWFPKJ-LURJTMIESA-N 433.991 4.567 50 10 IJGE COc1ccc(Br)c(CNCCCCCCI)c1 234818274 OCDOQILKPDPNEI-UHFFFAOYSA-N 426.136 4.543 50 10 IJGE CC(=NNC(=O)/C(=C\C(C)=C\c1ccccc1)NC(=O)c1ccccc1)c1ccccc1O 252610353 IAVPMFYZZSHZEZ-SBWZIKDPSA-N 439.515 4.650 50 10 IJGE CC(C)[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NN=Cc1ccccc1C(F)(F)F 254658479 PCXGUJYHADAUMQ-SXYIGIQMSA-N 449.517 4.513 50 10 IJGE COc1ccc(C(=O)Oc2cccc(C=NNC(=O)c3cc4ccccc4cc3O)c2)cc1 254801001 QDALAPZCKUNEBR-UHFFFAOYSA-N 440.455 4.537 50 10 IJGE FC1(F)CCN(c2ncc(Br)c3ccsc23)C[C@H]1CBr 403992719 JWSWEQZLENLTFJ-MRVPVSSYSA-N 426.124 4.915 50 10 IJGE O=S(=O)(NC1(CBr)CCCCCCC1)c1ccc(Br)s1 713472719 FMDVVVXYBXAGBQ-UHFFFAOYSA-N 445.242 4.667 50 10 IJGE O=C(N[C@@H](CBr)C1CCC1)c1cc(Br)c(Br)s1 717615765 KFWUEXOOWXVLMO-QMMMGPOBSA-N 446.002 4.567 50 10 IJGE C[C@]1(CBr)CCCN1C(=O)c1cc(Br)c(Br)s1 723006204 QSPXQWHXKVAEDD-LLVKDONJSA-N 446.002 4.663 50 10 IJGE COc1ccc(C(=O)NN=Cc2sc(Nc3ccc(C)cc3)nc2Cl)c(OC)c1 729933506 GEGPNTZWBMCNLE-UHFFFAOYSA-N 430.917 4.630 50 10 IJGE O=C(NNc1c(Cl)cc(Cl)cc1Cl)C(=O)Nc1ccc(N2CCCCC2)cc1 766261687 GQUOAPLUVYGXFH-UHFFFAOYSA-N 441.746 4.719 50 10 IJGE COc1ccc([C@H](C)COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cc1 768822235 GFTYUVCPHRPMRH-QTCOBDOFSA-N 440.503 4.726 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N[C@H](C)c2ccc3nc(O)oc3c2)c(C)n1-c1ccc(F)cc1 1131894299 HCZUHXKEANVCBJ-MXDDHBLUSA-N 444.466 4.864 50 10 IJGE CC(=O)CCc1ccc2oc(C(=O)NNc3cc(C#N)ccc3Br)c(C)c2c1 1469945178 XTQVWLGTHQYZMV-UHFFFAOYSA-N 440.297 4.654 50 10 IJGE C/C(=C/C(C)(C)C)C(=O)NNC(=O)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1 1530289184 KSDYLQOWNPXFCD-ICFOKQHNSA-N 441.531 4.754 50 10 IJGE CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NN=Cc2ccc(O)c([N+](=O)[O-])c2)cc1 1772754245 OLBOEAANAYJNIA-UHFFFAOYSA-N 427.501 4.543 50 10 IJGE CC(=O)c1cccc(NC(=O)[C@@H](Br)Cc2ccccc2Br)c1 1858181655 XWBAYYKCLZQDHY-INIZCTEOSA-N 425.120 4.596 50 10 IJGE CCCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@@H]2c1c[nH]c2ccccc12 1865700429 SRFDCGZLLLULKT-OAQYLSRUSA-N 425.492 4.668 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2Cl)[C@H]1c1cccnc1 1865700580 XYNBNUSNGBRIDI-FQEVSTJZSA-N 425.879 4.806 50 10 IJGE CC(C)[C@H](CCNC(=O)OC(C)(C)C)CCC(=O)N(C)C[C@H]1C[C@H](Br)C1 1887822420 AZRJJIMFZSVWPH-ULQDDVLXSA-N 433.431 4.586 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)c1ncc(Cl)cc1Br 1916350319 YZKWFNKPOSZMRL-CYBMUJFWSA-N 448.586 4.914 50 10 IJGE O=C(NN(Cc1ccccc1)Cc1ccccc1)c1ccc(I)cc1 1923845188 MXURWBAWNNFLSM-UHFFFAOYSA-N 442.300 4.638 50 10 IJGE C[C@H](Br)C[C@@H](C)NC(=O)c1c(Br)cccc1Br 1945333867 WBMSZFDCBKGTOV-JGVFFNPUSA-N 427.962 4.503 50 10 IJGE CC(C)[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)CC[C@H]1C(F)(F)F 2044699513 LWTPHWACRTZSMA-KBPBESRZSA-N 431.337 4.527 50 10 IJGE FC(F)Oc1cc(I)c(OC(F)(F)F)cc1CBr 2060220688 BBIXPHGXKRLQIX-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE FC(F)(F)c1cc(Br)nc(-n2nc(CBr)c3c2C[C@H]2C[C@@H]32)c1 2080741191 RXSZLMGVBRMTOD-HTRCEHHLSA-N 437.057 4.603 50 10 IJGE Br[C@@H](Cc1ccccc1I)c1ccc2c(c1)CCO2 2087565104 ZESBUMKYLLITOD-AWEZNQCLSA-N 429.095 4.905 50 10 IJGE CCN1CCC[C@H]([C@H](Br)c2cccc(OCc3ccccc3)c2)S1(=O)=O 2089516902 ZSKHJEQLCAPDAB-WOJBJXKFSA-N 438.387 4.516 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCCCN1C[C@@H](CBr)c1ccccc1 2106781558 IXIXHGIKZONTMK-RTBURBONSA-N 425.411 4.934 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C[C@H](CBr)c2ccccc2)CC1(C)C 2106786198 SVYQJDVSODFSCB-ROUUACIJSA-N 425.411 4.790 50 10 IJGE CCN(C[C@H](CBr)c1ccccc1)C1CCN(C(=O)OC(C)(C)C)CC1 2106787383 IPAQMHUDPRDZBL-SFHVURJKSA-N 425.411 4.887 50 10 IJGE CCC[C@H](CBr)CN1CCC[C@@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2129045860 WTFFIOPWRSBMAP-HUUCEWRRSA-N 429.403 4.747 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCC2)C[C@H](CBr)c2ccccc2)C1 2163059560 UOUIIZXDNWKULS-IBGZPJMESA-N 437.422 4.887 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(Cl)ccc2I)CC[C@H]1CCCl 2172473457 KTYFLYMOIGGGFQ-GHMZBOCLSA-N 426.125 4.672 50 10 IJGE CCCCN(CCCCI)C[C@@H]1CCCN1C(=O)OC(C)(C)C 2243585615 DJTQBYZTDZKUFR-INIZCTEOSA-N 438.394 4.703 50 10 IJGE COc1ccc([C@H](Br)c2ccc(OC)c(I)c2)s1 2257366967 HYZWNYADRPMRKM-CYBMUJFWSA-N 439.112 4.854 50 10 IJGE Cc1c(Br)ccc([C@@H](Cl)C2CC(S(C)(=O)=O)C2)c1Br 2269881917 YQHPPHQWPSMLFF-RPTIHFLNSA-N 430.589 4.623 50 10 IJGE Cc1ccc(C(=O)N(C[C@H](C)Br)C(C)(C)C)cc1I 2272451841 KYJXLXYSOWSKPE-NSHDSACASA-N 438.147 4.624 50 10 IJGE CC1CC(CBr)(N(C)C(=O)c2cc(F)c(Br)cc2Cl)C1 2282988835 XENPAVVLZWYAFW-UHFFFAOYSA-N 427.539 4.877 50 10 IJGE N#CC(=CNc1ccc(C(N)=O)cc1)c1nc(-c2ccc(Br)cc2)cs1 2296763898 AALRSPAFCVEOFC-UHFFFAOYSA-N 425.311 4.648 50 10 IJGE C[C@]1(CCl)C[C@H](NCc2ccc(I)c(Br)c2)C1 2306229156 UTDFGHVEIOZIBK-MJHDQNEOSA-N 428.539 4.551 50 10 IJGE Cc1c(C=C(C#N)C(=O)NC[C@@H]2CCCO2)c2ccccc2n1Cc1ccc(Cl)cc1 2313610208 VDCQQTAPNQSDBC-NRFANRHFSA-N 433.939 4.854 50 10 IJGE CCCN1C[C@H](Br)[C@H](Cc2ccc(Cl)cc2I)C1 2318558448 VEJRDBPQKYKOHX-YPMHNXCESA-N 442.566 4.592 50 10 IJGE CC1(C)CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)C[C@]2(C)C2CC2)C1 2345019787 VTUQNZPXGXBLIF-HXUWFJFHSA-N 429.443 4.909 50 10 IJGE COc1ccc(CCCC(=O)N[C@@H](CCBr)COCc2ccccc2)cc1 2369971096 FRYATMKZUPMIOR-FQEVSTJZSA-N 434.374 4.505 50 10 IJGE CCCC(=O)Nc1ccc(C(=O)NNC(=O)[C@H](CC)Oc2ccccc2[C@H](C)CC)cc1 10683372 NRCQEHMKZYSOQL-UTKZUKDTSA-N 439.556 4.557 50 10 IJGE COC(=O)c1c(NC(=O)/C(C#N)=C\c2ccc(N3CCCCC3)o2)sc2c1CCCC2 38704611 LKLXPCSOAJCMQK-SQFISAMPSA-N 439.537 4.542 50 10 IJGE CCCCCOc1ccc(/C=N/NC(=O)COc2ccc(Br)cc2)cc1OC 40846897 IYCAUNKUZVSEHL-OEAKJJBVSA-N 449.345 4.556 50 10 IJGE CC[C@@H](C)N1C(=O)C(C#N)=C(C)/C(=C\c2cn(-c3ccccc3)nc2-c2ccccc2)C1=O 101334079 HINKOWOJWQJQDD-MMTNMYCKSA-N 436.515 4.930 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCC(CBr)CC1 123926345 QJVVXPCAZMKIFL-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)/C=C\c1cccc(C(F)(F)F)c1 207775893 YACZYUQFEKQMSX-KHPPLWFESA-N 431.439 4.612 50 10 IJGE O=C(NCCCCCCBr)c1cc(Br)c(Br)s1 232472463 SKODMBSTFFJSIE-UHFFFAOYSA-N 448.018 4.958 50 10 IJGE CN(CCCCCBr)C(=O)c1cc(Br)cc(Br)c1 234281405 HNYICWRTNQDJQS-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OCc2ccccc2F)C1 303740731 DXGSKUWDNLPYRJ-GOSISDBHSA-N 449.304 4.547 50 10 IJGE ClCc1nc2cccnc2n1-c1ccc(I)cc1Br 305969949 KGZXHSCVJZNSLY-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE COc1cc(Br)c([C@H]2CC[C@@](C)(CI)O2)cc1OC 311903451 BIPXIZNYPSXVRL-RISCZKNCSA-N 441.103 4.512 50 10 IJGE COC[C@H](O[C@@H](CI)c1cccc(Br)c1)C(C)C 404151063 RZOQENBHICYNIC-KBPBESRZSA-N 427.120 4.613 50 10 IJGE FC(F)(F)c1cc(Br)cc(I)c1CBr 575691949 QQKRAEMRCDKBJE-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE CC[C@@H](C[C@H](C)Br)NC(=O)c1cc(Cl)ccc1I 716938016 JOPRUCVTOYEFNJ-WPRPVWTQSA-N 444.538 4.627 50 10 IJGE COc1ccc(C(=O)NN=Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)c(OC)c1 731153451 MMSSALAXKQJOLE-UHFFFAOYSA-N 440.931 4.740 50 10 IJGE CCOc1ccc(NC(=S)NNC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)cc1 732677492 ZCTYNNHLZHMCAX-UHFFFAOYSA-N 443.475 4.787 50 10 IJGE CC[C@H](NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)c1ccc(F)cc1F 737934616 FOOHWQKBIINOSS-ZLKNRPIFSA-N 445.473 4.916 50 10 IJGE COCc1c(Br)cccc1NC(=O)NNc1ccc(C#N)cc1C(F)(F)F 799395096 BVFQZNPYMUZZPW-UHFFFAOYSA-N 443.223 4.635 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NCC2(c3ccccc3)CCC2)c(-c2ccccc2)n1 914467366 DESQHPZWCNTJFZ-XLNRJJMWSA-N 435.531 4.609 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2ccc(Br)cc2C)cc1)[C@H]1C[C@H]1C 1625067208 YSSOOWUPSLWPPP-YJYMSZOUSA-N 431.334 4.667 50 10 IJGE C#Cc1cccc(NC(=O)NNC(=O)c2ccc(COc3ccc4ccccc4c3)cc2)c1 1665162739 NOOICKOZCSPGTP-UHFFFAOYSA-N 435.483 4.867 50 10 IJGE CCN1C(=O)Cc2cc(-c3nc(NC(=O)/C(C#N)=C/c4ccccc4)sc3C)ccc21 1859513467 DMMIDMYNFYISNX-YBFXNURJSA-N 428.517 4.573 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2cc(C)ccc2C)c1 1865692971 KILUXOKJAUQSSC-DEOSSOPVSA-N 428.536 4.864 50 10 IJGE CCCn1nc(C)c2c1OC(N)=C(C#N)[C@H]2c1cccc(OC)c1OCc1cccc(C)c1 1865704860 GJMIEMJWUQJKRI-HSZRJFAPSA-N 444.535 4.716 50 10 IJGE C[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)[C@H]1CCCCN1C(=O)OC(C)(C)C 1880761088 LBXSWXKIDYTCGI-QLFBSQMISA-N 435.403 4.700 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Cl)cc(C(=O)NC[C@@H]2C[C@@H]2Br)cc1Cl 1910124513 LGLRLYYYVJOHDB-UWVGGRQHSA-N 438.149 4.854 50 10 IJGE C[C@H](Br)[C@@H]1CCN(Cc2cccc(Br)c2Br)C1 1943905258 FPWOBAFPUZLJKM-VHSXEESVSA-N 425.990 4.817 50 10 IJGE CC(C)C(CCO[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1I)C(C)C 1988261961 GNACSZPBVQRQAD-HOTGVXAUSA-N 439.378 4.744 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CCC2CC1C2)C(=O)OC(C)(C)C 1992237251 GECLQWOQRQVTTH-HNFMNYKYSA-N 437.362 4.642 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)c(F)cc1F 2008312904 KVVIEQGRPARPLJ-NSHDSACASA-N 438.721 4.593 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1Cc1ccc(I)c(Cl)c1 2026566330 JHSWWCPKNDYCMK-ONGXEEELSA-N 428.539 4.692 50 10 IJGE CC1(C)[C@@H](Br)CCN1C(=O)c1c(Br)cccc1Br 2033095737 PWVFORZVCJKZND-JTQLQIEISA-N 439.973 4.600 50 10 IJGE CC[C@@H](Cl)CN(CC)C(=O)c1ccc(I)c(Br)c1 2044547277 AJDRNXOBNWWNFR-SNVBAGLBSA-N 444.538 4.533 50 10 IJGE CC(C)[C@@H](CBr)CN1CCC[C@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2044704198 AQYWVTYSCXMNNG-BBRMVZONSA-N 431.337 4.575 50 10 IJGE C[C@H]1CO[C@H](COc2c(Br)cc(Br)cc2CBr)C1 2047588863 CIXMZUQDKOFRLN-KCJUWKMLSA-N 442.973 4.910 50 10 IJGE CCOC(=O)c1c(C)[nH]c(C(=O)C(C#N)=Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c1C 2053516142 ZUHRQZPAQUQOSW-UHFFFAOYSA-N 433.420 4.766 50 10 IJGE BrCC1CC2(C1)CN(Cc1cccc(Br)c1Br)C2 2066494670 YAKJYKXLCLYMOL-UHFFFAOYSA-N 438.001 4.819 50 10 IJGE Clc1ccc(I)c(CN2CC[C@H](Br)[C@H]3CC[C@@H]32)c1 2069997355 SUBUTDZJHCNAMM-DYEKYZERSA-N 440.550 4.692 50 10 IJGE Cc1nn(C)c([C@H](Br)Cc2ccc(Br)cc2)c1Br 2072306791 LMIDZTVLVXWCEB-LLVKDONJSA-N 436.973 4.932 50 10 IJGE COc1cc(-n2nc(CBr)c([N+](=O)[O-])c2C(F)(F)F)cc(C(F)(F)F)c1 2079141890 PSXRRZZABGCMJT-UHFFFAOYSA-N 448.117 4.722 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@@H]2CCC[C@@]2(CCl)C1 2103164164 HHBNMZVBHLXAPV-ISVAXAHUSA-N 427.589 4.754 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C1 2106780819 BVFKWVHHZWBYMY-SJORKVTESA-N 435.447 4.582 50 10 IJGE CCN(C(=O)OC(C)(C)C)C1CCN(C[C@@H](CBr)c2ccccc2)CC1 2106786606 VKSOISURTWWUFV-GOSISDBHSA-N 425.411 4.887 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1[C@H](CCl)C[C@@H]2CCC[C@@H]21 2108400128 UJDMSSALWMHSMP-NRPADANISA-N 427.589 4.895 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@H]1CCCN(CC2(CBr)CCC2)C1 2129044032 PFTHLHNMNSKNNE-AWEZNQCLSA-N 427.387 4.501 50 10 IJGE CN(Cc1ccccc1)[C@H]1CCCCN(c2ccc([N+](=O)[O-])c(CBr)c2)C1 2169165469 IOIAVOHARISPKZ-FQEVSTJZSA-N 432.362 4.981 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)c2ccccc21 2196906239 BFOUODMDMMTSQO-VMBOVVBDSA-N 437.378 4.547 50 10 IJGE ClCCc1nc2cc(Br)c(Br)cc2n1Cc1ccns1 2234064701 GLDWQBWMTFSVBH-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE O=S(=O)(c1cc(F)c(F)cc1F)N(Cc1ccccc1)C1(CBr)CCC1 2277437955 QRISBGJCJSRJGP-UHFFFAOYSA-N 448.304 4.612 50 10 IJGE CC1CC(CBr)(CN2C[C@H](NC(=O)OC(C)(C)C)[C@H](c3ccccc3)C2)C1 2280056990 MNCFSFKXDNDFDK-XTNNAYBXSA-N 437.422 4.790 50 10 IJGE O=C(N[C@@H]1CCC[C@@H]1CCBr)c1cc(Br)c(F)cc1Cl 2285959751 VGSQABGLTVHBFQ-AMIZOPFISA-N 427.539 4.925 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC2C[C@H]3CC[C@H](C2)C3)C1 2299545624 RFFHPKYENXLARC-YZVOILCLSA-N 449.373 4.786 50 10 IJGE C[C@@]1(CBr)CCN(Cc2ccc(Cl)cc2I)C1 2302325581 IQJVSJWCBXZBSC-ZDUSSCGKSA-N 428.539 4.552 50 10 IJGE C[C@@H]1CO[C@@](CBr)(Cc2cc(I)ccc2Cl)C1 2307276457 WSJMWYSYPFGPAJ-TVQRCGJNSA-N 429.523 4.677 50 10 IJGE CC1(C)COC[C@]1(CBr)Cc1cc(Cl)ccc1I 2314641292 FRMJWWYSIUIXFL-CQSZACIVSA-N 443.550 4.925 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)c(I)c2)CC[C@H]1Br 2315551561 SGYJIKYDSYBRHV-CYBMUJFWSA-N 442.566 4.940 50 10 IJGE CCOc1cc(C=NNC(=O)Cc2ccc(OC)cc2)ccc1OCc1cc(C)ccc1C 2318415661 TUORNBOOYQQJAL-UHFFFAOYSA-N 446.547 4.983 50 10 IJGE C[C@@H]1C[C@@H](CBr)CCN1Cc1ccc(Cl)cc1I 2318540090 OUGUADSHNLIUTQ-MNOVXSKESA-N 442.566 4.940 50 10 IJGE COc1cc(C=NNC(=O)Nc2ccccc2C)cc([N+](=O)[O-])c1OCc1cccc(C)c1 2323840066 HOSJVLQZDOQMSN-UHFFFAOYSA-N 448.479 4.955 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CO[C@]3(C)C[C@H]2C3)cc1I 2337698262 SCOSUPAKLAPCAC-LWWSYDQCSA-N 437.115 4.551 50 10 IJGE CC[C@H](Oc1ccccc1[C@@H](C)CC)C(=O)NNC(=O)c1ccc(OCC(C)C)cc1 10683833 WFJDQBXDYQGDAO-AVRDEDQJSA-N 426.557 4.854 50 10 IJGE CCOC(=O)[C@]1(C)c2[nH]c3ccccc3c2[C@H](c2ccc(Cl)cc2)CN1C(=O)CCl 11767118 GMTABGKMARAVLC-SBUREZEXSA-N 445.346 4.813 50 10 IJGE O=C(N/N=C/c1c(O)ccc2ccccc12)c1ccn(Cc2ccc(Cl)cc2Cl)n1 20533948 FHVDODPGNQJBAJ-BRJLIKDPSA-N 439.302 4.861 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2cc(Cl)c(OCC)c(Cl)c2)cc1 58893866 JZVLPUSJSLFWGN-HTAGGTJDSA-N 439.339 4.755 50 10 IJGE Cc1ccc(-n2nc(C)c(/C=N/NC(=O)COc3ccc(Cl)cc3Cl)c2C)cc1C 59166155 WULGNBOXKJCANI-OPEKNORGSA-N 445.350 4.942 50 10 IJGE CN(C)CCCP(Br)(c1ccccc1)(c1ccccc1)c1ccccc1 59200987 ZCRBOUUCHRWEJX-UHFFFAOYSA-N 428.354 4.778 50 10 IJGE COc1cc(/C=C2/C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(F)cc1 101334882 QEMALACJVVJCMT-SRZZPIQSSA-N 448.494 4.662 50 10 IJGE Cc1ccc(Cn2c(SCC(=O)NN=C/C=C/c3ccco3)nc3ccccc32)cc1 254383039 OCTXKYUBUAROHS-ZVYIQZSDSA-N 430.533 4.894 50 10 IJGE Cc1cccc(-n2c(C)cc(C=NNC(=O)C(O)(c3ccccc3)c3ccccc3)c2C)c1 254635195 ZTTQEXKDOLEWPW-UHFFFAOYSA-N 437.543 4.789 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccncc2)ccc1OCCCOc1cccc(C)c1C 263630673 VDZZDHGYIIBBKD-UHFFFAOYSA-N 447.535 4.709 50 10 IJGE ClCc1nc2cccnc2n1-c1ccc(Br)c(I)c1 311618496 HPELFFLVPSKNCC-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE Clc1ccc(I)c(CNCCCCCCBr)c1 405343840 OVWWHJGRZBDNED-UHFFFAOYSA-N 430.555 4.990 50 10 IJGE C[C@@H](Cl)c1nc2cc(I)c(F)cc2n1CC1SCCS1 692805985 IPPXSBYJRXZEOP-SSDOTTSWSA-N 442.750 4.886 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@H]2CC[C@H](Cl)[C@H]1C2 721566764 JSEROLMUHDWJFO-FKTZTGRPSA-N 427.589 4.895 50 10 IJGE CC(=O)N(c1ccc(C)cc1)c1nc(/C=C(/C#N)C(=O)N(C)Cc2ccccc2)cs1 787151006 XUBIOPVXCWFOSJ-MOSHPQCFSA-N 430.533 4.702 50 10 IJGE C#C[C@H]1CCCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1631298887 SKTRGADECFAYPB-ACRNLXFHSA-N 436.353 4.635 50 10 IJGE Cn1cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2Cc1cccc(Cl)c1 1865699370 RXCFWALSLURUHC-NRFANRHFSA-N 441.922 4.808 50 10 IJGE COc1cc(/C=C(\C#N)S(=O)(=O)c2ccccc2)cc(OC)c1OCc1ccccc1 1872727182 CPXOVNFYMNRJRK-FYJGNVAPSA-N 435.501 4.621 50 10 IJGE COc1cc(Br)c([C@H](Br)[C@@H]2C[C@@H]2Br)cc1OC 1910111323 GGRDCVKGNKEMLM-UTMSNSNXSA-N 428.946 4.686 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)c1ccc(I)cn1 1915069696 NLFASAROYBDBNW-CYBMUJFWSA-N 445.142 4.866 50 10 IJGE O=C(c1cncc(Br)c1)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915312467 KCYLCNLUBUFEHU-QGZVFWFLSA-N 438.163 4.660 50 10 IJGE C[C@H](c1ccncc1Br)[C@@H](Br)c1cnn(C)c1Br 1924047844 QJXPZELZOBGFQU-RDDDGLTNSA-N 437.961 4.580 50 10 IJGE C[C@H]1[C@H](CBr)CCN1Cc1cccc(Br)c1Br 1943880166 AZPGTAPQPPANDR-UWVGGRQHSA-N 425.990 4.817 50 10 IJGE CCCC(CBr)(CBr)Cc1nn(C)c(C)c1Br 1945076719 BVLLCAUKAYVBIW-UHFFFAOYSA-N 431.010 4.610 50 10 IJGE CC1(C)CN(Cc2cc(Br)ccc2Br)[C@H]1CBr 2006498780 GEGHUQUSFQGRNW-LBPRGKRZSA-N 425.990 4.817 50 10 IJGE C[C@@H]1CN(Cc2cc(Br)ccc2Br)CC[C@@H]1Br 2006503420 NZONEXWRTVNIRS-SKDRFNHKSA-N 425.990 4.817 50 10 IJGE C[C@H](NC(=O)c1c(Br)cccc1Br)C(C)(C)CBr 2033092059 YPSQBPMPIOAMMV-QMMMGPOBSA-N 441.989 4.751 50 10 IJGE F[C@@]1(CBr)CCCN(Cc2ccc(Br)cc2Br)C1 2039795650 XUYCREUUINLRAW-CYBMUJFWSA-N 443.980 4.911 50 10 IJGE Clc1cc(CN2C[C@@H](Br)[C@H](C3CC3)C2)ccc1I 2086651838 LBMHXFOHEUVHRL-NWDGAFQWSA-N 440.550 4.550 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)C1CCN(C[C@@H](CBr)c2ccccc2)CC1 2106789554 ZGHFCVOKVZQGNY-VQIMIIECSA-N 425.411 4.790 50 10 IJGE Cc1cc(S(=O)(=O)N(C)[C@@H]2CC(C)(C)[C@@H]2OCc2ccccc2)sc1CCl 2156441423 GLPQUJQGKLAPCV-VQIMIIECSA-N 428.019 4.800 50 10 IJGE C[C@H]1CCCN(CC2(CBr)CCOCC2)[C@@H]1CCCNC(=O)OC(C)(C)C 2163063291 PJXLQMYMLRGGGS-ZWKOTPCHSA-N 447.458 4.584 50 10 IJGE C[C@@]1(CC(CBr)(CBr)c2cccc(Cl)c2)COCCO1 2174170132 ANKSDZCFULXSQI-CQSZACIVSA-N 426.576 4.563 50 10 IJGE C[C@@]12CC[C@@]([C@@H](Br)c3cc(I)cc4c3OCC4)(CO1)C2 2178377195 BLDDWXGCFQXTGE-JYJNAYRXSA-N 449.126 4.621 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)ccc2n1C[C@@H]1COCCN1Cc1ccccc1 2194650110 QAWZYXLPUJGHTQ-MAUKXSAKSA-N 448.792 5.000 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1[C@H]1COC[C@H]1F 2234067405 OAXHMQNFHOVKKB-RMUHFYJVSA-N 426.511 4.771 50 10 IJGE Cc1c(Br)csc1C(=O)N1C[C@]2(F)CCC[C@]2(CBr)C1 2234508776 WXEJUKRRGJOQPR-UONOGXRCSA-N 425.161 4.548 50 10 IJGE N[C@@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@H](Br)C1 2250815589 DLTFQLCQBXFKMG-RDSNPXOSSA-N 433.916 4.663 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@]23CCOC[C@@H]2C3)c1 2263509819 KVWWWOSXTRKMGS-BPNCWPANSA-N 438.985 4.944 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@H]1CCCCN1CC1(CBr)CC(F)C1 2265638096 IVCLMFUGKSZKMV-XOYHFGRZSA-N 443.348 4.514 50 10 IJGE COc1ccc([C@H](Br)CCC2CC(OC)C2)cc1I 2269533892 JCJQGXMEIRJQOW-KGPNIALWSA-N 439.131 4.941 50 10 IJGE CCN(C[C@@](C)(CBr)OC1(C2CCCCC2)COC1)C(=O)OC(C)(C)C 2272935778 SSFJPNRGYXSFIE-LJQANCHMSA-N 434.415 4.763 50 10 IJGE O=C(COc1cc(Cl)ccc1Cl)NN=CC(Br)=Cc1ccccc1 2296825670 VPYUVBGEGRIDBM-UHFFFAOYSA-N 428.113 4.910 50 10 IJGE C[C@H]1CCN(Cc2ccc(I)c(Br)c2)C[C@H]1Cl 2306231479 JYRCJKVSHHZTQV-JOYOIKCWSA-N 428.539 4.503 50 10 IJGE Cc1nc(Br)c(C[C@@H](Br)c2cccc(Br)c2)n1C 2315519556 JYHXTLNPNSRTJI-LLVKDONJSA-N 436.973 4.932 50 10 IJGE C[C@@H]1C[C@@H](Br)[C@@H](C)N(Cc2ccc(Cl)c(I)c2)C1 2315548220 DWXYRILLOWORSW-CKYFFXLPSA-N 442.566 4.938 50 10 IJGE COc1cc(NC=C(C#N)C(=O)Nc2cccc(C(F)(F)F)c2)c(OC)cc1Cl 2324412807 JIWNWNUGNSAYMY-UHFFFAOYSA-N 425.794 4.834 50 10 IJGE CC(C)[C@@H](C(O)=C(C#N)c1nc(-c2cccs2)cs1)N1C(=O)c2ccccc2C1=O 2331326854 WDXASLLLWOVMFS-SFHVURJKSA-N 435.530 4.985 50 10 IJGE CCOc1ccc(-c2csc(C(C#N)=C(O)[C@H]3CC(=O)N(C(C)C)C3)n2)c(OCC)c1 2331386550 LWIPFKJCWCXHGF-HNNXBMFYSA-N 441.553 4.657 50 10 IJGE COc1ccc([C@H](Cl)c2c(Br)c(Br)nn2C)c(Cl)c1 2338859768 HTHNBWXLOKJLJK-JTQLQIEISA-N 428.939 4.935 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CCCN(C[C@]3(CBr)CC3(F)F)C2)C1 2351892673 SDXRIMPISIRZGT-QZTJIDSGSA-N 437.369 4.520 50 10 IJGE CC(C)c1ccc(C(=O)NNC(=O)COc2ccc3ccccc3c2Br)cc1 10451888 YCAUGDIUKKNBBJ-UHFFFAOYSA-N 441.325 4.566 50 10 IJGE O=C(O)c1ccc(COc2ccccc2/C=N/NC(=O)c2cc3ccccc3cc2O)cc1 33590319 MQAQVGZWKZPEQI-JFLMPSFJSA-N 440.455 4.587 50 10 IJGE COc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCc3ccccc3F)c(OC)c2)cc1 40007320 SKMNSULDASQHGZ-CPNJWEJPSA-N 432.451 4.968 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NCCc2ccccc2)ccc1OCc1ccc(C)cc1 40007464 HTVWZGCUGXAMQT-LFVJCYFKSA-N 426.516 4.849 50 10 IJGE Cc1cccc(C(CBr)(CBr)Cc2cn3ccsc3n2)c1 149647508 QDUPODNWYFFNPH-UHFFFAOYSA-N 428.193 4.975 50 10 IJGE CC(C)C[C@@H](Br)CNC(=O)c1ccc(Br)cc1Br 232584485 TVAMCHNVOFZJLR-SNVBAGLBSA-N 441.989 4.751 50 10 IJGE COC(C)(C)CCO[C@@H](CI)c1ccc(Br)cc1 234674132 OIOUPTMDJNANFZ-ZDUSSCGKSA-N 427.120 4.757 50 10 IJGE CCOC(=O)[C@@H](Br)Cc1c(Br)cc(Cl)cc1Br 304153339 RBBXERBMGPKVLJ-JTQLQIEISA-N 449.364 4.734 50 10 IJGE COc1cc(/C=C\C(=O)Cl)cc(I)c1OCc1ccccc1 690654005 ZXVHFPKFOBLFCD-FPLPWBNLSA-N 428.653 4.657 50 10 IJGE C[C@@H](Br)C(C)(C)NC(=O)c1scc(Br)c1Br 705509292 CHXMICMIIDQPSW-RXMQYKEDSA-N 433.991 4.565 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@@]1(C)CN(c1nc3sccn3c1CBr)C2 705962860 MORLNJHKIVSHQH-SFTDATJTSA-N 445.430 4.639 50 10 IJGE CC[C@@H](C[C@H](C)Br)NC(=O)c1scc(Br)c1Br 716903960 AAXZGNYPFSYGOQ-BQBZGAKWSA-N 448.018 4.955 50 10 IJGE O=C(NN=Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1OCc1ccc(F)cc1 739399934 KBIZKXNDPOEYNV-UHFFFAOYSA-N 427.819 4.730 50 10 IJGE CC(C)(C)c1ccc(COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cn1 797302772 DZOMCRSMOARLCP-KGENOOAVSA-N 439.519 4.807 50 10 IJGE O=C(NN=Cc1cc(Cl)cc(Cl)c1O)c1ccc(NC(=O)C2CCCCC2)cc1 1084075154 IIESCKJUFIAVDD-UHFFFAOYSA-N 434.323 4.982 50 10 IJGE CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NNc1ccc(Cl)cc1Br 1168053799 BIGGPXWWRKPOKH-SFHVURJKSA-N 434.721 4.510 50 10 IJGE Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NNc1nc2ccccc2[nH]c1=S 1646013510 NXMIMSIEMAWEOX-UHFFFAOYSA-N 429.864 4.805 50 10 IJGE C[C@H](Br)C(=O)c1cc(I)ccc1SC(F)(F)F 1848425821 DOLSGTXUJHAHJF-YFKPBYRVSA-N 439.034 4.869 50 10 IJGE O=C(CCCl)Nc1ccc(Oc2ccc(NC(=O)[C@H]3CCCC[C@H]3C(=O)O)cc2)cc1 1859505293 UQADGEIBVOTZBJ-VQTJNVASSA-N 444.915 4.876 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CC)nn2-c1ccccc1Cl 1865691084 IUIWXYMHFFTUMQ-NRFANRHFSA-N 432.911 4.871 50 10 IJGE Cc1ccc(C)c(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)c1 1865711137 QKPFPUYERAEBPH-SFHVURJKSA-N 442.416 4.924 50 10 IJGE O=S(=O)(c1cccc(Br)c1)N(Cc1ccccc1)C1(CCl)CCC1 1915760240 NBGDRIKALONBNI-UHFFFAOYSA-N 428.779 4.802 50 10 IJGE Cc1cnc(C(=O)N(Cc2ccccc2)[C@@H](C)CCBr)c(Br)c1 1992737603 NVTDIYZLYVJBNU-AWEZNQCLSA-N 440.179 4.968 50 10 IJGE C[C@H](Br)[C@H]1CCCN1C(=O)c1cc(Br)c(Br)s1 2018106068 BASOYSWSNXWEHH-POYBYMJQSA-N 446.002 4.661 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@H]1CCCCN1CC1(CBr)CCC1 2065452061 GJNIWIGIJALWDO-CQSZACIVSA-N 425.358 4.566 50 10 IJGE O=S1(=O)CCC[C@@H]([C@H](Br)c2cc(Cl)c(Br)cc2F)C1 2089859818 FJZAWZQZFSIFEE-KRTXAFLBSA-N 434.552 4.502 50 10 IJGE Cn1nc(COc2cccc(CBr)c2Cl)c(Br)c1Cl 2096688038 GCCXTYVDUYGDDG-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2[C@H]1CN(Cc2ccccc2)C[C@H]1C 2096803838 TXHOZPNGXRLCOH-ACJLOTCBSA-N 433.781 4.934 50 10 IJGE CC(C)(C)OC(=O)NCc1cccc2c1N(C(=O)CCCCBr)CCC2 2106773799 MWIAAQOEXXSREP-UHFFFAOYSA-N 425.367 4.556 50 10 IJGE CN(Cc1ccc(I)cc1)C1(CBr)CC2(CCC2)C1 2108320174 VVIATRRWXODCOC-UHFFFAOYSA-N 434.159 4.821 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1cccc(F)c1Br 2117895280 QPTANTQWRSZZLP-JTQLQIEISA-N 442.110 4.702 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1ccc(C(C)(F)F)cc1 2128390675 VAIHIBDZOVCESV-GOSISDBHSA-N 426.301 4.851 50 10 IJGE Cc1csc(CCl)c1S(=O)(=O)N(C)[C@H]1CC(C)(C)[C@@H]1OCc1ccccc1 2156446152 ZQIMLIDZMNTCBV-QFBILLFUSA-N 428.019 4.800 50 10 IJGE CN(Cc1ccccc1)[C@@H]1CCCCN(c2ccc(CBr)cc2[N+](=O)[O-])C1 2169164949 HDOFTXAZGPPWIK-LJQANCHMSA-N 432.362 4.981 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2C[C@H]1CCCN1Cc1ccccc1 2184934998 IIVZSRFRJILCLE-QGZVFWFLSA-N 447.808 4.948 50 10 IJGE CC(C)(C)[C@@H]1[C@H](Cl)CCN1C(=O)c1ccc(I)c(Cl)c1 2185112937 GBBJPUXADIONGQ-MFKMUULPSA-N 426.125 4.813 50 10 IJGE C=CC[C@@]1(CBr)CCCN(Cc2ccc(I)cc2)C1 2272138859 QLWMSQLNFJGRIY-INIZCTEOSA-N 434.159 4.844 50 10 IJGE CC(C)([C@H](Cl)c1c(F)cc(Br)c(F)c1Br)S(C)(=O)=O 2272854565 QPOSKMHEXARFCL-SNVBAGLBSA-N 440.531 4.593 50 10 IJGE Cc1sc(Br)c(C(=O)NCC2(CBr)CC(F)(F)C2)c1C 2281654560 JFHRPDSIKSTOHL-UHFFFAOYSA-N 431.140 4.668 50 10 IJGE CCN1C(=C(C#N)c2nc(C#N)c(C#N)nc2Sc2ccc(C)cc2)Nc2ccccc21 2293202104 DHYDSUZTYZGDPQ-UHFFFAOYSA-N 435.516 4.824 50 10 IJGE CC(C)N(Cc1ccc(Cl)c(I)c1)C[C@@H](C)Br 2300240719 PLGLWFGXTPXSJA-SNVBAGLBSA-N 430.555 4.938 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1Cc1ccc(Cl)cc1I 2302325816 KPPFLPQBPPFPMZ-WCQYABFASA-N 428.539 4.692 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@@H]2CCCC[C@H]3C[C@@H]32)CC1 2302876317 RWRYBCLCFKEFCP-HRCADAONSA-N 449.373 4.786 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1Cc1cc(I)ccc1Cl 2307325095 VNYPCLJJQVTTJS-DGCLKSJQSA-N 428.539 4.692 50 10 IJGE Clc1ccc(I)c(CN2[C@H]3CC[C@H](C3)[C@@H]2CBr)c1 2310106768 XNHHFPULAGYWGZ-LQJRIPTKSA-N 440.550 4.692 50 10 IJGE C=CCc1cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)cc(Br)c1OCC#N 2313567811 LKHUSFNXGHLKHD-UHFFFAOYSA-N 436.309 4.934 50 10 IJGE O=S1(=O)C[C@H]2C([C@@H](Cl)c3cc(Br)ccc3OCc3ccccc3)[C@@H]2C1 2314439271 GKAQSVDDISJPDZ-MDZRGWNJSA-N 441.774 4.599 50 10 IJGE CCc1ccc(N(C(=O)C(C#N)=Cc2ccc(OC)cc2)S(=O)(=O)c2ccccc2)cc1 2314777600 MFNQBBPAPZWELT-UHFFFAOYSA-N 446.528 4.587 50 10 IJGE CCCCCCOc1ccc(C=C(C#N)C(=O)Nc2nnc(SC)s2)cc1OC 2314793628 VXGGPJVWXFVKBG-UHFFFAOYSA-N 432.571 4.773 50 10 IJGE CC(C)[C@H]1[C@H](Br)CCN1Cc1ccc(Cl)c(I)c1 2315549888 XJDCXWLQISLLCQ-RISCZKNCSA-N 442.566 4.938 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3nc(S)[nH]c3c2)cc1OCc1ccc(C)cc1 2323603075 MDPVWJBQLKDRCX-UHFFFAOYSA-N 446.532 4.512 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@H]([C@H]3CCCN3C(=O)OC(C)(C)C)C2)C1 2345009656 GEHYMNCPDVBZIJ-IAGOWNOFSA-N 429.443 4.909 50 10 IJGE F[C@@]12CCC[C@]1(CCl)CN(Cc1ccc(Cl)cc1I)C2 2366738060 JBBQPHNKBZWUGT-LSDHHAIUSA-N 428.116 4.878 50 10 IJGE CN(Cc1nccn1Cc1ccccc1)c1nc(C(F)(F)F)ccc1CBr 2369850280 AAHJAQIHGDWAIM-UHFFFAOYSA-N 439.279 4.877 50 10 IJGE CCOc1ccc2ccccc2c1/C=N\NC(=O)Cn1c(-c2ccccn2)nc2ccccc21 33155090 OGEJEFVFRBEJHA-RHANQZHGSA-N 449.514 4.801 50 10 IJGE CCN(c1ncnc(NNC(=O)c2ccccc2Cl)c1N)c1cccc2ccccc12 40702054 BYLBCISHXAAIHA-UHFFFAOYSA-N 432.915 4.780 50 10 IJGE CCc1cccc(OCC(=O)N/N=C/c2ccc(OCc3ccccc3C)c(OC)c2)c1 40888724 HHULCGVFIOLPPB-JVWAILMASA-N 432.520 4.674 50 10 IJGE COc1cccc(CN(C(=O)CCl)[C@@H](C(=O)NC2CCCCC2)c2ccccc2C)c1 97914446 PQXBFQYEPQRMIK-XMMPIXPASA-N 442.987 4.761 50 10 IJGE CC[C@H](C)N1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccc(C)cc3)c(OC)c2)C1=O 214269797 XHSWDMZBMSMRBQ-FPJJECCMSA-N 444.531 4.973 50 10 IJGE O=C(NN=CC1=C(N2CCOCC2)/C(=C\c2ccc(Cl)cc2Cl)CC1)c1ccco1 245285181 WFXJULYNRQCVAN-OOCUIMHWSA-N 446.334 4.766 50 10 IJGE ClCc1c(Br)cccc1N1CCO[C@H]2CCN(Cc3ccccc3)C[C@@H]21 404212724 XHRUVROZCUHHIJ-SFTDATJTSA-N 435.793 4.668 50 10 IJGE Clc1ccc(I)c(CN2CC[C@H](CCBr)C2)c1 405342467 NTNYYIJPMJDIQG-JTQLQIEISA-N 428.539 4.552 50 10 IJGE ClCc1cc(Br)cc(Br)c1OCCOC[C@H]1CCCO1 710310114 TYRZMZJMYKQKJK-GFCCVEGCSA-N 428.548 4.525 50 10 IJGE N#C/C(=C/c1ccc(-c2nc3ccccc3s2)o1)C(=O)NCc1ccc([N+](=O)[O-])cc1 787150095 YABUYJOXCVGWCV-PTNGSMBKSA-N 430.445 4.688 50 10 IJGE Cc1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c(OC[C@@H]2CCCO2)c1 799391533 QDCHBNCCTUNKNY-HNNXBMFYSA-N 434.418 4.592 50 10 IJGE Cc1ccc(CNC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)c(C)c1 914482426 CWLGYZGKVSKSQD-FYJGNVAPSA-N 443.938 4.957 50 10 IJGE N#Cc1ccccc1Cn1cc(C=NNC(=O)CC[C@H](O)c2ccccc2)c2ccccc21 1083907598 VZYZSQOAZRATFV-SANMLTNESA-N 436.515 4.525 50 10 IJGE CCOc1cc(C=NNC(=O)c2cccc([N+](=O)[O-])c2C)ccc1OCc1ccccc1 1084322277 VYLKRRNRTKCHGC-UHFFFAOYSA-N 433.464 4.645 50 10 IJGE C=CCC1(C(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(C)c2C)CCCCC1 1136795588 ZPOYYLSREYUYEG-UHFFFAOYSA-N 430.552 4.972 50 10 IJGE C#CCN(Cc1ccc(F)cc1)C(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(F)cc2)c1C 1357771269 OZRSOOBBRYADCW-PXLXIMEGSA-N 429.470 4.941 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccc(-c3cccc(Cl)c3)nc2O)cc1C(F)(F)F 1632134016 JSCPDHIWHPVYEO-UHFFFAOYSA-N 432.789 4.755 50 10 IJGE CCc1nn(-c2ccccn2)c2c1[C@@H](c1ccc(OCc3ccccc3)cc1)C(C#N)=C(N)O2 1865690614 WYZDXKIVNAXOFO-DEOSSOPVSA-N 449.514 4.627 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2-c1ccccc1 1865702859 GXOVYDQXOJYFAO-SFHVURJKSA-N 440.425 4.898 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCN(C[C@@H](Br)C(F)(F)F)C2)C1 1879197714 CPXODZHUQFKXJI-QLFBSQMISA-N 443.348 4.671 50 10 IJGE Cc1c(Br)sc([C@H](Br)C2[C@@H]3COC[C@@H]23)c1Br 1922895748 YSULNWHTEVGMOS-HCVRKRLWSA-N 430.987 4.910 50 10 IJGE C[C@@H](Br)CCCNC(=O)c1c(Br)cccc1Br 1945333434 PYCLKQFBYHOXMN-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE CCOc1c(Br)cc(Br)cc1C[C@H](CBr)OC 2008748318 JDTAVHFUDHDYKV-SNVBAGLBSA-N 430.962 4.563 50 10 IJGE C[C@@H](CCBr)CCNC(=O)c1c(Br)cccc1Br 2033088457 IMYHHAPNYZQIDM-VIFPVBQESA-N 441.989 4.753 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](C(F)(F)F)CCN1CCCCCBr 2045430856 HGRMIZKOMFYFRF-KGLIPLIRSA-N 431.337 4.719 50 10 IJGE CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(CBr)c1F 2059312082 GGUZOLXSSNCCAN-ZDUSSCGKSA-N 432.330 4.849 50 10 IJGE Cc1cc(CNC(=O)OC(C)(C)C)cc(NC(=O)[C@@H](Br)C2CCCC2)c1 2110728546 QFWKMSZMTYWYMU-KRWDZBQOSA-N 425.367 4.912 50 10 IJGE Cc1cc(CBr)cnc1N1C[C@@]23CCC[C@]2(CN(Cc2ccccc2)C3)C1 2153340117 AOANREFYVLSPBB-GOTSBHOMSA-N 426.402 4.777 50 10 IJGE CC1(C)CC[C@H](CNC(=O)c2ccc(CBr)cc2)N(C(=O)OC(C)(C)C)C1 2162485104 AQUSVRDMEWYCSJ-QGZVFWFLSA-N 439.394 4.737 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@@H]1CN(C[C@H](CBr)c1ccccc1)C2 2163058630 MBXOZQKWQCICOG-JQVVWYNYSA-N 437.422 4.792 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@H](CBr)CC2CC2)C[C@@H]1c1ccccc1 2169173698 LNYCDXGVVVEQEZ-DFQSSKMNSA-N 437.422 4.790 50 10 IJGE CCc1nc(C(=O)N(CCBr)Cc2cccs2)c(Br)s1 2171090004 BPJOVXHTTSSKSA-UHFFFAOYSA-N 438.210 4.567 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@H]1C[C@@H]2CC[C@H](C1)O2 2181362721 TXXKKHNJYLYLFN-DNVSUFBTSA-N 449.126 4.620 50 10 IJGE C[C@@H]1[C@H](NC(=O)OC(C)(C)C)CC[C@H](C(=O)N(C)CC2CC(Br)C2)C1(C)C 2196906455 DZNBBBUSGFIMGW-PYVGIJRLSA-N 445.442 4.584 50 10 IJGE C[C@H](Cl)CN(c1ncc(I)cc1Br)C(C)(C)C 2250600769 JZIUQZOQJWGNIU-QMMMGPOBSA-N 431.543 4.681 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@H](Br)C2(CCC2)C1 2285846769 RXGUZOPPXKUSMD-LBPRGKRZSA-N 425.523 4.631 50 10 IJGE BrC[C@@H]1Cc2ccccc2CN1Cc1ccc(I)cc1 2296464183 FXMOIZFBAMBWCI-KRWDZBQOSA-N 442.138 4.613 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2cc(Br)ccc2O)sc(C)c1C 2296833246 PMZKTLVAFFFQPM-UHFFFAOYSA-N 449.326 4.555 50 10 IJGE N#CC(=Cc1ccc(OC(=O)c2ccco2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 2297551528 PHRKMBWJAXOFGC-UHFFFAOYSA-N 437.795 4.606 50 10 IJGE C[C@@H]1C[C@@H](Br)CN(Cc2ccc(Cl)cc2I)C1 2302326536 QCHHYVFWQAHTFM-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE Clc1ccc(C[C@]2(CBr)C[C@]23CCOC3)cc1I 2315554319 DGIXSKRMAANWTR-UONOGXRCSA-N 441.534 4.679 50 10 IJGE CCN1C(=O)CCc2cc(-c3nc(NC(=O)C(C#N)=Cc4ccccc4)sc3C)ccc21 2320934124 UTKKITUQICXTRX-UHFFFAOYSA-N 442.544 4.963 50 10 IJGE CCOC(=O)CN(C(=O)C(C#N)=Cc1cccc(Br)c1)c1ccc(Cl)cc1 2324521798 YNWOUFXAJNXIKK-UHFFFAOYSA-N 447.716 4.606 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@@H]1CCCC[C@@H]1C(F)(F)F 2343414960 VPBLMEYKWDLHQP-ZACQAIPSSA-N 436.312 4.842 50 10 IJGE Clc1cc(Br)c(CN2C[C@H](CBr)OC3(CCC3)C2)s1 2345950689 VEDXWFQJILVGOE-VIFPVBQESA-N 429.605 4.682 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccco4)ccc32)cc1OCC 38679168 CWEVJSSVSRLELP-QHCPKHFHSA-N 446.459 4.514 50 10 IJGE Cc1cc(C)c2c(CC(=O)N/N=C3\CCCc4oc(C(=O)OC(C)C)c(C)c43)coc2c1 40827045 IGXXWCKCSVQTFO-NLRVBDNBSA-N 436.508 4.916 50 10 IJGE C/C(=N/NC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1)c1ccc(Cl)s1 59400037 DSXACJQJAYZSOK-NPLDLRHZSA-N 447.988 4.724 50 10 IJGE O=C(Nc1ccccc1S[C@H](Cl)C(F)(F)F)c1ccc(Cn2ccccc2=O)o1 97111255 KGUMYGQGJBBFHZ-SFHVURJKSA-N 442.846 4.961 50 10 IJGE CC(CC(=O)Nc1ccc(Br)cc1)=NNC(=O)c1ccc(C(C)(C)C)cc1 254506341 WVMCSABFBQNINK-UHFFFAOYSA-N 430.346 4.881 50 10 IJGE CCCCc1ccc(OCC(=O)NN=Cc2ccc(OC(=O)c3cccs3)cc2)cc1 254571457 XHQGUEQVPAUZCP-UHFFFAOYSA-N 436.533 4.839 50 10 IJGE CC(C)C[C@@H](C)O[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 725343878 UALACBCWDZQSGU-RHSMWYFYSA-N 425.351 4.642 50 10 IJGE O=C(NCc1ccccc1-n1cccn1)C(=O)Nc1cccc(S(F)(F)(F)(F)F)c1 762644701 AUYNTYUAXGQSOP-UHFFFAOYSA-N 446.401 4.785 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2cc(Cl)ccc2OCc2ccc(C#N)cc2)cc1 1084314142 AGHKSGTUMVZPPO-UHFFFAOYSA-N 433.895 4.953 50 10 IJGE N#CSc1ccc(NC(=O)c2cccc(NC(=O)c3c(F)cccc3Cl)n2)cc1 1860557554 KUBKTBJNYNNXMM-UHFFFAOYSA-N 426.860 4.952 50 10 IJGE Cc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1cccc(F)c1)C(C#N)=C(N)O2 1865707922 JMMYFCYVHVIJAO-IBGZPJMESA-N 429.282 4.904 50 10 IJGE O=C(NCCCBr)c1cccc(N2COc3ccc4ccccc4c3C2)c1 1865900696 USZVHHFAIOUQLH-UHFFFAOYSA-N 425.326 4.711 50 10 IJGE COc1cc(OC)c(OC)cc1/C=C(\C#N)c1nc(-c2ccc(OC)c(OC)c2)cs1 1872781435 GTDWGSUYPXKVAX-LZYBPNLTSA-N 438.505 4.917 50 10 IJGE CC(C)[C@H](Br)[C@H](C)NC(=O)c1cc(Br)sc1Br 1997050945 SEYNMVROECZHMU-RCOVLWMOSA-N 448.018 4.811 50 10 IJGE ClC[C@H](Nc1ncc(I)cc1Br)c1ccsc1 2015763023 STDBJYRYCNPAKC-JTQLQIEISA-N 443.535 4.902 50 10 IJGE CC(C)N1C[C@H](Br)[C@H](Cc2c(Br)cccc2Br)C1 2039261358 GWOGMNADIGZCIV-YGRLFVJLSA-N 440.017 4.858 50 10 IJGE C=CCn1c(C)c(C)c(S(=O)(=O)c2ccccc2)c1NC(=O)C(C#N)=Cc1ccccc1 2085242028 PYPUGHVFYOCALZ-UHFFFAOYSA-N 445.544 4.669 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]12CC[S@](=O)(=NCC1(CBr)CCCC1)C2 2106788325 ORSWQJCOGVIPSG-NIYFSFCBSA-N 449.455 4.583 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCN(C[C@H](CBr)c2ccccc2)C1(C)C 2106887514 CJEKOUXNNSZUSI-ROUUACIJSA-N 425.411 4.790 50 10 IJGE COCc1cc(Br)c([C@@H](Cl)c2nn(C)c(Br)c2C)s1 2111930338 QYYBAQWDUJTHLR-VIFPVBQESA-N 428.577 4.790 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Cl)c1c(Br)cnn1C 2138240204 HGPCLYKNGQCJNH-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE CCCC(CBr)(CCC)CN1CCC[C@@H]2CC[C@]21CNC(=O)C(F)(F)F 2163059276 RSTGNSCYRHKLHX-QAPCUYQASA-N 441.376 4.891 50 10 IJGE CC[C@@H](N)Cc1cc(Cl)cc(Br)c1OC[C@H]1C[C@@H](Br)C1 2196937901 MJRXZYMFDDKESM-SUZMYJTESA-N 425.592 4.935 50 10 IJGE FC(F)(F)[C@@H]1C[C@@]1(CCl)CNCc1ccc(I)c(Cl)c1 2208027483 AGFWIZFMHMFGTC-VXGBXAGGSA-N 438.058 4.842 50 10 IJGE Cn1nc(Br)c([C@@H](Cl)c2scc(C(F)(F)F)c2Br)n1 2226986620 KECFMQQONNHOGH-RXMQYKEDSA-N 439.482 4.749 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1[C@H](C)C[S@@](C)=O 2234059305 IIJPSAIKNACZME-SMPFOWEGSA-N 442.604 4.801 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCCCN(c2nc(CBr)cs2)C1 2254174415 PTDMLXQVPVHWST-UHFFFAOYSA-N 430.362 4.776 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@H](CBr)C(C)(C)C)[C@H](C(F)(F)F)C1 2266272048 JXKBBDFTBUTAJS-MCIONIFRSA-N 445.364 4.964 50 10 IJGE Clc1ccc(CN2C[C@H](C3CC3)[C@@H](Br)C2)cc1I 2315552670 HNKIYQIDIGJKJV-NEPJUHHUSA-N 440.550 4.550 50 10 IJGE Clc1ccc(COc2ccc(CBr)nc2)c(I)c1 2317809926 CVBMHYSVKGUOQI-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE C[C@H](Br)[C@@H]1CCCN(Cc2ccc(Cl)cc2I)C1 2318539097 LBEBAAXUWKSKQD-WDEREUQCSA-N 442.566 4.940 50 10 IJGE CCn1c(C)c(C=NNC(=O)c2ccc3nc(-c4ccccc4O)[nH]c3c2)c2ccccc21 2323743441 XOENAEFXCOQZSW-UHFFFAOYSA-N 437.503 4.982 50 10 IJGE COc1ccc([C@@H](C)NC=C(C#N)C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)cc1OC 2325107945 JKBSTEFYNKKDKT-MSOLQXFVSA-N 433.552 4.518 50 10 IJGE COc1ccc(Cn2c(Cl)nc(Cl)c2CBr)c(Br)c1 2339480960 XKDYYTYCFHPAMH-UHFFFAOYSA-N 428.939 4.904 50 10 IJGE CN(C[C@@H]1CCCCN1Cc1ccccc1)c1c(CBr)c(C(F)F)nn1C 2365330918 VZUTYJNWCPQCAG-INIZCTEOSA-N 441.364 4.744 50 10 IJGE COc1c(Cl)cc(COC2(CI)CCOCC2)cc1Cl 2365734338 OPSRJGMEXKFYQC-UHFFFAOYSA-N 431.097 4.503 50 10 IJGE O=C(NC1CCCCCC1)[C@@H](c1ccc(F)cc1)N(Cc1ccccc1)C(=O)CCl 3039033 SPKXGJCMYSHIML-HSZRJFAPSA-N 430.951 4.973 50 10 IJGE N#C/C(=C/c1cccc([N+](=O)[O-])c1)C(=O)Nc1nc2ccc(OC(F)(F)F)cc2s1 3192637 QJEHSYWSBDOOAH-WDZFZDKYSA-N 434.355 4.649 50 10 IJGE C=CCOc1ccc(Br)cc1/C=N/NC(=O)[C@H](C)Oc1cccc(Cl)c1 20311316 RTNXWARWDNAZDP-AEOXGOBCSA-N 437.721 4.585 50 10 IJGE [O-][n+]1onc(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)c1-c1ccccc1 105406414 YOTNSXBZKLLLDW-UHFFFAOYSA-N 437.439 4.784 50 10 IJGE COc1ccc(Br)c([C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CBr)c1 382685635 ILUNRTCHHYNWNV-FZMZJTMJSA-N 449.183 4.803 50 10 IJGE CO[C@H](CO[C@@](C)(CI)c1ccccc1Br)C(C)C 389316787 RZJFCRBMSOXUEK-CABCVRRESA-N 441.147 4.787 50 10 IJGE CC[C@@H](Br)CCCNC(=O)c1ccc(I)c(Cl)c1 398569604 PAWGLTVLLVAAMU-SNVBAGLBSA-N 444.538 4.628 50 10 IJGE CO[C@@]1(CC(CBr)(CBr)c2ccccc2Cl)CCOC1 692462195 MIMWSTDQQHTPMJ-OAHLLOKOSA-N 426.576 4.563 50 10 IJGE Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)c3ccc(-c4ccccc4)o3)cc2)cc1 753410448 FHVOTUMFGYFRFS-UHFFFAOYSA-N 432.501 4.845 50 10 IJGE Cc1nc(Cc2ccc(F)cc2)sc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799751928 VJEQBBQERZBVRY-UHFFFAOYSA-N 434.418 4.829 50 10 IJGE N#C/C(=C\c1ccc(I)o1)C(=O)Nc1cccc(Cl)c1Cl 1084541855 PKVHNSKAJDNFLT-SOFGYWHQSA-N 433.032 4.737 50 10 IJGE COc1ccc2c(c1)c(C(=O)NNc1nc(-c3cccnc3)nc(C)c1C)c(C)n2C1CC1 1318729634 KGVMYUYTVDTVKN-UHFFFAOYSA-N 442.523 4.519 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2ccc(-c3cc(O)n[nH]3)cc2)c(C)n1-c1ccccc1F 1540729003 DVKKUXFNRGGMRE-XDHOZWIPSA-N 441.466 4.875 50 10 IJGE CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NNc1c(Cl)cccc1Br 1559008056 BGIPUGSTGISISW-KRWDZBQOSA-N 434.721 4.510 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(O)cc2)CCC3)cc1 1772744442 DMQKNROMMOJHKQ-UHFFFAOYSA-N 432.476 4.546 50 10 IJGE COc1cc(C=NNC(=O)COc2cc(C)cc(C)c2C)ccc1OCc1ccccc1 1772753203 BPUGIRFUYDQQOM-UHFFFAOYSA-N 432.520 4.729 50 10 IJGE O=C(CSc1nc(-c2ccccc2)cs1)NN=Cc1cccc(Br)c1 1772755251 XHXFEFBKYIUNHS-UHFFFAOYSA-N 432.368 4.815 50 10 IJGE CCN(CC)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccccc2Cl)cc1 1865702194 PCBDWKHHHVTRQR-HSZRJFAPSA-N 447.970 4.958 50 10 IJGE C[C@H](CC(=O)N(C)C[C@H]1C[C@H]1Br)c1ccc(NC(=O)OC(C)(C)C)cc1 1887829863 OYYBWYZIWMKNAN-FRFSOERESA-N 425.367 4.769 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Cl)CCc1ccc(Cl)cc1Br 1905438380 MXKUPCMZZDBDBK-ZDUSSCGKSA-N 427.125 4.939 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)C(=O)Cc1ccc(Br)cc1F 1914638275 NUHBVTRAAAGZBD-ZDUSSCGKSA-N 443.154 4.943 50 10 IJGE CC[C@H](CBr)CN1C[C@@H](CC)N(C(=O)OCc2ccccc2)C[C@@H]1CC 1977883689 FXCXEGHOHPXBIE-YZGWKJHDSA-N 425.411 4.919 50 10 IJGE Clc1nc(N2CC[C@H]3CN(Cc4ccccc4)C[C@@H]3C2)sc1CBr 2003091803 ZSASBWVCFNRNOZ-LSDHHAIUSA-N 426.811 4.650 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1csc(Br)c1Br 2023033176 BSIRZXMEFMVRKD-HTRCEHHLSA-N 448.018 4.813 50 10 IJGE CC(C)[C@@H](Br)CCNC(=O)c1cc(Br)ccc1Br 2029915903 CQVRNDOXXKSCSY-NSHDSACASA-N 441.989 4.751 50 10 IJGE O=C(NC[C@@H](Br)C1CCC1)c1cccc(Br)c1Br 2031476292 AHZRNGIEDPLNAJ-LLVKDONJSA-N 439.973 4.505 50 10 IJGE BrC[C@@H]1CC2(CC2)CN1Cc1cccc(Br)c1Br 2037826119 XFJMCEAPZBFEQM-NSHDSACASA-N 438.001 4.961 50 10 IJGE CC(C)[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(CBr)c1 2059265934 BGVBZUWYJXLVNY-OAHLLOKOSA-N 428.367 4.956 50 10 IJGE CN(c1ncc(I)cc1Br)[C@H]1CCCCC[C@@H]1Cl 2069528696 LEHVMOYCQVMZBJ-RYUDHWBXSA-N 443.554 4.825 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@H]2[C@H](Cl)CCC[C@H]2C1 2094583771 LOMRWTKBUAVRTD-QXFUBDJGSA-N 427.589 4.753 50 10 IJGE CCCC(CBr)(CCC)CN1CC(CCNC(=O)OC(C)(C)C)(OC)C1 2106785937 RELXKZOGQXBYDS-UHFFFAOYSA-N 435.447 4.584 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1[C@H](CCl)C[C@@H]2CCC[C@H]21 2108400129 UJDMSSALWMHSMP-OYNCUSHFSA-N 427.589 4.895 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CNC(=O)CCCCBr)CCCC[C@@H]12 2108946799 LQNYYUGGZCKHCV-OXQOHEQNSA-N 431.415 4.628 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(CCNC(=O)[C@H](Br)C2CCCC2)cc1 2110723513 OEBGLMILJBEEDI-QGZVFWFLSA-N 425.367 4.646 50 10 IJGE ClCc1nc2ncccc2n1-c1ccc(I)cc1Br 2119399434 UBAWYCJTEZPGGC-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(Cc2ccc(CBr)cc2)CCC1(F)F 2126471847 OYDDDMCZIFYBNZ-MRXNPFEDSA-N 433.337 4.706 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@@H]2OCCN(C(=O)OC(C)(C)C)[C@H]2C1 2163061907 IQWNKIOYEDSDNN-ROUUACIJSA-N 447.458 4.678 50 10 IJGE O=[N+]([O-])c1ccc(CBr)c(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1 2176907726 BVPVGYNLLNIPQR-OAQYLSRUSA-N 430.346 4.592 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Br)[C@H]1OCCOC1(C)C 2203000375 NXEKWJZRUJWDRY-DGCLKSJQSA-N 428.548 4.741 50 10 IJGE CC[C@H]1CN(C(=O)OC(C)(C)C)[C@@H](CC)CN1CCCCCI 2211186075 NMBIUTJIEXVITN-HOTGVXAUSA-N 438.394 4.702 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCCCl)CCN(C(=O)OC(C)(C)C)CC1 2211440465 WUKXIDUYAYBCBC-UHFFFAOYSA-N 448.048 4.575 50 10 IJGE Fc1cc(F)c(OC[C@H]2CC2(Br)Br)c(CBr)c1 2213084769 PMDXGRHERNSDBJ-SSDOTTSWSA-N 434.900 4.745 50 10 IJGE O=S(=O)(Cc1ccsc1Br)N(Cc1ccccc1)[C@@H](CCl)C1CC1 2213760899 MWRZSGMWORTCLU-INIZCTEOSA-N 448.835 4.860 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)[C@H]1C[C@@H]2CCC[C@H](C1)C2(F)F 2233637896 IYORMYVGIDFYTQ-AKHDSKFASA-N 444.360 4.887 50 10 IJGE CCC[C@@H](CCl)CNCc1ccc(I)c(Br)c1 2306228569 RDVQJGMOYOEYRW-NSHDSACASA-N 430.555 4.798 50 10 IJGE CC[C@H](C)N(CCBr)Cc1cc(I)ccc1Cl 2307323916 GEONHGDKRWDJMQ-JTQLQIEISA-N 430.555 4.940 50 10 IJGE CCCOc1ccccc1C=CC(=O)Oc1ccc(C=C(C#N)C(=O)OCC)cc1OCC 2314774422 JKNUKPRYSBSRJH-UHFFFAOYSA-N 449.503 4.963 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)cc2I)[C@H](C)C[C@@H]1Br 2318557839 OXDIJHNSAVKFTR-BREBYQMCSA-N 442.566 4.938 50 10 IJGE O=C1C(=Cc2ccccc2Br)Oc2cc(OC(=O)C(Cl)Cl)ccc21 2323752183 GWIJEDZBYQSTFQ-UHFFFAOYSA-N 428.065 4.774 50 10 IJGE CC[C@H](NC(=O)C(C#N)=CNc1cc([N+](=O)[O-])ccc1OC)c1ccc2c(c1)CCCC2 2325092632 BSZPJNJNVMYAKG-NRFANRHFSA-N 434.496 4.569 50 10 IJGE Cc1cc(C)cc(NC=C(C#N)C(=O)Nc2ccc(I)cc2C)c1 2325408171 JQPMSLLRGNCIIS-UHFFFAOYSA-N 431.277 4.675 50 10 IJGE CC(C)C[C@H](CBr)CN1CCC[C@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2353830367 CLFOCWYLXVGZPG-PBHICJAKSA-N 445.364 4.965 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@@H]2[C@@H]3CC[C@@H](CN3C(=O)OC(C)(C)C)[C@H]2C1 2353833743 HUCGWONAUVYJQS-LFDJNIOPSA-N 429.443 4.621 50 10 IJGE Cc1sc(Br)c(C)c1[C@@H](Br)[C@]12CCC[C@H]1CS(=O)(=O)C2 2358571735 SSDLHLGEZCAMJV-SUHUHFCYSA-N 442.238 4.778 50 10 IJGE C=CC[C@@H](Br)[C@@H]1CCN1C(=O)c1cc(Br)c(F)cc1Cl 2360965870 ZKSXJBFQSVAWKX-RNCFNFMXSA-N 425.523 4.796 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccc([N+](=O)[O-])c2)CCC3)c1 40813056 GHPZMKAOSSVZMB-LGUFXXKBSA-N 446.463 4.527 50 10 IJGE Cc1c(Cl)cccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccn1)CCC2 40814271 KDHIPOLVESUVGC-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE FC(F)(F)c1ccc(N2CCC(OCCBr)CC2)c(Br)c1 129577983 JCMALBPNFPTOHQ-UHFFFAOYSA-N 431.090 4.848 50 10 IJGE N#C/C(=C/NCCc1ccccc1Br)C(=O)Nc1cccc(Cl)c1Cl 217130041 VAKNLICWJYFUPK-QBFSEMIESA-N 439.140 4.934 50 10 IJGE CC(C)(CCBr)CNC(=O)c1cc(Br)ccc1Br 227908349 QKHVGEXGKRXQHY-UHFFFAOYSA-N 441.989 4.753 50 10 IJGE CCC(CC)[C@@H](Br)CNS(=O)(=O)c1ccc(Br)cc1Cl 230664214 LSKBIXQPKWPECO-NSHDSACASA-N 447.620 4.581 50 10 IJGE O=C(NCCCCCCBr)c1cc(Br)ccc1Br 232472496 RNXOQTKMNVDVDV-UHFFFAOYSA-N 441.989 4.897 50 10 IJGE O=S(=O)(Nc1ccc(CBr)cc1)c1ccc(Cl)c(Br)c1 236057150 NOWAQANQXNUBDV-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE CC(=NNC(=O)c1ccc(OCC(=O)N2[C@H](C)CCC[C@H]2C)cc1)c1ccc(Cl)s1 254288360 DSXACJQJAYZSOK-HUUCEWRRSA-N 447.988 4.724 50 10 IJGE O=C(COc1cccc2ccccc12)NN=Cc1ccc(OC(=O)c2ccccc2F)cc1 254305573 JDAARGRHHSQCTK-UHFFFAOYSA-N 442.446 4.727 50 10 IJGE O=C(CNc1cccc2ccccc12)NN=Cc1ccc(OC(=O)c2cccc(F)c2)cc1 254597826 LWFVBJQAZSPCLU-UHFFFAOYSA-N 441.462 4.760 50 10 IJGE CCCCCCOc1ccc(OCCOc2ccc(C=NNC(C)=O)cc2OC)cc1 254614936 IGKMVJSELFCICR-UHFFFAOYSA-N 428.529 4.582 50 10 IJGE CCCCOc1ccc(OCC(=O)NN=Cc2cccc(OCc3ccccc3)c2)cc1 254804150 PGAYBIHWZHRJJS-UHFFFAOYSA-N 432.520 4.974 50 10 IJGE O=C(OCC1c2ccccc2-c2ccccc21)N1CCC(I)CC1 307741870 JSARFTAYMIIGET-UHFFFAOYSA-N 433.289 4.835 50 10 IJGE CC[C@H](Br)c1nnc(-c2cccc(F)c2I)s1 721719686 PRSNVEBHHNILMH-ZETCQYMHSA-N 427.080 4.795 50 10 IJGE CC(=O)N(c1ccc(C)cc1)c1nc(C=NNC(=O)c2cccc(C(F)(F)F)c2)cs1 729933616 LIKRAGDGSCKLIS-UHFFFAOYSA-N 446.454 4.919 50 10 IJGE CCOc1ccc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N[C@H](C)c2cc3ccccc3o2)cc1 744569334 AEUJMKWDDRBQPL-JVCUKQJDSA-N 432.476 4.548 50 10 IJGE O=C(NNc1nc(-c2ccccn2)nc2c1CCC2)c1ccccc1CCc1ccccc1 748338056 CIAFWQHDZCFMNI-UHFFFAOYSA-N 435.531 4.569 50 10 IJGE O=C(NNc1ccc(OCC(F)(F)F)cc1)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 748694039 HWVGFBBHDRFYRC-HUUCEWRRSA-N 434.336 4.773 50 10 IJGE C=CCCC[C@H](NC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)c1ccccc1 1471198931 CBWVFFAFQNSQBL-SFHVURJKSA-N 441.475 4.704 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1)c1ccccc1 1557178500 OTWPEIUVZRUTGP-WNPPMXKSSA-N 439.906 4.515 50 10 IJGE C/C(=C/C(=O)NNc1cc([N+](=O)[O-])ccc1Br)c1ccc(C(F)(F)F)cc1 1611304603 USQDVZVTTWMVPK-NTMALXAHSA-N 444.207 4.923 50 10 IJGE C/C(=C\c1cccc(Cl)c1)C(=O)NNC(=O)COc1ccccc1Cc1ccccc1 1638026395 NMCZLJCWQOGEQX-NBVRZTHBSA-N 434.923 4.561 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2F)CCC3)cc1 1772744621 YSIINXKHPBGRJS-UHFFFAOYSA-N 434.467 4.979 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2)[C@@H]1c1ccccc1C(=O)O 1865704452 WHGLUBQAEDGODH-JOCHJYFZSA-N 448.482 4.515 50 10 IJGE COc1cccc(-c2ccc(C(=O)N/N=C\c3ccc(Br)cc3F)c(C)n2)c1 1865760617 HCVVYDGHWXBATE-MSXFZWOLSA-N 442.288 4.731 50 10 IJGE CCCC[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)C(=O)Nc1ccc(SC#N)cc1 1866939726 MEIOOYFUESTKIG-HBMCJLEFSA-N 425.529 4.816 50 10 IJGE CSCC[C@@H](NC(=O)CCCc1ccccc1C)C(=O)Nc1ccc(SC#N)cc1 1867121243 FHNCHMOJRNRQDQ-OAQYLSRUSA-N 441.622 4.768 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C/c3cc4c(cc3[N+](=O)[O-])OCCO4)n2)cc1C 1872780517 BTRPYHCHRJAHQD-LZYBPNLTSA-N 435.461 4.871 50 10 IJGE COc1ccc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc1OCc1cccc(Cl)c1 1873498436 MGWQHGZGURLEAW-ZMOGYAJESA-N 439.855 4.600 50 10 IJGE CC[C@H]1CN(C(=O)OC(C)(C)C)[C@H](CC)CN1CC(C)(C)CI 1904651435 PMWOVRGYABTUQR-LSDHHAIUSA-N 438.394 4.558 50 10 IJGE C[C@@]1(CI)CC[C@@]2(CN(Cc3ccccc3)C3(CCCC3)C2)O1 1939538442 YHARXRWKDYGNCM-AZUAARDMSA-N 425.354 4.948 50 10 IJGE BrC[C@@H](NCc1c(Br)cccc1Br)C1CCC1 1945331342 XGVYHYHXIVALDL-CYBMUJFWSA-N 425.990 4.865 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@]2(CC[C@H](CI)O2)CC12CCCC2 1990423896 KRHWFUDGLHLXCB-KDOFPFPSSA-N 435.346 4.683 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CC12CCC1(CC2)CC[C@](C)(CI)O1 1996430092 GSEVDOPMWRJWMK-PEKORBKZSA-N 449.373 4.834 50 10 IJGE CC1([C@@H](Br)c2cc(I)cc3c2OCC3)CC(F)C1 2035874499 HBYURPKGERGAKF-IMXVTNBVSA-N 425.079 4.800 50 10 IJGE CC(C)(C)OC(=O)N1[C@H](CO[Si](C)(C)C(C)(C)C)C[C@@H]1CI 2049399010 AFMDYXAIKHJZBT-OLZOCXBDSA-N 441.426 4.821 50 10 IJGE O=C(CBr)c1cc(C(F)(F)F)c(Br)cc1OC(F)(F)F 2054794059 HGLWDYIBQLOGFT-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE C[C@@]1(NC(=O)c2cc(Br)ccc2Br)CCC[C@@H]1Br 2062574706 VEMFEXSRPRFZKI-WCQYABFASA-N 439.973 4.648 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)C(C)(C)C)C[C@H]1C(F)(F)F 2066632824 JWEWQNYNDCPEDB-OLZOCXBDSA-N 431.337 4.527 50 10 IJGE CN(c1ncc(I)cc1Br)[C@@H]1CCCCC[C@H]1Cl 2069528697 LEHVMOYCQVMZBJ-VXGBXAGGSA-N 443.554 4.825 50 10 IJGE CC(C)[C@@H](CCN(C)C(=O)c1ccc(CBr)cc1)NC(=O)OC(C)(C)C 2106647746 WMVCPMWGGCDGII-QGZVFWFLSA-N 427.383 4.593 50 10 IJGE CC(C)(C)[C@@H]1C[C@H](CBr)CN(C(=O)NCCCOCc2ccccc2)C1 2116471420 VBEWFQSBJRLXMS-RTBURBONSA-N 425.411 4.682 50 10 IJGE Brc1ccccc1[C@H](CI)OC[C@@H]1C2C[C@@H]3C1[C@@H]3C2 2134523759 ZOZPKGYYFDPBLG-DVARWVEZSA-N 433.127 4.844 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@@H]1CCCCN1C(=O)[C@@H](Br)C1CCCC1 2143047238 JGJOSLOOHKRNMK-HOTGVXAUSA-N 431.415 4.625 50 10 IJGE CCCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2167031431 IOODMMREARUVKN-ROUUACIJSA-N 445.442 4.968 50 10 IJGE O=C(c1ccc(OCc2ccccc2)cc1)N1CCC(COCCBr)CC1 2167390132 HTMDIAMLLAKPRT-UHFFFAOYSA-N 432.358 4.529 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2OCCN(CCCCCCCCCBr)[C@@H]2C1 2185534912 XLRFJXDPNZOTBF-MOPGFXCFSA-N 447.458 4.822 50 10 IJGE C[C@H](c1nncs1)n1c(CCl)nc2cc(Br)c(Br)cc21 2234072145 NOHFFHMCVDTXCZ-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE Cc1ccc(I)c(C(=O)N2[C@H](CBr)CCC23CCC3)c1 2240905479 KNNWHRDPPHFISJ-LBPRGKRZSA-N 448.142 4.522 50 10 IJGE C[C@@H]1OCC[C@H]1[C@@H](Br)Cc1cc(Br)cc(Br)c1 2252836614 DULUYPRROUIHJF-CKLFPEKLSA-N 426.974 4.943 50 10 IJGE COc1ncc(C(=O)N(Cc2ccccc2)[C@H](CBr)C(C)C)cc1Cl 2259093168 BNGUGPHFIUVPEK-QGZVFWFLSA-N 425.754 4.806 50 10 IJGE CN(C(=O)c1scc(Br)c1Cl)C1(CBr)CCSCC1 2264511384 CTHLEKSSYWVRDK-UHFFFAOYSA-N 447.645 4.897 50 10 IJGE CC1CC(CBr)(CN2CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]2C(F)(F)F)C1 2266273872 OZSLEBLENAWSRQ-DLOXAQCQSA-N 443.348 4.718 50 10 IJGE C=CCC1(CBr)CCN(Cc2ccc(I)cc2)CC1 2272115994 ROGGIBMHZSBCBT-UHFFFAOYSA-N 434.159 4.844 50 10 IJGE CC1(C)C[C@](C)(CCl)CN1C(=O)c1ccc(Cl)c(I)c1 2283651448 HBUJVLMETPPPGP-OAHLLOKOSA-N 426.125 4.814 50 10 IJGE COc1ccc(CCNC(=O)C(C#N)=Cc2cccc(OCc3ccccc3)c2)cc1OC 2297381979 IXNOIUIWBQFVNR-UHFFFAOYSA-N 442.515 4.549 50 10 IJGE C[C@H]1C[C@H](Br)CCN1Cc1ccc(Cl)c(I)c1 2300241383 YKPOEIGGHVDZJG-GXSJLCMTSA-N 428.539 4.692 50 10 IJGE C[C@H](NC(=O)C(C#N)=CNCc1ccc(Br)cc1)c1ccc2c(c1)CCCC2 2325119047 UROOVRHIFHEUEU-INIZCTEOSA-N 438.369 4.702 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3CCC[C@@]3(CNC(=O)OC(C)(C)C)C2)C1 2345004572 MIXPRSJCIREXIO-HRAATJIYSA-N 429.443 4.815 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CN(C[C@@]2(CBr)CC2(F)F)C2CC2)CC1 2351887862 RJJLWFAYDGAKIG-SFHVURJKSA-N 437.369 4.518 50 10 IJGE COc1cc(-c2cc(C(=O)NN=Cc3ccc(F)cc3)n[nH]2)ccc1OCc1ccccc1 2687716 LJYSHADUERCPID-UHFFFAOYSA-N 444.466 4.567 50 10 IJGE O=C(Cc1cccs1)NNC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 25259634 NKKOVPKHHRIFSE-UHFFFAOYSA-N 439.587 4.654 50 10 IJGE CCCOc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(I)cc1C 40948943 SPZRFRBHYNFEBE-FOWTUZBSSA-N 446.288 4.934 50 10 IJGE C[C@H](SCc1ccccc1)C(=O)N/N=C/c1ccccc1OCc1ccc(C(=O)O)cc1 59165677 KYKCQYIWFIUMOB-CMPFEXHJSA-N 448.544 4.736 50 10 IJGE C[C@@H](SCc1ccccc1)C(=O)N/N=C/c1ccccc1OCc1ccc(C(=O)O)cc1 59165678 KYKCQYIWFIUMOB-GTPWMTBTSA-N 448.544 4.736 50 10 IJGE N#C/C(=C\c1cc(Br)cc(Br)c1O)C(=O)Nc1ccc(F)cc1 101512598 AHMBNBJWUVFJJE-BJMVGYQFSA-N 440.066 4.602 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OCc1ccc(Cl)cc1 231317709 QYRMTXHUUCXYLF-MRXNPFEDSA-N 439.721 4.575 50 10 IJGE O=C1COc2ccc([C@H](Cl)c3cc(Br)sc3Br)cc2N1 236039954 SAXMLFWZQJKVCM-LBPRGKRZSA-N 437.540 4.932 50 10 IJGE COc1ccc(C(=O)Oc2ccc3ccccc3c2C=NNC(=O)Cc2ccccc2)cc1 254297213 ZXGPSPIETIQWHV-UHFFFAOYSA-N 438.483 4.760 50 10 IJGE Clc1cc(N2CC[C@H](N3CCN(Cc4ccccc4)CC3)C2)ccc1CBr 380138664 UTVQUHOPLXTKEO-NRFANRHFSA-N 448.836 4.631 50 10 IJGE O=C(OCc1ccccc1)N1C[C@H](CI)[C@H](c2ccc(F)cc2)C1 382709071 WGXAVPCSASKOSJ-WMZOPIPTSA-N 439.268 4.613 50 10 IJGE Cc1ccc([C@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CI)s1 382723987 PCJYJGUYAHIUJS-CVEARBPZSA-N 441.334 4.844 50 10 IJGE BrCC(CBr)(C[C@H]1CCOC1)c1cccc(Br)c1 400528658 GUUNVRHFNJZKAQ-LLVKDONJSA-N 441.001 4.903 50 10 IJGE BrCc1cc(Br)cc(Br)c1O[C@@H]1CCSC1 405384889 KPRJUKDNSAJTPY-SECBINFHSA-N 430.987 4.991 50 10 IJGE Cn1nccc1[C@H]1CCCCN1C(=O)C(=O)Nc1cccc(S(F)(F)(F)(F)F)c1 799274530 SSKVGWOYCDQHJH-OAHLLOKOSA-N 438.422 4.770 50 10 IJGE COc1cccc(C(CSc2nc3ccccc3s2)=NNC(=O)c2cccnc2)c1 1084581023 ABRIBOKGBLYWHO-UHFFFAOYSA-N 434.546 4.626 50 10 IJGE CC(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3ccc(Cl)cc3)nc3ccccc23)c1 1463950575 MVYBELPWDYGRTF-UHFFFAOYSA-N 443.890 4.833 50 10 IJGE CC(=O)c1cccc(NC(=O)CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)c1 1618337698 IGIRPHSJMQALLG-UHFFFAOYSA-N 445.635 4.794 50 10 IJGE C=C1C[C@@H]2CC[C@H](C1)N2C(=O)CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C 1633640359 AFDSGIWJAIQCAM-ZRZAMGCNSA-N 433.668 4.663 50 10 IJGE O=C(CCCOc1ccccc1)N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21 1860823169 VYYAYEKEAJNQCT-COOPMVRXSA-N 447.922 4.566 50 10 IJGE CCCc1nn(-c2cccc(Cl)c2)c2c1[C@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865702115 MXYSIXZBCDQBHL-LJQANCHMSA-N 426.854 4.975 50 10 IJGE N#C/C(=C(/O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2cccc([N+](=O)[O-])c2)cs1 1873941178 ZYAFBVHBGPPYLN-LLWUOSFCSA-N 446.488 4.560 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CC[C@@H]([C@H](CBr)NC(=O)OC(C)(C)C)C1 1880761530 OCWBRWIUAWRKOW-ZNMIVQPWSA-N 435.403 4.606 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCC(C)(C)N(C(=O)OC(C)(C)C)C1 1880762845 YYZUIHNZJKQFMN-KGLIPLIRSA-N 435.403 4.700 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1c(C)cc(F)cc1C 1915078498 QVQRXUQEBUBNQS-QGZVFWFLSA-N 428.367 4.807 50 10 IJGE O=C(N[C@H]1CC[C@H](CBr)C1)c1cc(Br)sc1Br 1942368061 OASPATLSFUJWLE-BQBZGAKWSA-N 446.002 4.567 50 10 IJGE CC(C)(C)OC(=O)N1CCCC2(C1)CC1(CC[C@](C)(CI)O1)C2 1986985102 KRYXZMFYCBEGPF-WWDZGPRUSA-N 435.346 4.540 50 10 IJGE C[C@@H]1CC[C@H](CBr)N(c2ncc(Br)cc2Br)C1 2001930021 RAVYQUHCTIPMGV-PSASIEDQSA-N 426.978 4.606 50 10 IJGE CC1(C)CC[C@@H](CBr)N1c1ncc(Br)cc1Br 2025396948 VDNJHDJWTUICCR-VIFPVBQESA-N 426.978 4.749 50 10 IJGE O=C(Nc1c(Br)cccc1Br)N1CCC(Br)CC1 2043824890 QNXLQUCSBMAYBE-UHFFFAOYSA-N 440.961 4.603 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C[C@@H](CBr)C(C)(C)C)CCC1(F)F 2044695859 HNQUNCYLHRYZNU-KGLIPLIRSA-N 427.374 4.668 50 10 IJGE CCC[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)CC[C@H]1C(F)(F)F 2044698487 CAOIQAALQZCWAO-KGLIPLIRSA-N 431.337 4.671 50 10 IJGE CCC(CC)(CBr)CN(CCN(C)C(=O)OC(C)(C)C)CC(F)(F)F 2044702179 YMRPCVZYTVEFJR-UHFFFAOYSA-N 433.353 4.919 50 10 IJGE O=C(CBr)c1cc(OC(F)(F)F)cc(Br)c1Br 2054921196 HNPDDCWSKLYGJY-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE Cc1oc(C)c(S(=O)(=O)N(Cc2ccccc2)CC2CCC2)c1CBr 2059264126 AOMCGZIHTXHUCC-UHFFFAOYSA-N 426.376 4.782 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2C[C@H]1CCN1Cc1ccccc1 2096782702 JAYSKSGDJRGUHE-MRXNPFEDSA-N 433.781 4.558 50 10 IJGE CCN(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2110714094 AGQXGFCPZKMARN-DLBZAZTESA-N 431.415 4.578 50 10 IJGE CC(C)(C)OC(=O)NC1(C2CCN(C[C@@H](CBr)CC3CC3)CC2)CCC1 2112862959 GBZCWSMIVRKBMR-QGZVFWFLSA-N 429.443 4.957 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1c(Cl)cccc1Br 2113165987 VJUFOTUUCYPZGL-SECBINFHSA-N 429.605 4.739 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@H]1C2C[C@@H]3C1[C@@H]3C2 2134569788 JNXUHLJRJVSLGQ-RCMQJZMTSA-N 431.111 4.564 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)[C@H](CCCl)C(F)(F)F 2142943578 NDOROFBRTYVHNR-LLVKDONJSA-N 426.047 4.936 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CC[C@H](Cl)C(F)(F)CC1 2150038639 HKGDRKNPTQTGOO-JTQLQIEISA-N 431.502 4.690 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@H]1CN(Cc2ccccc2)C[C@@H]1C 2153119541 HMAOYVOWVAZPCR-LIRRHRJNSA-N 447.808 4.977 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@@H](CBr)c2cscn2)cc1Br 2175661608 BJIOLZAAVGHTAT-NSHDSACASA-N 438.572 4.733 50 10 IJGE CN(c1ncc(Br)cc1Br)[C@H](CBr)CC1CC1 2213798421 NSYKUHFOMROMPQ-JTQLQIEISA-N 426.978 4.606 50 10 IJGE C[C@@H]1OCC[C@@H]1[C@@H](Br)Cc1cc(Br)cc(Br)c1 2252836615 DULUYPRROUIHJF-HJIKLVIJSA-N 426.974 4.943 50 10 IJGE C[C@](CBr)(NC(=O)c1scc(Br)c1Cl)C(F)(F)F 2253544815 CLTURTWZGRHOJQ-MRVPVSSYSA-N 429.483 4.610 50 10 IJGE C[C@](CI)(OCc1cccnc1)c1ccccc1Br 2279027999 DYDJTFCPBXWGJH-OAHLLOKOSA-N 432.099 4.711 50 10 IJGE C[C@@H]1CCN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@H]1CBr 2282976697 VZEPKTGWGIFPGK-RKDXNWHRSA-N 427.539 4.735 50 10 IJGE CN(C[C@@H]1CCC[C@@H]1Br)C(=O)c1cc(F)c(Br)cc1Cl 2282979348 YZCVZWAFGBXACJ-WPRPVWTQSA-N 427.539 4.877 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@H](Br)CC12CC2 2282979630 CMRBKYBBLWZLPG-QMMMGPOBSA-N 425.523 4.774 50 10 IJGE CC[C@@H]1[C@@H](Cl)CCN1Cc1ccc(I)c(Br)c1 2306232756 YKJIOVLGCGTUKW-WCQYABFASA-N 428.539 4.645 50 10 IJGE CN(Cc1sccc1I)C1(CBr)CC2(CCC2)C1 2316762814 VEQIWHXFBHSJFK-UHFFFAOYSA-N 440.188 4.882 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC=C(C#N)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 2325205762 PLWDYXJSNAZNEN-AWEZNQCLSA-N 428.876 4.652 50 10 IJGE Cn1nc(C(F)(F)F)c(CBr)c1N(Cc1ccccc1)C[C@@H]1CCCO1 2339775342 JQJQTJJAIUCVJR-AWEZNQCLSA-N 432.284 4.519 50 10 IJGE CC1(C)CC(CBr)(CN2[C@H]3CC[C@@H]2C[C@H](CNC(=O)OC(C)(C)C)C3)C1 2345003832 BJMRJZKLENBPCC-BJWYYQGGSA-N 429.443 4.955 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCCN1C[C@]1(CBr)CC1(F)F 2351886721 CZQFAQABKVBZLE-IIDMSEBBSA-N 437.369 4.661 50 10 IJGE Cc1cc(C(=O)N2CC[C@H](Br)C[C@H]2C(F)(F)F)sc1Br 2361454284 HWAOMOGNPJBVTR-CBAPKCEASA-N 435.103 4.749 50 10 IJGE C[C@@H](Cl)CN(C(=O)c1ccc(Cl)c(I)c1)C1CCCC1 2368842913 BGSXBBWBUPSOKJ-SNVBAGLBSA-N 426.125 4.957 50 10 IJGE CCCCN(CCCC)Cc1ccc(C(=O)NNC(=S)Nc2cc(C)cc(C)c2)o1 4683349 AYPLXECNNARBGQ-UHFFFAOYSA-N 430.618 4.930 50 10 IJGE Nc1c(NNC(=O)c2ccc(Cl)cc2Cl)ncnc1Sc1ccc(Cl)cc1 40723071 NFRMFUCEYCVXAS-UHFFFAOYSA-N 440.743 4.927 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCCc2ccccc2)ccc1OCc1ccc(C)cc1 40869080 HTVWZGCUGXAMQT-JLPGSUDCSA-N 426.516 4.849 50 10 IJGE O=C(N/N=C1/C(=O)N(C(c2ccccc2)c2ccccc2)c2ccccc21)c1ccccc1O 59148691 LJDURAPQQKMCIH-XLVZBRSZSA-N 447.494 4.663 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCCc2ccccc2)cc(Br)c1OC(C)C 96482782 BCITXKCVLBHILG-WQRHYEAKSA-N 443.341 4.511 50 10 IJGE BrCc1c(Oc2cccc(I)c2)nc2sccn12 218203654 AWFWXHNICGUHTE-UHFFFAOYSA-N 435.084 4.688 50 10 IJGE CC(C)(C)C[C@@H](Br)CNS(=O)(=O)c1ccc(Br)cc1Cl 226267057 NBDUZBOJNJXFDC-SNVBAGLBSA-N 447.620 4.581 50 10 IJGE O=C(N[C@@H]1CCC[C@@H]1CBr)c1ccc(Br)cc1Br 231558805 PTRCBDTUAAFXJM-PRHODGIISA-N 439.973 4.505 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(Br)sc2Br)CC[C@H]1Br 235355161 VEAPBBUHMXVCCN-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(CCBr)cc2)c1I 235910007 DZTUQUXXUHZGHQ-UHFFFAOYSA-N 444.110 4.789 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)cc1 254294670 YNIJHGHRBUXSHJ-UHFFFAOYSA-N 438.535 4.544 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2ccc(F)c(Cl)c2)[C@@H](CI)C1 394705328 DVVOWMNCNFMPFC-NWDGAFQWSA-N 439.696 4.865 50 10 IJGE O=C(c1cc(Cl)cc(Br)c1)N1CCC(F)(F)[C@H](CBr)C1 403966816 LYKNHPYTQGDWNK-SECBINFHSA-N 431.502 4.595 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN(c2ncc(Br)cc2Br)C1 688974834 BMVOAMRPBHLTIQ-RKDXNWHRSA-N 426.978 4.606 50 10 IJGE O=C(N[C@@H]1CCC[C@@H](Br)C1)c1ccc(Br)cc1Br 694502443 AHBGBVXIXMSYCG-PSASIEDQSA-N 439.973 4.648 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1Br)c1scc(Br)c1Br 707811809 PQTMEJHTKNJEPA-POYBYMJQSA-N 446.002 4.709 50 10 IJGE Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)NNC(=O)c3cccc4cccnc34)s2)cc1 730913375 GRYAVRDQMMJUAX-INIZCTEOSA-N 445.548 4.680 50 10 IJGE O=C(NNc1c(F)cc(F)cc1Br)c1cc(-c2cccc(Cl)c2)no1 741981846 ZNDRSUWZYQXKHS-UHFFFAOYSA-N 428.620 4.793 50 10 IJGE COc1ccccc1[C@H](NC(=O)NNC(=O)c1ccc(Cl)cc1)c1ccccc1Cl 745842824 ODXKYMPDEHMSGI-HXUWFJFHSA-N 444.318 4.736 50 10 IJGE Cc1cccc(NC(=O)C(=O)NN=Cc2ccccc2OCc2ccccc2Cl)c1C 1084280117 YVQCIIJMHWNJLW-UHFFFAOYSA-N 435.911 4.625 50 10 IJGE C=CCOc1ccc(-n2c(C)cc(C=NNC(=O)CC[C@H](O)c3ccccc3)c2C)cc1 1084638530 NIVFXKFXHSCQGK-VWLOTQADSA-N 431.536 4.623 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)[C@H](C#N)c2ccc3ccccc3n2)c(-c2ccccc2)n1 1341867302 DGPMMSYCYKGXCY-FQWPPLDYSA-N 442.482 4.795 50 10 IJGE C#CCN(C(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C)[C@H]1CCCc2ccccc21 1463010047 TWAWSPJXNKTCJR-LWDDGCSTSA-N 441.575 4.730 50 10 IJGE C=CCC[C@H](NC(=O)NNc1ccc(CC(=O)OC)cc1)c1ccc(C(F)(F)F)cc1 1469490713 FWUZGDICTYDWTQ-IBGZPJMESA-N 435.446 4.755 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cccc(Cl)c2SC(C)C)cc1 1667414573 VAWMVBBIVUAPCE-CQSZACIVSA-N 449.960 4.663 50 10 IJGE CCCc1nn(Cc2ccc(C)cc2)c2c1[C@@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689046 ISOZPIQAVXGSLG-NRFANRHFSA-N 434.927 4.770 50 10 IJGE CCCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1cccn1C)C(C#N)=C(N)O2 1865699062 KBFHAVIVYIUHMP-GOSISDBHSA-N 428.323 4.688 50 10 IJGE Cc1ccccc1COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccn2)cc1 1865702883 HNLXEHIEPQIIBD-VWLOTQADSA-N 449.514 4.681 50 10 IJGE COc1ccc([C@H](CC(=O)N[C@@H](C)C(=O)Nc2ccc(SC#N)cc2)C(C)C)cc1C 1866763086 YWHWCKBEQBCQPD-LAUBAEHRSA-N 439.581 4.850 50 10 IJGE CC[C@H](NC(=O)[C@@H](C)c1ccc(Br)cc1)C(=O)Nc1ccc(SC#N)cc1 1866945150 YRMTYICVWODDDY-UGSOOPFHSA-N 446.370 4.659 50 10 IJGE COc1ccc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc1OCc1ccccc1Cl 1873498291 ASBDZSGJNQYMSZ-ZMOGYAJESA-N 439.855 4.600 50 10 IJGE CC(C)CNCC1(C[C@H]2C[C@H]2Br)C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 1887901877 SUHAIIUCIPODDX-YLOHMFRLSA-N 429.443 4.954 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2[C@H]3CCCO[C@H]32)s1 1900923821 FKMLNWNCUULRNE-KNPZVZKISA-N 433.536 4.867 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)C(=O)c1cc(O)cc(Br)c1 1914231289 AJLMSDODMKKRBL-GFCCVEGCSA-N 427.136 4.581 50 10 IJGE Cc1cnc2c(S(=O)(=O)N(Cc3ccccc3)C(C)(C)CBr)cccc2c1 1915749086 DOLNNQJVSGPHML-UHFFFAOYSA-N 447.398 4.908 50 10 IJGE CCO[C@H](C)C(CBr)(CBr)c1cccc(Br)c1 1941151413 WJSHASMQRCRTAN-SNVBAGLBSA-N 428.990 4.902 50 10 IJGE CC[C@H](C)[C@@H](Br)CNC(=O)c1cc(Br)c(Br)s1 1942802877 HMRCODBNKSTQPO-XPUUQOCRSA-N 448.018 4.813 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1C(=O)c1csc(Br)c1Br 1945186181 CQSHCLRPWQYFCK-RNFRBKRXSA-N 446.002 4.661 50 10 IJGE Cc1ccc(Br)c(CN(C)C[C@H](Br)COCc2ccccc2)n1 1980429323 GYLGUDAQDKFEEQ-INIZCTEOSA-N 442.195 4.565 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)C(=O)Cc1ccc(O)c(Br)c1 1980631748 GQCXXHIYJIJZEC-ZDUSSCGKSA-N 441.163 4.509 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)c1ccc(CBr)cc1Br 2020224305 BPUNCPWUTQCNGY-PHIMTYICSA-N 425.990 4.954 50 10 IJGE CCOC(C)(C)CO[C@H](CI)c1ccc(Br)cc1 2033160530 SJTQAHNPNFJVRO-CYBMUJFWSA-N 427.120 4.757 50 10 IJGE BrC[C@]1(Cc2c(Br)cccc2Br)C[C@@]12CCOC2 2039021405 AIEZIEDMEPGNRM-KGLIPLIRSA-N 438.985 4.946 50 10 IJGE CCCN1C[C@@H](Br)[C@@H](Cc2ccc(Br)cc2Br)C1 2039263713 YFLTUZGHIJHPMJ-SMDDNHRTSA-N 440.017 4.859 50 10 IJGE COc1cc(Cn2nc(CBr)c(Br)c2C(F)(F)F)ccc1F 2079234193 PSTNOFBQFYGGDT-UHFFFAOYSA-N 446.036 4.755 50 10 IJGE BrC[C@]12CCC[C@H]1N(Cc1ccc(I)cc1)CCC2 2108953153 SMHBMOMNRINQNQ-HZPDHXFCSA-N 434.159 4.821 50 10 IJGE CCCOC1([C@@H](Br)c2cc(I)cc3c2OCC3)CC1 2110255730 NVVJKBRLIHRVJK-AWEZNQCLSA-N 437.115 4.621 50 10 IJGE Cn1cc(COc2c(Br)cc(Br)cc2CCl)c(Cl)n1 2111945903 GFNZMBZTYQVHRL-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C(=O)NC2CC(Br)C2)cc1C(F)(F)F 2126741531 YKVBUMZHLRYFGJ-UHFFFAOYSA-N 437.256 4.708 50 10 IJGE CCc1cc(Br)c([C@H](Br)c2cccc(S(C)(=O)=O)c2)s1 2145940476 BKODFJOMQJPFNE-CYBMUJFWSA-N 438.206 4.961 50 10 IJGE CN(C(=O)c1cc(Cl)ccc1I)C1(CCl)CCCCC1 2170169443 RYTCBPBMWNXFJR-UHFFFAOYSA-N 426.125 4.958 50 10 IJGE COc1ncc(Cl)cc1C(=O)N(Cc1ccccc1)[C@@H](CBr)C(C)C 2217962130 XRVQQHPCQQUNKI-KRWDZBQOSA-N 425.754 4.806 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1Cc1cc(Br)ccc1Br 2251042877 VGDHPHOUPFCVSI-QWHCGFSZSA-N 425.990 4.959 50 10 IJGE O=C(N[C@@H](CCBr)C(F)(F)F)c1scc(Br)c1Cl 2253552300 PFWOIESRPOWJFQ-YFKPBYRVSA-N 429.483 4.610 50 10 IJGE C[C@H](Cl)CC(C)(C)CNC(=O)Cc1cc(Br)cc(Br)c1 2295315853 QUCMLQPFVRRFEU-JTQLQIEISA-N 425.592 4.914 50 10 IJGE CCCN(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2351887542 ALCALDJPGPCJQJ-MAUKXSAKSA-N 439.385 4.908 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@](C)(CBr)C(C)(C)C)C[C@H]1C(F)(F)F 2352072650 OJUDENYMBFBDCN-PBFPGSCMSA-N 445.364 4.821 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CCN(C[C@@H](CBr)c3ccccc3)C[C@@H]21 2361359784 DOZGHCKPDULXKU-AQNXPRMDSA-N 437.422 4.887 50 10 IJGE ClCC(CCl)(Cc1ncc(I)cn1)c1ccc(Cl)cc1 2381293863 TVEUCKYVTNJQLX-UHFFFAOYSA-N 441.527 4.693 50 10 IJGE Cc1c(C(=O)N2CCCC[C@@H]2C)oc2c1/C(=N/NC(=O)c1ccccc1Cl)CCC2 40812550 SCZAAMASHUQROM-GYQDZVIGSA-N 427.932 4.726 50 10 IJGE Cc1ccc(Cn2cc(/C=N\NC(=O)CC[C@@H](O)c3ccccc3)c3ccccc32)cc1 58891247 LEQVSTIIVZYWLR-GPMZVODXSA-N 425.532 4.962 50 10 IJGE O=[N+]([O-])c1cc(CBr)ccc1Oc1cccc(I)c1 218203769 QTXIEOAFEVYJTJ-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE C[C@H](Br)CCN(C)C(=O)c1cc(Br)sc1Br 235477029 BDLLYYDGNFLPSI-LURJTMIESA-N 433.991 4.519 50 10 IJGE COC(=O)[C@H](C)[C@@H]1CC[C@@H]2[C@@]34CC[C@@]5(C[C@H](OC(C)=O)CC[C@@]5(C)C3=CC[C@]12C)OO4 254592058 FOTZVCWKWXRZRV-AKZRBYCYSA-N 432.557 4.513 50 10 IJGE O=C(Nc1cccc(F)c1I)c1ccc(CBr)cc1 306009148 RJHKCCCQLBMWRG-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE Cc1cc(C)c(C(=O)CCCC(=O)NNc2nc(-c3cccnc3)nc(C)c2C)c(C)c1 736693608 MWEZDPYYJOOPBD-UHFFFAOYSA-N 431.540 4.577 50 10 IJGE Cn1nccc1[C@H]1CCCCN1S(=O)(=O)c1cccc(S(F)(F)(F)(F)F)c1 798473407 HYFIGJTZKGBHTH-OAHLLOKOSA-N 431.452 4.993 50 10 IJGE Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@H](c1ccc(C(C)C)cc1)c1cccs1 913627854 CGGSGZKDLKIDQW-OAQYLSRUSA-N 447.564 4.561 50 10 IJGE Cc1oc(-n2c(C)cc(C=NNC(=O)c3ccccc3Br)c2C)c(C#N)c1C 1084333646 MYBQNWQXVJKPEO-UHFFFAOYSA-N 439.313 4.702 50 10 IJGE CCOc1cc(C=NNC(N)=O)cc(Br)c1OCc1cccc2ccccc12 1084496179 NTHOFSRQWMUWTC-UHFFFAOYSA-N 442.313 4.582 50 10 IJGE C#CC[C@@H](NC(=O)NNc1cc(C(F)(F)F)ccc1Br)c1ccccc1 1469448793 WDSNXLKVPURFGL-OAHLLOKOSA-N 426.236 4.859 50 10 IJGE CCCOc1ccc(/C=N\NC(=O)c2ccc(-c3ccc(OC)cc3)nc2C)cc1OC 1865762296 YKVFYVCWFLDGNY-QQXSKIMKSA-N 433.508 4.627 50 10 IJGE Cc1ccccc1-c1nc(CC(=O)NC(C)(C)C(=O)Nc2ccc(SC#N)cc2)c(C)o1 1866645023 XHZUPLJNUUAMAS-UHFFFAOYSA-N 448.548 4.608 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC(CC1CC1)CC1CC1 1899317299 AHXBUJOXZJIWPP-SFHVURJKSA-N 437.362 4.690 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@@H](CCl)C2(CCC2)C1 1914494996 YJUCHKFLHJBJNH-MRVPVSSYSA-N 427.589 4.754 50 10 IJGE C[C@H]1OCC[C@]1(CBr)Cc1c(Br)cccc1Br 1945331054 PPWCAOFRXFSCQQ-NOZJJQNGSA-N 426.974 4.944 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@H](CBr)C2CCC2)CC[C@H]1C(F)(F)F 1966375849 YVOBXVUMXPSYFC-RRFJBIMHSA-N 443.348 4.575 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1sccc1Br 2006105758 WTWVVNQJGXOVHU-SECBINFHSA-N 430.149 4.624 50 10 IJGE O=C(NC1(CBr)CCCC1)c1cccc(Br)c1Br 2031487757 YHPIWYFKDJOCHX-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE C[C@@H]1CN(Cc2cc(Cl)ccc2I)[C@H](C)C[C@H]1Br 2032205026 VZCRQCQLVGHMSV-GIPNMCIBSA-N 442.566 4.938 50 10 IJGE O=C(CBr)c1ccc(OC(F)(F)F)c(Br)c1OC(F)F 2054834760 RHEDTNNSPRLYOA-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE O=S(=O)(c1cc(CBr)ccc1F)N(Cc1ccccc1)CC1CCC1 2059264604 HXUMCDOPHVLQEN-UHFFFAOYSA-N 426.351 4.712 50 10 IJGE Clc1cc(CN2CCC3(CC(Br)C3)C2)ccc1I 2086656160 UBLOQBZVUJIPPL-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE C[C@@H]1CCN(C[C@@H](CBr)c2ccccc2)[C@H](CNC(=O)OC(C)(C)C)C1 2106783321 ZAFIGGFRNDOXRH-QRQLOZEOSA-N 425.411 4.790 50 10 IJGE CC(C)[C@H](CBr)CN1CC[C@H](C(F)(F)F)C[C@H]1CNC(=O)OC(C)(C)C 2107584926 NYTWBLDNRSSMGB-ILXRZTDVSA-N 445.364 4.821 50 10 IJGE Cc1sc(Br)c(C(=O)N(C)C2(CBr)CCSCC2)c1C 2171183054 WOUAODMHZAHCGE-UHFFFAOYSA-N 441.254 4.860 50 10 IJGE C[C@@]1(CC(CBr)(CBr)c2ccc(F)cc2)CSCCO1 2201228220 PMJRQCUVFBWYGN-CQSZACIVSA-N 426.189 4.766 50 10 IJGE BrC1CCC2(CCCN2C[C@@H]2CC2(Br)Br)CC1 2213088592 QDDYWVLUKHRCAC-UNXYVOJBSA-N 430.022 4.665 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CCC[C@]23CCC[C@H](CI)O3)C1 2213354083 IOGQEPVWFYEKHH-NNFUDEMPSA-N 449.373 4.786 50 10 IJGE CO[C@H]1C[C@@H](CO[C@](C)(CI)c2ccccc2Br)C1 2230050611 UHOXTQKETWMMDK-TYNCELHUSA-N 439.131 4.541 50 10 IJGE Cc1sc(C(=O)N(C)C2(CBr)CCSCC2)c(C)c1Br 2234480620 VNZMFPHDPXXPII-UHFFFAOYSA-N 441.254 4.860 50 10 IJGE C[C@@H](CC1CCN(CCCCI)CC1)N(C)C(=O)OC(C)(C)C 2243589006 JEMDBWHPCIMJEI-HNNXBMFYSA-N 438.394 4.559 50 10 IJGE COc1ccc([C@@H](Br)C2(OC)CC(C)C2)cc1I 2257355754 PZWFNPWFAQRQRW-JRZRUSQNSA-N 425.104 4.551 50 10 IJGE CCN(C[C@](C)(CBr)OC1(C2CCCCC2)COC1)C(=O)OC(C)(C)C 2272935777 SSFJPNRGYXSFIE-IBGZPJMESA-N 434.415 4.763 50 10 IJGE C=CC[C@@](C)(CBr)CNC(=O)c1cc(Br)c(F)cc1Cl 2285836854 GWIYGRZNSNTZCF-AWEZNQCLSA-N 427.539 4.949 50 10 IJGE CO[C@H]1C[C@@H]([C@H](Cl)Cc2cc(Br)cc(Br)c2)C[C@H]1OC 2295332507 XSMUUHUUSDRZCL-QPKOPYBWSA-N 426.576 4.802 50 10 IJGE CCCOc1ccc(C=C(NC(=O)c2ccccc2)C(=O)NN=Cc2ccccc2F)cc1 2296734178 MTCCMWWZFNYQNP-UHFFFAOYSA-N 445.494 4.536 50 10 IJGE C=CC[C@H](Br)[C@H]1CCN1Cc1ccc(Cl)cc1I 2318537954 GTOWVZCLNCFOQS-GXTWGEPZSA-N 440.550 4.859 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4)[nH]c3c2)cc1[N+](=O)[O-] 2323745006 WOMGDAILEVKMSW-UHFFFAOYSA-N 443.463 4.691 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)C(C#N)=CNc1ccc(Cl)cc1C(F)(F)F 2324431295 VGCCNFFODYQPNF-UHFFFAOYSA-N 437.805 4.994 50 10 IJGE Cl[C@@H]1CCN(Cc2ccc(I)c(Br)c2)[C@H]2CC[C@@H]21 2325210326 XBDHHWMVJJIKLD-QKCSRTOESA-N 440.550 4.645 50 10 IJGE CCCc1sc(Br)cc1[C@H](Br)[C@@H]1CCCS(=O)(=O)C1 2338024620 WNQDXYQMRGDBDC-NOZJJQNGSA-N 430.227 4.724 50 10 IJGE CCCOc1ccccc1/C=C/C(=O)Oc1ccc(/C=C(\C#N)C(=O)OCC)cc1OC 40950441 DUMYQQCULOEPIX-PZBCRXGTSA-N 435.476 4.573 50 10 IJGE Cn1ccnc1COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 98008583 JETIMQJVSCPBNV-GDNBJRDFSA-N 427.291 4.852 50 10 IJGE CCS(=O)(=O)CCCC(CBr)(CBr)c1cccc(Cl)c1 118878147 JAHLWRLPIHOKQB-UHFFFAOYSA-N 446.632 4.583 50 10 IJGE CN(C)c1ccc(P(c2ccc(N(C)C)cc2)c2ccccc2-c2ccccc2O)cc1 140702005 RNEMMDNAQFODPP-UHFFFAOYSA-N 440.527 4.949 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)NCc2ccco2)ccc1OC(=O)/C=C\c1ccccc1 206681404 AGHMINXCIRTTDA-BGVZQIFQSA-N 442.471 4.520 50 10 IJGE Fc1ccc([C@@H](Br)c2ccc3c(c2)OCCO3)c(I)c1 236186214 HGQBLAJZUQDRBX-HNNXBMFYSA-N 449.057 4.686 50 10 IJGE O=C(/C=C/c1ccco1)Oc1cccc(C=NNC(=O)c2cc3ccccc3cc2O)c1 254822782 MDFRDBCJVGIHGA-DTOSGJEGSA-N 426.428 4.521 50 10 IJGE FC(F)Oc1cc(CBr)cc(I)c1Br 575682084 JDGGJZCEOQCGBV-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE BrCc1cc(Br)c(OCCOCC2CC2)c(Br)c1 690409479 OAGUXUOGULNHDV-UHFFFAOYSA-N 442.973 4.912 50 10 IJGE CN(OCc1ccccc1)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 749137590 FBZFOCOIQIOLSQ-XSFVSMFZSA-N 445.910 4.614 50 10 IJGE Cc1cc(OCc2ccccc2)ccc1NC(=O)NNC(=O)c1cccc2cccnc12 756613132 XWKFNNJDTYNBJO-UHFFFAOYSA-N 426.476 4.589 50 10 IJGE O=C(CCCc1ccccc1)NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21 1084230532 NVEOCKBOKRTTSD-UHFFFAOYSA-N 431.923 4.730 50 10 IJGE O=C(O)c1ccc(COc2ccccc2C=NNC(=O)c2cc3ccccc3cc2O)cc1 1084570530 MQAQVGZWKZPEQI-UHFFFAOYSA-N 440.455 4.587 50 10 IJGE CC(=NNC(=O)Cn1c(C(F)(F)F)nc2ccccc21)c1ccc(Cl)c(Cl)c1 1084578379 VUBLXLWNEUCSAI-UHFFFAOYSA-N 429.229 4.902 50 10 IJGE C#Cc1cccc(N(Cc2ccccc2)C(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)c1 1125843006 VMNZHJGQEOORMG-NLRVBDNBSA-N 437.543 4.873 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNc2cncc(Br)c2)cc1 1295839054 DFDPYIVPZDLRMS-UHFFFAOYSA-N 425.286 4.547 50 10 IJGE CC(=O)c1ccc(Br)c(NC(=O)NNc2cc(F)ccc2Br)c1 1674418301 LDHBSJJUEKRWIL-UHFFFAOYSA-N 445.086 4.702 50 10 IJGE Cc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)N3CCCc4ccccc43)c(C)c21 1772743637 HJFJEQQNQFBBHA-UHFFFAOYSA-N 441.531 4.960 50 10 IJGE CCc1nn(CC(C)C)c2c1[C@H](c1ccc(OC(=O)c3ccccc3)cc1)C(C#N)=C(N)O2 1865704990 JTZQLBDUQSESOS-JOCHJYFZSA-N 442.519 4.539 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2cccc(F)c2)cc1 1865709195 QUYGSIOGFHUQLR-SFHVURJKSA-N 442.416 4.870 50 10 IJGE Cc1ccc(OCCCC(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3)nc2C)cc1 1865755835 SFIWVEMEOJZERD-UHFFFAOYSA-N 437.927 4.639 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)N/N=C\c1c(Cl)nc2scc(C)n12 1865762105 NUDBFMHHIZSGDC-GYRAYZOKSA-N 445.882 4.770 50 10 IJGE COc1ccc([C@@H](C(=O)NC(C)(C)C(=O)Nc2ccc(SC#N)cc2)C(C)C)cc1 1866982927 LWQIZMAIGKCFOE-FQEVSTJZSA-N 425.554 4.541 50 10 IJGE Brc1cccnc1C[C@@H](Br)c1ncsc1Br 1924866218 TXTPJEFYQHGETK-SSDOTTSWSA-N 426.959 4.742 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(O)c(Br)c1 1961198451 FIKAZCMEYFFNBH-GFCCVEGCSA-N 427.136 4.581 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)c1ccc(NC(=O)OC(C)(C)C)c(Cl)c1 2076216516 RINBKNZBUCGLTI-BJHJDKERSA-N 431.758 4.933 50 10 IJGE ClCc1nc2cncc(Br)c2n1-c1ccc(I)cc1 2095438554 XPVLXMNYRAGBOL-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE BrC[C@@H]1CN(Cc2ccc(I)cc2)CC12CCCC2 2118604343 RQDLHTUERBKXRO-CQSZACIVSA-N 434.159 4.678 50 10 IJGE C[C@H](N(Cc1ccccc1)S(=O)(=O)N1CCC[C@@H](CCBr)C1)C(C)(C)C 2123368098 BDDQILOQNQLOKJ-HKUYNNGSSA-N 445.467 4.665 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CC[C@@H](CCl)C(F)(F)C1 2146382432 HKFHKRVIRYNKFU-VIFPVBQESA-N 431.502 4.548 50 10 IJGE CCC[C@H]1CCCN(S(=O)(=O)c2cc(CBr)sc2Br)C1 2179792183 CLPLSJFCOOWEJC-JTQLQIEISA-N 445.242 4.606 50 10 IJGE N#C[C@@H]1CN(c2ccc(C(F)(F)F)c(CBr)c2)CCN1Cc1ccccc1 2181261152 QUHJBQHKWLZJJZ-GOSISDBHSA-N 438.291 4.815 50 10 IJGE FC(F)(F)c1ccccc1CO[C@@H](CCl)[C@@H](I)CCl 2227755177 SRGJJIQGKAQDMO-QWRGUYRKSA-N 427.031 4.872 50 10 IJGE Cc1cc(Br)c(C(=O)NCC2(F)CCC(CBr)CC2)s1 2237613005 XLSSCSGOWQWRGI-UHFFFAOYSA-N 427.177 4.842 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2CCCCS2(=O)=O)c(Br)c1Cl 2283561111 FKCKLBJFSNYCMC-GHMZBOCLSA-N 446.588 4.514 50 10 IJGE Cc1ccc(C(C)C)c(OCC(=O)NN=Cc2cccc(OC(=O)C=Cc3ccco3)c2)c1 2297708380 AWZIMOVKZOAASM-UHFFFAOYSA-N 446.503 4.859 50 10 IJGE CCC[C@](C)(CCl)NCc1ccc(I)c(Br)c1 2306223698 IKEZUMUSZKQLOO-CYBMUJFWSA-N 430.555 4.941 50 10 IJGE CC[C@H](C)N1C(=O)C(=Cc2ccc(OCc3ccccc3F)c(OC)c2)C(C)=C(C#N)C1=O 2314610822 MRWNDAGWSXQUNC-INIZCTEOSA-N 448.494 4.804 50 10 IJGE CCOc1ccc(C=CC(=O)Oc2ccc(C=C(C#N)C(=O)NCc3ccco3)cc2)cc1 2314754311 PCPCVOXRJADKQN-UHFFFAOYSA-N 442.471 4.520 50 10 IJGE CC1(C)C[C@H](CBr)N(Cc2ccc(Cl)c(I)c2)C1 2315553904 YPPVESWAHHRTKC-LLVKDONJSA-N 442.566 4.940 50 10 IJGE CCSc1ccc(Cl)cc1CC(=O)NN=Cc1ccc(OC)c(OC)c1Cl 2323681522 WKLJWBWUWHEXOF-UHFFFAOYSA-N 427.353 4.815 50 10 IJGE ClC[C@@H]1CCC[C@H](NCc2ccc(I)c(Br)c2)C1 2325212609 PNWDULMKGUQMPU-PWSUYJOCSA-N 442.566 4.941 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2C[C@H](Br)C[C@H]2C1 2327407180 PGTATQRPRDENLK-IAZYJMLFSA-N 440.550 4.550 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1cc(F)c(F)c(OC)c1F 2336103411 DRJHPUQSPFICBY-ZDUSSCGKSA-N 430.264 4.928 50 10 IJGE O=C(N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(NC(=O)C2CCCCC2)cc1 12487516 JWKKLAPRCWCPGD-YDZHTSKRSA-N 428.876 4.531 50 10 IJGE Cc1cc(C)cc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2O)CCC3)c1 40826340 JRBDZPJDICYDCG-LGUFXXKBSA-N 432.476 4.600 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2ccccc2OCc2ccccc2)cc1 58895421 SRPRDUGOKFQMAX-RNHXXFPGSA-N 432.520 4.628 50 10 IJGE C#CCOc1ccc(/C=N/NC(=O)c2cc3cc(Br)ccc3o2)cc1CC=C 59303577 NCFBVVKJWACBOL-ZVHZXABRSA-N 437.293 4.700 50 10 IJGE COc1c(C(=O)CBr)ccc2c1OC(c1ccccc1)(c1ccccc1)O2 205290966 YDUUWMKGCNTCTB-UHFFFAOYSA-N 425.278 4.945 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)/C=C\c4ccc(C)cc4)ccc32)cc1 205641800 HVZZNDHFWRXIOK-GUAXOKFESA-N 438.483 4.841 50 10 IJGE CC(=O)N(c1ccccc1)c1nc(/C=C(\C#N)c2nnc(-c3ccccc3)n2C)cs1 210592373 ZHDCZTJBTYGURA-QGOAFFKASA-N 426.505 4.687 50 10 IJGE CCOC(=O)c1ccccc1N/C=C(/C#N)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 217249065 WRRFBFQJLLQCBQ-QXMHVHEDSA-N 437.805 4.994 50 10 IJGE CCC(CC)COC1(CI)CCN(C(=O)OC(C)(C)C)CC1 300769089 ZATORUWJEHDIAR-UHFFFAOYSA-N 425.351 4.644 50 10 IJGE CC(C)(C)Cc1nc(-c2ccc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)cc2)no1 799753601 JNMBIFHGUGOHNO-UHFFFAOYSA-N 443.429 4.973 50 10 IJGE Cc1cc(/C=C(/C#N)c2nnc(-c3cccc4cccnc34)o2)c(C)n1C[C@@H]1CCCO1 1345866147 BGUFHXCWSKKYKX-MSTPFNHUSA-N 425.492 4.946 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2cc3oc(O)nc3cc2F)c(C)n1-c1ccccc1F 1629001028 RRXNMMZKVPBANG-OVCLIPMQSA-N 434.402 4.765 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(OC)cc2)cc1 1865692017 HJGVBFPCTSUYSX-QHCPKHFHSA-N 430.508 4.586 50 10 IJGE CCCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3CC(C)C)cc1OC 1865695681 GIYKPAVGFASJLW-JOCHJYFZSA-N 438.572 4.897 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2cccc(Cl)c2)[C@H]1c1ccncc1 1865699750 BMWOHFXGDMTJTK-NRFANRHFSA-N 439.906 4.865 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2-c1ccc(OC)cc1 1865704612 ZYDDPGGCLDJHDD-HSZRJFAPSA-N 444.535 4.840 50 10 IJGE CC1(C)C[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)CN(C(=O)OC(C)(C)C)C1 1880760551 HLZQJGQNYXHUOL-UONOGXRCSA-N 435.403 4.558 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)CCC[C@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1881164029 DEGRLXIRGIMRAB-RBSFLKMASA-N 435.403 4.558 50 10 IJGE O=S(=O)(c1cscc1Br)N(Cc1ccccc1)[C@@H](CCl)C1CC1 1915153472 VAKHSLCPWQSSIH-HNNXBMFYSA-N 434.808 4.719 50 10 IJGE O=C(c1ccc(I)cc1)N(Cc1ccccc1)[C@@H](CCl)C1CC1 1915207817 LBIPXOWHXMAAQP-SFHVURJKSA-N 439.724 4.951 50 10 IJGE O=C(N[C@@H](CBr)CC1CC1)c1cccc(Br)c1Br 2031482738 WFWQYMQTOXFXIA-SECBINFHSA-N 439.973 4.505 50 10 IJGE O=C1Cc2cc([C@H](Br)C3CC(Br)C3)c(Br)cc2N1 2076167152 IULSZLBEDARHRU-KTRLOWJHSA-N 437.957 4.553 50 10 IJGE C[C@H](NC(=O)N1CCC(Br)CC1)c1ccc(NC(=O)OC(C)(C)C)cc1 2106196129 UFXYYSAAAPYJSO-ZDUSSCGKSA-N 426.355 4.664 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](CN(C[C@H](CBr)C2CCC2)C2CC2)C1 2106784031 FKKBNJFMZZZTPF-AEFFLSMTSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CCCN(C[C@@H](CBr)C3CCC3)C2)C1 2106784710 KPPHQYQFAOHADQ-WIYYLYMNSA-N 429.443 4.911 50 10 IJGE CCCN(C(=O)[C@H](Br)C1CCCC1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2110716092 UHMFMXYWPHWEOX-IAGOWNOFSA-N 431.415 4.578 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@H]2CCCCN(C[C@H](CBr)CC3CC3)C2)C1 2112862130 ALYSOJNUSMAKAK-ROUUACIJSA-N 429.443 4.767 50 10 IJGE CC(C)(C)[C@@H]1C[C@@H](CBr)CN(C(=O)NCCCOCc2ccccc2)C1 2116471418 VBEWFQSBJRLXMS-RBUKOAKNSA-N 425.411 4.682 50 10 IJGE CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1CCBr 2123255610 YLVLLXAXNHAMQD-INIZCTEOSA-N 440.403 4.622 50 10 IJGE CC(C)[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)n(C2CC2)c1 2123267594 ACIPQGXELPZUJC-MRXNPFEDSA-N 439.419 4.953 50 10 IJGE Cc1c(Br)ccc([C@@H](Cl)[C@@H]2CCCS(=O)(=O)C2)c1Br 2138873142 WMJUJEBXOKNGFC-RNCFNFMXSA-N 430.589 4.625 50 10 IJGE Cc1cc(Br)c(C(=O)N2CCC[C@](F)(CBr)C2)cc1Cl 2157508466 CQZVYLWWGUXIPM-AWEZNQCLSA-N 427.539 4.750 50 10 IJGE CN(C(=O)c1cc(Cl)cc(Br)c1)C1(CBr)CCSCC1 2171181414 FATZGWMWABSONP-UHFFFAOYSA-N 441.616 4.835 50 10 IJGE CN(c1ncc(Br)cc1C(F)(F)F)[C@H](CCBr)C(F)F 2178514881 GZPHEDFFNNSJNB-MRVPVSSYSA-N 426.021 4.718 50 10 IJGE C[C@@H](CCCl)N(Cc1ccccc1)S(=O)(=O)Cc1ccccc1Br 2213761119 QKVYCRZIDPUKFU-HNNXBMFYSA-N 430.795 4.799 50 10 IJGE Fc1ccc([C@@H](CI)O[C@@H]2CCN(Cc3ccccc3)C2)cc1 2244800348 LYLOIEAXECLVRO-RTBURBONSA-N 425.285 4.593 50 10 IJGE COc1cc(C=C2C(=O)N(C3CCCC3)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1 2314617021 PCZOOXSHFAIDLF-UHFFFAOYSA-N 442.515 4.809 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)cc2I)CC[C@H]1CBr 2318556791 DTBJFJGMSLVYCP-MNOVXSKESA-N 442.566 4.798 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1csc(C(F)(F)F)c1 2320359747 BFRXHFIRXQLXIC-AWEZNQCLSA-N 436.293 4.867 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=CNc2ccc(Cl)c(C(F)(F)F)c2)cc1 2324332836 TVPHEILOLXBGMJ-UHFFFAOYSA-N 437.805 4.994 50 10 IJGE ClCc1c(Cl)ncnc1OCc1c(Br)cccc1Br 2340637311 RGYKMAZCLSZDAN-UHFFFAOYSA-N 426.923 4.973 50 10 IJGE CCC[C@H](CBr)CN1C[C@@H]2CC(F)(F)CC[C@]2(NC(=O)OC(C)(C)C)C1 2344075184 CZZAEILPEZCQDD-VKJFTORMSA-N 439.385 4.812 50 10 IJGE COc1cccc(CN(C(=O)CCl)[C@@H](C(=O)NC2CCCCC2)c2ccc(F)cc2)c1 3037404 HCIUOMKZQDFDKQ-HSZRJFAPSA-N 446.950 4.592 50 10 IJGE COc1cccc(OCC(=O)Oc2cccc(/C=C(/C#N)c3ccc(OC)c(OC)c3)c2)c1 31902938 HSZADZDRWQPHKG-NDENLUEZSA-N 445.471 4.761 50 10 IJGE Cc1cccn2c(=O)c(/C=C(/C#N)c3nc4ccccc4s3)c(N3CCC(C)CC3)nc12 35145705 AJHMKUJCFBEHCI-JXAWBTAJSA-N 441.560 4.913 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(OC)c4)ccc32)c1 38684841 ATUVKQFSHLGTBN-XMMPIXPASA-N 442.471 4.531 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccc(Cl)c2)CCC3)n1 40813378 VJLVCBWCXOTFSM-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE O=C(N/N=C1\C(=O)N(Cc2c(Cl)cccc2Cl)c2ccccc21)c1cccc(F)c1 59471814 PTXYZERMDCWBLG-QOMWVZHYSA-N 442.277 4.813 50 10 IJGE C=CCOc1ccc(/C=C2/C(=O)N([C@@H](C)c3ccccc3)C(=O)C(C#N)=C2C)cc1OC 101305599 CMTAYPOMKLLXSE-SXZORUHJSA-N 428.488 4.613 50 10 IJGE COc1cc(/C=C2/C(=O)N(CCc3ccccc3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 101338291 YXWDDGRSWADDAL-HYARGMPZSA-N 444.531 4.565 50 10 IJGE CCCOc1ccc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)cc1[N+](=O)[O-] 169891379 OXIZKCAUUKREEH-XFRWHIHTSA-N 434.496 4.754 50 10 IJGE CCOc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4)nc3c2)cc1OCC 169926872 ODIMOIGHKAUAAI-WGOQTCKBSA-N 428.492 4.791 50 10 IJGE CCCOc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4)nc3c2)cc1[N+](=O)[O-] 169926930 WOMGDAILEVKMSW-MFKUBSTISA-N 443.463 4.691 50 10 IJGE CCCCCCCOc1ccc(/C=C2\C(=O)N(C[C@@H]3CCCO3)C(=O)C(C#N)=C2C)cc1 214329774 AFNGADLKZWDVLB-NRPPHEFGSA-N 436.552 4.807 50 10 IJGE CCc1cccc(CC)c1NC(=O)/C(C#N)=C\NCCc1ccc(Br)cc1 217209342 WASLXTDWCDWVSB-CYVLTUHYSA-N 426.358 4.752 50 10 IJGE CCOc1cc(C=NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OCc1ccc(C)cc1 252597279 CRCWFYFMKMSQLD-UHFFFAOYSA-N 433.464 4.645 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)NN=Cc2cccc(OC(=O)/C=C/c3ccco3)c2)cc1 254866352 HAVLQWQTBKFWRZ-SNSRCWGTSA-N 446.503 4.725 50 10 IJGE BrCc1cc(Br)c(O[C@@H]2CCSC2)c(Br)c1 405344892 FQMBYHDBCZQCHY-MRVPVSSYSA-N 430.987 4.991 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1cccc([C@H]2CCc3ccccc3N2S(N)(=O)=O)c1 616592570 CFBVJXANXAREQN-OAQYLSRUSA-N 432.662 4.906 50 10 IJGE C[C@H]1CN(Cc2cc(Cl)ccc2I)C[C@H](C)C1Br 688069816 DBWNWAVUPLLCCI-UWVGGRQHSA-N 442.566 4.796 50 10 IJGE CC(CBr)(CBr)NC(=O)c1c(Cl)cccc1C(F)(F)F 712552406 DOSBOPOEDDDJSF-UHFFFAOYSA-N 437.481 4.637 50 10 IJGE O=C(NNc1cnnc2ccccc12)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 733811661 JZLWUCNWIPONCP-UHFFFAOYSA-N 440.438 4.606 50 10 IJGE Cc1ccc(NC(=O)NNC(=O)c2ccc(NC(=O)c3cccs3)c(C)c2)c(Cl)c1 802050184 QJTMVJBJFWZAPI-UHFFFAOYSA-N 442.928 4.737 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OCc2cc(-c3ccccc3)no2)c(-c2ccccc2)n1 808433260 FXYORFLNZYVZMD-STZFKDTASA-N 449.470 4.769 50 10 IJGE CN(Cc1c(F)cccc1Cl)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 914462909 HUUPOYSCVKZXAS-AQTBWJFISA-N 447.901 4.822 50 10 IJGE O=C(COc1ccc(Br)cc1Cl)NN=Cc1c(Cl)cccc1Cl 1084591160 YBZJLTCRKOLENM-UHFFFAOYSA-N 436.520 4.938 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCc3cc4ccccc4nc3O)c2C)cc1 1440211763 OOETXAIOGCWCGP-HYARGMPZSA-N 436.515 4.880 50 10 IJGE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NNc1ncc(Br)cc1C 1451965044 GMQXCNSTVFCFKI-YRNVUSSQSA-N 430.224 4.598 50 10 IJGE C=C(C)[C@H](NC(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1)c1ccc(F)c(F)c1 1680280758 PTPJTTDKYXMYEI-QRQCRPRQSA-N 439.462 4.533 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2)c1 1865689662 CDDUTAKHYNECOR-KRWDZBQOSA-N 426.398 4.508 50 10 IJGE Cc1ccc(-c2csc(/C(C#N)=C(\O)CCN3C(=O)c4ccccc4C3=O)n2)c(C)c1 1872748822 PEGWZNPADINFNB-VZCXRCSSSA-N 429.501 4.906 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)c1c(F)ccc(NC(=O)OC(C)(C)C)c1F 1887824074 VSPYQHNOJGLZNF-PHIMTYICSA-N 433.293 4.557 50 10 IJGE CN(CC1CN(C(=O)OCc2ccccc2)C1)C[C@@](C)(CBr)C(C)(C)C 1904846775 YWHIYUAJBXZYSB-OAQYLSRUSA-N 425.411 4.634 50 10 IJGE O=C(c1ncccc1Br)N(Cc1ccccc1)C1(CBr)CCC1 1915740388 FGBHFWJFZZDOBY-UHFFFAOYSA-N 438.163 4.804 50 10 IJGE O=S(=O)(c1cscc1Br)N(Cc1ccccc1)C1(CCl)CCC1 1915769113 ZBPIJIMSDHQQHG-UHFFFAOYSA-N 434.808 4.863 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CC[C@@H]2C[C@H]2C1)C(=O)OC(C)(C)C 1917418956 CNVKOIXZDYYZHY-FSZRXZPDSA-N 437.362 4.642 50 10 IJGE BrC[C@H](NCc1ccc(Br)cc1Br)C1CCC1 1943850647 RIHJHXOKRMHDFK-ZDUSSCGKSA-N 425.990 4.865 50 10 IJGE CC1(C)C[C@@H](Br)CN1C(=O)c1cc(Br)sc1Br 1949214331 HYEQGDWCSUBLMJ-ZCFIWIBFSA-N 446.002 4.661 50 10 IJGE CC(C)[C@H](Br)[C@H](C)NC(=O)c1cc(Br)cc(Br)c1 2041309212 YKUSESNSTMLMFM-UFBFGSQYSA-N 441.989 4.749 50 10 IJGE CCn1nnc(Br)c1C[C@@H](Br)c1cccc(Br)c1 2050572092 QSUGNOWUQYISFP-SNVBAGLBSA-N 437.961 4.502 50 10 IJGE ClC[C@H]1CCC[C@H](CNc2ncc(I)cc2Br)C1 2069526478 WJNPWYNOZZPUMF-UWVGGRQHSA-N 443.554 4.906 50 10 IJGE CCCCCC[C@H]1[C@@H](CCCCCC)C=C2[C@@]3(C)CC4=C(C(=O)OC4=O)[C@@H]1[C@@]2(O)OC3=O 2080449538 MOBNKYGKVWHWSM-OFGXFFMQSA-N 444.568 4.751 50 10 IJGE Clc1cccc(C(CBr)(CBr)C[C@@H]2COCCCO2)c1 2154014501 UDTDLONZUZCNMH-CQSZACIVSA-N 426.576 4.563 50 10 IJGE O=C(N1CCC[C@@H]([C@H]2CCCCN2CC2(CBr)CCCC2)C1)C(F)(F)F 2163064102 SONMOPHCHVLDGL-HZPDHXFCSA-N 439.360 4.597 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@H](CBr)c2ccccc2)C2(CCC2)C1 2174539779 HVOZCPOLNFCGBC-MJGOQNOKSA-N 437.422 4.934 50 10 IJGE CCC1CCC(CBr)(OCCOCCOCCOCc2ccccc2)CC1 2236088646 JTQQLWMYWHUTFV-UHFFFAOYSA-N 443.422 4.987 50 10 IJGE O=C(c1scc(Br)c1Cl)N1[C@H]2CC[C@H]1CC(CBr)C2 2264504044 LRCLMHRBJZDFLT-IUCAKERBSA-N 427.589 4.942 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](C)OC2(C1)CN(C(=O)OC(C)(C)C)C2 2288472678 SDEQDRZBXJRLQY-QGZVFWFLSA-N 447.458 4.678 50 10 IJGE Cc1cccc(NC(=O)C(C#N)=Cc2cc(Br)c(O)c(Br)c2)c1 2293245275 SROZHQBJPMWGSR-UHFFFAOYSA-N 436.103 4.771 50 10 IJGE CC[C@@H](C[C@H](C)Cl)NCc1ccc(I)c(Br)c1 2306222400 UBIHKQGFNAWQKY-ONGXEEELSA-N 430.555 4.939 50 10 IJGE C[C@@H]1CCN(Cc2cc(I)ccc2Cl)C[C@@H]1Br 2307329350 ZROVBZXEQGGDDB-SKDRFNHKSA-N 428.539 4.550 50 10 IJGE BrC[C@@H]1C[C@H]2CCCC[C@@H]2N1Cc1sccc1I 2316760800 YGOJSMAHYKGBKT-MDZLAQPJSA-N 440.188 4.881 50 10 IJGE Clc1ccc(CN2CC[C@H](CBr)C23CC3)c(I)c1 2318538303 IJBULOWRJAHHIF-LLVKDONJSA-N 440.550 4.694 50 10 IJGE CCCCc1ccc(NC(=O)C(C#N)=CNCCc2cccc(Br)c2)cc1 2324474241 RZQNDOOHRGFFDY-UHFFFAOYSA-N 426.358 4.970 50 10 IJGE CC(C)(C)OC(=O)N[C@@]1(C)CN(C[C@](C)(CBr)C(C)(C)C)CC1(F)F 2327110037 PNVJVWVRDQRUJW-IRXDYDNUSA-N 427.374 4.668 50 10 IJGE N#CC(=C(O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2cccc([N+](=O)[O-])c2)cs1 2331232923 ZYAFBVHBGPPYLN-QGZVFWFLSA-N 446.488 4.560 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@H]2CC(F)(F)CC[C@@]2(NC(=O)OC(C)(C)C)C1 2344076740 KYEWAMXMLVSLHE-IIDMSEBBSA-N 439.385 4.668 50 10 IJGE Cc1nsc(Br)c1C(=O)N(C)CC(C)(C)[C@@H](Br)C(C)C 2365997120 WUHFRTSISGTYKM-NSHDSACASA-N 426.218 4.732 50 10 IJGE CCCCCN1C(=O)/C(=C(/C#N)C(=O)Nc2cc(C)nn2-c2ccccc2)c2ccccc21 12651140 NMOBNOQWGDIUGP-FLFQWRMESA-N 439.519 4.633 50 10 IJGE CCOc1ccc(/C=N/NC(=O)COc2ccc(Br)cc2C(C)C)cc1OC 40950982 YPAMJMCQGITLSV-FSJBWODESA-N 449.345 4.509 50 10 IJGE O=C(N/N=C1/C(=O)N(C(c2ccccc2)c2ccccc2)c2ccccc21)c1ccccc1 59154292 MINFCVMPOVGCQC-XLVZBRSZSA-N 431.495 4.957 50 10 IJGE COc1cc(CBr)cc(Br)c1OCc1c(Cl)c(C)nn1C 91324740 JPINSPDSKQXBRH-UHFFFAOYSA-N 438.547 4.627 50 10 IJGE C[C@H](Br)C[C@H](C)NC(=O)c1cc(Br)ccc1Br 161233972 HIEDZMJJSGYNAK-YUMQZZPRSA-N 427.962 4.503 50 10 IJGE COc1cc(C=NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OCc1cccc(Cl)c1 252606812 GVOPUYMZRMGQEZ-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE C=CCc1ccc(OCC(=O)NN=Cc2cccc(OCc3ccccc3)c2)c(OC)c1 254384842 XZKHBRVAKILLSS-UHFFFAOYSA-N 430.504 4.532 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1C(=O)c1cc(Br)cc(Br)c1 399422252 NXMHRTWTIIXULN-PSASIEDQSA-N 439.973 4.600 50 10 IJGE O=C(CSc1nnc(-c2ccco2)n1C1CCCCC1)NNc1ccc(Cl)cc1 749283772 HPCGHXRYPSGSSF-UHFFFAOYSA-N 431.949 4.932 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OC[C@@H]2CCC3(CCCCC3)O2)c(-c2ccccc2)n1 786266836 DRBOUOKVHXVYML-ODFZLOHPSA-N 444.535 4.796 50 10 IJGE CC(=NNC(=O)COc1ccc2cc(Br)ccc2c1Br)C1CC1 1084433487 OAOLCPPREAMPFF-UHFFFAOYSA-N 440.135 4.646 50 10 IJGE Cc1cccc(-c2cccc(CNC(=O)NNC(=O)c3ccc(Br)cc3)c2)c1 1115963018 MXAMVVODRIEHSK-UHFFFAOYSA-N 438.325 4.569 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2cnc(-c3ccccc3)s2)c(C)n1C[C@@H]1CCCO1 1318996315 DFDMDFNXEMUYNX-ZAAFRKLLSA-N 446.576 4.631 50 10 IJGE C#CC[C@H]1CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1 1461812177 ILZPDVHGWPGIGF-TYJAPOHBSA-N 425.454 4.892 50 10 IJGE CCN(C(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc(O)cc1)CCC2)c1cccc(C)c1 1772745399 XZOCMJLMTUELEG-UHFFFAOYSA-N 445.519 4.739 50 10 IJGE Cc1c(C(=O)Oc2cccc3ccccc23)oc2c1C(=NNC(=O)c1ccccn1)CCC2 1772747348 OPFLFOLJBWPVML-UHFFFAOYSA-N 439.471 4.826 50 10 IJGE N#CSc1ccc(NC(=O)Oc2ccc(CNC(=O)c3cccnc3Cl)cc2)cc1 1858914650 SHGMZAQYXYIDKP-UHFFFAOYSA-N 438.896 4.849 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(C)cc2)cc1OC 1865697186 OWLUSHXKUNNQDY-DEOSSOPVSA-N 444.535 4.895 50 10 IJGE CCN(C[C@@](C)(CBr)OCCOCc1ccccc1)C(=O)OC(C)(C)C 1880585183 JLSHPBHWMHVBET-HXUWFJFHSA-N 430.383 4.630 50 10 IJGE CC1(C)C[C@@H](C[C@@H](CBr)NC(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)C1 1880753838 JLIFOVVLKKBSJU-UONOGXRCSA-N 435.403 4.700 50 10 IJGE CC(C)[C@H](C)[C@H](C)O[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1901527239 SMRFVCWQMLUNEX-MPGHIAIKSA-N 439.378 4.888 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)C(=O)c1ncc(Br)cc1Cl 1974521650 RMNCBMWCFQTGPY-NSHDSACASA-N 446.570 4.923 50 10 IJGE C[C@](CBr)(NC(=O)c1ccc(Br)cc1Br)C1CC1 2029957743 UKRFEWCHVHREPW-CYBMUJFWSA-N 439.973 4.505 50 10 IJGE Clc1ccc(I)c(CN2C[C@H](Br)[C@H](C3CC3)C2)c1 2030226634 LUZHZLVCTIKPHD-STQMWFEESA-N 440.550 4.550 50 10 IJGE CSc1ccc(C=C(C#N)c2nc(CCN3C(=O)c4ccccc4C3=O)cs2)cc1 2040744374 ZDAKAUMIGQBHTR-UHFFFAOYSA-N 431.542 4.768 50 10 IJGE FC(F)(F)c1cc(I)cc(CCl)c1I 2060237517 MYJPVXUSTOGNPV-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE CC(C)[C@H](Br)c1cn(-c2ccc(Br)c(Br)c2)nn1 2065990269 LYUYTHPLFMJYON-LBPRGKRZSA-N 437.961 4.884 50 10 IJGE Clc1cc(CBr)ccc1N1CCCN(Cc2ccccc2)CCOCC1 2088628579 PJRMTIUDRGYXTB-UHFFFAOYSA-N 437.809 4.964 50 10 IJGE CC[C@]1(NC(=O)OC(C)(C)C)CCCN(C[C@H](CBr)c2ccccc2)C1 2106788321 ORQSSHOTKRWOOJ-RXVVDRJESA-N 425.411 4.934 50 10 IJGE O=C(c1ccc(Cl)c(Br)c1)N1CCC([C@H](F)CBr)CC1 2163247347 WSSSEZCGBXMANU-CYBMUJFWSA-N 427.539 4.688 50 10 IJGE Cc1cc([C@@H](Br)c2ccc3c(c2)CCS3(=O)=O)sc1Br 2170066677 IYWFUCWUCRJCKE-ZDUSSCGKSA-N 436.190 4.633 50 10 IJGE CC[C@H](Cl)[C@@H]1CCCCN1C(=O)c1cc(Cl)ccc1I 2170620506 ZEYJALZJRJKDSP-JSGCOSHPSA-N 426.125 4.957 50 10 IJGE CC1(C)CCCN(C(=O)c2ccc(I)c(Cl)c2)[C@H]1CCl 2185811441 IOAMIJKVARNCSJ-ZDUSSCGKSA-N 426.125 4.814 50 10 IJGE Fc1cc(Br)cc2c1nc(CCCl)n2-c1csnc1Br 2232920721 DEDHSIOVMDWYAZ-UHFFFAOYSA-N 439.535 4.927 50 10 IJGE C[C@H](CCBr)CCN1CC[C@H](NC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2255000223 AKTHADSPCJDKQO-RDBSUJKOSA-N 431.337 4.718 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2[C@H]1CCN(Cc2ccccc2)C1 2270561348 JXMFEZKOUBBQJP-HNNXBMFYSA-N 434.765 4.993 50 10 IJGE COc1cc(C=C(C#N)C(=O)NC2CCCCCC2)ccc1OC(=O)c1cccc(C)c1 2295672293 JMICNIIDPABRRA-UHFFFAOYSA-N 432.520 4.969 50 10 IJGE C[C@H](Br)COCc1cn(-c2cc(Cl)c(Br)cc2Cl)nn1 2295838363 XMYORCNMZYASHP-ZETCQYMHSA-N 443.954 4.637 50 10 IJGE Fc1ccc(OCc2sccc2I)c(CBr)c1 2301072380 XOGMIQCOKHSNSX-UHFFFAOYSA-N 427.076 4.966 50 10 IJGE C[C@@H]1[C@@H](CBr)CCN1Cc1ccc(Cl)cc1I 2302335127 BBRBLKRDNHHULB-NXEZZACHSA-N 428.539 4.550 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@H](C3)[C@H]2CBr)cc1I 2315548140 DIDHXYCCMBPUHU-UHIISALHSA-N 440.550 4.692 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)NNC(=O)C=Cc1ccc(C(C)C)cc1 2321070524 YRBMCKJIYYRAHI-UHFFFAOYSA-N 435.474 4.933 50 10 IJGE C[C@H]1CCc2[nH]c3ccc(C(=O)NN=Cc4cc(Cl)c(O)c(Cl)c4O)cc3c2C1 2323168504 CMQYGSXFDYTBLE-JTQLQIEISA-N 432.307 4.775 50 10 IJGE CCSc1ccc(Cl)cc1CC(=O)NN=Cc1cc(Br)ccc1O 2323678273 VABGSWVEZOBJPV-UHFFFAOYSA-N 427.751 4.613 50 10 IJGE CC(C)COC(=O)c1ccc(NC(=O)C(C#N)=Cc2cccc(Br)c2)cc1 2329697832 BGHCEYIABUYNIJ-UHFFFAOYSA-N 427.298 4.808 50 10 IJGE O=C(Nc1ccccc1[N+](=O)[O-])c1cccc(S(=O)(=O)C[C@H](Cl)c2ccccc2)c1 8453772 QMMIVTRTELTFQK-SFHVURJKSA-N 444.896 4.601 50 10 IJGE N#CC1=C2SCN(c3ccccc3F)CN2C(=O)C[C@@H]1c1ccc(Br)cc1 9693399 VRXPBUYBCBRRCE-OAHLLOKOSA-N 444.329 4.808 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)c2ccccc2C)cc1Br 14640668 JRVOUFOMJPHZBU-UHFFFAOYSA-N 433.346 4.791 50 10 IJGE CCOc1cc(/C=C2/C(=O)N(Cc3ccccc3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 38605968 UWVUOTVAEFBLAR-LPYMAVHISA-N 444.531 4.913 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@H](C)Oc4ccccc4F)ccc32)cc1 38649235 APOSYHRWVLVFDU-FYSMJZIKSA-N 444.462 4.725 50 10 IJGE CC(C)Cc1ccc([C@H](C)C(=O)NNC(=O)c2ccc(NC(=O)c3ccccc3)cc2)cc1 66199338 KZYRNLJTNZYVBC-IBGZPJMESA-N 443.547 4.702 50 10 IJGE COc1ccc([C@@H](Br)c2ccccc2I)c(OC)c1 104045246 ZDWOKOHMBWHVBS-HNNXBMFYSA-N 433.083 4.793 50 10 IJGE CC(C)(C)c1cc(/C=N/NC(=O)c2cc(-c3ccccc3)nc(O)n2)cc(C(C)(C)C)c1O 169923103 IHBNNLWZEZKGRE-JFLMPSFJSA-N 446.551 4.914 50 10 IJGE C[C@@H](Br)c1ccccc1NC(=O)c1cc(I)ccc1O 235061685 WEMAYDIETYHELP-SECBINFHSA-N 446.082 4.705 50 10 IJGE O=C(CCn1c2c(c3ccccc31)CCCC2)NN=Cc1cc(Br)ccc1O 245238704 ZFOBARJSAHLMOE-UHFFFAOYSA-N 440.341 4.529 50 10 IJGE CC(=NNC(=O)CSc1nnc(-c2ccc(C)cc2)n1-c1ccccc1)c1cccs1 254308918 MQAVBZCLAMZMSW-UHFFFAOYSA-N 447.589 4.937 50 10 IJGE O=C(NN=Cc1ccc(O)c(O)c1)c1ccc(CSc2cccc3cccnc23)cc1 254818866 LPMTXYXHUWBBOH-UHFFFAOYSA-N 429.501 4.702 50 10 IJGE COc1cccc([C@@H](Br)c2cc(I)cc3c2OCC3)c1 312246984 BOZOJJBWEHFMJU-OAHLLOKOSA-N 445.094 4.719 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)O[C@H]2CCOc3cc(F)ccc32)c(-c2ccccc2)n1 766305974 GEZCJCVEQIPDBG-CAVPUYEOSA-N 442.450 4.577 50 10 IJGE CC(=O)CCc1ccc(OCCC(=O)NNc2nc3cc(Cl)ccc3cc2C)cc1 779037224 IKCNNXBAZAPVFR-UHFFFAOYSA-N 425.916 4.630 50 10 IJGE O=C(NN=Cc1ccc(-c2cccc(Cl)c2)o1)C(=O)Nc1ccc(Cl)c(Cl)c1 1084172002 WSTXCMOZONEAFQ-UHFFFAOYSA-N 436.682 4.996 50 10 IJGE Cc1ccc(-c2ccc(C=NNC(=O)CC[C@H](O)c3ccccc3)o2)c(Br)c1 1084216204 MZUNPSFAMXXKQA-FQEVSTJZSA-N 441.325 4.981 50 10 IJGE CCCc1nn(CC)c2c1[C@@H](c1ccc(OCc3ccc(C)cc3)cc1)C(C#N)=C(N)O2 1865694140 USKZFADKQQZSMC-QHCPKHFHSA-N 428.536 4.961 50 10 IJGE O=C(N[C@H](CCl)[C@@H]1CC=CCC1)c1scc(Br)c1Br 1885059517 AYUNOEWCKJQSKB-PSASIEDQSA-N 427.589 4.967 50 10 IJGE CC1(C)CN(Cc2cc(Cl)ccc2I)C[C@@H]1CBr 1914502794 PHHBOXJLJRJNLW-NSHDSACASA-N 442.566 4.798 50 10 IJGE Cc1cc(Br)sc1[C@H](Br)c1cnn(C)c1Br 1939449938 GBPOGYMQLANITE-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE CCCC(CBr)(CBr)Cc1c(Br)cnn1CC 1945478461 KZYPYHGRGDGODO-UHFFFAOYSA-N 431.010 4.784 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CCC[C@H]2C[C@H]21)C(=O)OC(C)(C)C 1995175612 JFQMFADOBGXJSJ-BORJPKMPSA-N 437.362 4.642 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1C(=O)c1c(Br)cccc1Br 2033085496 FBIUINUJUYVCIR-RKDXNWHRSA-N 439.973 4.600 50 10 IJGE CN(CC(C)(C)CBr)C(=O)c1ccc(Br)cc1Br 2033567039 NMTKANOEGMYGRK-UHFFFAOYSA-N 441.989 4.705 50 10 IJGE CC(C)COc1ccc(C=C(C#N)C(=O)Nc2ccccc2I)cc1 2053623439 YPSUSHNMAYMHSV-UHFFFAOYSA-N 446.288 4.872 50 10 IJGE CCC(CC)(CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1CC(F)F 2063525474 VSEAQKRXYRPDQN-CQSZACIVSA-N 427.374 4.764 50 10 IJGE Fc1cccc(Cn2nc(CBr)c(Br)c2C(F)(F)F)c1F 2079230597 RSRSZCSUWOFUQK-UHFFFAOYSA-N 434.000 4.886 50 10 IJGE CC1(C)CN(Cc2ccccc2)CCN(c2cc(CBr)sc2[N+](=O)[O-])C1 2094066730 FASPONYYQSXJAW-UHFFFAOYSA-N 438.391 4.900 50 10 IJGE CC(C)[C@H](CBr)CN=[S@](=O)(CCNC(=O)OC(C)(C)C)c1ccccc1 2107396602 RHABLKFOSOKYFP-DXPJPUQTSA-N 447.439 4.705 50 10 IJGE CN([C@@H]1CC(C)(C)[C@@H]1OCc1ccccc1)S(=O)(=O)c1ccc(CCCl)s1 2156442676 OAHABEBKXKFXLP-IEBWSBKVSA-N 428.019 4.534 50 10 IJGE CC(C)(C)[C@@H](CCBr)NC(=O)Cc1ccc(Br)cc1Cl 2237436451 LAVQLSOHCXQVOZ-CYBMUJFWSA-N 425.592 4.961 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)c2cnsn2)c1 2246006303 XEHIGZRLFBAJBE-SECBINFHSA-N 426.959 4.742 50 10 IJGE COc1c(C)cc(C)cc1[C@@H](Br)c1cc(I)sn1 2263459191 UXYQNAINLHJORR-GFCCVEGCSA-N 438.128 4.857 50 10 IJGE CC1CC(CBr)(CN(CC2CC2)C[C@@H]2CCCN2C(=O)OC(C)(C)C)C1 2265312643 WLMOGXZMWJALRJ-JGCRXCKMSA-N 429.443 4.909 50 10 IJGE CC1CC(CBr)(CN2CC[C@H](NC(=O)OC(C)(C)C)C[C@H]2C(F)(F)F)C1 2266273871 OZSLEBLENAWSRQ-CWVKQELPSA-N 443.348 4.718 50 10 IJGE COC1(COc2c(Br)cc(Br)cc2CCl)CCOCC1 2280292658 ZUHULNLNEOUEEG-UHFFFAOYSA-N 428.548 4.525 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H](CCl)C1)c1ccc(Cl)c(I)c1 2283658614 XQNTVXYTLFUEPG-GHMZBOCLSA-N 426.125 4.720 50 10 IJGE O=C(NCC[C@H]1CCC[C@H]1Br)c1cc(Br)c(F)cc1Cl 2285846174 LAQKANCIHVSLOM-PSASIEDQSA-N 427.539 4.925 50 10 IJGE O=C(CNc1cccc2ccccc12)NN=Cc1cccc(OC(=O)C=Cc2ccco2)c1 2294728470 HPNFVZTULBCABC-UHFFFAOYSA-N 439.471 4.614 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CC[C@@H]2[C@@H](CCN2C(=O)OC(C)(C)C)C1 2297084586 DKDNOIRHHSBGMX-CAOSSQGBSA-N 447.414 4.700 50 10 IJGE CCN[C@@H](c1cc(Br)c(Br)cc1F)[C@@H]1C[C@H]1Br 2298019750 LHNJTMBAEFZNFK-SLOVDRIHSA-N 429.953 4.785 50 10 IJGE C[C@H]1CCN(Cc2ccc(Cl)cc2I)C[C@H]1Br 2302325126 DMRCMPIIVIZKGE-JOYOIKCWSA-N 428.539 4.550 50 10 IJGE CC(C)C[C@@H](CBr)CN1CC=CCC12CN(C(=O)OCc1ccccc1)C2 2308058512 VRPGDMWGUIIVLL-FQEVSTJZSA-N 435.406 4.697 50 10 IJGE C=CCc1cc(C=C(C#N)C(=O)Nc2cccc(Br)c2)cc(OCC)c1O 2313543599 RMJXLGXWWWELES-UHFFFAOYSA-N 427.298 4.828 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCCC2)C[C@]2(CBr)CC2(F)F)C1 2351892580 QXTPGZSSNZQHRJ-GOSISDBHSA-N 437.369 4.518 50 10 IJGE CC(C)C[C@H](CBr)CN1CCCC[C@@H]1[C@@H]1CCCN(C(=O)C(F)(F)F)C1 2382185444 YQQFEDYGYRPDNX-BRWVUGGUSA-N 441.376 4.699 50 10 IJGE CC[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)COc1ccc(C(C)C)cc1 14768334 FRIAIHZQTGKZOM-RUZDIDTESA-N 446.547 4.861 50 10 IJGE CC(C)c1ccc(Oc2ncnc(NNC(=O)c3ccc(Cl)cc3)c2[N+](=O)[O-])cc1 40611036 FBYAKBAKENXLIZ-UHFFFAOYSA-N 427.848 4.711 50 10 IJGE Cc1c(C(=O)N2CCCC[C@@H]2C)oc2c1/C(=N/NC(=O)c1ccc3ccccc3n1)CCC2 40825701 SZJVKIPQKABCPH-PFOGTBOLSA-N 444.535 4.621 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NC(C)C)ccc1OC(=O)c1ccc(Cl)c(Cl)c1 40884538 MIFDLOZTIYITPE-OVCLIPMQSA-N 433.291 4.653 50 10 IJGE C=CCc1cc(/C=N/NC(=O)COc2ccc(-c3ccccc3)cc2)cc(OCC)c1O 59303245 DWUPKVMSVCCCOP-WPWMEQJKSA-N 430.504 4.716 50 10 IJGE CC(=O)c1cccc(N2Cc3ccccc3/C2=N\C(=O)/C(C#N)=C/c2ccc3c(c2)OCO3)c1 102928042 BNBOOSJKKXCBFD-OZVQCWSZSA-N 449.466 4.518 50 10 IJGE CC[C@H](Br)C(=O)Nc1nc2scc(-c3cc(Cl)ccc3Cl)n2n1 170503020 GOSADNQZPJOLEV-VIFPVBQESA-N 434.146 4.877 50 10 IJGE CCCN(CCC)c1ccc(C=NNC(=O)C(O)(c2ccccc2)c2ccccc2)cc1 254431864 CNRCIGOAXVQQGG-UHFFFAOYSA-N 429.564 4.699 50 10 IJGE COc1cccc(/C=C/C(C)=NNC(=O)COc2ccc(OCc3ccccc3)cc2)c1 254766243 KQPRKIRFQBLJCI-ZBLQSNPJSA-N 430.504 4.859 50 10 IJGE FC(F)c1cc(I)c(CBr)cc1Br 575684653 HEJWWPGVIFRTKY-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE Fc1cc2nc(CCCl)n(CC3CN(Cc4ccccc4)C3)c2cc1Br 716245047 UDQPSSHQSGWVBP-UHFFFAOYSA-N 436.756 4.851 50 10 IJGE CC(C)c1ccc(C2(CNC(=O)NNC(=O)c3cccc4cccnc34)CCCC2)cc1 731043372 FSYSYJBOQHIBQQ-UHFFFAOYSA-N 430.552 4.814 50 10 IJGE Cc1cc(C=NNC(=O)[C@@H]2COc3ccccc3O2)c(C)n1-c1ccc(Cl)c(Cl)c1 1084223456 VJIAYMRLZSGDKG-NRFANRHFSA-N 444.318 4.691 50 10 IJGE O=C(NNc1cc(C(F)(F)F)ccc1Br)c1cc(O)nc2ccc(F)cc12 1469067345 UAAZOHPSJVJUOR-UHFFFAOYSA-N 444.182 4.618 50 10 IJGE C#CCOc1ccc(CNC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1 1533412350 LTVKUWGIISLYME-JCMHNJIXSA-N 443.934 4.983 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1ccccc1OCCOc1ccccc1 1633440475 ZVLFIEFFSMBBNX-UHFFFAOYSA-N 432.505 4.507 50 10 IJGE CCc1nn(Cc2cccc(F)c2)c2c1[C@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2 1865710989 NEHVKCCTVCDLSV-LJQANCHMSA-N 442.416 4.870 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)Cc1c(Cl)cc(F)cc1Cl 1886328510 QLQOHZHAKMBKGL-SECBINFHSA-N 431.088 4.735 50 10 IJGE O[C@H](c1c(Br)sc(Br)c1Cl)[C@H]1C[C@H]1Br 1893036704 UWZVKAPYZTWNHI-VPGXFDHMSA-N 425.367 4.743 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCC[C@@H](CNC(=O)OCc2ccccc2)C1 1905523645 HNVWEQNXLAVTPI-PMACEKPBSA-N 425.411 4.682 50 10 IJGE C[C@@H]1CN(Cc2ccc(Br)cc2Br)CC[C@@H]1Br 1943841948 FZBQDYRVNIQVOW-SKDRFNHKSA-N 425.990 4.817 50 10 IJGE COc1ccc([C@H](Br)[C@H]2C[C@@H]2Br)c(OC)c1Br 2020150113 MAPZTKLXILMFIT-NRPADANISA-N 428.946 4.686 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1Cc1ccc(I)c(Cl)c1 2026566328 JHSWWCPKNDYCMK-KOLCDFICSA-N 428.539 4.692 50 10 IJGE FC(F)c1ccc(CBr)c(I)c1Br 2054779307 FPRIGKYTYJOPMJ-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE ClCC[C@@H]1CCCN(c2ncc(I)cc2Br)CC1 2069532112 RBXNDLOTRHLJQO-JTQLQIEISA-N 443.554 4.684 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1ccc(Br)cc1Br 2081242583 NPBOCIFIHFJWON-PRHODGIISA-N 441.989 4.751 50 10 IJGE CC(C)(C)OC(=O)NCc1cccc2c1N(C[C@@H](Br)C(F)(F)F)CCC2 2106784770 LAVXDIWORGHEKM-CQSZACIVSA-N 437.300 4.790 50 10 IJGE Cc1cc(Br)c(CCl)c(N2C[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1 2116805420 GVKIHBZMWBHGNL-NHCUHLMSSA-N 435.793 4.586 50 10 IJGE C[C@](CI)(O[C@@H]1[C@@H]2C[C@H]2[C@H]2C[C@H]21)c1ccccc1Br 2143311170 LGJJUUYJYDHIPJ-NWOLRWQLSA-N 433.127 4.770 50 10 IJGE C[C@@H](Br)c1ccccc1NC(=O)Cc1ccccc1I 2143869446 ZBHFGYDGFIYFHO-LLVKDONJSA-N 444.110 4.928 50 10 IJGE O=C(c1ccc(Cl)cc1Br)N1CC[C@H](CBr)C(F)(F)C1 2146374673 DAQZUEDSLFLBAU-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE C[C@]1(CCl)CC(F)(F)CN1C(=O)c1cccc(Br)c1Br 2159049227 MDQKDXITCMZFEK-GFCCVEGCSA-N 431.502 4.690 50 10 IJGE BrCc1c(N2CCC3(CCN(Cc4ccccc4)C3)CC2)nc2sccn12 2163335891 VAWCGJFOBTULCC-UHFFFAOYSA-N 445.430 4.783 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1C1CCN(C[C@@H](CBr)C(C)(C)C)CC1 2185504421 XLHVUXGHGJYEHN-OAHLLOKOSA-N 443.430 4.993 50 10 IJGE Cc1c(CBr)cccc1NS(=O)(=O)c1cscc1Br 2268336968 FCOGWEFIPAUOMB-UHFFFAOYSA-N 425.167 4.515 50 10 IJGE C[C@@H]1C[C@@H](CBr)CCN1C(=O)c1cc(F)c(Br)cc1Cl 2282982924 ICYOSBGABPQAMN-BDAKNGLRSA-N 427.539 4.877 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@@H](Br)CCC12CC2 2285956946 CHOBDBPXBKIKOC-QMMMGPOBSA-N 425.523 4.774 50 10 IJGE Clc1ccc(CN2CCCC[C@H]2CBr)cc1I 2300238313 JLILDMXHMYSMPL-NSHDSACASA-N 428.539 4.694 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@H]2CCCC3(CC3)C2)C1 2302706018 DGYQZEQJDBGJQC-KXBFYZLASA-N 449.373 4.931 50 10 IJGE BrC[C@@]12CCC[C@H]1N(Cc1sccc1I)CCC2 2316760189 RLPWFLIOAORCMD-KGLIPLIRSA-N 440.188 4.882 50 10 IJGE COc1ccc(C(C#N)=Cc2ccc(OC(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1OC 2320506199 DPNMHPHFBSDSHL-UHFFFAOYSA-N 430.416 4.895 50 10 IJGE COc1ccc(C(C#N)=Cc2ccc(OC(=O)COc3ccccc3)c(OC)c2)cc1OC 2320506768 RBWGCWBYURACKH-UHFFFAOYSA-N 445.471 4.761 50 10 IJGE Cl[C@@H]1CN(Cc2ccc(I)c(Br)c2)CC12CCC2 2325220954 KMWXBYRZHYDVQY-CYBMUJFWSA-N 440.550 4.647 50 10 IJGE FC(F)(F)[C@H]1[C@H](Br)CCCN1Cc1ncc(Br)cc1Cl 2370295051 QEQIHSJKSGHWLU-LDYMZIIASA-N 436.497 4.788 50 10 IJGE CCCCCCOc1ccc(Br)cc1C(=O)NNC(=O)c1ccccc1C 14648259 JMEUCXIZVOZHPG-UHFFFAOYSA-N 433.346 4.791 50 10 IJGE CCCCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccco2)cc1 38657429 YWZTZCQYHGUSNH-QHCPKHFHSA-N 430.460 4.896 50 10 IJGE O=C(COc1ccccc1Cl)N/N=C/c1ccccc1OC(=O)c1ccc(Cl)cc1 48572595 CSKHIIZMVWWJQJ-DHRITJCHSA-N 443.286 4.742 50 10 IJGE ClC[C@H](I)[C@@H](CCl)OCc1cccc(Br)c1 158544639 BMTYQFZDSKDABT-WDEREUQCSA-N 437.930 4.616 50 10 IJGE Cc1ccc(SCC(=O)Oc2ccc(/C=C(/C#N)C(=O)NCc3ccco3)cc2)cc1 206964758 WVVRPCDZONKOBM-UYRXBGFRSA-N 432.501 4.509 50 10 IJGE O=C(NN=C/C=C/c1ccccc1)/C(=C\c1cccs1)NC(=O)c1ccccc1Cl 252607625 HDEGMMMKAFSUJO-KFTNQRMBSA-N 435.936 4.988 50 10 IJGE CC(=NNC(=O)CSc1nc2ccccc2n1Cc1ccc(Cl)cc1)c1ccncc1 252633749 WGDCVQRAZXUWPG-UHFFFAOYSA-N 449.967 4.766 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1ccccc1[C@@H]1CCN(S(N)(=O)=O)c2ccccc21 616589322 XSNCVTPOJOUKGC-FQEVSTJZSA-N 446.689 4.796 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCC[C@@H](CBr)C1 705401942 SFCOHHFLAKBTTK-ZETCQYMHSA-N 446.002 4.520 50 10 IJGE O=C(NN=Cc1cc(Br)ccc1OCc1cccc(F)c1)c1cccs1 725432555 BQOZZTYWFYQNMV-UHFFFAOYSA-N 433.302 4.993 50 10 IJGE O=C(COc1ccccc1O)NNC(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 730899717 WTDRBXYTEDIPDM-UHFFFAOYSA-N 446.290 4.598 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2C[C@H]3CCCC[C@H]3C2)c(-c2ccc(Cl)cc2)n1 750139893 IQFBYJKCONNJEL-MRMAUXFQSA-N 433.943 4.673 50 10 IJGE C[C@@H](CBr)COC(=O)CSc1nnc(-c2ccco2)n1C1CCCCC1 770405462 JSRABSRPCOHNQG-ZDUSSCGKSA-N 442.379 4.710 50 10 IJGE C[C@H]1CCN(C(=O)C(=O)Nc2ccc(S(F)(F)(F)(F)F)cc2)C[C@@H]1n1ccnc1 773405401 BCAPAELPHHFUSG-WFASDCNBSA-N 438.422 4.589 50 10 IJGE CCOc1cc(C=NNC(=O)c2sc3nc(C)cc(C)c3c2-n2cccc2)ccc1OC 1081098329 ABVUOISTBKIIPS-UHFFFAOYSA-N 448.548 4.875 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2 1440536442 USHZORYCCATBQZ-GFCCVEGCSA-N 438.471 4.531 50 10 IJGE C=C/C=C\CC(=O)NNc1c(Br)cc(Br)cc1Br 1565986169 TXQQLAWXDFBEOW-ARJAWSKDSA-N 438.945 4.550 50 10 IJGE C#CCN(C(=O)[C@H](Br)C(C)(C)C)[C@H]1CCOc2ccc(Br)cc21 1617600637 MTHSSTVXQKJLCK-HOCLYGCPSA-N 443.179 4.544 50 10 IJGE COc1cccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2C)CCC3)c1 1772743436 AIEXGGWQBAUGRG-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE N#CSc1ccc(NC(=O)C2CCN(C(=O)c3cccc(Br)c3)CC2)cc1 1860588187 KRCIGCOJJFPNFP-UHFFFAOYSA-N 444.354 4.513 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)c3ccc(CSC(C)C)o3)c(C)n2)cc1C 1865756131 IBHMSUSDBKCGPN-UHFFFAOYSA-N 437.565 4.983 50 10 IJGE CC(C)(C)OC(=O)NC[C@H](c1ccccc1)[C@@H](CBr)NC(=O)OC(C)(C)C 1883674850 IJMBJRKFNPVOHZ-HZPDHXFCSA-N 443.382 4.583 50 10 IJGE CN(C[C@H](CBr)C1CCC1)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 1890233068 DZCOWXGQYACLGZ-OALUTQOASA-N 425.411 4.995 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@]23CCOC[C@H]2C3)s1 1900919386 OYGAWJJGYZBCSL-LIEZGIJOSA-N 433.536 4.869 50 10 IJGE Cn1cc(Br)c(C[C@H](CBr)c2ccc(Br)cc2)n1 2027112336 SPSURYOMVRYFHR-SNVBAGLBSA-N 436.973 4.666 50 10 IJGE CC1(C)CCN(c2ncc(Br)cc2Br)C[C@H]1CBr 2031405431 HSSDDPWOUCGENA-SECBINFHSA-N 441.005 4.854 50 10 IJGE CCC[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)CC[C@@H]1C(F)(F)F 2044698489 CAOIQAALQZCWAO-ZIAGYGMSSA-N 431.337 4.671 50 10 IJGE COC[C@@H]1C[C@H]1COc1c(Br)cc(Br)cc1CBr 2069753868 PHKNEVKWFXTYLI-UWVGGRQHSA-N 442.973 4.768 50 10 IJGE BrCc1cc(C2CCC2)nn1Cc1ccc(I)cc1 2070033893 HQXAWCIJNBBQCY-UHFFFAOYSA-N 431.115 4.698 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1ccc(Br)c(Cl)c1 2081235360 FEVWPKJPVXNTBR-PELKAZGASA-N 444.538 4.682 50 10 IJGE Clc1cc(CN2C[C@@H]3CC[C@]3(CBr)C2)ccc1I 2086654954 KFABHNAOWXCJNW-FZMZJTMJSA-N 440.550 4.552 50 10 IJGE CC[C@H]1CCN(C(=O)c2ccc(CBr)cc2)[C@@H](CNC(=O)OC(C)(C)C)C1 2162912400 VFNZBGCFAIYJQU-MAUKXSAKSA-N 439.394 4.737 50 10 IJGE C[C@H]1CN(C(=O)c2ccc(I)c(Cl)c2)CC[C@H]1CCCl 2172476009 RDEMDQAKIRNLKM-WDEREUQCSA-N 426.125 4.672 50 10 IJGE Brc1ccc([C@H](CI)OC2CC(n3ccnc3)C2)cc1 2183689177 MJACKOHVGCGINK-NRXISQOPSA-N 447.114 4.542 50 10 IJGE C[C@H](c1nscc1Br)N(C)c1nc2sccn2c1CBr 2186583767 ZXYNQSWEVYTUKW-SSDOTTSWSA-N 436.198 4.707 50 10 IJGE BrC[C@@H]1C[C@H]2CCCC[C@H]2N1Cc1ccc(I)cc1 2231964299 KNASCRFVGUYHQI-VNQPRFMTSA-N 434.159 4.819 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1ncc(Br)cc1C 2243964014 ALJAPKIIFXQBRC-HNNXBMFYSA-N 440.179 4.968 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@@H](Br)[C@H]1C1CC1 2285834938 GWMXMDQUNNGUKI-NOZJJQNGSA-N 425.523 4.630 50 10 IJGE FC1(F)CC[C@@H]1CO[C@H](CI)c1cccc(Br)c1 2313727043 RXHFZTARXVOXJU-ZYHUDNBSSA-N 431.058 4.987 50 10 IJGE CCOC(=O)C(C#N)=Cc1cccc(OC(=O)COc2ccc(-c3ccccc3)cc2)c1 2314755069 PZSJNIYJHKXJLM-UHFFFAOYSA-N 427.456 4.808 50 10 IJGE CCCn1c(CBr)nnc1-c1ccc(Cl)cc1I 2317747259 UKTUEISNOLOECO-UHFFFAOYSA-N 440.510 4.508 50 10 IJGE C[C@H]1CCCN(Cc2cc(I)ccc2Cl)[C@@H]1CBr 2327398855 JKQXYBWFZBMSDH-IINYFYTJSA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCN(C[C@H]2C[C@@H](Br)C2)[C@@H](C(F)(F)F)C1 2337544375 BGHUALQPXGHHBK-BYNSBNAKSA-N 443.348 4.718 50 10 IJGE Cc1ccnc(CO[C@H](CI)c2ccc(Br)cc2)c1 2343573004 IDZXPODXYPJJQU-OAHLLOKOSA-N 432.099 4.845 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H](C(F)(F)F)[C@@H](NC(=O)OC(C)(C)C)C2)C1 2345012092 YJTQBFBHYZKAST-STQMWFEESA-N 443.348 4.575 50 10 IJGE Cc1cc(Br)c(C(=O)N2CC[C@@H](Br)C[C@H]2C(F)(F)F)s1 2361464839 RMXSWZUDRTYDJF-APPZFPTMSA-N 435.103 4.749 50 10 IJGE COc1c(Cl)cc(Cl)cc1/C=N/NC(=O)CSc1nc2ccccc2s1 3206891 AVEGIPXBXVFVKV-DNTJNYDQSA-N 426.350 4.854 50 10 IJGE CC[C@@H](C)NC(=O)c1oc2c(c1C)/C(=N/NC(=O)Cc1coc3c(C)c(C)ccc13)CCC2 40826572 MVXWTYDXUPHUSK-WVZIWNLSSA-N 449.551 4.879 50 10 IJGE N#Cc1ccccc1Cn1cc(/C=N\NC(=O)CC[C@@H](O)c2ccccc2)c2ccccc21 58888490 VZYZSQOAZRATFV-XAVTVXAQSA-N 436.515 4.525 50 10 IJGE Br[C@H](c1cccc(I)c1)c1cnn(-c2ccccc2)c1 109864625 QMACOWDKJORORF-MRXNPFEDSA-N 439.094 4.961 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(Br)c(Br)s2)CC[C@H]1Br 167821386 YOSRXJCOZXOIOO-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE CCN(C[C@@](C)(CI)OCCC1CCC1)C(=O)OC(C)(C)C 229550113 DIZKHOFXJYYKNL-QGZVFWFLSA-N 425.351 4.644 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1 254330955 UYKLZGRVCFYKMH-UHFFFAOYSA-N 448.331 4.558 50 10 IJGE CC(CC(=O)Nc1ccccc1-c1ccccc1)=NNC(=O)COc1ccc(C)cc1C 254394569 CDMSJUJEJNCKMP-UHFFFAOYSA-N 429.520 4.870 50 10 IJGE CC[C@@H](Br)[C@@H](CC)NC(=O)c1cc(Cl)ccc1I 313086930 PNDWTOJUKHSSAQ-ZYHUDNBSSA-N 444.538 4.627 50 10 IJGE C[C@]12CN(Cc3ccccc3)C[C@]1(C)CN(C(=O)c1ccc(CBr)cc1)C2 705910308 VABRPSVNCSREAI-DHIUTWEWSA-N 427.386 4.566 50 10 IJGE ClCCc1nc2ccc(Br)cc2n1Cc1sncc1Br 722790193 KZIMQXOYMOZHDZ-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2cc3c(s2)-c2ccccc2C(C)(C)C3)c1 1176933895 VFOCMHQXEYTACE-UHFFFAOYSA-N 431.586 4.862 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2ccc(OCc3ccccc3)cc2)cc1)C1CC1 1562889827 KDVMWFBPGHYAOH-UHFFFAOYSA-N 430.508 4.930 50 10 IJGE CCN(CC)[C@H](C(=O)NNc1nc2ccccc2[nH]c1=S)c1cccc(C(F)(F)F)c1 1585173368 CDKQDIXKCRMHTL-KRWDZBQOSA-N 449.502 4.837 50 10 IJGE CCCCCN1C(=O)C(=NNC(=O)c2ccccc2Cl)c2cc(Br)ccc21 1772752316 UKTFBERFQGKSSJ-UHFFFAOYSA-N 448.748 4.773 50 10 IJGE COc1cccc(-c2csc(/C(C#N)=C(\O)CNC(=O)c3ccc(Cl)cc3)n2)c1 1872744037 FFPSJIGDIKJCCL-ZPHPHTNESA-N 425.897 4.695 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1ccc(Cl)c(Br)c1 1882087142 HTYHUTGEFRMMEV-JTQLQIEISA-N 427.564 4.933 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Cl)CCc1cc(Cl)cc(Br)c1 1905405753 PXQKOCQVNNIBRY-ZDUSSCGKSA-N 427.125 4.939 50 10 IJGE Cc1cc(F)ccc1S(=O)(=O)N(Cc1ccccc1)[C@@H](CBr)C(C)C 1915294974 FHGAEUXUSRYVBI-SFHVURJKSA-N 428.367 4.745 50 10 IJGE CC(C)(C)[C@@H](CBr)NC(=O)c1csc(Br)c1Br 1945189635 VTBCIZFLCUOPAE-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE CN(C[C@@H](Br)C1CC1)C(=O)c1csc(Br)c1Br 1945190611 QDXHAQQCFULDJR-MRVPVSSYSA-N 446.002 4.519 50 10 IJGE O=C(NC1CCN(C[C@H](CBr)c2ccccc2)CC1)OCc1ccccc1 1999493903 IKKNXXFQDNZCLP-FQEVSTJZSA-N 431.374 4.556 50 10 IJGE CC(C)[C@@](C)(CBr)NC(=O)c1c(Br)cccc1Br 2033089753 XDNMKCKIMBOSPQ-CYBMUJFWSA-N 441.989 4.751 50 10 IJGE CC(C)(C)C[C@@H](CBr)CNC(=O)c1csc(I)c1 2038696261 IZUODOPPXVBQSL-VIFPVBQESA-N 444.176 4.530 50 10 IJGE CC(C)(C)OC(=O)NCCN(CC(F)(F)F)CC1(CBr)CCCCC1 2044704283 BJUMMPFLKYISKC-UHFFFAOYSA-N 431.337 4.721 50 10 IJGE Cc1cc(C)c(-n2nc(CBr)c(Br)c2C(F)(F)F)c(C)n1 2078909175 HPDOJHOJZMDMKF-UHFFFAOYSA-N 427.062 4.869 50 10 IJGE Cn1ncc(Br)c1COc1c(Br)cc(Cl)cc1CCl 2087325195 KLZFYQDUUUOJPZ-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@@H](CCNC(=O)OC(C)(C)C)C1 2119488826 ZZWQPXPJARLVNL-KRWDZBQOSA-N 435.447 4.584 50 10 IJGE O=C(c1cccc(Br)c1Cl)N1CC[C@H](CBr)C(F)(F)C1 2146376346 YTYFIZBUYCZTKO-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE Fc1cccc(CBr)c1N1CCC[C@@]2(CN(Cc3ccccc3)CCO2)C1 2151740075 PYZCVPYSKGJMHD-JOCHJYFZSA-N 433.365 4.592 50 10 IJGE CC[C@H]1CN(C(=O)c2ccc(CBr)cc2)[C@H](CC)CN1C(=O)OC(C)(C)C 2162914252 CZBRZGZYUOSAMZ-MSOLQXFVSA-N 439.394 4.832 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CC2(CBr)CCC2)C[C@@H]1c1ccccc1 2185530238 SFTKYQJMKJKWOM-RTBURBONSA-N 437.422 4.792 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CBr)OCCCC(F)(F)C(F)(F)F 2217218088 XPDDTVRBYSUYHE-LBPRGKRZSA-N 428.236 4.659 50 10 IJGE O[C@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@H](Br)C1 2250732967 SXXVMHVIYJSVOU-ANYMCVJYSA-N 434.900 4.697 50 10 IJGE O=C(NC[C@H]1CCCC[C@@H](Cl)C1)c1ccc(Cl)c(I)c1 2283661104 FEGLJQAYWHCRJK-CMPLNLGQSA-N 426.125 4.862 50 10 IJGE CC(C)[C@H]1[C@H](Br)CCN1C(=O)c1cc(Br)c(F)cc1Cl 2285846818 SIAPUQAAFVJCRD-RNCFNFMXSA-N 427.539 4.876 50 10 IJGE C[C@@H]1CC[C@H](CBr)N(Cc2ccc(Cl)c(I)c2)C1 2315554538 GHTCVEZICLSEHV-ZYHUDNBSSA-N 442.566 4.940 50 10 IJGE CN[C@H](c1c(C)cc(Br)c(OC)c1Br)[C@H]1C[C@@H]1Br 2317397958 GPLJDFMKDYREMF-UBJUHAIHSA-N 441.989 4.573 50 10 IJGE COC[C@@H]1C[C@H](Cl)[C@@H](Cc2ccc(I)c(Br)c2)C1 2325204649 QOKMUTWKFDTFCA-GVXVVHGQSA-N 443.550 4.876 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(C)CN(C[C@](C)(CBr)C(C)(C)C)CC1(F)F 2327110035 PNVJVWVRDQRUJW-DLBZAZTESA-N 427.374 4.668 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Cl)c1ccc([C@@H]2CCOC2)s1 2364049004 ALGQIAHTXCBLNW-RDDDGLTNSA-N 440.588 4.839 50 10 IJGE C[C@H](Cl)C(=O)N1CCN(c2nc(C3CCCCC3)nc3sc4c(c23)CCCC4)CC1 35849090 VHZIEYMQDGMCJY-HNNXBMFYSA-N 447.048 4.894 50 10 IJGE COc1ccc(NC(=S)NNC(=O)c2ccc(-c3cccc(C(F)(F)F)c3)o2)cc1 39892594 SPAJACMLZURESV-UHFFFAOYSA-N 435.427 4.605 50 10 IJGE Br[C@H](c1ccc(I)cc1)c1ccc2c(c1)OCCCO2 109842985 BZDLKQYGSIWAGO-MRXNPFEDSA-N 445.094 4.937 50 10 IJGE O=[N+]([O-])c1ccc(Oc2ccc(I)cc2)c(CBr)c1 218201339 PAQCFMXMYVLZJH-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE O=[N+]([O-])c1cc(Br)cc(Cl)c1OC[C@@H](Br)C(F)(F)F 311658682 FWSMRWRHJRPAGL-SSDOTTSWSA-N 427.398 4.715 50 10 IJGE C[C@]1(CBr)CCN(C(=O)c2cc(Br)c(Br)s2)C1 381399948 UZQGIVLMQTUKPW-LLVKDONJSA-N 446.002 4.520 50 10 IJGE O=C(c1cc(Br)sc1Br)N(CCBr)CC1CC1 708426765 NSVPSLQFNUHDGV-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE CC(=O)N(C)c1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 743713541 IBVUZFFKDDPAEB-XSFVSMFZSA-N 430.483 4.762 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2cc(C)n(-c3ccccc3F)c2C)cc1 1084036334 YKXJBCWILSWWPQ-DEOSSOPVSA-N 437.515 4.596 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)N(C)C)c(Br)cc1OCc1ccccc1F 1084467964 IRPMRCRKRFEUQE-CXUHLZMHSA-N 447.304 4.561 50 10 IJGE C=CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccc(Cl)cc1Br 1454090965 WLRXXOLSCJJZGX-OAHLLOKOSA-N 446.773 4.795 50 10 IJGE C=CCn1cc2ccc(NC(=O)NNC(=O)c3sc4cc(F)ccc4c3Cl)cc2n1 1680703787 DBCYBCJBTBZYRH-UHFFFAOYSA-N 443.891 4.696 50 10 IJGE Cc1c(C(=O)NC2CCCCC2)oc2c1C(=NNC(=O)c1ccc(Cl)cc1)CCC2 1772743786 KVYPKZIMDVWPKR-UHFFFAOYSA-N 427.932 4.774 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(O)cc2)CCC3)c(C)c1 1772745221 UETFELWAGCXLOC-UHFFFAOYSA-N 431.492 4.633 50 10 IJGE O=C1/C(=N\NC(=O)C23CC4CC(CC(C4)C2)C3)c2ccccc2N1Cc1ccccc1Cl 1860822370 AXNDVLFLOJJNBV-NFFVHWSESA-N 447.966 4.924 50 10 IJGE CCc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865701894 HMBXVVIEKPJYEH-IBGZPJMESA-N 426.854 4.644 50 10 IJGE CCCc1nn(-c2ccccc2Cl)c2c1[C@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706077 MXIXDTWWDNJTHE-LJQANCHMSA-N 435.871 4.605 50 10 IJGE Cc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccccc2F)c1 1865711374 WOCMWOJSPMHVMP-KRWDZBQOSA-N 428.389 4.616 50 10 IJGE Cc1nsc(Br)c1C(=O)N(Cc1ccccc1)[C@@H](C)CBr 1914196604 YPIIKQHTVFMZLR-JTQLQIEISA-N 432.181 4.640 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1F 1915104852 INIGHTYRPRFSOL-OAHLLOKOSA-N 434.758 4.797 50 10 IJGE Cc1ncnc(N(Cc2ccccc2)[C@H](CBr)C(C)C)c1Br 1915255799 RJRFSFPAMBDQCE-OAHLLOKOSA-N 427.184 4.974 50 10 IJGE CCc1nn(CC)c(CN(C)C[C@H](Br)COCc2ccccc2)c1Cl 1916371962 XETGQHIQOVZZCY-INIZCTEOSA-N 428.802 4.531 50 10 IJGE C[C@@H]1CCN(Cc2cccc(Br)c2Br)C[C@H]1Br 1943880793 KEAPXVAIJIJPGF-BXKDBHETSA-N 425.990 4.817 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCC[C@H]1CCBr 1945189679 XJJOGYGPPACWES-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE CC(C)(C)OC(=O)N1C[C@](C)([C@@H]2CCC[C@H](CI)O2)CC1(C)C 1992813517 JVYVRSCWHQEKFG-QWQRMKEZSA-N 437.362 4.785 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1cc(F)cc(Br)c1 2010827583 TTWNEWRIFLUKIA-UHFFFAOYSA-N 439.416 4.584 50 10 IJGE Cl[C@H](c1cc(I)cc2c1OCC2)C1CC(Br)C1 2020148680 QFOXKCORBJSSKS-KWPJZBAWSA-N 427.507 4.680 50 10 IJGE CC(C)N1C[C@@H](Br)[C@H](Cc2ccc(Br)cc2Br)C1 2039262900 RTHKVHHSGJOKAZ-BXUZGUMPSA-N 440.017 4.858 50 10 IJGE CN(C(=O)c1sccc1I)[C@@H]1CCCCC[C@H]1Br 2052430059 VISIRNXKARHUHC-MWLCHTKSSA-N 442.160 4.521 50 10 IJGE Cc1cc(C)cc(Cn2nc(CCl)c(I)c2C(F)(F)F)c1 2079210203 LGLWQHZJIDXGGE-UHFFFAOYSA-N 428.623 4.910 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CC2(CBr)CCCCCC2)C[C@@H]1C(F)F 2106784619 JVHFGCKENHNALP-GJZGRUSLSA-N 439.385 4.812 50 10 IJGE C[C@H](CCBr)CCN1C[C@H](c2ccccc2)[C@@H](NC(=O)OC(C)(C)C)C1 2106786182 STLZHRWOFRZHEM-QRQLOZEOSA-N 425.411 4.790 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@H]1CCN(Cc2ccccc2)C1 2128513718 QDQUOABKMPJFJF-INIZCTEOSA-N 433.781 4.731 50 10 IJGE ClCc1cc(Br)ccc1N1CC[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2129050225 CNXLZRPFSQRPPM-NHCUHLMSSA-N 435.793 4.668 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@@H](Br)c2cc(Cl)c(Br)s2)C1 2137224447 BGFAHVSJLXOYHU-VIRWGQHYSA-N 448.629 4.815 50 10 IJGE C[C@]1(Cn2c(CCCl)nc3cncc(Br)c32)CCN(Cc2ccccc2)C1 2151782805 DYNRERQEULPCHT-NRFANRHFSA-N 447.808 4.887 50 10 IJGE Cc1cc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)ncc1CBr 2151925570 OERCAADCBXLLRF-NMIHRBCNSA-N 426.402 4.632 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC12CCC(NC(=O)c1ccc(CBr)cc1)CC2 2162491238 WXGOPZTVBXZMDD-BATSVXPKSA-N 437.378 4.537 50 10 IJGE CCC(CC)(CBr)CN1C[C@H](CCNC(=O)C(F)(F)F)c2ccccc21 2163062128 JUJHNFSIIPHNEL-AWEZNQCLSA-N 435.328 4.860 50 10 IJGE CC(C)(C)[C@@H](CBr)CN1CCC([C@@H]2CCCN(C(=O)C(F)(F)F)C2)CC1 2163065181 YDOUFENVEOSMMJ-CVEARBPZSA-N 441.376 4.557 50 10 IJGE C[C@@H]1CCC(C)(C)CN1S(=O)(=O)c1cc(CBr)sc1Br 2179791312 PQYXEBVKCPKXCY-SECBINFHSA-N 445.242 4.605 50 10 IJGE CN(c1ccc(CBr)c([N+](=O)[O-])c1)[C@@H]1CN(Cc2ccccc2)C(C)(C)C1 2188575562 AFEPRBPEFPKKHE-IBGZPJMESA-N 432.362 4.979 50 10 IJGE C[C@@H]1[C@H](NC(=O)OC(C)(C)C)CC[C@@H](C(=O)N(C)C[C@H]2C[C@@H](Br)C2)C1(C)C 2196913594 DZNBBBUSGFIMGW-UHDSXZAQSA-N 445.442 4.584 50 10 IJGE C[C@H](CC1CCN(C(=O)[C@H](Br)C2CCCC2)CC1)N(C)C(=O)OC(C)(C)C 2203636459 BAOMZIKYHCBZAE-CRAIPNDOSA-N 445.442 4.824 50 10 IJGE Cc1ccc(-n2c(Cl)nc(Cl)c2CBr)c(I)c1 2217280899 NMPXIPYOMHDKLG-UHFFFAOYSA-N 445.913 4.987 50 10 IJGE C[C@@H](Br)CN(CC(C)(C)C)C(=O)c1cccc(I)c1 2272438855 NUVHFTKZMFRVRN-LLVKDONJSA-N 438.147 4.563 50 10 IJGE C[C@H](Cl)CN(C(C)(C)C)S(=O)(=O)c1cc(Br)ccc1Br 2288067563 FVSYBJAAOKYWHG-VIFPVBQESA-N 447.620 4.628 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@@H]1Cc1cc(I)ccc1Cl 2307339151 BNZVADWBUOPDAC-OUJBWJOFSA-N 429.523 4.676 50 10 IJGE N#CC(=Cc1cc(Br)c(N2CCOCC2)o1)c1cccc(C(F)(F)F)c1 2313543550 LATPYHJWLVYPTE-UHFFFAOYSA-N 427.220 4.962 50 10 IJGE COC(=O)c1c(NC(=O)C(C#N)=Cc2ccc(N3CCCCC3)o2)sc2c1CCCC2 2314646731 LKLXPCSOAJCMQK-UHFFFAOYSA-N 439.537 4.542 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)C3(CC3)C2)cc1I 2315552060 ZBIRDTQKOOMZHD-ZDUSSCGKSA-N 440.550 4.694 50 10 IJGE Clc1ccc(CN2CCC[C@H](CCBr)C2)c(I)c1 2318543117 YZSXZXBOHVHCKU-LLVKDONJSA-N 442.566 4.942 50 10 IJGE COc1ccc(Cc2nc3ccc(C(=O)NN=Cc4c(F)cccc4Cl)cc3[nH]2)cc1 2323720862 MYUGNGDMYGNPIC-UHFFFAOYSA-N 436.874 4.719 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CBr)OCc1cccc(C(F)(F)F)c1 2327977004 ARZOEBVTKRZDMR-MRXNPFEDSA-N 426.273 4.900 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CBr)OCc1cccc(CC(F)(F)F)c1 2353124006 PJWFXYGQWDAAMA-KRWDZBQOSA-N 440.300 4.986 50 10 IJGE Cc1cc2c(c(=O)n1Cc1ccccc1)[C@@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 2204606 FAUUZGNNRDGVOS-FQEVSTJZSA-N 438.314 4.730 50 10 IJGE CCc1ccc(OCC(=O)N/N=C/c2cc(Cl)cc(Cl)c2O)c(Br)c1 13977521 VBXKYXZBECRVHA-ODCIPOBUSA-N 446.128 4.553 50 10 IJGE Cc1ccc(Oc2ncnc(NNC(=O)c3cccc4ccccc34)c2[N+](=O)[O-])cc1C 40658768 VNERPLDEKHQXAX-UHFFFAOYSA-N 429.436 4.704 50 10 IJGE CCCCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C(\C#N)C(=O)OC)cc2OC)cc1 40864808 GRRJRDJHMBRNNS-DUNXJPOSSA-N 435.476 4.573 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C/c2ccc(Cl)cc2)c(OC)c1 40970395 SYKAXKSTQXKOSA-PJBLTWOLSA-N 438.911 4.791 50 10 IJGE CCOc1cccc(NC(=O)/C(C#N)=C/c2cc(Br)c(N3CCCC3)o2)c1 59250110 UIWVZNULFBFRAT-GXDHUFHOSA-N 430.302 4.587 50 10 IJGE C=CCOc1cc(Br)c(/C=N/NC(=O)c2cc3ccccc3o2)cc1OCC 59680206 XONUOAXPEKFNBD-YDZHTSKRSA-N 443.297 4.923 50 10 IJGE Cc1cccc(N2C(=O)c3ccc(C(=O)Nc4nc(CCl)cs4)cc3C2=O)c1C 170535204 JPNPVLVPILCDIU-UHFFFAOYSA-N 425.897 4.552 50 10 IJGE CCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C(/C#N)C(=O)NCc3ccco3)cc2)cc1 206687611 PCPCVOXRJADKQN-PXSLEKJFSA-N 442.471 4.520 50 10 IJGE CCCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccc(C)cc3)c(OC)c2)C1=O 214231072 YLMXGASWDXZPLS-HMAPJEAMSA-N 444.531 4.975 50 10 IJGE C[C@@H](Br)C1CCN(c2ncc(Br)cc2Br)CC1 235149013 IUHBYAMAADTJSK-MRVPVSSYSA-N 426.978 4.606 50 10 IJGE O=C(CCn1c2ccccc2c2ccccc21)NN=Cc1cc(Br)ccc1O 252608377 HKHZWRVBYSOOCP-UHFFFAOYSA-N 436.309 4.803 50 10 IJGE C[C@H](CNC(=O)c1cc(Br)sc1Br)C[C@@H](C)Br 397721924 KLDKMGLDHXFPLJ-NKWVEPMBSA-N 448.018 4.813 50 10 IJGE CC[C@H]1CN(C(=O)c2cc(Br)sc2Br)C[C@H]1Br 400008742 MVSDFKKDXUOHRT-POYBYMJQSA-N 446.002 4.519 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccc([C@@H]2CCN(S(N)(=O)=O)c3ccccc32)cc1 616675542 GPGWTCNVQJFBJZ-IBGZPJMESA-N 432.662 4.754 50 10 IJGE ClCc1cc(Br)cc(Br)c1OCCCO[C@@H]1CCOC1 699529679 GKRVIPRIWDERNT-GFCCVEGCSA-N 428.548 4.525 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2ccc(-c3ccc(Cl)cc3)o2)cc1 725379832 GVAREHIOBZUPLO-NRFANRHFSA-N 426.900 4.963 50 10 IJGE COc1ccccc1-c1ccc([C@@H](C)NC(=O)NNC(=O)c2cn(C)c3ccccc23)cc1 743508725 RPURXICCUVDUJS-QGZVFWFLSA-N 442.519 4.559 50 10 IJGE O=C(NCc1ccc(COCc2ccccc2)cc1)NNC(=O)c1cccc2ccccc12 743534228 GTHODVWPRHCWRT-UHFFFAOYSA-N 439.515 4.701 50 10 IJGE Cc1ccc(-n2nc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c3c2CCC3)c(C)c1 799753693 OEIVBKQUQMNHGM-UHFFFAOYSA-N 439.441 4.625 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706289 SIFAANNLMSPTDT-HXUWFJFHSA-N 449.898 4.664 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc3ccccc23)[C@@H]1c1ccccc1O 1865707803 GSPYWKQZBVYOJE-LJQANCHMSA-N 448.404 4.968 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@@H](c1ccccc1OC)C(C#N)=C(N)O2 1865710167 QAIMFPBIOSUDSJ-QHCPKHFHSA-N 428.536 4.728 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CN(C(=O)OC(C)(C)C)C2(CCCC2)C1 1882088796 UNMYYNUNGLUOSE-GJZGRUSLSA-N 447.414 4.844 50 10 IJGE Cc1cc(Br)c([C@@H](Br)c2cc(Br)n(C)n2)s1 1937821635 LDGATXMUNHNKNN-VIFPVBQESA-N 428.975 4.799 50 10 IJGE BrC[C@@H]1CSCCN1Cc1ccc(Br)cc1Br 1943858700 JMDKMLYRFJOWQG-LLVKDONJSA-N 444.030 4.524 50 10 IJGE Clc1nc(N2C[C@H]3C[C@@H](CN(Cc4ccccc4)C3)C2)sc1CBr 1949586784 WEOXDVHCGDGJMK-GJZGRUSLSA-N 426.811 4.650 50 10 IJGE BrCc1ccc(Br)cc1OCCOCCOCc1ccccc1 1983395067 KOWURHXGGPUHJG-UHFFFAOYSA-N 444.163 4.956 50 10 IJGE CN(CC1CC(Br)C1)c1cccc(Br)c1CBr 2020224323 BUECEASOOKZCIF-UHFFFAOYSA-N 425.990 4.954 50 10 IJGE BrC[C@]1(Cc2cc(Br)ccc2Br)C[C@@]12CCOC2 2054720901 ZYXFZFAZPQZGMP-KGLIPLIRSA-N 438.985 4.946 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1C(=O)c1cc(Br)ccc1Br 2073318278 AIHGTFHEDNNWML-PRHODGIISA-N 439.973 4.600 50 10 IJGE CC1(C)CN(Cc2ccccc2)[C@H](Cn2c(Cl)nc(Cl)c2CBr)CO1 2074185191 PFZQRKOQIQHLSR-CQSZACIVSA-N 447.204 4.764 50 10 IJGE C[C@H]1CCN(Cc2ccc(I)c(Cl)c2)C[C@@H]1CBr 2086659010 SFHKLFZPQITKES-JQWIXIFHSA-N 442.566 4.798 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](C)CC[C@@H]1CNC(=O)C(F)(F)F 2106784714 KREKQSZWKCQAGY-LSDHHAIUSA-N 429.365 4.747 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCC([C@H](F)CCl)CC1 2106949095 YKCVGIYWOUYGDX-SECBINFHSA-N 433.568 4.702 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CCCCCBr)C[C@@H]1c1ccccc1 2129066304 CTASBZUSJMRIFU-RTBURBONSA-N 425.411 4.792 50 10 IJGE C[C@@]1(CNc2ncc(I)cc2Br)CCC[C@H]1Cl 2249866241 XJXZGSFETVLIBR-PWSUYJOCSA-N 429.527 4.658 50 10 IJGE Fc1ccccc1[C@H](CI)OC1CCN(Cc2ccccc2)CC1 2250387071 NQPHEFLAENNOKM-FQEVSTJZSA-N 439.312 4.983 50 10 IJGE CC[C@@H]1OCC[C@@H]1[C@@H](Br)c1ccc(OC)c(I)c1 2257368513 HYCZZOSFQFKUEG-JKOKRWQUSA-N 425.104 4.551 50 10 IJGE COc1ccnc(N(C)[C@@H]2C[C@@H]3C[C@H](OCc4ccccc4)C[C@@H]32)c1CBr 2281103767 SCIZSCMHJYXPHP-CGBFIWBNSA-N 431.374 4.805 50 10 IJGE COc1ccc(NC(=O)C(C#N)=Cc2ccc(OC(=O)c3cccs3)c(OC)c2)cc1 2297382377 XFIMFBXIHZMFHM-UHFFFAOYSA-N 434.473 4.530 50 10 IJGE C=CCOc1ccc(Br)cc1C=C(C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1C 2297400017 YUFWWFZHWVGDJM-UHFFFAOYSA-N 442.269 4.776 50 10 IJGE Cc1cc(I)c(OC[C@@H](Br)C(F)(F)F)cc1Cl 2299800063 XNVCCDUOACOEML-SECBINFHSA-N 443.428 4.958 50 10 IJGE C[C@H]1[C@H](Br)CCCN1Cc1ccc(Cl)c(I)c1 2300239136 UNVUTUTXRDVMOE-GXSJLCMTSA-N 428.539 4.692 50 10 IJGE COc1c(Br)cc(C)c([C@H](Br)C2COC2)c1Br 2301491689 HDYGWJAPEXCBPD-SNVBAGLBSA-N 428.946 4.611 50 10 IJGE CC1=C(C#N)C(=O)N(CCc2ccccc2)C(=O)C1=Cc1ccc(-c2ccc(F)cc2)o1 2314617101 QRQPNWDBPCPLQL-UHFFFAOYSA-N 426.447 4.921 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cc2c(s1)CCSC2 2320362580 ZFKJADLTISAIHY-MRXNPFEDSA-N 440.428 4.638 50 10 IJGE CN(C(=O)C(C#N)=CN1CCN(C(c2ccccc2)c2ccccc2)CC1)C1CCCCC1 2324537072 NBWGZAKSQGIQJN-UHFFFAOYSA-N 442.607 4.592 50 10 IJGE C[C@H](NC(=O)C(C#N)=CNc1ccc(Cl)c([N+](=O)[O-])c1)C12CC3CC(CC(C3)C1)C2 2324900484 YZPZRCQQAHTFCI-QRYOHXEKSA-N 428.920 4.789 50 10 IJGE CC[C@@H](NC(=O)C(C#N)=CNc1cc([N+](=O)[O-])ccc1OC)c1ccc2c(c1)CCCC2 2325092633 BSZPJNJNVMYAKG-OAQYLSRUSA-N 434.496 4.569 50 10 IJGE CC(C)(C)[C@@](C)(CBr)Cn1ccnc1CCCN1C(=O)c2ccccc2C1=O 2327111716 DLURTLFUAUJMPO-QFIPXVFZSA-N 446.389 4.559 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC(F)(F)C[C@@H]1CN(CCCCCCBr)C2 2344057612 XBCPHWWWMKFEEB-QAPCUYQASA-N 439.385 4.956 50 10 IJGE CC(C)(C)[C@H]1[C@H](Cl)CCN1C(=O)c1ccc(Cl)cc1I 2365591195 KNTGVBYBKDLNNJ-DGCLKSJQSA-N 426.125 4.813 50 10 IJGE CC[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)[C@H](C)Oc1ccc(C)c(C)c1 10153421 BVNMDCCBNMCPOC-CPJSRVTESA-N 446.547 4.743 50 10 IJGE C=CCOc1ccc(Br)cc1/C=C(/C#N)c1nn(-c2ccccc2)c(N)c1C#N 33475773 WTQDKKWCWFIWKH-WJDWOHSUSA-N 446.308 4.718 50 10 IJGE CC[C@H]1CCC/C1=N/NC(=O)COc1c(C)cc(Br)cc1Br 100057412 OBBZSPMYKYLWLU-UXNQKTKSSA-N 432.156 4.581 50 10 IJGE COC(=O)c1c(-c2ccccc2)csc1NC(=O)/C(C#N)=C\c1ccc(OC)c(OC)c1 206250521 FZAWZELRWIYSHK-BOPFTXTBSA-N 448.500 4.765 50 10 IJGE CCCCOc1ccc(OCC(=O)NN=Cc2ccc(OCc3ccccc3)cc2)cc1 254840771 NZADJAUHDBHFRX-UHFFFAOYSA-N 432.520 4.974 50 10 IJGE Cn1cc(CC(CCl)(CCl)c2cccc(Br)c2)c(Br)n1 714087956 FSXSLMSZHRUQDP-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE Cc1ccc(C(=O)NNc2ccc(S(C)(=O)=O)cc2)c(Sc2ccc(Cl)cc2)c1 759970633 ICXOKEXKRQRWKE-UHFFFAOYSA-N 446.981 4.960 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)n3ccc(=NCC(F)(F)F)cc3)c2C)c1 775493109 HFPKOCMFXRJONS-DEDYPNTBSA-N 438.453 4.914 50 10 IJGE CCc1c(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cnn1-c1cccc(Cl)c1 799751210 QTLJAJQQXIAQGG-UHFFFAOYSA-N 433.821 4.735 50 10 IJGE N#Cc1ccc(NNC(=O)c2nc(-c3ccccc3)n3c2CCCCC3)c(C(F)(F)F)c1 799754937 VZPKCBMKQDHXMK-UHFFFAOYSA-N 439.441 4.924 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2C[C@H]3CCC[C@@H](C3)C2)c(-c2ccc(Cl)cc2)n1 804342463 HJWRFOABDRDZKO-AJOUPAOOSA-N 433.943 4.673 50 10 IJGE COc1ccc(C(=O)NN=Cc2cc(C)n(-c3ccc(Br)cc3)c2C)cc1 1084119823 VWLYXKGFAUBIHL-UHFFFAOYSA-N 426.314 4.629 50 10 IJGE BrC[C@H](CN1CCC[C@H]1c1ccc(I)cc1)C1CC1 1307642806 INHVKEHYSGQXFL-ZBFHGGJFSA-N 434.159 4.849 50 10 IJGE C#CCN(C(=O)CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)C1CCCCC1 1442749169 ARSCLZQHMIRPPV-UHFFFAOYSA-N 447.695 4.748 50 10 IJGE Cc1ccc(NNC(=O)CCc2nc(O)c3c4c(sc3n2)C[C@H](C)CC4)c(Cl)c1 1449704464 RCLCCAXQZIFMRC-GFCCVEGCSA-N 430.961 4.559 50 10 IJGE C=C[C@@H](C(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1)c1ccccc1 1540396019 NKIDKADHLMOZHF-JOCHJYFZSA-N 434.923 4.958 50 10 IJGE C#Cc1ccc(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)cc1 1558728287 VRBNHTYSAZAFTC-XMHGGMMESA-N 425.879 4.644 50 10 IJGE C=C(CBr)CN1CCN(c2ccc(Br)cc2C(F)(F)F)CC1 1559521974 SXYJTWLCNGNAGS-UHFFFAOYSA-N 442.117 4.541 50 10 IJGE CCn1c(O)nc2cc(C(=O)NNc3cc(C(F)(F)F)cc(C(F)(F)F)c3)ccc21 1628398381 PHIKVXCZFZKQBT-UHFFFAOYSA-N 432.324 4.556 50 10 IJGE Cc1cc(C(=O)NNc2nc3ccccc3[nH]c2=S)nn1-c1ccc(Cl)c(Cl)c1 1646017375 KOERATMVAOEEQC-UHFFFAOYSA-N 445.335 4.850 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2cc(C)ccc2C)c1 1865690736 ZWDGPBDKPJHKKG-HSZRJFAPSA-N 428.536 4.728 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)N[C@@H](CC(C)C)C(=O)Nc2ccc3ccccc3c2)cc1 1866126711 JIABUPGQWYFYJH-DIXABZHVSA-N 441.531 4.925 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cc(F)ccc1Cl 1915077451 IKVLCGDZDIQGOT-CQSZACIVSA-N 434.758 4.844 50 10 IJGE C[C@H]1C[C@H]1N(CCBr)Cc1c(Br)cccc1Br 2002028816 GFQXYEOGDWDHNZ-TVQRCGJNSA-N 425.990 4.817 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1Cc1cc(Br)ccc1Br 2006498636 FBCMLJYWUPTMPY-SKDRFNHKSA-N 425.990 4.959 50 10 IJGE C[C@H]1CN(Cc2cc(Br)ccc2Br)C[C@H]1CBr 2006500103 MNHNAXLTHBIPJK-GXSJLCMTSA-N 425.990 4.674 50 10 IJGE CCOc1c(Br)cc(C[C@H](CBr)OC)cc1Br 2008748220 IXYZZLNXGDMRBZ-SECBINFHSA-N 430.962 4.563 50 10 IJGE ClC[C@@H](Nc1ncc(I)cc1Br)c1cccs1 2015762105 HHPNPEHFOZGBLM-SECBINFHSA-N 443.535 4.902 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1Br)c1c(Br)cccc1Br 2033081485 FXGSIJFOQDKLHJ-LDYMZIIASA-N 439.973 4.648 50 10 IJGE Cc1sc(Br)c(C(=O)NCCCCCCI)c1C 2039503908 TZDKBUTVOINHIT-UHFFFAOYSA-N 444.176 4.853 50 10 IJGE F[C@]1(CBr)CCCN(Cc2ccc(Br)cc2Br)C1 2039795651 XUYCREUUINLRAW-ZDUSSCGKSA-N 443.980 4.911 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc([S@](C)(=O)=NC(=O)CCCCBr)c1 2044529719 AHBORTFZNIZXFM-VWLOTQADSA-N 433.368 4.582 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)C[C@@H]1C[C@@H]1C(C)(F)F 2046142675 WUXPACCCRSNOEQ-ULQDDVLXSA-N 438.378 4.529 50 10 IJGE COc1ccc(OC)c(-n2nc(CBr)c(Br)c2C(F)(F)F)c1 2079235924 JUMRBLUTANUQFX-UHFFFAOYSA-N 444.045 4.566 50 10 IJGE BrCc1ccc2c(c1)CN(Cc1ccc(I)cc1)C2 2111210020 YNXTXSVXWRJXMR-UHFFFAOYSA-N 428.111 4.702 50 10 IJGE O=S(=O)(c1cc(F)c(Cl)c(CCl)c1)N(Cc1ccccc1)C[C@H]1CCCO1 2152214198 BJOWEISNBMONDX-MRXNPFEDSA-N 432.344 4.588 50 10 IJGE O=C(N[C@H](CBr)CC1CCOCC1)c1ccccc1OCc1ccccc1 2195483645 QSCGUKIFRIUIAW-IBGZPJMESA-N 432.358 4.576 50 10 IJGE C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CC(C)(C)CN1CCCCCI 2211183078 BSCZHSKMRRDONF-GJZGRUSLSA-N 438.394 4.605 50 10 IJGE CC(C)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1CCCCCI 2211187124 ZNSWHWIUQDTXLN-MRXNPFEDSA-N 438.394 4.559 50 10 IJGE CN(Cc1sccc1I)C1CCC(CBr)CC1 2301078464 IQZBWNFNZZEOAQ-UHFFFAOYSA-N 428.177 4.738 50 10 IJGE CC[C@H](Br)C(=O)c1c(C)cc(Br)c(OC)c1Br 2301503277 SDNXSRXWKUCKPH-ZETCQYMHSA-N 428.946 4.885 50 10 IJGE C[C@H](CCCBr)CNCc1ccc(Cl)cc1I 2302314756 AKHWANHRMMMTLL-SNVBAGLBSA-N 430.555 4.845 50 10 IJGE Cl[C@H]1CCCCN(Cc2ccc(I)c(Br)c2)C1 2306215867 ZVPCANANNLEYTG-NSHDSACASA-N 428.539 4.647 50 10 IJGE C[C@H](CBr)CN1CC[C@@H](CCNC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2315864886 WQTDTASGPSHVMA-MCIONIFRSA-N 431.337 4.575 50 10 IJGE COc1ccc([C@H](C)NC(=O)C(C#N)=CN[C@H](C)c2ccc3c(c2)CCCC3)cc1OC 2325044961 OPCXVARRIOFILS-MSOLQXFVSA-N 433.552 4.518 50 10 IJGE CC(C)(C)OC(=O)NCCCC[S@](C)(=O)=NC[C@@](C)(CBr)C(C)(C)C 2327074981 CXMQEZNRPJUTBE-CJAUYULYSA-N 441.476 4.836 50 10 IJGE C[C@](CI)(OCC1CC(F)C1)c1ccccc1Br 2327340109 FMUMOMSVGCVQMP-QIMFLAQGSA-N 427.095 4.864 50 10 IJGE Clc1ccc(I)cc1CN1[C@H]2CC[C@H]1CC(Br)C2 2327409240 LUKDUNGSCKMPJO-STQMWFEESA-N 440.550 4.835 50 10 IJGE Cn1nc(C(F)F)c(CBr)c1N1CCCN(Cc2ccccc2)C(C)(C)C1 2365278798 WGACRBOUTUJBJZ-UHFFFAOYSA-N 441.364 4.744 50 10 IJGE CC(C)[C@H]1C[C@H](Br)CN1C(=O)c1cc(Br)c(F)cc1Cl 2370882776 GWFNXKRNSFPZJG-ISVAXAHUSA-N 427.539 4.876 50 10 IJGE COc1ccc(/C(C#N)=C\c2cccc(OC(=O)c3cccc(NC(C)=O)c3)c2)cc1OC 31902972 BQUCYKCAQCQFGO-MTJSOVHGSA-N 442.471 4.946 50 10 IJGE CC1CCC(NC(=O)[C@H](c2ccc(F)cc2)N(CCc2ccccc2)C(=O)CCl)CC1 97914696 BRYUWUCQLRHIFL-RWRPHHHKSA-N 444.978 4.872 50 10 IJGE COc1ccccc1CN(C(=O)CCl)[C@@H](C(=O)NC1CCCC1)c1ccc(Cl)cc1 97915035 ZMPHQDYJMDXKQG-JOCHJYFZSA-N 449.378 4.716 50 10 IJGE C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@@H]3[C@@H]1CC/C2=N/NC(=O)c1cccc([N+](=O)[O-])c1 105436440 PEVAPRZFSJGMGN-HPAITCNKSA-N 433.508 4.943 50 10 IJGE COc1cc(/C=N\NC(=O)Cc2ccc(Cl)cc2)ccc1OCc1ccccc1F 169902004 ZZIKTKIRYCYDFK-WGARJPEWSA-N 426.875 4.760 50 10 IJGE O=C(N/N=C/c1ccc(OCc2ccccc2)cc1)c1nn(-c2ccccc2)c2c1CCC2 169927633 HKYAJZDIQJNZJY-MTDXEUNCSA-N 436.515 4.704 50 10 IJGE CC[C@@H](Br)C(=O)Nc1nc2scc(-c3ccc(Cl)cc3Cl)n2n1 170486891 OZWZHDCPGQJLCW-SECBINFHSA-N 434.146 4.877 50 10 IJGE N#C/C(=C/Nc1ccc(Nc2ccccc2)cc1)C(=O)N1CCN(c2ccc(F)cc2)CC1 217237305 AYOPOEBQQRJSEO-VXPUYCOJSA-N 441.510 4.737 50 10 IJGE CC[C@H](Br)c1nnc(-c2cc(Cl)ccc2I)o1 233989012 QJOYDQNUFFEBRD-QMMMGPOBSA-N 427.467 4.841 50 10 IJGE O=C(Nc1ccccc1C(=O)NN=Cc1ccc(OCc2ccccc2)cc1)c1ccco1 254396195 JAZPINWRUDOARD-UHFFFAOYSA-N 439.471 4.875 50 10 IJGE CC(C)(C)C(=O)[C@@H](Br)Cc1cc(I)ccc1Cl 304215841 YRETZKYPPMKJRK-JTQLQIEISA-N 429.523 4.866 50 10 IJGE CSc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CI)cc1 382700830 YJEHPILNCCOHBA-HIFRSBDPSA-N 433.355 4.794 50 10 IJGE Cc1ccsc1[C@H]1CN(C(=O)OCc2ccccc2)C[C@@H]1CI 394745640 ZZVIBZWGJIRFHP-HOTGVXAUSA-N 441.334 4.844 50 10 IJGE Cc1ccc([N+](=O)[O-])cc1-c1ccc(C=NNC(=O)c2ccccc2Br)o1 1083967861 QEYZRHLVRAKALD-UHFFFAOYSA-N 428.242 4.690 50 10 IJGE O=C(NN=Cc1ccccc1Oc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccncc1 1084226685 AGBAZJNFXPQYIG-UHFFFAOYSA-N 430.342 4.565 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNC(=S)Nc2cc(C)ccc2F)cc1 1633764174 VDOPJDAMJOUJOM-UHFFFAOYSA-N 436.512 4.712 50 10 IJGE C/C(=C\C(=O)NNc1ccccc1I)c1ccccc1C(F)(F)F 1643723410 VGVJAVUVXJWTBO-ZHACJKMWSA-N 446.210 4.857 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2Cc1ccccc1 1865691727 ZNZKUZZGQBMFFI-QHCPKHFHSA-N 426.520 4.667 50 10 IJGE N#C/C(=C(/O)CCN1C(=O)c2ccccc2C1=O)c1nc(-c2ccc(F)cc2F)cs1 1872817890 CBYLMMXWRNQENV-MNDPQUGUSA-N 437.427 4.567 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C1(C)C 1882086269 AARLRZZRWDBISQ-APIJFGDWSA-N 447.414 4.556 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1cccc(Cl)c1Br 1882087427 JRFUPLKQROSMTP-SNVBAGLBSA-N 427.564 4.933 50 10 IJGE O=C(c1cc(F)cc([N+](=O)[O-])c1F)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915263638 HOGLOKZHDKQMCU-QGZVFWFLSA-N 439.256 4.689 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H](C)N(c2nc3sccn3c2CBr)C1 1921469087 IMXHDKFEXVDEMO-HOTGVXAUSA-N 433.419 4.638 50 10 IJGE CCn1ncc(Br)c1[C@@H](Br)Cc1ncccc1Br 1924877767 HACFKQYDUXPZLX-VIFPVBQESA-N 437.961 4.502 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]3(CCC[C@@H](CI)O3)CC[C@@H]21 1935705002 BJUPSZIDYHZWDY-LDDOYCOJSA-N 435.346 4.539 50 10 IJGE C[C@@H]1[C@H](CBr)CCN1Cc1cccc(Br)c1Br 1943880168 AZPGTAPQPPANDR-ZJUUUORDSA-N 425.990 4.817 50 10 IJGE CC1(C)C[C@H](Br)CN1Cc1cc(Cl)ccc1I 1949215732 OGMMAXDEKPCIFA-JTQLQIEISA-N 428.539 4.692 50 10 IJGE C[C@H]1C[C@@H](CBr)CN1Cc1cc(Cl)ccc1I 1950510331 LZAJMRSQEQYRJQ-UWVGGRQHSA-N 428.539 4.550 50 10 IJGE COc1cc(CBr)cc(Br)c1OCC1(Br)CC1 2002768442 QJISESHZDYCMQU-UHFFFAOYSA-N 428.946 4.659 50 10 IJGE CC[C@@H](Cl)CN(CC)C(=O)c1cc(I)ccc1Br 2044540282 AQGZFPKYXFXHCH-SECBINFHSA-N 444.538 4.533 50 10 IJGE CN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)C(C#N)=C2Nc3ccccc3S2)cc1 2053513345 NLHXSPNKQXQFOS-UHFFFAOYSA-N 447.541 4.647 50 10 IJGE C[C@H](CCBr)CCN1C[C@@H](NC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2106786180 STLZHRWOFRZHEM-NZSAHSFTSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H](N(C[C@H](CBr)C1CC1)C1CC1)C(F)(F)F 2106788753 SFSOXFWTLVEHAI-ZFWWWQNUSA-N 443.348 4.718 50 10 IJGE Fc1c(CN2CCS[C@H](CCBr)C2)ccc(Cl)c1Br 2110525380 CFAFVSMBKKVDEJ-SNVBAGLBSA-N 431.596 4.944 50 10 IJGE CC1(C)C[C@@H](O[C@](C)(CI)c2ccccc2Br)CO1 2115709184 YVUGRGWQWZEZHE-IAQYHMDHSA-N 439.131 4.683 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2OCCN(CCCCCCCCCBr)[C@H]2C1 2185534914 XLRFJXDPNZOTBF-RBUKOAKNSA-N 447.458 4.822 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@H]1C[C@@H](C(C)(C)C)CN(C(=O)OC(C)(C)C)C1 2196908342 XFGRECCYHAZLPH-MWDXBVQZSA-N 445.442 4.538 50 10 IJGE CC(C)(C)OC(=O)NC1(c2ccccc2NC(=O)N2CCC(Br)CC2)CC1 2199684622 RIWGZNFJVSCRIT-UHFFFAOYSA-N 438.366 4.592 50 10 IJGE CN(CCCCCI)c1ccc(CNC(=O)OC(C)(C)C)cc1 2211191094 OSWYSURXFUKCDC-UHFFFAOYSA-N 432.346 4.753 50 10 IJGE FC1(F)[C@@H]2CC[C@H](O[C@H](CI)c3ccc(Br)cc3)[C@@H]21 2230422053 WGWBXMWFQKVSDR-YVECIDJPSA-N 443.069 4.986 50 10 IJGE FC1(F)C[C@H]1Cn1c(CCCl)nc2cc(Br)c(Br)cc21 2234066442 MDXMDHFKBPEOPT-ZETCQYMHSA-N 428.502 4.998 50 10 IJGE CC[C@H]1[C@H](Br)CCN1Cc1ccc(Br)cc1Br 2251034413 VQAQUSIQPUBQTO-YPMHNXCESA-N 425.990 4.959 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1C(=O)c1cccc(Br)c1Br 2260389009 SIYFPLLNCWZJTK-ONGXEEELSA-N 439.973 4.600 50 10 IJGE Cc1ccc(I)c(C(=O)N(C[C@H](C)Br)C(C)(C)C)c1 2272458503 YFHTZMRCJZDRMM-NSHDSACASA-N 438.147 4.624 50 10 IJGE O=C(NCC1(CBr)CC(F)(F)C1)c1c(Cl)cccc1Br 2281658355 MROHEMJSZYTXLP-UHFFFAOYSA-N 431.502 4.643 50 10 IJGE N#CC(=Cc1cccc(Br)c1)c1nc(O)c2cc(Br)ccc2n1 2293858453 YUHKSFCXVIDTPT-UHFFFAOYSA-N 431.087 4.925 50 10 IJGE CCC[C@H](CCBr)NCc1ccc(Cl)c(I)c1 2300240672 OWQCKNRMSWJNDT-LLVKDONJSA-N 430.555 4.988 50 10 IJGE C[C@@H]1C[C@@H]1N(CCBr)Cc1cc(I)ccc1Cl 2307332301 MUSJHQWVGCNGHL-RNCFNFMXSA-N 428.539 4.550 50 10 IJGE C[C@@H](c1ccncc1Br)[C@@H](Br)c1c(Br)ncn1C 2315592686 ZSCSVCGUWHCARN-OIBJUYFYSA-N 437.961 4.580 50 10 IJGE COc1ccc(CCC(CBr)(CBr)OC)c(Br)c1 2317254538 GABPNVOWXFWQIC-UHFFFAOYSA-N 444.989 4.565 50 10 IJGE Cc1ccc2nc(-c3ccc(NC=C(C#N)C(=O)N4C[C@H](C)O[C@@H](C)C4)cc3)sc2c1 2318455278 QEULCJZEPLBXKE-IRXDYDNUSA-N 432.549 4.727 50 10 IJGE C[C@H]1CC[C@@H](CBr)N(Cc2ccc(Cl)cc2I)C1 2318512122 QAWYCTGPHUYIOR-GWCFXTLKSA-N 442.566 4.940 50 10 IJGE O=C(C=Cc1ccc(OCc2ccccc2)cc1)Nc1nnc(CCBr)s1 2320547470 LUXVULFDBSRRBB-UHFFFAOYSA-N 444.354 4.706 50 10 IJGE ClC[C@]12CC[C@H]1CN(Cc1ccc(I)c(Br)c1)C2 2325211603 KFJFRLKHIZIYFO-FZMZJTMJSA-N 440.550 4.505 50 10 IJGE Fc1c(Br)cc(Cl)c([C@@H](Cl)C2COCCOC2)c1Br 2337090168 KEDKYEDKNIUZAY-NSHDSACASA-N 436.930 4.947 50 10 IJGE CC(C)N(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2351887531 AIAMEXUODOVFAZ-MAUKXSAKSA-N 439.385 4.907 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2ccccc2OCc2cccc(C)c2)cc1 58895485 XHQKQEHYJPQRSE-AEJDXJHNSA-N 446.547 4.937 50 10 IJGE CCOc1cc(/C=N/NC(=O)c2cc3ccccc3o2)c(Br)c(Cl)c1O 59305494 ZIWOLPJLXCYPGK-ZVBGSRNCSA-N 437.677 4.717 50 10 IJGE CC(=O)c1ccc(-c2ccc(/C=C3/C(=O)N(Cc4ccccc4)C(=O)C(C#N)=C3C)o2)cc1 101335087 PSPNOFQAKSZIOS-OEAKJJBVSA-N 436.467 4.942 50 10 IJGE Cn1c(=O)oc2cc([C@@H](Cl)c3cc(Br)ccc3Br)ccc21 161096991 ZZLRHOFRWYUQLR-CQSZACIVSA-N 431.511 4.985 50 10 IJGE O=C(NC[C@H]1CC[C@H](Br)C1)c1cc(Br)sc1Br 227675718 RBWGEZZGVODRME-BQBZGAKWSA-N 446.002 4.567 50 10 IJGE CC[C@](C)(CBr)NC(=O)c1cc(Br)sc1Br 234115497 KOMGMQAHOUNLRH-SNVBAGLBSA-N 433.991 4.567 50 10 IJGE Cc1ccccc1NNC(=O)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 739387873 QUAIPVMCTWOBFF-UHFFFAOYSA-N 445.779 4.942 50 10 IJGE Cc1cccc2c(CCNC(=O)/C(C#N)=C\c3cn(CCC#N)nc3-c3ccccc3)c[nH]c12 741704591 FYSNYLGNFFGDHJ-JCMHNJIXSA-N 448.530 4.519 50 10 IJGE COc1cc(Oc2ccccc2)ccc1NC(=O)NNC(=O)c1cccc2cccnc12 757755756 KTHBOSAVLFYMCW-UHFFFAOYSA-N 428.448 4.502 50 10 IJGE COc1cccc(/C=C(/C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)c1OCc1ccccc1 1084017492 WFAMXORLPRXKCM-UYRXBGFRSA-N 429.432 4.728 50 10 IJGE COc1ccc(C(=O)NN=Cc2c(Br)c(C)n(-c3cccc(C)c3)c2C)cc1 1084530878 QPLDMJUHBPNKQU-UHFFFAOYSA-N 440.341 4.938 50 10 IJGE O=C(NN=Cc1c[nH]nc1-c1ccc(C(F)(F)F)cc1)c1ccc(Br)cc1 1320892741 CBYTYYLYQWIJHU-UHFFFAOYSA-N 437.219 4.622 50 10 IJGE C=CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccc(Br)cc1Cl 1450650696 HJRWONHKQSDPFW-OAHLLOKOSA-N 446.773 4.795 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)Cc2coc3c(Cl)c(Cl)ccc23)c1C 1457668006 DWLJCWCPGOUXHO-UHFFFAOYSA-N 442.306 4.894 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)C2(c3ccc(Cl)cc3Cl)CCCC2)c1 1558200001 PXGXXCBKOGVEQU-UHFFFAOYSA-N 432.376 4.804 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)c1C 1650818165 WLZRASAHAWFQSR-AEFFLSMTSA-N 425.895 4.585 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1cc(C)ccc1C 1865704126 NZJPTHJBXLDITL-DEOSSOPVSA-N 428.536 4.864 50 10 IJGE COCCOc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2-c2ccccc2OC)cc1 1866213768 BMOSKHXSFVKMEW-LVZFUZTISA-N 428.488 4.933 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C[C@@H]1CN(C(=O)OC(C)(C)C)CC12CCC2 1883484715 BPDKHTIHCNFSOT-CABCVRRESA-N 447.414 4.702 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Cl)Cc1ccc(Cl)c(Br)c1F 1905344650 WCWWKSMZYLUPGW-SNVBAGLBSA-N 431.088 4.688 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H](C)N(c2cc(CBr)sc2[N+](=O)[O-])C1 1921470454 QQHKJIUAIPFJAO-GJZGRUSLSA-N 438.391 4.898 50 10 IJGE FC(F)C[C@@H](CBr)NCc1c(Br)cccc1Br 1945329742 OUMOIGJEQRQQOJ-ZETCQYMHSA-N 435.932 4.720 50 10 IJGE CC(C)C1CC(OC2(CI)CCN(C(=O)OC(C)(C)C)CC2)C1 1987763782 MUYMSRJLXMCGFD-UHFFFAOYSA-N 437.362 4.642 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OCC2CC3(CCC3)C2)CC1 2017329768 QHOHQUVTJZFXBZ-UHFFFAOYSA-N 449.373 4.788 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1Cc1cc(Cl)ccc1I 2018105817 YJBUUSLWJHPKQX-NOZJJQNGSA-N 428.539 4.692 50 10 IJGE C[C@@H](CCCBr)CNCc1ccc(I)c(Cl)c1 2026568080 XXKQEKHHGNTVIV-JTQLQIEISA-N 430.555 4.845 50 10 IJGE O=C(CNc1cccc(C(F)(F)F)c1)NN=CC(Br)=Cc1ccccc1 2042446467 ORIODVFGPXVZSX-UHFFFAOYSA-N 426.236 4.655 50 10 IJGE O=C(CBr)c1cc(Br)cc(OC(F)(F)F)c1C(F)(F)F 2054795836 HCVPDXUFSFVKOL-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE FC(F)Oc1cc(OC(F)(F)F)cc(CBr)c1I 2060222243 LXTRMPIBLWFRKO-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE COc1cc(-n2nc(CBr)c(Br)c2C(F)(F)F)ccc1C 2079241092 XTUIQYHCNXFIAJ-UHFFFAOYSA-N 428.046 4.866 50 10 IJGE CN(C[C@@H]1CN(CCCCCCCCCBr)CCO1)C(=O)OC(C)(C)C 2106780790 BODMNARULWNMAX-GOSISDBHSA-N 435.447 4.680 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(CC3(CBr)CCCC3)C[C@@H]21 2106786965 WPVIEJYMYSKPIB-XDNAFOTISA-N 427.427 4.519 50 10 IJGE O=C(NC[C@@H]1C[C@H](Cl)C12CCC2)c1scc(Br)c1Br 2115601365 GICVNAWBCNZDFV-CBAPKCEASA-N 427.589 4.801 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1ccc(C(C)(F)F)cc1 2128390679 VAIHIBDZOVCESV-SFHVURJKSA-N 426.301 4.851 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(CBr)cc2)[C@H]2CCCC[C@H]21 2162912296 TZLDJPHXSZRHQS-ZWKOTPCHSA-N 437.378 4.586 50 10 IJGE CC(C)(C)[C@@H]1C[C@@H](CCl)CN(C(=O)c2csc(I)c2)C1 2165006142 FYUFVDYBWOBAAH-CMPLNLGQSA-N 425.763 4.716 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC2(CCC2)[C@@H]1NC(=O)[C@H](Br)C1CCCC1 2167033557 RVYFYIRPYGYESJ-GVDBMIGSSA-N 443.426 4.530 50 10 IJGE C[C@H]1CN(C(=O)c2ccc(I)c(Cl)c2)CC[C@@H]1CCCl 2172476006 RDEMDQAKIRNLKM-QWRGUYRKSA-N 426.125 4.672 50 10 IJGE Clc1ccc(I)c(CN2C[C@H](Br)CCC23CC3)c1 2220275696 XBNWCWCHLSACML-LLVKDONJSA-N 440.550 4.837 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@H]2CCCOC2)c1 2252836775 GUDHOBWPYWAJSX-GWCFXTLKSA-N 426.974 4.944 50 10 IJGE Cc1cc([C@@H](Br)c2cscc2S(C)(=O)=O)sc1Br 2260096541 QWSSOCDPXUTEQX-JTQLQIEISA-N 430.208 4.768 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H](CBr)[C@H]2CC[C@@H]1C2 2282986243 NZXGBMHDVCAZIF-HHURGBBESA-N 425.523 4.630 50 10 IJGE O=C(NCC[C@@H]1CCC[C@@H]1Br)c1cc(Br)c(F)cc1Cl 2285846177 LAQKANCIHVSLOM-WPRPVWTQSA-N 427.539 4.925 50 10 IJGE CC1(C)C[C@H](Br)CN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285847322 ZPMUYOJTOAONFA-QMMMGPOBSA-N 427.539 4.877 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)CCCOc2ccc(C)cc2C)c(OC)c1 2293190713 IBFGWRZSTRTJEU-UHFFFAOYSA-N 437.492 4.547 50 10 IJGE N#CC(=Cc1cn(CCOc2ccccc2Cl)c2ccccc12)C(=O)NC[C@H]1CCCO1 2297456345 JVEGPGLMYWFXSW-HXUWFJFHSA-N 449.938 4.576 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)c(I)c2)CC[C@@H]1Br 2300239168 UWCIQDMFXDEIHU-ONGXEEELSA-N 428.539 4.550 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)C[C@@H]1C[C@H]1C(C)(F)F 2309016436 WUXPACCCRSNOEQ-GVDBMIGSSA-N 438.378 4.529 50 10 IJGE CCN1C(=O)C(=Cc2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)C(C)=C(C#N)C1=O 2314617535 AZWQKOLPNXPNOI-UHFFFAOYSA-N 448.482 4.898 50 10 IJGE C[C@H](NC(=O)C(C#N)=CNCc1ccccc1Br)C12CC3CC(CC(C3)C1)C2 2318469575 VXKSNTFHYSBZDG-SCUMNGBJSA-N 442.401 4.667 50 10 IJGE ClCc1cnc(OCc2cccc(I)c2)c(Br)c1 2319109005 VASJXQDAPGPLCR-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE C[C@@H]1CCCN(Cc2ccc(I)c(Br)c2)[C@H]1CCl 2325224057 SQKGOAGKKIYWKD-YGRLFVJLSA-N 442.566 4.893 50 10 IJGE N#C/C(=C\c1cn(CC(=O)N2CCOCC2)c2ccccc12)c1cccc(C(F)(F)F)c1 920243 LJHOXFXESOTIKZ-LDADJPATSA-N 439.437 4.583 50 10 IJGE CC/C(C)=N\NC(=O)COc1ccc2cc(Br)ccc2c1Br 12491525 UDBMORSRYCNUTL-GRSHGNNSSA-N 428.124 4.646 50 10 IJGE N#C/C(=C/c1ccc(Cl)cc1)C(=O)Nc1nc2c(s1)CCN(Cc1ccccc1)C2 34688509 LTULWGORJRATME-PDGQHHTCSA-N 434.952 4.900 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(F)cc4)ccc32)cc1 38676909 KTLPGBKWXAXMNV-VWLOTQADSA-N 444.462 4.591 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCCc2ccccc2)ccc1OCc1ccccc1C 40889444 SOHJKSLRYCWMCI-JLPGSUDCSA-N 426.516 4.849 50 10 IJGE CCOC(=O)COc1c(Cl)cc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)cc1Cl 59335284 AXAWKEWNZYTTOK-NVNXTCNLSA-N 433.291 4.789 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\Nc1cccc(Br)c1 217240870 JMPMRUVAIRQHDR-PFONDFGASA-N 442.313 4.864 50 10 IJGE CC(C)(C)C(=O)[C@H](Br)Cc1ccc(I)cc1Cl 232154668 DIJNLTVAUOUEMG-SNVBAGLBSA-N 429.523 4.866 50 10 IJGE CCC[C@@H](Oc1ccc(OC)cc1)C(=O)NN=Cc1ccc(OC(=O)c2ccccc2)cc1 245285917 ZRAMBMVEKAWQLW-XMMPIXPASA-N 446.503 4.612 50 10 IJGE O=C(NN=C/C=C/c1ccccc1[N+](=O)[O-])c1cc(-c2ccc3c4c(cccc24)CC3)n[nH]1 254293511 WIKZTVAFWGRJKR-MBMFXOPVSA-N 437.459 4.666 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2ccc(CCl)cc2)[C@@H](CI)C1 382696256 BBLABJHBLXIWAV-LSDHHAIUSA-N 435.733 4.811 50 10 IJGE O=C(NCCC1(CBr)CC1)c1cc(Br)sc1Br 395903844 YXNDILICFJTUDN-UHFFFAOYSA-N 446.002 4.568 50 10 IJGE ClCc1ccc(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@H]32)c(Br)c1 404200910 RCLJMVMDVSUQBS-RTWAWAEBSA-N 435.793 4.668 50 10 IJGE ClCc1c(Br)cccc1N1CCO[C@H]2CCN(Cc3ccccc3)C[C@H]21 404212719 XHRUVROZCUHHIJ-RTWAWAEBSA-N 435.793 4.668 50 10 IJGE C[C@H](Nc1ncc(C(F)(F)F)cc1I)[C@@H](C)CBr 686109200 PRBBXHWNSJIAPX-BQBZGAKWSA-N 437.041 4.536 50 10 IJGE CCn1cc([C@@H](Cl)c2cc(Br)c(F)cc2OC)nc1Br 698391821 NXLZULQNHATEAG-LBPRGKRZSA-N 426.511 4.904 50 10 IJGE C[C@H](Cl)c1nnc(-c2ccc(I)c(Br)c2)s1 721581075 WWRNUVMDPNRAKB-YFKPBYRVSA-N 429.508 4.872 50 10 IJGE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NNc1c(Cl)cccc1Cl 763624551 PALRJBWETLWMES-UHFFFAOYSA-N 432.336 4.918 50 10 IJGE Cn1cc([C@@H](NS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)C(F)(F)F)cn1 774947300 DKDQWFUGTGVZOY-LLVKDONJSA-N 445.357 4.659 50 10 IJGE Cc1ccc(-n2c(C)cc(C=NNC(=O)C(=O)Nc3ccc(C(C)C)cc3)c2C)c(C)c1 1084130527 QSNDMBHFSFLAMQ-UHFFFAOYSA-N 430.552 4.923 50 10 IJGE CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C[C@H](CBr)C3CC3)C2)CC1 1559992744 HMBSOFPBSHXCLK-MOPGFXCFSA-N 429.443 4.767 50 10 IJGE COc1ccccc1/C(C#N)=C/c1cccc(OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1 1615067209 GPPLTFAUCWPVBM-RQZCQDPDSA-N 445.387 4.795 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1ccc(Br)cc1Cl)c1cccc(Cl)c1 1616414191 REIHXMNQPMVQJD-JXMROGBWSA-N 428.113 4.620 50 10 IJGE COc1ccc(OC)c(C/C(O)=C(\C#N)c2nc(-c3ccc4c(c3)OCCO4)cs2)c1 1872750564 HEBFLXLFKADYSB-ZPHPHTNESA-N 436.489 4.634 50 10 IJGE CC(C)(C)OC(=O)N[C@@]12CCC[C@]1(F)CN(CC1(CBr)CCCCC1)C2 1893716215 HGTIQYWWDJDLFB-VQTJNVASSA-N 433.406 4.803 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)c1ncc(S(C)(=O)=O)cc1Cl 1915255875 SDLIXOXXWNCLPI-KRWDZBQOSA-N 445.810 4.565 50 10 IJGE BrCC[C@H]1CCN(Cc2cc(Br)ccc2Br)C1 2006504055 VQFQAABRCKGVJJ-JTQLQIEISA-N 425.990 4.819 50 10 IJGE CC(C)[C@@H](Br)c1cn(-c2ccc(Cl)cc2I)nn1 2057429960 UVKJKKXDWZAUJI-GFCCVEGCSA-N 440.510 4.617 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(C[C@]13CCCOC3)C[C@@]2(CBr)C(F)(F)F 2083265410 XUKBARQHWQQHPY-JYJNAYRXSA-N 428.289 4.510 50 10 IJGE CC(C)(C)OC(=O)N1CCC(C2CCN(C[C@H](Br)C(F)(F)F)CC2)CC1 2106954057 FUROXTAVWKQXCD-HNNXBMFYSA-N 443.348 4.671 50 10 IJGE CN(C(=O)c1cc(Br)c(Cl)s1)[C@@H](CCBr)C(F)(F)F 2122009379 QTOZVHACSNKWGN-ZETCQYMHSA-N 443.510 4.952 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2ccc(CBr)cc2)CC12CCCC2 2162591576 MDBOSDLXKGDGDK-QGZVFWFLSA-N 437.378 4.634 50 10 IJGE Clc1ccc(Br)cc1CN1CCC(COCCBr)CC1 2167398074 JKWIAEKZONOGTN-UHFFFAOYSA-N 425.592 4.726 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@H]1CCN2C[C@@H](CBr)c1ccccc1 2197355198 GINOMPLIYMCOBC-XQBPLPMBSA-N 437.422 4.934 50 10 IJGE Clc1ccc(I)c(CN2CC(CCCBr)C2)c1 2216706620 ZAFLJGJYYRJDKP-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)C(=O)c1cccc(Cl)c1Br 2248086120 BWYOHPFTXQBCPE-CQSZACIVSA-N 431.157 4.999 50 10 IJGE CC(C)[C@H](CBr)CN1CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2255002363 WMUCXYUNCDUUBN-HZSPNIEDSA-N 431.337 4.574 50 10 IJGE C[C@]12CO[C@](CO[C@H](CI)c3ccccc3Br)(C1)C2 2266292446 YWKLQXMXVCZOMZ-KFWWJZLASA-N 437.115 4.511 50 10 IJGE CC[C@@H](Cl)[C@@H]1CCCCN1C(=O)c1ccc(Cl)c(I)c1 2283654855 FNGQYKCGRPRRAR-RISCZKNCSA-N 426.125 4.957 50 10 IJGE N#CC(=Cc1ccc(OCc2ccc(C(=O)O)cc2)c(Cl)c1)C(=O)NCc1ccccc1 2293175833 BNHWWGKAVXTASR-UHFFFAOYSA-N 446.890 4.841 50 10 IJGE C[C@H]1C[C@H]1N(CCBr)Cc1cc(I)ccc1Cl 2307332302 MUSJHQWVGCNGHL-TVQRCGJNSA-N 428.539 4.550 50 10 IJGE N#CC(=Cc1cn(Cc2ccc(F)cc2)c2ccc(Br)cc12)C(=O)NC1CC1 2313624330 PTHUDZPNRAVFMF-UHFFFAOYSA-N 438.300 4.777 50 10 IJGE Cc1ccc(Oc2nc3ccccn3c(=O)c2C=C(C#N)c2nc3ccccc3n2C)cc1 2314436982 WCUIHHJDPUWSEM-UHFFFAOYSA-N 433.471 4.746 50 10 IJGE CCc1ccc(C[C@H]2SC(=C(C#N)C(=O)NC)N(c3ccc(C(C)C)cc3)C2=O)cc1 2314593077 HGPFIKKYLXYIEC-JOCHJYFZSA-N 433.577 4.545 50 10 IJGE COc1cc(C=C2C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1 2314611092 QGXWWMYPNQPOLO-UHFFFAOYSA-N 430.504 4.522 50 10 IJGE COc1cc(CC(CBr)(CBr)C2CC2)c(Br)cn1 2315345795 WBDQZXGKZCPAFO-UHFFFAOYSA-N 441.989 4.581 50 10 IJGE COC[C@H]1C[C@@H](Cc2ccc(Cl)cc2I)[C@H](Br)C1 2318528867 KALFIMZSKDCAIN-XHVZSJERSA-N 443.550 4.923 50 10 IJGE Cc1ccnc(CO[C@@H](CI)c2ccc(Br)cc2)c1 2343573003 IDZXPODXYPJJQU-HNNXBMFYSA-N 432.099 4.845 50 10 IJGE CC1(C)CC(CBr)(CN2CC(F)(F)[C@](C)(CNC(=O)OC(C)(C)C)C2)C1 2351602193 BLIGMNIRTYDMDZ-QGZVFWFLSA-N 439.385 4.670 50 10 IJGE O=C(c1scc(Br)c1Br)N(CCCCl)C1CCOCC1 2381028812 QCRQWOJBXYDBNZ-UHFFFAOYSA-N 445.604 4.523 50 10 IJGE CC[C@H](Oc1ccccc1[C@@H](C)CC)C(=O)NNC(=O)c1ccccc1Br 10683797 QSYJMEYGESNHLV-KSSFIOAISA-N 433.346 4.581 50 10 IJGE C=CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(C)o2)cc1 38659250 PSRRVRNSSRPTRC-HSZRJFAPSA-N 428.444 4.590 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(C)c1/C=N/NC(=O)c1cc(F)c(F)cc1Cl 59151346 VAHJZUHICHRILS-YCPBAFNGSA-N 437.277 4.897 50 10 IJGE CCc1ccc(NC(=O)C(=O)NN=Cc2ccccc2OCc2ccccc2Cl)cc1 252591884 BCSUJPDNZHMGMY-UHFFFAOYSA-N 435.911 4.570 50 10 IJGE CCCOc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)c2ccccc2O)cc1 254618619 RBMVVNZZWMFNIX-UHFFFAOYSA-N 440.503 4.798 50 10 IJGE CC(CBr)(CBr)NC(=O)c1cccc(OCc2ccccc2)c1 310033724 ZKXUQVKAILVLRK-UHFFFAOYSA-N 441.163 4.544 50 10 IJGE BrC[C@@H]1CCCCN(c2ncc(Br)cc2Br)C1 696787208 CFACDMRCCPNARH-VIFPVBQESA-N 426.978 4.608 50 10 IJGE ClCc1cnc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)c(Br)c1 705845095 KRDYCYLQTHAVJB-XCJLJZCSSA-N 446.820 4.930 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NC(=O)c1cc(Br)cc(Br)c1 716939956 PTUGREDXRGOOHQ-PELKAZGASA-N 441.989 4.894 50 10 IJGE O=C(N[C@H](CCl)CC(F)(F)F)c1cc(Br)sc1Br 717822925 BFIABMLVBFCAEF-BYPYZUCNSA-N 429.483 4.563 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@]3(CC[C@](C)(CI)O3)[C@H]1C2 721762726 RPBPCLVVQGMRFY-DTTOXWODSA-N 435.346 4.539 50 10 IJGE O=C(NNc1nc(-c2ccncc2)no1)/C(=C\c1ccc(Cl)cc1)c1ccc(F)cc1 732065852 YSSBJTADGPNMMH-UYRXBGFRSA-N 435.846 4.608 50 10 IJGE CC(=O)N(C)c1cccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C)c3)c2C)c1 744776882 JLSUAJHZFIITLY-HYARGMPZSA-N 426.520 4.931 50 10 IJGE COc1cc(OC)cc(C(=O)Oc2ccc(/C=C(\C#N)C(=O)c3ccoc3C)cc2OC)c1 744858700 ARIPPXVEAYGNMK-GIJQJNRQSA-N 447.443 4.623 50 10 IJGE C#CCOc1ccc(C=NNC(=O)c2ccc(Cl)cc2Cl)cc1Br 1084387141 DMSNICDZMAFWGX-UHFFFAOYSA-N 426.097 4.532 50 10 IJGE C[C@@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CCC2=NNC(=O)c1cccc([N+](=O)[O-])c1 1084617548 PEVAPRZFSJGMGN-ILSIFQBBSA-N 433.508 4.943 50 10 IJGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 1087669073 WKIISFWOIIPCOE-IAGOWNOFSA-N 445.466 4.702 50 10 IJGE O=C(NNc1ccccc1OC(F)(F)F)c1cc2cccc(C(F)(F)F)c2nc1O 1155063757 SUIQBMBBTFNQPE-UHFFFAOYSA-N 431.292 4.615 50 10 IJGE CC(C)Oc1cc(Br)cc(C(=O)NNc2nc3ccccc3[nH]c2=S)c1 1585174074 WIZHUMWWUWUWFL-UHFFFAOYSA-N 433.331 4.599 50 10 IJGE CCCCCOc1ccc(C=NNC(=O)COc2ccccc2Br)cc1OC 1772754461 IBQTUJUVVFKKDL-UHFFFAOYSA-N 449.345 4.556 50 10 IJGE O=C(CSc1nc(-c2ccccc2)cs1)NN=Cc1ccc(Br)cc1 1772755089 MEQISICFOSCOOU-UHFFFAOYSA-N 432.368 4.815 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2c(F)cccc2Cl)cc1 1865694276 SEXHFYPIFKXUFJ-NRFANRHFSA-N 438.890 4.649 50 10 IJGE Cc1cccc(C)c1N1C(=O)c2ccc(NC(=O)/C(C#N)=C/c3ccc(F)cc3)cc2C1=O 1866127594 SRIIACLUPQLVLN-LDADJPATSA-N 439.446 4.789 50 10 IJGE CCCCCOc1ccc(/C=C(\C#N)c2nc(O)c3cc(OC)c(OC)cc3n2)cc1OC 1872727571 KRPVJQDVWJPLOX-GZTJUZNOSA-N 449.507 4.994 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)c1ccc(S(C)(=O)=O)cc1F 1915322280 LFECYSYJACPBKW-IBGZPJMESA-N 428.367 4.655 50 10 IJGE C[C@H](c1ccncc1Br)[C@H](Br)c1ccsc1S(C)(=O)=O 1924062669 HHVDUEPVPOVCBW-PELKAZGASA-N 439.194 4.549 50 10 IJGE O=C(N[C@@H]1CC[C@@H](CBr)C1)c1cc(Br)sc1Br 1942368063 OASPATLSFUJWLE-RNFRBKRXSA-N 446.002 4.567 50 10 IJGE BrC[C@H]1CN(Cc2cccc(Br)c2Br)CCS1 1943880459 FPEKYVCDPVEFFQ-JTQLQIEISA-N 444.030 4.524 50 10 IJGE BrC[C@@H]1CC12CCN(c1ncc(Br)cc1Br)CC2 2031626670 RVHSRJIQYARAMM-VIFPVBQESA-N 438.989 4.608 50 10 IJGE Brc1cccc(Br)c1C[C@@H]1CN(C2CC2)C[C@H]1Br 2039251075 OBAUIHLUUKNTAH-YMTOWFKASA-N 438.001 4.612 50 10 IJGE C[C@H](CCBr)CCN1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]1C(F)(F)F 2052477552 GTKBSBWDVQJPJV-HZSPNIEDSA-N 431.337 4.670 50 10 IJGE BrC[C@H]1CN(Cc2cc(Br)ccc2Br)CC12CC2 2054712327 HGUXOMFREUGPLW-NSHDSACASA-N 438.001 4.819 50 10 IJGE Cc1ccccc1-n1nc(CBr)c(I)c1C(F)(F)F 2079260539 GWJNKXRKKJAAHZ-UHFFFAOYSA-N 445.020 4.699 50 10 IJGE C[C@H]1CCc2nn(-c3cc(C(F)(F)F)cc(Br)n3)c(CBr)c21 2080517353 JNPQMUNTBGCFHD-ZETCQYMHSA-N 439.073 4.993 50 10 IJGE BrC[C@@H]1CCC2(CCC2)N1c1ncc(Br)cc1Br 2084959765 HDBUNRRSEQRMHQ-JTQLQIEISA-N 438.989 4.893 50 10 IJGE CN(C(=O)[C@H](Br)C1CCCC1)c1ccc(CNC(=O)OC(C)(C)C)cc1 2110718874 VLWSALOIMVRNML-QGZVFWFLSA-N 425.367 4.628 50 10 IJGE CN(Cc1cc(Cl)ccc1I)[C@H](CCCl)C(F)(F)F 2122000520 ILKKOXIGXOBTGC-LLVKDONJSA-N 426.047 4.936 50 10 IJGE BrCc1c(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)nc2sccn12 2148938548 JBCOFJOGHILEAI-ROUUACIJSA-N 445.430 4.639 50 10 IJGE Fc1cccc(C(CBr)(CBr)CCS[C@H]2CCOC2)c1 2149124252 QYQXWRZNKSJNJC-AWEZNQCLSA-N 426.189 4.766 50 10 IJGE CCn1ncc(Br)c1[C@@H](Cl)c1cc(Br)c(F)cc1OC 2150667942 IZBOYOJJFVRIPD-LBPRGKRZSA-N 426.511 4.904 50 10 IJGE CC[C@H](Cl)[C@@H]1CCCCN1C(=O)c1ccc(I)c(Cl)c1 2170618726 REUWDICRJBZZQC-FZMZJTMJSA-N 426.125 4.957 50 10 IJGE Brc1ccc([C@@H](CI)OC2CC(n3ccnc3)C2)cc1 2183689178 MJACKOHVGCGINK-YMAMQOFZSA-N 447.114 4.542 50 10 IJGE C[C@@H](c1nscc1Br)N(C)c1nc2sccn2c1CBr 2186583768 ZXYNQSWEVYTUKW-ZETCQYMHSA-N 436.198 4.707 50 10 IJGE CC1(C)CN(c2ccc(CBr)cc2[N+](=O)[O-])CCCN1Cc1ccccc1 2193720732 VRJPVLTUMAAFSD-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE O=S(=O)(Nc1ccc(Cl)cc1CBr)c1ccc(Br)s1 2231000831 DELPXDJGAOGJCX-UHFFFAOYSA-N 445.585 4.860 50 10 IJGE CCCN(C[C@@H](C)Br)C(=O)c1cc(Br)ccc1Br 2259760365 DIZHLMAAXJDQST-SECBINFHSA-N 441.989 4.847 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@]23CCOC[C@H]2C3)c1 2263509821 KVWWWOSXTRKMGS-DDTOSNHZSA-N 438.985 4.944 50 10 IJGE CN(Cc1ccc(I)cc1)c1c(F)cccc1CBr 2265606156 YAVQXMJJZWELAZ-UHFFFAOYSA-N 434.090 4.962 50 10 IJGE COc1ccc(C=C(C#N)C(=O)NC[C@@H]2CCCO2)cc1COc1ccc(C(C)(C)C)cc1 2295672406 VIXRYCONVCDEJH-DEOSSOPVSA-N 448.563 4.774 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)C1(CCBr)CC1 2300241389 YLUXSLBISARDOM-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC(F)(F)C[C@@H]1CN(CCCCCBr)C2 2320884463 LAHBCSAYTNSNNW-PBHICJAKSA-N 425.358 4.566 50 10 IJGE Cc1cc(I)ccc1NC=C(C#N)C(=O)Nc1cccc(Cl)c1 2325423264 MUZPZUTWLGBNPH-UHFFFAOYSA-N 437.668 4.711 50 10 IJGE COc1ccc(OC)c(CC(O)=C(C#N)c2nc(-c3cc(OC)ccc3OC)cs2)c1 2331324598 UAFCTNRUXIFNBP-UHFFFAOYSA-N 438.505 4.880 50 10 IJGE COc1cc(F)c(CBr)c(N2CC[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c1 2359378447 XOTHMBITKFRHFW-ZWKOTPCHSA-N 433.365 4.973 50 10 IJGE COc1ccc2nc(N(/N=C/c3cccs3)C(=O)c3ccc([N+](=O)[O-])o3)sc2c1 9629212 OVKDNWYUZAYELQ-VXLYETTFSA-N 428.451 4.549 50 10 IJGE CC[C@@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)COc1ccc(Cl)cc1Cl 9871829 RXOJYLYEPKGGKC-KGLIPLIRSA-N 439.339 4.501 50 10 IJGE CCOC(=O)[C@]1(C)c2[nH]c3ccccc3c2[C@@H](c2ccc(Cl)cc2)CN1C(=O)CCl 11767133 GMTABGKMARAVLC-HXOBKFHXSA-N 445.346 4.813 50 10 IJGE CCCCN1C(=O)/C(=N\NC(=O)C2c3ccccc3Oc3ccccc32)c2ccccc21 27527389 OTSKXZFSADCZKA-PNHLSOANSA-N 425.488 4.591 50 10 IJGE COc1ccccc1OCC(=O)Oc1ccc(/C=C(/C#N)c2ccccc2OC)cc1OC 31901974 CJZPHYVABWJNML-RGEXLXHISA-N 445.471 4.761 50 10 IJGE Cc1cc(Oc2cc(N3CCN(C(=O)C(C)(C)CCl)[C@H](C)C3)ncn2)ccc1Cl 37356490 YNBLYGMZUZEBCR-OAHLLOKOSA-N 437.371 4.533 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C3/C(=O)N(C4CCCC4)C(=O)C(C#N)=C3C)o2)cc1 38607860 WEGDJQUPXWHXAY-KGENOOAVSA-N 444.487 4.658 50 10 IJGE Cc1c(C(=O)O)oc2c1/C(=N/NC(=O)C(c1ccccc1)c1ccccc1)CC(C)(C)C2 39853321 RCRSZXKOHKQICJ-ZXVVBBHZSA-N 430.504 4.911 50 10 IJGE O=C(N/N=C\c1ccc(Cl)c(Cl)c1)c1cccn(Cc2ccccc2Cl)c1=O 169920880 MLNCGZKHSDOYOL-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE C[C@@]1(CBr)CCN(Cc2cc(Cl)ccc2I)C1 405348771 SHBOEHNUIURIFG-ZDUSSCGKSA-N 428.539 4.552 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1cccc([C@H]2CNCCN2S(=O)(=O)c2ccccc2)c1 616640089 VZHJLMXPOYCZCN-JOCHJYFZSA-N 446.689 4.544 50 10 IJGE CC[C@H](C[C@@H](C)Br)NC(=O)c1cc(Br)ccc1Br 716936349 FUVMWKNILQOHNI-PSASIEDQSA-N 441.989 4.894 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)c(C(F)(F)F)c1 799387939 PGJPZCAZIAUERS-UHFFFAOYSA-N 425.361 4.604 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CC(=O)NNc1ccc(C#N)cc1C(F)(F)F)c1ccccc1 799749050 KYSYVTALMGFVPI-SFHVURJKSA-N 448.445 4.676 50 10 IJGE C=CCCC[C@H](C(=O)NNC(=O)Nc1cc(OC)c(Cl)cc1OC)c1ccccc1 1155437251 HQMNOUUDSGPZKA-INIZCTEOSA-N 431.920 4.650 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(O[C@@H]2CCOc3ccccc32)CC1 1224325866 MCQSGVGUDVACSB-QGZVFWFLSA-N 426.351 4.691 50 10 IJGE Cc1cccc(Br)c1NNC(=O)c1ccc2c(c1)nc(O)n2C1CCCC1 1300359334 ZSNHDGWWCOWBDD-UHFFFAOYSA-N 429.318 4.685 50 10 IJGE CCOc1ccccc1[C@H](CC(C)C)NC(=O)NNC(=O)c1ccc(Br)cc1 1318867560 VPJWEWIMMMICGL-SFHVURJKSA-N 448.361 4.579 50 10 IJGE Cc1c(C(=O)NNC(=O)c2ccccc2F)oc2c1C(=NNc1ccccc1)CC(C)(C)C2 1772729465 PJOIWTALXQHQNK-UHFFFAOYSA-N 448.498 4.591 50 10 IJGE COc1cc(C=NNC(=O)c2cccnc2)ccc1OCc1c(Cl)cccc1Cl 1772753504 LZZYCNQOWHEDEL-UHFFFAOYSA-N 430.291 4.740 50 10 IJGE CC(=O)[C@@H](Br)c1ccc(SC(F)(F)F)c(I)c1 1848425911 RBWAVJHUTWCBRW-SECBINFHSA-N 439.034 4.928 50 10 IJGE CCOC(=O)N1CCc2cc(NC(=O)/C(C#N)=C/c3ccc(Br)cc3)ccc21 1866128803 NAGMWBIUXMOUCX-LFIBNONCSA-N 440.297 4.514 50 10 IJGE COc1cc(OC)c(-c2csc(/C(C#N)=C(\O)[C@@H]3CC(=O)N(C(C)C)C3)n2)cc1Cl 1872756699 WEVQLPGTYREAFY-KMCFQHSYSA-N 447.944 4.530 50 10 IJGE CC[C@@H]1C[C@@H]1CCO[C@](C)(CI)CN(CC)C(=O)OC(C)(C)C 1902818016 RUYMNUCLRFUJRS-RVKKMQEKSA-N 439.378 4.890 50 10 IJGE C[C@H](CCCl)N(Cc1ccccc1)C(=O)c1ccccc1I 1915079391 BFRUSMZTTCEXBU-CQSZACIVSA-N 427.713 4.951 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1Br)c1csc(Br)c1Br 1945183299 BSRJBCQWHREPKW-HTQZYQBOSA-N 446.002 4.709 50 10 IJGE CC1(C)CN(C(=O)c2csc(Br)c2Br)[C@@H]1CBr 1945187475 XEXRMQAJTQPDIZ-SSDOTTSWSA-N 446.002 4.519 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@]2(CC[C@](C)(CI)O2)CC12CCC2 1986113211 YSHUGQVKNUZYDU-AEFFLSMTSA-N 435.346 4.683 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CC[C@@]23CCC[C@@H](CI)O3)C1 1986986360 QRUAJJYWYACJHK-WBAXXEDZSA-N 435.346 4.540 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1csc(Br)c1 2006100628 CNUPHCPPHDIAOP-SECBINFHSA-N 430.149 4.624 50 10 IJGE Cc1cc(S(=O)(=O)N(Cc2ccccc2)CC2CCC2)sc1CBr 2009647580 VJDVZWJEGQLJHH-UHFFFAOYSA-N 428.417 4.942 50 10 IJGE CCCN(CCCBr)Cc1ccc(I)c(Cl)c1 2026567968 WXOVRVWDALBNEQ-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE COC[C@@H](C)OC[C@@H](Br)Cc1c(Br)cccc1Br 2038123962 NNGANZYNVDRZNS-ZJUUUORDSA-N 444.989 4.569 50 10 IJGE CC1(C)CC[C@H](CCl)N(c2ncc(I)cc2Br)C1 2069528753 MTWYPZNYKWTLAO-SNVBAGLBSA-N 443.554 4.683 50 10 IJGE CC[C@@H](C)[C@H](CBr)NC(=O)c1cc(Br)cc(Br)c1 2081239766 WPGRPYGTDKFAAM-PELKAZGASA-N 441.989 4.751 50 10 IJGE O=C(N[C@@H]1C[C@H]2CC[C@H]1N(CCCCCCCCCBr)C2)C(F)(F)F 2106787291 YOTAUONZFMSXDT-BZUAXINKSA-N 427.349 4.643 50 10 IJGE C[C@]1(COc2c(Br)cc(CCl)cc2Br)CSCCO1 2136553302 HGGVXWFIZRKTQK-ZDUSSCGKSA-N 430.589 4.851 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CC[C@@H](Cl)C(F)(F)CC1 2150038268 DSMKUSPKJJVJRX-LLVKDONJSA-N 431.502 4.690 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2CCc1nccn1Cc1ccccc1 2153147637 SWFDDTVMRGDSMR-UHFFFAOYSA-N 444.764 4.729 50 10 IJGE Cc1c(CCl)cc(Cl)cc1S(=O)(=O)N(C)[C@H]1CC[C@H]1OCc1ccccc1 2156443648 RQEIRTGGODTGPO-RBUKOAKNSA-N 428.381 4.756 50 10 IJGE CC(C)(C)OC(=O)NC1CC2(CCCCN2CCCCCI)C1 2211186077 UIHPKMZNLXJAIH-UHFFFAOYSA-N 436.378 4.504 50 10 IJGE Clc1cc(CBr)ccc1OCCOCCOCCOCc1ccccc1 2227773039 VOLGPZYIABYWOH-UHFFFAOYSA-N 443.765 4.864 50 10 IJGE CCC(CC)[C@H](Br)CNC(=O)c1cc(C)ccc1I 2232158563 XPCRFTGFLODFGV-CYBMUJFWSA-N 438.147 4.529 50 10 IJGE COCC1([C@H](Br)c2ccc(OC)c(I)c2)CCCC1 2269539143 DEGXGENRMBGHSG-CQSZACIVSA-N 439.131 4.943 50 10 IJGE C[C@@]1(CBr)CC(F)(F)CN1C(=O)c1cccc(Cl)c1Br 2283196808 ADRGAAIFOHALQT-LBPRGKRZSA-N 431.502 4.737 50 10 IJGE CC[C@H](C)[C@H](CBr)NCc1ccc(Cl)c(I)c1 2300237529 ADNPBEPOLBXTAS-ZANVPECISA-N 430.555 4.844 50 10 IJGE BrCCN(Cc1cccs1)Cc1sccc1I 2301071986 TZAHRAOUXRKJLT-UHFFFAOYSA-N 442.185 4.811 50 10 IJGE CC(C)[C@@H](CCCl)NCc1ccc(I)c(Br)c1 2306218502 AQEMVAFQJLHOBJ-CYBMUJFWSA-N 430.555 4.797 50 10 IJGE CC(C)[C@@H](Cl)CN(C)Cc1ccc(I)c(Br)c1 2306229429 WSWTVCMDHDJWNQ-LBPRGKRZSA-N 430.555 4.749 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2cccc(OC)c2)sc2c1CC[C@@H](CC)C2 2314571951 PHMPDLINOGNYPN-OAHLLOKOSA-N 438.549 4.994 50 10 IJGE Clc1ccc(CN2CCC23CC(CBr)C3)c(I)c1 2318510786 KHJYXXDFTFUUMC-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1csc(C(F)(F)F)c1 2320359334 BFRXHFIRXQLXIC-CQSZACIVSA-N 436.293 4.867 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc(F)c(C(F)(F)F)c1 2369432410 CVTQONVFGBTLPH-OAHLLOKOSA-N 448.254 4.945 50 10 IJGE C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)COc1ccc(-c2ccccc2)cc1 14665907 FUDROHFUBDLRPO-IBGZPJMESA-N 446.547 4.645 50 10 IJGE COc1cc(/C=N/NC(=O)c2cccnc2)ccc1OCc1c(Cl)cccc1Cl 40888731 LZZYCNQOWHEDEL-OPEKNORGSA-N 430.291 4.740 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2cc(Cl)ccc2Cl)cc1 40987655 MWTMDUFJVFHLOF-LFIBNONCSA-N 447.318 4.801 50 10 IJGE C[C@H]1CN(C(=O)c2cc(Br)c(Br)s2)CC[C@@H]1Br 167821275 YOSRXJCOZXOIOO-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE O=C(NC[C@H]1CC[C@H](Br)C1)c1cc(Br)c(Br)s1 227667778 LFMPBAQMCLFNSU-BQBZGAKWSA-N 446.002 4.567 50 10 IJGE CCCCCCO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 231314038 RCWBWABNQPCFSP-KRWDZBQOSA-N 425.351 4.788 50 10 IJGE CCC[C@@H](C)CO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 233278348 QWSASFXCRXBKPI-RHSMWYFYSA-N 425.351 4.644 50 10 IJGE CC(=O)[C@@H](Br)[C@@H](C)c1ccc(I)cc1Br 300916716 VMTGDOVUPIPFMX-KGFZYKRKSA-N 445.920 4.510 50 10 IJGE CC[C@H](C)N(CCBr)C(=O)c1cc(Cl)ccc1I 310948762 QLJIRKMFZWPOKG-VIFPVBQESA-N 444.538 4.580 50 10 IJGE COC(=O)c1cccc(NC(=O)c2cccc(NC(=O)Nc3ccc(SC#N)cc3)c2)c1 586732505 DMWUMOFRPSRXQT-UHFFFAOYSA-N 446.488 4.943 50 10 IJGE CO[C@@]1(CC(CBr)(CBr)c2ccc(Cl)cc2)CCOC1 692459462 ZNURABVEEKUPSP-OAHLLOKOSA-N 426.576 4.563 50 10 IJGE C[C@H](NC(=O)c1cc(Br)sc1Br)C1(CBr)CC1 696032095 CFMSKHMFYRKWDR-LURJTMIESA-N 446.002 4.567 50 10 IJGE CC[C@H](NC(=O)c1scc(Br)c1Br)[C@@H](C)Br 705423753 FQBUJUVMNBVAJE-VDTYLAMSSA-N 433.991 4.565 50 10 IJGE COc1ccc(C=NNC(=O)c2ccccc2OCc2ccc(F)cc2)c(Cl)c1OC 730431777 WSCORAJPJFSVRC-UHFFFAOYSA-N 442.874 4.839 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccccc2SCc2cscn2)c1C 736693696 FELOUUQLJSHBNT-UHFFFAOYSA-N 448.577 4.661 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)c2sc(-c3ccccc3)nc2-c2ccccc2)cc1 748138024 DRJFOCBTRGRGAM-UHFFFAOYSA-N 449.557 4.638 50 10 IJGE COc1ccc2nc(NNC(=O)c3ccc(NC(=O)c4cccs4)c(C)c3)c(C)cc2c1 778481886 JQPIKXXMEHXFDG-UHFFFAOYSA-N 446.532 4.931 50 10 IJGE COc1ccc(C=NNC(=O)COc2ccc(Br)cc2Cl)c2ccccc12 1084479952 UDKYAYAPZGOXFG-UHFFFAOYSA-N 447.716 4.793 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2)[C@H]1c1ccccc1[N+](=O)[O-] 1865710433 YBJIMFCWRWVFGM-QFIPXVFZSA-N 449.470 4.725 50 10 IJGE CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cccc(Br)c2)c(Cl)c1 1866131767 MOCDLWAAKCPSCC-RIYZIHGNSA-N 433.689 4.825 50 10 IJGE COc1ccc(C)cc1-c1csc(/C(C#N)=C(\O)CCc2nc3ccccc3[nH]c2=O)n1 1873920349 DSDOPLQOFYOXKU-PGMHBOJBSA-N 444.516 4.789 50 10 IJGE C[C@@H](Br)C(C)(C)CNC(=O)c1csc(Br)c1Br 1913834262 QLJAEWGCXAWOAH-ZCFIWIBFSA-N 448.018 4.813 50 10 IJGE CCC[C@H](Br)CCNC(=O)c1scc(Br)c1Br 1942751468 UKUGPJMWOJNJQJ-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@H]2OCCO[C@@H]2C)cc1Br 2027178980 UNDZQPAUBORDOP-JCOFBHIZSA-N 442.973 4.760 50 10 IJGE CC(C)N(C)C[C@H](Br)CCc1cc(Cl)ccc1I 2038159564 IFUBJCCWZPYVLC-GFCCVEGCSA-N 444.582 4.981 50 10 IJGE CC[C@@H]1CCCCN1CC(=O)C(C#N)=C1NC(c2ccc(Br)cc2)=CS1 2042453702 ZBWVVYZDMFSRIM-MRXNPFEDSA-N 432.387 4.653 50 10 IJGE FC(F)(F)c1cc(Br)nc(-n2nc(CBr)c3c2C[C@@H]2C[C@@H]32)c1 2080741192 RXSZLMGVBRMTOD-POYBYMJQSA-N 437.057 4.603 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2[C@@]12C[C@@H]1CN(Cc1ccccc1)C2 2099677868 CWAHLRKKAPJYJA-JLTOFOAXSA-N 434.740 4.908 50 10 IJGE CC(C)[C@H](CBr)CN1CC[C@@](NC(=O)OC(C)(C)C)(c2ccccc2)C1 2106780833 BWIQFJRDDBQJIM-UTKZUKDTSA-N 425.411 4.779 50 10 IJGE CC(C)(C)[C@H](CBr)CN1CCCC[C@H]1[C@@H]1CCCN(C(=O)C(F)(F)F)C1 2163064849 WNQYLVAQFUCITB-OAGGEKHMSA-N 441.376 4.699 50 10 IJGE Cc1cc(Br)sc1[C@H](Br)c1ccc2c(c1)CCS2(=O)=O 2170069645 CPTSEGJMQQUFGK-CYBMUJFWSA-N 436.190 4.633 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2C[C@@]1(Br)CC1(F)F 2202502174 BVOJOYNHQOMLLP-NSHDSACASA-N 432.465 4.849 50 10 IJGE C[C@@H]1C[C@@H](Br)[C@@H](C)N(Cc2cc(Cl)ccc2I)C1 2220346363 YNTIKWMUSNMOHT-GIPNMCIBSA-N 442.566 4.938 50 10 IJGE CC1(C)CN(c2ncc(Br)cc2Br)C[C@@H]1CCBr 2222544517 ZXDLYWSAXDFWQH-VIFPVBQESA-N 441.005 4.854 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1Cc1c(Br)cccc1Br 2251037211 ANJPRIWNASMRRS-STQMWFEESA-N 425.990 4.959 50 10 IJGE COc1ccc(Br)c2c1nc(CCCl)n2CCN(C)Cc1ccccc1 2270562176 OXLOXTMBZRLLFZ-UHFFFAOYSA-N 436.781 4.721 50 10 IJGE COC(=O)c1ccc(COc2ccccc2C=C(C#N)C(=O)Nc2ccc(C)cc2)cc1 2297488355 KQBWWUTUFCKFJL-UHFFFAOYSA-N 426.472 4.906 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)C1(CCCl)CC1 2306227662 MBHFJTGGNRYTEZ-UHFFFAOYSA-N 428.539 4.647 50 10 IJGE Clc1ccc(CN2CC[C@@H](Br)[C@H]2C2CC2)cc1I 2315547946 AYOBKWUKOLRENI-BXUZGUMPSA-N 440.550 4.692 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)NN=Cc1ccc(Br)cc1 2321215759 XRCASCIAJUXXHZ-UHFFFAOYSA-N 430.252 4.862 50 10 IJGE Cl[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccc(I)c(Br)c1 2325217781 IARDVKRAIMDXFO-CNDDSTCGSA-N 440.550 4.788 50 10 IJGE CCN(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2326919585 OPCUADYXTRPFGG-WMLDXEAASA-N 425.358 4.518 50 10 IJGE CCOc1ccc(-c2csc(C(C#N)=C(O)CCN3C(=O)c4ccccc4C3=O)n2)cc1 2331305186 ASUTWSCVAUPOOV-UHFFFAOYSA-N 445.500 4.688 50 10 IJGE Cn1cc(I)c(COc2c(Cl)cc(Cl)cc2CCl)n1 2341859632 LVOWRCRVOGCFPJ-UHFFFAOYSA-N 431.488 4.649 50 10 IJGE CC(C)[C@H](Br)C(C)(C)NC(=O)Cc1ccc(Br)cc1Cl 2365959169 LCCBNMDPXWLJAG-AWEZNQCLSA-N 425.592 4.959 50 10 IJGE Cc1ccccc1[C@H](C(=O)NC1CCCCC1)N(CCc1ccccc1)C(=O)CCl 4672305 UWGAGALUDHWFNG-XMMPIXPASA-N 426.988 4.795 50 10 IJGE COc1ccc2cc([C@H](C)C(=O)N/N=C/c3ccc(O)c(Br)c3)ccc2c1 20551201 KZDFDBKZWKCQAV-ZXCVBSDHSA-N 427.298 4.570 50 10 IJGE Cc1c(C(=O)Nc2ccncc2)oc2c1/C(=N/NC(=O)c1cccc3ccccc13)CCC2 40813547 RDMRSMDZUZHITB-XHLNEMQHSA-N 438.487 4.859 50 10 IJGE Cc1ccc(C)c(OCCCC(C)(C)C(=O)NNC(=O)COc2ccc(Cl)c(C)c2)c1 66201377 BFQHRYNSJATGDW-UHFFFAOYSA-N 446.975 4.677 50 10 IJGE CC1=C(C#N)C(=O)N(CCc2ccccc2)C(=O)/C1=C/c1ccc(-c2ccc(F)cc2)o1 101338209 QRQPNWDBPCPLQL-PXLXIMEGSA-N 426.447 4.921 50 10 IJGE Cc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)cc1 205652429 ZFMOOPUZGHEWKD-CNPINADKSA-N 426.447 4.971 50 10 IJGE C[C@@H]1CCC[C@@H](CO[C@](C)(CI)CNC(=O)OC(C)(C)C)C1 300795840 VKVFUHHVOWKRAF-CKEIUWERSA-N 425.351 4.548 50 10 IJGE C[C@H](CCn1c(CCCl)nc2cc(Br)cnc21)N(C)Cc1ccccc1 379606942 DKWSLBVFXFAXRN-OAHLLOKOSA-N 435.797 4.886 50 10 IJGE COc1cccc([C@H]2CN(Cc3ccccc3)C[C@@H]2CI)c1Cl 382721746 NUIORNMZHPJLSV-RDJZCZTQSA-N 441.740 4.999 50 10 IJGE O=S(=O)(c1cc(CCl)c(Cl)cc1Cl)N1CC[C@H](COCc2ccccc2)C1 384061327 YWXYSHYBNRYJKI-HNNXBMFYSA-N 448.799 4.960 50 10 IJGE C[C@H](Br)C[C@@H](C)CNC(=O)c1cc(Br)ccc1Br 397850827 SAVVIMXSLLFYKO-BDAKNGLRSA-N 441.989 4.751 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC2CCCCCC2)CC1 686145106 YFHWZUDCQCGYNE-UHFFFAOYSA-N 437.362 4.931 50 10 IJGE C[C@@H]1CCN(C(=O)c2scc(Br)c2Br)C[C@@H]1Br 707788378 AAZLJULOQJWXAV-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE Cc1cc(Oc2ncccn2)ccc1NC(=O)NNc1ccc(C#N)cc1C(F)(F)F 799394106 FPWCVBSRCVWTNL-UHFFFAOYSA-N 428.374 4.616 50 10 IJGE Cc1ccc(-n2nc(C)c(C=NNC(=O)c3ccc(Br)cc3)c2C)cc1C 1084363228 UTWIPNZHMMZMEU-UHFFFAOYSA-N 425.330 4.632 50 10 IJGE Cc1ccc(Cl)cc1NNC(=O)[C@@H](C)SCc1nc(O)c2c(C)c(C)sc2n1 1304402677 WKQYXORLBBVRQS-GFCCVEGCSA-N 436.990 4.741 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C[C@H](CBr)C3CC3)CC2)C1 1307924879 WOYQDEJYAPLNGL-MOPGFXCFSA-N 429.443 4.767 50 10 IJGE C#C[C@H]1CCCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1631298890 SKTRGADECFAYPB-YNGKYYQNSA-N 436.353 4.635 50 10 IJGE CCc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)Cc1ccccc1)CCC2 1772749052 PNWSHXKOLYZIPV-UHFFFAOYSA-N 429.520 4.802 50 10 IJGE Cc1ccc(C)c(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2ccccc2F)c1 1865684174 VKDPXESJXZXBIT-GOSISDBHSA-N 442.416 4.924 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1sccc1C)C(C#N)=C(N)O2 1865699241 ODRGBVHIYUZNHR-QGZVFWFLSA-N 428.920 4.874 50 10 IJGE CCOC(=O)c1c(-c2ccc(CC)cc2)csc1NC(=O)CI 1865947600 MGRNYIIVNXFHBK-UHFFFAOYSA-N 443.306 4.528 50 10 IJGE IC[C@@H]1CCC[C@@]2(CN(Cc3ccccc3)C3(CCCC3)C2)O1 1939534592 CYHWHSYVHRKIOY-AZUAARDMSA-N 425.354 4.948 50 10 IJGE CC(C)(CCBr)CNC(=O)c1csc(Br)c1Br 1945189314 NTUVNBSDNRWKRK-UHFFFAOYSA-N 448.018 4.814 50 10 IJGE C[C@]1([C@H](Br)c2cc(Br)c(Br)s2)COCCO1 1992637608 CKXIMGUCUDONQA-PSASIEDQSA-N 434.975 4.515 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@H]([C@@]2(C)CCC[C@H](CI)O2)CC1 1993734188 BAOHDOCTKBLTHA-ATNYBXOESA-N 437.362 4.833 50 10 IJGE C[C@@H]1C[C@@H](CBr)CCN1c1ncc(Br)cc1Br 2004847899 WFTHFWUFBVJOGT-BDAKNGLRSA-N 426.978 4.606 50 10 IJGE CC[C@H](C)[C@@H](Br)CNC(=O)c1ccc(Br)cc1Br 2029977466 MGGYMEONUATTSW-UFBFGSQYSA-N 441.989 4.751 50 10 IJGE CCCOCCCO[C@H](CI)c1ccc(Br)cc1 2031754773 NMJJXYFEFXQZDE-CQSZACIVSA-N 427.120 4.759 50 10 IJGE CN(C)c1nc(C(C#N)=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)nc(=N)[nH]1 2040489733 FTFGXOHUXCHCJW-UHFFFAOYSA-N 433.519 4.884 50 10 IJGE C[C@@H](CCl)C(=O)N(CCCNC(=O)OC(C)(C)C)c1cccc(Br)c1 2044692642 CDJJGJRGXNPRBH-ZDUSSCGKSA-N 433.774 4.572 50 10 IJGE CC1CC(CBr)(NC(=O)c2cccc(Br)c2Br)C1 2045117244 XOULFBPUKDGSOA-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE C[C@@]1(NC(=O)c2cc(Br)ccc2Br)CCC[C@H]1Br 2062574705 VEMFEXSRPRFZKI-DGCLKSJQSA-N 439.973 4.648 50 10 IJGE ClC[C@]1(CNc2ncc(I)cc2Br)CC12CCC2 2069534707 YVVCYQLUHRZWLG-ZDUSSCGKSA-N 441.538 4.660 50 10 IJGE Clc1cc(CN2C[C@@H](Br)CC23CCC3)ccc1I 2086662051 RBKQARLJTRBQHE-NSHDSACASA-N 440.550 4.837 50 10 IJGE BrC[C@H]1CCc2nc([C@@H]3C[C@@H]4CC[C@H](C3)N4Cc3ccccc3)ncc2C1 2187368132 KSKFHLXIAGUNPY-MMKMLUHNSA-N 426.402 4.887 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)[C@H]2CCS(=O)(=O)C2)c(C)c1Br 2227350180 VTRWQLFONXCIMS-ZANVPECISA-N 430.589 4.543 50 10 IJGE COc1ccc(Br)c(CCl)c1OCc1cc(Br)sn1 2227747023 VCADHRSIHGTZGA-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE Cc1cc(N(C)Cc2ccc(I)cc2)ncc1CBr 2265606282 ZEMZORASFDPNNB-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE O=C(N[C@@H]1C[C@H]2C[C@H]1C[C@@H]2Br)c1cc(F)c(Br)cc1Cl 2282978155 JUORDSVHTGFGKE-IOALNURASA-N 425.523 4.533 50 10 IJGE O=C(NCC1(CCl)CCCCC1)c1ccc(Cl)c(I)c1 2283652026 OTHADKIVEMZPAP-UHFFFAOYSA-N 426.125 4.864 50 10 IJGE CN(C(=O)c1cc(Br)c(F)cc1Cl)[C@H](CCBr)C(F)F 2285845511 BKFRWWKZMNOUJB-SNVBAGLBSA-N 437.481 4.732 50 10 IJGE Clc1ccc(COc2nc(CBr)cs2)c(I)c1 2301820685 OQPDVPSSXNYIJQ-UHFFFAOYSA-N 444.519 4.875 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@@H]2CCCC[C@H]3C[C@@H]32)C1 2302671915 NZXLAHCKYVTIQQ-YIOZNXECSA-N 449.373 4.786 50 10 IJGE Clc1ccc(CN2C[C@H](Br)[C@H](C3CC3)C2)cc1I 2315552672 HNKIYQIDIGJKJV-RYUDHWBXSA-N 440.550 4.550 50 10 IJGE O=C(N[C@@H]1C[C@@H]2C[C@H]1C[C@@H]2Br)c1cc(Br)c(F)cc1Cl 2359509202 RNXRPZWAXXDHIE-XZCDRZHDSA-N 425.523 4.533 50 10 IJGE Cc1scc(C(=O)N2CCC[C@H](Br)[C@@H]2C(F)(F)F)c1Br 2370255049 QNFVQTGDDINLIG-WCBMZHEXSA-N 435.103 4.749 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)cc2/C=C(/C#N)C(=O)NCc2ccccc2)cc1 35516308 YZUWDFNEEJPAOA-JWGURIENSA-N 434.499 4.771 50 10 IJGE CCc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)cc1 38653085 WZOQJAVZVPHIHX-VWLOTQADSA-N 444.462 4.591 50 10 IJGE CCOc1c(/C=N/NC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)cccc1OC 40912047 YZLXBGWDABGAKK-MTDXEUNCSA-N 446.547 4.949 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@H]1Br)c1ccc(Br)c(Cl)c1 123770637 KEMNOWGWOCPAHI-UKRRQHHQSA-N 429.539 4.893 50 10 IJGE CC(C)C[C@H](Br)CNC(=O)c1cc(Br)ccc1Br 226257889 KZCFGHDRTAFDFG-JTQLQIEISA-N 441.989 4.751 50 10 IJGE O=C(CNc1cccc2ccccc12)NN=Cc1cccc(OC(=O)c2cccs2)c1 254441687 ADISNBCJXYRVGL-UHFFFAOYSA-N 429.501 4.683 50 10 IJGE COCC[C@H](C)Oc1c(Br)cc(Br)cc1CBr 310298971 PQZGPNFDLQGYGS-QMMMGPOBSA-N 430.962 4.910 50 10 IJGE CC[C@@H](CCBr)CNC(=O)c1scc(Br)c1Br 707884090 CRGUXFOPOZBXKX-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)[C@H]2CCCC[C@H]2c2nc3ccccc3s2)c1 1303280413 HUSZWXQXJOEASO-ZWKOTPCHSA-N 434.590 4.569 50 10 IJGE C=CCCc1ccccc1NC(=O)NNC(=O)COc1ccccc1Cc1ccccc1 1310624785 OZNIHAYEUBFGMW-UHFFFAOYSA-N 429.520 4.628 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)c1C 1638346860 SQCZEGHGKGPDEN-UHFFFAOYSA-N 446.942 4.973 50 10 IJGE CCOc1ccc(Br)cc1C=NNC(=O)COc1ccc2ccccc2c1 1772753633 WTEFKLPRNSUAKL-UHFFFAOYSA-N 427.298 4.530 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CCC)nn3CC(C)C)cc1OCC 1865691713 ZHKDXAGFPWPCQA-QFIPXVFZSA-N 438.572 4.897 50 10 IJGE COc1ccc(C)cc1-c1csc(/C(C#N)=C(\O)[C@H]2CC(=O)N(Cc3ccccc3)C2)n1 1873921270 ZNZFUXMQWLXLDT-FCFMXISVSA-N 445.544 4.969 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CC[C@]12CCCN(C(=O)OC(C)(C)C)C2 1882689743 FIIMAYPOMNZIEW-SXGZJXTBSA-N 447.414 4.702 50 10 IJGE C[C@@H](CCBr)N(C)C(=O)c1csc(Br)c1Br 1917093092 HSLUVDKFAPQMKY-LURJTMIESA-N 433.991 4.519 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1Cc1cccc(Br)c1Br 1943881058 NEJLYMLDUOIXGY-ONGXEEELSA-N 425.990 4.959 50 10 IJGE C=CCC[C@H](CBr)NC(=O)c1cc(Br)sc1Br 2019475178 KSWBLQCBCMQICB-SSDOTTSWSA-N 446.002 4.733 50 10 IJGE CC(C)[C@@H](Br)[C@@H](C)NC(=O)c1cc(Br)cc(Br)c1 2041309210 YKUSESNSTMLMFM-PRHODGIISA-N 441.989 4.749 50 10 IJGE COc1ccc(-n2nc(CBr)c(Br)c2C(F)(F)F)c(OC)c1 2079238884 IKABFCGSEGLBHV-UHFFFAOYSA-N 444.045 4.566 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](C(C)(C)C)CN(C[C@H](CBr)C2CC2)C1 2108378900 XRLZGWMQSLDSDI-RYQLBKOJSA-N 431.459 4.916 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1cc(Br)ccc1F 2117896270 ZBAGHRKCMCVQBP-JTQLQIEISA-N 442.110 4.702 50 10 IJGE COc1ccc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)C1CCCC1 2123270455 NADYCEDAMOCNSD-UHFFFAOYSA-N 438.387 4.724 50 10 IJGE CCCC(CBr)(CCC)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1CCOC 2163059796 WMHJTIGHXMPIFY-SFHVURJKSA-N 449.474 4.926 50 10 IJGE COC[C@](C)(CC(CBr)(CBr)c1cccc(Cl)c1)OC 2198254704 RUTHXXRLYVHQIA-AWEZNQCLSA-N 428.592 4.809 50 10 IJGE CCN(C[C@@](C)(CI)O[C@@H]1CCC(F)(F)C1)C(=O)OC(C)(C)C 2212200753 PPKNAUSOQDFYDV-IUODEOHRSA-N 447.304 4.642 50 10 IJGE Clc1cccc(OCCOCCOCCOCc2ccccc2)c1CBr 2227772275 PVBYSPUBJILTHC-UHFFFAOYSA-N 443.765 4.864 50 10 IJGE C=CC[C@]1(CBr)CCCN1C(=O)c1ccc(C)c(I)c1 2287757210 FASHIIDAKXEIAK-MRXNPFEDSA-N 448.142 4.545 50 10 IJGE CCOc1c(Br)cc(C=C(C#N)C(=O)Nc2ccc(CC)cc2)cc1OC 2293665285 IPFLNTYJRJRGKH-UHFFFAOYSA-N 429.314 4.964 50 10 IJGE N#CC(=Cc1ccc(Cl)cc1)C(=O)Nc1nc2c(s1)CN(Cc1ccccc1)CC2 2296500487 RHXRRXREDCWMAW-UHFFFAOYSA-N 434.952 4.900 50 10 IJGE COc1ccc(Br)cc1C=NNC(=O)c1nc(-c2ccccc2)sc1C 2323745741 IAZAZLQLTUJJEZ-UHFFFAOYSA-N 430.327 4.654 50 10 IJGE ClC[C@@H](Cc1ccc(I)c(Br)c1)C1CCOCC1 2325218015 KGGQUIBRHSPAOO-GFCCVEGCSA-N 443.550 4.878 50 10 IJGE CCOC(=O)c1cc(CC)sc1NC(=O)C(C#N)=Cc1cccc(Br)c1 2329699333 DREYSKHPNZJYCH-UHFFFAOYSA-N 433.327 4.795 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CC2CCN(C[C@H]3C[C@H](Br)C3)CC2)CC1 2335923334 SSLREMZSTHPGCI-WGSAOQKQSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CCC2CCN(C[C@@H]3C[C@H]3Br)CC2)CC1 2335932406 ISEDYVQYJCITEG-RBUKOAKNSA-N 429.443 4.909 50 10 IJGE Cc1scc(C(=O)NC2(CCBr)CCSCC2)c1Br 2343577175 ZGIDUSSCSWFIQK-UHFFFAOYSA-N 427.227 4.600 50 10 IJGE COc1cc(CBr)cc(N2[C@H]3CCC[C@H]2CN(Cc2ccccc2)CC3)n1 2364772734 PKAKWXRPDJPAJA-PMACEKPBSA-N 430.390 4.619 50 10 IJGE COc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)Cc3ccc(Cl)cc3)ccc21 38650091 CTIFKIYVGNMXNN-XMMPIXPASA-N 446.890 4.715 50 10 IJGE CCN(C(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccc1OC)CCC2)c1ccccc1 40813218 RZDNZAKDDXXGCN-NHFJDJAPSA-N 445.519 4.734 50 10 IJGE CCCCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C(\C#N)C(=O)OCC)cc2OC)cc1 40864709 BRECDANOPXUCHT-SVWIXSIKSA-N 449.503 4.963 50 10 IJGE COc1cc(/C=C2/C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1 101334809 QGXWWMYPNQPOLO-CIAFOILYSA-N 430.504 4.522 50 10 IJGE CCOc1cc(/C=C2\C(=O)N(CC)C(=O)C(C#N)=C2C)ccc1OCc1ccc(C)cc1 214214944 KEQRZZDGBKRKTB-BKUYFWCQSA-N 430.504 4.585 50 10 IJGE CC(C)(C)S(=O)(=O)CC[C@@H](CBr)Cc1ccc(Br)cc1 232658765 MHROFIYWMDAHMZ-CYBMUJFWSA-N 426.214 4.606 50 10 IJGE COc1cc(C=NNC(=O)COc2ccc(Cl)cc2C)ccc1OCc1ccccc1 250874429 IHHAUIUWPBWYGR-UHFFFAOYSA-N 438.911 4.765 50 10 IJGE O=C(NN=Cc1c(-c2ccccc2)nc2sc(C3CCCCC3)nn12)c1ccncc1 254699429 UTOUNFDTHSETPX-UHFFFAOYSA-N 430.537 4.664 50 10 IJGE C[C@@H]1CCC[C@@H](O[C@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)C1 299981949 RWFABNWIWNJRNT-RKVPGOIHSA-N 437.362 4.786 50 10 IJGE FC(F)Oc1cc(Br)c(CBr)c(I)c1 575682623 WJGCMMRPDXEJDO-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE CCC(CC)(CCl)NC(=O)c1ccc(I)c(Br)c1 721601097 CWRGWWJQAQHDKK-UHFFFAOYSA-N 444.538 4.581 50 10 IJGE COc1ccc(-c2ncc(C(=O)Oc3ccc([N+](=O)[O-])c4ncccc34)s2)cc1OC 766893226 STIZGCKKQCPWAG-UHFFFAOYSA-N 437.433 4.503 50 10 IJGE O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)Oc1ccc([N+](=O)[O-])c2ncccc12 770126208 KJGJWMCURAJNCK-UHFFFAOYSA-N 442.840 4.544 50 10 IJGE Cc1ccccc1NNC(=O)C(=O)Nc1cccnc1Oc1ccc(Cl)cc1Cl 792352482 CTLRIFRGOSCCJJ-UHFFFAOYSA-N 431.279 4.571 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)COc2ccc(C(C)(C)C)cc2C(C)(C)C)c1 1644838203 NPCVPWFBZVWIFE-UHFFFAOYSA-N 437.609 4.660 50 10 IJGE COc1ccc(-c2nn(C)c3c2[C@H](c2c(Cl)cccc2Cl)C(C#N)=C(N)O3)cc1 1865686396 VFNHWXCNINWJAQ-INIZCTEOSA-N 427.291 4.621 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2Cc1ccccc1F 1865691381 QMPIFVYZPMDUBN-QHCPKHFHSA-N 444.510 4.806 50 10 IJGE COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)/C(C#N)=C/c1ccc(F)cc1 1866127570 QRITYFCZFOMEHF-LDADJPATSA-N 445.450 4.641 50 10 IJGE CC(C)(C)OC(=O)NC1CCC([C@]2(C)CC[C@@](C)(CI)O2)CC1 1936000427 WAQQOMDDQRBYFY-GNNGFNCTSA-N 437.362 4.833 50 10 IJGE CC1(C)OC[C@@H](Cc2cccc(Br)c2Br)[C@@H]1Br 1943886698 XIONLLPAZLXSHR-SKDRFNHKSA-N 426.974 4.943 50 10 IJGE O=C(NCCCCCCBr)c1csc(Br)c1Br 1945189080 IJACNHWPCCTNSJ-UHFFFAOYSA-N 448.018 4.958 50 10 IJGE CC(C)CN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@@H](Br)C(F)(F)F 2044705001 IAPPOALKHQBAFS-UONOGXRCSA-N 431.337 4.670 50 10 IJGE CC[C@@H](C)[C@H](CI)NCc1ccc(Br)c(F)c1F 2081255855 RRXMLSONUCJZGR-KCJUWKMLSA-N 432.090 4.667 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](C(C)(C)C)CN(C[C@@H](CBr)C2CC2)C1 2108378898 XRLZGWMQSLDSDI-JQHSSLGASA-N 431.459 4.916 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Cl)C2 2134124765 NSXXKTSYBRKJCV-WXKLWKFWSA-N 431.552 4.596 50 10 IJGE CCC(CC)(CBr)CN1CCC([C@H]2CCCN(C(=O)C(F)(F)F)C2)CC1 2163065039 WXUFXFDCQROZLQ-INIZCTEOSA-N 441.376 4.701 50 10 IJGE Cc1cc(Br)c(C(=O)NC[C@@H](Br)CC(F)(F)F)cc1Cl 2175691688 ZUIXJTUJVVCZEV-ZETCQYMHSA-N 437.481 4.857 50 10 IJGE CCC(CC)CN(CC)S(=O)(=O)c1cc(CBr)sc1Br 2179790158 ABJFGXWUJFMMNX-UHFFFAOYSA-N 447.258 4.852 50 10 IJGE F[C@@]12CCC[C@]1(CCl)CN(Cc1ccc(I)c(Cl)c1)C2 2208029216 JNRMQNWHSFOWQA-LSDHHAIUSA-N 428.116 4.878 50 10 IJGE CC1CC(CBr)(CN2CCC[C@H]([C@@H]3CCCN3C(=O)OC(C)(C)C)C2)C1 2265311454 HDJXCFPXWXSSRG-KQNFGGRRSA-N 429.443 4.909 50 10 IJGE O=C(N[C@@H]1C[C@H]2C[C@H]1C[C@H]2Br)c1cc(F)c(Br)cc1Cl 2282978156 JUORDSVHTGFGKE-NDORMNELSA-N 425.523 4.533 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2cc(Br)c(OC)c(OCC)c2)cc1 2293665754 YBGGGMZKWUZBLN-UHFFFAOYSA-N 445.313 4.801 50 10 IJGE N#CC=C(NC(=O)c1ccccc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1 2297498837 UOVFYIGRBJLXCL-UHFFFAOYSA-O 433.471 4.775 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)COc2cc(Cl)ccc2Cl)cc1 2314785118 MWTMDUFJVFHLOF-UHFFFAOYSA-N 447.318 4.801 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cc(Cl)cc(F)c1F 2320354256 IOYNWPQRGISVSO-AWEZNQCLSA-N 432.692 4.718 50 10 IJGE Cc1cnc(N(C)Cc2ccc(I)cc2)cc1CBr 2352271020 CVHSQKGUJXNXHK-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE COc1ccc2ccccc2c1-c1cc(C(=O)NN=Cc2ccccc2Br)n[nH]1 1741568 NIICMPUWNHPBRT-UHFFFAOYSA-N 449.308 4.765 50 10 IJGE CC[C@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)c1ccc(C)c(Br)c1 10683601 SNRSZNVBEPSPRM-KUHUBIRLSA-N 447.373 4.890 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(OC(C)C)cc4)ccc32)o1 38659246 YXWCIPQHRWMFIB-HSZRJFAPSA-N 430.460 4.813 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCc3nc4ccccc4s3)c2C)cc1 104692112 IMRBTNADIOUTDG-CPNJWEJPSA-N 442.544 4.936 50 10 IJGE CCCOc1c(OC)cc(/C=N\NC(=O)Cc2cc(Cl)ccc2SC)cc1OC 169922621 DYVDQLJOEAXDEX-QRVIBDJDSA-N 436.961 4.561 50 10 IJGE ClCc1c(Br)nn(-c2cccc(Br)c2)c1Br 309205978 PYHLSVLIPQZWMQ-UHFFFAOYSA-N 429.337 4.899 50 10 IJGE CCc1nn(CC)c(CN(CCBr)Cc2ccccc2)c1Br 309574091 QUPOIDZNLAUUFE-UHFFFAOYSA-N 429.200 4.625 50 10 IJGE CC[C@@](C)(CCBr)NC(=O)c1scc(Br)c1Br 705403995 YJGWSZDCFYHPIR-NSHDSACASA-N 448.018 4.957 50 10 IJGE Cn1nc(CC(CBr)(CBr)c2ccc(Cl)cc2)cc1Cl 706184175 RHKUDYCCTATLFR-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE ClCc1cc(Br)ccc1N1CC[C@@]2(CN(Cc3ccccc3)CCO2)C1 717596581 YUNQGZQZZVEBIV-OAQYLSRUSA-N 435.793 4.669 50 10 IJGE CCC[C@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1cccc(C(F)(F)F)c1 726798763 DNLKNPKODBNEGB-SFHVURJKSA-N 430.430 4.739 50 10 IJGE O=C(NNC(=O)[C@@H](Sc1cc(F)ccc1F)c1ccccc1)c1cccc2cccnc12 730215601 FZMOGMFKBVCCFW-QFIPXVFZSA-N 449.482 4.808 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)Oc1ccc([N+](=O)[O-])c3ncccc13)O[C@@H](C)C2 770137151 UFLRLNZUNPJZCH-QANKJYHBSA-N 434.448 4.574 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2cc(C)n(-c3cc(Cl)ccc3OC)c2C)cc1 1084077565 IYMVNDQFHRFSPV-UHFFFAOYSA-N 425.916 4.919 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@@H]1CCN(C(=O)c2ccc3c(c2)nc(O)n3CC(F)(F)F)C1 1470551476 OQLGXIVOFWGCII-CQSZACIVSA-N 443.542 4.541 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2cc(Cl)ccc2Br)cc1)C1CC1 1476687310 JQYZIGUWCCNIJB-UHFFFAOYSA-N 437.725 4.766 50 10 IJGE CCc1nn(Cc2ccccc2)c2c1[C@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865702714 ZYONZUBINWZUKW-HSZRJFAPSA-N 427.552 4.558 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@H]1c1ccccc1O 1865708032 MGJCXKDTAHJCBW-INIZCTEOSA-N 446.816 4.527 50 10 IJGE CN(Cc1ccsc1Br)C[C@@H](Br)COCc1ccccc1 1916370197 QDLFDGBDJRSFKS-OAHLLOKOSA-N 433.209 4.923 50 10 IJGE CC(C)(C)OC(=O)N[C@H](Cc1ccc(Br)cc1)[C@H](Br)CF 1952042495 NHWBCXCIKRXQHK-CHWSQXEVSA-N 425.136 4.618 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@H]1Cc1cc(Cl)ccc1I 2007129382 TUBRMFDYOZXYJQ-GIPNMCIBSA-N 429.523 4.676 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1C(=O)c1cc(Br)cc(Br)c1 2073319405 FVHCYFUWAHCTPZ-PRHODGIISA-N 439.973 4.600 50 10 IJGE CCN=c1[nH]c(NCCSSCCNC(=O)OC(C)(C)C)c(Cl)cc1Cl 2125302463 SUVNDWJREVHVHW-UHFFFAOYSA-N 441.450 4.560 50 10 IJGE CN(c1cc([N+](=O)[O-])ccc1CBr)[C@@H]1CN(Cc2ccccc2)C(C)(C)C1 2176909393 UKNMBDIYZKGOBJ-IBGZPJMESA-N 432.362 4.979 50 10 IJGE Cc1sc(Br)cc1C(=O)NC[C@]1(CBr)C[C@@H]1C(F)(F)F 2192585896 IYZOOCJAPBEFIE-GZMMTYOYSA-N 435.103 4.512 50 10 IJGE O=C(N[C@H](CCl)c1cccs1)c1ccc(Cl)c(I)c1 2268354146 BMAXKSZVOOUUGX-LLVKDONJSA-N 426.106 4.716 50 10 IJGE N#CC(=CNc1ccc2oc(=O)ccc2c1)c1nc(-c2cc3ccccc3oc2=O)cs1 2295945698 UVLSWBCOMDLNRY-UHFFFAOYSA-N 439.452 4.999 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN1Cc1cc(I)ccc1Cl 2307322849 SXLZZOYSRWEGGS-ZJUUUORDSA-N 428.539 4.550 50 10 IJGE Cn1cnc(Br)c1[C@@H](Br)c1ccc(F)c(Br)c1F 2315594751 YPOMAMGYALWSDN-ZETCQYMHSA-N 444.899 4.708 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CC(F)(F)CN1C[C@@](C)(CBr)C(C)(C)C 2327105671 GOSHZTLDOKJQSV-CXAGYDPISA-N 427.374 4.668 50 10 IJGE CC(C)N1C[C@@H](Br)[C@H](Cc2cc(I)ccc2Cl)C1 2327395899 WZXMVDVWQRKYCQ-DGCLKSJQSA-N 442.566 4.591 50 10 IJGE COc1cc(-c2csc(C(C#N)=C(O)[C@H]3CC(=O)N(C(C)C)C3)n2)c(OC)cc1Cl 2331376946 NFDKCPRUUKYDFO-LBPRGKRZSA-N 447.944 4.530 50 10 IJGE CC(C)(CBr)CN1CC[C@H](CCNC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2337588286 WOUHHHWZYVYFGR-UONOGXRCSA-N 445.364 4.965 50 10 IJGE O=C(N[C@H](CCl)c1cccs1)c1ccc(Cl)cc1I 2340052358 NQJDHNZTOUABGN-LLVKDONJSA-N 426.106 4.716 50 10 IJGE O=C(NC1CCCC1)[C@H](c1ccc(F)cc1)N(Cc1ccccc1Cl)C(=O)CCl 3039513 BGIXQYSEPGOYSU-NRFANRHFSA-N 437.342 4.847 50 10 IJGE COc1ccc(C=NNC(=O)COc2ccc(C(C)(C)CC(C)(C)C)cc2)cc1OC 33746494 KLMBFKHSFQTIRR-UHFFFAOYSA-N 426.557 4.947 50 10 IJGE C[C@H](Oc1ccc(F)cc1)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cccc(F)c1 38678111 VMTRYLSBLADRHY-LFVRLGFBSA-N 448.425 4.556 50 10 IJGE Cc1ccc(Cl)cc1Nc1ncnc(NNC(=O)c2cccc(Cl)c2)c1[N+](=O)[O-] 40592857 NJFVZIGDIRBRQL-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE CN(/C=C(/C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)C1CCCCC1 216487997 VYDHQLXRGJRUII-LVWGJNHUSA-N 442.607 4.592 50 10 IJGE Cc1ccc(-n2c(SCC(=O)NN=C/C=C\c3ccco3)nnc2-c2ccccc2)cc1 254313357 SRUPAXPXBQFDKB-BOUMBJFTSA-N 443.532 4.743 50 10 IJGE CCOc1ccc(C=NNC(=O)c2cc(-c3cccc(OCc4ccccc4)c3)n[nH]2)cc1 254345106 HQVPFSRSALRLGA-UHFFFAOYSA-N 440.503 4.818 50 10 IJGE CC(=NNC(=O)c1ccc(COc2cccc3cccnc23)cc1)c1ccc([N+](=O)[O-])cc1 254482938 IVJCWXOOYJNGNX-UHFFFAOYSA-N 440.459 4.876 50 10 IJGE CN([C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(CCl)c(Cl)cc1Cl 381225077 WYOBNJHAVHLELB-MRXNPFEDSA-N 447.815 4.627 50 10 IJGE CC[C@H](Br)CCCNC(=O)c1cc(Br)c(Br)s1 398591188 WXDUTBFLGQJWID-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE O=C(NC[C@H]1CN(Cc2ccccc2)CC12CCC2)c1ccc(CBr)cc1 693681634 RUGACIUMFPCPII-NRFANRHFSA-N 427.386 4.614 50 10 IJGE O=C(NNc1ccnc2cc(Cl)ccc12)C1CCN(c2nc3ccccc3s2)CC1 729515706 RWPXAIARYBYCGP-UHFFFAOYSA-N 437.956 4.858 50 10 IJGE Cc1cc(C)cc(NNC(=O)CSc2nnc(-c3ccco3)n2C2CCCCC2)c1 748351768 DRUVLSRUDMQKIL-UHFFFAOYSA-N 425.558 4.896 50 10 IJGE C/C(C=NNC(=O)Cc1nc(O)c2c(C)c(C)sc2n1)=C/c1cccc(C(F)(F)F)c1 807952513 MSTOEZNOUUGOIF-ZQTOSFTKSA-N 448.470 4.781 50 10 IJGE C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CCC2=NNC(=O)c1ccc([N+](=O)[O-])cc1 1084242509 KEQULFQWPVKPAT-APDHKMKFSA-N 433.508 4.943 50 10 IJGE C=C(Cl)C[C@@H](NC(=O)/C(C#N)=C/c1cc(C)n(C2CCCCC2)c1C)C(=O)OCC 1132193085 UTXZGTNZHFTGKS-UBXANZILSA-N 431.964 4.708 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCc3cnc(O)c4ccccc34)c2C)c1 1155726825 PDNHNLGZGOYSCO-BKUYFWCQSA-N 436.515 4.880 50 10 IJGE C=CCOc1c(Br)cc(CNC[C@]2(C)C[C@@H]2Br)cc1OCC 1658338098 HFXBXSLHTXAACU-RDJZCZTQSA-N 433.184 4.676 50 10 IJGE CCOc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccc1F)CCC2 1772743527 AYLRBWRARWGNAS-UHFFFAOYSA-N 449.482 4.849 50 10 IJGE Cc1sc(Br)cc1[C@@H](Br)c1c(Br)ncn1C 1900420488 MYGIHRQGMJXPRU-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE CCN(C[C@](C)(CI)OC[C@@H]1CC12CCC2)C(=O)OC(C)(C)C 1902102931 VIWAXXIPARWFSE-YOEHRIQHSA-N 437.362 4.644 50 10 IJGE CC(C)(CCS(=O)(=O)N(Cc1ccccc1)[C@@H](CBr)C1CC1)C1CC1 1915177494 VPUVYGBBXOWFLF-IBGZPJMESA-N 428.436 4.818 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1C(=O)c1csc(Br)c1Br 1945190070 GDIONRFBMCECBI-HTRCEHHLSA-N 446.002 4.661 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)Cc1cc(C(F)(F)F)ccc1Cl 1994841669 FCYXGPPVQCRHMT-GFCCVEGCSA-N 446.650 4.961 50 10 IJGE Cn1ncc([C@H](Br)c2cc3sccc3s2)c1I 2025273474 ZCTLZNLZQIODLI-JTQLQIEISA-N 439.141 4.785 50 10 IJGE Cc1csc([C@@H](Br)c2cc(S(C)(=O)=O)cs2)c1Br 2039332838 STAOVJKZITYJPU-JTQLQIEISA-N 430.208 4.768 50 10 IJGE O=C(NN(c1ccccc1)c1ccccc1)C1CCN(C(=O)C=Cc2ccccc2)CC1 2042444530 NJXBNWODCGQMNO-UHFFFAOYSA-N 425.532 4.808 50 10 IJGE Br[C@@H](Cc1ccc2c(c1)CCO2)c1ccc(I)cc1 2112339201 QRNNXDJLOZUKFU-HNNXBMFYSA-N 429.095 4.905 50 10 IJGE Cc1cc(CBr)cnc1N1C[C@@]23CCC[C@@]2(CN(Cc2ccccc2)C3)C1 2153340118 AOANREFYVLSPBB-ZRZAMGCNSA-N 426.402 4.777 50 10 IJGE O=[N+]([O-])c1ccc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1CBr 2163336609 YOTVIXHWXDVCNO-OAQYLSRUSA-N 430.346 4.592 50 10 IJGE CN(C(=O)c1cc(Br)cc(Br)c1)C1(CCl)CCSCC1 2171186301 SLUVYGJHKWWYBI-UHFFFAOYSA-N 441.616 4.788 50 10 IJGE C[C@](CI)(O[C@@H]1[C@@H]2[C@H]3C[C@H]4[C@@H]1[C@H]4[C@@H]32)c1ccccc1Br 2208404057 BWOBTWGJKJTBCG-XWVISWLASA-N 445.138 4.626 50 10 IJGE CO[C@@H]1C[C@H]1[C@H](Br)c1c(F)cc(Br)c(F)c1Br 2250745349 KNNSQSXLHQOBLJ-MSVFPHSYSA-N 434.900 4.961 50 10 IJGE CCc1nn(CCCCCCCBr)c(CC)c1I 2263205250 GPNGNWNHVZUCFC-UHFFFAOYSA-N 427.168 4.958 50 10 IJGE Brc1ccc([C@H](CI)OC2(C3CCC3)COC2)cc1 2272915860 RDLLIWNUNFYFHO-AWEZNQCLSA-N 437.115 4.511 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@@H](C2)[C@@H]1CBr 2282967272 NZXGBMHDVCAZIF-UPFKWVMWSA-N 425.523 4.630 50 10 IJGE C[C@H](c1ccncc1Br)[C@H](Br)c1cscc1S(C)(=O)=O 2288510668 GKMFSGULFDVOLT-OQPBUACISA-N 439.194 4.549 50 10 IJGE C[C@@H]1[C@H](CCl)CCN1Cc1ccc(I)c(Br)c1 2306224081 MPSZFYLMJILMBM-KOLCDFICSA-N 428.539 4.503 50 10 IJGE Clc1ccc(CN2CC3(CC3)C[C@@H]2CBr)cc1I 2315555342 PPXZBGCOKAFTHS-LLVKDONJSA-N 440.550 4.694 50 10 IJGE Clc1ccc(CN2C[C@H]3C[C@H](Br)C[C@H]2C3)c(I)c1 2318529342 OUWFEPFXLPYSPQ-XHVZSJERSA-N 440.550 4.692 50 10 IJGE ClC[C@@H](NCc1ccc(I)c(Br)c1)C1CCCC1 2325215534 ZQPOPLWBANMXTR-CQSZACIVSA-N 442.566 4.941 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@H]2C[C@H](Cl)CC[C@H]21 2328611009 CBMSRTQSYNZESJ-QXFUBDJGSA-N 427.589 4.895 50 10 IJGE C[C@@](CI)(OC1[C@@H]2C[C@@H]2[C@H]2C[C@@H]12)c1ccccc1Br 2333440106 LGJJUUYJYDHIPJ-YZELDIBWSA-N 433.127 4.770 50 10 IJGE O=C1C(Cl)=CC(Br)=C/C1=C\NNC(=O)c1cc2c(ccc3ccccc32)o1 8437580 GHIIVQPVZYULPE-ZRDIBKRKSA-N 443.684 4.689 50 10 IJGE N#C/C(=C/c1cn(CC(=O)Nc2ccccc2)c2ccccc12)C(=O)NCc1ccccc1 33323219 IHENEQVQKBPQFA-QNGOZBTKSA-N 434.499 4.503 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(Cl)c2)cc1 38651147 XWVLEONMPOVSTJ-XMMPIXPASA-N 446.890 4.851 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3Cl)ccc2[C@H]1c1cccc([N+](=O)[O-])c1 38653397 RMRMQRLCEYSHRH-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE O=C(NNc1ncnc(Oc2cccc3ccccc23)c1[N+](=O)[O-])c1cccc(Cl)c1 40583526 LNECQDCXOLXWTL-UHFFFAOYSA-N 435.827 4.741 50 10 IJGE Cc1cccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2[N+](=O)[O-])c1 40648511 GOFRKMJKRQMXJX-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccccc2)C(=O)/C1=C/Nc1ccccc1C(=O)c1ccccc1 101235185 PVXNCDISQUGYQD-JJIBRWJFSA-N 447.494 4.622 50 10 IJGE Brc1ccc([C@H](CI)OC[C@H]2CCCCO2)cc1 161961635 QYFTYLQVKMRDJE-KGLIPLIRSA-N 425.104 4.511 50 10 IJGE CCCCOc1ccc(/C=C2\C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)cc1OCC 214319404 GEBDLGTWQBGASS-MOSHPQCFSA-N 434.492 4.650 50 10 IJGE COc1cccc(-c2cc(C(=O)NN=C(C)c3cc(O)ccc3O)c3cc(C)ccc3n2)c1 254735134 VBBSTCDIKMLZMI-UHFFFAOYSA-N 441.487 4.784 50 10 IJGE COc1ccc(OCCCOc2ccc(C=NNC(=O)Nc3ccccc3)cc2OC)cc1 254837498 BYOLREAXBPNGRG-UHFFFAOYSA-N 449.507 4.707 50 10 IJGE COc1ccc(OC)c([C@@H](Br)c2sccc2I)c1 310799223 DBTYZWWVOOFWSS-GFCCVEGCSA-N 439.112 4.854 50 10 IJGE O=C(NC1(CCBr)CCSCC1)c1cc(Br)ccc1Cl 719666304 QYJCLMGFONZQBE-UHFFFAOYSA-N 441.616 4.883 50 10 IJGE Cc1nc([C@@H]2CCCCN2C(=O)/C(C#N)=C\c2cc(C)n(-c3ccccc3F)c2C)no1 737614952 HHUXHXBHIBDAME-QUYTYNJFSA-N 433.487 4.585 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)cc1 748146967 JOMLHHHRXNZAHF-UHFFFAOYSA-N 446.981 4.793 50 10 IJGE O=C(NNc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 775621205 PLJSZAIEGDIGCE-UHFFFAOYSA-N 425.832 4.649 50 10 IJGE O=C(CCCCl)Nc1ccc(N2CCN(c3c(F)c(F)c(F)c(F)c3F)CC2)cc1 953055318 AIIUXZGZWMWUKC-UHFFFAOYSA-N 447.835 4.666 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)Oc2ccc([N+](=O)[O-])c3ncccc23)s1 1537865625 MOGPBVNBFBRQKD-UHFFFAOYSA-N 435.914 4.901 50 10 IJGE Cc1c(C(=O)Nc2ccc(F)cc2F)oc2c1C(=NNC(=O)c1cccs1)CCC2 1772749089 JOVWIUKLBJNTOM-UHFFFAOYSA-N 429.448 4.650 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccc(OC)cc1)nn2CCC 1865702792 FLEUTWGWWSDSTL-JOCHJYFZSA-N 444.535 4.976 50 10 IJGE CCCc1nn(-c2ccccc2Cl)c2c1[C@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865709587 DEZPWONQKJIRIG-LJQANCHMSA-N 435.871 4.605 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C[C@]1(C)CCCCN1C(=O)OC(C)(C)C 1890137061 YPTRTPCCFTYWJA-KUHUBIRLSA-N 435.403 4.844 50 10 IJGE Cc1cc(Br)c([C@H](Br)c2c(Br)ncn2C)s1 1900442245 ZYUFLWAVXRRPKP-SSDOTTSWSA-N 428.975 4.799 50 10 IJGE C[C@@H](Br)C(C)(C)CNC(=O)c1cc(Br)ccc1Br 1913837980 NMRYWLKKXJPQPM-MRVPVSSYSA-N 441.989 4.751 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(F)c1 1915295715 MWZYMNQQCPNRRO-SFHVURJKSA-N 432.330 4.575 50 10 IJGE BrC[C@@H]1CCCCN1Cc1cccc(Br)c1Br 1943883359 ZYTFGAMVQAGIMC-NSHDSACASA-N 425.990 4.961 50 10 IJGE CC(C)CN(CCBr)C(=O)c1scc(Br)c1Br 1948635933 VWAJAJOJEVMZNJ-UHFFFAOYSA-N 448.018 4.766 50 10 IJGE ClCc1c(Cl)ncn1-c1ccc(I)cc1Br 1982521533 FFCHXACWZZABTE-UHFFFAOYSA-N 431.886 4.632 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN1Cc1cc(Br)ccc1Br 2006503208 LKAAKSLPPMKNEB-ZJUUUORDSA-N 425.990 4.817 50 10 IJGE O=S(=O)([C@H]1CC[C@H](CBr)C1)N(Cc1ccccc1)Cc1cccs1 2009647590 VLJWKEBWDRUKKN-WMZOPIPTSA-N 428.417 4.644 50 10 IJGE O=C(NC[C@@H]1CCCN(C[C@H](CBr)c2ccccc2)C1)OCc1ccccc1 2044697861 XFPDDTJUCCLNHH-UNMCSNQZSA-N 445.401 4.804 50 10 IJGE CCC[C@H](Cl)c1cn(-c2cc(Br)ccc2I)nn1 2057419858 CTFYRJSTKQKXGJ-VIFPVBQESA-N 440.510 4.714 50 10 IJGE C[C@@]1(NC(=O)c2cccc(Br)c2Br)CCC[C@H]1Br 2062579207 SIPOSFBIPPOYSU-ZWNOBZJWSA-N 439.973 4.648 50 10 IJGE C=CCC[C@@H](CBr)NC(=O)c1cc(Br)cc(Br)c1 2075329156 LGSLIYBEFQIUHF-LBPRGKRZSA-N 439.973 4.671 50 10 IJGE Cc1c(Br)ccc([C@H](Br)[C@@H]2OCCO[C@@H]2C)c1Br 2083320549 KNOQFPRKQAASQE-OXHMUOHRSA-N 442.973 4.760 50 10 IJGE O=S1(=O)CCC([C@H](Br)c2cc(Br)c(Cl)cc2F)CC1 2097825491 WLBLOEGXVBKXJO-LBPRGKRZSA-N 434.552 4.502 50 10 IJGE COc1ccc([C@@H](Cl)c2nn(C)c(Cl)c2Br)cc1Br 2110721224 HFDRCNJLTCASDJ-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE C[C@@H]1CCCC[C@]1(CNC(=O)OC(C)(C)C)NC(=O)[C@H](Br)C1CCCC1 2110723284 NFYUJJKAALLQKS-AKCHCHLHSA-N 431.415 4.530 50 10 IJGE Clc1cc(N2CC[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)ccc1CBr 2129050497 DILVKKWYZPUBOQ-NHCUHLMSSA-N 435.793 4.715 50 10 IJGE ClCc1c(Br)cccc1N1CC[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 2129055734 RWNCQYUZVUTZRN-SFTDATJTSA-N 435.793 4.668 50 10 IJGE Clc1cccc(C(CBr)(CBr)C[C@H]2COCCCO2)c1 2154014500 UDTDLONZUZCNMH-AWEZNQCLSA-N 426.576 4.563 50 10 IJGE C[C@H](NC(=O)c1ccc(CBr)cc1)[C@H](NC(=O)OC(C)(C)C)c1ccco1 2172878617 VSLFRDHUSPONQW-GUYCJALGSA-N 437.334 4.559 50 10 IJGE CN(CCCCCI)[C@H]1CCCC[C@@H]1N(C)C(=O)OC(C)(C)C 2211186342 OYXPVZMTCQIPET-HOTGVXAUSA-N 438.394 4.702 50 10 IJGE ClCCc1nc2cccc(Cl)c2n1C[C@@H]1CC1(Br)Br 2224807555 TVPFHFLETUSVQP-QMMMGPOBSA-N 426.967 4.977 50 10 IJGE O=S1(=O)CC[C@H]([C@H](Br)c2cc3sc(Br)cc3s2)C1 2263618588 RFOPNPIWPRTROZ-KGFZYKRKSA-N 430.208 4.596 50 10 IJGE CCOc1cccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)c1 2294193471 SISRDZJUGJTWTP-UHFFFAOYSA-N 443.503 4.825 50 10 IJGE CC(C)(C)[C@H]1[C@H](Br)CCN1Cc1sccc1I 2301073414 IKPNHSVNQZETGH-BXKDBHETSA-N 428.177 4.737 50 10 IJGE C[C@@H]1OCC[C@]1(CBr)Cc1ccc(Cl)cc1I 2302315233 HHNZHIIFJVEKOI-TVQRCGJNSA-N 429.523 4.677 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2cccc([N+](=O)[O-])c2)sc2c1CC[C@@H](C)C2 2314571790 MAWXBNSRRRVNLD-CYBMUJFWSA-N 439.493 4.503 50 10 IJGE C=CCN1C(=O)C(=Cc2ccc(OCc3ccccc3F)c(OCC)c2)C(C)=C(C#N)C1=O 2314617134 RGBKJOWVTHVRJE-UHFFFAOYSA-N 446.478 4.582 50 10 IJGE COc1ccc(C(C)=NNC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)cc1OC 2321260940 BRPWQHATEQMOAJ-UHFFFAOYSA-N 425.435 4.506 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2N)ccc1OCc1ccc(C(C)(C)C)cc1 2323203054 NWQQEARFYUYJRI-UHFFFAOYSA-N 431.536 4.918 50 10 IJGE CCN(Cc1ccccc1)c1ccc(C=NNC(=O)c2ccc3nc(S)[nH]c3c2)cc1 2323602996 DGFAJMACLZMRFZ-UHFFFAOYSA-N 429.549 4.642 50 10 IJGE N#CC(=CNC1CCN(Cc2ccccc2)CC1)C(=O)Nc1ccc(Cl)c(Cl)c1 2324269019 WEOOLWMBBBDUOS-UHFFFAOYSA-N 429.351 4.594 50 10 IJGE Clc1ccc(I)cc1CN1[C@H]2CC[C@@H]1C[C@@H](Br)C2 2327389284 LUKDUNGSCKMPJO-UOJUARBOSA-N 440.550 4.835 50 10 IJGE Clc1ccc(I)cc1CN1CCC12CC(CBr)C2 2327390069 OVXZRGFMDGNOHX-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE COc1ccc(CC(O)=C(C#N)c2nc(-c3ccc4c(c3)OCCO4)cs2)c(OC)c1 2331329953 BRWHUQWOXBMCHS-UHFFFAOYSA-N 436.489 4.634 50 10 IJGE CC(C)[C@@H](CBr)CN1C[C@@H]2CC(F)(F)CC[C@]2(NC(=O)OC(C)(C)C)C1 2344115515 KYEWAMXMLVSLHE-MPGHIAIKSA-N 439.385 4.668 50 10 IJGE Brc1cccc([C@@H](CI)OC[C@@H]2O[C@H]3CC[C@H]2C3)c1 2352707572 LTXWNIGEHGMRFQ-MHEUCROKSA-N 437.115 4.509 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc2ccccc2c1O 2369687224 IRYKBFNXWZVLOJ-GOSISDBHSA-N 428.326 4.646 50 10 IJGE CN(C)c1ccnc(N(C)C[C@H]2CCCCN2Cc2ccccc2)c1CBr 2377473401 SAZAPSRCTUQTRB-LJQANCHMSA-N 431.422 4.533 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@]2(CBr)CC2(F)F)[C@H](c2ccccc2)C1 2379985470 ILNNBAJAMQEZJV-QFBILLFUSA-N 445.348 4.701 50 10 IJGE COc1cc(/C=N/NC(=O)CSc2nc3ccccc3s2)ccc1OCC(C)C 32520823 AJTAPFWCIBEWGA-SSDVNMTOSA-N 429.567 4.582 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3[N+](=O)[O-])ccc2[C@H]1c1ccc(Cl)cc1 38651345 CJNPTYQYSRMNAO-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE CC[C@@H]1CCC/C1=N/NC(=O)COc1c(C)cc(Br)cc1Br 100057410 OBBZSPMYKYLWLU-PFMFLNCGSA-N 432.156 4.581 50 10 IJGE CCCOc1ccc(/C=C(/C#N)C(=O)Nc2sc3c(c2C(=O)OC)CC[C@H](C)C3)cc1 108861716 QAZWLLKETFBKJL-SUCHYCSPSA-N 438.549 4.994 50 10 IJGE O=C(Nc1nc(CCl)cs1)c1ccc2c(c1)C(=O)N(c1ccccc1Cl)C2=O 170535207 ALDYGRPUJUCOII-UHFFFAOYSA-N 432.288 4.588 50 10 IJGE COc1cc(C[C@@H](Br)C(=O)C2CC2)c(Br)cc1Br 234985656 GDOQUYGHHVLVBA-LLVKDONJSA-N 440.957 4.505 50 10 IJGE O=C(CCCC[C@H]1CCSS1)N1CC[C@@H](Oc2ncccc2Br)C1 238815049 BFZOJZIJAOLYMV-KGLIPLIRSA-N 431.421 4.538 50 10 IJGE COC(=O)[C@H](C)[C@@H]1CC[C@@H]2[C@@]34CC[C@@]5(C[C@H](OC(C)=O)CC[C@@]5(C)C3=CC[C@@]12C)OO4 254592065 FOTZVCWKWXRZRV-CXAHDPGGSA-N 432.557 4.513 50 10 IJGE C[C@H](Br)C[C@@H]1CCCN1c1ncc(Br)cc1Br 304588315 RPGRCOFSYHAZLY-WPRPVWTQSA-N 426.978 4.749 50 10 IJGE CCc1ccc([C@H](Br)c2cnn(C)c2I)cc1CC 381961095 YYOYBZUFLQDHBG-AWEZNQCLSA-N 433.131 4.634 50 10 IJGE CC(=O)N(C)c1ccccc1NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(C)c2)c1C 735640529 HQWALRDDXTWIRF-JCMHNJIXSA-N 426.520 4.931 50 10 IJGE CCc1nn(Cc2ccccc2Cl)c2c1[C@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865701965 JLQFKVYESKCRQE-LJQANCHMSA-N 426.854 4.644 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)CCC1CCN(C(=O)OC(C)(C)C)CC1 1880765895 CLQVSHSLPWADDG-OAHLLOKOSA-N 435.403 4.702 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C2CC2)C1 1883307641 YDUHXRZKZYAXIO-ARFHVFGLSA-N 447.414 4.700 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Br)Cc1ccsc1 1900969089 GLJBLMFMJOKXAT-SSDOTTSWSA-N 428.975 4.685 50 10 IJGE N#C[C@@H]1CN(c2ccc(CBr)c(Br)c2)CCN1Cc1ccccc1 1914891207 LSNSXQKKANZFOT-GOSISDBHSA-N 449.190 4.558 50 10 IJGE CC1(C)C[C@H](Br)CN1C(=O)c1csc(Br)c1Br 1949203710 FUXKYKJIHGBZME-LURJTMIESA-N 446.002 4.661 50 10 IJGE CC1(C)OCCO[C@@H]1[C@@H](Br)c1cc(Br)sc1Br 2013744699 OGEKLESEQJBWTC-DTWKUNHWSA-N 449.002 4.903 50 10 IJGE CN(Cc1cc(Cl)ccc1I)C1CC(CBr)C1 2018085394 OFCITWQNPDOBHE-UHFFFAOYSA-N 428.539 4.550 50 10 IJGE CC[C@H](COC)O[C@](C)(CI)c1ccccc1Br 2033504627 NLTJAMLJHDOVTP-BXUZGUMPSA-N 427.120 4.541 50 10 IJGE CC[C@H](C)CCCN=c1[nH]nc(SCC(=O)C(C#N)=C2Nc3ccccc3S2)s1 2042440523 HEPOJPZNRFRSRN-ZDUSSCGKSA-N 445.639 4.812 50 10 IJGE CC1(C)C[C@@H](O[C@@H](CI)c2ccc(Br)cc2)CO1 2052241278 ODCQAWFETLPJHG-OLZOCXBDSA-N 425.104 4.509 50 10 IJGE ClCc1cc(Br)cnc1N1CC[C@H]2CCN(Cc3ccccc3)C[C@@H]2C1 2092525355 YSLGWLBBOLKBOL-IEBWSBKVSA-N 434.809 4.931 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@@]1(C)CCN(Cc2ccccc2)C1 2153105846 IEGRWTINGDTYHH-NRFANRHFSA-N 447.808 4.905 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc2c(c1)N(CC1(CBr)CCOCC1)CCC2 2163061874 IMQSWHDDQHVFFB-UHFFFAOYSA-N 439.394 4.978 50 10 IJGE CC1(C)CO[C@@H](COc2c(Br)cc(CCl)cc2Br)CO1 2176668201 QVHDLVYAEVDLCK-JTQLQIEISA-N 428.548 4.523 50 10 IJGE Cc1ccc(C(=O)NCC(C)(C)C[C@H](C)Br)cc1I 2224620871 UZPKCHHGONDMCY-NSHDSACASA-N 438.147 4.529 50 10 IJGE CN[C@H](c1c(F)cc(Br)c(F)c1Br)[C@@H]1C[C@@H]1Br 2250747372 LFVFLXPKQJPXLK-WOKAVZEJSA-N 433.916 4.534 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([S@](C)(=O)=NCCCCCCCBr)C1 2263163859 APTSZDWFPMNPJK-LMKMVOKYSA-N 439.460 4.829 50 10 IJGE CCc1nn(C)c([C@H](Cl)c2ccc(OC)c(I)c2)c1Cl 2285009468 MQFWORZNBLLJLF-GFCCVEGCSA-N 425.097 4.577 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2cccc(C(F)(F)F)c2)cc(Br)c1O 2293034773 NMEZAIAUVONWON-UHFFFAOYSA-N 441.203 4.728 50 10 IJGE COc1ccc(C(=O)Oc2cc(C=C(C#N)C(=O)Nc3ccccc3F)ccc2OC)cc1 2294511034 YJKFEUXTHZOPKZ-UHFFFAOYSA-N 446.434 4.608 50 10 IJGE CC(C)(C)C[C@H](Cl)CNC(=O)Cc1cc(Br)cc(Br)c1 2295316272 WLGXNTPNBJYSBC-ZDUSSCGKSA-N 425.592 4.914 50 10 IJGE C[C@@H](Br)[C@@H]1CCN(Cc2ccc(Cl)c(I)c2)C1 2300240693 PCHAVQDRFXYJAS-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE Clc1ccc(CN2CCC[C@@H](CBr)C2)cc1I 2300242528 LQQBVYVHIFCMAS-NSHDSACASA-N 428.539 4.552 50 10 IJGE C[C@H]1OCC[C@]1(CBr)Cc1ccc(Cl)cc1I 2302315231 HHNZHIIFJVEKOI-NOZJJQNGSA-N 429.523 4.677 50 10 IJGE CC1=C(C#N)C(=O)N(C2CCCCC2)C(=O)C1=CNc1ccccc1C(=O)c1ccccc1 2314585686 MNOHSWRODAAUAL-UHFFFAOYSA-N 439.515 4.755 50 10 IJGE FC1(CBr)CCN(Cc2ccc(Cl)c(I)c2)CC1 2315554682 HYQBAOKWAOVUMT-UHFFFAOYSA-N 446.529 4.644 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=CNc2ccc(Cl)cc2C(F)(F)F)cc1 2318455472 UQHWQLPOLGPFGP-UHFFFAOYSA-N 437.805 4.994 50 10 IJGE COc1ccccc1OCC(=O)Oc1ccc(C=C(C#N)c2ccccc2F)cc1OC 2320507054 XSXATTTXGGKUKQ-UHFFFAOYSA-N 433.435 4.891 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)C=Cc1cccc(F)c1 2321178278 JRUHUFOIZJMDHU-UHFFFAOYSA-N 444.293 4.977 50 10 IJGE CCCOc1c(Cl)cc(C=NNC(=O)CSc2nc3ccccc3[nH]2)cc1Cl 2323081469 XNWLPLLCOBVOGI-UHFFFAOYSA-N 437.352 4.901 50 10 IJGE Cl[C@@H]1CN(Cc2ccc(I)c(Br)c2)C[C@@H]1C1CC1 2325226221 MISWZIGDHRNAEK-DGCLKSJQSA-N 440.550 4.503 50 10 IJGE Cl[C@@H]1CCN(Cc2ccc(I)c(Br)c2)[C@@H]1C1CC1 2325234539 YUUWROIBNOEDTI-TZMCWYRMSA-N 440.550 4.645 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C[C@@](C)(CBr)C(C)(C)C)CC1(F)F 2327109892 OGQAGEVKJUSRTE-SUMWQHHRSA-N 427.374 4.668 50 10 IJGE CC(C)COc1ccc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)cc1 14024889 GCTLXQOYUBTYDH-UHFFFAOYSA-N 439.339 4.648 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)c1C 25768101 GRZJDSQZRZFGIO-XNHPLOEXSA-N 435.524 4.900 50 10 IJGE CCCCOc1ccc(/C=C(/C#N)C(=O)Oc2cccc(/C=C(/C#N)C(=O)OCC)c2)cc1 33689073 QEMGNNAHVDNOKI-URBBLPHHSA-N 444.487 4.848 50 10 IJGE Cc1ccc(S(=O)(=O)NNC(=O)c2sc3ccc4ccccc4c3c2Cl)cc1 40838469 GSAHZTQFKHTFPB-UHFFFAOYSA-N 430.938 4.640 50 10 IJGE Cc1ccc(S(=O)(=O)Nc2ccccc2P(c2ccccc2)c2ccccc2)cc1 100253742 VVBXMZHSRZEBAQ-UHFFFAOYSA-N 431.497 4.554 50 10 IJGE ClC[C@@H](I)[C@@H](CCl)OCc1cccc(Br)c1 158544358 BMTYQFZDSKDABT-GHMZBOCLSA-N 437.930 4.616 50 10 IJGE N#C/C(=C/NC1CCN(Cc2ccccc2)CC1)C(=O)Nc1cccc(Cl)c1Cl 217129510 QSQWCQXCKKVWNE-VKAVYKQESA-N 429.351 4.594 50 10 IJGE CC1(C)C[C@H](NC(=O)NC[C@]2(c3ccc(F)cc3F)CC2(C)C)C[C@@](C)(CN=C=O)C1 243461577 NHKOTQILITZNSV-VWMXVWASSA-N 433.543 4.853 50 10 IJGE C[C@@H](Br)C[C@@H](C)CNC(=O)c1cc(Br)sc1Br 397721926 KLDKMGLDHXFPLJ-RNFRBKRXSA-N 448.018 4.813 50 10 IJGE COc1ccccc1CC(=O)NNC(=O)N[C@@H](C)c1ccccc1-c1ccc(Cl)cc1 740060913 AVYPBXTYPWGLAD-INIZCTEOSA-N 437.927 4.650 50 10 IJGE Cc1ccncc1[C@H](C)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 771378771 BZRFFQGDBDTXEB-DAQNXSASSA-N 444.926 4.605 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCc3ccccc32)c(-c2ccccc2)n1 914469772 GWVQJMSMFSLULK-PXJFTPKESA-N 435.531 4.607 50 10 IJGE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2 1463643018 OUJQXRQUGHRMQV-CVCOIXHCSA-N 438.471 4.636 50 10 IJGE C/C(=C/c1ccc(F)cc1)C(=O)NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl 1463680185 FPBGRCQHUWNSLW-NTMALXAHSA-N 431.842 4.919 50 10 IJGE O=C(NNc1c(Cl)cc(Br)cc1Cl)c1cnc(O)c(C(F)(F)F)c1 1620440013 CLSTZEVPBYUQOP-UHFFFAOYSA-N 445.022 4.632 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccccc2Oc2cccc(C)c2)cc1 1665492418 NNKNKJPUALBHCX-SFHVURJKSA-N 447.491 4.610 50 10 IJGE COc1ccc(-c2nn(C)c3c2[C@@H](c2c(Cl)cccc2Cl)C(C#N)=C(N)O3)cc1 1865686397 VFNHWXCNINWJAQ-MRXNPFEDSA-N 427.291 4.621 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1ccc(OC)cc1)C(C#N)=C(N)O2 1865714062 BTWNMKAHKATHCV-NRFANRHFSA-N 434.927 4.764 50 10 IJGE Cc1sc(C)c(C[C@H](CBr)NC(=O)OC(C)(C)C)c1Br 1882067249 QAWHDNXFQVNHCM-SNVBAGLBSA-N 427.202 4.958 50 10 IJGE CN(C)CC(C)(C)CO[C@@H](CI)c1ccc(Br)cc1 1899009822 IGYCVQXYBCSDFN-AWEZNQCLSA-N 440.163 4.530 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](Br)[C@H](OCc2cccc(Cl)c2Cl)C1 1901218498 MRVYWXMIXDUAKW-WCQYABFASA-N 425.150 4.893 50 10 IJGE CC(C)[C@@H](CCl)N(Cc1ccccc1)C(=O)c1cc(I)sn1 1909914049 BLBFNNYUYBSRGJ-CQSZACIVSA-N 448.757 4.654 50 10 IJGE FC(F)(C1CC1)[C@@H](Br)c1cc(I)cc2c1OCC2 1912533546 FQHWIVAXXYFXFR-LBPRGKRZSA-N 429.042 4.707 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1cc(O)cc(Br)c1 1915109829 IVUREFCVUZQWDB-HNNXBMFYSA-N 441.163 4.971 50 10 IJGE CN(NCc1ccc(OC(F)(F)F)c(Br)c1)C(=O)OCc1ccccc1 1936603468 FSULXDSCUJQGEO-UHFFFAOYSA-N 433.224 4.621 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1C(=O)c1csc(Br)c1Br 1945190072 GDIONRFBMCECBI-SVRRBLITSA-N 446.002 4.661 50 10 IJGE CC(C)(C)OC(=O)N1CCCC2(C1)CC1(CC[C@@](C)(CI)O1)C2 1986985101 KRYXZMFYCBEGPF-AOCRQIFASA-N 435.346 4.540 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@@H](OC2CC3(CCCCC3)C2)C1 1989967981 PKSVQMAAIXWSPV-GJZGRUSLSA-N 435.346 4.539 50 10 IJGE CC(C)[C@H](CBr)CN1CCC[C@@H](N(CC(F)F)C(=O)OC(C)(C)C)C1 2044698301 AUPHPBKNTNBKBF-HUUCEWRRSA-N 427.374 4.620 50 10 IJGE BrC[C@@H]1[C@H]2CC[C@H](C2)N1Cc1cc(Br)ccc1Br 2058370552 OHLOEUCHIOUNIH-MRCXROJRSA-N 438.001 4.959 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCN[C@H]1CCc2ccc(Br)cc21 2061264709 SUNIQMCJJACRDT-INIZCTEOSA-N 447.464 4.932 50 10 IJGE Brc1cc2c(cc1[C@H](Br)[C@@H]1C[C@H]1Br)OCCCO2 2076174835 XQSFLEITDXWPIM-HUQFOHBGSA-N 440.957 4.830 50 10 IJGE Brc1cc2c(cc1[C@@H](Br)[C@H]1C[C@@H](Br)C1)OCCO2 2076182058 MTSYOYXQEHAIQW-DAROEXNTSA-N 440.957 4.830 50 10 IJGE Cc1cc(Br)c(C)c([C@H](Cl)[C@H]2CCS(=O)(=O)C2)c1Br 2136372513 UNBMQSWQUJFOII-TVQRCGJNSA-N 430.589 4.543 50 10 IJGE CCCN(C1CCN(Cc2ccccc2)CC1)S(=O)(=O)c1csc(CCl)c1 2143615223 QEVXFNKCVCUXDN-UHFFFAOYSA-N 427.035 4.552 50 10 IJGE BrCc1c(N2CC[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)nc2sccn12 2148938546 JBCOFJOGHILEAI-MSOLQXFVSA-N 445.430 4.639 50 10 IJGE O=C(N[C@@H]1CN(Cc2ccccc2)C2(CCCC2)C1)c1ccc(CBr)cc1 2154527797 BAILEYHIXJACBJ-NRFANRHFSA-N 427.386 4.899 50 10 IJGE CN(C(=O)c1cc(Cl)cc(Br)c1)[C@@H](CCBr)C(F)(F)F 2178516343 VKNOTSQWRXCAGC-JTQLQIEISA-N 437.481 4.890 50 10 IJGE FC1(F)[C@@H]2CC[C@H](O[C@@H](CI)c3ccc(Br)cc3)[C@@H]21 2230422050 WGWBXMWFQKVSDR-MROQNXINSA-N 443.069 4.986 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1[C@@H](C)C[S@@](C)=O 2234059303 IIJPSAIKNACZME-DDIDRBJESA-N 442.604 4.801 50 10 IJGE COC[C@@]1(C)C[C@]1(CBr)Cc1cc(Cl)ccc1I 2257075768 UYCXXYXHKCGUDX-KGLIPLIRSA-N 443.550 4.925 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1cc(Cl)c(O)c(Cl)c1 2264185444 RLUSWMRIEGFUCG-UHFFFAOYSA-N 427.419 4.695 50 10 IJGE CC(C)CN(C[C@H]1CCCN1C(=O)OC(C)(C)C)CC1(CBr)CC(F)C1 2265640533 ZYCUJPGIJWOHMJ-OHTSDLOESA-N 435.422 4.857 50 10 IJGE CCCCO[C@@H]1[C@H](Br)C[C@H]1Oc1cccc(C)c1I 2277956192 PSIDCLQMELOBRW-UXIGCNINSA-N 439.131 4.700 50 10 IJGE COc1cc(F)c(CBr)c(N2CC[C@H]3CN(Cc4ccccc4)C[C@@H]3C2)c1 2283544970 LGYOLISWBQSQKR-ZWKOTPCHSA-N 433.365 4.688 50 10 IJGE COCc1cccc([C@H](Br)c2ccc(OC)c(I)c2)c1 2284996161 HHAHLXWMICFXNZ-INIZCTEOSA-N 447.110 4.931 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](O)[C@H]1C[C@@H](Br)C1 2301501033 CFGPTMKCKVGBTD-KEHGIVTQSA-N 430.937 4.866 50 10 IJGE C[C@@H](Cl)C(C)(C)CNCc1ccc(I)c(Br)c1 2306223616 HNABOQLZPJIWMX-SECBINFHSA-N 430.555 4.797 50 10 IJGE Clc1ccc(CN[C@H](CBr)C2CCCC2)c(I)c1 2318558622 XFKVMTRWGWWYLO-CQSZACIVSA-N 442.566 4.988 50 10 IJGE C[C@@H](CCBr)CCN1C[C@@H]2CC(F)(F)CC[C@]2(NC(=O)OC(C)(C)C)C1 2344107647 DTQJMSBJTXYQFU-MPGHIAIKSA-N 439.385 4.812 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@]3(NC(=O)OC(C)(C)C)CCC[C@@]3(F)C2)C1 2345010488 LXNVZEQSUSKNNM-UXHICEINSA-N 433.406 4.659 50 10 IJGE CCCN(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@]1(CBr)CC1(F)F 2351892358 ODQGRJZWKPKWSW-CRAIPNDOSA-N 439.385 4.766 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)OC(C)C)cc1COc1c(F)c(F)c(F)c(F)c1F 33712236 ICXDKBIONFZOMG-WUXMJOGZSA-N 441.352 4.828 50 10 IJGE CNC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1cccc(OCc2ccccc2)c1 35445971 XGMVMXSEWCJSNM-JCMHNJIXSA-N 434.499 4.771 50 10 IJGE O=C(NNc1ncnc(Oc2ccc3ccccc3c2)c1[N+](=O)[O-])c1ccccc1Cl 40586655 GNRGEYIKYXTGPD-UHFFFAOYSA-N 435.827 4.741 50 10 IJGE CC(C)CC(=O)N/N=C1\C(=O)N(Cc2ccc(Cl)cc2)c2ccc(Br)cc21 40846378 PHWSJXPEOLNOGX-CLCOLTQESA-N 448.748 4.516 50 10 IJGE O=C(COc1ccccc1Br)N/N=C/c1ccccc1OCc1ccccc1 40911723 OZYNYFKICFPBPO-ZVHZXABRSA-N 439.309 4.557 50 10 IJGE COc1ccc(OC)c([C@@H](Br)c2csc(I)c2)c1 124406707 JNIVVNPIUVXCLT-ZDUSSCGKSA-N 439.112 4.854 50 10 IJGE CCCOc1ccc(/C=C2\C(=O)N(Cc3ccccc3)C(=O)C(C#N)=C2C)cc1OCC 214281424 DPJBLJICCQZSHZ-STZFKDTASA-N 430.504 4.667 50 10 IJGE Cn1ncc([C@H](Br)c2cccc3ccccc23)c1I 382205097 RQVUJYFFCBJTKN-CQSZACIVSA-N 427.083 4.662 50 10 IJGE C[C@H]1C[C@H](Br)CN(C(=O)c2cc(Br)sc2Br)C1 401899033 MDEMLMQCNHQOFO-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE FC(F)Oc1cc(I)cc(Br)c1CBr 575682101 JULFXKSZPNPVAC-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])c2ncccc12)c1cc2sc(N3CCCC3)nc2s1 796953208 KBVDQTMDTMNFPB-UHFFFAOYSA-N 426.479 4.634 50 10 IJGE C/C(=C/C#N)N1C(=O)c2ccc(C(=O)Nc3ccc(-c4nc5ccccc5o4)cc3)cc2C1=O 1083991889 YLOIFHLCWLFBFE-QINSGFPZSA-N 448.438 4.770 50 10 IJGE O=C(NN=CC(=NNC(=O)c1ccccc1Cl)c1ccccc1)c1ccccc1Cl 1084184798 JKOGSDMGVNWNMV-UHFFFAOYSA-N 439.302 4.543 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1S[C@H](C)C(=O)NN=C(C)CCCC 1084303899 SRVZZPFQXNNDHA-MRXNPFEDSA-N 449.024 4.893 50 10 IJGE C=CCO[C@@H]1CCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3cccc4ccccc34)c2C)C1 1435663540 CRNSWMFSEJZJBQ-HDMRQQGGSA-N 425.532 4.958 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNC(=O)c1ccc(Br)cc1 1529734831 WRWGUCCXSSXIAX-MDZDMXLPSA-N 428.113 4.620 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C)c1cccc(C(F)(F)F)c1 1538922138 ZRPZHURRLNZNBN-QINSGFPZSA-N 441.453 4.977 50 10 IJGE O=C(NNc1ccc(F)cc1Br)c1ccc(-c2cccc(Cl)c2)nc1O 1566584867 JYCNPDRTFYLJLI-UHFFFAOYSA-N 436.668 4.766 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@@H]1c1cccs1 1865698278 PGANLKPFAAMLNK-AWEZNQCLSA-N 436.846 4.883 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1ccc(C)cc1 1865702868 HFJRPQQVPORGNV-HSZRJFAPSA-N 428.536 4.809 50 10 IJGE CC(C)C[C@H](CNC(=O)OC(C)(C)C)C[C@H](CBr)NC(=O)OC(C)(C)C 1880731270 ZMQLZBNXJMVEKL-LSDHHAIUSA-N 437.419 4.852 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1cnsc1Br 1887458583 RHJQZTDTQUDEEC-LBPRGKRZSA-N 432.181 4.722 50 10 IJGE CC1(C)CN(C(=O)c2cc(Br)sc2Br)[C@H]1CBr 1944088091 ODLXQZXUKLNAFM-ZETCQYMHSA-N 446.002 4.519 50 10 IJGE CC[C@H](C)[C@H](CBr)NC(=O)c1cc(Br)sc1Br 2023035377 IUGWOKGGXDRCRD-XPUUQOCRSA-N 448.018 4.813 50 10 IJGE Brc1cnc(N2CC[C@@H]3C[C@H](Br)CC[C@H]32)c(Br)c1 2027435461 OQEINYHFWQOWIS-KBVBSXBZSA-N 438.989 4.749 50 10 IJGE CCC[C@](C)(CBr)NC(=O)c1c(Br)cccc1Br 2033091053 MQSGIXANTXJTCM-CYBMUJFWSA-N 441.989 4.895 50 10 IJGE CC(C)(C)OC(=O)N1Cc2sc(NC(=O)CCCCBr)nc2C1(C)C 2044175839 NQEQQFOJVLTPPW-UHFFFAOYSA-N 432.384 4.633 50 10 IJGE Fc1cscc1[C@@H](Br)c1cc(I)cc2c1OCC2 2055674299 ASQWVTFDIJUGRW-LBPRGKRZSA-N 439.087 4.911 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCCO2)C[C@]2(C1)C[C@]2(CBr)C(F)(F)F 2083259145 GULBALNQZJCQIM-OWCLPIDISA-N 428.289 4.510 50 10 IJGE Cc1c(Br)ccc([C@H](Br)[C@H]2OCCO[C@@H]2C)c1Br 2083320548 KNOQFPRKQAASQE-JCOFBHIZSA-N 442.973 4.760 50 10 IJGE COCCCN(Cc1ccccc1)S(=O)(=O)c1cc(CCl)c(Cl)cc1Cl 2095873079 ZLKXACDMKMJZCA-UHFFFAOYSA-N 436.788 4.960 50 10 IJGE CC(C)[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)C[C@@H]1C(F)(F)F 2121769734 AFZRZXVZHBTBTN-RRFJBIMHSA-N 445.364 4.916 50 10 IJGE O=C(N1CCC[C@H]([C@H]2CCCCN2CC2(CBr)CCCC2)C1)C(F)(F)F 2163064104 SONMOPHCHVLDGL-JKSUJKDBSA-N 439.360 4.597 50 10 IJGE Cc1c(Cl)cc(CN2C[C@H](C)O[C@@H](CCBr)C2)cc1Br 2179379840 CCRXTZGZSFFAMA-GWCFXTLKSA-N 425.592 4.785 50 10 IJGE CCCCCCN(C)S(=O)(=O)c1ccc(Br)c(CBr)c1 2196727539 IDJSKRUSHSDWNB-UHFFFAOYSA-N 427.202 4.545 50 10 IJGE Cc1cc(C(=O)Nc2ccccc2CBr)ccc1I 2230679632 PSSIGBVEJYQFBA-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE Cc1nc(-c2ccc(I)cc2)nc2c1C[C@@H](CBr)CC2 2237093965 QEVVWRPGZPHOLY-NSHDSACASA-N 443.126 4.556 50 10 IJGE CC(C)C(OC1(CI)CCN(C(=O)OC(C)(C)C)CC1)C(C)C 2244272126 MQGRKEMONHUNPX-UHFFFAOYSA-N 439.378 4.888 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)NC2CCCCC2)ccc1OCc1ccccc1C#N 2293140481 HUHGAVHBGNVLPN-UHFFFAOYSA-N 429.520 4.892 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)N(C)C)c(Br)cc1OCc1cccc(F)c1 2313568267 QVBNDLJPIZXQSO-UHFFFAOYSA-N 447.304 4.561 50 10 IJGE COc1ccc(Br)cc1C=NNC(=O)c1ccc2[nH]c3c(c2c1)C[C@@H](C)CC3 2323163853 UIJAKDXNQNWBCC-ZDUSSCGKSA-N 440.341 4.828 50 10 IJGE CCCCCOc1ccc(C=NNC(=O)c2nn(-c3ccccc3)c3c2CCC3)cc1OC 2323759256 CTWOVMXCGISMPV-UHFFFAOYSA-N 446.551 4.703 50 10 IJGE CCCCN(C=C(C#N)C(=O)Nc1ccc(I)cc1C)CCCC 2325406293 KZMGGCIAFDSDTB-UHFFFAOYSA-N 439.341 4.848 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cccc(C(F)(F)F)c1 2343416129 LSYANMWFFXBZKD-QGZVFWFLSA-N 430.264 4.806 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)CN(C)S(=O)(=O)c1sccc1Br 2366076155 DROOMDWGXYLNGC-LLVKDONJSA-N 447.258 4.577 50 10 IJGE COc1c(F)cc([C@@H](Cl)c2c(Br)c(Br)nn2C)cc1F 2370447323 BONVEUPBYXUPSC-SECBINFHSA-N 430.474 4.560 50 10 IJGE CCOc1cc(/C=N/NC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)ccc1O 40866552 XTUUOBZXNZUWGI-WPWMEQJKSA-N 432.520 4.646 50 10 IJGE CCOc1cc(/C=N\NC(=O)CSc2nc3ccccc3s2)ccc1OC(C)C 137783423 SMSAETQQQYMQHU-UUYOSTAYSA-N 429.567 4.725 50 10 IJGE FC(F)(F)c1cc(-c2nnc(CBr)n2C2CC2)ccc1Br 163154408 NKVPMFBAYXWNCO-UHFFFAOYSA-N 425.046 4.956 50 10 IJGE COc1cc(/C=N/NC(=O)c2cc3ccccc3n2C)cc(Br)c1OC(C)C 169926275 OUJNPJBUKFVETF-FSJBWODESA-N 444.329 4.501 50 10 IJGE COc1ccc([C@@H](Br)c2sccc2I)cc1F 310238762 COOANSMSPGWZMF-LLVKDONJSA-N 427.076 4.985 50 10 IJGE CCC[C@H](CCBr)CNS(=O)(=O)c1c(Cl)cccc1Br 312359773 OEFKYTWFXKMJFX-SNVBAGLBSA-N 447.620 4.582 50 10 IJGE C[C@@H](Br)C[C@@H](C)CNC(=O)c1cc(Br)cc(Br)c1 397814915 FGPLPCLPGXVHLS-RKDXNWHRSA-N 441.989 4.751 50 10 IJGE Brc1cnc(N2C[C@@H]3CC[C@H](Br)C[C@H]3C2)c(Br)c1 398719435 YDKYUJKLPTWCRF-GUBZILKMSA-N 438.989 4.606 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1C(=O)c1cc(Br)c(Br)s1 399471287 MOXIEHQGSQFOFR-RQJHMYQMSA-N 446.002 4.661 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CCC(F)(F)[C@H](CCl)C1 403966228 CRHLAJJQXWZKCY-MRVPVSSYSA-N 431.502 4.548 50 10 IJGE Cc1c(Cl)cccc1NNC(=O)CCc1nc(O)c2c3c(sc2n1)C[C@H](C)CC3 748543879 YWETVLLRRSPGKK-LLVKDONJSA-N 430.961 4.559 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)cc1 768982921 NLGVREZNVDNJJT-KRWDZBQOSA-N 425.426 4.761 50 10 IJGE COc1cccc(NC(=O)NN(C(=O)c2cc(Cl)cc(Cl)c2)C(C)(C)C)c1OC 1088690963 NSCNQCWLLXKJBO-UHFFFAOYSA-N 440.327 4.988 50 10 IJGE Cc1[nH]nc(O)c1NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1160089999 VZAXYWIBBQZNSI-RIYZIHGNSA-N 430.295 4.684 50 10 IJGE C#Cc1ccc(NC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)c(Cl)c1 1220234464 CTZHLVHWESPMAV-UHFFFAOYSA-N 437.858 4.506 50 10 IJGE Cc1ccc(Cl)cc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccco1)CCC2 1772747847 VCKCHIQDCGXXIP-UHFFFAOYSA-N 425.872 4.866 50 10 IJGE CCCc1nn(-c2ccc(Cl)cc2)c2c1[C@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865705621 AETBVHBYAXRUAQ-LJQANCHMSA-N 435.871 4.605 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(OCCCOCc2ccccc2)CC1 1881763814 VTNFRJKHUKCKLF-UHFFFAOYSA-N 442.394 4.775 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)CCc1ccc(NC(=O)OC(C)(C)C)cc1 1887823438 NORISVHXKIXGNX-IYBDPMFKSA-N 425.367 4.598 50 10 IJGE O=S(=O)(c1ccc(Br)cc1Cl)N(CCCCl)Cc1ccccc1 1914609959 PVNNXCJZBRFNFP-UHFFFAOYSA-N 437.186 4.922 50 10 IJGE Cc1ccnc(C(=O)N(Cc2ccccc2)C[C@H](C)Br)c1Br 1927120748 DUXQFJRRIYRYGC-ZDUSSCGKSA-N 426.152 4.578 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Cl)cc(C(=O)NC[C@H]2C[C@@H]2Br)cc1Cl 2020184023 LGLRLYYYVJOHDB-ZJUUUORDSA-N 438.149 4.854 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1c(Br)sc(C)c1C 2081237673 ZMHWKONJPPWLRO-OIBJUYFYSA-N 444.176 4.707 50 10 IJGE Clc1cc(CN2[C@H]3CC[C@H]2CC(Br)C3)ccc1I 2086657324 DFNNPLMZBKKNLV-RYUDHWBXSA-N 440.550 4.835 50 10 IJGE CCN1CCC[C@H]([C@@H](Br)c2ccccc2OCc2ccccc2)S1(=O)=O 2089514390 KQJWGZRUZBDRNK-UXHICEINSA-N 438.387 4.516 50 10 IJGE Fc1ccc2nc(CCl)n([C@]34C[C@@H]3CN(Cc3ccccc3)C4)c2c1Br 2099679048 NJPRJXAYCAGYAM-VLIAUNLRSA-N 434.740 4.908 50 10 IJGE CC(C)(CC(CBr)(CBr)C1CCCCCC1)S(C)(=O)=O 2167896306 WMHWANJYXWGIKE-UHFFFAOYSA-N 432.262 4.946 50 10 IJGE Cn1cnc(Cl)c1CC(CBr)(CBr)c1cccc(Cl)c1 2168232602 XPWHJRZZKVZWQQ-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE Cc1sc(Br)c([C@H](Br)[C@]23CCC[C@@H]2CS(=O)(=O)C3)c1C 2203025055 USXATHPBMTVARZ-OSMZGAPFSA-N 442.238 4.778 50 10 IJGE CCCN(CCCCCI)C[C@H]1CCCN1C(=O)OC(C)(C)C 2211186845 QNYXRNUNHCBVQA-MRXNPFEDSA-N 438.394 4.703 50 10 IJGE Clc1ccc(OCCOCCOCCOCc2ccccc2)c(CBr)c1 2227770726 HDYSXHLGBVIOCS-UHFFFAOYSA-N 443.765 4.864 50 10 IJGE ClCc1c(Br)cccc1OCCOCCOCCOCc1ccccc1 2227771503 LNNFOZZYFOXVIR-UHFFFAOYSA-N 443.765 4.817 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@H]1C[C@H]2[C@H](CBr)NC(=O)OC(C)(C)C 2241631268 VSBSKOSZELPMCK-JKJDWNRSSA-N 447.414 4.604 50 10 IJGE O=C(NC1CCC2(CCC[C@@H](CI)O2)CC1)OCc1ccccc1 2241898408 CPFNAQJZJBMLOC-HFCFLWKCSA-N 443.325 4.598 50 10 IJGE CC[C@@H](Br)[C@@H](CC)NC(=O)c1ccc(Cl)c(I)c1 2256386509 BZNZQMBUZDOVQX-BXKDBHETSA-N 444.538 4.627 50 10 IJGE O=C(N[C@@]1(CBr)C[C@H]2CC[C@H]1C2)c1cc(Br)c(Cl)s1 2268623860 PMCWBTXQFWZGPT-UVPNAGLESA-N 427.589 4.848 50 10 IJGE COc1ccc(Oc2ccc(C)nc2CBr)cc1I 2271390433 XWXOZBDVNLCRPJ-UHFFFAOYSA-N 434.071 4.690 50 10 IJGE Cc1cc(Br)c([C@H](Br)C2(S(C)(=O)=O)CCC2)c(C)c1F 2279141670 KWSUVWVJSQNJHC-ZDUSSCGKSA-N 428.161 4.608 50 10 IJGE CC(C)[C@@H]1[C@H](Br)CCN1C(=O)c1cc(F)c(Br)cc1Cl 2282968345 VDWQDBMTMYNVIC-NOZJJQNGSA-N 427.539 4.876 50 10 IJGE COc1ccccc1Oc1nc2c(C)cccn2c(=O)c1C=C(C#N)c1nc2ccccc2[nH]1 2296542792 RPKCVDBHCKXICI-UHFFFAOYSA-N 449.470 4.744 50 10 IJGE CC(C)C[C@H](CBr)CN1CCC12CCN(C(=O)OCc1ccccc1)CC2 2308058835 XYYAESHVJOXELF-HXUWFJFHSA-N 437.422 4.921 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Br)c1ccc(F)c(F)c1 2316833134 WBTYJCZZURDYJL-QMMMGPOBSA-N 444.899 4.708 50 10 IJGE CCOc1cc(C=NNC(=O)c2c(C)ccc3ccccc23)cc(Br)c1O 2323675234 SJAUHGISJZHQAG-UHFFFAOYSA-N 427.298 4.779 50 10 IJGE CN(C[C@@H](Cl)CCc1ccc(I)c(Br)c1)C1CC1 2325203788 JBDGIVCZIBWWBE-NSHDSACASA-N 442.566 4.688 50 10 IJGE C[C@H]1[C@@H](Br)C[C@@H](C)CN1Cc1cc(I)ccc1Cl 2327396713 GUHJPOVGCFQQRG-NRUUGDAUSA-N 442.566 4.938 50 10 IJGE CC(C)(C)OC(=O)Nc1nc2cc(NC(=O)[C@H]3C[C@@H](Br)C3)ccc2s1 2328526078 QPHGHRLTTHBNQD-AOOOYVTPSA-N 426.336 4.755 50 10 IJGE Cc1cc(-c2csc(C(C#N)=C(O)[C@@H](C)N3C(=O)c4ccccc4C3=O)n2)ccc1F 2331320403 JVRPJGSHAQQCRM-CYBMUJFWSA-N 433.464 4.735 50 10 IJGE COc1ccc(OC)c([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc(Cl)c(Cl)c4)c32)c1 10013816 JKTPOKNQTOIGLR-KRWDZBQOSA-N 443.290 4.619 50 10 IJGE CC(C)CCOc1ccccc1C(=O)NNC(=O)COc1ccccc1-c1ccccc1 14033650 GJZGODMEZNHJIM-UHFFFAOYSA-N 432.520 4.619 50 10 IJGE COc1cc(/C=N/NC(=O)c2ccncc2)ccc1OCc1c(Cl)cccc1Cl 40888730 GHEAZOHBOCKKOW-BRJLIKDPSA-N 430.291 4.740 50 10 IJGE O=C(NC1(CBr)CCCC1)c1ccc(Br)cc1Br 232476306 UMPWKHIBQYRZQG-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE COCCOCCCC(CBr)(CBr)c1ccc(Cl)cc1 234749643 JXZQWHKBTILPTG-UHFFFAOYSA-N 428.592 4.811 50 10 IJGE CC(C)(C)c1ccc(C=NNC(=O)/C(=C\c2cccs2)NC(=O)c2ccccc2)cc1 252630097 UUJWJJHVGXGDOP-CSLZCAIXSA-N 431.561 4.967 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2)ccc1OCCCOc1cccc(C)c1C 254490918 JWVMZDSPACXIDM-UHFFFAOYSA-N 432.520 4.924 50 10 IJGE CC(=NNC(=O)c1ccc(COc2ccc3c(c2)CCC3)o1)c1ccc(-n2ccnc2)cc1 254835857 HSFJISCIOITRHE-UHFFFAOYSA-N 440.503 4.687 50 10 IJGE COc1ccc(OC)c(C=NNC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)c1 256017200 GDVRGXSRCVEUQK-UHFFFAOYSA-N 432.520 4.559 50 10 IJGE FC(F)c1cc(Br)c(I)c(CBr)c1 575687835 WNDOCIKSBIXXJQ-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE CC(C)(C)[Si](C)(C)OCCN1c2ccccc2NC[C@@H]1S(=O)(=O)c1ccccc1 616684791 OLGPPSINSNAAPX-NRFANRHFSA-N 432.662 4.740 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)Nc2cc(F)ccc2O)c(-c2ccc(Cl)cc2)n1 759700443 BCOWOXFGBOLXLV-GDNBJRDFSA-N 435.846 4.508 50 10 IJGE O=C(NN=Cc1cc([N+](=O)[O-])ccc1Cl)c1ccc(NC(=O)C2CCCCC2)cc1 1083914649 LJMIRSNSFFILSW-UHFFFAOYSA-N 428.876 4.531 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(CC)cc2)c(Br)cc1OC 1084154840 ZMYHKWQNYOMYAM-MHWRWJLKSA-N 429.314 4.964 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)c1ccc(Br)cc1Cl)c1ccccc1 1224522577 NOXZHRQVULTMFS-QGZVFWFLSA-N 436.737 4.754 50 10 IJGE CCn1c(O)nc2ccc(C(=O)NNc3c(Cl)cc(Br)cc3Cl)cc21 1566091374 NENRDDXGNRIERA-UHFFFAOYSA-N 444.116 4.588 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1)c1cccc(C(F)(F)F)c1 1587210973 OUTUJSFZTXNKKC-SSZFMOIBSA-N 434.458 4.995 50 10 IJGE C#Cc1ccc(C(=O)NNC(=O)c2ccc(COc3ccccc3-c3ccccc3)cc2)cc1 1624238347 ITINDLIFXWQPCG-UHFFFAOYSA-N 446.506 4.989 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNC(=O)c1ccc(F)cc1Br 1630596491 JAWZRFKIGXZOGH-CLFYSBASSA-N 446.103 4.760 50 10 IJGE Cc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)Nc3cccc([N+](=O)[O-])c3)c(C)c21 1772744303 VMCBAABTZIGXEH-UHFFFAOYSA-N 446.463 4.527 50 10 IJGE CCc1nn(-c2ccc(C)cc2)c2c1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706111 NVWRYLMOPPZIKB-LJQANCHMSA-N 435.871 4.523 50 10 IJGE CCC[C@@]1(C(=O)N(C)CC2CC(Br)C2)CCCCN1C(=O)OC(C)(C)C 1887828820 BAGDIHBZEJZRRJ-PMTKGXAQSA-N 431.415 4.578 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] 1915090141 IDKIWANNHCVQDR-GFCCVEGCSA-N 427.245 4.689 50 10 IJGE CC(C)[C@H](CBr)N(CCn1cc(Br)cn1)Cc1ccccc1 1915288615 LNYMGIGSEHOBJW-KRWDZBQOSA-N 429.200 4.567 50 10 IJGE CCn1cc([C@@H](Br)Cc2ncccc2Br)nc1Br 1924866086 RGGMDLLPHIKQCY-VIFPVBQESA-N 437.961 4.502 50 10 IJGE C[C@@H](Br)CCCNC(=O)c1csc(Br)c1Br 1937737722 LSTZSSIMIRVJFY-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE O=C(N[C@@H]1CC[C@@H](CBr)C1)c1scc(Br)c1Br 1942372756 ZKOWEOHTYCJEBM-RNFRBKRXSA-N 446.002 4.567 50 10 IJGE CC1(C)CN(C(=O)c2cc(Br)sc2Br)[C@@H]1CBr 1944088090 ODLXQZXUKLNAFM-SSDOTTSWSA-N 446.002 4.519 50 10 IJGE C[C@]1(NC(=O)c2cc(Br)sc2Br)CCC[C@@H]1Br 2011553897 AMZDSRUOCYZBBX-CPCISQLKSA-N 446.002 4.709 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H](Br)[C@H](C2CC2)C1 2033087224 USCNBLIFYLWOSM-HZMBPMFUSA-N 438.001 4.817 50 10 IJGE COCCCCO[C@@](C)(CI)c1ccccc1Br 2067245426 SBJQVUKJCMMRCI-AWEZNQCLSA-N 427.120 4.543 50 10 IJGE COc1cc(Br)c(C(=O)N(Cc2ccccc2)[C@@H](C)CCl)cc1OC 2068779968 BQONIOIQJHPQKL-ZDUSSCGKSA-N 426.738 4.736 50 10 IJGE C[C@@H]1C[C@H](O[C@H](CI)c2cccc(Br)c2)CCO1 2084725839 RTXPSHQUIMUQIP-LERXQTSPSA-N 425.104 4.509 50 10 IJGE CCN1CCC[C@@H]([C@H](Br)c2ccc(OCc3ccccc3)cc2)S1(=O)=O 2089514914 NKTSMIVRXDFADE-VQTJNVASSA-N 438.387 4.516 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)CC2CC2)C[C@@H]1CC(F)(F)F 2119510934 BIXFIICJRRGCGC-GJZGRUSLSA-N 443.348 4.671 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@H](CBr)c2ccccc2)CC12CCC2 2163059310 RYUJAABKUJYQMK-RTBURBONSA-N 437.422 4.934 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CN(C(=O)[C@@H](Br)C2CCCC2)C2CC2)CC1 2167031440 IPHOQJKKWIYFJF-SFHVURJKSA-N 443.426 4.578 50 10 IJGE COCc1cc(Br)c([C@@H](Br)[C@@H]2C[C@H](OC)[C@H](OC)C2)s1 2174904398 VMULKBAXOGEDML-MHNYQROPSA-N 428.186 4.533 50 10 IJGE CO[C@@H]1CC(Oc2c(Br)cc(Cl)cc2CBr)C[C@H]1OC 2187175455 YPUQKYLHRYLREB-CHWSQXEVSA-N 428.548 4.569 50 10 IJGE CC[C@H]1CCN(CCCCCI)[C@H](CNC(=O)OC(C)(C)C)C1 2211188213 YYMMZOZSRWZETA-HOTGVXAUSA-N 438.394 4.607 50 10 IJGE CN(C[C@@H]1CC1(Br)Br)C[C@H](Br)C1CCCCC1 2213093872 HQMKAHHDCRYMHN-RYUDHWBXSA-N 432.038 4.768 50 10 IJGE Cc1ccc(Br)c(CNCCSSCCNC(=O)OC(C)(C)C)c1 2215172903 XQOBEINMBADOGO-UHFFFAOYSA-N 435.453 4.753 50 10 IJGE C[C@]1(CNc2ncc(I)cc2Br)CCC[C@@H]1Cl 2249866239 XJXZGSFETVLIBR-CMPLNLGQSA-N 429.527 4.658 50 10 IJGE COc1ccc([C@H](Br)[C@H]2C(F)(F)C23CC3)cc1I 2257359086 WNWZEQKMXQMWJA-WDEREUQCSA-N 429.042 4.781 50 10 IJGE O=C(N[C@@H](CBr)CC(F)(F)F)c1cc(F)c(Br)cc1Cl 2282977293 YRGSSPWMNPZPGN-RXMQYKEDSA-N 441.444 4.687 50 10 IJGE C[C@H]1C[C@H](Br)[C@H](C)CN1C(=O)c1cc(Br)c(F)cc1Cl 2285845167 WPJDMBCJAAMDDX-WEDXCCLWSA-N 427.539 4.876 50 10 IJGE CS(=O)(=O)c1cscc1CC(CBr)(CBr)C1CCCC1 2288540808 JRDYFCZCNJYYTD-UHFFFAOYSA-N 444.254 4.661 50 10 IJGE O=C(NN=CC(Br)=Cc1ccccc1)c1cc(-c2ccc(Cl)s2)[nH]n1 2297533763 XDSXALGHNBAXHR-UHFFFAOYSA-N 435.734 4.943 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1Cc1cc(I)ccc1Cl 2307325096 VNYPCLJJQVTTJS-WCQYABFASA-N 428.539 4.692 50 10 IJGE CCCCN1C(=O)C(=Cc2ccc(OCc3ccccc3)c(OC)c2)C(C)=C(C#N)C1=O 2314611249 RNDDWJCGHBTMRT-UHFFFAOYSA-N 430.504 4.667 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H]2C[C@@H]3CBr)cc1I 2315553681 VUNRNOLKIMUXHB-GYSYKLTISA-N 440.550 4.692 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1csc(C(F)(F)F)c1 2320359333 BFRXHFIRXQLXIC-AWEZNQCLSA-N 436.293 4.867 50 10 IJGE Cc1sc2nc(SCC(=O)NN=Cc3ccccc3)nc(O)c2c1-c1ccccc1 2320482173 ZAGJVPHRRUGIEO-UHFFFAOYSA-N 434.546 4.615 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2ccc3nc(Cc4ccccc4)[nH]c3c2)cc1 2323721157 RUSQFZOTIVEIPK-UHFFFAOYSA-N 425.536 4.764 50 10 IJGE CCOC(=O)c1sc(NC(=O)C(C#N)=Cc2cccc(Cl)c2)c(C(=O)OCC)c1C 2329687290 GYWADCZPDAVHQR-UHFFFAOYSA-N 446.912 4.609 50 10 IJGE Clc1cc(Br)c(CN2C[C@@H]3OCCC[C@@]3(CBr)C2)s1 2345960212 USKRLWDGOMNSMC-WCQYABFASA-N 429.605 4.540 50 10 IJGE COc1cc(Cl)c(CBr)c(N(C)C[C@@]2(Br)CC2(F)F)c1 2365819182 MACABQHHVSOFOB-LBPRGKRZSA-N 433.518 4.852 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1SCC(=O)NN=C1CCCCCC1 59261279 ZNDMMHYSXTWOOW-UHFFFAOYSA-N 447.008 4.648 50 10 IJGE COc1ccc([C@H](Br)c2cccc(I)c2)cc1OC 104048975 OHUCZXLHBQYDAM-OAHLLOKOSA-N 433.083 4.793 50 10 IJGE COc1cc(/C=N/NC(=O)Nc2ccccc2)cc([N+](=O)[O-])c1OCc1ccc(C)cc1 169885147 CQUZYSZRGMFSMC-ZVHZXABRSA-N 434.452 4.646 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C\Nc1ccc(Cl)c([N+](=O)[O-])c1)C12CC3CC(CC(C3)C1)C2 217036035 YZPZRCQQAHTFCI-UORUSPLLSA-N 428.920 4.789 50 10 IJGE CCN(CC)c1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)NN=Cc2cccs2)cc1 252620385 MCZBPMRKIHNGQM-VOTZUISLSA-N 446.576 4.516 50 10 IJGE CCCCCCCCCCCCCC(=O)NCC(=O)NN=Cc1cc(OC)ccc1O 254702335 JGPLNCHXSOMHLF-UHFFFAOYSA-N 433.593 4.668 50 10 IJGE C[C@H](Br)C[C@@H]1CCCCN1C(=O)c1csc(I)c1 310731192 MYFOCKBPRUVFLY-ONGXEEELSA-N 442.160 4.521 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1cccc([C@@H]2CCc3ccccc3N2S(N)(=O)=O)c1 616596044 PMPFBIHEYGOVQC-QFIPXVFZSA-N 446.689 4.948 50 10 IJGE CCC[C@H](CCBr)NC(=O)c1cc(Cl)ccc1I 716856582 SQGJBBHKZDZKTD-SNVBAGLBSA-N 444.538 4.628 50 10 IJGE CCN(C[C@@](C)(CI)O[C@H](C)CC(C)C)C(=O)OC(C)(C)C 725343886 VNSWBFAULCWVQD-RHSMWYFYSA-N 427.367 4.888 50 10 IJGE N#CCCCOc1cccc(C=NNC(=O)c2ccccc2OCc2ccc(F)cc2)c1 726736255 GXOBOCDYDJJNTR-UHFFFAOYSA-N 431.467 4.851 50 10 IJGE C/C(=C/C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)c1ccccc1C(F)(F)F 743832117 GIPHGOWEJNNPKF-KHPPLWFESA-N 429.345 4.563 50 10 IJGE COc1cccc(-c2ccc(CNC(=O)NNC(=O)c3c(Cl)cccc3Cl)cc2)c1 745871511 OLTKXVDHLQQUBI-UHFFFAOYSA-N 444.318 4.813 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C[C@@H](C)c2ccc(Br)cc2)c1C 771022755 NWZHELFOXMMSHQ-CYBMUJFWSA-N 440.345 4.555 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2cc(C)n(-c3cccc(C)c3)c2C)cc1 1084081509 ZPUPTGNRTXSERP-RUZDIDTESA-N 433.552 4.765 50 10 IJGE CC(C)(C)N(NC(=O)Nc1cc(F)ccc1F)C(=O)c1cc(Cl)cc(OCCF)c1 1088694229 AYZHHCUROXMJHC-UHFFFAOYSA-N 443.853 4.944 50 10 IJGE Cn1cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2-c1cccc2ccccc12 1865699399 SRLABIZWWXKJFI-SFHVURJKSA-N 435.409 4.601 50 10 IJGE COc1cccc(-c2nc(Nc3ccc(SC#N)cc3)cc(N3CCO[C@@H](C)C3)n2)c1 1868505051 COXXLVFZTGZOJN-INIZCTEOSA-N 433.537 4.694 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)c1ccc(S(=O)(=O)C(F)(F)F)cc1 1914354144 XCGCDQHSSUHDOA-ZDUSSCGKSA-N 436.293 4.770 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] 1915090142 IDKIWANNHCVQDR-LBPRGKRZSA-N 427.245 4.689 50 10 IJGE Clc1ccccc1C(CBr)(CBr)CC[C@H]1COCCO1 1916658505 LYRFVVRZPHSDCV-LBPRGKRZSA-N 426.576 4.563 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@@]2(CCC[C@@H](CI)O2)C1 1939617854 FTMNDOJPRSFOLP-RLFYNMQTSA-N 437.362 4.834 50 10 IJGE BrC[C@]1(Cc2c(Br)cccc2Br)CCCOC1 1945330193 JWRSJZRJQVCKED-CYBMUJFWSA-N 426.974 4.946 50 10 IJGE FC(F)(CBr)CCNCc1cc(Br)ccc1Br 2012615455 MFMQMUAELHVVCR-UHFFFAOYSA-N 435.932 4.722 50 10 IJGE C[C@H](Nc1ncc(I)cc1Br)[C@H]1CCC[C@@H]1Cl 2015759069 QEKUSUOABRHZKB-NMLBEHRDSA-N 429.527 4.657 50 10 IJGE CC1(C)CC[C@H](CBr)N1c1ncc(Br)cc1Br 2025396947 VDNJHDJWTUICCR-SECBINFHSA-N 426.978 4.749 50 10 IJGE CCN(CC)C[C@H](Br)CCc1ccc(I)c(Cl)c1 2086648478 IMLCGKNREWBMIG-GFCCVEGCSA-N 444.582 4.983 50 10 IJGE C[C@@H]1CCCN(C[C@@H](CBr)c2ccccc2)[C@@H]1CNC(=O)OC(C)(C)C 2106782684 SFSSKXMIHYYXBV-BHIYHBOVSA-N 425.411 4.790 50 10 IJGE CN(C(=O)c1scc(Br)c1Br)[C@@H](CCCl)C(F)(F)F 2122008692 KKZANWROOGMQCV-LURJTMIESA-N 443.510 4.905 50 10 IJGE ClCc1ccc(N2CC[C@H]3OCCN(Cc4ccccc4)[C@H]3C2)cc1Br 2129055633 RSNYEAPEDALTIK-LEWJYISDSA-N 435.793 4.668 50 10 IJGE CC(C)(C)OC(=O)NCc1cccc(CNC(=O)c2ccc(CBr)cc2)c1 2162494405 IOCVORQVTLJDAF-UHFFFAOYSA-N 433.346 4.536 50 10 IJGE CCN(CC1(CBr)CCOCC1)[C@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2163058835 OCLWODKORBLTTP-MSOLQXFVSA-N 447.458 4.584 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@H](CBr)c2ccccc2)CC2(CCC2)C1 2163061719 HSXNGTTVVQKQBQ-OALUTQOASA-N 437.422 4.934 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CCN(C[C@H](CBr)c3ccccc3)CC[C@H]2C1 2163065188 YDZFEIDKXWPIOK-ZCNNSNEGSA-N 437.422 4.744 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CN(C(=O)[C@H](Br)C2CCCC2)C2CC2)CC1 2167031439 IPHOQJKKWIYFJF-GOSISDBHSA-N 443.426 4.578 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1Br)C1(CBr)CCSCC1 2171181700 JBTYMQSYFRYWHR-UHFFFAOYSA-N 441.616 4.835 50 10 IJGE Cn1nc(CN2CCCC23CCC(Br)CC3)c(Br)c1Cl 2202272234 BOALNPOGOGNRQA-UHFFFAOYSA-N 425.596 4.508 50 10 IJGE COC[C@]12C[C@]([C@H](Br)c3cc(Br)c(Cl)cc3F)(CO1)C2 2206081840 JJMNFYZHLVBMAR-MGPQQGTHSA-N 428.523 4.873 50 10 IJGE Cc1cc(Br)c([C@@H](Br)[C@H]2CCCS(=O)(=O)C2)c(C)c1Cl 2232511287 PUGWKOYHRLRMSR-GWCFXTLKSA-N 444.616 4.980 50 10 IJGE Fc1cc(Br)cc2c1nc(CCCl)n2[C@]12C[C@@H]1CN(Cc1ccccc1)C2 2232924915 WRDLDDHKWLETDT-VFNWGFHPSA-N 448.767 4.950 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCCCN(C(=O)OC(C)(C)C)CC1 2242080370 ODIDSQCRJOWPHZ-HUUCEWRRSA-N 435.403 4.702 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)C[C@@H]2CCOC2)c1 2252840560 YRTCDZHDWDZQMD-ONGXEEELSA-N 426.974 4.944 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@H]1COC2(CCC2)C1 2284739708 KRLQHWLUFDMYCR-BXUZGUMPSA-N 449.126 4.621 50 10 IJGE C[C@H]1CCN(Cc2ccc(Cl)cc2I)C[C@@H]1Br 2302325125 DMRCMPIIVIZKGE-CABZTGNLSA-N 428.539 4.550 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@H](CC2CC2)C2CC2)CC1 2303862239 XGSZWKDPEIBYBY-MRXNPFEDSA-N 449.373 4.786 50 10 IJGE C[C@@H](Br)CCCN(C)C(=O)c1ccc(I)c(Cl)c1 2314464002 DCQFWDQKKIVKFO-SECBINFHSA-N 444.538 4.580 50 10 IJGE C=CC[C@@H](Br)[C@H]1CCN1Cc1ccc(Cl)c(I)c1 2315549151 ORTOIOCMXGTPGR-BXUZGUMPSA-N 440.550 4.859 50 10 IJGE CCCOc1ccc(C=NNC(=O)Cc2cc(Cl)ccc2SCC)cc1[N+](=O)[O-] 2323681142 IDCJIFGDPUFPDU-UHFFFAOYSA-N 435.933 4.842 50 10 IJGE C[C@@H]1CCCN(Cc2cc(I)ccc2Cl)[C@@H]1CBr 2327398856 JKQXYBWFZBMSDH-QMTHXVAHSA-N 442.566 4.940 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@H]1CC[C@H](C(F)(F)F)CC1 2343412456 QCHGIQPNSRVSRU-ULQDDVLXSA-N 436.312 4.842 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2C(=O)O)ccc1OCc1ccc(F)cc1 33760524 XJNSVGSKERYPTN-PDGQHHTCSA-N 446.434 4.657 50 10 IJGE N#C/C(=C/c1cccc(C(F)(F)F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Br 33930492 FENNPBCTLWZJBA-WDZFZDKYSA-N 440.175 4.922 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1Cc1cc(Br)cs1 98040466 OEKZVOMITMVECU-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CCCCCCCOc1ccc(/C=C2/C(=O)N(C[C@@H]3CCCO3)C(=O)C(C#N)=C2C)cc1 101337283 AFNGADLKZWDVLB-MWLMUJSGSA-N 436.552 4.807 50 10 IJGE COc1ccc(C(=O)Nc2cccc(/C=C(\C#N)c3nnc(-c4ccccc4)n3C)c2)cc1 210707530 NBQOXUVJXRTUDE-RCCKNPSSSA-N 435.487 4.807 50 10 IJGE Cc1ccccc1[C@H]1CN(C(=O)OCc2ccccc2)C[C@H]1CI 382684318 GLXQMGUOMQAZFQ-MJGOQNOKSA-N 435.305 4.782 50 10 IJGE O=C(N[C@@H](CCl)C1CCCCC1)c1ccc(I)c(Cl)c1 386233857 KFSWGNJEOQVDPN-AWEZNQCLSA-N 426.125 4.862 50 10 IJGE CC[C@H](C)N(CCBr)Cc1cc(Cl)ccc1I 405356024 XZWZOFVOWCLEKD-JTQLQIEISA-N 430.555 4.940 50 10 IJGE Cc1ccc(F)c(NNC(=O)C(=O)Nc2cccc(-c3ccc(Br)cc3)c2)c1 807013587 AKACATVCJUZYLB-UHFFFAOYSA-N 442.288 4.645 50 10 IJGE Cc1cc2ccc(Cl)cc2nc1NNC(=O)c1cc2c(C(F)(F)F)cc(O)nc2o1 1325028497 QDUDLAXATOKOPQ-UHFFFAOYSA-N 436.777 4.819 50 10 IJGE C=CC[C@@]1(C(=O)NN=C(c2ccccc2)c2ccccc2)CCCN1C(=O)OC(C)(C)C 1355156104 KJNVLQGVZCCDPV-SANMLTNESA-N 433.552 4.901 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)CSc3ccc(C)cc3)cc2)cc1 1538741075 MTHDOKDTVOBXMQ-UHFFFAOYSA-N 434.517 4.543 50 10 IJGE C=CCOc1c(Br)cc(CNC[C@@]2(C)C[C@H]2Br)cc1OCC 1658338097 HFXBXSLHTXAACU-NVXWUHKLSA-N 433.184 4.676 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@@H]1c1ccccc1 1865680193 BIGADOCIFPOWPZ-MRXNPFEDSA-N 430.817 4.822 50 10 IJGE CCOc1c(OC)cccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2CC(C)C 1865694008 SVMIKHQPSCGEBD-NRFANRHFSA-N 444.535 4.832 50 10 IJGE CCCSc1ccccc1C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2F)nc1C 1865759876 WUPSLNJSYKKMRZ-UHFFFAOYSA-N 441.503 4.912 50 10 IJGE CC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1880767771 SBAICNRSXNAYJK-QLFBSQMISA-N 435.403 4.558 50 10 IJGE O=S(=O)(c1cc(F)ccc1Cl)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915171045 VVGCDUUBYNYPAA-QGZVFWFLSA-N 446.769 4.844 50 10 IJGE Brc1cccc(Br)c1[C@@H]1CC[C@@H](CI)O1 1931393616 BJPZZFPHTQEYAV-XVKPBYJWSA-N 445.920 4.867 50 10 IJGE C[C@@](CBr)(NC(=O)c1cc(Br)sc1Br)C1CC1 1942791429 FBZZBXHYYRCRNI-NSHDSACASA-N 446.002 4.567 50 10 IJGE Clc1ccc(I)c(CN2CCCC[C@H](Br)C2)c1 2003413286 WDMOVRZFGUBGQG-NSHDSACASA-N 428.539 4.694 50 10 IJGE CC[C@H](CCCBr)NC(=O)c1cc(Br)cc(Br)c1 2036512972 DTAGBUODQRXRQN-GFCCVEGCSA-N 441.989 4.895 50 10 IJGE O=C(CCl)c1cc(I)c(C(F)(F)F)cc1OC(F)(F)F 2055116955 FJWJPARNKSHYFY-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE Cc1oc(C)c(S(=O)(=O)N(Cc2ccccc2)CC(F)(F)F)c1CBr 2059265117 PRXMWRVBFCGSFJ-UHFFFAOYSA-N 440.281 4.545 50 10 IJGE Clc1ccc(I)c(CN2CC[C@H](Br)[C@H]2C2CC2)c1 2067022571 WXQGATGZAUUAMG-GXTWGEPZSA-N 440.550 4.692 50 10 IJGE C[C@H](Cl)c1nc2cc(I)ccc2n1C[C@H]1C[C@H]1Br 2076170245 HAQXLAJKUBZBSB-QXFUBDJGSA-N 439.522 4.724 50 10 IJGE CCN(C[C@H](CBr)c1ccccc1)C[C@H]1CCCN1C(=O)OC(C)(C)C 2106782947 VKSGQJUQIZMCHN-RBUKOAKNSA-N 425.411 4.887 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](C(F)(F)F)CCN1C[C@@H](CBr)C1CC1 2107587289 UQDODWPJUPPSQF-KFWWJZLASA-N 443.348 4.575 50 10 IJGE O=S(=O)(Cc1ccc(Br)cc1)N(Cc1ccccc1)C1(CCl)CCC1 2218988428 ZJSYHEBKMFCUFD-UHFFFAOYSA-N 442.806 4.943 50 10 IJGE Cc1ccc(C(=O)NCC(C)(C)C[C@@H](C)Br)cc1I 2224620870 UZPKCHHGONDMCY-LLVKDONJSA-N 438.147 4.529 50 10 IJGE Cc1sc(C(=O)N2[C@H]3CC[C@H]2[C@@H](F)[C@@H](Br)C3)c(Br)c1C 2237632900 DVHHHNZRHUCPEZ-GMOBBJLQSA-N 425.161 4.606 50 10 IJGE Cc1cc(Br)c(C(=O)N2C[C@]3(F)CCC[C@]3(CBr)C2)s1 2237633431 LMNZLKSJLJIJJF-UONOGXRCSA-N 425.161 4.548 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CCN(CC1(CBr)CC(F)C1)C2 2265639773 VGQCCRDMXMJBGX-UHFFFAOYSA-N 427.358 4.905 50 10 IJGE C[C@@H]1[C@@H](CCl)CCN1Cc1ccc(I)c(Br)c1 2306224082 MPSZFYLMJILMBM-MWLCHTKSSA-N 428.539 4.503 50 10 IJGE CCOc1cccc(-c2nn(-c3ccccc3)cc2C=C(C#N)C(=O)NC2CCCC2)c1 2314522321 DOXAGLZUGWSAMD-UHFFFAOYSA-N 426.520 4.904 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1)c1cccn(Cc2ccc(Cl)c(Cl)c2)c1=O 2323651829 JPRHKNPBVXDDKX-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE C=CC[C@@H](Br)[C@H]1CCN1C(=O)c1cc(F)c(Br)cc1Cl 2360963488 JIKLQQGEVNVTLE-NOZJJQNGSA-N 425.523 4.796 50 10 IJGE CCOc1cccc(N2C[C@H]3CN(Cc4ccccc4)C[C@@]3(C)C2)c1CBr 2367569958 JLCNTCJCPBYHFR-XXBNENTESA-N 429.402 4.939 50 10 IJGE N#C/C(=C/c1c[nH]c2ccc(OCc3ccccc3)cc12)C(=O)Nc1cccc(C(=O)O)c1 2784811 NPEHQUHWGPVTGK-ODLFYWEKSA-N 437.455 4.991 50 10 IJGE COc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCc3ccccc3C#N)c(OC)c2)cc1 59433093 GNVBUSHFWBUNSR-FYJGNVAPSA-N 439.471 4.700 50 10 IJGE CC[C@H](CSC)n1c(CCCl)nc2cc(I)c(F)cc21 133471091 JYAUEQCVCXFNSE-SECBINFHSA-N 426.726 4.875 50 10 IJGE CC[C@H](NC(=O)/C(C#N)=C\NCCc1c[nH]c2ccccc12)c1ccc2c(c1)CCCC2 217192501 OIIRPNJLLLWIGY-PBMMVTTKSA-N 426.564 4.854 50 10 IJGE O=C1OC(=O)[C@@H]2[C@H]3C[C@@H]([C@@H]4Sc5[nH]c(=S)sc5[C@H](c5ccc(Cl)cc5)[C@H]43)[C@H]12 256027105 TZTGJCWNBZDYHI-SGGWTVLCSA-N 435.979 4.647 50 10 IJGE ClCc1nc2ccncc2n1-c1cc(Br)ccc1I 311468013 ABSKRRFFVHOFLE-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE COc1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CBr)cc1Br 394588081 YOWHHPMIHKVXNZ-CHWSQXEVSA-N 449.183 4.803 50 10 IJGE C/C(=N\NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCc1ccc(C)cc1 396177181 KKWUSBALTSNHHG-MTDXEUNCSA-N 427.504 4.526 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccccc1[C@H]1CN(S(=O)(=O)c2ccccc2)CCO1 616604330 VEGFMDKZZBHMPP-JOCHJYFZSA-N 447.673 4.971 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1ccc([C@@H]2Cc3ccccc3N(S(N)(=O)=O)C2)cc1 616670105 TZXYUYRXQKDEBW-OAQYLSRUSA-N 446.689 4.601 50 10 IJGE Cc1cc(Br)c([C@@H](Br)c2nn(C)cc2Br)s1 693098899 DBBKFCDSXNKVBL-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N2CCc3n[nH]cc3C2)c(C)n1-c1cccc(Cl)c1Cl 743901336 HSLJSZPYTWXCRM-SXGWCWSVSA-N 440.334 4.616 50 10 IJGE CCCOc1ccc(Oc2ncccc2CNC(=O)NNc2cccc(F)c2F)cc1 745594085 BWIZJMYSJFPZNK-UHFFFAOYSA-N 428.439 4.767 50 10 IJGE Cc1cc(S(=O)(=O)Nc2cccc(S(F)(F)(F)(F)F)c2)ccc1OCC(=O)O 762455618 BUAPBYULIASMBZ-UHFFFAOYSA-N 447.403 4.917 50 10 IJGE COc1cc(C=NNC(=O)c2ccc3ccccc3n2)ccc1Oc1ccccc1[N+](=O)[O-] 1084540899 UJJVFXLSECLUET-UHFFFAOYSA-N 442.431 4.708 50 10 IJGE C=CCO[C@H]1CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3cccc4ccccc34)c2C)C1 1435663539 CRNSWMFSEJZJBQ-DFOZZHOTSA-N 425.532 4.958 50 10 IJGE Cc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1cccc([N+](=O)[O-])c1)CCC2 1772746033 OOJMMHHZURGVKV-UHFFFAOYSA-N 446.463 4.527 50 10 IJGE COc1cc(C=NNC(=O)COc2cccc(C)c2C)ccc1OCc1ccc(C)cc1 1772753379 XWWHXEYRMNLOBA-UHFFFAOYSA-N 432.520 4.729 50 10 IJGE CCN(CC)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3CC(C)C)cc1 1865702144 NYCGBCMVUFKHOV-KRWDZBQOSA-N 433.478 4.622 50 10 IJGE CCOc1ccc(-c2csc(/C(C#N)=C(\O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)n2)cc1 1872747776 TURYLEHGHBNMSB-ZPHPHTNESA-N 438.421 4.975 50 10 IJGE Cc1sc(C)c(C[C@@H](CBr)NC(=O)OC(C)(C)C)c1Br 1882067248 QAWHDNXFQVNHCM-JTQLQIEISA-N 427.202 4.958 50 10 IJGE Clc1ccc(I)c(C[C@@]2(CBr)CC=CCO2)c1 1946375206 QLVMTRQNMUGMDC-CYBMUJFWSA-N 427.507 4.597 50 10 IJGE Cc1cc(Br)c(CBr)c(N2CCN(Cc3ccccc3)CC2)c1 1981765162 JWWSVJKSSJGQNA-UHFFFAOYSA-N 438.207 4.975 50 10 IJGE O=C(N[C@@H]1CCC[C@@H]1CBr)c1c(Br)cccc1Br 2033096909 ZRADXYIKRYGNJS-LDYMZIIASA-N 439.973 4.505 50 10 IJGE O=C(CBr)c1cc(Br)c(OC(F)(F)F)cc1C(F)(F)F 2054795975 MGWVQAMVMHGJSY-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE C[C@H](Br)[C@@H]1CCCN(Cc2ccc(I)c(Cl)c2)C1 2086658682 POHZFWBMBXZTAF-CMPLNLGQSA-N 442.566 4.940 50 10 IJGE CS(=O)(=O)c1csc([C@H](Br)c2cccc(F)c2Br)c1 2093075240 UXBVTIZQMREJDE-GFCCVEGCSA-N 428.142 4.538 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@@H](Br)c2cc(Br)c(Cl)s2)C1 2137224883 DZZKFFAPCLSRAO-JWYUURKGSA-N 448.629 4.815 50 10 IJGE CS(=O)(=O)c1sccc1[C@H](Br)c1ccc(F)c(Br)c1F 2150556282 LZCXMZCFEFHQKK-SECBINFHSA-N 446.132 4.677 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)[C@@H](Br)C2CCCC2)cc1 2167044252 WKKAYVBJIKQBRR-KDOFPFPSSA-N 439.394 4.842 50 10 IJGE COc1cc(F)c(Br)cc1[C@H](Cl)c1nn(C)c(Br)c1C 2168215721 MWQWFRZDNXMILW-NSHDSACASA-N 426.511 4.729 50 10 IJGE CN(C(=O)c1ccc(Br)cc1Br)[C@H](CCCl)C(F)(F)F 2178514900 HDBTXBDJRGYSLS-SNVBAGLBSA-N 437.481 4.843 50 10 IJGE C[C@@H](CC1CCN(C(=O)[C@@H](Br)C2CCCC2)CC1)N(C)C(=O)OC(C)(C)C 2203636462 BAOMZIKYHCBZAE-YJBOKZPZSA-N 445.442 4.824 50 10 IJGE Fc1c(C[C@]23CO[C@](CI)(C2)C3)ccc(Cl)c1Br 2222281923 QZJIFQWSQQMBKH-BETUJISGSA-N 445.497 4.768 50 10 IJGE COCCSCCn1c(CCl)nc2cc(Br)c(Br)cc21 2234076529 XJRVYQHXTMZKFP-UHFFFAOYSA-N 442.604 4.680 50 10 IJGE CCC[C@H](CBr)CN1CC[C@@H](NC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2254964927 RNBGRPSWKPEBFA-MGPQQGTHSA-N 431.337 4.718 50 10 IJGE COc1cc(Cl)c([C@@H](Cl)c2cc(I)sn2)c(OC)c1 2277608240 GAUIMGSTSRSNPT-LBPRGKRZSA-N 430.094 4.747 50 10 IJGE CC(F)(F)C[C@H](CBr)NC(=O)c1cc(Br)c(F)cc1Cl 2285956574 HUSMGWXIANEMDL-ZCFIWIBFSA-N 437.481 4.780 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc(OC(C)C)c(OC)c2)sc(C)c1C 2296818197 YKJIWHOUISPYJW-UHFFFAOYSA-N 442.537 4.883 50 10 IJGE O=C(NN=CC(Br)=Cc1ccccc1)[C@@H]1COc2cc3ccccc3cc2O1 2296845216 IAZPECNVYCBUQO-NRFANRHFSA-N 437.293 4.518 50 10 IJGE C[C@H]1[C@H](Br)C[C@@H](C)CN1Cc1ccc(Cl)c(I)c1 2315548222 DWXYRILLOWORSW-JFGNBEQYSA-N 442.566 4.938 50 10 IJGE CC1(C)CC[C@@H](CCl)N(C(=O)c2ccc(Cl)cc2I)C1 2365588666 MONLGXVVDRQJDB-NSHDSACASA-N 426.125 4.814 50 10 IJGE O=C(NCC[C@@H]1CCCC[C@H]1Cl)c1ccc(Cl)cc1I 2365592374 PLPQHYLMEUHHPP-GXFFZTMASA-N 426.125 4.862 50 10 IJGE C=CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(C)cc2)cc1 38649230 ZAAVITPCMILIJE-RUZDIDTESA-N 438.483 4.997 50 10 IJGE O=C(CCc1ccccc1)N/N=C1/C(=O)N(Cc2cccc3ccccc23)c2ccccc21 59160807 RDHFKXRBBWRLQY-KDJFERLWSA-N 433.511 4.840 50 10 IJGE CC1(C)C[C@H](N=C=O)C[C@](C)(CNC(=O)NC[C@]2(c3ccc(F)cc3F)CC2(C)C)C1 170290751 KVOAOFVALQDWEF-DPSWKAHMSA-N 433.543 4.853 50 10 IJGE COc1cc(N/C=C(/C#N)C(=O)Nc2ccc(Br)cc2)c(OC)cc1Cl 216792869 DHNMEFKPOCHNAI-KHPPLWFESA-N 436.693 4.578 50 10 IJGE CCOc1ccc(CCN/C=C(/C#N)C(=O)Nc2cc(Cl)ccc2C)cc1OCC 217214463 LIQFKVRYDVSMSA-SDXDJHTJSA-N 427.932 4.624 50 10 IJGE CCC[C@H](C)COC1(CI)CCN(C(=O)OC(C)(C)C)CC1 233330438 ZOQRDJBRUXROGP-AWEZNQCLSA-N 425.351 4.644 50 10 IJGE CC[C@H](C)N(CCBr)C(=O)c1cc(Br)cc(Br)c1 310776887 NXVSDRMELCLAJK-VIFPVBQESA-N 441.989 4.847 50 10 IJGE ClCc1cc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)ncc1Br 705846041 OMARHRHVHIUOLZ-VELGLUOQSA-N 446.820 4.930 50 10 IJGE CCN(CC)C(=O)[C@@H](c1cccs1)N(C(=O)CCl)c1cccc(C(F)(F)F)c1 725240017 ITELXLUBSWMTJI-QGZVFWFLSA-N 432.895 4.948 50 10 IJGE CC(C)(C)OC(=O)Nc1ccccc1CC(=O)NNc1ccc(C#N)cc1C(F)(F)F 799749009 JHFGDGXEQPLPLP-UHFFFAOYSA-N 434.418 4.610 50 10 IJGE COc1ccc(C2(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)CCCC2)cc1OC 799751273 MFSOUVHYNYJELS-UHFFFAOYSA-N 433.430 4.549 50 10 IJGE C=CC[C@]1(C(=O)NNc2nc3cc(Cl)ccc3cc2C)CCCN1C(=O)OC(C)(C)C 1137829872 GVJSXKPAIRQYIK-HSZRJFAPSA-N 444.963 4.986 50 10 IJGE C=CC[C@H](C(=O)NNc1nc2ccccc2c(=O)n1-c1ccc(C)cc1C)c1ccccc1 1146770105 DJJQGJOHNVDZJJ-NRFANRHFSA-N 438.531 4.806 50 10 IJGE CC(=O)c1ccc(OCCCC(=O)NNc2c(Cl)cccc2Br)cc1 1651126510 HVNLYABSMKRSRH-UHFFFAOYSA-N 425.710 4.607 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccc(Cl)c2)CCC3)nc1 1772749168 XRMSPLCEKFCRIO-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE C[C@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(Br)c1 1914662941 BQJJHQJYIHOMAN-LBPRGKRZSA-N 437.186 4.921 50 10 IJGE CC(C)(C)OC(=O)NCCN(Cc1ccccc1)C[C@@H](CBr)C1CCC1 1953584359 KAXUCFSWDHKWJQ-LJQANCHMSA-N 425.411 4.825 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OCC2CC3(CCC3)C2)C1 2017328853 KVMCQYIQOVSMPG-LJQANCHMSA-N 449.373 4.788 50 10 IJGE Fc1cccc([C@@H](Br)c2ncn3ccsc23)c1I 2083990710 KTFQKZQSIJTOFI-SECBINFHSA-N 437.075 4.624 50 10 IJGE FC(F)[C@H]1CCc2c3c(cc(I)c2[C@H](Br)C1)CCO3 2094490335 ZPBWNDLVZJOQDD-WCBMZHEXSA-N 443.069 4.880 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@@H]1CCC[C@H]1CNC(=O)OC(C)(C)C 2106786237 SYUHZSHASIKCQD-GBESFXJTSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)NCCc1cccc(NC(=O)[C@@H](Br)C2CCCC2)c1 2139240891 KZJXBNJZEUMINB-KRWDZBQOSA-N 425.367 4.646 50 10 IJGE Brc1ccc([C@H](CI)O[C@H]2C[C@H](n3ccnc3)C2)cc1 2183660603 MJACKOHVGCGINK-KKUMJFAQSA-N 447.114 4.542 50 10 IJGE COC[C@@]1([C@H](Br)c2cc(Br)cc(Cl)c2OC)CCCO1 2203013820 YPAXLEHDGZYSBL-ZIAGYGMSSA-N 428.548 4.743 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CBr)OCc1ccc(C(F)(F)F)cc1 2223305085 XKUVVNKMCIASAI-INIZCTEOSA-N 426.273 4.900 50 10 IJGE COc1ccc(Br)c(CCl)c1OCc1sncc1Br 2227726525 FRVLSPDQOXLINF-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE C[C@@](CI)(O[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1F 2250381575 PNDLOEOIRGLOPF-XLIONFOSSA-N 439.312 4.767 50 10 IJGE COc1csc([C@H](Br)c2ccc(OC)c(I)c2)c1 2257367610 MVCKRGXAIDAUQC-CYBMUJFWSA-N 439.112 4.854 50 10 IJGE C=CC[C@]1(CCl)CCN(C(=O)c2cc(Br)c(Br)s2)C1 2272171315 AIWGJTOTDZPIEV-CYBMUJFWSA-N 427.589 4.920 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1cc(F)c(Br)cc1Cl 2282973879 DLTNNGZXFNHPBB-QMMMGPOBSA-N 447.595 4.878 50 10 IJGE CSc1ccc(C=C2CNCC3=C2OC(N)=C(C#N)[C@H]3c2ccc(SC)cc2)cc1 2297504873 HFJDDCKHGKRXBV-JOCHJYFZSA-N 433.602 4.879 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1Cc1ccc(Cl)c(I)c1 2300238727 OJYYZBVFAARIMT-NOZJJQNGSA-N 428.539 4.692 50 10 IJGE C[C@@H]1CN(CC2(CBr)CC(C)(C)C2)C[C@@H](C)N1C(=O)OCc1ccccc1 2304520496 JUSZVEDIJGAHAI-QZTJIDSGSA-N 437.422 4.919 50 10 IJGE Cc1cccc(COc2ccccc2C=C(C#N)C(=O)N2CCN(c3ccccc3)CC2)c1 2313566899 CYHSBWKLLQFSAI-UHFFFAOYSA-N 437.543 4.830 50 10 IJGE N#CC(=CNc1ccc(Oc2ccccc2)cc1)C(=O)N1CCN(c2ccc(F)cc2)CC1 2318462127 CBIKXPBLDFMXRA-UHFFFAOYSA-N 442.494 4.786 50 10 IJGE CCc1ccc(C=NNC(=O)c2cccn(Cc3ccc(Cl)c(Cl)c3)c2=O)cc1 2323651827 JOXWJGWSXSOYLO-UHFFFAOYSA-N 428.319 4.530 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCc2sc(CNC(=O)OC(C)(C)C)nc2C1 2353834870 PLCXNLYOSXGEKC-AWEZNQCLSA-N 446.455 4.583 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@](C)(CBr)C(C)(C)C)[C@]2(CCCOC2)C1 2380168324 MBRVCBGCXZECLQ-ORYQWCPZSA-N 447.458 4.582 50 10 IJGE COc1ccc(/C=N/NC(=O)COc2ccc(C(C)C)cc2Br)c(C)c1C 14014695 ZVYBNSSHOAFNHW-FOKLQQMPSA-N 433.346 4.727 50 10 IJGE CCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccc(OC)cc1 38650403 IGLZYDBUNJEFST-XMMPIXPASA-N 442.471 4.531 50 10 IJGE Cc1c(C(=O)Nc2ccccc2)oc2c1/C(=N/NC(=O)c1ccc3ccccc3n1)CCC2 40825872 UCRRTQMWDKHWPC-ZTKZIYFRSA-N 438.487 4.859 50 10 IJGE CCOc1cc(/C=C2\C(C)=C(C#N)c3nc(N)c(C#N)c(C)c32)cc(Br)c1O 53287904 HHFJKFHRYRLALI-WLRTZDKTSA-N 437.297 4.562 50 10 IJGE CCOc1cc(/C=N/NC(=O)CC[C@H](O)c2ccccc2)ccc1OCc1ccccc1 58887352 BKVODXRRQGEUTK-UBCTUXONSA-N 432.520 4.628 50 10 IJGE O=S(=O)(Nc1cccc(CBr)c1)c1ccc(Br)cc1Cl 137111488 QUYKIOHRKXJODB-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE CN([C@H]1CCCC[C@@H]1Cl)S(=O)(=O)c1c(Cl)cc(Br)cc1Cl 158227848 WWBVDWNYBQLRGV-CABZTGNLSA-N 435.598 4.926 50 10 IJGE O=C(N/N=C\c1ccc(Cl)c(Cl)c1)c1cccn(Cc2cccc(Cl)c2)c1=O 169920707 GIXDTRDSUAURFU-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE COc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3cc4ccccc4cc3O)cc2)cc1 252607299 GZRLASQDSRMNPY-UHFFFAOYSA-N 440.455 4.537 50 10 IJGE COc1ccc(C=NNC(=O)c2cccc([N+](=O)[O-])c2)cc1OCc1ccccc1Cl 252609034 HPLIZCGXSVGHBC-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE O=C(NN=Cc1cccc(OCc2ccccc2)c1)C(O)(c1ccccc1)c1ccccc1 254480017 DHOMZKQJCAHTEF-UHFFFAOYSA-N 436.511 4.652 50 10 IJGE CO[C@H](CO[C@](C)(CI)c1ccccc1Br)C(C)C 389316794 RZJFCRBMSOXUEK-HUUCEWRRSA-N 441.147 4.787 50 10 IJGE C[C@H](CCCCCl)NC(=O)c1cc(Br)ccc1I 398597375 SFHRSYQZUIGTSF-SECBINFHSA-N 444.538 4.581 50 10 IJGE FC(F)Oc1c(I)cc(C(F)(F)F)cc1CBr 575722824 GXIBOCMKNRVTAW-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE Cc1cc(C(=O)CCl)c(C)n1CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 705613919 BTKMEGOOQPNGIT-UHFFFAOYSA-N 436.983 4.998 50 10 IJGE O=C(N[C@H](CCCl)C1CCCC1)c1ccc(I)c(Cl)c1 725043226 LAKNZQZMRRUSET-CQSZACIVSA-N 426.125 4.862 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OCCOC2CCCCCC2)c(-c2ccccc2)n1 740944484 FESTYUIGYWUVTJ-FXBPSFAMSA-N 432.524 4.653 50 10 IJGE CC(C)(C)[S@](=O)Cc1cccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1 799400626 VKFOJZROCNGYHT-SSEXGKCCSA-N 438.475 4.773 50 10 IJGE COc1ccccc1OCC(=O)NN=Cc1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1084192504 MQCHOEXDLKLHAQ-UHFFFAOYSA-N 446.334 4.939 50 10 IJGE C=CCc1cc(/C=C(\C#N)C(=O)Nc2cccc(Cl)c2Cl)ccc1OCC(=O)O 1084276356 YXRCFFULQAEOAL-XNTDXEJSSA-N 431.275 4.731 50 10 IJGE C=CCO[C@@H]1CCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1 1566816825 VBNQEFRTFQRMJW-BHSBJAHRSA-N 443.469 4.823 50 10 IJGE Cc1ccc(Cl)cc1NNC(=O)CCSCc1nc(O)c2c3c(sc2n1)CCC3 1602897172 ZXCIAAVZMSQXHQ-UHFFFAOYSA-N 449.001 4.614 50 10 IJGE CCCN1C(=O)C(=NNC(=O)CCCOc2ccc(Cl)cc2Cl)c2cc(C)ccc21 1772720599 TYEFERLNDIXSDL-UHFFFAOYSA-N 448.350 4.738 50 10 IJGE O=C(NNS(=O)(=O)c1ccc(Cl)cc1)c1ccc(-c2ccc3ccccc3c2)s1 1860405724 VHNFCBLRZNGVMZ-UHFFFAOYSA-N 442.949 4.845 50 10 IJGE CCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccccc1O)C(C#N)=C(N)O2 1865707667 CLQIWVUMMUCVBU-SFHVURJKSA-N 427.291 4.665 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C[C@H]1CCCC[C@H]1NC(=O)OC(C)(C)C 1890792166 SHZRTEQOQQLTKB-QLFBSQMISA-N 435.403 4.748 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2cccnc12 1915322954 HIHGNWNKTVUUJI-IBGZPJMESA-N 447.398 4.845 50 10 IJGE C[C@H](Oc1cccc(Cl)c1)C(=O)N(C)C[C@H](Br)COCc1ccccc1 1916346362 BVGSCWVOUYIGPL-RDJZCZTQSA-N 440.765 4.546 50 10 IJGE Cc1c(Br)sc([C@@H](Cl)[C@H]2CCCCS2(=O)=O)c1Br 1922942218 QXYAAPUSYHAEKF-APPZFPTMSA-N 436.618 4.829 50 10 IJGE FC(F)(F)[C@H](CBr)NCc1c(Br)cccc1Br 1945323398 RHMULJUHQJJMGC-VIFPVBQESA-N 439.895 4.627 50 10 IJGE Br[C@H](c1sccc1I)c1ncn2ccsc12 1994414139 UQGFCVYARPQKGZ-ZETCQYMHSA-N 425.114 4.546 50 10 IJGE Cl[C@H]1CCCCC[C@H]1Nc1ncc(I)cc1Br 2015757141 PCSAHTVZDXFZLU-WDEREUQCSA-N 429.527 4.801 50 10 IJGE FC1(F)C[C@@]1(Br)COc1ccc(Br)c(CBr)c1 2023780422 UJANSDRBSICOCC-SNVBAGLBSA-N 434.900 4.896 50 10 IJGE C[C@]1(CBr)CC(F)(F)CN1C(=O)c1cscc1OCc1ccccc1 2041122037 OZMDATAHWCBSFM-QGZVFWFLSA-N 430.314 4.962 50 10 IJGE BrCC1CC2(CCN2Cc2cccc(Br)c2Br)C1 2042654024 VCRGWHVSNNNZAR-UHFFFAOYSA-N 438.001 4.961 50 10 IJGE CC(C)[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)ccc1F 2059264135 ASWXCTOWMSKXPS-HNNXBMFYSA-N 428.367 4.956 50 10 IJGE FC(F)(F)c1cc(I)ccc1NC[C@H]1C[C@@H](Br)C1 2076192209 XIAUDQPAJMPQJO-OCAPTIKFSA-N 434.037 4.895 50 10 IJGE BrC[C@]12CC[C@H]1CN(Cc1c(Br)cccc1Br)C2 2078146654 ZJANMRVPIHJSBR-HZMBPMFUSA-N 438.001 4.819 50 10 IJGE CC[C@](C)(CCCl)NC(=O)c1ccc(Br)cc1I 2086148272 YMETVGOKLQYAJH-CYBMUJFWSA-N 444.538 4.581 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H]1n1c(CCCl)nc2cncc(Br)c21 2095447764 MMQSNYGIMACYSD-KDOFPFPSSA-N 433.781 4.668 50 10 IJGE CN(C(=O)c1scc(Br)c1Br)C1(CCl)CCSCC1 2114725153 PNKWWDHAMKBELQ-UHFFFAOYSA-N 447.645 4.850 50 10 IJGE Cc1cc(CBr)ccc1N1CCC[C@]2(CN(Cc3ccccc3)CCO2)C1 2151742059 ZCTNBEILSCWKLQ-QHCPKHFHSA-N 429.402 4.761 50 10 IJGE Cn1nc(CC(CCl)(CCl)c2ccccc2Br)cc1Br 2168212260 QDYZDGITEWZTNW-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE CCC(CC)CCN(C)S(=O)(=O)c1cc(CBr)sc1Br 2179791425 QWKGYEINYDMFNF-UHFFFAOYSA-N 447.258 4.852 50 10 IJGE CC(C)C(O[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1)C(C)C 2244285905 NLRXRXMCVWFJGM-SFHVURJKSA-N 439.378 4.888 50 10 IJGE COc1ccc(C(=O)N(CCCBr)Cc2ccccc2)c(Cl)c1OC 2256278899 GVDBSWCVYIYLNJ-UHFFFAOYSA-N 426.738 4.785 50 10 IJGE COc1ccc([C@H](Br)C[C@H]2C[C@@H](OC)C2)cc1I 2257371068 WSSHFTNTQWIODN-ADEWGFFLSA-N 425.104 4.551 50 10 IJGE C[C@@]1(CBr)C=CCCN1C(=O)c1cc(F)c(Br)cc1Cl 2282987728 HYTFSLVVJDLJNR-AWEZNQCLSA-N 425.523 4.797 50 10 IJGE CC(C)CN(C[C@H](C)Br)C(=O)Cc1ccc(Br)cc1Cl 2288050763 YTCXFSLTYDQFFK-NSHDSACASA-N 425.592 4.913 50 10 IJGE N#CC(=Cc1cnn(Cc2ccccc2Cl)c1)C(=O)Nc1ccccc1Br 2297607659 WFTWHDYQVLVZQA-UHFFFAOYSA-N 441.716 4.893 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1Cc1ccc(Cl)cc1I 2302316572 XADUHQGSFJQNIK-SKDRFNHKSA-N 428.539 4.692 50 10 IJGE CCCCOc1ccc(C=C(C#N)C(=O)Nc2sc(C(=O)OCC)c(C)c2C#N)cc1 2314735418 SWVJEYFYNIOCQE-UHFFFAOYSA-N 437.521 4.829 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)C=Cc1ccc(F)cc1 2321176146 CCVCBQDZLCRLIU-UHFFFAOYSA-N 444.293 4.977 50 10 IJGE CCCCCOc1c(OC)cc(C=C(C#N)c2nc(O)c3ccccc3n2)cc1[N+](=O)[O-] 2323858255 YLXNTNHOLRCIHW-UHFFFAOYSA-N 434.452 4.885 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(C)CN(C[C@@](C)(CBr)C(C)(C)C)CC1(F)F 2327110036 PNVJVWVRDQRUJW-IAGOWNOFSA-N 427.374 4.668 50 10 IJGE N#CC(=C(O)CNC(=O)c1ccc(Cl)cc1)c1nc(-c2ccc(F)cc2F)cs1 2331286736 FGQHNRYRWWYEJG-UHFFFAOYSA-N 431.851 4.964 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C)CN(C[C@@H](CBr)c2ccccc2)CC1(F)F 2379683777 UBOLCKVPHBFFLE-APWZRJJASA-N 447.364 4.647 50 10 IJGE CC[C@@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)COc1cccc2ccccc12 10683595 VWCLHBSXQZYSGW-XMSQKQJNSA-N 434.536 4.737 50 10 IJGE COc1ccc(/C(C#N)=C\c2ccc(OC(=O)COc3ccccc3)c(OC)c2)cc1OC 31902061 RBWGCWBYURACKH-MOSHPQCFSA-N 445.471 4.761 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@H]2C)oc2c1/C(=N/NC(=O)c1ccccc1)CCC2 40804077 SISXCHIPNOWZOK-BMJQMZGESA-N 427.504 4.650 50 10 IJGE COc1ccc(/C=N/NC(=O)COc2ccc(C)cc2C(C)(C)C)cc1Br 40840423 QRQPBNXDSDEGII-FSJBWODESA-N 433.346 4.593 50 10 IJGE CC[C@@H]1CCC[C@H](O[C@@](C)(CI)CNC(=O)OC(C)(C)C)C1 231317009 WIFIBBPYTSMREM-KEYYUXOJSA-N 425.351 4.690 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)CN(Cc2ccccc2)Cc2ccccc2)cc1 254302438 KZQONJGFSWBNKH-UHFFFAOYSA-N 428.580 4.685 50 10 IJGE CC[C@@H](NC(=O)c1cc(Br)sc1Br)[C@@H](C)Br 386959732 YVVJDVGXMINKPX-IYSWYEEDSA-N 433.991 4.565 50 10 IJGE FC(F)c1cc(I)c(Br)c(CBr)c1 575686861 RKBNGHFXQFXPTH-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE O=C(N[C@H]1CCC[C@H](Br)C1)c1scc(Br)c1Br 705449094 XPMUMNVDAGNWRF-BQBZGAKWSA-N 446.002 4.709 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1C(=O)c1scc(Br)c1Br 705491318 SGKBZXFKJBBUSB-RNFRBKRXSA-N 446.002 4.661 50 10 IJGE COc1ccc(Oc2ncc(CBr)cc2C)cc1I 712918916 HBFWEMORFWMENI-UHFFFAOYSA-N 434.071 4.690 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)c1C 736694219 QUHBVPYXAGPAMM-JKSUJKDBSA-N 428.323 4.709 50 10 IJGE O=S(=O)(CCCCCl)N(Cc1ccccc1)C[C@H](O)c1ccccc1C(F)(F)F 780840168 ROYODWKLMYWXDU-IBGZPJMESA-N 449.922 4.590 50 10 IJGE Cc1ccccc1NNC(=O)C(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 783331314 QXIVHAHXOUELTR-UHFFFAOYSA-N 443.425 4.675 50 10 IJGE CC(C)(C)c1ccc(NNC(=O)C(=O)Nc2cc(-c3ccccc3)nn2C(C)(C)C)cc1 784806239 CJPJMFCXJYRMME-UHFFFAOYSA-N 433.556 4.684 50 10 IJGE O=C(COc1ccc(Cl)cc1Br)NN=Cc1cccc(Cl)c1Cl 1084025728 YDKYDIZJRIFETM-UHFFFAOYSA-N 436.520 4.938 50 10 IJGE C#CC[C@@H]1CCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1 1461812159 ILZPDVHGWPGIGF-BDBXIWDTSA-N 425.454 4.892 50 10 IJGE C=CCOc1cc(OC)ccc1C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2 1628472001 VNEAVVWFYKVVNN-INIZCTEOSA-N 442.581 4.547 50 10 IJGE C/C(=C\c1ccc(Cl)cc1)C(=O)NNC(=O)COc1ccccc1Cc1ccccc1 1650629239 SRBMRFQEKCLHOH-OBGWFSINSA-N 434.923 4.561 50 10 IJGE C#C[C@H](NC(=O)NNc1cc(C(F)(F)F)ccc1F)c1ccc(Br)cc1 1683508433 SKGJWKGTWKZULD-AWEZNQCLSA-N 430.199 4.608 50 10 IJGE COc1ccc2ccccc2c1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccc(F)cc1 1865688602 WDBONCXKLTWORG-DEOSSOPVSA-N 440.478 4.759 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(OC(C)C)c(OC)c1 1865697549 WGTIFXAMXJWNAE-QFIPXVFZSA-N 444.535 4.974 50 10 IJGE CCc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865701964 JLQFKVYESKCRQE-IBGZPJMESA-N 426.854 4.644 50 10 IJGE Cc1ccc(COc2ccccc2/C=N/NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc1 1873795467 KXICDEVHPRFREU-WGLQLPMYSA-N 439.556 4.573 50 10 IJGE CC1(C)C[C@@H](C[C@H](CBr)NC(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)C1 1880753839 JLIFOVVLKKBSJU-ZIAGYGMSSA-N 435.403 4.700 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C1[C@H]2CCC[C@H]1CN(Cc1ccccc1)C2 1882087114 HLKJUVQNNAZPMN-FHWLQOOXSA-N 437.422 4.823 50 10 IJGE O=S(=O)(c1cc(Cl)cc(Cl)c1)N(CCCBr)Cc1ccccc1 1914648330 UGUUJHWDECORFC-UHFFFAOYSA-N 437.186 4.969 50 10 IJGE CC(C)(CCl)N(Cc1ccccc1)C(=O)c1ccc(I)c(O)c1 1915787375 FMPRLXRPJCCEJQ-UHFFFAOYSA-N 443.712 4.657 50 10 IJGE CCC[C@@H](Br)CCNC(=O)c1cc(Br)sc1Br 1942749321 XKYKSUBOOPXBOH-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE O=C(NC[C@H](Br)C1CCC1)c1csc(Br)c1Br 1945186766 MJBDXIUKHYQECT-QMMMGPOBSA-N 446.002 4.567 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ncc(Br)cc1Cl 1974520608 FAXUNVQTIRLREB-LLVKDONJSA-N 446.570 4.923 50 10 IJGE Brc1cnc(N2[C@H]3CCC[C@@H](Br)[C@H]2CC3)c(Br)c1 2036550902 BVHINAFBPLXCLH-HOSYDEDBSA-N 438.989 4.891 50 10 IJGE BrC[C@@H]1CC2(CC2)CN1Cc1cc(Br)ccc1Br 2054712870 LFXRQJUIWJERTC-LBPRGKRZSA-N 438.001 4.961 50 10 IJGE COCC(C)(C)N(Cc1ccccc1)S(=O)(=O)c1c(C)csc1CBr 2059284252 ILZDXBUVWASBNB-UHFFFAOYSA-N 446.432 4.567 50 10 IJGE Cc1cc(C(=O)N[C@H](C)CCCCCI)ccc1Br 2117892111 CCDXFORLSJWFLN-GFCCVEGCSA-N 438.147 4.871 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCCC2)[C@@H](CC(F)F)C1 2127049005 YSLRVLHLSCYMGR-HNNXBMFYSA-N 439.385 4.908 50 10 IJGE CC1(C)CN(Cc2ccccc2)CCN(c2ccc([N+](=O)[O-])cc2CBr)C1 2150471136 XOAKIRXJIHFGSZ-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE Cc1c(CCl)cc(Cl)cc1S(=O)(=O)N(C)[C@@H]1CC[C@H]1OCc1ccccc1 2156443649 RQEIRTGGODTGPO-RTBURBONSA-N 428.381 4.756 50 10 IJGE CCN(C(=O)[C@H](Br)C1CCCC1)[C@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2167032812 OFZUVFJMNPXXFP-OKZBNKHCSA-N 445.442 4.872 50 10 IJGE Cn1cnc(Cl)c1CC(CBr)(CBr)c1ccc(Cl)cc1 2168232283 UJQVOTWGKANZGC-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Cl)C2 2190670682 MJHQPIZVQCRSQU-QNWHQSFQSA-N 425.523 4.534 50 10 IJGE CCOc1cc(CBr)ccc1OC[C@H]1CC1(Br)Br 2218000663 VHKRUWZVYVTWDA-SNVBAGLBSA-N 442.973 4.865 50 10 IJGE CCOCc1cc(Br)c([C@H](Cl)c2cn(C)c(Br)n2)s1 2224788959 LUTAUSZLEHVVNU-SNVBAGLBSA-N 428.577 4.871 50 10 IJGE COC1CC([C@H](Br)Cc2cc(Br)cc(Br)c2)C1 2252838140 ZRIYHLCGCZULLD-UTVJUBTNSA-N 426.974 4.943 50 10 IJGE CC[C@H]1[C@H](Br)CCN1C(=O)c1c(Br)cccc1Br 2260390371 YQKFLDSKPYIPAM-KCJUWKMLSA-N 439.973 4.600 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@@H]2C[C@@H](Br)CC[C@H]21 2264507572 SCVGPZMGEACUJS-KHQFGBGNSA-N 427.589 4.942 50 10 IJGE COc1ccnc(N(C)[C@@H]2C[C@@H]3C[C@H](OCc4ccccc4)C[C@H]32)c1CBr 2281103775 SCIZSCMHJYXPHP-PNYFIKQUSA-N 431.374 4.805 50 10 IJGE C[C@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@H](C)C1Br 2285959037 OHYSGQDYIWOYOK-YUMQZZPRSA-N 427.539 4.733 50 10 IJGE O=C(CSc1nc2ccccc2s1)NN=CC(Br)=Cc1ccccc1 2293648557 RQYUVKSFILBYJB-UHFFFAOYSA-N 432.368 4.926 50 10 IJGE CCCN(Cc1ccc(Cl)c(I)c1)C[C@@H](C)Br 2300239571 ZXIHNDUGUDHWMV-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE N#CC(=Cc1cccn1-c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(C(F)(F)F)c1 2314486045 ALNFGVWLZGIVGX-UHFFFAOYSA-N 426.354 4.950 50 10 IJGE BrCc1ccc2c(c1)CN(Cc1sccc1I)C2 2316762685 SXTWRKAEBZXDRP-UHFFFAOYSA-N 434.140 4.763 50 10 IJGE CC(C)[C@@H](CBr)N(C)C(=O)c1cc(Br)ccc1Br 2318849848 XIBZHMDYFXOMSL-GFCCVEGCSA-N 441.989 4.703 50 10 IJGE COc1cc(C=C(C#N)c2ccccc2OC)ccc1OC(=O)c1cccc([N+](=O)[O-])c1 2320506375 IFXWROIDEFCZEF-UHFFFAOYSA-N 430.416 4.895 50 10 IJGE N#CC(=CN1CCC(Cc2ccccc2)CC1)C(=O)N1CCC(Cc2ccccc2)CC1 2324762591 UPGBIALCYVADAC-UHFFFAOYSA-N 427.592 4.830 50 10 IJGE CCCc1sc(Br)cc1[C@@H](Br)[C@@H]1CCCCS1(=O)=O 2338018407 BFOWGLMOSZJFLL-WCQYABFASA-N 430.227 4.866 50 10 IJGE COCCOCCN(Cc1ccccc1)c1cc(OC)cc(Cl)c1CBr 2340258198 LSMXQVGKIKPPSW-UHFFFAOYSA-N 442.781 4.913 50 10 IJGE O=C(c1ccc(Cl)cc1I)N(CCCl)C1CCCCC1 2365586480 MVHDSISFWVBKGN-UHFFFAOYSA-N 426.125 4.958 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)N(c3ccccc3F)C3=C2C(=O)CC(C)(C)C3)cc1OC 9761224 BXJKWLDXPXXWPU-HSZRJFAPSA-N 447.510 4.784 50 10 IJGE O=C(NNC(=O)c1cc(Cl)cc(Cl)c1)c1ccc(NC(=O)C2CCCCC2)cc1 10384518 OLRMDFZKOHVYJC-UHFFFAOYSA-N 434.323 4.587 50 10 IJGE C=CCNC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc(OC(C)C)c(C)c1 34870638 OSFCKVNQWWFKGK-RCCKNPSSSA-N 426.520 4.844 50 10 IJGE Cc1c(C(=O)NC2CCCC2)oc2c1/C(=N/NC(=O)c1cccc3ccccc13)CCC2 40813506 RLTGKDOIOBYOSA-SGWCAAJKSA-N 429.520 4.884 50 10 IJGE CN(Cc1csc(Br)c1)S(=O)(=O)c1ccc(Cl)c(CCl)c1 91271030 CPCICTVTBKHBRE-UHFFFAOYSA-N 429.188 4.724 50 10 IJGE CCn1nc(C)c(Br)c1CC(CBr)(CBr)C(C)C 118670393 DDOCUVASYLICEU-UHFFFAOYSA-N 445.037 4.949 50 10 IJGE CCOc1ccccc1-c1cc(C(=O)NN=Cc2ccc(O)c(OC)c2)c2ccccc2n1 252639372 YKHGELXHBXRFIF-UHFFFAOYSA-N 441.487 4.779 50 10 IJGE C=CCOc1ccc(C(=O)NN=Cc2ccc(OC(=O)/C=C/c3ccccc3)cc2)cc1 254484324 JYPJBQSVSUMOMC-ZIGUYJKXSA-N 426.472 4.634 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CCC[C@@H](Br)CC1 378671077 DBBSKONLMWDFPJ-SECBINFHSA-N 439.973 4.601 50 10 IJGE Cl[C@H](c1coc(Br)c1)c1cc(I)cc2c1OCC2 386106496 SMNXTUWOFAOFHA-GFCCVEGCSA-N 439.474 4.910 50 10 IJGE COc1cc(Cl)c([C@@H](Br)c2cn(C)c(Br)n2)cc1Cl 698450028 AWUAIUSKVXRWCH-LLVKDONJSA-N 428.939 4.982 50 10 IJGE C[C@@](O)(CNC(=O)C(=O)Nc1cccc(S(F)(F)(F)(F)F)c1)C1CCCCC1 792333661 WDFPPBIHCPKBIF-QGZVFWFLSA-N 430.439 4.730 50 10 IJGE C#CCN(C(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(OCC)cc2)c1C)c1nccs1 1126809344 BIXMDPKEPGOQDJ-HKWRFOASSA-N 430.533 4.523 50 10 IJGE C#C[C@@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Br)cc2)c1C)C(C)(C)C 1460801697 MDOWPAVKQBEMGM-USUABIMMSA-N 438.369 4.928 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)C2(c3cccc(C(F)(F)F)c3)CCCCC2)c1 1471691114 PDKIRDHKJCRVBW-UHFFFAOYSA-N 445.510 4.906 50 10 IJGE C#CCC1(NC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc4ccccc34)c2C)CCOCC1 1535310818 UHNQWQCHMGLDEO-HKOYGPOVSA-N 437.543 4.843 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNC(=O)c1cc(F)ccc1Br 1584831733 AUNSIVWBGOOZLD-CLFYSBASSA-N 446.103 4.760 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3-c2ccc(OC)cc2)cc1 1865690643 XUAVCDZPRWPDFD-QHCPKHFHSA-N 444.535 4.840 50 10 IJGE COc1ccc(-c2ccc(C(=O)N/N=C(/C)c3ccc(F)c(F)c3)c(C)n2)cc1OC 1865763545 QNQYNJODKBIODR-WKIKZPBSSA-N 425.435 4.506 50 10 IJGE Cc1cc(F)cc(C)c1S(=O)(=O)N(Cc1ccccc1)C1(CBr)CCC1 1915755046 IBRPTGBNLZZQCV-UHFFFAOYSA-N 440.378 4.951 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2Cc1csnc1Br 1926873220 PNBYWFMAHCHARN-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE Cc1sc([C@H](Br)c2cn(C)nc2Br)cc1Br 1981649145 YWFJTUQBPZVQNK-SECBINFHSA-N 428.975 4.799 50 10 IJGE CC1(C)CC(CO[C@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)C1 1989576264 ULOCAHCGHWOWKQ-SFHVURJKSA-N 437.362 4.644 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)c1scc(Br)c1Br 2020201441 RDSDEITZGPJKCV-KNVOCYPGSA-N 446.002 4.519 50 10 IJGE CC(C)N1C[C@H](Cc2cccc(Br)c2Br)[C@@H](Br)C1 2039262939 RXTVJTRSWVBFKR-AAEUAGOBSA-N 440.017 4.858 50 10 IJGE C[C@](CI)(OC1CC(CF)C1)c1ccccc1Br 2055632878 HAADCIYGKWGJLA-QIMFLAQGSA-N 427.095 4.864 50 10 IJGE FC(F)c1c(I)ccc(CCl)c1I 2060240454 NBMFMKVNVAXFGO-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE CC[C@@H]1CN(Cc2cc(Cl)ccc2I)C[C@@H]1CBr 2084891292 YJJKMSOTMNSFGC-PWSUYJOCSA-N 442.566 4.798 50 10 IJGE CC(C)(C)[C@@H]1C[C@@H](CBr)CN(c2ccc(I)cn2)C1 2108720061 PCBXGYVOKCRXKN-NWDGAFQWSA-N 437.163 4.570 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@H](CBr)CC2CC2)CC[C@H]1C(F)(F)F 2112873944 HWGVUXATFBZRKL-RBSFLKMASA-N 443.348 4.575 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](CN(C(=O)[C@@H](Br)C2CCCC2)C2CC2)C1 2167033419 RACQLPPRUOBECR-YJBOKZPZSA-N 443.426 4.578 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)[C@@H](Br)C2CCCC2)CC12CCC2 2176868239 JYILDGBPOCOWTF-RDJZCZTQSA-N 443.426 4.626 50 10 IJGE C[C@@H]1CCC[C@@H](N(C)S(=O)(=O)c2cc(CBr)sc2Br)C1 2179786920 HSBNXKSHAHNEJJ-NXEZZACHSA-N 445.242 4.605 50 10 IJGE C[C@@H]1CC[C@H](CO[C@@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)C1 2243469986 PBBHPHLAYYWSPP-RVKKMQEKSA-N 437.362 4.644 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@H]1CN(CC1(CBr)CC(F)C1)C1CC1 2265631650 FSSZNIJZRNZGPH-CMVHYPBASA-N 433.406 4.754 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCN(CC3(CBr)CC(F)C3)C2)C1 2280360819 WVMBUBKRQITOKC-NSSZEPTDSA-N 447.433 4.859 50 10 IJGE C[C@@]1(CBr)CCCN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282976130 SQLLIBBSADSZKK-AWEZNQCLSA-N 427.539 4.879 50 10 IJGE CN[C@@H](c1c(F)cc(Br)c(F)c1Br)[C@@H]1C[C@H]1Br 2298664391 LFVFLXPKQJPXLK-RDSNPXOSSA-N 433.916 4.534 50 10 IJGE CC[C@H](C)[C@@H](CBr)NCc1ccc(Cl)c(I)c1 2300237528 ADNPBEPOLBXTAS-TVQRCGJNSA-N 430.555 4.844 50 10 IJGE CS(=O)(=O)Nc1ccc(C(O)=C(C#N)c2nc(-c3ccc(Cl)s3)cs2)cc1 2331400683 ITOVEPMVMQZPTD-UHFFFAOYSA-N 437.955 4.846 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1COC2(CCN(C[C@](C)(CBr)C(C)(C)C)CC2)C1 2380177577 WBKXDYPQJLDBTE-JXFKEZNVSA-N 447.458 4.582 50 10 IJGE Cc1cccc2c1N(CC1(CBr)CCOCC1)CCN2C(=O)OC(C)(C)C 2381158551 XJABOEGGXTYFNP-UHFFFAOYSA-N 439.394 4.748 50 10 IJGE COc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(Cl)cc4)ccc32)c1 38650123 GPLQEAIDJMUVAY-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE CCOc1ccc2ccccc2c1/C=N/NC(=O)Cn1c(C(F)(F)F)nc2ccccc21 59181295 MQVJTSOAUBBGOR-UVHMKAGCSA-N 440.425 4.757 50 10 IJGE Cc1cnc([C@H](C)n2c(CCl)nc3cc(I)c(F)cc32)s1 125288402 UIZIEDGBXDWKNH-QMMMGPOBSA-N 435.693 4.893 50 10 IJGE C[C@@H]1CC(O[C@@H](CI)c2ccccc2Br)C[C@@H](C)O1 162588531 TWLLMFGTHBPAND-HFAKWTLXSA-N 439.131 4.898 50 10 IJGE CC[C@@H](Br)c1nnc(-c2ccc(I)c(Cl)c2)o1 232377186 LYIROBAAXHSIBH-SSDOTTSWSA-N 427.467 4.841 50 10 IJGE C[C@H](CCCBr)NC(=O)c1ccc(Br)cc1Br 235420422 KMFXGASSIZYKHA-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE CC(=NNC(=O)Cc1ccc(Cl)c(Cl)c1)c1ccc(NC(=O)C(F)(F)F)cc1 254382186 UCSZYKZQHRCTQZ-UHFFFAOYSA-N 432.229 4.577 50 10 IJGE CC[C@H](Cl)[C@@H](CC)NS(=O)(=O)c1cc(Br)c(C)cc1Br 313139858 HFWLCIQCBWSOIP-NWDGAFQWSA-N 447.620 4.594 50 10 IJGE CCOC(=O)O[C@]1(C(=O)OCCl)CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@@]21C 725239825 FVOOBFFVLCZGIJ-YVZJMWPASA-N 448.943 4.866 50 10 IJGE Cc1nc([C@H]2CCCCN2C(=O)/C(C#N)=C\c2cc(C)n(-c3ccccc3F)c2C)no1 737614943 HHUXHXBHIBDAME-DUBROFONSA-N 433.487 4.585 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCc2ccc(-c3csc(C)n3)cc2)c1C 790483181 CHJJMPPCSRGFEI-TVSCDJBNSA-N 448.592 4.968 50 10 IJGE C=C(C)CN1CCC(NC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(Cl)c3)c2C)CC1 1443514985 HNKTWVXDLRUYIO-FYJGNVAPSA-N 436.987 4.811 50 10 IJGE C=CCCC[C@@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2)c1C)C(=O)OC 1558384504 ZTAUSRFNYRIUSJ-OOIVEFLKSA-N 439.943 4.669 50 10 IJGE CCOc1cc(C=NNC(=O)COc2cc(C)ccc2C(C)C)cc(Br)c1O 1772753790 IWSBVTLGCSVKSX-UHFFFAOYSA-N 449.345 4.514 50 10 IJGE COc1cc(C=NNC(=O)COc2ccc(C)c(C)c2)ccc1OCc1ccc(C)cc1 1772754615 LQNIZSUBRJTYCE-UHFFFAOYSA-N 432.520 4.729 50 10 IJGE COc1cc(C(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)ccc1[N+](=O)[O-] 1860391341 BBEXMAXGOVJIJP-UHFFFAOYSA-N 447.472 4.560 50 10 IJGE CCCn1nc(CC)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(OCc2ccccc2)c(OC)c1 1865687393 QFKYRXUNVGALGP-QHCPKHFHSA-N 444.535 4.661 50 10 IJGE CCc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689800 WWLJHKPJBAFGNU-IBGZPJMESA-N 441.318 4.724 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2cccc(Cl)c2)[C@@H]1c1cccnc1 1865700437 SVVBJMKFRVHBFS-HXUWFJFHSA-N 425.879 4.806 50 10 IJGE Brc1ccc(I)cc1SC[C@@H]1C[C@@H]1Br 1887827954 NKNNJJRXDPQJNP-RCOVLWMOSA-N 447.961 4.929 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1ncsc1Br 1915272929 ZMMCOVIGYJUXHO-ZDUSSCGKSA-N 446.208 4.968 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cc(F)c(Cl)cc1F 1916334153 CTTXUXVWXSAHHF-CYBMUJFWSA-N 432.692 4.671 50 10 IJGE CN(C(=O)c1csc(Br)c1Br)[C@@H]1CCC[C@@H]1Br 1945186468 HZUCKNGTFFBNNM-JGVFFNPUSA-N 446.002 4.661 50 10 IJGE CC[C@H](C)[C@@H](Br)CNC(=O)c1cc(Br)ccc1Br 2029977740 OSZJBYROQHTUCE-UFBFGSQYSA-N 441.989 4.751 50 10 IJGE CC(C)(C)OC(=O)NCCCN(C[C@H](Br)C(F)(F)F)c1ccccc1 2044702912 PFYNIQJGLNBHCW-AWEZNQCLSA-N 425.289 4.734 50 10 IJGE C[C@H](Cl)[C@H](NC(=O)c1cc(Br)sc1Br)C(F)(F)F 2074732940 BDFJQRVPRFFHST-DZSWIPIPSA-N 429.483 4.561 50 10 IJGE CCC[C@@H]1CN(c2ncc(Br)cc2Br)C[C@@H]1CBr 2084887515 BYNJJTKUIMJOCD-ZJUUUORDSA-N 441.005 4.854 50 10 IJGE O=C(N(Cc1ccccc1)C1(CBr)CCC1)C1(C(F)(F)F)CCOCC1 2116581825 WSIGRUDNOLSGDJ-UHFFFAOYSA-N 434.296 4.692 50 10 IJGE CC(C)(C)CN(Cc1ccccc1)S(=O)(=O)c1cc(CBr)n(C2CC2)c1 2123271115 PQOKIRJTCSXGHX-UHFFFAOYSA-N 439.419 4.955 50 10 IJGE C[C@]1(CBr)CC(F)(F)CN1C(=O)c1ccc(Cl)cc1Br 2159050781 VQKJOOBZZZTNKU-GFCCVEGCSA-N 431.502 4.737 50 10 IJGE C[C@H]1C[C@@H](CBr)CCN1C(=O)c1cc(Br)c(F)cc1Cl 2285846753 RRIKBDTWMAZQBA-IUCAKERBSA-N 427.539 4.877 50 10 IJGE C[C@H]1CCN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@H]1CBr 2285959313 PQBBSOPSAXUTKP-DTWKUNHWSA-N 427.539 4.735 50 10 IJGE FC(F)C1(CBr)CCN(Cc2ncc(Br)cc2Cl)CC1 2289885424 IVTFAPVKTIAJJP-UHFFFAOYSA-N 432.534 4.740 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@H](Cl)c1nn(C)nc1Br 2295282837 GNGLQQBANPURGV-VIFPVBQESA-N 443.954 4.639 50 10 IJGE Cc1ccc(CBr)cc1NC(=O)Cc1ccccc1I 2296110549 VESWCNMPLIPRAE-UHFFFAOYSA-N 444.110 4.676 50 10 IJGE Clc1ccc(I)cc1CN1CCC[C@H](Br)CC1 2307329287 ZAUVDONTWKNPTM-NSHDSACASA-N 428.539 4.694 50 10 IJGE Clc1ccc(I)cc1CN1CCCC[C@H]1CBr 2307329647 CUQPDEPDYSGLAV-LBPRGKRZSA-N 428.539 4.694 50 10 IJGE Clc1ccc(CN2C[C@H]3C[C@H]2CC[C@H]3Br)cc1I 2315552289 CHOHZGQKDMEZNF-IJLUTSLNSA-N 440.550 4.692 50 10 IJGE CC(C)[C@H]1[C@H](Br)CCN1Cc1ccc(Cl)cc1I 2318521907 MYDKHWYIZNTZPO-OCCSQVGLSA-N 442.566 4.938 50 10 IJGE C[C@H]1[C@H](C)N(Cc2cc(I)ccc2Cl)CC[C@H]1Br 2327409350 NFPYAWOBPGXGAV-OUJBWJOFSA-N 442.566 4.938 50 10 IJGE CCOC(=O)/C(C#N)=C1/S[C@H](Cc2ccc(Cl)cc2)C(=O)N1c1ccc(C)cc1 2888291 QCLWHINDQOVTGA-AZZGVMCLSA-N 426.925 4.638 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2F)cc(Br)c1OC(C)C 59117183 GLBZBRVEWYCGDH-ZSOIEALJSA-N 433.277 4.930 50 10 IJGE CCOc1ccc(CCN/C=C(/C#N)C(=O)Nc2ccc(C)c(Cl)c2)cc1OCC 217018291 UTIABEPBLSPAMZ-SDXDJHTJSA-N 427.932 4.624 50 10 IJGE O=C(CCCCCCC(=O)NN=C/C=C/c1ccccc1)NN=C/C=C\c1ccccc1 254753921 UVOGTJZFSNQHRF-ZPILGCONSA-N 430.552 4.958 50 10 IJGE CN(CCCCBr)C(=O)c1cc(Br)sc1Br 385000171 CSMUASIBCNFQRD-UHFFFAOYSA-N 433.991 4.520 50 10 IJGE C[C@@H]1CN(S(=O)(=O)c2cc(Cl)cc(CCl)c2Cl)CCN1Cc1ccccc1 396359330 YOVJFUHVQCENHA-CQSZACIVSA-N 447.815 4.627 50 10 IJGE C[C@H]1C[C@H](Br)CN(C(=O)c2scc(Br)c2Br)C1 705469068 VQVBLDPYASRIGB-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE ClCc1ccc(N2CC[C@]3(CN(Cc4ccccc4)CCO3)C2)cc1Br 717590454 DXQKASYXJLIPQW-NRFANRHFSA-N 435.793 4.669 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@H]2CC[C@@H](Cl)[C@H]1C2 721566765 JSEROLMUHDWJFO-SZEHBUNVSA-N 427.589 4.895 50 10 IJGE O=C(NNc1cccc(F)c1F)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 743720470 FPPFDTKKDLXSMM-UHFFFAOYSA-N 446.251 4.737 50 10 IJGE CC(C)[C@H](NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1ccc(C(F)(F)F)cc1 747938249 NJKYWPUNTCXEOJ-IBGZPJMESA-N 432.446 4.538 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)c2ccc(C(F)(F)F)cc2)c1C 791191746 WVVNOKHADKRHBZ-HNIBHBHRSA-N 448.441 4.664 50 10 IJGE COc1cc(C(=O)NN=Cc2ccc(Sc3ccc(Cl)cc3)o2)cc(OC)c1OC 1084417342 BPAZWYCTZAUYQR-UHFFFAOYSA-N 446.912 4.874 50 10 IJGE C=CCC[C@@H](CO)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1449422467 IIZDBWJTUZOUEY-PNDHZVEESA-N 432.351 4.751 50 10 IJGE CCOc1cc([C@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)ccc1OC 1614687757 CUZXRDWDRFVMQC-RBUKOAKNSA-N 448.357 4.841 50 10 IJGE Cc1cc(Nc2ccc3c(c2)CCCC3)c(C(=O)NNc2ccc(F)c(F)c2F)c(O)n1 1636764923 PARQLDIEDLNVEA-UHFFFAOYSA-N 442.441 4.892 50 10 IJGE Cc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2cccc([N+](=O)[O-])c2)cc1 1865706052 MKWQDQZRMAXXSL-JOCHJYFZSA-N 449.470 4.974 50 10 IJGE N#CSc1ccc(NC(=O)[C@@H](NC(=O)CCc2ccccc2F)c2ccccc2)cc1 1866595002 CXCMZERKLJXHLD-QHCPKHFHSA-N 433.508 4.828 50 10 IJGE CC[C@H](NC(=O)[C@H](C)c1ccc(Br)cc1)C(=O)Nc1ccc(SC#N)cc1 1866945147 YRMTYICVWODDDY-ACJLOTCBSA-N 446.370 4.659 50 10 IJGE Fc1cc(Br)c2nc(CCCl)n(C[C@@H]3CCN3Cc3ccccc3)c2c1 1912674072 JFJGVBJYMUOIKJ-INIZCTEOSA-N 436.756 4.994 50 10 IJGE C[C@@H](Br)C(C)(C)CNC(=O)c1cc(Br)c(Br)s1 1913830633 QRZLLWPAAFMCBK-ZCFIWIBFSA-N 448.018 4.813 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1ncccc1Br 1915111285 SWTGXZKJAXGTCT-ZDUSSCGKSA-N 426.152 4.660 50 10 IJGE Brc1cnccc1C[C@H](Br)c1nscc1Br 1924069344 UNRSZSBYAMHNJJ-ZETCQYMHSA-N 426.959 4.742 50 10 IJGE Cc1nn(-c2ccc(CBr)c(Cl)c2)c(C)c1I 1945162407 QNFUPTPBWKSBIW-UHFFFAOYSA-N 425.495 4.642 50 10 IJGE C[C@H](Br)[C@H]1CCN(C(=O)c2csc(Br)c2Br)C1 1945183591 JDVJYDWGLGKTFX-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1Cc1cccc(Br)c1Br 2018118173 YGUPTMGOIDUOBR-CABZTGNLSA-N 425.990 4.959 50 10 IJGE Brc1cccc(Br)c1CN1C[C@@H]2CC[C@@H](Br)[C@H]2C1 2033086016 HQIVPTFJPBEFGY-PKFCDNJMSA-N 438.001 4.817 50 10 IJGE ClCc1cc(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)ncc1Br 2092524708 SNTHLABIAOLOCR-HKUYNNGSSA-N 434.809 4.931 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]23CCC[C@@]2(CN(CC2(CBr)CCCC2)C3)C1 2106782568 RLIBIYUSAYWVHB-NHCUHLMSSA-N 427.427 4.665 50 10 IJGE Cc1cccc(Br)c1C(=O)N[C@@H](C)CCCCCI 2117894949 OEZARFQQJJAAKI-LBPRGKRZSA-N 438.147 4.871 50 10 IJGE BrCc1c(N2CC[C@@]3(CCCN(Cc4ccccc4)C3)C2)nc2sccn12 2163319425 VDMBESCXJOCKPY-OAQYLSRUSA-N 445.430 4.783 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CCCCCCBr)CC[C@H]1C(F)(F)F 2231105239 YVXJEUYTSRWDJT-LSDHHAIUSA-N 445.364 4.967 50 10 IJGE O=C(NC[C@@]12CCC[C@]1(CBr)C2)c1scc(Br)c1Cl 2264504058 LVLWKVBTIWLKDM-OLZOCXBDSA-N 427.589 4.849 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2ccc(C(=O)O)cc2)cc1OCc1ccc(F)cc1 2293771897 OHOAYKDWJKOVDO-UHFFFAOYSA-N 446.434 4.657 50 10 IJGE Clc1cc(I)c([C@@H](Br)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)s1 2300953536 KNSVWDFOLQYMSV-GAQUGTPGSA-N 445.547 4.866 50 10 IJGE C[C@H](Br)CN(Cc1ccc(Cl)cc1I)C1CC1 2302325107 DIHXRUADFRCEPK-VIFPVBQESA-N 428.539 4.692 50 10 IJGE ClC1CCC(NCc2ccc(I)c(Br)c2)CC1 2306218378 ZOFGZBYRROJIJK-UHFFFAOYSA-N 428.539 4.693 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccccc2F)cc(Br)c1OC(C)C 2313630856 GLBZBRVEWYCGDH-UHFFFAOYSA-N 433.277 4.930 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc3c(c2)C[C@@H](C)O3)sc2c1CCCC2 2314617622 KYTBYPICQQIZEE-CQSZACIVSA-N 436.533 4.673 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3nc(Cc4ccccc4)[nH]c3c2)c(Cl)c1OC 2318418381 YUCIDCSDCJJYLP-UHFFFAOYSA-N 448.910 4.588 50 10 IJGE CC[C@H]1[C@H](CBr)CCN1Cc1ccc(Cl)cc1I 2318526366 IUMAXGBHBHRXTJ-HZMBPMFUSA-N 442.566 4.940 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@]3(CCCN(C(=O)OC(C)(C)C)C3)C2)C1 2345012115 YRTGVSLEWLUEPU-FQEVSTJZSA-N 429.443 4.911 50 10 IJGE CC(C)(C)[C@@H]1CC[C@H](Br)[C@@H](Cc2ncc(I)cn2)C1 2353065764 QVGYTFIAQAGOST-WZRBSPASSA-N 437.163 4.850 50 10 IJGE CC(C)[C@@H](CBr)CN1C[C@@H](CNC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2356242036 KZGVIDFMNDROTN-ZCNNSNEGSA-N 439.438 4.894 50 10 IJGE O=S1(=O)CC[C@@H](C(CCl)(CCl)Cc2sc(Cl)cc2Br)C1 2372274063 YVNKTXHJMAWIPG-MRVPVSSYSA-N 440.639 4.605 50 10 IJGE C=CCOc1ccccc1C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1C(C)(C)C 14661783 RXWUPLRKSLRMMT-UHFFFAOYSA-N 438.568 4.686 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)N1CCC(Cc3ccccc3)CC1)[C@@H](Br)C2=O 33514284 NPBUGTHCTPFBBA-NMNUPHIUSA-N 432.402 4.627 50 10 IJGE COc1ccc(/C=N/NC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1Br 40847513 PSKNHMSAGNIVDV-HKXVIOCSSA-N 439.737 4.646 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@@H](CCBr)C1 125153829 JHSAMSZEMBWXEK-SSDOTTSWSA-N 446.002 4.520 50 10 IJGE CCC[C@@H](CCBr)CNC(=O)c1cccc(C)c1I 227502900 OVCZBDGQDKCWDO-LBPRGKRZSA-N 438.147 4.531 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@H]2CCSc3ccc(F)cc32)c(C)n1C[C@@H]1CCCO1 302816420 QLOJRTYGYAOUSV-JQWOEJBRSA-N 439.556 4.683 50 10 IJGE Cn1ncc([C@@H](Br)c2cc(F)c(Br)cc2F)c1Br 379226891 XCXQCPDEGOOODZ-JTQLQIEISA-N 444.899 4.708 50 10 IJGE C[C@H]1C[C@@H](n2c(CCCl)nc3cc(Br)cnc32)CN1Cc1ccccc1 398003328 PBBFPDMTNQJBLM-WMLDXEAASA-N 433.781 4.811 50 10 IJGE CC1(C)C[C@H](Cl)C[C@H](NC(=O)c2cc(Cl)ccc2I)C1 693879470 UBCKBUDEUYODDJ-MNOVXSKESA-N 426.125 4.861 50 10 IJGE C[C@@H](NC(=O)c1cc(Br)sc1Br)C1(CBr)CC1 696032098 CFMSKHMFYRKWDR-ZCFIWIBFSA-N 446.002 4.567 50 10 IJGE CC(C)[C@@H]1CN(c2cc(CBr)sc2[N+](=O)[O-])CCN1Cc1ccccc1 704742003 ZQKMWWIYSWTLNE-SFHVURJKSA-N 438.391 4.898 50 10 IJGE O=C(c1scc(Br)c1Br)N(CCBr)C1CCC1 705513487 BDNBFLRIMGZATM-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE N#Cc1ccc(-c2cccc(CNC(=O)NNC(=O)c3c(Cl)cccc3Cl)c2)s1 740046444 HRLUWWIOYAYMDF-UHFFFAOYSA-N 445.331 4.738 50 10 IJGE O=C(Nc1ccccc1C(=O)NNc1cccc(F)c1F)c1ccccc1Br 748795917 FXLLAYZXOFFSEF-UHFFFAOYSA-N 446.251 4.737 50 10 IJGE Cc1cc(N2CCSCC2)ccc1NC(=O)NNc1ccc(C#N)cc1C(F)(F)F 799394633 DQJZRAMCIXEMED-UHFFFAOYSA-N 435.475 4.587 50 10 IJGE CC(C)(C(=O)NNc1nccnc1C1CCC1)[C@H](O)c1ccc(OCc2ccccc2)cc1 805473024 IHEGKRNIDYMQFT-HSZRJFAPSA-N 446.551 4.526 50 10 IJGE CC(C)(C)[Si](C)(C)COCCc1cnc(CCO[Si](C)(C)C(C)(C)C)c[n+]1[O-] 888086310 BYYXXNNSRDVCBW-UHFFFAOYSA-N 426.750 4.886 50 10 IJGE O=C(Nc1ccccc1C(=O)NN=Cc1cccc(OCc2ccccc2)c1)c1ccco1 1083922592 QUKRADPRWGERKI-UHFFFAOYSA-N 439.471 4.875 50 10 IJGE Cc1ccccc1C(=O)Nc1ccc(C(=O)NN=Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1 1084631317 VZJYHBBVFLDCEL-UHFFFAOYSA-N 436.855 4.573 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNC(=O)Cc2ccc3ccccc3c2)cc1 1457603271 JFMPCRWYJJKZNV-UHFFFAOYSA-N 437.499 4.790 50 10 IJGE CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N1CCC[C@@H](O[Si](C)(C)C(C)(C)C)C1 1527931172 CZGVUZRKSNNCSF-IRLDBZIGSA-N 428.649 4.963 50 10 IJGE C=CCC1(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(OCC)cc3)c2C)CCOCC1 1531779336 PSKTUBSRCXXSMC-XLNRJJMWSA-N 433.552 4.641 50 10 IJGE C=CCC[C@@H]1CCCN1C(=O)CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C 1558671654 DLVDWGUDBAKVGQ-HSZRJFAPSA-N 435.684 4.910 50 10 IJGE C#CC[C@@]1(C(=O)NNc2ccccc2Oc2ccccc2)CCCN1C(=O)OC(C)(C)C 1628599119 VGBIRDLKBYFTIS-VWLOTQADSA-N 435.524 4.715 50 10 IJGE CCOc1ccc2ccccc2c1C=NNC(=O)COc1ccc(Br)cc1 1772754503 XCFXICUUIJJEQL-UHFFFAOYSA-N 427.298 4.530 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccc(Cl)cc2)[C@@H]1c1cccc(F)c1 1865710853 JZHXRCQOSGAMHZ-OAHLLOKOSA-N 434.780 4.902 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C[C@H](Br)C(F)(F)F)CC2)C1 1879207068 ZEYWQOYGTRZTKC-GJZGRUSLSA-N 443.348 4.671 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@@H]1CC[C@@H]1NC(=O)OCc1ccccc1 1999516122 XTMPRXKSWGPYNT-PCCBWWKXSA-N 431.374 4.554 50 10 IJGE CCCN1C[C@@H](Br)[C@H](Cc2ccc(I)c(Cl)c2)C1 2086651234 GMGJPDFAVFFBFF-VXGBXAGGSA-N 442.566 4.592 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CC2(CBr)CCCCCC2)C[C@@H]1C(F)F 2106784621 JVHFGCKENHNALP-LSDHHAIUSA-N 439.385 4.812 50 10 IJGE CC1(C)C[C@H](O[C@@](C)(CI)c2ccccc2Br)CO1 2115709185 YVUGRGWQWZEZHE-NHYWBVRUSA-N 439.131 4.683 50 10 IJGE CC(C)C(=O)[C@H](Br)Cc1ccc(C(F)(F)F)cc1I 2139267990 ZIAZYZQFMPXLNK-SNVBAGLBSA-N 449.048 4.841 50 10 IJGE CN(Cc1ccccc1)[C@@]1(Cn2c(CCl)nc3c(Br)cccc32)CCOC1 2155116718 SSGSCRSIRNTBHB-OAQYLSRUSA-N 448.792 4.829 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCCCN2C(=O)[C@@H](Br)C2CCCC2)CC1 2178246377 CBROHIUOWRALCY-KRWDZBQOSA-N 443.426 4.722 50 10 IJGE O=S(=O)(Nc1ccc(Br)c(Br)c1)c1cccc(CCl)c1 2185907388 LXKJSIYIAZISAY-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE COC[C@](C)(CC(CBr)(CBr)c1ccc(Cl)cc1)OC 2198252104 MTQFCLTUIFXKHN-AWEZNQCLSA-N 428.592 4.809 50 10 IJGE Cc1sc(Br)c(C)c1[C@@H](Cl)c1cnn(C)c1I 2213641225 LEUGFGQSJBUCHP-VIFPVBQESA-N 445.551 4.794 50 10 IJGE COc1ccc([C@@H](Cl)c2nscc2Br)cc1I 2248885523 CSKNDIYYKCQACY-SNVBAGLBSA-N 444.519 4.847 50 10 IJGE C[C@]12CO[C@](CO[C@@H](CI)c3cccc(Br)c3)(C1)C2 2266257605 WSWBVARHYDVHDI-SOUVJXGZSA-N 437.115 4.511 50 10 IJGE COC[C@@]1([C@H](Br)c2ccc(OC)c(Cl)c2Br)CCCO1 2283559424 GIMZCXXRXSLUQU-ZIAGYGMSSA-N 428.548 4.743 50 10 IJGE CC(C)(C)[C@@H]1[C@@H](Br)CCN1Cc1sccc1I 2301073415 IKPNHSVNQZETGH-CABZTGNLSA-N 428.177 4.737 50 10 IJGE O=[N+]([O-])c1ccc([C@H](Br)c2sc(Cl)cc2I)o1 2301083839 MIAWNHJUALTUBX-QMMMGPOBSA-N 448.463 4.992 50 10 IJGE CC[C@H]1CN(Cc2cc(I)ccc2Cl)C[C@@H]1Br 2307328686 PXAHKUMXELBCQE-CABZTGNLSA-N 428.539 4.550 50 10 IJGE CN(Cc1cc(I)ccc1Cl)C[C@H]1C[C@H](Br)C1 2307332398 OECKIACEEGCMSI-HOMQSWHASA-N 428.539 4.550 50 10 IJGE COc1ccc([N+](=O)[O-])cc1-n1c(C)cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)c1C 2313568269 QWIPIRRCFNGVSH-UHFFFAOYSA-N 430.464 4.865 50 10 IJGE Cl[C@@H]1CCCC[C@H]1CNCc1ccc(I)c(Br)c1 2325211331 HQPBKAIHZRJFMW-WCQYABFASA-N 442.566 4.941 50 10 IJGE N#CC(=CNc1ccc(Nc2ccccc2)cc1)C(=O)N1CCN(Cc2ccccc2)CC1 2325448826 LVSODIFPLHXRGV-UHFFFAOYSA-N 437.547 4.594 50 10 IJGE COc1ccc([C@@H](Br)[C@]23C[C@H](C[C@H](C)O2)C3)cc1I 2342811737 UOGAYOLPCKPSHU-NBLIUIFLSA-N 437.115 4.693 50 10 IJGE CC(C)C[C@H](CBr)CN1CC[C@@H](NC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2353821912 GUWPVROXWYVSGP-RBSFLKMASA-N 445.364 4.964 50 10 IJGE COCCCOc1ccnc(CN(Cc2ccccc2)[C@@H](C)CCBr)c1C 2364650195 GGBMFOLBVDSSFR-SFHVURJKSA-N 435.406 4.981 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1I)[C@H]1CCCCC[C@@H]1Cl 2365582950 XMBRISNOODSXSV-JSGCOSHPSA-N 426.125 4.957 50 10 IJGE COc1ccc(Br)cc1/C=N/NC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 13953755 PGMZQKWOXBFBIT-PRMNVEQPSA-N 446.128 4.682 50 10 IJGE N#C/C(=C/c1ccc(OCc2ccccc2)c(Br)c1)C(=O)N1CCCCC1 33668572 UTQJYIVOMQHLAM-UYRXBGFRSA-N 425.326 4.948 50 10 IJGE CC(C)Cc1ccc([C@@H](C)C(=O)NNC(=O)c2ccc(NC(=O)c3ccccc3)cc2)cc1 66199337 KZYRNLJTNZYVBC-LJQANCHMSA-N 443.547 4.702 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Br)c3cc4c(s3)CCC4)cc2[nH]1 109884142 VJFXEGFBQBNBKQ-CQSZACIVSA-N 428.149 4.653 50 10 IJGE C[C@H](Br)C(C)(C)NC(=O)c1cc(Br)cc(Br)c1 235455214 PBEQYXAYSMNLKH-ZETCQYMHSA-N 427.962 4.503 50 10 IJGE COc1ccc(C=NNC(=O)c2sccc2C)cc1COc1ccc(C)cc1[N+](=O)[O-] 252619943 LUTCBVGOALJWIF-UHFFFAOYSA-N 439.493 4.625 50 10 IJGE C[C@H](Br)c1ccccc1NS(=O)(=O)c1cc(Br)cs1 311566440 AZMQRDYPUGHXDU-QMMMGPOBSA-N 425.167 4.767 50 10 IJGE Cl[C@H](c1ccc(Br)o1)c1cc(I)cc2c1OCC2 385375073 PRVKVYDJHORMJD-LBPRGKRZSA-N 439.474 4.910 50 10 IJGE C=CCC(CBr)(CBr)Cc1c(Br)c(CC)nn1C 387147482 JOJHKCNMROSXMB-UHFFFAOYSA-N 443.021 4.640 50 10 IJGE CO[C@H](COc1c(Br)cc(CBr)cc1Br)C1CC1 400243828 LARMFVRPVUVVER-GFCCVEGCSA-N 442.973 4.910 50 10 IJGE CCn1cc([C@H](Cl)c2sc(COC)cc2Br)nc1Br 688130808 NTTRQDIUVFEJNN-JTQLQIEISA-N 428.577 4.964 50 10 IJGE CC(C)N(C[C@@H](C)Br)C(=O)c1cc(Br)ccc1Br 691342372 DCYOZQQVRBSTMK-SECBINFHSA-N 441.989 4.846 50 10 IJGE BrCc1cnc(-c2cc(Br)ccc2I)o1 701755841 PJMAVLMYTTWTNW-UHFFFAOYSA-N 442.876 4.604 50 10 IJGE O=C(NN=Cc1ccc(-c2ccc(Cl)c(Cl)c2)o1)C(=O)Nc1ccccc1Cl 725401901 QTQQDRQWOJDNCR-UHFFFAOYSA-N 436.682 4.996 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C2(c3ccc(OCC(C)C)cc3)CCC2)c1C 749539385 XTKYLRYDAUWARI-UHFFFAOYSA-N 445.567 4.755 50 10 IJGE Cc1ccc(-n2nc(C)c(CC(=O)NNc3nc(C(F)(F)F)cs3)c2C)cc1Cl 755852674 KPMZQEONNNDSMB-UHFFFAOYSA-N 443.882 4.612 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1ccc(Br)c2ccccc12 757886438 BSRCLEBYZBIVHB-UHFFFAOYSA-N 435.281 4.617 50 10 IJGE CC(C)c1nnc2n1CCN(S(=O)(=O)c1cccc(S(F)(F)(F)(F)F)c1)[C@@H]2C 784043086 UBPNEMWNNMHCEK-LLVKDONJSA-N 446.467 4.824 50 10 IJGE CC(=O)c1cc(C(=O)NNc2ccc(Cl)c(Br)c2)ccc1OC(C)C 1456191293 TUEZRGLHAZHTQB-UHFFFAOYSA-N 425.710 4.849 50 10 IJGE Cc1ccc([N+](=O)[O-])cc1[C@H]1CN(C(=O)OCc2ccccc2)C[C@@H]1CBr 1614639737 TVRWHKOEACMCCP-LPHOPBHVSA-N 433.302 4.650 50 10 IJGE CCCOc1c(OC)cccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2-c1ccc(C)cc1 1865692363 FEMVGZBJONJBNO-QFIPXVFZSA-N 430.508 4.505 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1cncc(Br)c1 1915287864 CXKXFUSQCBKXGS-KRWDZBQOSA-N 440.179 4.906 50 10 IJGE Brc1cnc(N2CC[C@]3(CCC[C@@H]3Br)C2)c(Br)c1 1918905535 XBCFXWDECWTILT-WCQYABFASA-N 438.989 4.751 50 10 IJGE COC[C@@]1([C@@H](Br)c2sc(Br)cc2Br)CCCO1 1922895041 QRMSPUHBDBNJJX-WDEREUQCSA-N 449.002 4.905 50 10 IJGE BrCC1(Cc2ccc(Br)cc2Br)CCOCC1 1943845542 KYFMNHPYIPXKTN-UHFFFAOYSA-N 426.974 4.946 50 10 IJGE CC[C@H](C)[C@H](CBr)NCc1ccc(I)c(Cl)c1 2026564144 QJHDEJOJVYQEJR-ZANVPECISA-N 430.555 4.844 50 10 IJGE Cn1ncc([C@@H](Br)c2ccc(CC3CC3)s2)c1I 2027410319 ILZUVXPDJAWXTN-GFCCVEGCSA-N 437.144 4.523 50 10 IJGE CC1(C)C[C@H](O[C@@H](CI)c2ccccc2Br)CO1 2052239226 FMGDJCILVOVKEZ-GWCFXTLKSA-N 425.104 4.509 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@H](CBr)c2ccccc2)CC1(C)C 2106786197 SVYQJDVSODFSCB-QZTJIDSGSA-N 425.411 4.790 50 10 IJGE CCCN(C(=O)[C@@H](Br)C1CCCC1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2110716094 UHMFMXYWPHWEOX-SJORKVTESA-N 431.415 4.578 50 10 IJGE CC[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1N(C)C(=O)c1ccc(CBr)cc1 2163625854 VVDMIQSFOSACDZ-SJLPKXTDSA-N 439.394 4.689 50 10 IJGE CN(C(=O)c1ccc(Cl)c(Br)c1)[C@H](CCBr)C(F)(F)F 2178515166 JQJAXZWZJBRQJH-SNVBAGLBSA-N 437.481 4.890 50 10 IJGE Fc1cc(Br)c2nc(CCl)n(C[C@]3(Br)CC3(F)F)c2c1 2202505842 OCWJHHVAALPTAT-LLVKDONJSA-N 432.465 4.849 50 10 IJGE Cc1c(Br)sc([C@@H](Cl)c2cnn(C)c2I)c1C 2213633737 XAXZAFVALUHKNA-QMMMGPOBSA-N 445.551 4.794 50 10 IJGE CCOCc1cc(Br)c([C@@H](Cl)c2c(Br)cnn2C)s1 2224774921 RGSBAPOZNYRMRX-JTQLQIEISA-N 428.577 4.871 50 10 IJGE FC1(F)COC[C@@H]1n1c(CCl)nc2cc(Br)c(Br)cc21 2234076846 XMGISAPWDQJZGB-JTQLQIEISA-N 430.474 4.507 50 10 IJGE CC1(C)CCN(Cc2ccccc2)CCN1c1ccc(CBr)c([N+](=O)[O-])c1 2239859955 IAFURYNSESTEAA-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCCCN(C(=O)OC(C)(C)C)CC1 2242080369 ODIDSQCRJOWPHZ-GJZGRUSLSA-N 435.403 4.702 50 10 IJGE CCCO[C@@H]1[C@@H](Br)C[C@@H]1Oc1cc(I)ccc1Cl 2259921229 OHKRVWQKOJCBFU-TVYUQYBPSA-N 445.522 4.654 50 10 IJGE Cc1cc(Br)c([C@H](Br)C2CC(S(C)(=O)=O)C2)c(C)c1Cl 2285390799 GNURVDMTTITMOA-SRHKJQAYSA-N 444.616 4.979 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285846212 LJQSVJVLFYZMHM-BDAKNGLRSA-N 427.539 4.877 50 10 IJGE CC1CCC([C@H](CBr)NC[C@H]2CC2(Br)Br)CC1 2306825759 LJFINHKRGJGBME-HCWSGVFWSA-N 432.038 4.672 50 10 IJGE O=C(C=Cc1ccccc1Cl)NNC(=O)CCCOc1ccc(Cl)cc1Cl 2313621093 JGWWLKUGILQLNN-UHFFFAOYSA-N 427.715 4.667 50 10 IJGE C[C@@H]1C[C@@H](Br)[C@@H](C)N(Cc2ccc(Cl)cc2I)C1 2318545804 MMFBEARLSUFTAA-GIPNMCIBSA-N 442.566 4.938 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cc(Cl)c(F)cc1F 2320358700 RDTWLKYQCGWWBQ-ZDUSSCGKSA-N 432.692 4.718 50 10 IJGE COc1cccc(OCC(=O)Oc2ccc(C=C(C#N)c3ccccc3OC)cc2OC)c1 2320506958 VIOYUSXFIPSXIU-UHFFFAOYSA-N 445.471 4.761 50 10 IJGE COc1cc(C=NNC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)cc([N+](=O)[O-])c1OC(C)C 2323138490 BAVQUOCLMFSFNI-MDQWUCQQSA-N 443.544 4.837 50 10 IJGE COc1cc(NC=C(C#N)C(=O)N[C@H](C)C23CC4CC(CC(C4)C2)C3)c(OC)cc1Cl 2324904477 QPVQJCGVYALJMA-ZJRYTYELSA-N 443.975 4.898 50 10 IJGE ClC[C@@H]1[C@H]2CC[C@H](C2)N1Cc1ccc(I)c(Br)c1 2325208547 WURHHUBKHQKXMV-MISXGVKJSA-N 440.550 4.645 50 10 IJGE C[C@@H]1CC[C@](CCl)(NCc2ccc(I)c(Br)c2)C1 2325232871 GYFLPNKNLCVKEW-YGRLFVJLSA-N 442.566 4.941 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2CC[C@@H]3C[C@H]2CO3)cc1I 2334463527 LAECCBRCWYEDSK-FUTJPDQTSA-N 437.115 4.551 50 10 IJGE CCCCO[C@@H]1[C@@H](Br)C[C@H]1OCc1cccc(I)c1 2341609192 NQLNBUXGPHWKHQ-RRFJBIMHSA-N 439.131 4.529 50 10 IJGE COc1ccc(C)cc1NC(=O)[C@H](NNC(=O)c1ccc(C(C)(C)C)cc1)c1ccccc1 15474808 YRDPLFYAAGFVBY-XMMPIXPASA-N 445.563 4.916 50 10 IJGE Cc1cccc(C)c1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccc(F)cc1 38652725 JTMFKTIKTWIWRO-XMMPIXPASA-N 444.462 4.645 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@@H]2C)oc2c1/C(=N/NC(=O)c1ccc(F)cc1)CCC2 40811889 SDSLASTZFQCAJQ-GQIVLKDASA-N 445.494 4.789 50 10 IJGE CCCN(CCC)c1ccc(/C=C(/C#N)C(=O)NCCc2ccc(OC)c(OC)c2)cc1 96438657 XNTASPVBCZCBAF-XLNRJJMWSA-N 435.568 4.596 50 10 IJGE N#C/C(=C/c1cn(CC(=O)Nc2ccccc2)c2ccccc12)C(=O)NC1CCCCC1 108701661 YEGVHPVPGDULRL-CYVLTUHYSA-N 426.520 4.636 50 10 IJGE CC(C)(C)c1ccc(Cn2cccc(C(=O)N/N=C\c3c(F)cccc3Cl)c2=O)cc1 169921163 FSUCHTGSFQLLOO-VYYCAZPPSA-N 439.918 4.751 50 10 IJGE CC(C)COCCO[C@H](CI)c1ccccc1Br 232698898 AQHHNZIVWPSODH-CQSZACIVSA-N 427.120 4.614 50 10 IJGE CC(=NNC(=O)c1ccc(Br)s1)c1ccc(NC(=O)c2ccoc2C)cc1 252633624 WEWREVAYFLGYNK-UHFFFAOYSA-N 446.326 4.818 50 10 IJGE FC(F)Oc1cc(CBr)cc(C(F)(F)F)c1I 575723486 OLULMDPWZBVUOX-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@H]1C[C@@H]1c1cccc2ccccc12 730768284 BONFQGCIHCVTTE-RTWAWAEBSA-N 427.529 4.836 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1)c1ccccc1OC(F)F 1538898026 IGKVTUPJIYCMLQ-JQIJEIRASA-N 432.467 4.577 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)COc2ccc(Cl)cc2C2CCCCC2)c1 1644011452 HYGNLLOTZPRJMO-UHFFFAOYSA-N 441.984 4.766 50 10 IJGE Cc1cccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4ccc(F)cc4F)c(C)c32)c1 1772743684 IPFHVBMFKNBADJ-UHFFFAOYSA-N 437.446 4.897 50 10 IJGE O=C(CCCC[C@H]1CCSS1)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1 1860192978 XZMCISCXOHNGGY-SFHVURJKSA-N 442.672 4.904 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2c(F)cccc2Cl)cc1 1865694278 SEXHFYPIFKXUFJ-OAQYLSRUSA-N 438.890 4.649 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1cc(Br)c(Cl)s1 1880761354 MSFRWDQNTKAEKC-ZETCQYMHSA-N 433.593 4.995 50 10 IJGE C[C@@H](CCCl)N(Cc1ccccc1)C(=O)Cc1ccccc1I 1915137057 JPARSZFJPJVGJB-HNNXBMFYSA-N 441.740 4.880 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)S(=O)(=O)c1ccc2c(c1)CCCC2 1915750789 YBGYRUMPRYYWGO-UHFFFAOYSA-N 436.415 4.930 50 10 IJGE Cc1cc(N(C)C[C@H](Br)COCc2ccccc2)ncc1Br 1916347178 GUZHCWJZATXTSZ-HNNXBMFYSA-N 428.168 4.569 50 10 IJGE CCC[C@](C)(CBr)NC(=O)c1scc(Br)c1Br 1942781885 RKTMYXKBAXUSSN-LLVKDONJSA-N 448.018 4.957 50 10 IJGE COC[C@@]1([C@@H](Br)c2cc(Br)c(Br)s2)CCCO1 1943035465 CQYBVJVCUZPARY-GXSJLCMTSA-N 449.002 4.905 50 10 IJGE C[C@H]1[C@H](CBr)CCN1Cc1ccc(Br)cc1Br 1943858578 INMVUCYWQDLNQX-UWVGGRQHSA-N 425.990 4.817 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1cscc1OCc1ccccc1 1950312896 DZODZPSQKRGDQU-HNNXBMFYSA-N 428.417 4.964 50 10 IJGE O=S(=O)([C@H]1C[C@H](OCc2ccccc2)C1)N(Cc1ccccc1)[C@@H](CCl)C1CC1 1958928513 PQHYRSWBGRYSFP-VABKMULXSA-N 434.001 4.584 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)Cc1cnn(C)c1Br 1961869089 QHTVZDRMLQBIPC-INIZCTEOSA-N 429.200 4.604 50 10 IJGE C[C@@H](Cl)CC(=O)Nc1c(Br)cc(Br)cc1Br 1982336173 FTUFMOTZFMVXTN-RXMQYKEDSA-N 434.353 4.930 50 10 IJGE C[C@]1(NC(=O)c2ccc(CBr)cc2)CCCN(C(=O)OCc2ccccc2)C1 2044173469 LUBGJIAXUMVOIP-QFIPXVFZSA-N 445.357 4.503 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)c2ccccc2)C(C)(C)CC1 2106781701 KIKOZVOWIAUUTG-SFHVURJKSA-N 425.411 4.887 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@@H](Br)CC2(CCC2)C1 2115924880 NJTWTPPFYWILKN-QMMMGPOBSA-N 427.589 4.944 50 10 IJGE COCc1nnc(CC(CBr)(CBr)C2CCCCC2)s1 2186551436 LYDZBNOCFLSFER-UHFFFAOYSA-N 426.218 4.584 50 10 IJGE ClCc1cc(Br)ccc1OCCOCCOCCOCc1ccccc1 2227770974 IRHLHOHWMOZDAH-UHFFFAOYSA-N 443.765 4.817 50 10 IJGE COc1ccc([C@H](Br)c2cc(I)sn2)c(C)c1C 2256994232 AREXSBGGJYJGNT-ZDUSSCGKSA-N 438.128 4.857 50 10 IJGE CCOC1CC(C[C@H](Br)c2ccc(OC)c(I)c2)C1 2269542799 LFBJEMUEZQBTIC-GDKBPFBDSA-N 439.131 4.941 50 10 IJGE CCOc1c(Br)cc(C=C(C#N)C(=O)N[C@H](C)c2ccccc2)cc1OC 2293665640 ULEYLJQMABHMEV-CQSZACIVSA-N 429.314 4.641 50 10 IJGE Cc1cccc(COc2ccc(C=C(C#N)C(=O)N3CCN(c4ccccc4)CC3)cc2)c1 2313565265 AWELGQZKHPCMPU-UHFFFAOYSA-N 437.543 4.830 50 10 IJGE O=C(NN=Cc1c(F)cccc1Cl)c1cc(-c2ccccc2)nc(N2CCCCC2)n1 2323756749 YTYVIEOSEIDOCZ-UHFFFAOYSA-N 437.906 4.690 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)C(C#N)=CNc1ccc(OC)c(Cl)c1 2325306807 NQFIXINGFGLBJB-UHFFFAOYSA-N 427.888 4.764 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1 2328520351 DJVROPFAVCHMKN-ZIAGYGMSSA-N 431.337 4.527 50 10 IJGE O=C(NC1CCCC1)[C@H](c1ccc(F)cc1)N(Cc1ccc(Cl)cc1)C(=O)CCl 3039533 HWGFOAIWZDHWRR-NRFANRHFSA-N 437.342 4.847 50 10 IJGE CCCCCN1C(=O)/C(=N\NC(=O)c2ccc(Cl)cc2)c2cc(Br)ccc21 40846260 PKPBEZACFWINAD-NKFKGCMQSA-N 448.748 4.773 50 10 IJGE CCOc1ccc(/C=N/NC(=O)COc2cc(C)c(Cl)c(C)c2Br)cc1 40950706 FZRJWIAOAKCRQZ-LSHDLFTRSA-N 439.737 4.647 50 10 IJGE O=C1NCCc2ccc([C@@H](Br)c3ccc(Br)c(Cl)c3)cc21 129194095 IDIIMQMQXAVULN-OAHLLOKOSA-N 429.539 4.873 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)/C=C\c4ccccc4)ccc32)cc1 205660959 OKQPNENPIVUNBJ-HGSSNGHDSA-N 438.483 4.922 50 10 IJGE CCOc1ccc(/C=C\C(=O)Oc2ccc(/C=C(/C#N)C(=O)NCc3ccco3)cc2)cc1 206687567 PCPCVOXRJADKQN-CRBDHTPASA-N 442.471 4.520 50 10 IJGE O=C(NC[C@@H]1CCCC[C@H]1CCl)c1cc(Cl)ccc1I 236015484 UNFXXXLINDAQAW-QWRGUYRKSA-N 426.125 4.720 50 10 IJGE O=C(Nc1ccccc1CBr)c1ccc(F)cc1I 236185042 TZPPNYWZFNWIGW-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE ClCc1c(I)c(I)cc2ccsc12 307129580 QBERKJRIKARWJR-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1)N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 729620943 XVCILMKKWLJIKP-KRWDZBQOSA-N 444.919 4.624 50 10 IJGE O=C(NCc1ccc(Oc2ccccc2F)c(F)c1)NNC(=O)c1ccc(Cl)cc1 745868615 IZMFSUMKEVZWNV-UHFFFAOYSA-N 431.826 4.555 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(C(=O)NN=Cc3ccc(Br)s3)cc2)c1 1084465984 OUJAJLBIOHZDJS-UHFFFAOYSA-N 442.338 4.835 50 10 IJGE Cc1nn(-c2ccccc2)c(C)c1C=NNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 1084543521 LDDLJRVJIQXFTR-OAHLLOKOSA-N 431.323 4.714 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccccc2Oc2ccc(C)cc2)cc1 1310068590 IPPPZJZUHWQUCF-GOSISDBHSA-N 447.491 4.610 50 10 IJGE C=C(CC)CNC(=O)NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1 1312857051 SNOISXKRRYYVSY-UHFFFAOYSA-N 429.520 4.843 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1)c1cccs1 1457532710 YTDDBOOAYYOBPX-FYWRMAATSA-N 448.573 4.781 50 10 IJGE C#CCN(C[C@H](CBr)C1CC1)[C@H]1CCOc2ccc(Br)cc21 1473168329 OCUQRFINBVKEAB-YOEHRIQHSA-N 427.180 4.629 50 10 IJGE C/C(=C/C1CCC(C)CC1)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1 1544388626 PGRPTQCHEHHLOT-UPSXZMNFSA-N 445.607 4.534 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccccc2COCc2ccccc2)c1C 1648580582 JNBYSWRGCOWZJH-UHFFFAOYSA-N 439.519 4.629 50 10 IJGE CC1=C(C#N)C(=O)N(C[C@H]2CCCO2)C(=O)/C1=C\Nc1ccc(N=Nc2ccccc2)cc1 1772742739 AANCYKFPSMORQE-FBNUHJGQSA-N 441.491 4.786 50 10 IJGE COc1ccc(Cl)cc1-c1csc(/C(C#N)=C(\O)[C@@H]2CC(=O)N(C(C)(C)C)C2)n1 1872758709 MROFBBIGAPFDJL-RILUTCLRSA-N 431.945 4.912 50 10 IJGE CC(C)(C)OC(=O)Nc1ccccc1C[C@H](CBr)NC(=O)OC(C)(C)C 1880761415 NFKRJMCUYPLBHH-CQSZACIVSA-N 429.355 4.864 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@H](C(F)(F)CCl)C1 1892743795 JPOQPZQBWCVIPH-LURJTMIESA-N 437.531 4.609 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cccc(C(F)(F)F)c1F 1916354952 NXRUILZDBLIRBN-AWEZNQCLSA-N 448.254 4.897 50 10 IJGE CC[C@H](C)[C@H](Br)CNC(=O)c1scc(Br)c1Br 1942810440 MMWLZLROTVHZMH-NKWVEPMBSA-N 448.018 4.813 50 10 IJGE COc1cc([C@@H](Br)C2(Br)CC2)c(OC)cc1Br 2002806421 LAIKOBDEVSQINR-LLVKDONJSA-N 428.946 4.830 50 10 IJGE Brc1ccc(CN2CCCC[C@H](Br)C2)c(Br)c1 2003417195 LHALYWNHIUUONU-LBPRGKRZSA-N 425.990 4.961 50 10 IJGE C[C@]1(CCBr)CCN1Cc1cccc(Br)c1Br 2025222147 GSTQFXDGQYWHLD-ZDUSSCGKSA-N 425.990 4.961 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CCCC[C@H](Br)C1 2050104821 NMVSAWXZIGVTGK-VIFPVBQESA-N 439.973 4.601 50 10 IJGE Clc1cc(CN2C[C@@H](Br)CC3(CC3)C2)ccc1I 2086657158 BSWLGXSIFUQXGV-NSHDSACASA-N 440.550 4.694 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@H](Br)C(F)(F)F 2106781884 LVVKWGWESBUMNM-HNNXBMFYSA-N 437.300 4.790 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc(NC(=O)[C@H](Br)C2CCCC2)cc1F 2110729729 CQDSQWNEQHBCQY-MRXNPFEDSA-N 429.330 4.743 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([S@](C)(=O)=NCc2ccc(CBr)cc2)C1 2126472896 ZQAKZXBGIXQXJK-QLXKLKPCSA-N 445.423 4.579 50 10 IJGE Fc1cncc(N2CCC3(CCN(Cc4ccccc4)CC3)CC2)c1CBr 2143963593 QYGAJPAPLQGWMJ-UHFFFAOYSA-N 432.381 4.998 50 10 IJGE O=C(c1ccc(Br)cc1Cl)N1CC[C@H](CBr)C(F)(F)C1 2146375437 NIYYOPKPZXONFL-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE Clc1ccc(C(CBr)(CBr)COC[C@H]2CCCO2)cc1 2149039298 WZNQROZUOPBGSO-CQSZACIVSA-N 426.576 4.563 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)c(Br)c2F)C[C@@H](CBr)O1 2166829376 CKRPJNQJXZRFOC-SNVBAGLBSA-N 429.555 4.616 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 2202298195 MWGLMZOYFVIDRA-PBFBIOBFSA-N 446.776 4.849 50 10 IJGE O=C(c1cc(Cl)ccc1I)N1CCCC[C@H]1CCCCl 2206691163 IDWYTUBOXNWKKW-LBPRGKRZSA-N 426.125 4.958 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CBr)OCc1ccccc1C(F)(F)F 2220472918 NJANSXILLVWAOB-MRXNPFEDSA-N 426.273 4.900 50 10 IJGE COc1ccc([C@@H](Br)C[C@H]2COC(C)(C)C2)cc1I 2269542351 JUQXSZFHLRKEML-PWSUYJOCSA-N 439.131 4.941 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@@H](Br)CC12CC2 2282979629 CMRBKYBBLWZLPG-MRVPVSSYSA-N 425.523 4.774 50 10 IJGE CCC(CBr)(CBr)NC(=O)c1sc(C(F)(F)F)cc1C 2295250719 WWSSYXKBIWOBGR-UHFFFAOYSA-N 437.119 4.744 50 10 IJGE CCOc1ccc(Br)cc1C=C(C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1C 2297400009 NCOQKOJXSIQXCF-UHFFFAOYSA-N 430.258 4.610 50 10 IJGE N#CC(=Cc1ccc(OCc2ccccc2F)cc1)C(=O)N1CCN(c2ccccc2)CC1 2313565295 IQKOUYOIKSJFOV-UHFFFAOYSA-N 441.506 4.660 50 10 IJGE N#CC(=Cc1ccccc1OCc1ccc(F)cc1)C(=O)N1CCN(c2ccccc2)CC1 2313567570 LZQFNMMBWZJABO-UHFFFAOYSA-N 441.506 4.660 50 10 IJGE CCCOc1ccccc1C=C(C#N)C(=O)Nc1ccc(I)cc1 2314774159 VXPXIQCCKKYVLQ-UHFFFAOYSA-N 432.261 4.626 50 10 IJGE COC[C@@]1(C)C[C@]1(CBr)Cc1ccc(Cl)cc1I 2318546612 UPFDGTDFYPRGCK-KGLIPLIRSA-N 443.550 4.925 50 10 IJGE Clc1ccc(I)cc1CN1[C@H]2CC[C@@H]1C[C@H]2CBr 2327389772 NUCABRUPJXPCES-BHYNMZESSA-N 440.550 4.692 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@H]2CC[C@@H](Cl)[C@@H]1C2 2330964371 RDZFBNGIKDXERR-QNSHHTMESA-N 427.589 4.895 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@H](CN(C[C@@H](CBr)C3CCC3)C1)C2 2332629900 RCTOKZZPHRPEPT-YRISNDGFSA-N 429.443 4.815 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@H]1CCC[C@@]2(C1)CC2(F)F 2343415233 ZVABWCUJHVWNDV-JENIJYKNSA-N 430.333 4.689 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@@H]3CN(C(=O)OC(C)(C)C)CC[C@H]32)C1 2345005629 BGEVHJWUADJWGD-IAGOWNOFSA-N 429.443 4.909 50 10 IJGE COc1ccc(OC)c(-c2cc(C(=O)NN=Cc3ccc(C)cc3)c3ccccc3n2)c1 8573174 NEESKRURDSQXHN-UHFFFAOYSA-N 425.488 4.991 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)Cc3ccccc3)ccc21 38681881 FMPOCIPQMCIEBC-AREMUKBSSA-N 440.499 4.842 50 10 IJGE COc1ccccc1/C=N/NC(=O)COc1ccc(-c2ccccc2)cc1Br 40910759 YZXSMDMBXZRSJC-ZVHZXABRSA-N 439.309 4.654 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)COc2ccc(C(C)C)c(C)c2)c(OC)c1 206401749 AACUBEHBZGNYGD-UNOMPAQXSA-N 437.492 4.582 50 10 IJGE Cc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 254349782 HGQMOCUIOFPTLZ-UHFFFAOYSA-N 425.448 4.520 50 10 IJGE O=C(Cc1cccc2ccccc12)NN=Cc1cccc(OC(=O)c2cccc(F)c2)c1 254480565 XNAWLCUTPKUMRU-UHFFFAOYSA-N 426.447 4.891 50 10 IJGE CC[C@@H](Br)c1nnc(-c2cccc(F)c2I)s1 721719678 PRSNVEBHHNILMH-SSDOTTSWSA-N 427.080 4.795 50 10 IJGE COc1ccc(-c2cc(C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)sc2C)cc1 736692022 WTIYSXCOSSZAHS-UHFFFAOYSA-N 445.548 4.958 50 10 IJGE Cc1cc(C(=O)NNc2ccc(Br)c(F)c2)ccc1NC(=O)c1cccs1 771675067 NZVSZTXZTXWWCQ-UHFFFAOYSA-N 448.317 4.967 50 10 IJGE C#C[C@@H]1CCCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1 1643854229 JYUHHIVAJVCTGH-BAOGCXAUSA-N 425.454 4.892 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)s1 1648578065 HHHXIGHCIHZQDF-UHFFFAOYSA-N 431.521 4.649 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)c1 1651317497 MYYNAVQRUQLTBT-UHFFFAOYSA-N 430.577 4.830 50 10 IJGE C=C(C)[C@@H](NC(=O)NNc1c(F)cc(F)cc1Br)c1ccc(F)c(F)c1 1681551175 CHNZZVHWTRQABB-OAHLLOKOSA-N 432.215 4.949 50 10 IJGE O=C(COc1ccccc1)NN=Cc1cc(Br)ccc1OCc1ccccc1 1772753945 IVHSSCQBUSITQY-UHFFFAOYSA-N 439.309 4.557 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2cccc(Cl)c2)c1 1865689933 GWZYHAIETIJIPI-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE C[C@@H]1CN(Cc2cccc(Br)c2Br)C[C@H]1CBr 1943881544 BSSQDLLZXONMSV-MWLCHTKSSA-N 425.990 4.674 50 10 IJGE CC1([C@H](CBr)NC(=O)c2scc(Br)c2Br)CC1 1945360151 FLQWZXKHGDJIFN-ZETCQYMHSA-N 446.002 4.567 50 10 IJGE COc1ccc([C@H](Cl)c2cc(I)sn2)c(Br)c1 2007645666 TUGGDXGJUCWZMX-NSHDSACASA-N 444.519 4.847 50 10 IJGE O=C(NC1(CCBr)CCC1)c1cccc(Br)c1Br 2031481304 FIXBVETYQOLFPQ-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE C[C@@](CI)(OC1CC(F)(F)C1)c1ccccc1Br 2031585444 WKIVEGQSOBSZAM-LBPRGKRZSA-N 431.058 4.914 50 10 IJGE CC1(C)C[C@@](C)(CBr)CN1c1ncc(Br)cc1Br 2078801649 BVHPBLKXKHPIBA-ZDUSSCGKSA-N 441.005 4.997 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2106787142 YCMBKVIFNOTWIF-IEBWSBKVSA-N 425.411 4.744 50 10 IJGE Cc1nc(Br)c(Br)n1CC(C)(C)c1nc(CCl)cs1 2110045523 HZGLXMNBSCYNAT-UHFFFAOYSA-N 427.593 4.890 50 10 IJGE C[C@]1(CBr)CC(F)(F)CN1C(=O)c1cc(Cl)cc(Br)c1 2159049622 POBKLQCWPJEOFC-GFCCVEGCSA-N 431.502 4.737 50 10 IJGE CN(C(=O)c1cc(Cl)ccc1I)[C@@H]1CCCCC[C@H]1Cl 2172546799 IXIABOXLUUPNIA-TZMCWYRMSA-N 426.125 4.957 50 10 IJGE CC[C@@H](Br)C(=O)N[C@@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1 2179674254 JRZZSAOXGCEXHH-MSOLQXFVSA-N 435.362 4.695 50 10 IJGE Cc1sc(C)c(S(=O)(=O)NC2(CCCBr)CCC2)c1Br 2205776545 PHZQMCIHYOJABM-UHFFFAOYSA-N 445.242 4.504 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)[C@H](C)CBr)c(Br)c1 2212711181 GCFZHVZHLKTYAO-CYBMUJFWSA-N 441.163 4.884 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@@H]2CCCC23CCC3)CC1 2250320584 XSMBYFOGRWNPPX-OAHLLOKOSA-N 449.373 4.931 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H]2CC[C@@H](C2)[C@H]1CBr 2285846619 QALOAQLFQPJNSJ-UVPNAGLESA-N 425.523 4.630 50 10 IJGE CC[C@H](C)[C@@H](CBr)NCc1ccc(Cl)cc1I 2302329694 UYVFZIOPEWHCJA-TVQRCGJNSA-N 430.555 4.844 50 10 IJGE CC[C@@H](Cl)CN(CC)Cc1ccc(I)c(Br)c1 2306218610 CCTYFODJQUGWHI-LLVKDONJSA-N 430.555 4.893 50 10 IJGE CC[C@@H]1[C@H](CBr)CCN1Cc1cc(I)ccc1Cl 2327398965 KXBOOXVGLYNKFQ-IINYFYTJSA-N 442.566 4.940 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3C2(C)C)C1 2345004476 KZJWUKIOEWEUOM-CVEARBPZSA-N 429.443 4.765 50 10 IJGE COc1cc(/C=C(/C#N)c2nc3ccccc3s2)ccc1OCC(=O)Nc1nccs1 35520020 ITPHJMPXCKMTFB-GDNBJRDFSA-N 448.529 4.843 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(C)cc2)cc1 38649175 ZBXVJDBUWBPWBF-VWLOTQADSA-N 426.472 4.506 50 10 IJGE O=C(NNc1ncnc(Nc2cccc(Cl)c2)c1[N+](=O)[O-])c1cccc2ccccc12 40648628 NUHLNLFTUHXUNQ-UHFFFAOYSA-N 434.843 4.692 50 10 IJGE [C-]#[N+][C@@H](c1cc(Br)cc(Br)c1)S(=O)(=O)c1ccc(C)cc1 138945227 ZRBDMWRXFUPOHW-OAHLLOKOSA-N 429.133 4.912 50 10 IJGE CCCOc1c(/C=N\NC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cccc1OC 169917825 JJOUAVHNDUNCNJ-QRVIBDJDSA-N 426.542 4.625 50 10 IJGE CCn1c(SCC(=O)NN=Cc2ccc(C)cc2)nnc1-c1ccc(C(C)(C)C)cc1 254407272 ALORFWAEHIJQKR-UHFFFAOYSA-N 435.597 4.813 50 10 IJGE COC(=O)[C@H](C)[C@@H]1CC[C@@H]2[C@@]34CC[C@@]5(C[C@H](OC(C)=O)CC[C@]5(C)C3=CC[C@@]12C)OO4 254592075 FOTZVCWKWXRZRV-FUSUTXTGSA-N 432.557 4.513 50 10 IJGE COc1cc2c(cc1NC(=O)CC(C)=NNC(=O)c1ccc(F)cc1)oc1ccccc12 254618649 SASUNDVHVYHYMN-UHFFFAOYSA-N 433.439 4.868 50 10 IJGE COC1CCC(O[C@@H](CI)c2cccc(Br)c2)CC1 686230065 AIBFVYDWROPWMK-NRXISQOPSA-N 439.131 4.899 50 10 IJGE O=C(NC1(CBr)CCCCCC1)c1csc(I)c1 713450717 YEHCVEITUHNXBU-UHFFFAOYSA-N 442.160 4.570 50 10 IJGE O=C(NCc1ccc(Oc2ccccc2C(F)(F)F)nc1)NNc1cccc(F)c1F 745871429 MSRROZUKARBNJG-UHFFFAOYSA-N 438.356 4.997 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(C(=O)NN=Cc3ccc(Cl)c([N+](=O)[O-])c3)cc2)c1 1084329686 ROLYMPNJTIHQBE-UHFFFAOYSA-N 436.855 4.573 50 10 IJGE CCc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1cccc(OC)c1)CCC2 1772749454 LSFYNMMGTAEIAV-UHFFFAOYSA-N 445.519 4.882 50 10 IJGE O=C(CCBr)c1ccc(I)cc1SC(F)(F)F 1848425825 FJFWUMIZJWKEBC-UHFFFAOYSA-N 439.034 4.871 50 10 IJGE N#CSc1ccc(NC(=O)CCC(=O)N2CCC[C@@H]2c2nc3ccccc3s2)cc1 1868176863 FAGQYYIICGHBTG-GOSISDBHSA-N 436.562 4.952 50 10 IJGE CC(C)CNCC1(C[C@H]2C[C@@H]2Br)C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 1887901876 SUHAIIUCIPODDX-QWRFSNNTSA-N 429.443 4.954 50 10 IJGE Cc1cc([C@H](Br)c2c(Br)ncn2C)sc1Br 1900441553 UOKUTNNPYCBCBH-ZETCQYMHSA-N 428.975 4.799 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC[C@](C)(CI)O2)[C@@H]2CCCC[C@H]21 1984441675 MTIUHMJLFWCYBJ-DTTOXWODSA-N 435.346 4.539 50 10 IJGE CC[C@H](Br)CN(CC)C(=O)c1cc(Br)c(Br)s1 1999377512 KULKCUOVJPYXKC-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE FC(F)(CBr)CCNCc1ccc(Br)cc1Br 2012614174 CNMBXHBEXAPHPP-UHFFFAOYSA-N 435.932 4.722 50 10 IJGE F[C@@H]1CC[C@@H]([C@@H](Br)c2cc(I)cc3c2OCC3)C1 2032983178 DNQLSQNZXULSLL-ZDSQKVDBSA-N 425.079 4.800 50 10 IJGE Clc1ccc(I)c(CN2CC3(CC3)C[C@@H]2CBr)c1 2037830676 IEJQXLGXHRUOOT-GFCCVEGCSA-N 440.550 4.694 50 10 IJGE CCC[C@H]1CN(c2ncc(Br)cc2Br)C[C@H]1CBr 2084887514 BYNJJTKUIMJOCD-VHSXEESVSA-N 441.005 4.854 50 10 IJGE ClCCc1nc2c(Br)cccc2n1[C@@]12C[C@H]1CN(Cc1ccccc1)C2 2099679095 NWLYRYGHJIWQFA-HRAATJIYSA-N 430.777 4.811 50 10 IJGE Cc1c(Br)cnc2c1nc([C@@H](C)Cl)n2CC1CN(Cc2ccccc2)C1 2128499379 YKZBDQWTSCDADD-CQSZACIVSA-N 433.781 4.934 50 10 IJGE O=C(NC[C@]12CCC[C@@]1(CCl)C2)c1csc(Br)c1Br 2142942535 DTQGSNLVTZRKEL-QWHCGFSZSA-N 427.589 4.802 50 10 IJGE O=S(=O)(N[C@H](CCBr)C1CCCCC1)c1cscc1Br 2143923266 QAZJEAQVWDCSNU-GFCCVEGCSA-N 445.242 4.523 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)C1[C@@H]2COC[C@@H]12 2213491740 ICCPIPVVMUGZFA-QHMRUWFYSA-N 428.921 4.679 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1Cc1cnns1 2234055803 DPYHYPJDKKXNRG-LURJTMIESA-N 436.560 4.761 50 10 IJGE C[C@H]1CC[C@H](COC2(CI)CCN(C(=O)OC(C)(C)C)CC2)C1 2243469182 GFEQLIXGOZDYDO-GJZGRUSLSA-N 437.362 4.644 50 10 IJGE CO[C@@H]1C[C@H]1[C@@H](Br)c1c(F)cc(Br)c(F)c1Br 2250745348 KNNSQSXLHQOBLJ-BTDYQHFOSA-N 434.900 4.961 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C[C@H](C)O[C@@H]2C)cc1I 2257373265 LZXFYQULCYYOLE-SAOAKYDJSA-N 425.104 4.549 50 10 IJGE O=S1(=O)CCC[C@@H]1[C@@H](Br)c1cc2sc(Br)cc2s1 2263560382 PZMFJFCOQINVHI-KOLCDFICSA-N 430.208 4.739 50 10 IJGE CCC12COC([C@@H](Br)c3ccc(OC)c(I)c3)(C1)C2 2269539279 CYDLMDFOVWXKKS-NFOMZHRRSA-N 437.115 4.695 50 10 IJGE CCOC(=O)C(C#N)=C1S[C@@H](Cc2ccc(Cl)cc2)C(=O)N1c1ccc(C)cc1 2293039218 QCLWHINDQOVTGA-IBGZPJMESA-N 426.925 4.638 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]1C(F)(F)F 2353829355 ZFSSLSKUUYEUHC-ZNMIVQPWSA-N 445.364 4.916 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)NS(=O)(=O)c1ccc(Br)cc1Cl 2366100572 QVZWEPRDCGAWHF-GFCCVEGCSA-N 447.620 4.579 50 10 IJGE CCCCCCOc1ccccc1C(=O)NNC(=O)COc1ccccc1[C@H](C)CC 7659866 PIZJZHRWEIUCII-LJQANCHMSA-N 426.557 4.999 50 10 IJGE Cc1ccc(C(=O)NNc2ncnc(Nc3cc(C(F)(F)F)ccc3Cl)c2N)cc1 40682672 ITYIFDXUCFKHPB-UHFFFAOYSA-N 436.825 4.540 50 10 IJGE CCCCOc1ccc(/C=N/NC(=O)COc2ccc(Br)cc2CC)cc1 40959811 YWUVANFNVVDJDS-OEAKJJBVSA-N 433.346 4.720 50 10 IJGE Cc1ccccc1C(CBr)(CBr)Cc1c(C)nn(C)c1Cl 167849594 LTIPNHVVDUQSOI-UHFFFAOYSA-N 434.603 4.961 50 10 IJGE CCCCCCCCCOc1ccc(/C=N\NC(=O)c2sc(N)nc2C)cc1OC 169888384 BPYPMWSVWYROTM-IWIPYMOSSA-N 432.590 4.936 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1Br)c1cc(Br)cc(Br)c1 232459295 IIULIMXBGJAWFJ-RYUDHWBXSA-N 439.973 4.648 50 10 IJGE FC(F)Oc1cc(I)c(Br)cc1CBr 575682218 KMYROFXLCYZLNU-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE CCN(C[C@H](C)Br)C(=O)c1scc(Br)c1Br 705447349 HQDBRWPWEHPFDY-LURJTMIESA-N 433.991 4.519 50 10 IJGE CN(C(=O)c1ccc(Br)cc1Br)[C@H]1CCC[C@@H]1Br 709268701 RVBXEELKOPVBRN-JQWIXIFHSA-N 439.973 4.600 50 10 IJGE C=CCOc1c(Br)cc(C=NNC(=O)CCCc2cccs2)cc1OC 732532786 QSIJSFAFRXTGDY-UHFFFAOYSA-N 437.359 4.557 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)O[C@@H]2CCc3ccc(F)cc32)c(-c2ccccc2)n1 749061919 AHXLKXBSLBOAKA-UOCRBVKVSA-N 426.451 4.741 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N2CCC(C(=O)C(F)(F)F)CC2)c(C)n1-c1ccc(F)cc1 775437323 BKEWIBHTWCCSAN-LDADJPATSA-N 447.432 4.510 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)O[C@H]([C@@H]2CCOC2)C(F)(F)F)c(C)n1-c1ccc(F)cc1 778021178 DKANOAVUZYSBQW-QHWBIOISSA-N 436.405 4.651 50 10 IJGE CC(=NNC(=O)c1sc(-c2ccc(Cl)cc2)cc1N)c1ccc([S@](=N)(=O)O)cc1 916357818 MCFTYHCXERISJR-UHFFFAOYSA-N 448.957 4.683 50 10 IJGE CC(=O)c1ccc(NC(=O)NNc2c(Br)cccc2Br)cc1C 1562506678 JTLXSOOCCBQHQR-UHFFFAOYSA-N 441.123 4.871 50 10 IJGE Cc1ccccc1-n1ncc(C(=O)NNc2nc3ccccc3[nH]c2=S)c1C(F)(F)F 1633439484 JFQDYPAUWPUBFD-UHFFFAOYSA-N 444.442 4.562 50 10 IJGE COc1ccc(-c2nn(Cc3ccccc3)c3c2[C@@H](c2cccs2)C(C#N)=C(N)O3)cc1 1865698243 OCQXLLNRMWXASA-OAQYLSRUSA-N 440.528 4.887 50 10 IJGE COc1ccc([C@H](C(=O)NC(C)(C)C(=O)Nc2ccc(SC#N)cc2)C(C)C)cc1 1866982928 LWQIZMAIGKCFOE-HXUWFJFHSA-N 425.554 4.541 50 10 IJGE CC(C)OC(=O)c1ccc(/C(C#N)=C/c2ccc(OCC(=O)Nc3ccccc3)cc2)o1 1872728709 PCCMNVQYAZYMIN-XMHGGMMESA-N 430.460 4.926 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@]23CCOC[C@H]2C3)s1 1900919383 OYGAWJJGYZBCSL-DADVEIPYSA-N 433.536 4.869 50 10 IJGE CN(C[C@@](C)(CBr)C(C)(C)C)[C@@H]1CCN(C(=O)OCc2ccccc2)C1 1904845252 PRUUTOISPRHSSB-WIYYLYMNSA-N 425.411 4.777 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cccc2cccnc12 1915089484 ZNPXYDNCXWDLLB-GOSISDBHSA-N 433.371 4.599 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@H]1Cc1ccc(Br)cc1Br 2007138520 WLPPINZIOQJACR-SUZMYJTESA-N 426.974 4.943 50 10 IJGE CC(C)N(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@H](Br)C(F)(F)F 2044699484 LTEWFXDPNKSUIN-KGLIPLIRSA-N 431.337 4.670 50 10 IJGE CC(C)[C@@H](Br)CN(C)C(=O)c1cc(Br)ccc1Br 2048729851 GHYCICVPQXLCLB-LBPRGKRZSA-N 441.989 4.703 50 10 IJGE C[C@H](N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)n(C)c1)C(C)(C)C 2059284528 MBJRRTVJQOBIMW-HNNXBMFYSA-N 427.408 4.546 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@@H]2C[C@@H](Cl)CC[C@@H]21 2093947454 WTQBECOTSTZUCA-WEDXCCLWSA-N 427.589 4.895 50 10 IJGE C[C@H]1C[C@@H](C)[C@@H](CNC(=O)OC(C)(C)C)CN1Cc1ccc(CBr)cc1 2126464443 AWBYEQPUWLYJBV-GJYPPUQNSA-N 425.411 4.953 50 10 IJGE CC[C@@H]1CCN(C(=O)c2ccc(CBr)cc2)[C@@H](CNC(=O)OC(C)(C)C)C1 2162912399 VFNZBGCFAIYJQU-CRAIPNDOSA-N 439.394 4.737 50 10 IJGE C[C@@]12CC[C@@]([C@H](Br)c3cc(I)cc4c3OCC4)(CO1)C2 2178377199 BLDDWXGCFQXTGE-PMPSAXMXSA-N 449.126 4.621 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2N1C(=O)OC(C)(C)C 2196913227 CNCQUVONXAFDIT-ATIWLJMLSA-N 443.426 4.577 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@H]2C[C@@H]([C@@H](F)CBr)C2)cc1Br 2199058467 OFRSNUQIRGPURF-PLMOITTCSA-N 427.539 4.652 50 10 IJGE CCOc1cccc(CBr)c1OC[C@H]1CC1(Br)Br 2218001755 YAKJKUDDSOIZKR-SNVBAGLBSA-N 442.973 4.865 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OCC[C@H]1CCCC12CC2 2243323041 UCCZZDADUKEHBT-PBHICJAKSA-N 437.362 4.692 50 10 IJGE CC1(C)CN(C(=O)c2ccc(Cl)c(I)c2)C[C@@H]1CCCl 2283661423 GNSHABJWHIHZHH-NSHDSACASA-N 426.125 4.672 50 10 IJGE ClC[C@@H]1CCC[C@@H]1CNCc1ccc(I)c(Br)c1 2325211808 LWDDGTDZDGXXTE-NWDGAFQWSA-N 442.566 4.798 50 10 IJGE Clc1ccc(I)cc1C[C@@H](CBr)C1CCOCC1 2327399281 PSPIUHYRTFUUGA-LBPRGKRZSA-N 443.550 4.925 50 10 IJGE COc1ccc([C@H](Br)[C@H]2OC[C@@H]3CCC[C@H]23)cc1I 2334464166 VLTZEJVSLMFACV-GVARAGBVSA-N 437.115 4.551 50 10 IJGE Cc1nc(Br)c([C@H](Cl)c2c(F)cc(F)c(Br)c2F)n1C 2362444998 TVHGQPGEULPSJX-SECBINFHSA-N 432.465 4.999 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1I)C1CCC(CCl)CC1 2365581017 ATYFNGWKKVGAED-UHFFFAOYSA-N 426.125 4.814 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(O[C@H]2CCCCC23CCOCC3)C1 2368353748 IASJOSFWGYADHC-UWJYYQICSA-N 446.426 4.907 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@H]1C[C@@H]2CCC[C@H](C1)C2(F)F 2369430753 IGWVSHRYELABCM-OKYOBFRVSA-N 444.360 4.935 50 10 IJGE Cc1ccc(/C(CSc2nc3ccccc3[nH]2)=N\NC(=O)c2ccccc2O)c(C)c1 59460791 IYFFFEWPTNOHBO-MEFGMAGPSA-N 430.533 4.812 50 10 IJGE O=C(N/N=C/c1ccccc1Oc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cccc(O)c1 59500340 JNFXWYAMAPDOAA-BRJLIKDPSA-N 445.353 4.875 50 10 IJGE CCC/C(=N/NC(=O)[C@]1(C)CC1(Br)Br)c1ccc(Cl)cc1 96438421 PRRIMQPMYSKYET-YQNUULROSA-N 436.575 4.857 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C\NCc1ccccc1Br)c1ccc2c(c1)CCCC2 217204588 TUCJEDJUYMMKAL-KQRQPNSISA-N 438.369 4.702 50 10 IJGE Cc1ccc(NC(=O)c2ccc(CBr)cc2)cc1I 228129831 MJBWIFMKULCKCS-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE CC(C)CCCO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 231313658 KMVOCWOCPYORMS-QGZVFWFLSA-N 425.351 4.644 50 10 IJGE CCOC[C@H](C)O[C@](C)(CI)c1ccccc1Br 233791154 YLCZEADFTXDHBY-SMDDNHRTSA-N 427.120 4.541 50 10 IJGE CC(=NNC(=O)/C(=C/C(C)=C\c1ccccc1)NC(=O)c1ccccc1)c1ccc(O)cc1 252622238 NRCONHIAHYHNKB-AGLDHPETSA-N 439.515 4.650 50 10 IJGE CC(=NNC(=O)CCCCCC(=O)NN=C(C)c1ccc(C)s1)c1ccc(C)s1 254894594 JDIRAMAGRDQTLC-UHFFFAOYSA-N 432.615 4.758 50 10 IJGE CC(C)(C)[C@@H](Br)CNC(=O)c1ccc(Br)cc1Br 324398151 GXFLKFVXNYUTSI-NSHDSACASA-N 441.989 4.751 50 10 IJGE O=C(CBr)c1c(Br)cc(OC(F)F)cc1OC(F)(F)F 575683758 CXIJYDDZKAIDBS-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCC(CBr)CC1 705402938 VGROTJFSFGPYKQ-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE BrCc1c(Br)cccc1N1CC2(CN(Cc3ccccc3)C2)C1 706185686 XWIPEJXKMXWVBD-UHFFFAOYSA-N 436.191 4.666 50 10 IJGE CCOC(=O)O[C@]1(C(=O)OCCl)CC[C@H]2[C@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@@]21C 725239824 FVOOBFFVLCZGIJ-OKDJKNPTSA-N 448.943 4.866 50 10 IJGE CCc1ncsc1NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 747233175 IBJBAKQSDZSAHU-XNTDXEJSSA-N 436.928 4.682 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)N(C)C)c(Br)cc1OCc1ccc(C)cc1 1084472646 GONZHOFOLKBDRD-VCHYOVAHSA-N 443.341 4.730 50 10 IJGE C=CCC[C@H](CO)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1449422474 IIZDBWJTUZOUEY-ZKTNYTPDSA-N 432.351 4.751 50 10 IJGE C=C(C)COc1cccc(NC(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)c1 1476104159 OCZJYVKSIFMORX-INIZCTEOSA-N 431.920 4.532 50 10 IJGE C=CCC[C@@H](NC(=O)NNc1ccc(C(=O)OC)c(F)c1)c1ccc(C(F)(F)F)cc1 1680633963 VLLZSTNYRGPZNX-GOSISDBHSA-N 439.409 4.965 50 10 IJGE CN(C)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3Cc2ccccc2)cc1 1865684117 UBAFZNLDDSPCAM-XMMPIXPASA-N 447.542 4.883 50 10 IJGE CCc1nn(-c2ccc(OC)cc2)c2c1[C@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 1865685777 MWEISGCSQAQPEG-SFHVURJKSA-N 441.318 4.968 50 10 IJGE CCCc1nn(Cc2ccc(C)cc2)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699142 LYZSXEGHXHPLOE-DEOSSOPVSA-N 437.547 4.902 50 10 IJGE N#CSc1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OCc2ccccc2)cc1 1865996603 SMRRAHDEGMQPIM-JOCHJYFZSA-N 431.517 4.736 50 10 IJGE N#CSc1ccc(NC(=O)[C@@H](NC(=O)c2cc(-c3ccco3)on2)c2ccccc2)cc1 1866640312 SZPIRVYBPNSIJP-NRFANRHFSA-N 444.472 4.618 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)C(Cl)(Cl)Cl)n2)c(OC)c1OC 1872759324 KIMWGFUQOWGGTH-ZROIWOOFSA-N 435.716 4.999 50 10 IJGE CN(Cc1sccc1I)C[C@H](Cl)COCc1ccccc1 1888203808 RVOXGJRJICJGET-AWEZNQCLSA-N 435.758 4.609 50 10 IJGE CCCN[C@H](c1sc(Cl)cc1I)[C@@H]1C[C@H]1Br 1900962370 GZIGEAGFEHTDAC-XSSZXYGBSA-N 434.568 4.830 50 10 IJGE Cc1nn(C)c(CN(Cc2ccccc2)[C@H](C)CCBr)c1Br 1915114479 PFDPWFZYGZNZLM-CYBMUJFWSA-N 429.200 4.667 50 10 IJGE CCC[C@](C)(CBr)NC(=O)c1cc(Br)sc1Br 1942784614 DUQDOMWJJDASLH-LLVKDONJSA-N 448.018 4.957 50 10 IJGE C[C@H]1C[C@H](Br)CN(Cc2c(Br)cccc2Br)C1 1945323939 UWFCMHQKWQWSOT-UWVGGRQHSA-N 425.990 4.817 50 10 IJGE CCCC(CBr)(CCC)CN=[S@@](C)(=O)CCNC(=O)OC(C)(C)C 1999498609 ZRIFXDOASWHEEY-DEOSSOPVSA-N 427.449 4.590 50 10 IJGE Cc1c(Cl)cc(CN[C@@H](CI)C(C)C)cc1Br 2002244499 OWUKMIBKXJKWQT-ZDUSSCGKSA-N 430.555 4.960 50 10 IJGE CC1(C)C[C@@H](CBr)CN1c1ncc(Br)cc1Br 2012360842 BXKUOIZFUAXJCR-QMMMGPOBSA-N 426.978 4.606 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1ccccc1OCc1ccccc1 2023033772 KVARUVYCFIFZEP-QAPCUYQASA-N 437.321 4.845 50 10 IJGE O=C(CCl)c1c(I)ccc(OC(F)(F)F)c1C(F)(F)F 2055164525 XUBRAHUGGYVFGD-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE CC(C)[S@](=O)(=NCC[C@H](C)CCBr)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2063273346 LQRNAKIHKSQKEX-ITNZAGEZSA-N 439.460 4.683 50 10 IJGE Cc1cccc(C)c1Cn1nc(CCl)c(I)c1C(F)(F)F 2079211205 LYRQQFNWXZCCMM-UHFFFAOYSA-N 428.623 4.910 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1ccc(Br)c(Cl)c1 2081235361 FEVWPKJPVXNTBR-PRHODGIISA-N 444.538 4.682 50 10 IJGE ClCCc1nc2cc(Br)ccc2n1[C@]12C[C@@H]1CN(Cc1ccccc1)C2 2099678420 IMNHTUUCJQLMRY-IERDGZPVSA-N 430.777 4.811 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CN(CC3(CBr)CCCCCC3)C[C@@]2(C)C1 2106784210 HBMXKOHILFDLHP-XLIONFOSSA-N 429.443 4.911 50 10 IJGE C[C@@H]1CN(C[C@H](CBr)c2ccccc2)C[C@@H](C)C1NC(=O)OC(C)(C)C 2106789131 WLSLYOKAWVMGPU-NUJGCVRESA-N 425.411 4.646 50 10 IJGE CC[C@H]1CN(C(=O)OC(C)(C)C)CCCN1C[C@H](CBr)c1ccccc1 2106789389 YDMJCHRINQVOKQ-OALUTQOASA-N 425.411 4.887 50 10 IJGE O=C1NCCc2ccc([C@@H](Cl)c3csc(Br)c3Br)cc21 2150341823 LIMGFKKRVLRRQW-GFCCVEGCSA-N 435.568 4.887 50 10 IJGE COCCN(c1c(CBr)ccc(Br)c1Cl)[C@H]1CCSC1 2170157120 MKWCZSGARYJURF-NSHDSACASA-N 443.632 4.956 50 10 IJGE CCN(CCCCCI)[C@@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C 2211184549 DUILBHGCFXDUQH-HZPDHXFCSA-N 438.394 4.607 50 10 IJGE COc1ccc(Br)c(CBr)c1OCC1(Br)CC1 2214868395 RMNJPMBDTZBYJG-UHFFFAOYSA-N 428.946 4.659 50 10 IJGE C[C@H](NC(=O)c1cc(F)c(Br)cc1Cl)[C@@H]1CCC[C@H]1Br 2282991167 BTHUEQNIAXFSGZ-OYNCUSHFSA-N 427.539 4.924 50 10 IJGE COc1ccc(-c2csc(C(C#N)=CNc3ccc4oc(=O)ccc4c3)n2)cc1OC 2295945859 JCWRWVWNEQOTRN-UHFFFAOYSA-N 431.473 4.910 50 10 IJGE CCOc1cc(C=C(C#N)c2nc3ccc(C)cc3[nH]2)cc(I)c1O 2296400190 BXDHYFNWZOMSPI-UHFFFAOYSA-N 445.260 4.644 50 10 IJGE O=C(Cc1cccc2ccccc12)NN=Cc1c[nH]nc1-c1cccc(Br)c1 2297635520 JPYOIZIAUPSYLF-UHFFFAOYSA-N 433.309 4.685 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)CC1CC(Cl)C1 2306217775 SYQKCPVKUYCWOU-UHFFFAOYSA-N 428.539 4.503 50 10 IJGE F[C@]1(CBr)CCCN(Cc2ccc(Cl)c(I)c2)C1 2315553278 PVOOXHCYVFSANW-ZDUSSCGKSA-N 446.529 4.644 50 10 IJGE COc1ccc(C=NNC(=O)Cc2cc(Cl)ccc2SC)cc1Br 2323680349 AXHVJPSVORHAPT-UHFFFAOYSA-N 427.751 4.526 50 10 IJGE CC(C)c1ncccc1CO[C@@]1(CBr)CCCN(C(=O)OC(C)(C)C)C1 2342167971 XNIRODHBHWXVIM-HXUWFJFHSA-N 427.383 4.886 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)CCc1cc(Cl)cc(Cl)c1 2366852332 BCOBULSKXWGGKJ-IINYFYTJSA-N 428.141 4.892 50 10 IJGE CC(C)(C)[C@@](C)(CBr)CS(=O)(=O)Cc1ccccc1Br 2380202716 LXPRLJRWSVQCBE-HNNXBMFYSA-N 426.214 4.811 50 10 IJGE CCc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)cc1 38653077 WZOQJAVZVPHIHX-RUZDIDTESA-N 444.462 4.591 50 10 IJGE O=[N+]([O-])c1ccc(C[C@@H](Br)c2csc(I)c2)cc1 124511445 LEEHUFBHUOYGLC-LLVKDONJSA-N 438.084 4.940 50 10 IJGE CC[C@@H](NC(=O)/C(C#N)=C\Nc1cc([N+](=O)[O-])ccc1OC)c1ccc2c(c1)CCCC2 217192617 BSZPJNJNVMYAKG-OHUBLEDJSA-N 434.496 4.569 50 10 IJGE C[C@@H](Cl)c1nc2cc(I)ccc2n1C[C@H]1CSCCS1 229627162 FLMSTSAVZOEPNY-KOLCDFICSA-N 438.787 4.789 50 10 IJGE O=C(NC[C@H]1CCCC[C@H]1CCl)c1cc(Cl)ccc1I 236013707 UNFXXXLINDAQAW-WDEREUQCSA-N 426.125 4.720 50 10 IJGE O=C(NN=Cc1coc2c(Cl)cc(Cl)cc2c1=O)c1cccc(Br)c1 254392378 JDQCTQJICBWLCU-UHFFFAOYSA-N 440.080 4.626 50 10 IJGE COc1ccccc1C=NNC(=O)c1cc(-c2ccc(OCc3ccc(C)cc3)cc2)n[nH]1 254417013 OLYAXRQMBCPCPV-UHFFFAOYSA-N 440.503 4.737 50 10 IJGE CC[C@H](CBr)N(C)C(=O)c1cc(Br)sc1Br 382170687 LFWJCGGUEYWDON-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE C[C@H](CCCCBr)NC(=O)c1cc(Br)c(Br)s1 398449326 SVEIYNJRLSZCPW-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE COC1CC(COc2c(Br)cc(Br)cc2CBr)C1 703888129 NEUKYEFJIRPEHK-UHFFFAOYSA-N 442.973 4.910 50 10 IJGE CC(C)[C@@](C)(CBr)NC(=O)c1scc(Br)c1Br 707836264 BSWZNNLAPGIUMS-LLVKDONJSA-N 448.018 4.813 50 10 IJGE CS(=O)(=O)c1ccc(-c2nc(COC(=O)CCCC[C@@H]3CCSS3)co2)cc1 761361597 FVNFJLIZDKGBPY-MRXNPFEDSA-N 441.596 4.502 50 10 IJGE CN(Cc1ccccc1F)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 818032034 HUSDXVBLLHXDMV-UYRXBGFRSA-N 447.901 4.822 50 10 IJGE C#CCN(CC#N)C(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Cl)c(C(F)(F)F)c2)c1C 1459372152 HYXDPVNZOLOSAC-BOPFTXTBSA-N 444.844 4.659 50 10 IJGE C/C(=C/C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl)c1cccc(F)c1 1540389325 IGSZZMOSXKPMQE-RAXLEYEMSA-N 425.287 4.542 50 10 IJGE Cc1cc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)ccc1[N+](=O)[O-] 1614641138 IDQWQYQQGNGPFB-MSOLQXFVSA-N 433.302 4.650 50 10 IJGE Cc1cccc(Cl)c1NNC(=O)[C@@H](C)SCc1nc(O)c2c(C)c(C)sc2n1 1624314360 MXLLXTSFHGAIDR-GFCCVEGCSA-N 436.990 4.741 50 10 IJGE CC(=O)c1cc(F)c(O)c(NC(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(C)c3)c2C)c1 1645065083 UXUGATABFCZRKR-JMIUGGIZSA-N 431.467 4.996 50 10 IJGE CCN(C(=O)c1oc2c(c1C)C(=NNC(N)=O)CC(C)(C)C2)c1cccc2ccccc12 1772729232 FUPBIOMOXHZCEG-UHFFFAOYSA-N 432.524 4.753 50 10 IJGE N#CSc1ccc(NC(=O)CNC(=O)[C@H](c2ccc(Cl)cc2)C2CCCC2)cc1 1868158535 ZYVKLYOOEBAJDU-NRFANRHFSA-N 427.957 4.942 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C1CCC2(CC1)CN(C(=O)OC(C)(C)C)C2 1882087536 KIBJGIWOOSXSOC-OAHLLOKOSA-N 447.414 4.702 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C[C@@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C 1890792165 SHZRTEQOQQLTKB-KKUMJFAQSA-N 435.403 4.748 50 10 IJGE CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)C[C@]1(CBr)CC1(F)F 1893489599 RTUFALCVTHGRNT-LJQANCHMSA-N 447.364 4.824 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]3(CC[C@@H]21)CC[C@@](C)(CI)O3 1935707894 ZDRVODWGSNOAMI-IDCJVQTKSA-N 435.346 4.539 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1Br)c1csc(Br)c1Br 1945183300 BSRJBCQWHREPKW-JGVFFNPUSA-N 446.002 4.709 50 10 IJGE C[C@@]1(NC(=O)c2scc(Br)c2Br)CCC[C@@H]1Br 2011556653 SUCOHRFOCVHNQS-WRWORJQWSA-N 446.002 4.709 50 10 IJGE C[P@]1(=O)C[C@@H](Br)[C@@H](Cc2ccc(I)c(Cl)c2)C1 2026559709 CPQUKMUPJVLUEA-YAXFVEMYSA-N 447.478 4.873 50 10 IJGE Clc1cc(CN2CCCC[C@H]2CBr)ccc1I 2026562086 XZDSFNUFJNIAQA-NSHDSACASA-N 428.539 4.694 50 10 IJGE CC1([C@@H](CBr)NCc2ccc(I)c(Cl)c2)CC1 2026567247 QIIHGJJPXWTQIM-GFCCVEGCSA-N 428.539 4.598 50 10 IJGE CCCN(CCCBr)C(=O)c1cccc(Br)c1Br 2032093438 IIHRJQQVLBHOSK-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE CC(C)(C)OC(=O)NCCCN(CC(F)(F)F)CC1(CBr)CCCC1 2044705344 KQGNRBAUWNYHIO-UHFFFAOYSA-N 431.337 4.721 50 10 IJGE FC(F)(F)c1c(Br)c(CBr)nn1-c1cnccc1C1CC1 2078916605 WETQNPURPMTDOR-UHFFFAOYSA-N 425.046 4.821 50 10 IJGE Brc1ccccc1[C@H](CI)OCCOC1CCCC1 2087345319 XHMQSYUCDDDFDH-HNNXBMFYSA-N 439.131 4.901 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)[C@@H]2CCCS(=O)(=O)C2)cc1Br 2089861663 UBIZKCAFKHMJTC-RNCFNFMXSA-N 430.589 4.625 50 10 IJGE ClCc1nc2cncc(Br)c2n1CCCOCCOCc1ccccc1 2095437708 PAKCGCBEYTVMQI-UHFFFAOYSA-N 438.753 4.556 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2CN(CC3(CBr)CCCCCC3)C[C@@H]21 2106784481 JAOWAYFOTGFQNB-OKZBNKHCSA-N 429.443 4.957 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1 2106784870 LRLFSRRTUKYDFU-GBESFXJTSA-N 425.411 4.933 50 10 IJGE COc1cc(Cl)c([C@H](Br)c2cn(C)nc2Br)cc1Cl 2116555251 QSJVZVUHXSTDLS-NSHDSACASA-N 428.939 4.982 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2C[C@@H]1CCCN1Cc1ccccc1 2153120460 TVPSTKUOPIQCSS-KRWDZBQOSA-N 447.808 4.948 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2Cc1ncc(Br)s1 2153126555 WWRJNXXZZCTNGN-UHFFFAOYSA-N 436.560 4.508 50 10 IJGE CC(C)(C)C[C@H](CCl)CNC(=O)c1cc(Cl)ccc1I 2156327650 ZMRFCHBDHKCEIE-SNVBAGLBSA-N 428.141 4.966 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2ccc(CBr)cc2)C12CCCC2 2162490660 STRYEZSFWAKEER-QGZVFWFLSA-N 437.378 4.634 50 10 IJGE CC(C)(C)OC(=O)NCC1C[C@@H]2CC[C@H](C1)N2C[C@@H](CBr)c1ccccc1 2163063025 OCYAALMBQCSBHF-NLBBHCLQSA-N 437.422 4.933 50 10 IJGE COC[C@@H](C)OC[C@H](Br)CCc1ccc(Cl)c(Br)c1F 2166830959 IUKAQIQEAONOFQ-MWLCHTKSSA-N 432.555 4.989 50 10 IJGE CCCCCN(C(C)C)S(=O)(=O)c1cc(CBr)oc1Br 2179774219 CZMJYWPKFSKUEF-UHFFFAOYSA-N 431.190 4.526 50 10 IJGE CN([C@@H]1CCC(C)(C)C1)S(=O)(=O)c1cc(CBr)sc1Br 2179787857 UVVBHTFIXMKDEB-SECBINFHSA-N 445.242 4.605 50 10 IJGE COCC(COC)CC(CBr)(CBr)c1ccc(Cl)cc1 2199390616 WIYQSFWURVZEAH-UHFFFAOYSA-N 428.592 4.667 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@H]2CCCS2(=O)=O)c(C)c1Cl 2224302918 QCSMZVPAIGUARN-ZYHUDNBSSA-N 430.589 4.733 50 10 IJGE Cc1cc(Cl)c(Cl)cc1C[C@@H](Br)CN1C(=O)c2ccccc2C1=O 2241616510 KEZXVXPLESMUAU-GFCCVEGCSA-N 427.125 4.904 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC[C@@H]2CCC2(C)C)C1 2243127474 OLBLHEXNBVMUSY-KBXCAEBGSA-N 437.362 4.644 50 10 IJGE COc1cc2ncnc(N(Cc3ccccc3)[C@@H](C)CCBr)c2cc1OC 2294691241 BCRMLQDUABPKQK-HNNXBMFYSA-N 430.346 4.827 50 10 IJGE COc1ccc(OC)c(NC=C(C#N)c2nc(-c3cc4ccccc4oc3=O)cs2)c1 2296789986 GXIUBPBILHVZOJ-UHFFFAOYSA-N 431.473 4.910 50 10 IJGE N#CC(=Cc1ccccc1[N+](=O)[O-])c1nc(-c2cc3cc([N+](=O)[O-])ccc3oc2=O)cs1 2297321313 WQVAQFABKUFXCH-UHFFFAOYSA-N 446.400 4.797 50 10 IJGE CCCCOc1ccc(C=C(C#N)C(=O)Oc2ccc3c4c(c(=O)oc3c2)CCC4)cc1 2314735413 SRRVIHAWKADCKI-UHFFFAOYSA-N 429.472 4.973 50 10 IJGE Brc1cccc(CN2C[C@H]3CC[C@H]2C[C@@H]3Br)c1Br 2315481139 UAMKQNCQSXIFQJ-CDMKHQONSA-N 438.001 4.959 50 10 IJGE COc1ccc(C(C)=NNC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)c(OC)c1 2321278499 YYWQGEOIDAXVLP-UHFFFAOYSA-N 425.435 4.506 50 10 IJGE CC(C)N1C[C@@H](Cl)[C@H](Cc2ccc(I)c(Br)c2)C1 2325209927 SXMYQBBEADDLON-DGCLKSJQSA-N 442.566 4.544 50 10 IJGE C=CC[C@@H](Cl)[C@H]1CCN1Cc1ccc(I)c(Br)c1 2325230217 RJTIXYRCIUQDPB-TZMCWYRMSA-N 440.550 4.812 50 10 IJGE CN(CC[C@H]1CCCCN1C[C@]1(CBr)CC1(F)F)C(=O)OC(C)(C)C 2326919539 OHORWPHVPMRCIV-RHSMWYFYSA-N 425.358 4.518 50 10 IJGE Cc1ccc(-c2csc(C(C#N)=C(O)[C@@H](C)N3C(=O)c4ccccc4C3=O)n2)c(C)c1 2331309053 QQUCOSAEGFLJPN-OAHLLOKOSA-N 429.501 4.904 50 10 IJGE COc1nc(OCc2c(Br)cccc2Br)c(CCl)s1 2340646198 FFUXYWCHIHQKJM-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)CN(C)S(=O)(=O)c1cc(Br)cs1 2365907332 HANAXUTYLRTLCP-GFCCVEGCSA-N 447.258 4.577 50 10 IJGE Cc1sc(C)c(S(=O)(=O)NC(C)(C)[C@@H](Br)C(C)C)c1Br 2365961530 HJXOEKXKCVTRAF-LBPRGKRZSA-N 447.258 4.604 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@](C)(CBr)C(C)(C)C)[C@@]2(CCCOC2)C1 2380168322 MBRVCBGCXZECLQ-DQLDELGASA-N 447.458 4.582 50 10 IJGE N#C/C(=C\c1cc(Br)c2c(c1)OCO2)C(=O)Nc1cccc(C(F)(F)F)c1 20885560 ZZOIFUNWDBBZFL-NYYWCZLTSA-N 439.187 4.742 50 10 IJGE O=C(c1cc(C(F)(F)F)ccc1Br)N1CCC(CBr)CC1 159886091 VXBSYOWAFLWQTR-UHFFFAOYSA-N 429.074 4.715 50 10 IJGE CCCCOc1ccc(/C=C2\C(=O)N(Cc3ccccc3)C(=O)C(C#N)=C2C)cc1OC 214281166 IRKJODOSSIWADW-STZFKDTASA-N 430.504 4.667 50 10 IJGE C[C@H]1CCN(Cc2cc(Cl)ccc2I)[C@@H]1CBr 405329386 FPNKRXWWMFRMAV-TVQRCGJNSA-N 428.539 4.550 50 10 IJGE O=C(NNc1cccc(F)c1F)[C@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1 743720880 DHDAWEHLGJZNDB-CYFREDJKSA-N 435.474 4.588 50 10 IJGE O=C(NNc1cccc(F)c1)C(=O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1 783042564 COYIYVXHQXXTFP-UHFFFAOYSA-N 433.361 4.719 50 10 IJGE C=CCc1cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)cc(OCC)c1OCC(=O)OCC 1083922725 XWJKHWRVIOCQRB-KGENOOAVSA-N 448.519 4.610 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2ccc(OCc3cccc(C)c3)cc2)cc1 1084348438 FEKFWOVNDGAJRF-SANMLTNESA-N 446.547 4.937 50 10 IJGE CCc1ccc(OCC(=O)NN=Cc2ccc(Cl)cc2Cl)c(Br)c1 1084403596 IGQODPSJRBVGHR-UHFFFAOYSA-N 430.129 4.847 50 10 IJGE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)Cc1cccc2ccccc12 1351943590 UZUTXCOYKGIPOR-FYWRMAATSA-N 428.410 4.532 50 10 IJGE C[C@H](Oc1cccnc1NC(=O)Nc1ccc(SC#N)cc1)C(=O)OC1CCCCC1 1858847247 IQBXVAMAALUMEF-HNNXBMFYSA-N 440.525 4.942 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CCC)nn3-c2ccccn2)cc1 1865693348 VCBOIERUMKHCRM-QFIPXVFZSA-N 429.524 4.617 50 10 IJGE C[C@@H](Br)CCCNC(=O)c1cccc(Br)c1Br 1943888244 XXLZNHXTATYOEU-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE BrC[C@H](NCc1cccc(Br)c1Br)C1CCC1 1943907157 UOWZETARHQCBFE-LBPRGKRZSA-N 425.990 4.865 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@]21CC[C@](C)(CI)O1 1987456096 OHNOMBTVSTVBAU-SJLPKXTDSA-N 435.346 4.540 50 10 IJGE CC[C@H](CCCCl)NC(=O)c1cc(Br)ccc1I 2036511026 QHEYMYNGNZUROF-SNVBAGLBSA-N 444.538 4.581 50 10 IJGE CC1(C)C[C@H](Br)CN1C(=O)c1c(Br)cccc1Br 2037325854 QNZRVKJOQDDDHG-QMMMGPOBSA-N 439.973 4.600 50 10 IJGE O=C(c1csc(C(F)(F)F)n1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 2046643157 GRKMKDYRQQTQGC-AWEZNQCLSA-N 433.293 4.978 50 10 IJGE FC(F)(F)c1cc(Br)nc(-n2nc3c(c2CBr)[C@@H]2C[C@@H]2C3)c1 2080648133 OERORICAVKLHCA-HTRCEHHLSA-N 437.057 4.603 50 10 IJGE CCn1ncc(Br)c1[C@H](Cl)c1sc(COC)cc1Br 2094274027 HZPIJABSQYVBQC-JTQLQIEISA-N 428.577 4.964 50 10 IJGE Brc1ccc([C@H](CI)OC[C@@H]2CCCCCO2)cc1 2096323526 ZJQSQJMKKXDYLJ-GJZGRUSLSA-N 439.131 4.901 50 10 IJGE O=S1(=O)CCC[C@H]([C@@H](Br)c2cc(Br)c(Cl)cc2F)C1 2097823899 KQHIYUAEDIECNU-JVXZTZIISA-N 434.552 4.502 50 10 IJGE CN(Cc1c(Br)cnn1C)c1ccc(F)c(Cl)c1CBr 2156478151 KOZQUILFZKKVMI-UHFFFAOYSA-N 425.527 4.506 50 10 IJGE CCCN(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2167033896 TZKCSFJQVSQSAY-ROUUACIJSA-N 445.442 4.968 50 10 IJGE CC1(C)CN(c2nc3ccccn3c2CBr)CCCN1Cc1ccccc1 2193718510 ADVYQJVJYBNFIO-UHFFFAOYSA-N 427.390 4.720 50 10 IJGE COC[C@@](C)(CC(CBr)(CBr)c1cccc(Cl)c1)OC 2198254706 RUTHXXRLYVHQIA-CQSZACIVSA-N 428.592 4.809 50 10 IJGE C[C@@]1(CC(CBr)(CBr)c2ccccc2F)CSCCO1 2201228490 PYWAXKOWUVVRFT-CQSZACIVSA-N 426.189 4.766 50 10 IJGE C[C@@H]1CCC[C@]12[C@@H](Br)C[C@@H]2OCCOCCOCCOCc1ccccc1 2236089238 PXBKKPHQDABBLJ-RYFAJOAYSA-N 441.406 4.595 50 10 IJGE CC[C@@H](Br)c1nnc(-c2c(F)cccc2I)s1 2247949470 GYVRRKYINGVESH-ZCFIWIBFSA-N 427.080 4.795 50 10 IJGE CCC(CC)(CBr)NC(=O)c1ccc(Cl)c(I)c1 2256386936 PYIHVHJUZYSABM-UHFFFAOYSA-N 444.538 4.628 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2CCCOCC2)cc1I 2257374911 VWFRFSZLCPOBLB-YGRLFVJLSA-N 425.104 4.553 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CC(F)(F)CN1CC1(CBr)CCCCC1 2264249124 NRJSAUQKOQIHOV-CQSZACIVSA-N 425.358 4.566 50 10 IJGE COc1ccc([C@H](Br)C[C@H]2CCCOCC2)cc1I 2269545035 LHNOESDXTWNGQN-WCQYABFASA-N 439.131 4.943 50 10 IJGE CN(Cc1ccc(I)cc1)C[C@@H](CBr)c1ccccc1 2280256201 XABSRLLDOYDTDL-MRXNPFEDSA-N 444.154 4.902 50 10 IJGE CN(C(=O)c1cccc(Cl)c1Br)[C@@H](CCBr)C(F)(F)F 2283141543 XMRHBRYXZOYGTA-VIFPVBQESA-N 437.481 4.890 50 10 IJGE COC(=O)c1ccc(COc2ccccc2C=C(C#N)C(=O)N[C@@H](C)c2ccccc2)cc1 2297388049 UNUPSWMEELXTGR-IBGZPJMESA-N 440.499 4.837 50 10 IJGE CC(C)(CCCl)C(=O)Nc1cc(Br)ccc1I 2300169722 BMZHMQUPGGXTPA-UHFFFAOYSA-N 430.511 4.647 50 10 IJGE CCN(Cc1ccc(Cl)c(I)c1)C(C)(C)CBr 2300239920 FSPGEDHDJDPGFT-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE COc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)cc1 2314634449 UDMPWYMVBARZDE-RUZDIDTESA-N 442.446 4.671 50 10 IJGE CCOc1ccc(C=C(C#N)C(=O)Nc2ccc(C(=O)OCCC(C)C)cc2)cc1OC 2314729135 XJAFNHQITCYHKX-UHFFFAOYSA-N 436.508 4.842 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OCc1ccccc1Cl 2321677275 ASBDZSGJNQYMSZ-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE Cl[C@@H]1CCN(Cc2ccc(I)c(Br)c2)[C@H]1C1CC1 2325234538 YUUWROIBNOEDTI-OCCSQVGLSA-N 440.550 4.645 50 10 IJGE COc1ccc([C@H](Cl)c2c(Br)ncn2C)c(Br)c1Cl 2337277827 YUCNMHOGVXLCTH-VIFPVBQESA-N 428.939 4.935 50 10 IJGE CC1(C)CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)[C@H](C(F)(F)F)C2)C1 2345006546 OJNVJRXNUQCUAV-ZDUSSCGKSA-N 443.348 4.671 50 10 IJGE Cc1cc(Br)c(C(=O)N2CC[C@H](Br)C[C@@H]2C(F)(F)F)s1 2361464841 RMXSWZUDRTYDJF-IONNQARKSA-N 435.103 4.749 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)[C@H]1C[C@H](S(C)(=O)=O)C1 2365175399 GRZFLAFIEKDYOO-DNSOKLHBSA-N 448.579 4.762 50 10 IJGE Cc1sc(C(=O)N2CCC[C@@H](Br)[C@@H]2C(F)(F)F)cc1Br 2370254784 ONUVNQYSMMESTR-GMSGAONNSA-N 435.103 4.749 50 10 IJGE N#CC1=C(N)C(C#N)(C#N)[C@H](c2ccc(-c3ccc(Br)cc3)o2)[C@@H]2CCC=C12 2759505 BQOLBLXVNVFLDA-UZLBHIALSA-N 431.293 4.913 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)N(c3ccccc3F)C3=C2C(=O)CC(C)(C)C3)cc1OC 9761323 BXJKWLDXPXXWPU-QHCPKHFHSA-N 447.510 4.784 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2F)cc1C 38652164 AXRCANDFSNVJEH-RUZDIDTESA-N 444.462 4.645 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4F)ccc32)c1 40530163 AQCOGWQZUIWVJD-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE CC(C)(C)c1ccc(OCCCC(=O)N/N=C/c2ccc(O)cc2)c(Br)c1 40951390 YOHUOSYPDRUSFG-OEAKJJBVSA-N 433.346 4.762 50 10 IJGE COC(=O)c1cccc(Cn2cc(/C=C(\C#N)C(=O)NCc3ccccc3)c3ccccc32)c1 59297223 LFAMLTGRDDLCBN-HZHRSRAPSA-N 449.510 4.700 50 10 IJGE Cc1ccc(C)c(OCCCC(C)(C)C(=O)NNC(=O)c2ccccc2Br)c1 66201467 IAHIVTUTRQZCNJ-UHFFFAOYSA-N 447.373 4.712 50 10 IJGE C[C@H](Br)c1ccccc1NC(=O)c1cccc(I)c1 125520889 BCAIYLPKOHYUKO-JTQLQIEISA-N 430.083 4.999 50 10 IJGE CCOc1cc(/C=N/NC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)cc([N+](=O)[O-])c1OCC 169889374 WFRTVDRJNSLASZ-RCVWNDJPSA-N 443.544 4.839 50 10 IJGE Cc1ccccc1OCC(=O)NN=Cc1ccc(OC(=O)c2cccc3ccccc23)cc1 254814382 BUKPDZIOBBTVJA-UHFFFAOYSA-N 438.483 4.897 50 10 IJGE ClCc1ccc(I)c2scc(I)c12 306855526 WMDCJVDKLVKUEY-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21 383294330 XBXXSJHBQHUUDL-WSTWGYHLSA-N 445.138 4.954 50 10 IJGE C[C@@H](Cl)CC(C)(C)CNS(=O)(=O)c1cc(Br)ccc1Br 393580291 GOPZIVPILYSGGA-SECBINFHSA-N 447.620 4.534 50 10 IJGE C[C@@H]1[C@H]2CC[C@@H](C[C@@]13CC[C@](C)(CI)O3)N2C(=O)OC(C)(C)C 686235675 GEGHBTACZRFXIW-FOOXYVKASA-N 435.346 4.537 50 10 IJGE CCc1c(C)nn(-c2cccc(C(=O)NNc3c(F)cc(F)cc3Br)c2)c1C 766471387 XDGUKSHZWKUOCK-UHFFFAOYSA-N 449.299 4.849 50 10 IJGE CCc1c(C)nn(-c2cccc(C(=O)NNc3ccc(Br)cc3F)c2)c1C 767083994 IAKYEXSZUJISGM-UHFFFAOYSA-N 431.309 4.710 50 10 IJGE CC(C)[C@H](NC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F)C(F)(F)F 787960910 VFJVDEGHAURBET-GWCFXTLKSA-N 436.805 4.548 50 10 IJGE C=CCc1cc(/C=C(\C#N)C(=O)N(C)C)ccc1OCc1ccc(Br)cc1 1084047322 AHRHPGNXHSHBJJ-CPNJWEJPSA-N 425.326 4.752 50 10 IJGE C#CCN(C(=O)CCCC[C@H]1CCSS1)C1CCN(C(=O)OC(C)(C)C)CC1 1455815144 XWPKRWIJOVZWJB-SFHVURJKSA-N 426.648 4.562 50 10 IJGE Cc1c(C(=O)Nc2cccc(Cl)c2)oc2c1C(=NNC(=O)c1ccccc1O)CCC2 1772751864 ONHHRFLNXHBBRS-UHFFFAOYSA-N 437.883 4.670 50 10 IJGE CC[C@@](C)(NC(=O)c1nc(C(C)(C)C)n2ccccc12)C(=O)Nc1ccc(SC#N)cc1 1866874533 IACCAWVBTKBHPV-XMMPIXPASA-N 449.580 4.742 50 10 IJGE N[C@H](c1c(Cl)cc(Br)c(F)c1Br)[C@@H]1C[C@@H]1Br 1900373199 TVLUXIIFELNDMY-XTZAULBFSA-N 436.344 4.787 50 10 IJGE CCc1nn(C)c(CN(Cc2ccccc2)C[C@@H](Br)CC)c1Br 1915129408 ZMBHZYYZWBHVPF-HNNXBMFYSA-N 443.227 4.921 50 10 IJGE C[C@H](Br)C(C)(C)NC(=O)c1cccc(Br)c1Br 1943887329 OQMAQQXFRXDFNJ-ZETCQYMHSA-N 427.962 4.503 50 10 IJGE C[C@@]1(CBr)CCCN1C(=O)c1csc(Br)c1Br 1945190564 PDFDPWJIXYAOAT-NSHDSACASA-N 446.002 4.663 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@@H]2CC[C@@H]3CC[C@H]2C3)C1 1947121234 RLGDHLKHQCFEJR-GGXPGOJBSA-N 449.373 4.786 50 10 IJGE CC1(C)C[C@@H](Br)CN1Cc1c(Br)cccc1Br 1949218322 IJHJEWKJLYDAFW-SECBINFHSA-N 425.990 4.959 50 10 IJGE CCN(C[C@](C)(CI)OCCC[C@H]1C[C@@H]1C)C(=O)OC(C)(C)C 1985940275 IEMBDBSLSVJOAP-MPGHIAIKSA-N 439.378 4.890 50 10 IJGE C[C@]1(CCBr)CCN1Cc1c(Br)cccc1Br 2025225559 VQEYKNXELCTVIK-ZDUSSCGKSA-N 425.990 4.961 50 10 IJGE CCC[C@@H](CCBr)NC(=O)c1cccc(Br)c1Br 2031479902 PAMBHIKTOFBFAV-VIFPVBQESA-N 441.989 4.895 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCC2)C[C@H]1CC(F)F 2057191968 BFNKKNXLQWSIQH-CQSZACIVSA-N 425.358 4.518 50 10 IJGE C[C@]1(CBr)C[C@H](NC(=O)c2ccc(Br)cc2Br)C1 2059455318 VNUMRQUEZXCKJB-GMZHKTEUSA-N 439.973 4.505 50 10 IJGE O=[N+]([O-])c1c(CBr)nn(-c2ccc(F)cc2C(F)(F)F)c1C(F)(F)F 2079141642 KNVIYFYFNATNDX-UHFFFAOYSA-N 436.081 4.852 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1c(Br)sc(C)c1C 2081237672 ZMHWKONJPPWLRO-GMSGAONNSA-N 444.176 4.707 50 10 IJGE ClCc1cc(Br)cnc1N1CC[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1 2092525354 YSLGWLBBOLKBOL-HKUYNNGSSA-N 434.809 4.931 50 10 IJGE CCCC(=O)[C@H](Br)Cc1ccc(C(F)(F)F)cc1I 2139266263 HZVSUZDOATWPCE-SNVBAGLBSA-N 449.048 4.985 50 10 IJGE CN(Cc1cnn(C)c1Br)c1c(CCl)ccc(Br)c1Cl 2173263759 ARDIWGMZJXKUMW-UHFFFAOYSA-N 441.982 4.974 50 10 IJGE CCN(CCCCCI)[C@@H]1CCC[C@H]1CNC(=O)OC(C)(C)C 2211184553 DUILBHGCFXDUQH-JKSUJKDBSA-N 438.394 4.607 50 10 IJGE Fc1cc(Br)cc2c1nc(CCCl)n2CC1CN(Cc2ccccc2)C1 2224711663 ZXRMHSMTZJATRH-UHFFFAOYSA-N 436.756 4.851 50 10 IJGE COc1cc(F)c([C@@H](Br)c2c(Cl)c(C)nn2C)cc1Br 2240929612 IHYSALNAEKQZJM-LLVKDONJSA-N 426.511 4.776 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC[C@](C)(CI)O2)C[C@H]2CCCC[C@H]21 2246604628 ZETSDKIUZBWJGK-RGCFKVTRSA-N 449.373 4.929 50 10 IJGE Cc1ccc(N(C)Cc2ccccc2I)c(CBr)n1 2271559576 HPAOSLRXIANFLA-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1CBr)c1cc(Br)c(F)cc1Cl 2285843917 GFXDAOVBMTXDSP-AMIZOPFISA-N 427.539 4.925 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2cc(C(F)(F)F)ccc2Cl)c(OC)c1OC 2297381449 UVJUULHKYWRZAT-UHFFFAOYSA-N 440.805 4.930 50 10 IJGE C[C@@H](NC(=O)C(C#N)=Cc1c[nH]nc1-c1ccc(Br)cc1)c1ccc(F)cc1 2297435328 CZRAEMMJAVSIDG-CYBMUJFWSA-N 439.288 4.763 50 10 IJGE Clc1ccc(CN2CCCC[C@H](Br)C2)c(I)c1 2302306526 FCSICHTYZFOBLW-NSHDSACASA-N 428.539 4.694 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@@H]2CCCC3(CC3)C2)C1 2302706016 DGYQZEQJDBGJQC-DNVCBOLYSA-N 449.373 4.931 50 10 IJGE COc1ccc(NC(=O)C(C#N)=Cc2ccc(OCc3ccccc3F)c(OC)c2)cc1 2313724676 SKMNSULDASQHGZ-UHFFFAOYSA-N 432.451 4.968 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](Br)[C@H](OCCCCC(F)(F)C(F)(F)F)C1 2315804620 UHHRNFPXWVVPKA-GHMZBOCLSA-N 440.247 4.754 50 10 IJGE N#CC(=CN(Cc1ccccc1)c1ccccc1)C(=O)N1CCN(c2ccc(F)cc2)CC1 2325279866 BAGNICOXEHSHAK-UHFFFAOYSA-N 440.522 4.589 50 10 IJGE CN(CC[C@H](Cl)c1cccs1)C(=O)c1csc(I)c1 2340430411 TUKSHPGJGAPLRA-JTQLQIEISA-N 425.744 4.856 50 10 IJGE CC(C)(C)OC(=O)NCC(C)(C)C1CCN(C[C@]2(CBr)CC2(F)F)CC1 2351886198 VHTPIRWWBUPPTN-GOSISDBHSA-N 439.385 4.670 50 10 IJGE ClCc1c(OCc2ccc(Cl)cc2I)nc2sccn12 2365646577 AWVBHTOWUWQVBB-UHFFFAOYSA-N 439.105 4.972 50 10 IJGE C/C(=N\NC(=O)CSc1nnc(-c2ccccc2)n1-c1ccccc1)c1ccc(C)cc1 12447529 JIRDZQPACFQCKS-LGUFXXKBSA-N 441.560 4.875 50 10 IJGE Cc1csc(CCn2c(CCl)nc3cc(I)c(F)cc32)n1 97409181 AYCNQUWCWYOMOA-UHFFFAOYSA-N 435.693 4.526 50 10 IJGE CCCCOC(=O)c1ccccc1N/C=C(/C#N)C(=O)Nc1ccc(Br)cc1 216781185 DLNYBUIGPIIGMW-PFONDFGASA-N 442.313 4.864 50 10 IJGE CC(C)[C@@H](CBr)CNC(=O)c1cc(Br)ccc1Br 394178861 GPOLDEGAUULZBH-VIFPVBQESA-N 441.989 4.609 50 10 IJGE CCCOc1c(Cl)cc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1OC 799751266 LXIFTPPXYPFPCZ-UHFFFAOYSA-N 427.810 4.785 50 10 IJGE CC(C)c1ccc(C=NNC(=O)CCCC(=O)Nc2ccc(Br)cc2)cc1 1084046362 NIBRSVFMPJGJPY-UHFFFAOYSA-N 430.346 4.832 50 10 IJGE O=C(NN=Cc1c(Cl)cccc1Cl)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 1084203223 MLUJLKPQFBYTJC-UHFFFAOYSA-N 438.620 4.754 50 10 IJGE NNC(=O)/C=C\c1cc(Cl)c(OCc2cccc3ccccc23)c(Br)c1 1084375677 OFJSVUFROIGZRL-HJWRWDBZSA-N 431.717 4.838 50 10 IJGE COc1cccc(C(C)=NNC(=O)CCCSc2nc3ccc([N+](=O)[O-])cc3s2)c1 1084421763 URQZFFBXSKRDKM-UHFFFAOYSA-N 444.538 4.626 50 10 IJGE CN(C(=O)OC(C)(C)C)c1ccc(CNC(=O)[C@@H](Br)C2CCCC2)cc1 1183404812 KIQFLISSNKNKAJ-KRWDZBQOSA-N 425.367 4.628 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1cccs1 1628603909 PVDPKVHIRNHZOM-FYWRMAATSA-N 426.925 4.845 50 10 IJGE Cc1ccc(O)c([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccc(Cl)cc2)c1 1865687394 QHHHYHZSWZLTKX-INIZCTEOSA-N 446.816 4.777 50 10 IJGE Cc1ccc(C)c(Cn2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2ccccn2)c1 1865699856 DXKZHRMOHYEKOU-HSZRJFAPSA-N 433.515 4.828 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865715040 UFAMEGOSJVTWMU-JOCHJYFZSA-N 437.459 4.714 50 10 IJGE N#CSc1ccc(Nc2cc(N3CCC[C@@H](CO)C3)nc(-c3ccc(F)cc3)n2)cc1 1868456047 IHXMBYJFJOJQAY-MRXNPFEDSA-N 435.528 4.808 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)N(C)C[C@H]2C[C@H](Br)C2)cc1 1887822469 BTAABNPUOJPLIH-ZQIUZPCESA-N 425.367 4.518 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)CN1c1ccc([N+](=O)[O-])cc1CBr 1921470799 SQOUMTHLNJTRIP-SJORKVTESA-N 432.362 4.837 50 10 IJGE Brc1ccc(Br)c([C@H]2CC[C@@H](CI)O2)c1 1927790707 WSGSECUVBBXXIF-GZMMTYOYSA-N 445.920 4.867 50 10 IJGE BrC[C@H](CC1CC1)NCc1c(Br)cccc1Br 1945331768 VKRIBWIMXUZHON-JTQLQIEISA-N 425.990 4.865 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)O[C@H]1CCCC(F)(F)CC1 1995216105 BSCOYCVJOSUQRL-WFASDCNBSA-N 447.304 4.689 50 10 IJGE O=S(=O)(c1cc(CBr)cs1)N(CCC(F)(F)F)Cc1ccccc1 2009647156 RQRXLKOQTWYBIU-UHFFFAOYSA-N 442.322 4.786 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc([C@]2(C)CCC[C@@H](CI)O2)cc1 2014210800 PGRZBGWDNSVOGY-LPHOPBHVSA-N 445.341 4.931 50 10 IJGE CC[C@H](C)[C@@H](Br)CNC(=O)c1cc(Br)cc(Br)c1 2029977045 ILGDGQZSEBOVDJ-UFBFGSQYSA-N 441.989 4.751 50 10 IJGE BrC[C@H]1[C@H]2CC[C@@H](C2)N1Cc1cc(Br)ccc1Br 2058366508 OHLOEUCHIOUNIH-WFBYXXMGSA-N 438.001 4.959 50 10 IJGE COc1cc(CBr)ccc1S(=O)(=O)N(Cc1ccccc1)C(C)(C)C 2059312230 IFWUAZYAEIMDLP-UHFFFAOYSA-N 426.376 4.580 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CC[C@@H](C(F)(F)CBr)C1 2077092417 OBCHULXIWSBYFF-CQSZACIVSA-N 430.314 4.819 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@H]2CCC[C@]2(CCl)C1 2103164165 HHBNMZVBHLXAPV-OQPBUACISA-N 427.589 4.754 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCC2)C[C@@H]1CC(F)(F)F 2119515930 QMGJAIKLHMQWNM-AWEZNQCLSA-N 443.348 4.815 50 10 IJGE O=C(c1ncc(Br)cc1Cl)N(CCBr)Cc1ccsc1 2177057639 ZZKRCRCPVRFVAU-UHFFFAOYSA-N 438.572 4.596 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Br)[C@H]1OCCOC1(C)C 2203000378 NXEKWJZRUJWDRY-WCQYABFASA-N 428.548 4.741 50 10 IJGE CN(C[C@@H](F)[C@@H]1CCOC1)c1c(CBr)ccc(Br)c1Cl 2238357299 IDGANBVHLAUUGT-ZYHUDNBSSA-N 429.555 4.808 50 10 IJGE COc1ccc(Oc2cc(C)nc(CBr)c2)cc1I 2272762333 GOQGZVCQXQPIJY-UHFFFAOYSA-N 434.071 4.690 50 10 IJGE CC1(C)OCCO[C@@H]1[C@H](Cl)c1c(F)cc(Br)c(F)c1Br 2288358263 NCROVOIRBGVSFS-ZYHUDNBSSA-N 434.502 4.964 50 10 IJGE Clc1ccc(C[C@@]2(CBr)CCCOC2)c(I)c1 2302329069 PABOVTNRCLUUDF-CYBMUJFWSA-N 429.523 4.679 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(c2ncc(Br)cc2Br)[C@@H]1C 2304182220 JUICMIGICUVHSS-XKSSXDPKSA-N 426.978 4.605 50 10 IJGE Cc1ccccc1NC(=O)C(C#N)=Cc1c(Oc2ccccc2C)nc2ccccn2c1=O 2314533315 QBGKMSHXSIECMD-UHFFFAOYSA-N 436.471 4.649 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)COc2ccc(C(C)C)cc2)c(OCC)c1 2314735823 FTWLTJGAEJLDNB-UHFFFAOYSA-N 437.492 4.663 50 10 IJGE Cn1nc(C(F)(F)F)c(CBr)c1N(Cc1ccccc1)CC(F)(F)F 2317490516 GSQRPAPUSCPUBH-UHFFFAOYSA-N 430.190 4.903 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cc2c(s1)CCSC2 2320359212 ZFKJADLTISAIHY-INIZCTEOSA-N 440.428 4.638 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)C(C#N)=CN[C@@H](CC)c1ccc2c(c1)CCCC2 2324428709 NEJGLLCPCMQIEI-QHCPKHFHSA-N 431.536 4.829 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CC[C@H](NC(=O)OC(C)(C)C)C[C@H]3C2)C1 2345010869 OQZCMEBPRXWNLY-IKGGRYGDSA-N 429.443 4.813 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Cl)C1(S(C)(=O)=O)CCC1 2365194262 PKNOXKGUWCAGOY-GFCCVEGCSA-N 448.579 4.906 50 10 IJGE O=C(NC[C@@H]1CCC[C@H](CCl)C1)c1ccc(Cl)cc1I 2365587160 UIKUOAJTBWWOQB-WDEREUQCSA-N 426.125 4.720 50 10 IJGE CC(C)C[C@@H](CBr)CN1C[C@H](NC(=O)OC(C)(C)C)CCC12CCOCC2 2382175010 XVFLMFDWCXRXHA-ZWKOTPCHSA-N 447.458 4.582 50 10 IJGE COc1cccc(-c2nn(-c3ccc(F)cc3)cc2/C=C(\C#N)C(=O)Nc2nccs2)c1 9283694 PROVMNWVEXLJKE-LFIBNONCSA-N 445.479 4.689 50 10 IJGE COc1ccc(C(=O)N/N=C(\C)c2ccc3ccccc3c2)cc1I 12573969 NNDVKXYVWCSMIX-LPYMAVHISA-N 444.272 4.607 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(C(=O)NNC(=O)c3ccc(-c4ccccc4)cc3)cc2)c1 12578227 FGGYZPMLBGLROW-UHFFFAOYSA-N 449.510 4.989 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)COc2ccc([C@H](C)CC)cc2)cc1 14028436 SDIDTUPHDKCIID-LJQANCHMSA-N 426.557 4.999 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)c2cccc3ccccc23)c(OC)c1 40994234 VVJNORIQSRGGRV-HMMYKYKNSA-N 428.488 4.891 50 10 IJGE O=C(CCc1ccccc1O)N/N=C1\C(=O)N(Cc2cccc3ccccc23)c2ccccc21 59148713 LRJSONGZJCCZEI-IKPAITLHSA-N 449.510 4.545 50 10 IJGE Cc1cnc([C@@H](C)n2c(CCl)nc3cc(I)c(F)cc32)s1 125288144 UIZIEDGBXDWKNH-MRVPVSSYSA-N 435.693 4.893 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@H]1Cl)c1cc(Br)c(Br)s1 137615404 UGTRSIJUGNRNAL-ZYHUDNBSSA-N 435.568 4.908 50 10 IJGE CCC(CC)[C@H](Cl)CNS(=O)(=O)c1cc(Br)ccc1Br 230666041 NYHVERSJHQQYSD-GFCCVEGCSA-N 447.620 4.534 50 10 IJGE CCC(CC)CO[C@](C)(CI)CN(CC)C(=O)OC(C)(C)C 300721135 CPSMYVHMDNRYNB-QGZVFWFLSA-N 427.367 4.890 50 10 IJGE C[C@H](Br)C[C@@H]1CCCCN1C(=O)c1sccc1I 311059285 JMVICAQQJSAOOQ-UWVGGRQHSA-N 442.160 4.521 50 10 IJGE COc1cc(S(=O)(=O)N(Cc2ccccc2)Cc2ccccc2)cc(CCl)c1OC 379453015 LLDOGNTYAQRZQK-UHFFFAOYSA-N 445.968 4.834 50 10 IJGE C[C@H](Br)C[C@H](C)CNC(=O)c1cc(Br)cc(Br)c1 397814912 FGPLPCLPGXVHLS-IUCAKERBSA-N 441.989 4.751 50 10 IJGE Fc1ccc2nc(CCl)n(Cc3ccn(Cc4ccccc4)n3)c2c1Br 689799881 SPVNJKMEZUWBDB-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE Cn1cc([C@@H](Br)c2ccc(F)c(Br)c2F)nc1Br 691562326 RUCXWYVXWFHQMG-QMMMGPOBSA-N 444.899 4.708 50 10 IJGE O=S1(=O)CCC[C@H]1[C@H](Br)c1scc(C(F)(F)F)c1Br 694620831 GODDBGNBVWJGGF-XPUUQOCRSA-N 442.116 4.543 50 10 IJGE CCC[C@@H](Cc1ccccc1)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 727810682 CIHBQYFHFNAEMW-LDCGKNLRSA-N 437.547 4.898 50 10 IJGE O=C(Nc1ccccc1S[C@@H](Cl)C(F)(F)F)N[C@H]1CCN(c2ccccc2)C1=O 731751929 JRQAJMHAMBZITD-WMLDXEAASA-N 443.878 4.833 50 10 IJGE O=C(CSc1ccccc1C(=O)NNc1cccc(F)c1F)NCC1CCCCC1 743724699 RGHPYTDIPIOIGB-UHFFFAOYSA-N 433.524 4.510 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2ccc(-c3ccc(C(C)=O)cc3)o2)cc1 1084193181 VLKVNDWDJFUCQF-QHCPKHFHSA-N 434.492 4.512 50 10 IJGE C=CCOc1c(Cl)cc(C=NNC(=O)c2ccccc2Br)cc1OCC 1084195324 KSGFYHUVZGLPDO-UHFFFAOYSA-N 437.721 4.830 50 10 IJGE C[C@@H](Sc1ccc(Cl)cc1)C(=O)NN=Cc1ccc(OCC(=O)OC(C)(C)C)cc1 1084318546 BLRDLVGKBPAQIK-OAHLLOKOSA-N 448.972 4.691 50 10 IJGE CC(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)nc3ccccc23)ccc1C 1124216388 SOBVEWMVTGCZMM-UHFFFAOYSA-N 437.499 4.796 50 10 IJGE O=C(NNC(=O)c1ccc(Br)cc1)N[C@H](c1ccc(Cl)cc1)C1CCC1 1251668839 IHTWVYXQYDABQX-KRWDZBQOSA-N 436.737 4.588 50 10 IJGE Cc1sc2nc(CS[C@H](C)C(=O)NNc3ccc(Cl)cc3F)nc(O)c2c1C 1653145813 LYJZXUMGEZRWAQ-SNVBAGLBSA-N 440.953 4.571 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC[C@H]1CC[C@H]1C(C)(C)C 1902716556 UIPQDQRWHPXXDJ-LBTNJELSSA-N 439.378 4.794 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Br)c2n1Cc1csnc1Br 1925106084 REICOPBYIXLSOC-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@H]1CN(c1nc(Cl)c(CBr)s1)C2 1949582910 DGKUNVVJFUCGFS-KSSFIOAISA-N 426.811 4.650 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(Cc2ccccc2)C[C@@H](CBr)C2CCC2)C1 1954679511 CGUFMECNTHOWBD-LJQANCHMSA-N 437.422 4.919 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@@H]2CCCC23CC3)CC1 1986118786 MUOIWHJMEGSVQR-CQSZACIVSA-N 435.346 4.540 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@H]1Cc1cccc(Br)c1Br 2007137383 OUOSSSZXPWVNOO-JFGNBEQYSA-N 426.974 4.943 50 10 IJGE C[C@@H]1C[C@H]1N(CCBr)Cc1ccc(I)c(Cl)c1 2026563359 JISYQLMFZPPKNE-NOZJJQNGSA-N 428.539 4.550 50 10 IJGE CC[C@H](C)N(CCBr)C(=O)c1cccc(Br)c1Br 2031484923 FDGSMOAXOWJJGC-VIFPVBQESA-N 441.989 4.847 50 10 IJGE CCC(CC)(CBr)NC(=O)c1c(Br)cccc1Br 2033096362 XNIHVOACJWWLLT-UHFFFAOYSA-N 441.989 4.895 50 10 IJGE C[C@H]1OCC[C@H]1COc1c(Br)cc(CBr)cc1Br 2057463455 GDODAWVGMLHCGE-SCZZXKLOSA-N 442.973 4.910 50 10 IJGE ClCCc1nc2ccc(Br)cc2n1[C@@]12C[C@@H]1CN(Cc1ccccc1)C2 2099679085 NRDZSEVNBIMTLU-IIBYNOLFSA-N 430.777 4.811 50 10 IJGE C[C@@H](c1nscc1Br)N(C)c1cc(CCl)c(Br)cn1 2130019892 WLWAOBSEXKBCMZ-ZETCQYMHSA-N 425.577 4.999 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N[C@@H]2CCCCC[C@H]2Br)c1Br 2143909771 CRLHSXHNQPXRLS-GHMZBOCLSA-N 445.242 4.502 50 10 IJGE Cc1cccc(C(=O)N(C[C@@H](C)Br)C(C)(C)C)c1I 2272481012 YQWUIQZPZKQJDD-LLVKDONJSA-N 438.147 4.624 50 10 IJGE C[C@@H]1C[C@H](Br)[C@@H](C)N(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282971417 CEUYPDHOEQJFRS-MRTMQBJTSA-N 427.539 4.876 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@@H](Cc2ccccc2C)C(=O)N1c1ccc(C(C)C)cc1 2314593642 QJNGYYFLDQJLRJ-QHCPKHFHSA-N 445.588 4.847 50 10 IJGE CCCOc1ccccc1C=CC(=O)NNC(=O)c1ccc(-c2ccc(Cl)cc2)nc1C 2321060344 UVTGRVLYRJTORC-UHFFFAOYSA-N 449.938 4.974 50 10 IJGE Clc1nccc(OCc2cccc(I)c2)c1CBr 2321491444 CTCVQSYXJUZUHC-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE ClCCC1CCN(Cc2ccc(I)c(Br)c2)CC1 2325207313 PAZDIMVHRDWCOV-UHFFFAOYSA-N 442.566 4.895 50 10 IJGE CC1(C)C[C@@H](CCl)N(Cc2ccc(I)c(Br)c2)C1 2325226390 NZYXAOYYHDCAEU-NSHDSACASA-N 442.566 4.893 50 10 IJGE O=C(CCCOc1ccccc1)NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21 2326839029 VYYAYEKEAJNQCT-UHFFFAOYSA-N 447.922 4.566 50 10 IJGE Fc1cc(Cl)c(Br)c(Cl)c1[C@@H](Br)C1COCCOC1 2335298478 FMHRQAIZSLYUSQ-JTQLQIEISA-N 436.930 4.994 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(O[C@@H]2CCOc3ccccc32)C1 2340300325 XFENJBIVMNUGFK-YLJYHZDGSA-N 426.351 4.691 50 10 IJGE CCCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2351888864 LNSDIWQJRGFPMM-MAUKXSAKSA-N 439.385 4.908 50 10 IJGE O=C(N[C@H](CCCl)C1CCCC1)c1ccc(Cl)cc1I 2365589532 WHGGVIUABNZAQD-CQSZACIVSA-N 426.125 4.862 50 10 IJGE CC(C)C[C@H](CBr)CN1CCC[C@@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2382173611 FQWHVPVIHOLZAR-HZPDHXFCSA-N 443.430 4.993 50 10 IJGE N#C/C(=C1/C(=O)N(Cc2ccccc2Cl)c2ccccc21)c1nnc2n1CCCCC2 9402948 LTCKFEWHZQLPDC-PYCFMQQDSA-N 429.911 4.639 50 10 IJGE CCCCOc1ccccc1C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl 14032089 PUOYMLCACVQHHS-UHFFFAOYSA-N 439.339 4.793 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(C)c(C)c4)ccc32)cc1 38649257 NUONXRQWLNMIPP-SANMLTNESA-N 440.499 4.814 50 10 IJGE CCCCCOc1ccccc1C(=O)N/N=C/c1c(C)nn(-c2cccc([N+](=O)[O-])c2)c1C 59166300 RSSIRRMFHQGSBL-PCLIKHOPSA-N 449.511 4.730 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@@H]1Br)c1cc(Br)ccc1Cl 123833644 DIOSTHVMASKCJU-DZGCQCFKSA-N 429.539 4.893 50 10 IJGE C[C@@H](Br)c1ccccc1NS(=O)(=O)c1ccc(Br)s1 136604025 MPLYCLDPGWZVPX-MRVPVSSYSA-N 425.167 4.767 50 10 IJGE O=C(NC1CCC(Br)CC1)c1ccc(Br)c(C(F)(F)F)c1 139714588 CKZRZKXTXTWBHK-UHFFFAOYSA-N 429.074 4.904 50 10 IJGE O=C(N[C@H](CCl)Cc1ccccc1)c1cc(Br)sc1Br 236034132 KSVCCPZCVLDGCW-JTQLQIEISA-N 437.584 4.853 50 10 IJGE Fc1ccc([C@@H](Br)c2ccc3c(c2)CCO3)c(I)c1 236186364 VNUBQCVLKFUIPL-HNNXBMFYSA-N 433.058 4.850 50 10 IJGE N#C/C(N=Cc1ccc(Cl)cc1)=C(\C#N)NC(=O)Nc1ccc(OC(F)(F)F)cc1 254764818 PAMAMOBIHBGHGA-IDCGXVLUSA-N 433.777 4.738 50 10 IJGE COc1cccc(OCCCOc2c(C=NNC(=O)Nc3ccccc3)cccc2OC)c1 254845272 AMVDNILIEGINOM-UHFFFAOYSA-N 449.507 4.707 50 10 IJGE Nc1ccc(Cl)cc1[C@@H]1CN(Cc2ccccc2)C[C@H]1CI 382734207 WDLWWXSTQSCRJY-RHSMWYFYSA-N 426.729 4.573 50 10 IJGE CC[C@@H](COc1c(Br)cc(CBr)cc1Br)OC 397068432 KHUXFHSLOOKMJV-VIFPVBQESA-N 430.962 4.910 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@H]2C[C@H](Cl)CC[C@H]2C1 398701149 LTRMSERPTBWTTI-DJLDLDEBSA-N 427.589 4.753 50 10 IJGE COC[C@H](O[C@](C)(CI)c1ccccc1Br)C(C)C 404098619 BZUFXQQAPCXFEG-LSDHHAIUSA-N 441.147 4.787 50 10 IJGE ICc1ccc(Cn2c(CN3CCCC3)nc3ccccc32)cc1 607715883 IYRSZTDFQVGTOT-UHFFFAOYSA-N 431.321 4.615 50 10 IJGE CC(C)S(=O)(=O)CCC[C@@H](CBr)Cc1cccc(Br)c1 696943760 UHIMUAZAIJIXRD-CQSZACIVSA-N 426.214 4.606 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2cc(Cl)ccc2I)C[C@H]1CCl 709841946 XTZFSSRYSOXXGS-MWLCHTKSSA-N 438.058 4.794 50 10 IJGE Cn1cc(C(=O)NNC(=O)[C@@H](Sc2ccc(F)cc2)c2ccccc2)c2ccccc21 730207290 NGHAKVUPCUKKGD-QFIPXVFZSA-N 433.508 4.612 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2ccc(NC(=O)C3CCCCC3)cc2)c(O)c1 1084295489 RPXHCIADUNRZGT-UHFFFAOYSA-N 436.556 4.521 50 10 IJGE C=CCc1cc(CNC(=O)NN(Cc2ccccc2)c2ccccc2)cc(OC)c1OC 1221553982 ZHSRTAOQQRSCKU-UHFFFAOYSA-N 431.536 4.853 50 10 IJGE C=CCn1nc(C)c(-c2cc(C(=O)N3CCC[C@H](O[Si](C)(C)C(C)(C)C)C3)n[nH]2)c1C 1298994374 KEGYVDXWFRUEDA-SFHVURJKSA-N 443.668 4.702 50 10 IJGE C=C(C)COCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1457814372 WNQWLDFQKYTBOM-YBFXNURJSA-N 431.458 4.729 50 10 IJGE O=C(CSc1c(Cl)cccc1Cl)NNC(=O)Nc1cccc(C(F)(F)F)c1 1616048109 CKMDQVZFTPYSHS-UHFFFAOYSA-N 438.258 4.957 50 10 IJGE C/C(=C\C(=O)NNC(=O)CSc1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1 1618713957 NNNFCQXBVUGGKM-ZRDIBKRKSA-N 428.863 4.702 50 10 IJGE CC(=O)N1CCCc2cc(NC(=O)NNc3ccc(OCc4ccccc4)cc3)ccc21 1658878316 CVMYKLUFBCSZQO-UHFFFAOYSA-N 430.508 4.713 50 10 IJGE Cc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1ccc(Cl)cc1)C(C#N)=C(N)O2 1865682927 AYCMMIBUBLDZPW-LJQANCHMSA-N 429.282 4.904 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(Cl)c(Cl)c2)cc1 1865714336 HQMSJACNTNERHN-FQEVSTJZSA-N 441.318 4.773 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(O[C@@H]2COC3(CCCCC3)C2)C1 1879030684 VWCHYOOXPZJLPY-JXFKEZNVSA-N 432.399 4.659 50 10 IJGE CCN[C@@H](c1sc(Cl)cc1I)[C@H]1C[C@@H](Br)C1 1901028278 JOFBCJJODIZDTH-MATHAZKKSA-N 434.568 4.830 50 10 IJGE C[C@H]1CCN(Cc2c(Br)cccc2Br)C[C@@H]1Br 1945333884 WEOZQKCKLPMBID-ZANVPECISA-N 425.990 4.817 50 10 IJGE Cl[C@H]1C[C@@H](CNc2ncc(I)cc2Br)C12CCC2 2069527892 FLUSYVMSNDXYRF-KWQFWETISA-N 441.538 4.658 50 10 IJGE Oc1nc2cc([C@@H](Br)[C@H]3C[C@H](Br)C3)c(Br)cc2[nH]1 2076182529 SWRYNLQBSYOWIN-BVMVBECYSA-N 438.945 4.641 50 10 IJGE CC[C@H]1CN(Cc2cc(Cl)ccc2I)C[C@H]1CBr 2084891290 YJJKMSOTMNSFGC-CMPLNLGQSA-N 442.566 4.798 50 10 IJGE C[C@H]1CN(C(=O)CCCCBr)c2ccccc2CN1C(=O)OC(C)(C)C 2106772529 NTISNVBFBNFGSM-HNNXBMFYSA-N 425.367 4.724 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@H](C)[C@@H](NC(=O)C(F)(F)F)[C@H]1C 2106781013 DPEVQDHCVKLEQT-RRFJBIMHSA-N 429.365 4.745 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCCN(C[C@@H](CBr)c2ccccc2)C1 2106781071 FCWHHNPANBHLCW-IEBWSBKVSA-N 425.411 4.792 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@H]2CCCN(CC3(CBr)CCCCC3)C2)C1 2106788633 RHVXCCWTRLXICU-KRWDZBQOSA-N 429.443 4.911 50 10 IJGE CC[C@@H]1CN(C[C@H](CBr)c2ccccc2)CC[C@@H]1NC(=O)OC(C)(C)C 2106789512 YYOBWZFDBJYRKL-NEWSRXKRSA-N 425.411 4.790 50 10 IJGE CN(Cc1ccc(NC(=O)OC(C)(C)C)cc1)C(=O)[C@@H](Br)C1CCCC1 2110714161 ARJFYDVJQLNLOW-KRWDZBQOSA-N 425.367 4.946 50 10 IJGE O=C(c1cccc(OCc2ccccc2)c1)N1C[C@]2(F)CCC[C@]2(CBr)C1 2176642199 XHUNEAVMWJKWGN-FCHUYYIVSA-N 432.333 4.995 50 10 IJGE CCn1cc(Br)c([C@@H](Cl)c2cc(Br)c(OC)cc2F)n1 2202911215 BNTIOJSLRCDOSC-LBPRGKRZSA-N 426.511 4.904 50 10 IJGE COc1ccc([C@H](Br)C[C@H]2CC[C@H]2OC)cc1I 2257365215 PQCYGYOTVLFXAG-NQBHXWOUSA-N 425.104 4.551 50 10 IJGE COc1ccc([C@H](Br)CC[C@H]2CCCO2)cc1I 2257370144 ZSGYEXSEWSJUMQ-VXGBXAGGSA-N 425.104 4.695 50 10 IJGE CO[C@@H]1C[C@]2([C@@H](Br)Cc3cc(Br)cc(Br)c3)C[C@@H]12 2263525617 NZUWAWAFMZHAHD-RFQIPJPRSA-N 438.985 4.943 50 10 IJGE O=C(N[C@@]1(CCl)C[C@H]2CC[C@H]1C2)c1cc(Br)c(Br)s1 2268627721 YGMPDLDOQZSJDK-UVPNAGLESA-N 427.589 4.801 50 10 IJGE COc1ccc([C@H](Br)[C@H]2COC3(CCC3)C2)cc1I 2269555809 YYYNGMQSNHUNCB-RISCZKNCSA-N 437.115 4.695 50 10 IJGE C[C@H]1CC[C@H](CBr)CN1C(=O)c1cc(F)c(Br)cc1Cl 2282973914 FIRFQSMFJVFMHD-DTWKUNHWSA-N 427.539 4.877 50 10 IJGE C[C@H](Br)C1CCN(C(=O)c2cc(F)c(Br)cc2Cl)CC1 2282982627 LEDKQXJPHUZRDR-QMMMGPOBSA-N 427.539 4.877 50 10 IJGE COc1ccc(CNC(=O)[C@@H](Br)C2CCCC2)cc1NC(=O)OC(C)(C)C 2284168784 FIQCULWJXJRGKX-KRWDZBQOSA-N 441.366 4.612 50 10 IJGE CN(C[C@@]1(O)CCCN(CCCCCCCCCBr)C1)C(=O)OC(C)(C)C 2286319849 XJGRPCKVCQTXLU-NRFANRHFSA-N 449.474 4.806 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N(C[C@H](C)Br)CC(C)(C)C 2288055054 NOLZMUIFPRELIJ-VIFPVBQESA-N 447.258 4.639 50 10 IJGE CCCCN1C(=O)C(=Cc2ccc(-c3ccc(C(=O)OCC)cc3)o2)C(C)=C(C#N)C1=O 2314610664 KRZHYKFAXGCVSK-UHFFFAOYSA-N 432.476 4.516 50 10 IJGE Cl[C@H](CCc1ccc(I)c(Br)c1)CN1CCCC1 2325222643 LZWUVCNXVJSOIC-GFCCVEGCSA-N 442.566 4.690 50 10 IJGE Brc1ccc(CN2C[C@H]3CC[C@H]2[C@@H](Br)C3)c(Br)c1 2325465225 FZTHLBKCHHDIIS-HERUPUMHSA-N 438.001 4.959 50 10 IJGE C[C@@H]1C[C@H](CBr)CCN1Cc1cc(I)ccc1Cl 2327389324 LXNTVYFJRKUQFE-GHMZBOCLSA-N 442.566 4.940 50 10 IJGE COC[C@@]1(C)C[C@@]1(CBr)Cc1cc(I)ccc1Cl 2327405724 PJXFRPCTFVMPIO-ZIAGYGMSSA-N 443.550 4.925 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)C1(CCl)CCSCC1 2337229628 KERBIZVBJYUKCF-UHFFFAOYSA-N 430.182 4.881 50 10 IJGE O=C(c1ccc(Cl)cc1I)N(CCCl)Cc1cccs1 2365581293 DIKATVLJSCGWEM-UHFFFAOYSA-N 440.133 4.887 50 10 IJGE O=C(O)[C@H]1Nc2ccc(Cl)cc2[C@@H]2[C@H](Cl)[C@@H](Sc3ccccc3[N+](=O)[O-])C[C@H]12 8425371 FWTSKJIRYVHRKV-QUJYTELESA-N 439.320 4.999 50 10 IJGE CC[C@H](C)c1ccccc1OCC(=O)NNC(=O)[C@@H](C)Oc1ccc(-c2ccccc2)cc1 14038550 HFGTTWQNFRFWAZ-VQTJNVASSA-N 446.547 4.861 50 10 IJGE CCOc1cc(/C=C(\C#N)c2nc3ccccc3[nH]2)ccc1OCc1ccc(C(=O)O)o1 15013907 BMCGMJYOCVEJAB-LFIBNONCSA-N 429.432 4.896 50 10 IJGE COc1ccc(Br)cc1/C=C(/C#N)C(=O)Nc1sc2c(c1C#N)CCCC2 59116639 WRVVLVGWBIWTMT-JYRVWZFOSA-N 442.338 4.815 50 10 IJGE COc1cccc(C(=O)N/N=C/c2ccccc2OCc2cccc(Br)c2)c1 59445240 IYNCDWISSTXEOH-ZVHZXABRSA-N 439.309 4.801 50 10 IJGE CSC[C@@H](C)Cn1c(CCCl)nc2cc(I)c(F)cc21 97409282 CORNDTQCHROCTD-VIFPVBQESA-N 426.726 4.560 50 10 IJGE CC1=C(C#N)C(=O)N(CCc2ccccc2)C(=O)/C1=C/Nc1cccc(Cl)c1Cl 101233075 IMXYZSHSNOUECR-GHRIWEEISA-N 426.303 4.741 50 10 IJGE O=C(c1cc(C(F)(F)F)ccc1Br)N1CC[C@H](CCBr)C1 125080551 LZJQKOCYHDWHSG-VIFPVBQESA-N 429.074 4.715 50 10 IJGE CC[C@@H](CCBr)CNC(=O)c1cc(Br)sc1Br 233872161 WHTGXKMFZZUZOM-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE COc1ccc(C(=O)Oc2cccc(C=NNC(=O)Cc3cccc4ccccc34)c2)cc1 254353347 WLFBEGCFASOPHY-UHFFFAOYSA-N 438.483 4.760 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](c2cc(Br)cs2)[C@@H](CBr)C1 382700730 CKEJEEJCJFVVCC-GXSJLCMTSA-N 425.186 4.856 50 10 IJGE C[C@@H](CCBr)CCNCc1cc(Cl)ccc1I 405292783 ITBHXHVCTBMISJ-JTQLQIEISA-N 430.555 4.845 50 10 IJGE CC[C@@H](O[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1)C1CCC1 719658312 UFZDGUUHXFTUTN-CRAIPNDOSA-N 437.362 4.786 50 10 IJGE Cc1cccc(COc2ccc([C@H](C)NC(=O)NNC(=O)c3ccc(Cl)cc3)cc2)c1 727944350 NDNIODAAMFACDS-KRWDZBQOSA-N 437.927 4.933 50 10 IJGE CC(=O)N(C)c1cccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(F)cc3)c2C)c1 744771244 GXGSUIOPFXCCLR-DEDYPNTBSA-N 430.483 4.762 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N[C@H](c2cnn(C)c2)C(F)(F)F)c(C)n1C1CCCCC1 775145904 GMBNXBXDDDJDRC-PLMLNFJUSA-N 433.478 4.670 50 10 IJGE Cc1ccc(-c2ccc(C=NNC(=O)COc3cccc4ccccc34)o2)cc1C(=O)O 1083937416 XDIBDXOGWCFTNV-UHFFFAOYSA-N 428.444 4.636 50 10 IJGE C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@@H]3[C@@H]1CCC2=NNC(=O)c1ccc([N+](=O)[O-])cc1 1084242512 KEQULFQWPVKPAT-KXEAFHOWSA-N 433.508 4.943 50 10 IJGE CCOc1cc(C=NNC(=O)c2cccnc2)ccc1OCc1cccc2ccccc12 1084594245 UYYBKPWZGWAWCI-UHFFFAOYSA-N 425.488 4.976 50 10 IJGE C=CCN1CCC(NC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc4ccccc34)c2C)CC1 1136669994 XEEQHUAVXUVIJO-HKOYGPOVSA-N 438.575 4.921 50 10 IJGE Cn1cc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2)c2ccccc21 1865699426 UBMFMXJXJPJUOD-GOSISDBHSA-N 435.409 4.601 50 10 IJGE Cc1ccsc1[C@@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2Cc1cccc(F)c1 1865699599 XYHNURFAYKUGOA-CQSZACIVSA-N 434.418 4.677 50 10 IJGE Cc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699657 ZFGAUYCPFXZYPD-QFIPXVFZSA-N 429.911 4.603 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)c1ccc(-n2cccc2)cc1 1865755853 TXSCAQJFGIAMHX-UHFFFAOYSA-N 430.895 4.576 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc(-c3ccc(Cl)cc3)nc2C)cc(OC)c1OC 1865762072 LRJYIHCFJPGKOX-MXAYSNPKSA-N 439.899 4.500 50 10 IJGE N#C/C(=C\c1ccc(Br)cc1)C(=O)NCC1(c2ccc(F)c(F)c2F)CC1 1866128755 KFZWLKDBDIQOIU-UKTHLTGXSA-N 435.243 4.621 50 10 IJGE CN(NC1CCC([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1)C(=O)OCc1ccccc1 1893745556 LHGFBRJIUVCATF-NYLDSWQDSA-N 431.577 4.575 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@@]2(CCC[C@@H]2Cl)C1 1918907782 HNZHUDAXOAPHIM-GWCFXTLKSA-N 427.589 4.897 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]1CC1(CC[C@](C)(CI)O1)C2 1922293982 SNYPGUZDDGLVMS-GRDNDAEWSA-N 435.346 4.681 50 10 IJGE BrC[C@@H]1CN(Cc2c(Br)cccc2Br)CCS1 1945332303 BDDTXCMJAUMEEM-SECBINFHSA-N 444.030 4.524 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]([C@]2(C)CC[C@@](C)(CI)O2)CC1 1993736341 WAQQOMDDQRBYFY-DACLVMHWSA-N 437.362 4.833 50 10 IJGE Brc1cccc(CN2C[C@H]3C[C@H](Br)C[C@H]2C3)c1Br 2031484950 FLBCNXROGHXEQD-ZMLRMANQSA-N 438.001 4.959 50 10 IJGE F[C@@]1(CBr)CCCN(Cc2c(Br)cccc2Br)C1 2039797621 XFHONCJFMMSCCF-CYBMUJFWSA-N 443.980 4.911 50 10 IJGE Cc1ccc(C)c(NC(=O)C(C#N)=C2SCC(=O)N2c2ccccc2C(F)(F)F)c1 2040489841 QGHPQVNHOULNPN-UHFFFAOYSA-N 431.439 4.776 50 10 IJGE CCCC(CBr)(CCC)CN=[S@@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C 2044700048 PEVPUJDDSROZHR-MQNRADLISA-N 441.476 4.979 50 10 IJGE CC(F)(F)C[C@H](CCl)NC(=O)c1scc(Br)c1Br 2050363984 GTSYJPBCJXAGAQ-RXMQYKEDSA-N 425.520 4.656 50 10 IJGE C[C@]12CN(Cc3cc(Br)ccc3Br)C[C@@]1(CBr)C2 2054721104 BRDGWOJDGKKNIJ-KBPBESRZSA-N 438.001 4.819 50 10 IJGE O=C(CBr)c1cc(OC(F)(F)F)c(Br)cc1Br 2054922561 MAKHDXPIVCJZDN-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE C[C@@](CI)(OC1CC(CF)C1)c1ccccc1Br 2055632877 HAADCIYGKWGJLA-MGULZYLOSA-N 427.095 4.864 50 10 IJGE CCC[C@H](CCCl)NC(=O)c1ccc(Br)cc1I 2086154331 SMYOLVKVPKGJCK-SNVBAGLBSA-N 444.538 4.581 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@@H](Cl)CC2(CCC2)C1 2094999028 GQQRMRFXDJLJLE-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE C[C@H]1CN(C[C@H](CBr)c2ccccc2)C[C@@H](C)CN1C(=O)OC(C)(C)C 2106786907 HCEVZFPOISWKEQ-AOIWGVFYSA-N 425.411 4.742 50 10 IJGE Fc1ccc2nc(CCCl)n([C@]34C[C@@H]3CN(Cc3ccccc3)C4)c2c1Br 2155870769 BYDMDNUPGNTXIO-VFNWGFHPSA-N 448.767 4.950 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(C[C@@H](CBr)c3ccccc3)C[C@H]21 2163062171 KFICIVNFKTUHGZ-UAFMIMERSA-N 437.422 4.790 50 10 IJGE COc1cc(Br)c([C@H](Cl)[C@H]2C[C@@H](Br)C2)c(OC)c1OC 2196897057 UWHCBVJUXGVJPD-RGNHYFCHSA-N 428.548 4.928 50 10 IJGE Br[C@H]1CCCCCC[C@@H]1OCCOCCOCCOCc1ccccc1 2227779685 OQCBGBOPWXMBET-SFTDATJTSA-N 429.395 4.739 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CC(F)(F)CN1CC1(CBr)CCCCC1 2264250710 NRJSAUQKOQIHOV-CQSZACIVSA-N 425.358 4.566 50 10 IJGE CCn1c(SCC(=O)NN=CC=Cc2ccccc2)nnc1-c1ccc(Cl)cc1 2293716025 AXENGTBDBYBXST-UHFFFAOYSA-N 425.945 4.526 50 10 IJGE Cc1ccc(CBr)cc1NS(=O)(=O)c1cc(C)c(Br)s1 2296213624 HPDRHJNLZGCPJR-UHFFFAOYSA-N 439.194 4.823 50 10 IJGE Fc1cccc(CBr)c1OCc1sccc1I 2301068465 LQFWSBZSHIVZSA-UHFFFAOYSA-N 427.076 4.966 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)[C@H](CBr)CC1CC1 2315548734 KDPVEEJJWUXGQA-LBPRGKRZSA-N 442.566 4.940 50 10 IJGE C[C@H](NC(=O)C(C#N)=CNc1ccccc1Br)C12CC3CC(CC(C3)C1)C2 2324904480 RDVXKXXMKZACSS-HIGJEIRPSA-N 428.374 4.990 50 10 IJGE CC1(C)C[C@@H](CBr)N(Cc2cc(I)ccc2Cl)C1 2327390847 IQKXSPSXLDAGDE-LBPRGKRZSA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)N[C@@]12CCC(F)(F)C[C@H]1CN(CCCCCCBr)C2 2344057611 XBCPHWWWMKFEEB-MAUKXSAKSA-N 439.385 4.956 50 10 IJGE CC1(C)C[C@@H](Cl)C[C@H](NC(=O)c2ccc(Cl)cc2I)C1 2365587815 BNVIHRNMAREKCZ-QWRGUYRKSA-N 426.125 4.861 50 10 IJGE CCN(c1ncnc(NNC(=O)c2cccc(Cl)c2)c1N)c1cccc2ccccc12 40702061 DUQUDNWUQPIVJV-UHFFFAOYSA-N 432.915 4.780 50 10 IJGE CCN1C(=O)C(C#N)=C(C)/C(=C\c2cn(-c3ccccc3)nc2-c2cc(C)ccc2C)C1=O 101332466 FSFRCEPGIOWLCZ-OEAKJJBVSA-N 436.515 4.768 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CI)[C@@H](c2ccc(Cl)s2)C1 394734211 RSWITXXPCVWLDS-ZJUUUORDSA-N 427.735 4.787 50 10 IJGE O=C(c1cc(Br)ccc1Cl)N1CCC(F)(F)[C@@H](CBr)C1 403969422 MNMONYDYDBJKDW-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE O=C(c1ccc(Br)cc1Cl)N1CCC(F)(F)[C@@H](CBr)C1 404023348 ZQFJGMXDULCWLN-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1ccccc1SCc1ccccc1 755536847 UVAUCDXGCZRAIN-UHFFFAOYSA-N 428.517 4.994 50 10 IJGE CC(C)c1ccc(-c2noc(CCC(=O)Oc3ccc([N+](=O)[O-])c4ncccc34)n2)cc1 1320465554 GMCAVGCBSSGZDP-UHFFFAOYSA-N 432.436 4.855 50 10 IJGE C#CC[C@@H](CCOC)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1587382701 LPKFYELHIPEWAN-FNGUVFISSA-N 443.469 4.565 50 10 IJGE C#C[C@@H](NC(=O)NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1)c1ccccc1 1686919601 IWYAXTZUIJFPDV-XMMPIXPASA-N 447.560 4.643 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@@H]1c1ccccc1F 1865684495 ZGBOSUOFOOOEQK-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccccc2)c1 1865690205 LFVPVZYKDPENAE-SFHVURJKSA-N 440.425 4.567 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CCC)cc1 1865694680 ZCYFBVFQZVVSJL-JOCHJYFZSA-N 444.535 4.976 50 10 IJGE CCOC(=O)c1cc(CC)sc1NC(=O)/C(C#N)=C/c1cccc(Br)c1 1866131608 DREYSKHPNZJYCH-MDWZMJQESA-N 433.327 4.795 50 10 IJGE O=S(=O)(c1cccc(CBr)c1)N(Cc1ccccc1)Cc1ccccc1 1880809026 FQAJGBLBDZDXRO-UHFFFAOYSA-N 430.367 4.973 50 10 IJGE C[C@H](c1ccc(F)cc1Br)[C@H](CBr)NC(=O)OC(C)(C)C 1885095654 CPUPHWLPTCEMSQ-RNCFNFMXSA-N 425.136 4.980 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)c1ncc(Cl)cc1Br 1916350320 YZKWFNKPOSZMRL-ZDUSSCGKSA-N 448.586 4.914 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21 1917525363 JQQMZYNWIUUJHY-BAUSPSPZSA-N 445.138 4.954 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@]2(CCC[C@@H]2Cl)C1 1918918066 XCZAYEXQMLASNA-TVQRCGJNSA-N 427.589 4.897 50 10 IJGE O=C(N[C@@H](CBr)CC1CC1)c1cc(Br)c(Br)s1 1942806082 RJDOUBNCTQLYEB-SSDOTTSWSA-N 446.002 4.567 50 10 IJGE O=C(N[C@H](CCBr)C1CC1)c1csc(Br)c1Br 1945188988 GFUYKLAXJPPPQP-MRVPVSSYSA-N 446.002 4.567 50 10 IJGE ICC1(OCCOCCOCc2ccccc2)CCCCCC1 1983391698 WONVMLYYLULRED-UHFFFAOYSA-N 432.342 4.764 50 10 IJGE C[C@@H]1CC[C@@H](CBr)N(c2ncc(Br)cc2Br)C1 2001930022 RAVYQUHCTIPMGV-SCZZXKLOSA-N 426.978 4.606 50 10 IJGE Cc1ccccc1[C@@H](CI)OCCOCCOCc1ccccc1 2007814077 IWIUZGKIHGTKCQ-HXUWFJFHSA-N 440.321 4.721 50 10 IJGE CC(C)[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(CCBr)s1 2009640347 PJYXVEPENJDHMM-HNNXBMFYSA-N 430.433 4.921 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc([S@@](C)(=O)=NC[C@@H](CBr)C2CC2)cc1 2044703531 VNYSQIPHVBBCOL-DLUDVSRJSA-N 431.396 4.911 50 10 IJGE Brc1ccc([C@H](CI)OCCOC2CCCC2)cc1 2087345193 WBDPMTOVDKQBFX-HNNXBMFYSA-N 439.131 4.901 50 10 IJGE FC(F)(F)[C@@H]1C[C@@H]1[C@@H](Br)c1cc(I)cc2c1OCC2 2100660418 SAIOROCHQLZHKD-JMJZKYOTSA-N 447.032 4.861 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)C1CCN(C[C@H](CBr)c2ccccc2)CC1 2106789552 ZGHFCVOKVZQGNY-LPHOPBHVSA-N 425.411 4.790 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)[C@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2162915120 JDWLGMJQPVJDDT-ROUUACIJSA-N 439.394 4.737 50 10 IJGE C[C@H]1CN(C(=O)OC(C)(C)C)c2ccccc2N1C(=O)N1CCC(Br)CC1 2163054139 UUBWNIYKQPHKBE-AWEZNQCLSA-N 438.366 4.616 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@]2(CCCN(C[C@H](CBr)c3ccccc3)C2)C1 2163324579 HPBZFSRDRXZHOG-SIKLNZKXSA-N 437.422 4.888 50 10 IJGE CCCc1nc([C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)nc(O)c1CBr 2187324274 HIXCQYLFWHQTFB-BCDXTJNWSA-N 430.390 4.940 50 10 IJGE CC(C)CNCc1cc(Br)c(OC[C@H]2C[C@H]2Cl)c(Br)c1 2196896952 TUBQKIGXPROQSQ-BXUZGUMPSA-N 425.592 4.963 50 10 IJGE C[C@@]1(CCOCc2ccccc2)CCN1S(=O)(=O)c1ccc(Cl)c(CCl)c1 2197756828 XYPZVAWMWHTTOG-FQEVSTJZSA-N 428.381 4.839 50 10 IJGE BrC[C@]12CCC[C@@H]1N(C[C@H]1CC1(Br)Br)CCC2 2213093255 YSMAEBBLLOSYPH-GRYCIOLGSA-N 430.022 4.522 50 10 IJGE CC1CC(CBr)(CN2CCC[C@]3(CCCN(C(=O)OC(C)(C)C)C3)C2)C1 2265312156 PQKNISAOHFVSPT-SGDIKTSBSA-N 429.443 4.911 50 10 IJGE CC1CC(CBr)(CN2CCC([C@@H]3CCCN3C(=O)OC(C)(C)C)CC2)C1 2265312519 VGKYILDEDYNFKT-JGCRXCKMSA-N 429.443 4.909 50 10 IJGE CN(CC[C@H](NC(=O)[C@@H](Br)C1CCCC1)C(C)(C)C)C(=O)OC(C)(C)C 2278545745 JXDFYJDCFMZTKE-HOTGVXAUSA-N 433.431 4.728 50 10 IJGE Cc1ccc(CBr)cc1NS(=O)(=O)c1cc(Br)cs1 2278708818 YEEPYCIAHPTQFG-UHFFFAOYSA-N 425.167 4.515 50 10 IJGE CN(Cc1cccc(I)c1)C[C@@H](CBr)c1ccccc1 2280346743 HJIVJOUEIAWGAI-MRXNPFEDSA-N 444.154 4.902 50 10 IJGE C[C@]1(CBr)CCCN1Cc1ccc(Cl)cc1I 2302308518 BCUYUMGYSIVHTE-CYBMUJFWSA-N 428.539 4.694 50 10 IJGE Clc1ccc(CN(CCCBr)C2CC2)c(I)c1 2302327513 ZUZZLNVDODPOIY-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE CNC(=O)C(C#N)=Cc1cn(-c2ccccc2)nc1-c1cccc(OCc2ccccc2)c1 2314478928 XGMVMXSEWCJSNM-UHFFFAOYSA-N 434.499 4.771 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)cc2I)C[C@@]1(C)CBr 2318529750 UQOAPXOCYHPJES-IINYFYTJSA-N 442.566 4.798 50 10 IJGE N#CC(=CNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)NCCc1ccc(O)cc1 2324504849 JLAODFGWWQTEDB-UHFFFAOYSA-N 443.347 4.608 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2CC[C@H]1[C@@H](Br)C2 2327409184 KXJYALVJLPBZDF-WFBYXXMGSA-N 440.550 4.692 50 10 IJGE COc1cc(F)c(F)cc1[C@H](Cl)c1c(Br)c(Br)nn1C 2364235492 PIAMGCVUEMDKJC-JTQLQIEISA-N 430.474 4.560 50 10 IJGE FC(F)(F)c1ccc(CBr)c(N2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)n1 2369831646 NNJHNFDNCKVUEE-RDJZCZTQSA-N 440.307 4.706 50 10 IJGE CC[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)[C@H](C)Oc1ccc(C)c(C)c1 10153429 BVNMDCCBNMCPOC-NBGIEHNGSA-N 446.547 4.743 50 10 IJGE CC(C)C[C@@H](CBr)NC(=O)c1cc(Br)c(Br)s1 122675405 CWTQTHMCVIMHCR-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE COc1ccc(C(=O)Oc2ccc3ccccc3c2C=NNC(=O)c2ccc(F)cc2)cc1 254667967 KCSSHSQMRYBNSM-UHFFFAOYSA-N 442.446 4.971 50 10 IJGE COc1ccc(C(C)=NNC(=O)CCC(=O)N(c2ccccc2)c2ccccc2)cc1OC 254701031 GILZHZRTEOUWHY-UHFFFAOYSA-N 445.519 4.689 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1C1[C@@H]2CN(Cc3ccccc3)C[C@@H]12 398463438 SWMTVGLIFZDZEM-APHBMKBZSA-N 431.765 4.797 50 10 IJGE COC[C@@H](O[C@](C)(CI)c1ccccc1Br)C(C)C 404098615 BZUFXQQAPCXFEG-HUUCEWRRSA-N 441.147 4.787 50 10 IJGE CN(C[C@H]1CCCN(Cc2ccccc2)C1)c1cc(CBr)sc1[N+](=O)[O-] 720017456 WAVQCURJDXMAKI-MRXNPFEDSA-N 438.391 4.900 50 10 IJGE Cc1sc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(F)cc3)c2C)c(C(N)=O)c1C 728168183 BRHCLZAEBKHIDY-YVLHZVERSA-N 436.512 4.556 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N(C)[C@H](c2ccccc2)C(F)(F)F)c1C 728499467 UOIWQIAXRAZKHC-OKOPUSGGSA-N 433.474 4.981 50 10 IJGE CCCOc1ccccc1Oc1ncccc1CNC(=O)NNc1cccc(F)c1F 745654397 DJSVERHDFOCPCS-UHFFFAOYSA-N 428.439 4.767 50 10 IJGE Cc1csc(COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)n1 748800476 CQQFBHFIGMJIHI-CXUHLZMHSA-N 437.912 4.532 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1ccc(C(F)(F)F)cc1 749807615 OSGVPTGSDWATGG-LJQANCHMSA-N 442.441 4.905 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=S)Nc3ccc(Cl)c(Cl)c3)n[nH]2)cc1C 764506104 UTPVXSOBRCXUBP-UHFFFAOYSA-N 434.352 4.632 50 10 IJGE C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799754207 HDMXHHKZVGWPTE-CQSZACIVSA-N 440.425 4.878 50 10 IJGE Cc1ccc(-n2c(C)c(Br)c(C=NNC(=O)c3ccccc3O)c2C)cc1C 1084584672 TTXBINHPPXOEKM-UHFFFAOYSA-N 440.341 4.943 50 10 IJGE C=C(C)COc1cccc(NC(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)c1 1562324024 COTWMQUAJMOIGM-UHFFFAOYSA-N 425.485 4.976 50 10 IJGE COc1ccc(/C(C#N)=C/c2ccc(OC(=O)Cc3ccccc3)c(OC)c2)cc1OC 1615066065 KETVEHONOSATIQ-FYJGNVAPSA-N 429.472 4.925 50 10 IJGE O=C(N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21)c1ccc2cc[nH]c2c1 1860822559 GBILQPYOSOXZTK-QYQHSDTDSA-N 428.879 4.502 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccc(C)cc2)cc1 1865693652 LKDOBCAIRGUKIA-HSZRJFAPSA-N 428.536 4.809 50 10 IJGE CC(C)C[C@@H](CNC(=O)OC(C)(C)C)C[C@@H](CBr)NC(=O)OC(C)(C)C 1880731267 ZMQLZBNXJMVEKL-CABCVRRESA-N 437.419 4.852 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)C1 1882085888 XCFHIJWDSLCXJM-ARFHVFGLSA-N 449.430 4.996 50 10 IJGE O=S(=O)(c1ccccc1Cl)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915165657 NGKREXMXVQNADR-KRWDZBQOSA-N 428.779 4.704 50 10 IJGE CC(C)[C@@H](CBr)N(CCn1cc(Br)cn1)Cc1ccccc1 1915288616 LNYMGIGSEHOBJW-QGZVFWFLSA-N 429.200 4.567 50 10 IJGE CC(C)N(CCCBr)C(=O)c1csc(Br)c1Br 1945184107 VMHAOULRGZWMQI-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]2(CCC[C@@H](CI)O2)C12CCCCC2 1989552953 QLGIUJYKPDFTHU-KSSFIOAISA-N 435.346 4.683 50 10 IJGE C[C@H]1CN(Cc2ccc(CBr)cc2)C[C@H](C)N1C(=O)OCc1ccccc1 2011641015 MWVJBFKXXQHUFR-ROUUACIJSA-N 431.374 4.813 50 10 IJGE CCC[C@H](Cl)CCNC(=O)c1cc(Br)ccc1I 2029923387 PODURYFFZVDKRF-JTQLQIEISA-N 444.538 4.581 50 10 IJGE O=C(NCC1(CCBr)CC1)c1c(Br)cccc1Br 2033096041 WBVRBWUCPBVULO-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE Cc1cc(C(=O)N[C@H](C)CCCCCI)sc1Br 2054162160 PPMBLAVSJGLIII-SNVBAGLBSA-N 444.176 4.933 50 10 IJGE O=C(CCl)c1cc(OC(F)(F)F)cc(I)c1C(F)(F)F 2055162104 HYUWVQZWYWTMNP-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE C[C@]1(CBr)CCCN(Cc2ccc(I)c(Cl)c2)C1 2086658089 KJDGJTSFESJHHS-CQSZACIVSA-N 442.566 4.942 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@H]2CCC[C@]2(CCl)C1 2103175389 IWVNXWSKGWXPBK-OQPBUACISA-N 427.589 4.754 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@H]1CCC[C@H]1CNC(=O)OC(C)(C)C 2106786236 SYUHZSHASIKCQD-FHWLQOOXSA-N 425.411 4.790 50 10 IJGE CCC[C@H](CBr)CN1CC[C@@H](C(F)(F)F)C[C@H]1CNC(=O)OC(C)(C)C 2107588408 XNSHMICMHMUASF-KFWWJZLASA-N 445.364 4.965 50 10 IJGE Clc1ccc(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c(CBr)c1 2129059169 YJQLHRCYMCVORV-RTWAWAEBSA-N 435.793 4.715 50 10 IJGE Fc1cccc(CBr)c1N1CCN(Cc2ccccc2)C[C@H]1C(F)(F)F 2130160444 VMXAUHODEHNNOH-KRWDZBQOSA-N 431.271 4.974 50 10 IJGE Cc1cc(C(=O)N2C[C@]3(F)CCC[C@@]3(CBr)C2)sc1Br 2176631315 YARSXAMYEPLOAB-ZIAGYGMSSA-N 425.161 4.548 50 10 IJGE F[C@@H]1COCC[C@@H]1n1c(CCl)nc2cc(Br)c(Br)cc21 2234073220 JEGSJHGWRRJIIF-KOLCDFICSA-N 426.511 4.600 50 10 IJGE N#CC(=CNCc1ccc(Br)cc1)C(=O)Nc1ccc(Cl)c(Cl)c1 2318455417 SWPHWGIMYRUMSX-UHFFFAOYSA-N 425.113 4.892 50 10 IJGE Clc1ccc(CN2C[C@@H](Br)[C@H](C3CC3)C2)c(I)c1 2318557926 POEJYIUZSMLGGP-QWHCGFSZSA-N 440.550 4.550 50 10 IJGE COc1ccc(CC(=O)Oc2ccc(C=C(C#N)c3ccc(OC)c(OC)c3)cc2)cc1 2320507301 NBSUUWSIWCHFRI-UHFFFAOYSA-N 429.472 4.925 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)C(C#N)=CNC(c1ccccc1)c1ccccc1 2324428854 XTAOMNAMKDHIBF-UHFFFAOYSA-N 425.488 4.588 50 10 IJGE C[C@@H](NC=C(C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C12CC3CC(CC(C3)C1)C2 2325254921 DZEUOLRPNLNNKE-ZHHULCEESA-N 428.920 4.789 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@H]2C[C@@H](Cl)CC[C@H]21 2328781522 WTQBECOTSTZUCA-OYNCUSHFSA-N 427.589 4.895 50 10 IJGE CN(c1ncc(Br)c(CCl)n1)[C@H]1C[C@@H]2C[C@@H](OCc3ccccc3)C[C@H]12 2332005718 WAOQWTYQAWOLND-RCJHGTSTSA-N 436.781 4.798 50 10 IJGE C=CCOc1ccc(Br)cc1/C=N/NC(=O)COc1cc(C(C)C)ccc1C 20395757 UJOVPWBTDMPKKV-ZMOGYAJESA-N 445.357 4.975 50 10 IJGE C/C(=N/NC(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1ccc(Br)cc1 33715105 LYJIRVHLNCYOHT-MYYYXRDXSA-N 436.309 4.855 50 10 IJGE COc1cccc(-c2nn(-c3ccccc3)cc2/C=C(/C#N)S(=O)(=O)c2ccccc2)c1 35446356 WZACNXKIFOTQQA-JLPGSUDCSA-N 441.512 4.886 50 10 IJGE O=C1CCc2cc([C@@H](Br)c3csc(I)c3)ccc2N1 124413347 OOCKROYOYUPXFM-CQSZACIVSA-N 448.123 4.722 50 10 IJGE Cc1sc([C@H](Br)c2c(Br)cnn2C)cc1Br 693047021 INFHJRHCUUSLMV-VIFPVBQESA-N 428.975 4.799 50 10 IJGE Cn1ncc(Br)c1[C@H](Br)c1cc(F)c(Br)cc1F 693060272 DBFNWORULWQGNE-SNVBAGLBSA-N 444.899 4.708 50 10 IJGE O=C(NNc1ccc(Br)cc1Cl)c1cccc(OCc2cscn2)c1 733806905 KOTIMYASDFOSEM-UHFFFAOYSA-N 438.734 4.895 50 10 IJGE C#C[C@H](NC(=O)NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1)c1ccccc1 1686919600 IWYAXTZUIJFPDV-DEOSSOPVSA-N 447.560 4.643 50 10 IJGE CC(=O)[C@@H](Br)c1ccc(I)c(SC(F)(F)F)c1 1848425826 FNJGEDFGJFFYRD-SECBINFHSA-N 439.034 4.928 50 10 IJGE CCCc1nn(-c2ccccn2)c2c1[C@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 1865686746 ZNJGBYYJKMQUHW-KRWDZBQOSA-N 426.307 4.745 50 10 IJGE Cc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865705367 TYAZGPZFFLFLFG-QFIPXVFZSA-N 434.927 4.899 50 10 IJGE COc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(Cl)c(Cl)c2)c1 1865711918 LLGFVVJGFACLMF-FQEVSTJZSA-N 441.318 4.773 50 10 IJGE Cc1nc(-c2ccc(F)cc2)ccc1C(=O)NNC(=O)[C@@H](C)Oc1ccc(C(C)C)cc1 1865758109 JKMJKYFFACSXPC-QGZVFWFLSA-N 435.499 4.548 50 10 IJGE Cc1nn(C)c(CN(Cc2ccccc2)C2(CBr)CCC2)c1Br 1915792184 VGQTZNPOMPRHRG-UHFFFAOYSA-N 441.211 4.811 50 10 IJGE CN(Cc1cc(Br)cs1)C[C@H](Br)COCc1ccccc1 1916348378 NOQZMMXPDLPYQK-HNNXBMFYSA-N 433.209 4.923 50 10 IJGE BrC[C@H]1CCCN(Cc2ccc(Br)cc2Br)C1 1943851890 UGQVFBZKLKFJOP-SNVBAGLBSA-N 425.990 4.819 50 10 IJGE FC(F)(F)[C@@H](CBr)NCc1cccc(Br)c1Br 1943883991 NIZQFMNNBWJVLN-MRVPVSSYSA-N 439.895 4.627 50 10 IJGE CC1(C)CN(Cc2cc(Cl)ccc2I)[C@@H]1CBr 1944098275 WXTIUCIUNOCPCC-GFCCVEGCSA-N 428.539 4.550 50 10 IJGE C[C@@]1([C@@H](Br)c2cc(Br)c(Br)s2)COCCO1 1992637611 CKXIMGUCUDONQA-WPRPVWTQSA-N 434.975 4.515 50 10 IJGE Fc1cccc(C[C@H](Br)c2cc(I)sn2)c1F 2007642461 BSFYCPBHJKZNQK-ZETCQYMHSA-N 430.055 4.705 50 10 IJGE BrC[C@@H]1C[C@@H]2CN(Cc3c(Br)cccc3Br)C[C@@H]21 2053980539 HKCQCAJBTUVTJR-HBNTYKKESA-N 438.001 4.674 50 10 IJGE BrC[C@H]1CN(Cc2ccc(I)cc2)CCC12CCC2 2095293025 ABMOWNHJSCCINN-AWEZNQCLSA-N 434.159 4.678 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CCN(C[C@@H](CBr)c2ccccc2)C1(C)C 2106887513 CJEKOUXNNSZUSI-QZTJIDSGSA-N 425.411 4.790 50 10 IJGE BrC[C@@]12CCCC[C@@H]1N(c1ccc(I)cn1)CCC2 2108957430 ZIWWOFXIICITLK-ZFWWWQNUSA-N 435.147 4.610 50 10 IJGE CC(C)(C)OC(=O)N1CCO[C@@H]2CCN(CCCCCCCCCBr)C[C@@H]21 2163064504 UUKSCLHJPBZZPL-RBUKOAKNSA-N 447.458 4.822 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2cc(Cl)ccc2I)C[C@H]1CCl 2163290393 XTZFSSRYSOXXGS-KOLCDFICSA-N 438.058 4.794 50 10 IJGE CC(C)(C)OC(=O)N1CCCN(CCCCI)c2ccccc21 2243588428 CNBOKADPYNQHLD-UHFFFAOYSA-N 430.330 4.853 50 10 IJGE O=C(N[C@]1(CBr)C[C@H]2CC[C@H]1C2)c1cc(Br)c(Cl)s1 2268623859 PMCWBTXQFWZGPT-UPFKWVMWSA-N 427.589 4.848 50 10 IJGE Cc1ccc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)c(CBr)n1 2287030543 JOHCSSOHEYYGNN-JBPLPALLSA-N 426.402 4.632 50 10 IJGE COc1ccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3ccc(NC(C)=O)cc3)c2C)cc1 2294149868 PPWSZVCMPQJCGZ-UHFFFAOYSA-N 428.492 4.607 50 10 IJGE C[P@]1(=O)C[C@H](Cl)[C@H](Cc2ccc(I)c(Br)c2)C1 2306223937 LBEHZVHGRLASRW-MIHTYCSTSA-N 447.478 4.826 50 10 IJGE COC[C@@H]1C[C@H](Br)[C@H](Cc2ccc(Cl)c(I)c2)C1 2315549933 XTRQMJAAJHLVDG-TUAOUCFPSA-N 443.550 4.923 50 10 IJGE BrC[C@]12CCCC[C@H]1CN(Cc1sccc1I)C2 2316760761 XVXCKBPGEICPBH-FZMZJTMJSA-N 440.188 4.740 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NN=Cc3cn(C)c4ccc(OC)cc34)c(C)n2)cc1 2321242240 CNCGBOAEHJQMLG-UHFFFAOYSA-N 426.520 4.884 50 10 IJGE C[C@@H](NC=C(C#N)C(=O)Nc1ccc(Br)cc1)C12CC3CC(CC(C3)C1)C2 2324082626 VZOQWTUJJRQFLM-XSXQVXRUSA-N 428.374 4.990 50 10 IJGE N#CC(=CNC[C@H]1COc2ccccc2O1)C(=O)NC1CCCCCCCCCCC1 2325486027 ZYHBMZODJOQESY-QFIPXVFZSA-N 425.573 4.613 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](CC(F)(F)F)C1 2353826449 MTFXUUCGOBTUPY-GJZGRUSLSA-N 445.364 4.917 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@@](C)(F)[C@](C)(Br)C2)c1 2365819767 SDUOLLNLNJQELG-ZIAGYGMSSA-N 429.555 4.945 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)[C@@]1(C(=O)O)CCC(C)(C)C[C@H]1OCc1ccccc1 2379102707 QPUWQBALYRUTLC-YXTQBTIXSA-N 438.406 4.711 50 10 IJGE C=CCOc1ccc(C(=O)NNC(=O)[C@H](CC)Oc2ccc(-c3ccccc3)cc2)cc1 14768908 HPOZBYWUKYRHTO-DEOSSOPVSA-N 430.504 4.537 50 10 IJGE CN(C)c1ccc(N2C(=O)CS[C@H]2c2ccc(NC(=O)C(C)(C)CCl)cc2)cc1 35928425 ILIHQWOEWAHIPS-FQEVSTJZSA-N 431.989 4.735 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccnc2)CCC3)cc1Cl 40814124 VXMHLNYAVUWXLE-OVVQPSECSA-N 436.899 4.668 50 10 IJGE Cc1c(C(=O)NC(C)C)oc2c1/C(=N/NC(=O)c1ccc(-c3ccccc3)cc1)CCC2 40822656 WXJOIQAEITXGDU-SGWCAAJKSA-N 429.520 4.864 50 10 IJGE CCn1c(SCCCC(=O)N/N=C/c2cccc(Br)c2)nc2ccccc21 58987038 XZJFNWJVZRHVNA-HYARGMPZSA-N 445.386 4.841 50 10 IJGE Br[C@@H](c1cnn(-c2ccccc2)c1)c1ccccc1I 109864496 REWYYYQZOUVYNM-INIZCTEOSA-N 439.094 4.961 50 10 IJGE COc1cc(/C=N\NC(=O)c2c(C)ccc3ccccc23)cc(Br)c1OC 169921734 JYUNDHAMAVGOAQ-FMCGGJTJSA-N 427.298 4.692 50 10 IJGE Cc1ccc2nc(-c3ccc(N/C=C(/C#N)C(=O)N4C[C@H](C)O[C@@H](C)C4)cc3)sc2c1 217196865 QEULCJZEPLBXKE-QCHSQVKSSA-N 432.549 4.727 50 10 IJGE CCC(CC)[C@@H](Br)CNS(=O)(=O)c1ccc(Cl)c(Br)c1 230664748 CHYXMXSSLCPWQB-LBPRGKRZSA-N 447.620 4.581 50 10 IJGE CC(=NNC(=O)c1ccco1)c1ccc(NC(=O)[C@@H](C)Oc2ccc(C)cc2Cl)cc1 252636492 XIYVPRKDFRPREQ-MRXNPFEDSA-N 439.899 4.801 50 10 IJGE CC(C)c1ccc(C=NNC(=O)c2ccc(CN(c3ccccc3)S(C)(=O)=O)cc2)cc1 254522122 VLXWIPXOYGPHAW-UHFFFAOYSA-N 449.576 4.540 50 10 IJGE CC(=O)[C@@H](Br)[C@@H](C)c1ccc(Br)c(I)c1 300904556 NERALXQNAKNEJQ-KGFZYKRKSA-N 445.920 4.510 50 10 IJGE CC(C)(C)N(CCBr)C(=O)c1cc(Br)c(Br)s1 691099111 RVXWDLDGLZMBGF-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE CC(=NNC(=O)c1cccc(C(F)(F)F)c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 729934456 QSDCLROGJFBWIT-UHFFFAOYSA-N 438.471 4.576 50 10 IJGE CCCOc1ccccc1[C@H](CC(C)C)NC(=O)NNC(=O)c1cn(C)c2ccccc12 746427311 VYDPYKKUMWFGSU-NRFANRHFSA-N 436.556 4.699 50 10 IJGE Cn1c(=O)ccc2ccc(NC(=O)C(=O)Nc3cccc(S(F)(F)(F)(F)F)c3)cc21 787589923 JXBJSJBVQVIOFV-UHFFFAOYSA-N 447.385 4.773 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)Nc2cc(C)nn2-c2ccccc2C)c1C 788100593 KKVUOJFYGFPKFK-MEGCXXLRSA-N 431.540 4.661 50 10 IJGE O=C(NN=C1C(=O)N(C(c2ccccc2)c2ccccc2)c2ccccc21)c1ccc(O)cc1 1083912928 OTSNFFFMMXJKFG-UHFFFAOYSA-N 447.494 4.663 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@H]1c1ccccc1 1865680192 BIGADOCIFPOWPZ-INIZCTEOSA-N 430.817 4.822 50 10 IJGE CCCOc1ccc(-c2csc(/C(C#N)=C(\O)CN3C(=O)c4ccccc4C3=O)n2)cc1 1872749426 QSGUOCXMVPJYIX-VZCXRCSSSA-N 445.500 4.688 50 10 IJGE BrC[C@H]1CCCN(Cc2cccc(Br)c2Br)C1 1943880439 FGMBKLRXHHZWIK-SNVBAGLBSA-N 425.990 4.819 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC[C@H]1C[C@@H]1C1CCCC1 1993088824 IUJONRVOFKJHCA-RKVPGOIHSA-N 437.362 4.548 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]3(CCC[C@H](CI)O3)C[C@H]21 2001949851 IHTRXGZPLWAVEL-YKTARERQSA-N 449.373 4.929 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@@H]1Cc1cccc(Br)c1Br 2007137381 OUOSSSZXPWVNOO-HOSYDEDBSA-N 426.974 4.943 50 10 IJGE CN(C(=O)c1csc(Br)c1Br)C1CC(CBr)C1 2018080444 DLWGYWMWXGALMS-UHFFFAOYSA-N 446.002 4.519 50 10 IJGE CC[C@H](CCCBr)NC(=O)c1cc(Br)ccc1Br 2036514457 UPCABODVELATGY-SNVBAGLBSA-N 441.989 4.895 50 10 IJGE CCCN1C[C@H](Br)[C@H](Cc2cc(Cl)ccc2I)C1 2039250372 JJIHQCPDDIBULH-YPMHNXCESA-N 442.566 4.592 50 10 IJGE CC(C)[C@@H](Br)[C@H](C)NC(=O)c1c(Br)cccc1Br 2041305136 VXDKTOJJHCAOCM-QPUJVOFHSA-N 441.989 4.749 50 10 IJGE CC1(C)CCCN(c2ncc(Br)cc2Br)[C@H]1CBr 2065934382 WRPYICXOPVPEQX-NSHDSACASA-N 441.005 4.997 50 10 IJGE O=[N+]([O-])c1cc(Br)c(OCC2CC(Br)C2)c(Br)c1 2076257090 HDADJSNAORISSH-UHFFFAOYSA-N 443.917 4.672 50 10 IJGE ClCCc1nc2cc(Br)ccc2n1[C@@]12C[C@@H]1CN(Cc1ccccc1)C2 2099678421 IMNHTUUCJQLMRY-IIBYNOLFSA-N 430.777 4.811 50 10 IJGE CCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2110714206 AZIFTPBTDYQHMU-IAGOWNOFSA-N 431.415 4.578 50 10 IJGE CN(C(=O)c1cc(Br)sc1Br)C1(CCl)CCSCC1 2114719759 WSLKNZYBXDRBOK-UHFFFAOYSA-N 447.645 4.850 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Br)C2 2134105740 UJANCDYGDBVXGP-CVUIIHQFSA-N 431.552 4.643 50 10 IJGE CCN(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)c1ccc(CBr)cc1 2162910992 CQBNOLBIUSWDPO-KRWDZBQOSA-N 439.394 4.691 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@]2(CCN(C(=O)OC(C)(C)C)C2)C1 2163058347 JWGRYNRYQCRDHQ-OAQYLSRUSA-N 447.458 4.680 50 10 IJGE CC(C)(C)OC(=O)Nc1cnn2c1N(C[C@H](CBr)c1ccccc1)CCC2 2163064699 VQKGYTMHKLJVBH-INIZCTEOSA-N 435.366 4.619 50 10 IJGE CN(Cc1c(F)ccc(Br)c1F)[C@@H](CCBr)C(F)(F)F 2178518671 SPGMKTYNWSOSTO-JTQLQIEISA-N 425.033 4.875 50 10 IJGE CCCN(C[C@@H](C)Cl)C(=O)c1ccc(I)c(Br)c1 2259743780 JPNRFMNIEGHKTR-SECBINFHSA-N 444.538 4.533 50 10 IJGE N#CC(=Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1 2297551331 AYCSWVCTYSRLBN-UHFFFAOYSA-N 438.783 4.962 50 10 IJGE CO[C@@H]1C[C@H](Cl)C[C@@H]1Cc1ccc(I)c(Br)c1 2306199758 PPFCXQBDAFPXJS-OPQQBVKSSA-N 429.523 4.629 50 10 IJGE Cl[C@@H]1CCC[C@@H](NCc2ccc(I)c(Br)c2)C1 2306223118 AUBGWXCYEIFJDD-GHMZBOCLSA-N 428.539 4.693 50 10 IJGE N#CC(=Cc1c[nH]nc1-c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(C(F)(F)F)c1 2314488407 OBOQAYDHHWKOPQ-UHFFFAOYSA-N 427.342 4.549 50 10 IJGE CCOc1ccc(NC=C(C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1OCC 2325255093 YHXGSBZGHBUVAE-UHFFFAOYSA-N 430.848 4.504 50 10 IJGE Clc1ccc(I)cc1C[C@]1(CBr)O[C@H]2CC[C@H]1C2 2327569816 XWJXHUPEFUTGQD-VHRBIJSZSA-N 441.534 4.820 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@@]1(F)CN(C[C@@](C)(CBr)C(C)(C)C)C2 2352081792 OIRAZTMCNKNQME-AQNXPRMDSA-N 435.422 4.905 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H](CCl)C1)c1ccc(Cl)cc1I 2365587157 UIKUOAJTBWWOQB-GHMZBOCLSA-N 426.125 4.720 50 10 IJGE CC(C)[C@H]1C[C@@H](Br)CN1C(=O)c1cc(Br)c(F)cc1Cl 2370882775 GWFNXKRNSFPZJG-AMIZOPFISA-N 427.539 4.876 50 10 IJGE CC(=O)C1=C(C)NC(SCC(=O)c2ccc([N+](=O)[O-])cc2)=C(C#N)[C@@H]1c1cccc(C)c1 1199308 ISBKFNBPNVRRGD-QHCPKHFHSA-N 447.516 4.804 50 10 IJGE Cc1ccc2nc(N(/N=C/c3ccc([N+](=O)[O-])o3)C(=O)COc3ccccc3)sc2c1 9628934 IBODWLHTQGODAC-WSDLNYQXSA-N 436.449 4.552 50 10 IJGE O=C(COc1ccc2ccccc2c1Br)N/N=C/c1c(O)ccc2ccccc12 12575649 OILGGBJMBALSPD-DHRITJCHSA-N 449.304 4.990 50 10 IJGE COc1cc(/C=C(/C#N)c2ccccc2OC)ccc1OC(=O)c1cccc(NC(C)=O)c1 31902012 SQBNKDSNGVRQSZ-MOSHPQCFSA-N 442.471 4.946 50 10 IJGE C=CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccs4)ccc32)cc1 38658089 RCQXJYVTGRADHZ-JOCHJYFZSA-N 430.485 4.750 50 10 IJGE Cc1cc(C)c2c(=O)c(/C=C(/C#N)S(=O)(=O)c3ccc(Br)cc3)coc2c1 83309470 XVDJCQAJHUGEES-MFOYZWKCSA-N 444.306 4.511 50 10 IJGE CC(=NNC(=O)COc1cc(C)cc(C)c1)c1cccc(NC(=O)c2cccc(F)c2)c1 252640930 YYDASOLZZULMJR-UHFFFAOYSA-N 433.483 4.614 50 10 IJGE CCCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3ccc(OC)cc3)cc2)cc1 254761552 FRGSKOWGHJFSRP-UHFFFAOYSA-N 446.503 4.857 50 10 IJGE Nc1cc([C@H]2CN(Cc3ccccc3)C[C@@H]2CI)ccc1Cl 382710514 GYAUUSMNOKRUQV-JKSUJKDBSA-N 426.729 4.573 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@@H]2CC[C@@H](Cl)C[C@H]2C1 398701150 LTRMSERPTBWTTI-XHNCKOQMSA-N 427.589 4.753 50 10 IJGE O=C(NNC(=O)c1ccccc1OCc1ccc(F)cc1)Nc1cccc(C(F)F)c1 756300542 YYEOTQHGMNPKHV-UHFFFAOYSA-N 429.398 4.809 50 10 IJGE C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1 799389180 ZGUVVROZZBCDOW-CQSZACIVSA-N 445.445 4.740 50 10 IJGE O=C(NCc1cnc(-c2ccccc2)s1)NNc1ncc(C(F)(F)F)cc1Cl 1339856494 XDOWCBVBKQHKQM-UHFFFAOYSA-N 427.839 4.704 50 10 IJGE Cc1cc(OC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccn2)CCC3)ccc1Cl 1772747716 SRVRFIQTHHDHRN-UHFFFAOYSA-N 437.883 4.634 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@H]1c1ccc(F)cc1 1865708214 QSAMRUYIXJHGOF-INIZCTEOSA-N 448.807 4.961 50 10 IJGE C[C@@H]1OCCO[C@H]1[C@H](Br)c1cc(Br)sc1Br 1935544134 ZMBXYBCWJUXTII-LQQYEPNUSA-N 434.975 4.513 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@]21CCC[C@@H](CI)O1 1987456547 TZAZXPOUEBRHGV-KBXCAEBGSA-N 435.346 4.540 50 10 IJGE CCC[C@](C)(CBr)NC(=O)c1cccc(Br)c1Br 2031482480 SIVFHNKBXXRPOA-CYBMUJFWSA-N 441.989 4.895 50 10 IJGE Cc1ccc(Br)c(CN[C@@H](C)CCCCCI)n1 2054155906 UWOGBLLVCGFKCP-NSHDSACASA-N 425.152 4.626 50 10 IJGE O=C(N[C@H]1C[C@@H](CCBr)C1)c1cc(Br)cc(Br)c1 2078347958 QWKLUBMEBZQHLC-LYWQIFSTSA-N 439.973 4.505 50 10 IJGE FC(F)(F)c1cc(Br)cc(-n2nc(CBr)c3c2C[C@@H]2C[C@H]32)n1 2080742930 WZIFRFNZSCOREU-XPUUQOCRSA-N 437.057 4.603 50 10 IJGE Clc1cc(CN2CC3(CC3)C[C@@H]2CBr)ccc1I 2086657377 DUORUOYIWSWIGF-LLVKDONJSA-N 440.550 4.694 50 10 IJGE ClCc1nc2cncc(Br)c2n1CC1CCN(Cc2ccccc2)CC1 2095439615 MKFGHZFUNRXGHO-UHFFFAOYSA-N 433.781 4.845 50 10 IJGE BrC[C@]12CCCC[C@@H]1N(c1ccc(I)cn1)CCC2 2108957427 ZIWWOFXIICITLK-DZGCQCFKSA-N 435.147 4.610 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@@H](Cl)c2sc(Br)cc2Br)C1 2137239064 PHEZFEIXNJBHNQ-QILRFPOHSA-N 448.629 4.768 50 10 IJGE O=C(N[C@H]1C[C@H]2CC[C@H]1[C@H](Cl)C2)c1scc(Br)c1Br 2139715168 RCZAEJHVZBVASX-MFDQJXRNSA-N 427.589 4.799 50 10 IJGE COCCCCN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)cc(CCl)c1F 2152211470 NASLEVAPNDDJFZ-UHFFFAOYSA-N 434.360 4.835 50 10 IJGE COC1(C(F)(F)F)CN(c2c(CBr)ccc(Br)c2Cl)C1 2154376107 PZYIAMSMFRAYTM-UHFFFAOYSA-N 437.481 4.765 50 10 IJGE CCCN(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)CC1(CBr)CCOCC1 2163060527 BFGYUMYLNKYQIS-GOSISDBHSA-N 447.458 4.537 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CCCCCCCCCBr)[C@@H]2CCOC2)C1 2163062099 JPSFLMVWXKSPEA-GOSISDBHSA-N 447.458 4.822 50 10 IJGE O=C(c1ccc(OCc2ccccc2)cc1)N1C[C@@H](C(F)(F)F)[C@@H](CBr)C1 2163358119 HVKACYFSUASTLF-FUHWJXTLSA-N 442.275 4.911 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)c2ccccc2)[C@H](CC(F)F)C1 2183407160 GRXJTOHRKLUBBK-IAGOWNOFSA-N 447.364 4.742 50 10 IJGE CO[C@H]1C[C@@H](Oc2c(Br)cc(Br)cc2CCl)C[C@H]1OC 2187166867 BPIZFQJYYOXSFQ-LMKPVCQUSA-N 428.548 4.522 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2N1C(=O)OC(C)(C)C 2196913232 CNCQUVONXAFDIT-DZVNLGKHSA-N 443.426 4.577 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)C[C@H]1CC1(Br)Br 2208937065 KDNDXGRVDONJFT-WCQYABFASA-N 440.017 4.778 50 10 IJGE Cc1cc(Br)c([C@@H](Br)c2cc(S(C)(=O)=O)cs2)s1 2221842871 DFRRUBVDFSDOQX-JTQLQIEISA-N 430.208 4.768 50 10 IJGE CCOc1cccc(NC(=O)C(C#N)=Cc2ccc(OCc3cccc(C(=O)O)c3)cc2)c1 2294175235 HKAASHPFFOTJNR-UHFFFAOYSA-N 442.471 4.908 50 10 IJGE N#CC(=Cc1ccc(-c2ccc(C(=O)O)cc2)o1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 2297306966 NUDOJONHRJASAX-UHFFFAOYSA-N 437.795 4.752 50 10 IJGE CC1=C(C#N)C(=O)N([C@H](C)c2ccccc2)C(=O)C1=CNc1ccc([N+](=O)[O-])cc1Cl 2314585740 QUNNLHFPRGXGTO-CQSZACIVSA-N 436.855 4.514 50 10 IJGE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1ccc(OCc2ccccc2)cc1 2328821149 RQYGPYSBIDWKBP-AVRDEDQJSA-N 439.556 4.655 50 10 IJGE CN(Cc1ccccc1)[C@H]1CCN(c2nc(C(F)(F)F)ccc2CBr)C1 2343785686 PFTLIIYROJQLOT-INIZCTEOSA-N 428.296 4.706 50 10 IJGE CC1(C)CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C2)C1 2345006545 OJNVJRXNUQCUAV-CYBMUJFWSA-N 443.348 4.671 50 10 IJGE CCN(C[C@@]1(CBr)CC1(F)F)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2351889061 NYTYIYIMSGIGOF-DPXCBNATSA-N 437.369 4.659 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccc(F)c(C(F)(F)F)c1 2369432409 CVTQONVFGBTLPH-HNNXBMFYSA-N 448.254 4.945 50 10 IJGE CCOc1cccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)c1 1195192 JSRANXZWQRPABZ-YBFXNURJSA-N 429.476 4.767 50 10 IJGE Cc1ccc(/C=N/NC(=O)CSc2nc(=O)c3c(-c4ccc(C)cc4)csc3[nH]2)cc1 2613880 VBCNJFMRUGZZNE-BHGWPJFGSA-N 448.573 4.511 50 10 IJGE O=C(N/N=C/c1cccc(/C=N/NC(=O)c2ccccc2Cl)c1)c1ccccc1Cl 3093496 GRTXAEVYPSMDRJ-BKHCZYBLSA-N 439.302 4.521 50 10 IJGE COc1cc(/C=C2/C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 38608470 PHXQCTDSBJYYFA-WSDLNYQXSA-N 444.531 4.831 50 10 IJGE O=C(NC[C@H](Br)C1CCC1)c1scc(Br)c1Br 705439976 VOCZNQHENVCGCT-ZETCQYMHSA-N 446.002 4.567 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N2[C@H]3CC[C@H]2CC(O)C3)c(C)n1-c1cccc(Cl)c1Cl 736189749 UTNLYZCGFSQWRF-NZNBCCPUSA-N 444.362 4.822 50 10 IJGE O=C(CCCSc1nc2ccc([N+](=O)[O-])cc2s1)NN=C/C=C\c1ccccc1 1083977602 HFFKTEDUCDDMQT-XONUTPECSA-N 426.523 4.892 50 10 IJGE O=C(NN=Cc1ccc(N2CCCCCC2)o1)c1cc2cc(Br)ccc2o1 1084198632 IEEQJJDLZRBUCS-UHFFFAOYSA-N 430.302 4.933 50 10 IJGE C=CCOc1ccccc1C=NNC(=O)COc1ccc2ccccc2c1Br 1084240359 MYFSWIODLYTRGN-UHFFFAOYSA-N 439.309 4.696 50 10 IJGE Cc1cccc(C)c1NC(=O)CSc1ccc(C=NNC(=O)c2cccc(F)c2)o1 1084366029 PCBHVHIYMBSPEP-UHFFFAOYSA-N 425.485 4.530 50 10 IJGE C/C=N/NC(=O)CC[C@@H](C)[C@@H]1CC[C@@H]2[C@H]3[C@H](O)C[C@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@]12C 1085895344 JACKUUJOKIRMRC-HTHXYLLXSA-N 432.649 4.515 50 10 IJGE CCCOc1nc2ccccc2cc1/C=C\C(=O)NNc1nc2ccccc2[nH]c1=S 1453768628 JQPHVEZIWVRKDC-QXMHVHEDSA-N 431.521 4.786 50 10 IJGE Clc1sc(Cl)c(CI)c1CI 1615216292 KQANTEVWIUXJQO-UHFFFAOYSA-N 432.879 4.925 50 10 IJGE COc1cccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4ccc(C)c(C)c4)c(C)c32)c1 1772748668 CJWOBVFADQEUTJ-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE Cn1cccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2-c1ccccc1Cl 1865698875 FJUKCWXOKHWPJG-HXUWFJFHSA-N 427.895 4.749 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2)[C@H]1c1ccc(C(=O)O)cc1 1865709261 SFWNFJIZTKEECI-QFIPXVFZSA-N 448.482 4.515 50 10 IJGE Brc1ccccc1[C@H](CI)O[C@@H]1COC2(CCC2)C1 1889723589 UAKVVYQXRRJQSP-FZMZJTMJSA-N 437.115 4.653 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@]23COC[C@H](C2)C3)s1 1900917833 BBLYASRTRRAFMC-CYUDJLOBSA-N 433.536 4.869 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1Cc1ccc(Br)cc1Br 2018114576 GDYLARCLVJXEGU-RNCFNFMXSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OCc2ccc(F)cc2)C1 2024643742 MAUIUTQCNIMTAW-SFHVURJKSA-N 449.304 4.547 50 10 IJGE FC1(F)C[C@H](CBr)N(Cc2c(Br)cccc2Br)C1 2041126400 DOAKTDAXHXWXKU-MRVPVSSYSA-N 447.943 4.816 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)C[C@H]1C[C@@H]1C(C)(F)F 2046142674 WUXPACCCRSNOEQ-IKGGRYGDSA-N 438.378 4.529 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@H](CI)C(C)C)cc1Br 2048498850 YFWKONDUECDEGZ-GFCCVEGCSA-N 444.538 4.600 50 10 IJGE CC(C)(C)OC(=O)Nc1cnn2c1N(CC1(CBr)CCCCC1)CCC2 2106785782 QTYSYJQOQQLPDN-UHFFFAOYSA-N 427.387 4.786 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CN(C[C@@H](CBr)C2CCC2)C2CC2)CC1 2106786044 DJIFKMBIKTUSJZ-GOSISDBHSA-N 429.443 4.909 50 10 IJGE O=C(Nc1ccc2c(c1)CN(C[C@H](CBr)c1ccccc1)C2)C(F)(F)F 2163058506 KZZZELMLRGRKSZ-INIZCTEOSA-N 427.264 4.682 50 10 IJGE CN(c1c(CBr)ccc(Br)c1Cl)[C@H]1COCCC1(F)F 2168228032 QDJBBJXUPGCGLN-JTQLQIEISA-N 433.518 4.858 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)c2ccccc2)C[C@H]1CC(F)F 2177310842 AWUQVPJKENOLIA-DLBZAZTESA-N 447.364 4.742 50 10 IJGE Br[C@@H]1CN(C[C@@H]2CC2(Br)Br)C2(CCCCC2)C1 2217451630 ONRQBTUEBQIWAP-QWRGUYRKSA-N 430.022 4.665 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1[C@@H]1COC[C@@H]1F 2234067409 OAXHMQNFHOVKKB-ZKQGETEISA-N 426.511 4.771 50 10 IJGE CC(C)N(C[C@H]1CCCN(CCCCI)C1)C(=O)OC(C)(C)C 2243591426 UHFAAKUTKGTFHP-INIZCTEOSA-N 438.394 4.559 50 10 IJGE CN(CCCCCBr)C(=O)c1ccc(Cl)c(I)c1 2256393832 YKPLGTGJBGLTTM-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CC(F)(F)CN1CC1(CBr)CCCCC1 2264252646 NRJSAUQKOQIHOV-AWEZNQCLSA-N 425.358 4.566 50 10 IJGE CCn1nc(C)c(CBr)c1N1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1 2281295523 IWHZVNQEFLESLJ-CTNGQTDRSA-N 431.422 4.597 50 10 IJGE C[C@]1(NCc2ccc(I)c(Br)c2)CCC[C@H]1Cl 2306226703 HLCWOYUXGPRUMY-OLZOCXBDSA-N 428.539 4.693 50 10 IJGE COc1ccc(-c2ccc(C(=O)NN=Cc3c(F)cccc3Cl)c(C)n2)cc1OC 2321248558 ZXFIFLCKNHZFPD-UHFFFAOYSA-N 427.863 4.631 50 10 IJGE ClC[C@H]1[C@H]2CC[C@@H](C2)N1Cc1ccc(I)c(Br)c1 2325210269 WURHHUBKHQKXMV-MJVIPROJSA-N 440.550 4.645 50 10 IJGE CC(C)[C@@H](C(O)=C(C#N)c1nc(-c2ccccc2)cs1)N1C(=O)c2ccccc2C1=O 2331300959 FCDUNTZIKTYHAZ-FQEVSTJZSA-N 429.501 4.924 50 10 IJGE CCN(C[C@](C)(CBr)OC[C@@H](OC)c1ccccc1)C(=O)OC(C)(C)C 2336254892 BFYBTXCIEJPDNX-XLIONFOSSA-N 430.383 4.801 50 10 IJGE COc1cc(Cl)c([C@@H](Cl)c2c(Br)ncn2C)cc1Br 2337275535 WNVZFUWXAMOUGQ-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE CCN(C[C@@](C)(CBr)O[C@H]1CCOc2ccccc21)C(=O)OC(C)(C)C 2340299599 QEIXXLVMTZJJNP-FXAWDEMLSA-N 428.367 4.937 50 10 IJGE CC1(C)CC(CBr)(CN2CCC(OCCCNC(=O)OC(C)(C)C)CC2)C1 2371132642 DPVCVRAYFAWHKQ-UHFFFAOYSA-N 447.458 4.584 50 10 IJGE O=[N+]([O-])c1cc(Cl)cc(Br)c1OC[C@@]1(CBr)CC1(F)F 2379915947 KRZNLXKVAUQFAL-JTQLQIEISA-N 435.446 4.810 50 10 IJGE CCCCN(CCCC)Cc1ccc(C(=O)NNC(=S)Nc2ccc(C)cc2C)o1 4683352 QPKHPJZVVORNJT-UHFFFAOYSA-N 430.618 4.930 50 10 IJGE CC[C@@](C)(CCBr)NC(=O)c1cc(Br)cc(Br)c1 228575856 OXMQMTYBWQJYKA-ZDUSSCGKSA-N 441.989 4.895 50 10 IJGE CCC[C@@H](C)CO[C@](C)(CI)CN(CC)C(=O)OC(C)(C)C 233267407 HVYMGRFPMYJIDS-RHSMWYFYSA-N 427.367 4.890 50 10 IJGE ClCc1nnc(Nc2c(Br)cc(Br)cc2Br)o1 236024462 ADTPRJFLAGIUBO-UHFFFAOYSA-N 446.324 4.840 50 10 IJGE CCOc1ccc(OCc2ccc(C(=O)NN=C(C)c3ccc4c(c3)OCO4)cc2)cc1 254383921 HEFXTQZWTSOKQQ-UHFFFAOYSA-N 432.476 4.547 50 10 IJGE Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C=NNC(=O)c1cc2c(s1)CC[C@H](C)C2 254440596 BOEADEMHABTDBG-ZDUSSCGKSA-N 444.963 4.983 50 10 IJGE CC(=NNC(=O)c1ccco1)c1ccc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2C)cc1 254821557 VDJSMGBTPQTZGX-INIZCTEOSA-N 439.899 4.801 50 10 IJGE C[C@@H](NC(=O)c1ccc(Br)cc1Br)C1(CBr)CC1 696075332 CSRMSKJAFOPYJA-MRVPVSSYSA-N 439.973 4.505 50 10 IJGE CCO[C@@H](CO[C@H](CI)c1cccc(Br)c1)C1CC1 703468100 CALJHLMQQRILRR-CABCVRRESA-N 439.131 4.757 50 10 IJGE ClCc1cc(Br)cnc1N1C[C@H]2CC[C@H]1[C@H]1CN(Cc3ccccc3)C[C@@H]21 705845733 MJTIVOOVTXBNOW-SEVLPDGMSA-N 446.820 4.930 50 10 IJGE CC(=O)N(C)c1ccccc1NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccccc2F)c1C 735640326 VAYIGGZMUQQJMS-ZHZULCJRSA-N 430.483 4.762 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCCC[C@H]3c3noc(C)n3)c2C)c1 737622459 GMQBGRHQBKWGCD-YJADQXIJSA-N 429.524 4.755 50 10 IJGE N#C/C(=C\c1ccc(-c2nc3ccccc3s2)o1)C(=O)NCc1ccc([N+](=O)[O-])cc1 787150096 YABUYJOXCVGWCV-RVDMUPIBSA-N 430.445 4.688 50 10 IJGE CCOc1cc(C=NNC(=O)c2cc3cc(Br)ccc3o2)cc(Cl)c1O 1084593491 QTDIDOGJXXWZHH-UHFFFAOYSA-N 437.677 4.717 50 10 IJGE COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)/C(C#N)=C/c1cccc(F)c1 1866131197 IJMRWKMXDGSKKV-WOJGMQOQSA-N 445.450 4.641 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCN(CC3(CBr)CCC3)C2)C1 1879198672 OTMDECZOXHWFDD-MSOLQXFVSA-N 429.443 4.911 50 10 IJGE C[C@]1([C@@H](Br)c2sc(Br)cc2Br)COCCO1 1992638163 IISFXCVDSRYNAH-VHSXEESVSA-N 434.975 4.515 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1ncc(C)cc1Br 1992739648 ZOKGIJQPKKUGAW-HNNXBMFYSA-N 440.179 4.968 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCCC[C@@H](Br)C1 2003410950 WWKPUYODYGUVFC-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE CC(C)(C)OC(=O)N[C@H](C[S@](C)(=O)=NCC1(CBr)CCC1)C(C)(C)C 2044706532 VBYJQPOLEXXBBJ-PWECECGKSA-N 439.460 4.589 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@H](CCl)C(F)(F)C1 2093947852 JEOGJWOGKMIEKH-ZCFIWIBFSA-N 437.531 4.609 50 10 IJGE O=C(NC[C@@]1(CCl)CC12CCC2)c1scc(Br)c1Br 2097910374 VZUFWIPLCPXORU-ZDUSSCGKSA-N 427.589 4.802 50 10 IJGE CC[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1C[C@H](CBr)c1ccccc1 2106789390 YDMJCHRINQVOKQ-RBUKOAKNSA-N 425.411 4.887 50 10 IJGE COc1cc(Cl)c([C@@H](Br)c2cn(C)nc2Br)cc1Cl 2116555250 QSJVZVUHXSTDLS-LLVKDONJSA-N 428.939 4.982 50 10 IJGE Cc1cc(Br)cc(C(=O)N[C@@H](C)CCCCCI)c1 2117894272 KWTMBFATYLYADC-LBPRGKRZSA-N 438.147 4.871 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@@H](Br)c2sc(Cl)cc2Br)C1 2137234601 BUFWUUUHJZEVSL-CQFDHEJISA-N 448.629 4.815 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Br)Cc2ccc(Br)cc2F)c1 2149497625 AWADBWHMHNUVBD-NSHDSACASA-N 442.169 4.732 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CC[C@H](Cl)C(F)(F)CC1 2150038269 DSMKUSPKJJVJRX-NSHDSACASA-N 431.502 4.690 50 10 IJGE C[C@@]1(CBr)CC(F)(F)CN1C(=O)c1cc(Cl)ccc1Br 2159048328 DFIBBHOCRKODIE-LBPRGKRZSA-N 431.502 4.737 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(CBr)cc2)C2(CCC2)CC1 2163050820 NJKWCIXEBNEPEF-UHFFFAOYSA-N 437.378 4.587 50 10 IJGE CCC(CC)(CBr)CN1CCCC[C@H]1[C@H]1CCCN(C(=O)C(F)(F)F)C1 2163062440 LITMYFPEPKKKIN-HOTGVXAUSA-N 441.376 4.843 50 10 IJGE O=C(NCC[C@@H]1CCCC[C@H]1Cl)c1ccc(I)c(Cl)c1 2179638859 RXWZFIXQIKXIQG-CMPLNLGQSA-N 426.125 4.862 50 10 IJGE O=C(c1cc(Cl)ccc1Br)N1CC[C@@H](C(F)(F)CBr)C1 2197762917 KREMCVDNRUXMHP-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC[C@H](CI)O2)C[C@@H]2CCCC[C@@H]21 2242741019 QIYIKIPVQLAEOV-KRXQYRFLSA-N 435.346 4.539 50 10 IJGE C[C@@]1([C@H](Br)Cc2cc(Br)cc(Br)c2)CCOC1 2252836361 BFGVVBKGUJIPKP-CHWSQXEVSA-N 426.974 4.944 50 10 IJGE C[C@@]1(CBr)CCCN1Cc1ccc(Cl)c(I)c1 2300239589 ACHRMZKZAZATKT-ZDUSSCGKSA-N 428.539 4.694 50 10 IJGE C=CC[C@]1(CBr)CCCN1Cc1sccc1I 2301075502 ASIIZCYQXLNXKB-CYBMUJFWSA-N 426.161 4.658 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)c(I)c2)CC[C@@H]1CBr 2315554090 AXEIHBZFBOURSO-ZYHUDNBSSA-N 442.566 4.798 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1c(F)ccc(Cl)c1F 2320361991 RPRIGHJYZQYPRF-ZDUSSCGKSA-N 432.692 4.718 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(Cc2ccc(Cl)c(I)c2)[C@@H]1C 2321336561 XIGDWMOTOXKORG-UMNHJUIQSA-N 442.566 4.938 50 10 IJGE COc1cc(C)c(-c2csc(C(C#N)=C(O)[C@H]3CC(=O)N(C(C)(C)C)C3)n2)cc1C 2331402764 OCGOONLRYWAPPS-HNNXBMFYSA-N 425.554 4.875 50 10 IJGE CC[C@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)COc1ccccc1[C@H](C)CC 9871283 XMLIQPCEBUCTLO-QYZOEREBSA-N 426.557 4.707 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2O)c(C)n1-c1cccc(Cl)c1 35352505 UMFCSOPIKGFSHM-SXGWCWSVSA-N 436.855 4.907 50 10 IJGE CCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)c1 38652990 AWGHJSOGFSIZTA-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)Nc2ccc(C(F)(F)F)c(Cl)c2)cc(OC)c1OC 39884858 FNDTWOJVXQUPCI-WUXMJOGZSA-N 440.805 4.930 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)N(c2cccc(C)c2C)S(=O)(=O)c2ccccc2)cc1 40971402 IDHXSDGKEPXDIC-LTGZKZEYSA-N 446.528 4.641 50 10 IJGE N#C/C(=C/c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)C(=O)NC[C@H]1CCCO1 59297328 ATZUATLKZLYPMV-WSDUQJHMSA-N 431.319 4.775 50 10 IJGE CCc1c(C)sc(NC(=O)/C(C#N)=C\c2cc(OC)c(O)cc2Br)c1C#N 96438599 XOEULQPZOOBPJW-XGICHPGQSA-N 446.326 4.513 50 10 IJGE COc1cc(/C=C2/C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)ccc1OCCC(C)C 101336796 FMPNKUBWSPSGPU-UDWIEESQSA-N 434.492 4.506 50 10 IJGE CCOc1c(Br)cc(/C=N/NC(=O)Nc2ccccc2)cc1Br 169885194 JCVSOLDNHZROST-VXLYETTFSA-N 441.123 4.766 50 10 IJGE CCOc1ccccc1C(=O)NN=Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 254398508 DXHMXWHPAGLPSU-UHFFFAOYSA-N 428.467 4.841 50 10 IJGE CCCCOc1ccc(C(=O)NCC(=O)NN=Cc2cccc(Oc3ccccc3)c2)cc1 254736507 CNHZLIFOAMNLTL-UHFFFAOYSA-N 445.519 4.538 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@@H]1C=C(I)C(=O)[C@H]1OCc1ccccc1 309923085 WOQWQMNYYGLQIV-WBVHZDCISA-N 444.385 4.864 50 10 IJGE CCN(CC)C(=O)[C@H](c1cccs1)N(C(=O)CCl)c1cccc(C(F)(F)F)c1 725240016 ITELXLUBSWMTJI-KRWDZBQOSA-N 432.895 4.948 50 10 IJGE O=C(Nc1ccccc1C(=O)NNc1cccc(F)c1F)c1cccc(Br)c1 743722721 SRJXGWMCNNDHJJ-UHFFFAOYSA-N 446.251 4.737 50 10 IJGE O=C(NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl)c1cc(C2CCCCC2)[nH]n1 759764031 PXECBUFTVMPFFD-UHFFFAOYSA-N 445.898 4.761 50 10 IJGE COc1ccc(C(=O)NN=Cc2ccccc2OCc2ccc(Br)cc2)cc1 1083932465 VTFKAXLVVYCOOM-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1Cl)C(=O)Nc1ccc(Oc2ccccc2)cc1 1083989809 MMYRTTZNLLXSRG-UHFFFAOYSA-N 428.275 4.875 50 10 IJGE Cc1ccc(COc2ccc([C@@H]3C(C#N)=C(N)Oc4c3c(C)nn4-c3ccccn3)cc2)cc1 1865692329 DYPHMZURLRMVGA-RUZDIDTESA-N 449.514 4.681 50 10 IJGE COc1ccc(-c2ccc(C(=O)N/N=C\c3ccc(Br)cc3F)c(C)n2)cc1 1865762160 QQNKNYUWEPYRIN-MSXFZWOLSA-N 442.288 4.731 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)c3cc4ccccc4oc3=O)n2)c(OC)c1 1872755528 RSMFDUXCDLTOKK-FXBPSFAMSA-N 432.457 4.884 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCN(Cc2ccccc2)C(C)(C)C1 1881488957 CQPNQBHHUXHHQV-ZWKOTPCHSA-N 425.411 4.965 50 10 IJGE CC1([C@@H](CBr)NCc2ccc(Br)cc2Br)CC1 1945367809 GCMORZOVBVGUCE-GFCCVEGCSA-N 425.990 4.865 50 10 IJGE C[C@@]1(CCBr)CCN1Cc1cccc(Br)c1Br 2025222145 GSTQFXDGQYWHLD-CYBMUJFWSA-N 425.990 4.961 50 10 IJGE Brc1ccc(C[C@H]2CN(C3CC3)C[C@@H]2Br)c(Br)c1 2039252812 ZJIXQQHZXDATEV-HZMBPMFUSA-N 438.001 4.612 50 10 IJGE FC(F)(F)c1cc(I)c(I)c(CCl)c1 2060235680 KMYVKYRXOMAOIG-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Cl)c2)[C@H](C)C[C@@H]1Br 2086659018 SHJCNJWMTPQLKX-FOGDFJRCSA-N 442.566 4.938 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC2(CCC2)C[C@H]1CCl 2095173906 SWPRZPJDDMRLHT-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1C1[C@@H]2CN(Cc3ccccc3)C[C@@H]12 2095438852 BFHGMGGXEBZGMH-NWANDNLSSA-N 431.765 4.797 50 10 IJGE CCC(CBr)(CBr)NC(=O)c1cc2sc(C)cc2s1 2100333144 JQJYJVLSNCZPFM-UHFFFAOYSA-N 425.211 4.940 50 10 IJGE CCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2110714208 AZIFTPBTDYQHMU-SJORKVTESA-N 431.415 4.578 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]32 2134557598 JNXUHLJRJVSLGQ-TZCLQITCSA-N 431.111 4.564 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@H]1CCCCN1C(=O)[C@H](Br)C1CCCC1 2143047239 JGJOSLOOHKRNMK-HZPDHXFCSA-N 431.415 4.625 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CCl)c1F)N(Cc1ccccc1)C[C@@H]1CCCO1 2152215439 SPGVJDGJVCQART-KRWDZBQOSA-N 432.344 4.588 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2CN(C[C@H](CBr)c3ccccc3)C(C)(C)[C@H]2C1 2163064462 UPUHKFAIPGFONE-OTWHNJEPSA-N 437.422 4.742 50 10 IJGE Cc1cc(Br)c(CCl)c(N2CC[C@]3(CN(Cc4ccccc4)CCO3)C2)c1 2173450334 PEXGJWSQIWRBFJ-QFIPXVFZSA-N 449.820 4.978 50 10 IJGE Cc1sc(Br)c(C(=O)N(C)[C@H](CCBr)C(F)(F)F)c1C 2178516013 QYVRDLIBHWDVSS-MRVPVSSYSA-N 437.119 4.915 50 10 IJGE ClCc1nc2cncc(Br)c2n1C[C@@]12CC[C@H]1CN(Cc1ccccc1)C2 2201228591 JOBSCLICQLQACS-KKSFZXQISA-N 445.792 4.845 50 10 IJGE BrCC#Cc1sc(Br)c(Br)c1Br 2209077880 JMBCHGLPCANGMP-UHFFFAOYSA-N 437.776 4.782 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(Br)c1 2217402746 ZSEHWRGGFLDVRM-AWEZNQCLSA-N 434.758 4.797 50 10 IJGE Br[C@H]1CN(C[C@H]2CC2(Br)Br)C2(CCCCC2)C1 2217451628 ONRQBTUEBQIWAP-GHMZBOCLSA-N 430.022 4.665 50 10 IJGE CC(C)(C)OC(=O)N1CCC12CCS(=O)(=NCCCCCCBr)CC2 2223289540 BHOOQYVCJUCKMO-UHFFFAOYSA-N 437.444 4.583 50 10 IJGE C[C@H]1CCC[C@](CBr)(OCCOCCOCCOCc2ccccc2)C1 2227775437 AOGVXPCSSVWIEM-FPOVZHCZSA-N 429.395 4.597 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@H]2CCCC23CCC3)C1 2250323842 XKZSFBCMWVIVCM-HNAYVOBHSA-N 449.373 4.931 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2C[C@@H]1CCN1Cc1ccccc1 2270567008 YDAOLTPPQNNDOH-HNNXBMFYSA-N 434.765 4.821 50 10 IJGE COc1ccc([C@H](Br)[C@]23COC[C@H]2C3(F)F)c(Br)c1Cl 2283563638 ZNQNQFURMGQYDA-ZHAHWJHGSA-N 432.486 4.829 50 10 IJGE BrC[C@H]1C[C@@H]2CCCC[C@@H]2N1C[C@H]1CC1(Br)Br 2298231394 YYDKWYSELVQDMD-QCNOEVLYSA-N 430.022 4.520 50 10 IJGE CCCCOc1ccc(C=C2C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)cc1OC 2314617032 PIYWTEJLQHURIB-UHFFFAOYSA-N 444.531 4.975 50 10 IJGE CCOc1cc(C=C2C(=O)N(C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1Cl 2314617540 BMUHGPIFESETTG-UHFFFAOYSA-N 436.895 4.540 50 10 IJGE CCOc1ccc(C=C2C(=O)N([C@H](C)c3ccccc3)C(=O)C(C#N)=C2C)cc1OCC 2314618574 PWFNEKQMDYEJSF-GOSISDBHSA-N 430.504 4.837 50 10 IJGE Cc1[nH]c2ccccc2c1C=NNC(=O)c1cccn(Cc2ccc(C(C)(C)C)cc2)c1=O 2323662181 DFVSQYHAQHHKII-UHFFFAOYSA-N 440.547 4.748 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)C(C#N)=CNc1ccc(Br)cc1 2325068611 NHJOZYMPROQZBR-OAHLLOKOSA-N 428.330 4.853 50 10 IJGE Cl[C@H]1C[C@@H]2C[C@H](C1)CN2Cc1ccc(I)c(Br)c1 2325207884 RXVZGDDHWIBDLQ-TUAOUCFPSA-N 440.550 4.645 50 10 IJGE Cl[C@@H]1CCC[C@@H]1CCNCc1ccc(I)c(Br)c1 2325217190 BMCDYVQJUUNUON-DGCLKSJQSA-N 442.566 4.941 50 10 IJGE CCCCCOc1ccc(C=NNC(=O)CCCCCNC(=O)OC(C)(C)C)cc1OC 2328835188 BKBZLIYHANFJNX-UHFFFAOYSA-N 449.592 4.799 50 10 IJGE CC1(C)CC(CBr)(CN2CCC3(CCN(C(=O)OC(C)(C)C)CC3)C2)C1 2345004709 OBPLZOGKYARIFQ-UHFFFAOYSA-N 429.443 4.911 50 10 IJGE CC(C)[C@@H]1C[C@@H](Br)CN1C(=O)c1cc(F)c(Br)cc1Cl 2370880532 WUHQBDOZULQYNP-OQPBUACISA-N 427.539 4.876 50 10 IJGE COc1ccc(CC(=O)Oc2cccc(/C=C(/C#N)c3ccc(OC)c(OC)c3)c2)cc1 31902916 ZYWPVGVDUDABJI-BKUYFWCQSA-N 429.472 4.925 50 10 IJGE C/C(=N\NC(=O)C1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1)c1ccc2ccccc2c1 38199536 KWJRUHUWIDGAAM-NLRVBDNBSA-N 430.508 4.500 50 10 IJGE N#C/C(=C/c1cn(Cc2ccccc2)c2ccccc12)C(=O)NCc1ccc2c(c1)OCO2 59292000 CEYDQPGHDYZXPV-BKUYFWCQSA-N 435.483 4.642 50 10 IJGE C=CCOc1ccc(Br)cc1/C=C(/C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1C 96837252 YUFWWFZHWVGDJM-GDNBJRDFSA-N 442.269 4.776 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)ccc1OC(C)C 169917836 BCJGGYBADPBXBF-FMCGGJTJSA-N 426.542 4.623 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NC(C)C)ccc1OC(=O)CCc1ccc(C(C)C)cc1 207164438 HHWZYBUMQRKKRI-HMAPJEAMSA-N 434.536 4.788 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccccc3)c(OCC)c2)C1=O 214222151 SJNADAFHOVQGNS-STZFKDTASA-N 430.504 4.667 50 10 IJGE O=C(NN=Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccccc1 254527525 LPTMQHGIGUVSKU-UHFFFAOYSA-N 426.436 4.603 50 10 IJGE O=C(c1ccc(Br)c(Cl)c1)N1CCC(F)(F)[C@@H](CBr)C1 403993028 SKXOLQAQXQFFKJ-VIFPVBQESA-N 431.502 4.595 50 10 IJGE C[C@H]1[C@@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1cc(Br)c(Br)s1 686184352 CJXOSNOUTPMAOY-WPYKOPORSA-N 427.589 4.894 50 10 IJGE CC[C@@H](Br)CCNC(=O)c1scc(Br)c1Br 705517045 XIJSVWCFRXWMDA-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE Cn1cc(C[C@H](CBr)c2ccc(Br)cc2)c(Br)n1 714085329 NZDAZBOWMFLPJP-SNVBAGLBSA-N 436.973 4.666 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CSCc2ccc(Cl)cc2Cl)c1C 736692061 WWCCGQBMAVDDRD-UHFFFAOYSA-N 448.379 4.839 50 10 IJGE C=CCC(F)(F)C(=O)NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1 1350102387 IKYWPAVTRGWUAP-UHFFFAOYSA-N 436.458 4.905 50 10 IJGE C=CC[C@@]1(C(=O)N2CC[C@@H](O[Si](C)(C)C(C)(C)C)C2)CCCN1C(=O)OC(C)(C)C 1470550374 BKSMIKMDNHQVGQ-JPYJTQIMSA-N 438.685 4.955 50 10 IJGE O=C(NNc1ccc(Br)cc1F)c1cc2cccc(C(F)(F)F)c2nc1O 1596835357 VCIXQALVNRSDLE-UHFFFAOYSA-N 444.182 4.618 50 10 IJGE C=CCC[C@@H](NC(=O)NNc1cc(C(=O)OC)ccc1Br)c1ccccc1 1680805004 XVJQPUZGVGMBOB-QGZVFWFLSA-N 432.318 4.569 50 10 IJGE Cc1nn(-c2cccc(Cl)c2)c2c1[C@@H](c1cccc(Br)c1)C(C#N)=C(N)O2 1865684467 QMLYELQWQTYDJY-SFHVURJKSA-N 441.716 4.815 50 10 IJGE Cc1nn(Cc2ccccc2F)c2c1[C@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2 1865711283 UWFATEZYINLKKM-LJQANCHMSA-N 428.389 4.616 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@H](c1ccc(OC)cc1)C(C#N)=C(N)O2 1865714750 PHGRZLOUPAZVIF-HSZRJFAPSA-N 428.536 4.728 50 10 IJGE N#C/C(=C\c1cccc(Br)c1)C(=O)N1CCc2cc(Br)ccc21 1866366565 KUNQVIWIXDSVJJ-RIYZIHGNSA-N 432.115 4.708 50 10 IJGE C[C@H](CCBr)CCN(OCc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 1881877778 ATLDKXOUYDUHFJ-QGZVFWFLSA-N 441.410 4.851 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)c1cc(Br)sc1Br 2020194671 PJNNAJKXRMTLBE-KNVOCYPGSA-N 446.002 4.519 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1ccsc1C(F)(F)F 2039889133 VCBQJQKRXCVURM-ZDUSSCGKSA-N 436.293 4.819 50 10 IJGE O=C(c1csc(C(F)(F)F)n1)N(Cc1ccccc1)[C@H](CBr)C1CC1 2046643158 GRKMKDYRQQTQGC-CQSZACIVSA-N 433.293 4.978 50 10 IJGE Cc1nn(C)c([C@H](Br)c2ccc(F)c(Br)c2)c1Br 2072297860 DZBGMTNQXLTDHZ-LLVKDONJSA-N 440.936 4.877 50 10 IJGE Cc1cc(Br)c(C)c([C@H](Br)[C@H]2COCCO2)c1Br 2081072680 XAGCOUZLOHJPBK-ZWNOBZJWSA-N 442.973 4.680 50 10 IJGE Cn1nc(COc2cccc(Br)c2CCl)c(Br)c1Cl 2096684338 PRBYILHGOKODHT-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@@H]2CCC[C@H](C1)C2Cl 2111477382 ZYPBBAHZPMTOMK-OQJHAAMPSA-N 427.589 4.753 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@@H]2CC[C@@H](Br)C[C@H]2C1 2115941153 XGEJREGYESSHSH-XHNCKOQMSA-N 427.589 4.800 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCCC2)C[C@@H]1C(F)(F)F 2130168918 KLTIWVROCOAVBJ-CQSZACIVSA-N 443.348 4.815 50 10 IJGE Cc1c(Cl)cc(CN2CCC[C@@H](OCCBr)C2)cc1Br 2170212891 DQGALXCFUFGYSP-CYBMUJFWSA-N 425.592 4.787 50 10 IJGE Fc1c(CN2CCC[C@@H](OCCBr)C2)ccc(Cl)c1Br 2170215571 HBZMQXUPNMMJEI-LLVKDONJSA-N 429.555 4.618 50 10 IJGE O=C(c1cccc(OCc2ccccc2)c1)N1C[C@@]2(CBr)CCC[C@]2(F)C1 2176642201 XHUNEAVMWJKWGN-VXKWHMMOSA-N 432.333 4.995 50 10 IJGE O=C(c1cc(Cl)cc(Br)c1)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Br)C2 2190680563 XBVKJQWLRIDICS-ZDEQEGDKSA-N 425.523 4.581 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2C1[C@H]2CN(Cc3ccccc3)C[C@H]12 2224711555 XNQQAOFOCRIJIH-GJZGRUSLSA-N 434.740 4.980 50 10 IJGE ClCCc1nc2cc(Br)c(Br)cc2n1C[C@H]1C[C@H]1Cl 2225702269 PNYZSWHLAIIMAC-GMSGAONNSA-N 426.967 4.970 50 10 IJGE Cc1ccc(I)c(C(=O)N2[C@@H](CBr)CCC23CCC3)c1 2240905478 KNNWHRDPPHFISJ-GFCCVEGCSA-N 448.142 4.522 50 10 IJGE C[C@H]1C[C@@H](CBr)CN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282978367 MEXQCRBINDOQAB-IUCAKERBSA-N 427.539 4.735 50 10 IJGE C[C@@H](Br)CCCN(C)Cc1cc(Cl)ccc1I 2299546396 ZXRABNDCBSANSH-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc1OC(C)C 2323608825 QEWIMWFYJDEHBF-UHFFFAOYSA-N 426.542 4.623 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC(=O)C(C#N)=CNc1ccc(Nc2ccccc2)cc1 2325219641 UVTWHLVEOPPNSU-UHFFFAOYSA-N 429.436 4.805 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccc(Cl)cc2I)C[C@@H]1CCl 2366680339 QSAWGPNYUATGKF-GXSJLCMTSA-N 438.058 4.794 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1Br 33930185 UZXDLVBBZFPQAB-WDZFZDKYSA-N 436.649 4.565 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4cccc(C)c4C)ccc32)cc1 38649258 VCTCKJCMDWUHNX-AREMUKBSSA-N 440.499 4.814 50 10 IJGE Cc1ccc(-n2nc(C)c(/C=N/NC(=O)COc3ccc(C(C)(C)C)cc3)c2C)cc1C 59159737 CPJQZJHRTARKLY-JFLMPSFJSA-N 432.568 4.933 50 10 IJGE CC[C@](C)(CCBr)NC(=O)c1cc(Br)cc(Br)c1 228575860 OXMQMTYBWQJYKA-CYBMUJFWSA-N 441.989 4.895 50 10 IJGE Cc1ccc(OCc2ccc(C(=O)NN=Cc3cccn3-c3cccc([N+](=O)[O-])c3)o2)cc1 254449095 MDYATDDZOJMQDT-UHFFFAOYSA-N 444.447 4.630 50 10 IJGE CCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3ccccc3)cc2OCC)cc1 254750705 PJLHBLBGDNAWGS-UHFFFAOYSA-N 446.503 4.857 50 10 IJGE CSc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CI)cc1 382700832 YJEHPILNCCOHBA-ZFWWWQNUSA-N 433.355 4.794 50 10 IJGE C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F 792383459 CJKCWSYAPCDITB-ITMYJUKJSA-N 448.816 4.644 50 10 IJGE CC(=O)N1CCc2c(NC(=O)/C(C#N)=C/c3cc(C)n(-c4ccc(F)cc4)c3C)cccc21 1523625831 JQNKGCXISFHLDH-XSFVSMFZSA-N 442.494 4.688 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1 1567963630 KHSBVGRTBDGBCR-UHFFFAOYSA-N 438.487 4.564 50 10 IJGE CC(=O)[C@@H](Br)c1cccc(I)c1SC(F)(F)F 1848425893 OVVMPBIFOSLHAB-MRVPVSSYSA-N 439.034 4.928 50 10 IJGE Cc1nn(Cc2cccc(F)c2)c2c1[C@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 1865685188 FKUKDQLTDPOAFH-GOSISDBHSA-N 429.282 4.904 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CC)cc1 1865689704 CRNVJOQMPOMTPY-JOCHJYFZSA-N 444.535 4.976 50 10 IJGE C[C@H]1C[C@@H](CBr)CN1Cc1ccc(Br)cc1Br 1950534775 HJMPIHCREDEHGR-UWVGGRQHSA-N 425.990 4.817 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)c(F)cc1F 2008314194 UDJDSIMYQFXIPV-NSHDSACASA-N 438.721 4.593 50 10 IJGE C=CC[C@@H](CBr)CNC(=O)c1csc(Br)c1Br 2023511711 OCZYBUXYINYLDZ-ZETCQYMHSA-N 446.002 4.590 50 10 IJGE CC(C)(C)[C@H](Br)CNC(=O)c1cccc(Br)c1Br 2031480279 UCQMHZTYVBLAFB-SNVBAGLBSA-N 441.989 4.751 50 10 IJGE CC(C)(CCBr)CNC(=O)c1cccc(Br)c1Br 2031486991 PLEVTMLBMGUECH-UHFFFAOYSA-N 441.989 4.753 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CCSC[C@H]1CCBr 2052454660 UWHLIWFZATUNPJ-SSDOTTSWSA-N 433.618 4.507 50 10 IJGE CCC[C@H](CBr)CN=[S@@](=O)(C(C)C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2063272925 HDRADNITVXZJIW-ITNZAGEZSA-N 439.460 4.683 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@@H](Cl)C(F)(F)CC1 2093942057 JMFXNXBRWROCDS-SSDOTTSWSA-N 437.531 4.752 50 10 IJGE COc1ccc(NC(=O)[C@H](Br)C2CCCC2)cc1NC(=O)OC(C)(C)C 2110720256 BVTVPQQQQSTEOO-MRXNPFEDSA-N 427.339 4.934 50 10 IJGE CC(C)(C)OC(=O)N(CC(F)F)[C@H]1CCCN(C[C@H](CBr)CC2CC2)C1 2112865630 DRBRDFSWSIUKLW-HOTGVXAUSA-N 439.385 4.764 50 10 IJGE CC(C)(C)[C@H]1C[C@@H](CBr)CN(C(=O)NCCCOCc2ccccc2)C1 2116471416 VBEWFQSBJRLXMS-OALUTQOASA-N 425.411 4.682 50 10 IJGE O=C(N[C@@H]1C[C@H]2CC[C@H]1[C@H](Cl)C2)c1scc(Br)c1Br 2139715167 RCZAEJHVZBVASX-AKEJEFCPSA-N 427.589 4.799 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(NC(=O)[C@H](Br)C3CCCC3)CCCCC[C@H]12 2167031752 JSIWQPRITJAYMN-CSODHUTKSA-N 443.426 4.769 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCc2ccccc2N(CC2(CBr)CC(F)C2)C1 2280358850 IFOCWNGRKBWAMQ-BATSVXPKSA-N 441.385 4.846 50 10 IJGE O=C(N[C@H](CCl)CC1CCCC1)c1ccc(Cl)c(I)c1 2283663760 ONTHGPDUPOSAKH-LBPRGKRZSA-N 426.125 4.862 50 10 IJGE CS(=O)(=O)c1cscc1[C@@H](Br)c1cc(F)c(Br)cc1F 2288501988 WSDAQQIYEKOKOP-LBPRGKRZSA-N 446.132 4.677 50 10 IJGE CCC[C@@H](CCCl)CNC(=O)Cc1cc(Br)cc(Br)c1 2295316230 WASUZZLZCDTFNP-NSHDSACASA-N 425.592 4.916 50 10 IJGE CCCCCCOc1ccc(C=C(C#N)C(=O)Nc2ccc3c(c2)OCCO3)cc1OC 2314717138 OPMAHMXOPDAUIM-UHFFFAOYSA-N 436.508 4.971 50 10 IJGE C[C@]1(CBr)C=CCCN1Cc1ccc(Cl)c(I)c1 2315548873 LWLUURIBKJTPNL-CQSZACIVSA-N 440.550 4.860 50 10 IJGE ClC[C@H]1CCCN(Cc2ccc(I)c(Br)c2)CC1 2325224094 TWFCZVDNWKQBJZ-NSHDSACASA-N 442.566 4.895 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@H]1CCCCN1C[C@]1(CBr)CC1(F)F 2326918162 ZHDZDRXNBIGDSZ-CXAGYDPISA-N 425.358 4.565 50 10 IJGE CC1(C)CC2(C1)CC(CBr)(Cc1ncc(I)cn1)C2 2353305646 LYOPHEZRTCYNAO-UHFFFAOYSA-N 435.147 4.605 50 10 IJGE O=C(CNc1ccc2ccccc2c1)N/N=C/c1ccc(OC(=O)/C=C/c2ccco2)cc1 3038634 KVDIIRXMHFUMIU-AWCMJFRQSA-N 439.471 4.614 50 10 IJGE COc1ccc(Cl)c2sc(NNC(=O)COc3ccc(Cl)cc3Cl)nc12 9447639 AFQBTYDFMNOSEX-UHFFFAOYSA-N 432.716 4.787 50 10 IJGE Cc1ccccc1C(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(-c3ccccc3)cc2)cc1 12578834 RYBNIVNQNWOEOE-UHFFFAOYSA-N 449.510 4.989 50 10 IJGE COc1ccc(/C=N/NC(=O)COc2ccc(C(C)(C)C)cc2Br)c(C)c1C 14014698 FPCOUGZHTNBJTG-WYMPLXKRSA-N 447.373 4.901 50 10 IJGE COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(Cl)c2)cc1 38651124 NUKNVVPBIOBQSN-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE CC(C)Oc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccs2)cc1 38656422 CYWDYPUDXIECAN-JOCHJYFZSA-N 432.501 4.973 50 10 IJGE CCCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccco3)ccc21 40529712 RLQHHRCXRPQJEQ-QHCPKHFHSA-N 430.460 4.896 50 10 IJGE Cc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)N3c4ccccc4C[C@H]3C)c(C)c21 40811485 VLQAVMHUYZUAAL-QPGLCGFSSA-N 441.531 4.958 50 10 IJGE COc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)Oc4ccc(C)cc4)c(C)c32)cc1 40813890 GPAGGUSDWORFIJ-LHLOQNFPSA-N 432.476 4.595 50 10 IJGE CSc1ccc(/C=C2/CNCC3=C2OC(N)=C(C#N)[C@@H]3c2ccc(SC)cc2)cc1 98064695 HFJDDCKHGKRXBV-AAKHDSTQSA-N 433.602 4.879 50 10 IJGE N#Cc1cc(Br)ccc1-n1c(CCl)nc2cc(Br)cnc21 132710236 WYMXFTFKERUXNL-UHFFFAOYSA-N 426.499 4.556 50 10 IJGE CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)NN=Cc1cccc(Oc2ccccc2)c1 252618580 LHTDVZYQGDZNQS-DVECYGJZSA-N 429.520 4.774 50 10 IJGE CC1(CC(=O)NN=Cc2cn(Cc3ccc(F)cc3)c3ccccc23)SCCS1 254608223 PXHMQHIIBWGKOX-UHFFFAOYSA-N 427.570 4.865 50 10 IJGE CC1(C)O[C@H]2[C@H](O1)[C@H](CO[Si](C)(C)C(C)(C)C)O[C@H]2n1ccc2c(Cl)ncnc21 306146916 PTFANUVYJLNMOM-JTOWHCCKSA-N 440.016 4.524 50 10 IJGE ClCc1csc2c(I)c(I)ccc12 306830557 JEJBWHVSHXWCIH-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)ccc2n1C[C@H]1CN(Cc2ccccc2)CCO1 312356613 AJZDCFLWYAIMQX-MAUKXSAKSA-N 448.792 5.000 50 10 IJGE CC(C)(C)[C@@H](CBr)NC(=O)c1cc(Br)ccc1Br 393962188 TWGAVJUZVSSAMY-LLVKDONJSA-N 441.989 4.751 50 10 IJGE C[C@]1(CBr)CCCN1C(=O)c1cc(Br)sc1Br 723002911 BCSJBAWVZPAGFM-LLVKDONJSA-N 446.002 4.663 50 10 IJGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12 730768282 BONFQGCIHCVTTE-NHCUHLMSSA-N 427.529 4.836 50 10 IJGE O=C(CCCc1ccccc1)NN=Cc1ccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 1084041465 BYZGIBYVZGNNGG-UHFFFAOYSA-N 448.435 4.768 50 10 IJGE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)Cc1ccc2ccccc2c1 1182367601 YHUWKQRVKDDSMC-NTCAYCPXSA-N 428.410 4.532 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CC2c3ccccc3Oc3ccccc32)c1C 1339308029 MQWLUJTTWBHZBL-UHFFFAOYSA-N 437.503 4.926 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc3ccccc23)c1C)C1CCOCC1 1532934030 JBYDNQFPOWMGMC-FCYPAOMHSA-N 437.543 4.699 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1)c1ccccc1 1557178497 OTWPEIUVZRUTGP-FIWMFUAISA-N 439.906 4.515 50 10 IJGE CC(=O)[C@H](Br)c1ccc(SC(F)(F)F)cc1I 1848425809 AYHXGDLWODPENM-VIFPVBQESA-N 439.034 4.928 50 10 IJGE CC(=O)[C@H](Br)c1c(I)cccc1SC(F)(F)F 1848425900 PIKJANLNMSSSDJ-VIFPVBQESA-N 439.034 4.928 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2c(F)cccc2Cl)[C@@H]1c1ccco1 1865697960 GWWBFHGLXQGVPZ-AWEZNQCLSA-N 438.768 4.554 50 10 IJGE CC(C)CSc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)cc1 1865757946 BTHZTIYZUUQVJV-ZDUSSCGKSA-N 441.380 4.970 50 10 IJGE COc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1ccccc1)[C@@H](CBr)C(C)C 1915270228 CZARFZJDFIJNDX-SFHVURJKSA-N 435.318 4.665 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1ccc(Br)cc1 1916375354 UIJHOUOOOXTROG-KRWDZBQOSA-N 441.163 4.501 50 10 IJGE O=S(=O)(c1ccc(CCl)c(Br)c1)N(Cc1ccccc1)CC(F)F 1946836708 YZYSCWAUYLSMFU-UHFFFAOYSA-N 438.721 4.644 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@@H]2CC[C@H]3CC[C@H]2C3)C1 1947124339 RLGDHLKHQCFEJR-YYAJDYIMSA-N 449.373 4.786 50 10 IJGE F[C@H]1CCO[C@H]1COc1c(Br)cc(Br)cc1CBr 2058656548 SGSHKLRRVUKHCC-QWRGUYRKSA-N 446.936 4.612 50 10 IJGE CC[C@H](C)[C@H](CI)NCc1c(F)ccc(Br)c1F 2081240355 HEOTYCLVPRCHNE-UFBFGSQYSA-N 432.090 4.667 50 10 IJGE C[C@@H]1C[C@@H](O[C@@H](CI)c2cccc(Br)c2)CCO1 2084725840 RTXPSHQUIMUQIP-SWHYSGLUSA-N 425.104 4.509 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@H](CBr)c2ccccc2)C(C)(C)C1 2106784101 FZUZPMZSEJVPOJ-QZTJIDSGSA-N 425.411 4.933 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@H](CCl)C12CCC2 2133828014 OKOPUMXZIZSKCX-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE CCCC(CBr)(CCC)CN1CCC[C@H](N(CCO)C(=O)OC(C)(C)C)C1 2163063674 QVVOCCZOGIDDQC-SFHVURJKSA-N 449.474 4.662 50 10 IJGE Brc1ccccc1[C@@H](CI)OC1CC(n2ccnc2)C1 2183689727 UIRTUCYWJUIFDW-KOHJWAIASA-N 447.114 4.542 50 10 IJGE CC(C)CNCc1cc(Br)cc(Br)c1OC[C@H]1C[C@H]1Cl 2196897175 VTVQZXSOVIGYQK-BXUZGUMPSA-N 425.592 4.963 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 2241493228 KWZHFAIHISXCKP-HRCADAONSA-N 449.430 4.804 50 10 IJGE CC1CC(CBr)(CN2CCC[C@@H](c3n[nH]cc3NC(=O)OC(C)(C)C)C2)C1 2280052542 SVNOKTOFGQSCOK-RDYUPDBUSA-N 441.414 4.747 50 10 IJGE CCn1nc(C)c(CBr)c1N(C)[C@@H]1C[C@@H]2C[C@H](OCc3ccccc3)C[C@@H]21 2281304019 QNLLDGHPQMKYTK-VNYTWHDVSA-N 432.406 4.926 50 10 IJGE COc1cccc(NC(=O)C(C#N)=Cc2ccc(OCc3ccc(C(=O)O)cc3)cc2)c1 2294156158 VBMIEEAWYCFKNP-UHFFFAOYSA-N 428.444 4.518 50 10 IJGE CCOC(=O)c1c(-c2ccc(F)cc2)csc1NC(=O)C(C#N)=Cc1ccc(O)cc1 2295872389 ZXVRKASKVVOLGR-UHFFFAOYSA-N 436.464 4.982 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Cl)c(I)c2)[C@H]1CBr 2300238633 NFLGGKCUEDNVQC-RNCFNFMXSA-N 428.539 4.550 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(C)C[C@H]2CC[C@H]1C[C@@]21CCC[C@H](CI)O1 2307493728 XVMSBJAXCXCSOF-HIBCTMLNSA-N 449.373 4.833 50 10 IJGE C=CC[C@@H](Br)[C@@H]1CCN1Cc1ccc(I)c(Cl)c1 2314255349 SXHICLSCQXDKQW-RISCZKNCSA-N 440.550 4.859 50 10 IJGE C[C@@H](Br)CCCN(C)C(=O)c1cc(Cl)ccc1I 2314466121 PPXZGZUWTXBTLM-SECBINFHSA-N 444.538 4.580 50 10 IJGE CCCOc1ccc(C=C2C(=O)N(CCc3ccccc3)C(=O)C(C#N)=C2C)cc1OCC 2314617335 WIACLDJBRJXPBV-UHFFFAOYSA-N 444.531 4.709 50 10 IJGE C[C@@H](Br)C1CCN(Cc2ccc(Cl)c(I)c2)CC1 2315551933 XOXZKAWCVGWUFU-SNVBAGLBSA-N 442.566 4.940 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@H]1[C@H]2COC[C@H]21 2317423089 NBKGETAOAXXVAW-SSDHTEECSA-N 442.948 4.988 50 10 IJGE COc1ccc(Cl)c(CC(=O)NN=Cc2cccc(OC)c2OCc2ccccc2)c1 2323675893 YOFZBFMRXMAZKM-UHFFFAOYSA-N 438.911 4.629 50 10 IJGE CCCCOC(=O)c1ccccc1NC=C(C#N)C(=O)N1CCC(Cc2ccccc2)CC1 2324765227 OWYCYVWCJFRNND-UHFFFAOYSA-N 445.563 4.944 50 10 IJGE CC1(C)CC(CBr)(CN2CCCN(C(=O)OC(C)(C)C)CC(F)(F)C2)C1 2345005175 VIRLESGADLMYKC-UHFFFAOYSA-N 439.385 4.766 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(CBr)c(F)c2)c1I 2367669650 XLIBKGQDWQONKG-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE CC[C@H](C)c1ccccc1OCC(=O)NNC(=O)[C@H](C)Oc1ccccc1[C@@H](C)CC 9871292 XMLIQPCEBUCTLO-FHWLQOOXSA-N 426.557 4.707 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(=O)Nc1ccc(C(=O)O)cc1 33887700 OIVAJSVLGITGSM-LCYFTJDESA-N 437.795 4.752 50 10 IJGE COc1ccc(NC(=O)/C(C#N)=C\N(Cc2ccccc2)Cc2ccccc2)cc1OC 216732564 XVABGRAINXMAHC-QOCHGBHMSA-N 427.504 4.752 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)N/C=C(/C#N)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 217228593 PLWDYXJSNAZNEN-QAALXFNPSA-N 428.876 4.652 50 10 IJGE CO[C@@H](C)CC(CBr)(CBr)c1ccc(Br)cc1 228630558 MUZKLTVZUFQBNN-JTQLQIEISA-N 428.990 4.902 50 10 IJGE FC(F)C(F)(F)[C@@H](Br)c1cc(I)cc2c1OCC2 302558228 XNHKWCROSSGOMH-VIFPVBQESA-N 438.984 4.563 50 10 IJGE ClCc1cc(I)c(I)c2ccsc12 307096523 DQPMVQUCZDLLEH-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE O=C(OCc1ccccc1)N1C[C@@H](CI)[C@@H](c2ccc(F)cc2)C1 382709070 WGXAVPCSASKOSJ-SJLPKXTDSA-N 439.268 4.613 50 10 IJGE ClCc1nc2c(Br)cccc2n1CC[C@@H]1CN(Cc2ccccc2)CCO1 383766275 PSRZOHGKAPJPRF-QGZVFWFLSA-N 448.792 4.829 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1cccc([C@H]2Cc3ccccc3N(S(N)(=O)=O)C2)c1 616689210 AUABWFUSXZLDNU-NRFANRHFSA-N 446.689 4.601 50 10 IJGE FC(F)(F)c1cc(Br)cnc1N1CCS[C@@H](CCBr)C1 720089595 YZHIZGCZJPWDHO-VIFPVBQESA-N 434.119 4.570 50 10 IJGE CSc1ccc([C@@H](C)NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cc1 799066496 FHVUMZDHLCJTNX-AFDUHFSSSA-N 441.560 4.970 50 10 IJGE CC(=NNC(=O)CSc1nc2ccccc2[nH]1)c1ccc(OCc2ccccc2)cc1 1084000393 HJNXOPXVTGTHGA-UHFFFAOYSA-N 430.533 4.774 50 10 IJGE CCCCOc1ccc(OCC(=O)NN=Cc2cc(Br)ccc2OCC)cc1 1084554313 PULSGPRXYMJRCY-UHFFFAOYSA-N 449.345 4.556 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)c1C 1116103357 DVBYJKCWERVPHC-UHFFFAOYSA-N 446.942 4.973 50 10 IJGE C#CC[C@@H]1CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1 1461812151 ILZPDVHGWPGIGF-BAOGCXAUSA-N 425.454 4.892 50 10 IJGE C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccc(OCc2ccccc2)cc1 1557605621 KYZVUVSBADOEEM-HXUWFJFHSA-N 445.947 4.745 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CC)cc1 1865694170 QUFDTBLBDWQOIZ-NRFANRHFSA-N 430.508 4.586 50 10 IJGE CC1(C)[C@H](Br)CCN1Cc1cccc(Br)c1Br 1943882393 VQUCJWJJNBPGNN-LLVKDONJSA-N 425.990 4.959 50 10 IJGE O=C(Nc1ccc(Cl)c(I)c1Cl)C1CC(Br)C1 2020148822 SOZJMBGCAWSVSH-UHFFFAOYSA-N 448.913 4.710 50 10 IJGE C=CC[C@@H](CBr)CNC(=O)c1cc(Br)sc1Br 2023522052 YFFDDWYQTFDRCY-ZETCQYMHSA-N 446.002 4.590 50 10 IJGE BrC[C@H]1C[C@H]2CC[C@H]1N2Cc1cccc(Br)c1Br 2039487722 JNSYZZFYZKXGAO-NQBHXWOUSA-N 438.001 4.959 50 10 IJGE Br[C@@H](Cc1ccc2c(c1)CCO2)c1sccc1I 2049595053 GZLKWHIULIJIPG-NSHDSACASA-N 435.124 4.966 50 10 IJGE BrC[C@@H]1C[C@H]2CN(Cc3cccc(Br)c3Br)C[C@@H]12 2053982118 KKOBDCRZKIFNKX-SRVKXCTJSA-N 438.001 4.674 50 10 IJGE CC[C@@H](Cl)[C@H]1CCCCN1c1ncc(I)cc1Br 2069530442 XDJJMJVVMUTLKO-VXGBXAGGSA-N 443.554 4.825 50 10 IJGE O=S1(=O)CCCC[C@H]1[C@H](Br)c1cc(C2CC2)c(Br)s1 2094674345 UTZUKEVJJKCPFX-NWDGAFQWSA-N 428.211 4.791 50 10 IJGE Cc1cc([C@@H](Br)c2cc(I)cc3c2OCC3)oc1C 2132687450 VGMXVYHOYMLNPK-AWEZNQCLSA-N 433.083 4.920 50 10 IJGE CC[C@@H](Cl)[C@H]1CCCCN1C(=O)c1cc(Cl)ccc1I 2170620508 ZEYJALZJRJKDSP-TZMCWYRMSA-N 426.125 4.957 50 10 IJGE CO[C@]1(CN(C)c2c(CBr)ccc(Br)c2Cl)CCSC1 2186290325 BNMMARHQIPXTPI-AWEZNQCLSA-N 443.632 4.956 50 10 IJGE C[C@]1(CC(CBr)(CBr)c2ccc(F)cc2)CSCCO1 2201228219 PMJRQCUVFBWYGN-AWEZNQCLSA-N 426.189 4.766 50 10 IJGE BrCC1(CN2CC[C@H]3COC[C@@H](C2)N3Cc2ccccc2)CCCCCC1 2204517204 CHFFYVHZMFZNLL-FCHUYYIVSA-N 435.450 4.697 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)S(=O)(=O)Cc1ccsc1Br 2210633372 ZWTKRQNSFGYLJK-HNNXBMFYSA-N 436.824 4.860 50 10 IJGE Cn1ncc(-n2c(CCl)nc3cc(Br)c(Br)cc32)c1Cl 2234074085 LOJVAWFRJBJUAJ-UHFFFAOYSA-N 438.938 4.676 50 10 IJGE C=CC[C@@]1(CBr)CCN(c2ncc(Br)cc2Br)C1 2259498514 DHVSYRJSCLMOII-ZDUSSCGKSA-N 438.989 4.774 50 10 IJGE O=C(N[C@@H](CCBr)C(F)(F)F)c1cc(Br)c(F)cc1Cl 2285845955 HYKCHJLVPRQWHZ-VIFPVBQESA-N 441.444 4.687 50 10 IJGE O=C(N[C@@H]1CC[C@@H]2C[C@]21CBr)c1cc(Br)c(F)cc1Cl 2285963913 RAVSBVAIYTZLSY-PYSYBHHASA-N 425.523 4.535 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@@H](Br)[C@]1(C)COCCO1 2295363052 QYHGJDYRZXRPNK-KGLIPLIRSA-N 428.548 4.661 50 10 IJGE Clc1ccc(COc2ccc(CBr)nc2)cc1I 2315594761 YSKQZLWIPYZODF-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Br)Cc1cccc(F)c1 2316834680 SIXQOVYCEJOCKM-SECBINFHSA-N 440.936 4.763 50 10 IJGE CCCCCOc1ccc(C=NNC(=O)c2cccn(Cc3cccc(C)c3)c2=O)cc1 2323620141 AQQCOLRXYWVQNR-UHFFFAOYSA-N 431.536 4.538 50 10 IJGE CCCOc1cc(C=NNC(=O)c2ccc3nc(-c4ccccc4)[nH]c3c2)ccc1OC 2323744764 CSQDSDYPNQMZIV-UHFFFAOYSA-N 428.492 4.791 50 10 IJGE ClC[C@@]1(Cc2ccc(I)c(Br)c2)C[C@]12CCOC2 2325221076 KYWHIDZTMDFJSG-UONOGXRCSA-N 441.534 4.632 50 10 IJGE CN(C[C@]1(CBr)CC1(F)F)C1(CNC(=O)OC(C)(C)C)CCCCC1 2326917675 SBSVCGFEXLHXCG-MRXNPFEDSA-N 425.358 4.566 50 10 IJGE C[C@@H]1C[C@@H](CBr)CCN1Cc1cc(I)ccc1Cl 2327401054 LXNTVYFJRKUQFE-MNOVXSKESA-N 442.566 4.940 50 10 IJGE Clc1cc(Br)c(CN2CC3(CCOCC3)[C@H]2CBr)s1 2352873444 JPVLCAWBJSMZLL-LLVKDONJSA-N 429.605 4.540 50 10 IJGE FC(F)(F)[C@@H]1[C@@H](Br)CCCN1Cc1ncc(Br)cc1Cl 2370295050 QEQIHSJKSGHWLU-KWQFWETISA-N 436.497 4.788 50 10 IJGE Clc1cc(Br)ccc1CN(CCCBr)C1CCOCC1 2381155096 XEECGGQWTSNRFV-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccs2)cc1C 38656529 GPNAJDKQEPUEIX-QHCPKHFHSA-N 432.501 4.568 50 10 IJGE Cc1cc(/C=N/NC(=O)c2cc3ccccc3o2)c(C)n1-c1cc(C(=O)O)ccc1Cl 59680158 KQVSREDVBVICQX-BRJLIKDPSA-N 435.867 4.956 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C\c2ccccc2OCCC)cc1 207161160 RWLMGFLGYFMJJD-LOUIZWKLSA-N 432.520 4.917 50 10 IJGE CC(=NNC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCc1ccc(C)cc1 397029381 KKWUSBALTSNHHG-UHFFFAOYSA-N 427.504 4.526 50 10 IJGE Cc1cc(C(=O)NNc2ccc(Br)cc2)ccc1NC(=O)c1cccs1 759658742 JUNOXXVJYCFLDG-UHFFFAOYSA-N 430.327 4.828 50 10 IJGE COc1ccccc1Nc1nc2sc(C(=O)NNc3ccc([N+](=O)[O-])cc3)cc2s1 768248611 REXDCNRWLZPDNK-UHFFFAOYSA-N 441.494 4.775 50 10 IJGE CCN(Cc1c[nH]c2ccccc12)C(=O)/C(C#N)=C\c1cc(C)n(C[C@H]2CCCO2)c1C 785803669 YJHNLSNLYHAMSC-QCHPHUCNSA-N 430.552 4.721 50 10 IJGE COc1cccc(Cc2cnc(NC(=O)NNc3ccc(C#N)cc3C(F)(F)F)s2)c1 799382586 ZVFRMCPWSZNGPQ-UHFFFAOYSA-N 447.442 4.782 50 10 IJGE CCCc1cccc(C(C)C)c1NC(=O)C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799841655 MGPGSGZLLYDIQB-UHFFFAOYSA-N 432.446 4.735 50 10 IJGE Cc1ccc(NC(=O)c2c(-n3c(C)cc(C=NNC(N)=O)c3C)sc3c2CCCC3)cc1 1083944055 MUYUFBIWVPWANH-UHFFFAOYSA-N 449.580 4.597 50 10 IJGE C=C1CCC(CNC(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)CC1 1313258297 NSXNJAYAYCPAID-UHFFFAOYSA-N 427.932 4.609 50 10 IJGE C#CCCN(CC(F)(F)F)C(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(OCC)cc2)c1C 1458686905 BIUFKIQCMXIKMH-ZHZULCJRSA-N 443.469 4.814 50 10 IJGE CC(=O)c1cc(C(=O)NNc2ccc(S(=O)(=O)c3ccc(C(C)C)cc3)cc2)cs1 1521104292 UAYZJSYDIUDBLP-UHFFFAOYSA-N 442.562 4.664 50 10 IJGE C#CCC(C)(C)C(=O)NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1 1521750184 OWZUFPILMOAOLA-UHFFFAOYSA-N 426.516 4.743 50 10 IJGE COc1ccc(C=NNC(=O)COc2ccc(C)cc2C(C)(C)C)cc1Br 1772752295 QRQPBNXDSDEGII-UHFFFAOYSA-N 433.346 4.593 50 10 IJGE CCOC(=O)c1c(-c2cccc([N+](=O)[O-])c2)csc1NC(=O)[C@H](Br)CC 1859486376 KQGGTZARRABINQ-CYBMUJFWSA-N 441.303 4.612 50 10 IJGE CCc1nn(-c2ccc(OC)cc2)c2c1[C@@H](c1ccc(C(C)(C)C)cc1)C(C#N)=C(N)O2 1865682839 YPBAKCJMAQBKQZ-QFIPXVFZSA-N 428.536 4.959 50 10 IJGE CCCc1nn(Cc2ccc(C)cc2)c2c1[C@H](c1ccc(OCC)cc1)C(C#N)=C(N)O2 1865693669 LQLYZDLPDZHXIF-HSZRJFAPSA-N 428.536 4.809 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)Cc1c(Br)cccc1Br 1882069049 DKRSXSLFVUEXLB-VIFPVBQESA-N 427.564 4.886 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1cc(Br)sn1 1884458864 KSGHHMXRLJEBKV-LBPRGKRZSA-N 432.181 4.722 50 10 IJGE C[C@H](Br)C(C)(C)CNC(=O)c1cc(Br)c(Br)s1 1913830631 QRZLLWPAAFMCBK-LURJTMIESA-N 448.018 4.813 50 10 IJGE CC[C@@H](Cl)C(=O)Nc1c(Br)cc(Br)cc1Br 1976905668 XOEIHSQZUAZHGG-MRVPVSSYSA-N 434.353 4.930 50 10 IJGE CC[C@H](Cl)C(=O)Nc1c(Br)cc(Br)cc1Br 1976905671 XOEIHSQZUAZHGG-QMMMGPOBSA-N 434.353 4.930 50 10 IJGE C[C@H]1[C@H](Br)CCCN1Cc1cc(Br)ccc1Br 2006508119 OUOHOCDLVXDSAR-JOYOIKCWSA-N 425.990 4.959 50 10 IJGE COc1cc(CBr)cc(Br)c1OC[C@H]1C[C@H]1Br 2020240859 LAUWDUVYEWCGBA-RKDXNWHRSA-N 428.946 4.515 50 10 IJGE BrC[C@@H]1[C@H]2CCN(Cc3cc(Br)ccc3Br)C[C@@H]21 2054718414 NDKWZRDQNVXNBM-UPJWGTAASA-N 438.001 4.674 50 10 IJGE Brc1cccc(CN2C[C@H]3CC(Br)C[C@@H]3C2)c1Br 2065397099 LVSSHZLPHHUTSC-GHMZBOCLSA-N 438.001 4.817 50 10 IJGE CC1(CBr)CCN(Cc2ccc(I)c(Cl)c2)CC1 2086659487 WOCSRIAHRMDCRZ-UHFFFAOYSA-N 442.566 4.942 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@H](CBr)CC2CC2)CC[C@@H]1C(F)(F)F 2112873943 HWGVUXATFBZRKL-QLFBSQMISA-N 443.348 4.575 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@H](CNC(=O)[C@H](Br)C1CCCC1)c1ccccc1 2175021215 UENZEMKJRKETQC-QZTJIDSGSA-N 439.394 4.665 50 10 IJGE C[C@@H](Cl)c1nc2ccc(Br)cc2n1C[C@@H]1COCCN1Cc1ccccc1 2194650395 RNSNEDHQHGFHEG-CRAIPNDOSA-N 448.792 5.000 50 10 IJGE O=S(=O)(CCC(CCl)CCl)Nc1c(Cl)cc(Cl)cc1Br 2203048497 MFUWGQWRLGBUCM-UHFFFAOYSA-N 444.005 4.982 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Cl)c1c(Br)cnn1C 2264356972 SPBMOPPRPKUNES-JTQLQIEISA-N 428.939 4.935 50 10 IJGE O=C(NCC[C@H]1CCCC[C@@H]1Cl)c1ccc(Cl)c(I)c1 2283671083 WXNHXQKFTZGYIX-PWSUYJOCSA-N 426.125 4.862 50 10 IJGE C[C@H]1[C@H](Br)C[C@@H](C)CN1C(=O)c1cc(Br)c(F)cc1Cl 2285847492 BYPLLCPXOMEVKE-KHQFGBGNSA-N 427.539 4.876 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2-c1csnc1Br 2286083104 FPCSFXQJLPPPSI-UHFFFAOYSA-N 437.544 4.754 50 10 IJGE N#CC(=Cc1cc2c(cc1[N+](=O)[O-])OCO2)C(=O)Nc1ccccc1Oc1ccccc1 2297381892 OGXIMKABRYMKFL-UHFFFAOYSA-N 429.388 4.661 50 10 IJGE Clc1ccc(C[C@]2(CBr)CC=CCO2)c(I)c1 2302328923 NPLJZNVOAFRLDU-ZDUSSCGKSA-N 427.507 4.597 50 10 IJGE C[C@H](Cl)CCCN(C)C(=O)c1ccc(I)c(Br)c1 2314480678 LVALPFRSLPHAOO-VIFPVBQESA-N 444.538 4.533 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)c(I)c2)C[C@@H]1CBr 2315551257 ORJYEYJKDUVMLJ-NSHDSACASA-N 442.566 4.798 50 10 IJGE FC(F)(CBr)C(F)(F)CNCc1cccc(Cl)c1Br 2336537445 WXLHZCBIXULACS-UHFFFAOYSA-N 427.461 4.858 50 10 IJGE C[C@@H]1CCCN(C[C@@]2(CBr)CC2(F)F)[C@@H]1CCCNC(=O)OC(C)(C)C 2351886102 UATYCCRTQMMPJZ-RKVPGOIHSA-N 439.385 4.812 50 10 IJGE C=CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(F)cc4)ccc32)c1 38684520 LEALWICSJPLADK-DEOSSOPVSA-N 442.446 4.828 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccc1C)CCC2 40811470 XGSAJUVFWVPEAW-TURZUDJPSA-N 445.519 4.936 50 10 IJGE COC(=O)c1ccc(C(=O)OC)c(N/C=C(/C#N)c2nc(-c3ccc(C)c(C)c3)cs2)c1 102421000 RCRCUFKYVFIBMI-PDGQHHTCSA-N 447.516 4.977 50 10 IJGE O=[N+]([O-])c1ccc(CBr)cc1OCc1ccc(I)cc1 115901868 RWEGZUHJDLVLCS-UHFFFAOYSA-N 448.054 4.673 50 10 IJGE COc1cccc([C@H](Br)c2cc(I)cc3c2OCC3)c1 312246982 BOZOJJBWEHFMJU-HNNXBMFYSA-N 445.094 4.719 50 10 IJGE Cn1ncc([C@@H](Br)c2csc3ccccc23)c1I 379143742 BWDJKDHBVUVBRC-GFCCVEGCSA-N 433.112 4.724 50 10 IJGE CC(C)(C(F)F)[C@H](Br)c1cc(I)cc2c1OCC2 698465015 BZWJPEHHBAFOFK-LLVKDONJSA-N 431.058 4.953 50 10 IJGE COc1ccc(NS(=O)(=O)c2cccc(C(=O)NN=C(C)CCC3CCCC3)c2)cc1 740760285 PUUYTXXXQNAGJJ-UHFFFAOYSA-N 443.569 4.572 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])cc1Br)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 741442627 MMTAIRGNPUFWAW-NEPJUHHUSA-N 446.175 4.965 50 10 IJGE Cc1cc(C)c(CC(=O)NNc2nc3ccccc3[nH]c2=S)c(C)c1Br 1453768651 USAXHOOBXWJGCG-UHFFFAOYSA-N 431.359 4.666 50 10 IJGE COc1ccc(/C(C#N)=C/c2ccc(OC(=O)Cc3cccs3)c(OC)c2)cc1OC 1615065962 ALMJJWGCOOYYSK-WOJGMQOQSA-N 435.501 4.986 50 10 IJGE Cc1c(C(=O)Oc2ccc3ccccc3c2)oc2c1C(=NNC(=O)c1ccncc1)CCC2 1772745946 NQFPTODNCNVZQI-UHFFFAOYSA-N 439.471 4.826 50 10 IJGE C[C@H](C1CCC(NC(=O)OC(C)(C)C)CC1)[C@H](CBr)NC(=O)OC(C)(C)C 1882086961 GLUDYOZOFOXJDC-LMPOIIKSSA-N 449.430 4.994 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)Cc1cc(F)c(Cl)c(Cl)c1 1893682558 ZIMFKAYSECPPLU-SNVBAGLBSA-N 431.088 4.735 50 10 IJGE Cl[C@H](c1cc2c(cc1Br)OCCO2)c1csnc1Br 1925249886 FCRMLRIFNPNBHE-LLVKDONJSA-N 425.529 4.768 50 10 IJGE CC(C)C[C@H](CNC(=O)OC(C)(C)C)[C@H]1CC[C@@](C)(CI)O1 1931099596 QHFPIFAWHCJHEL-CPUCHLNUSA-N 425.351 4.546 50 10 IJGE CC1(C)[C@@H](Br)CCN1Cc1c(Br)cccc1Br 1945333728 ULZFAVMEVMNALZ-LBPRGKRZSA-N 425.990 4.959 50 10 IJGE CN(Cc1cc(Cl)ccc1I)CC(C)(C)CBr 1945722738 LDDATQBWSJLXEC-UHFFFAOYSA-N 430.555 4.798 50 10 IJGE CCN(C[C@](C)(CI)OCC1CC2(CC2)C1)C(=O)OC(C)(C)C 1989566544 WLPSFSARWAXESK-KRWDZBQOSA-N 437.362 4.644 50 10 IJGE BrC[C@@]1(Cc2cc(Br)ccc2Br)CCCOC1 2006502301 ZOYQYROLERJPDU-ZDUSSCGKSA-N 426.974 4.946 50 10 IJGE CCC[C@H](CBr)CNC(=O)c1cc(Br)sc1Br 2008108943 NJDPUWOADARGBY-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1cc(F)ccc1Br 2010825314 JGHLIIKMUHYLOH-UHFFFAOYSA-N 439.416 4.584 50 10 IJGE CN[C@@H](c1ccc(Br)c(C)c1Br)[C@H]1C[C@H](Br)C1 2024281143 CSJYJIRSJLKOTG-JRKPZEMJSA-N 425.990 4.954 50 10 IJGE C[C@@]1(CCBr)CCN1Cc1c(Br)cccc1Br 2025225558 VQEYKNXELCTVIK-CYBMUJFWSA-N 425.990 4.961 50 10 IJGE BrC[C@@H]1CC2(CCC2)CN1c1ncc(Br)cc1Br 2034099110 WIQKMFWPLHIXLH-JTQLQIEISA-N 438.989 4.751 50 10 IJGE C[C@@]1([C@H](Br)c2cc(I)cc3c2OCC3)CC1(F)F 2036108001 GPNONSHBDMMIKK-NEPJUHHUSA-N 429.042 4.707 50 10 IJGE CN(C[C@@H](Br)C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 2076788295 RHSHCDXMDJSETD-ZIAGYGMSSA-N 425.289 4.510 50 10 IJGE Cc1cc(Cl)ncc1-n1nc(CCl)c(I)c1C(F)(F)F 2078881578 COSDBSNDVDPICH-UHFFFAOYSA-N 436.002 4.591 50 10 IJGE O=C(N[C@H](CCl)c1cccs1)c1cc(Cl)ccc1I 2119046936 AZMJFVPLLGZFMN-LLVKDONJSA-N 426.106 4.716 50 10 IJGE CC(C)(C)OC(=O)N(CCNC(=O)N1CCC(Br)CC1)C1CCCCCC1 2162488261 SRPZKYYIBDIGDF-UHFFFAOYSA-N 446.430 4.515 50 10 IJGE C[C@@H]1C[C@@H](CCNC(=O)OC(C)(C)C)CCN1C(=O)c1ccc(CBr)cc1 2162879264 ONDUHIBYAHJOLX-CVEARBPZSA-N 439.394 4.737 50 10 IJGE CN(C(=O)c1ccc(Br)c(Cl)c1)[C@H](CCBr)C(F)(F)F 2178515918 QDJVWQTUCYCLSA-SNVBAGLBSA-N 437.481 4.890 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1sc(C)c(Br)c1C 2226086653 RYIMONCTWRIHQU-JTQLQIEISA-N 429.243 4.764 50 10 IJGE CCOCc1cc(Br)c([C@H](Br)[C@@]23COC[C@@H]2C3(F)F)s1 2233017401 XJOHFQODAUTSHF-ZMLRMANQSA-N 432.124 4.765 50 10 IJGE COc1ccc([C@H](Br)[C@@H](C)[C@@H]2CCCO2)cc1I 2257373780 ONOGCELSGPSSIX-DUFXMDAXSA-N 425.104 4.551 50 10 IJGE CN(Cc1ccc(I)cc1)c1cccc(F)c1CBr 2265604138 KFMFZIHVHVOQHZ-UHFFFAOYSA-N 434.090 4.962 50 10 IJGE CC1(C)CC[C@@H](CCl)N(C(=O)c2ccc(Cl)c(I)c2)C1 2283670598 UOXPVKDQBHUCAN-NSHDSACASA-N 426.125 4.814 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)C2CC(S(C)(=O)=O)C2)c(C)c1Br 2285271671 OOPCGYOQZBRIFW-FDZGAKKTSA-N 444.616 4.932 50 10 IJGE COc1ccc(NC=C(C#N)c2nc(-c3cc4ccccc4oc3=O)cs2)cc1OC 2296756816 ONYZWKXULUQQSY-UHFFFAOYSA-N 431.473 4.910 50 10 IJGE CC(C)[C@H](CBr)N(C)C(=O)c1csc(Br)c1Br 2302547799 QRSIFORWVVMESY-QMMMGPOBSA-N 448.018 4.765 50 10 IJGE COc1ccc(CNC(=O)C(C#N)=Cc2ccc(OCc3cccc(F)c3)c(OC)c2)cc1 2313738799 PVYTVWLOPYCINS-UHFFFAOYSA-N 446.478 4.645 50 10 IJGE C[C@H](Br)CCCN(C)C(=O)c1cccc(Br)c1Br 2314573432 DZSDDQZKXISANW-VIFPVBQESA-N 441.989 4.847 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Cl)cc2I)C[C@@H]1CBr 2318539437 MBFLMGVTGZIJSZ-PWSUYJOCSA-N 442.566 4.798 50 10 IJGE CC[C@H](NC(=O)C(C#N)=CNc1ccc([N+](=O)[O-])cc1OC)c1ccc2c(c1)CCCC2 2325081432 MVGOOALIUBAUDE-NRFANRHFSA-N 434.496 4.569 50 10 IJGE Clc1ccc(I)cc1CN1[C@H]2CC[C@@H]1C[C@@H]2CBr 2327389774 NUCABRUPJXPCES-IUPBHXKESA-N 440.550 4.692 50 10 IJGE Clc1ccc(I)cc1COc1ccc(CBr)nc1 2327401803 SPVREWXJGBZOMK-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@]3(F)CCC[C@@]3(NC(=O)OC(C)(C)C)C2)C1 2345008195 LXNVZEQSUSKNNM-VQTJNVASSA-N 433.406 4.659 50 10 IJGE CC1(C)CN(C(=O)c2ccc(Cl)cc2I)C[C@H]1CCCl 2365594922 DOAAGGDHKSMKBY-SNVBAGLBSA-N 426.125 4.672 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3)ccc2[C@@H]1c1ccc(Br)cc1 38651564 QWDPBSSIZSBDPT-NRFANRHFSA-N 447.288 4.886 50 10 IJGE CCOc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1cccs1)CCC2 40823654 ZDQOBEIJWIAHHW-PCLIKHOPSA-N 437.521 4.771 50 10 IJGE O=C(N[C@H](COCc1ccccc1)C(=O)Cl)OCC1c2ccccc2-c2ccccc21 98044047 CNSWGDFBUSGOOY-HSZRJFAPSA-N 435.907 4.876 50 10 IJGE CC(C)(CCBr)CNC(=O)c1ccc(Br)cc1Br 227907814 DAUFGPJNSCUYEB-UHFFFAOYSA-N 441.989 4.753 50 10 IJGE COc1cccc(Cn2nc(C)c(C=NNC(=O)c3cc4ccccc4cc3O)c2Cl)c1 254479624 IYETZZFEQWLFBL-UHFFFAOYSA-N 448.910 4.525 50 10 IJGE O=S(=O)(Nc1cc(Cl)cc(Br)c1)c1ccc(CBr)cc1 308319469 PDRWBMHTKDBSSD-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE O=S(=O)(c1ccc(Cl)c(F)c1Cl)N(CCBr)Cc1ccccc1 309680853 YVOUHTGBIWVNKP-UHFFFAOYSA-N 441.149 4.718 50 10 IJGE CCN(C(=O)c1ccc(I)c(Cl)c1)C(C)(C)CBr 688361150 PJELQVQYNDJFJR-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2)C1 714994277 IUIMBSXRFBHHQZ-FCHUYYIVSA-N 427.386 4.708 50 10 IJGE Cc1ccc(F)c(NNC(=O)c2ccccc2NC(=O)c2ccccc2Br)c1 748783470 FHLNILXIEYLFJJ-UHFFFAOYSA-N 442.288 4.906 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2ccc(OCc3ccc(C#N)cc3)c(OCC)c2)cc1 1084274693 BTYVIOIBVFMXOK-UHFFFAOYSA-N 443.503 4.699 50 10 IJGE COc1cc(C=NNC(=O)[C@@H](C)c2ccc(CC(C)C)cc2)cc(Br)c1O 1084370564 OYMHQBZVJAERGE-AWEZNQCLSA-N 433.346 4.616 50 10 IJGE Cc1nn(Cc2ccccc2)c(C)c1C=NNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 1084427214 SAYSAPAGRKWFSB-MRXNPFEDSA-N 445.350 4.773 50 10 IJGE C=CCc1cc(/C=C(\C#N)C(=O)Nc2cccc(Cl)c2Cl)ccc1OCC(=O)OC 1084515006 JMOWPVZVBKEIMJ-LFIBNONCSA-N 445.302 4.819 50 10 IJGE CC(=O)N(CCc1ccccc1)CC(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F 1352091940 WPEQRHQKEONYFA-LJQANCHMSA-N 444.906 4.936 50 10 IJGE O=C(Cc1csc(-c2ccc(Cl)cc2)n1)NNc1nc2ccccc2[nH]c1=S 1453762728 FRDODAJUZLPCEU-UHFFFAOYSA-N 427.942 4.755 50 10 IJGE CC(=O)c1ccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)nc3ccccc23)c(F)c1 1523452870 KFBRCNDEMQNFNE-UHFFFAOYSA-N 441.462 4.627 50 10 IJGE CC(C)(C)[C@@H]1CCc2sc(C(=O)NNC(=O)c3ccc(-c4ccccc4)nc3O)cc2C1 1628467455 WIWXSUJXVGEZQN-QGZVFWFLSA-N 449.576 4.742 50 10 IJGE CC(=O)CCc1ccc(O[C@H](C)C(=O)NNc2cc(Cl)ccc2Br)cc1 1637798399 SMEZHENMHXNPEQ-CYBMUJFWSA-N 439.737 4.535 50 10 IJGE Cc1c(C(=O)NCCc2ccccc2)oc2c1C(=NNC(=O)c1ccc(Cl)cc1)CCC2 1772744071 RIOFAEAJEVBXCY-UHFFFAOYSA-N 449.938 4.684 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(OCC)c(OCC)c1 1865689167 LLABWSSOLAAOLC-QFIPXVFZSA-N 444.535 4.976 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865709856 ISJXSVXEAOVVNQ-FQEVSTJZSA-N 449.898 4.664 50 10 IJGE CN(C)c1ccc([C@@H](CNC(=O)/C(C#N)=C/c2cccc(Cl)c2)N2CCCCC2)cc1 1866129922 SDUZLRZHYBTNMT-INJUALFYSA-N 436.987 4.656 50 10 IJGE C[C@@H](Br)C(C)(C)CNC(=O)c1ccc(Br)cc1Br 1913837341 DLTRHIRSYDPIQY-MRVPVSSYSA-N 441.989 4.751 50 10 IJGE Brc1cccc(Br)c1CN1C[C@@H](Br)CC2(CC2)C1 1925993676 PDYSISJKVPQOLW-JTQLQIEISA-N 438.001 4.961 50 10 IJGE O=C(NCC[C@@H](Br)C1CC1)c1cc(Br)sc1Br 1942742845 REZLKPOLTWMDRE-MRVPVSSYSA-N 446.002 4.567 50 10 IJGE COc1ccc([C@H](Br)c2cc(I)ccc2F)s1 2003649897 OQDMUESOHASQSY-GFCCVEGCSA-N 427.076 4.985 50 10 IJGE CC1(C)C[C@H](CBr)CN(c2ncc(Br)cc2Br)C1 2052456321 LARDJSGHVZRMLE-SECBINFHSA-N 441.005 4.854 50 10 IJGE Fc1cccc([C@H](Br)c2ncn3ccsc23)c1I 2083990712 KTFQKZQSIJTOFI-VIFPVBQESA-N 437.075 4.624 50 10 IJGE Clc1cc(CC[C@H](Br)CN2CCCC2)ccc1I 2086649757 SYWPEXIKIFNAHI-LBPRGKRZSA-N 442.566 4.737 50 10 IJGE FC1(CBr)CCN(Cc2ccc(I)c(Cl)c2)CC1 2086662629 WKUBHKFBNIJUEK-UHFFFAOYSA-N 446.529 4.644 50 10 IJGE CN(CC[C@H]1CCCCN1C(=O)[C@@H](Br)C1CCCC1)C(=O)OC(C)(C)C 2110716098 UJEHDKSWXGHQSL-SJORKVTESA-N 431.415 4.578 50 10 IJGE Cn1nc([C@@H](Br)c2cc(Br)cc3c2OCC3)c(Cl)c1Cl 2150718618 PHJFVRSBHOELFP-VIFPVBQESA-N 440.950 4.909 50 10 IJGE Cc1cc(N2CCC[C@]3(CN(Cc4ccccc4)CCO3)C2)ccc1CBr 2151739475 NISZUWHOJUFZCB-QHCPKHFHSA-N 429.402 4.761 50 10 IJGE Cc1c(Cl)cc(CN2C[C@H](CBr)OCC2(C)C)cc1Br 2167523510 IEYXDYFEBPYEJF-LBPRGKRZSA-N 425.592 4.785 50 10 IJGE O=C(Cc1ccc(Br)cc1Cl)N[C@@H](CBr)c1ccsc1 2237439121 FZYVDGBZWVZAAQ-ZDUSSCGKSA-N 437.584 4.959 50 10 IJGE COc1ccc([C@H](Br)C[C@@H]2CO[C@H](C)C2)cc1I 2257353248 GMBLPQKBMJACSU-CKYFFXLPSA-N 425.104 4.551 50 10 IJGE BrCC(CBr)(Cc1ncco1)c1ccccc1Br 2260806073 HJLJTCBGACEGRS-UHFFFAOYSA-N 437.957 4.707 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Br)c1nn(C)cc1Cl 2277882794 FXNCNCPXHNBPDT-SNVBAGLBSA-N 428.939 4.982 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@H](CBr)C12CC2 2282990273 PRPKETXOPDZYDN-MRVPVSSYSA-N 425.523 4.631 50 10 IJGE COc1cc(F)c(CBr)c(N2C[C@H]3CN(Cc4ccccc4)C[C@@]3(C)C2)c1 2283391742 JZFJTEOZOMXDRP-VGSWGCGISA-N 433.365 4.688 50 10 IJGE O=C(NCC(F)(F)C(F)(F)CBr)c1cscc1OCc1ccccc1 2314938052 KHYAEVPLENWSQA-UHFFFAOYSA-N 440.256 4.722 50 10 IJGE Cn1cc(I)c(C[C@H](CBr)C2CCCCCC2)n1 2319155715 BDSMVCRSVVGEIM-GFCCVEGCSA-N 425.152 4.549 50 10 IJGE CCCCCCOc1ccccc1C(=O)C=NNC(=O)CSc1nc2ccccc2[nH]1 2323081446 QHFUOFPLUQPBAY-UHFFFAOYSA-N 438.553 4.599 50 10 IJGE COc1c(Cl)cc(C=NNC(=O)CSc2nc3ccccc3s2)cc1Cl 2323195490 KOOZQHWZMIHDHG-UHFFFAOYSA-N 426.350 4.854 50 10 IJGE CC[C@@H]1[C@H](CCl)CCN1Cc1ccc(I)c(Br)c1 2325211665 AHHABFWIJMAEOW-SMDDNHRTSA-N 442.566 4.893 50 10 IJGE CC(C)(C)OC(=O)N1CCO[C@@]2(CCCN(C[C@](C)(CBr)C(C)(C)C)C2)C1 2380192441 QGJQVAWFPGEXRH-LEWJYISDSA-N 447.458 4.536 50 10 IJGE C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)C(c1ccccc1)c1ccccc1 14665728 GZKMZAPMWXBWNK-IBGZPJMESA-N 430.548 4.731 50 10 IJGE CC(C)c1ccccc1NC(=O)CO/C(=C(/C#N)c1nnc2n1CCCCC2)C(F)(F)F 33743665 PYEJUJIKWMWGCI-SILNSSARSA-N 447.461 4.580 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C\c2ccc(OCC)cc2)c(OCC)c1 35110515 YZEODDNOEXRLCO-MNJCBTFDSA-N 435.476 4.573 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NC(C)C)ccc1OC(=O)CCc1ccc(C(C)(C)C)cc1 40995880 WVGZVYINHJWHJZ-RCCKNPSSSA-N 448.563 4.962 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2cc(C)n(C3CCCCC3)c2C)cc1 58893222 LRPHIXMWSGSPFB-PGOXGVTESA-N 425.573 4.973 50 10 IJGE COCCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(-c3cc(Cl)ccc3Cl)o2)C1=O 101335713 AFGXVNJYVXQDOP-LFIBNONCSA-N 445.302 4.882 50 10 IJGE O=C(N[C@H](CCl)Cc1ccccc1)c1cc(Br)ccc1Br 161205827 OIJBZWQQDGUOOR-ZDUSSCGKSA-N 431.555 4.792 50 10 IJGE O=C(NN=Cc1cc(Br)ccc1OCc1ccc(F)cc1)c1ccccc1O 254758283 ICRXMWGZJVEBCK-UHFFFAOYSA-N 443.272 4.637 50 10 IJGE Cc1nn(-c2ccccc2)c(C)c1C=NNC(=O)c1n[nH]c2c1C[C@@H](CC(C)(C)C)CC2 254860923 WIMNZWGOHQQGFP-SFHVURJKSA-N 432.572 4.517 50 10 IJGE CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNc1cc(F)c(F)cc1F 734551954 DMLJRLJIEYITQL-QGZVFWFLSA-N 448.272 4.699 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])c2ncccc12)C12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2 770136959 PUGHQNOKXSIBAL-CJKMCJCZSA-N 431.286 4.782 50 10 IJGE Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)C(=O)NNc1ccc(F)c(F)c1F 784812065 FPQNPQVKDFXKIO-AWEZNQCLSA-N 443.425 4.634 50 10 IJGE N#Cc1ccc(NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)c(C(F)(F)F)c1 799748376 PBJPUAXYCHCTEQ-UHFFFAOYSA-N 448.408 4.582 50 10 IJGE COc1cccc(C(=O)c2ccc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)cc2)c1 799748555 SHCNBWKKBSVCLQ-UHFFFAOYSA-N 439.393 4.574 50 10 IJGE COc1c(C)cccc1C(=O)NN=C1C(=O)N(Cc2cccc3ccccc23)c2ccccc21 1083997837 NENVZLSTZHCBMU-UHFFFAOYSA-N 449.510 4.838 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C/c2cc(Cl)c(OCC#N)c(Br)c2)cc1 1083999863 PBNKCFXGSFGKKV-RIYZIHGNSA-N 430.689 4.859 50 10 IJGE C=C[C@@H]1OCCC[C@H]1NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1273305515 BHKBKEPHSAJFQT-YDSNLTDGSA-N 443.469 4.870 50 10 IJGE CC(=O)c1ccc(-c2ccc(C(=O)NNc3ccccc3I)o2)cc1 1471615217 DWJVLJIKXMTKAR-UHFFFAOYSA-N 446.244 4.511 50 10 IJGE C#CCCCC(=O)NNC(=O)Nc1cc(C(F)(F)F)ccc1Oc1ccc(OCC)cc1 1562099136 NOZLLAGHPCJYFT-UHFFFAOYSA-N 449.429 4.853 50 10 IJGE C/C(=C\c1ccccc1Cl)C(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1 1650629265 UUZDHJKQJXHHJS-SAPNQHFASA-N 445.906 4.508 50 10 IJGE CCOc1ccc(Br)cc1C=NNC(=O)COc1cc(C)c(Cl)c(C)c1 1772753738 GFRBIFKSRMJBOK-UHFFFAOYSA-N 439.737 4.647 50 10 IJGE CCOC(=O)c1cnn(-c2cc(C)c3ccccc3n2)c1N/C(C=O)=C\c1ccccc1C 1859489113 AOOZHWHTLAXCBD-ZHZULCJRSA-N 440.503 4.866 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(Cl)cc2)c1 1865694552 ZFHDCYYHHIIUDR-JOCHJYFZSA-N 434.927 4.900 50 10 IJGE COc1ccc(-c2ccc(C(=O)N/N=C\c3cccc(OC(C)C)c3)c(C)n2)cc1OC 1865760963 ZCXFHUQPUXPZDA-YSMPRRRNSA-N 433.508 4.625 50 10 IJGE CC(C)(C)[C@H]1CCc2c(sc(NC(=O)/C(C#N)=C/c3ccc(F)cc3)c2C(N)=O)C1 1866127939 NZEDSFRNXFTUDT-IPJDOKCGSA-N 425.529 4.683 50 10 IJGE Cc1cc(-c2csc(/C(C#N)=C(\O)[C@H](C)N3C(=O)c4ccccc4C3=O)n2)ccc1F 1872749825 JVRPJGSHAQQCRM-ITEXZYEPSA-N 433.464 4.735 50 10 IJGE CCC[C@H](CCNC(=O)OC(C)(C)C)CCC(=O)N(C)CC1CC(Br)C1 1887830556 ZGKIKPHXZLHQJE-GTPINHCMSA-N 433.431 4.730 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]1CC1(CC[C@@](C)(CI)O1)C2 1922293983 SNYPGUZDDGLVMS-ZQIUZPCESA-N 435.346 4.681 50 10 IJGE CCn1ncc(Br)c1[C@H](Br)Cc1ccncc1Br 1924021236 JSJHWENKKONSKQ-SECBINFHSA-N 437.961 4.502 50 10 IJGE CC(C)(C)OC(=O)NCCN(Cc1ccccc1)C(=O)c1ccc(CBr)cc1 1955938184 UNTWDEHIRNRKDV-UHFFFAOYSA-N 447.373 4.749 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1csc(Br)c1 2006100629 CNUPHCPPHDIAOP-VIFPVBQESA-N 430.149 4.624 50 10 IJGE Brc1cccc(CN2C[C@H]3C[C@@H](Br)C[C@H]3C2)c1Br 2065402802 LVSSHZLPHHUTSC-ZSBIGDGJSA-N 438.001 4.817 50 10 IJGE C=CC[C@H](CBr)CNC(=O)c1cc(Br)cc(Br)c1 2082056191 UWXAYBXXKCAQTC-SECBINFHSA-N 439.973 4.529 50 10 IJGE BrC1CCC2(CC1)CCN(Cc1ccc(I)cc1)C2 2099796955 QWDLAZOOKBPNIJ-UHFFFAOYSA-N 434.159 4.821 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CCC[C@@H]1[C@H]1CCN(Cc2ccccc2)C1 2145255938 RFWSIEROCCZQQY-FCHUYYIVSA-N 427.386 4.708 50 10 IJGE Fc1cc(Br)c2nc(CCCl)n([C@@]34C[C@@H]3CN(Cc3ccccc3)C4)c2c1 2155873727 QYDJKBRNYGVEKC-QVKFZJNVSA-N 448.767 4.950 50 10 IJGE Brc1ccc([C@H](CI)O[C@H]2C[C@H](n3cccn3)C2)cc1 2183664602 JCPWYXUSTDHFDR-KKUMJFAQSA-N 447.114 4.542 50 10 IJGE CC(C)CN(C1CCC1)S(=O)(=O)c1cc(CBr)sc1Br 2197134079 DMIFFMDNKWBJIA-UHFFFAOYSA-N 445.242 4.605 50 10 IJGE O=[N+]([O-])c1ccc(N2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)cc1CBr 2234714587 GOOCVBYJQYILLB-BGYRXZFFSA-N 430.346 4.733 50 10 IJGE COc1ccc([C@H](Br)[C@H]2C[C@]23CC3(F)F)cc1I 2257367865 DFHWYBKWTMUSII-ZHAHWJHGSA-N 429.042 4.781 50 10 IJGE O=[N+]([O-])c1cc(Br)cc(Cl)c1OCC1(CBr)CC(F)C1 2280373751 FYFVJHSBUWTZBJ-UHFFFAOYSA-N 431.483 4.903 50 10 IJGE CC(C)[C@@H]1[C@@H](Br)CCN1C(=O)c1cc(Br)c(F)cc1Cl 2285846819 SIAPUQAAFVJCRD-TVQRCGJNSA-N 427.539 4.876 50 10 IJGE COc1cccc(C=C(C#N)C(=O)Nc2ccc(C(=O)O)cc2)c1OCc1ccc(F)cc1 2293462033 CDAFPIWMDVOIAJ-UHFFFAOYSA-N 446.434 4.657 50 10 IJGE N#CC(=Cc1cn(CC(=O)Nc2ccccc2)c2ccccc12)C(=O)Nc1ccc(O)cc1 2294175222 DIOVXMDIEAOUDF-UHFFFAOYSA-N 436.471 4.531 50 10 IJGE N#CC(=Cc1ccc(-c2ccc([S@](=N)(=O)O)cc2)o1)S(=O)(=O)c1ccc(Cl)cc1 2296544425 CFDKVUFDJPVSAN-UHFFFAOYSA-N 448.909 4.817 50 10 IJGE O=S(=O)(N[C@H](CCCl)COCc1ccccc1)c1cc(Cl)sc1Cl 2303766483 IYQJQXNXUFAPRA-GFCCVEGCSA-N 428.790 4.548 50 10 IJGE BrC[C@H]1[C@@H]2CC[C@@H](C2)N1Cc1c(Br)cccc1Br 2310100506 BOKPGIFLSKRLLJ-BFVZDQMLSA-N 438.001 4.959 50 10 IJGE CCOc1cc(Br)c(C=C(C#N)C(=O)Nc2ccc(F)cc2)cc1OCC 2313630323 FZAXDJDHWOJWCP-UHFFFAOYSA-N 433.277 4.931 50 10 IJGE COc1ccc(Cl)cc1-c1csc(C(C#N)=C(O)[C@@H]2CC(=O)N(C(C)(C)C)C2)n1 2331410871 MROFBBIGAPFDJL-GFCCVEGCSA-N 431.945 4.912 50 10 IJGE CC1(C)CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)C[C@H]2C(F)(F)F)C1 2345008932 WJHRGHRONOKWFX-ZDUSSCGKSA-N 443.348 4.671 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](CN(C[C@]2(CBr)CC2(F)F)C2CC2)C1 2351886986 HJOFCNFZMMLUOZ-RDTXWAMCSA-N 437.369 4.518 50 10 IJGE CC1(C)CCCN(C(=O)c2ccc(Cl)cc2I)[C@H]1CCl 2365592067 OIYCWKNCGBRNLF-ZDUSSCGKSA-N 426.125 4.814 50 10 IJGE CC[C@@H](C)c1ccccc1OCC(=O)NNC(=O)c1ccccc1OCc1ccccc1 14030741 KVXGTYUTBMMFSE-LJQANCHMSA-N 432.520 4.619 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)c1C 25768105 GRZJDSQZRZFGIO-RONKMWSCSA-N 435.524 4.900 50 10 IJGE CCOC(=O)/C(C#N)=C/c1cccc(OC(=O)COc2ccccc2-c2ccccc2)c1 40935953 PDUUGRHHKUNENJ-RCCKNPSSSA-N 427.456 4.808 50 10 IJGE CC(C)C[C@@H](Br)CNC(=O)c1cc(Br)ccc1Br 226257880 KZCFGHDRTAFDFG-SNVBAGLBSA-N 441.989 4.751 50 10 IJGE CCCCCC[C@H](C)O[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1I 231313930 XFMALKGUUOGLDL-SOUVJXGZSA-N 425.351 4.785 50 10 IJGE CS/C(N=CN(C)C)=C(/C#N)[P+](c1ccccc1)(c1ccccc1)c1ccccc1 245284711 UFDWTORMQBJKGO-PXBUZNBNSA-N 430.537 4.626 50 10 IJGE ClCc1c(I)ccc2sc(I)cc12 306654951 KFQDNBHBWKIWLA-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE O=C(CCCN1C(=O)c2ccccc2C1=O)Nc1cccc(-c2nc(CCl)cs2)c1 327888432 MZAIZJNXERRAQY-UHFFFAOYSA-N 439.924 4.564 50 10 IJGE Cn1ncc([C@@H](Br)c2ccc(F)c3ccccc23)c1I 379204445 JKVCFFFIJILEIQ-AWEZNQCLSA-N 445.073 4.801 50 10 IJGE COc1ncnc2c1nc(CCCl)n2CCCN(Cc1ccccc1)Cc1ccccc1 390640251 KSQNCYGUFNOORL-UHFFFAOYSA-N 449.986 4.709 50 10 IJGE O=C(CBr)c1c(Br)ccc(OC(F)(F)F)c1OC(F)F 575683910 FIRRIPRQNBIRCF-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE CC(C)S(=O)(=O)CCC[C@H](CBr)Cc1ccc(Br)cc1 696943419 FZJXLWVOUVOIEK-AWEZNQCLSA-N 426.214 4.606 50 10 IJGE O=C(NC1(CCCl)CCSCC1)c1cc(Br)ccc1Br 719666936 XXPGWCXPPYNFHD-UHFFFAOYSA-N 441.616 4.836 50 10 IJGE O=C(NNC(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1)c1cccc2cccnc12 730215660 HWCVYSUJWLQXIW-QFIPXVFZSA-N 431.492 4.669 50 10 IJGE O=C(NNC(=O)N[C@H]1CCCOc2ccc(F)cc21)Nc1ccc(-c2ccccc2)cc1 743613287 GELCRIFOJSRYHP-NRFANRHFSA-N 434.471 4.742 50 10 IJGE C=CCOc1cn(-c2ccccc2)nc1C(=O)NNc1ccc(Cl)c(C(F)(F)F)c1 1146185755 GDJDJUDTHZWOMB-UHFFFAOYSA-N 436.821 4.866 50 10 IJGE CCOC(=O)c1c(NC(=O)NN=Cc2c(F)cccc2Cl)sc2c1CC[C@@H](C)C2 1772753072 CRHOUMWPZOOICV-LLVKDONJSA-N 437.924 4.998 50 10 IJGE CCOc1ccccc1C=NNC(=O)COc1ccc(Br)cc1C(C)(C)C 1772754536 JGDAZOABTOPNAF-UHFFFAOYSA-N 433.346 4.674 50 10 IJGE COc1cccc(O[C@@H](C)C(=O)NN=Cc2cn(Cc3ccccc3)c3ccccc23)c1 1772756154 MFMVEEPXWUDUTP-IBGZPJMESA-N 427.504 4.616 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2)cc1 1865693288 ITAAEHXOKBVVRL-KRWDZBQOSA-N 426.398 4.508 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2ccc(Br)cc2)sc2c1CCC2 1866129034 ZCKAUEWRDJXRGX-JLHYYAGUSA-N 445.338 4.722 50 10 IJGE COc1ccc(C(=O)N/N=C/c2cn(-c3ccccc3)nc2-c2ccc(OC)c(C)c2)cc1 1873498718 FEMNEEMTCCBCMR-JVWAILMASA-N 440.503 4.629 50 10 IJGE C[C@H](NC(=O)c1cccc(OCc2ccccc2)c1)c1nnc(CBr)s1 1877569962 FSKSCCGETGKROI-ZDUSSCGKSA-N 432.343 4.503 50 10 IJGE CC(C)[C@@H]1C[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)CN1Cc1ccccc1 1880755938 RJWDDVIDVRYIPQ-OTWHNJEPSA-N 425.411 4.821 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@@]1(F)CN(CC1(CBr)CCCCC1)C2 1893716214 HGTIQYWWDJDLFB-UXHICEINSA-N 433.406 4.803 50 10 IJGE CC(C)C[C@H](CBr)CN1CCC[C@@H](CNC(=O)OCc2ccccc2)C1 1905523649 HNVWEQNXLAVTPI-VQTJNVASSA-N 425.411 4.682 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OC[C@@H]1C[C@H]1c1ccccc1 1910883742 RCVXRKPLHAOUMR-TXPKVOOTSA-N 445.341 4.525 50 10 IJGE C[C@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1Cl 1914664183 PYKGYCYYVVGWHT-LBPRGKRZSA-N 437.186 4.921 50 10 IJGE CC(C)[C@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1ccccc1Br 1915276770 UEXOZTSAPBMDFS-KRWDZBQOSA-N 430.795 4.903 50 10 IJGE CN(Cc1c(Br)cccc1Br)[C@@H]1CCC[C@H]1Br 1945324155 WIEPYOBDPDZSLA-CHWSQXEVSA-N 425.990 4.959 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)Cc1cc(C(F)(F)F)ccc1Cl 1994841670 FCYXGPPVQCRHMT-LBPRGKRZSA-N 446.650 4.961 50 10 IJGE Clc1cc(CNCCCCCCBr)ccc1I 2026562068 XUIZXVKMGCDHIU-UHFFFAOYSA-N 430.555 4.990 50 10 IJGE CC(C)N1C[C@@H](Br)[C@@H](Cc2cc(Cl)ccc2I)C1 2039249207 ASEBIKGXJUMKGQ-WCQYABFASA-N 442.566 4.591 50 10 IJGE O=C(NNC(=O)c1ccco1)C(=Cc1cccc(OCc2ccccc2)c1)c1cccs1 2042450767 NOBMOOUYWCEOGV-UHFFFAOYSA-N 444.512 4.922 50 10 IJGE CC(C)(C)OC(=O)N1CCC([S@@](C)(=O)=NC[C@@H](CBr)C(C)(C)C)CC1 2044698444 BUZJIDPTSSVBEI-DLUDVSRJSA-N 439.460 4.541 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@@H](NC(=O)c2ccc(CBr)cc2)C1 2162592881 YPBIXVRGYWDDSG-MAUKXSAKSA-N 439.394 4.785 50 10 IJGE O=C(c1ccc(Br)cc1Cl)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Br)C2 2190679449 QKLDQWMMZMZPIF-YPWHJJHSSA-N 425.523 4.581 50 10 IJGE CN(CC1CC(Br)C1)C(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 2196908736 ZOJIILFLKJWHCV-HWOWSKLDSA-N 437.378 4.547 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)Cc1cc(Cl)cc(Cl)c1 2224038616 PRZPFPGEYFULDN-INIZCTEOSA-N 445.184 4.975 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2Cc1sncc1Br 2232914753 AJMBQWMNPPPLKA-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)C21CCC[C@H](CI)O1 2249326890 DJXQVCSPTYMESE-KGTZEYCTSA-N 449.373 4.833 50 10 IJGE CCO[C@@H]1CC[C@@H]([C@H](Br)c2ccc(OC)c(I)c2)C1 2269535964 XLNIHQDJUFWZHF-HCKVZZMMSA-N 439.131 4.941 50 10 IJGE C[C@@H]1CN(C(=O)c2ccc(Cl)c(I)c2)CC[C@H]1CCCl 2283654751 FDEPOMWAMZTRET-GHMZBOCLSA-N 426.125 4.672 50 10 IJGE N#CC(=Cc1cn(Cc2ccc(Cl)cc2Cl)c2ccccc12)C(=O)N1CCOCC1 2296683335 HMXNJSURESSWRA-UHFFFAOYSA-N 440.330 4.762 50 10 IJGE C[C@H](CCCCBr)NCc1cc(I)ccc1Cl 2307325474 ADANWUJOSPMLEB-SNVBAGLBSA-N 430.555 4.988 50 10 IJGE C[C@@H](Br)CC1C[C@@H]2CC[C@H](C1)N2C[C@H]1CC1(Br)Br 2318712594 PFIKSWVGGACBKN-NZISVWNOSA-N 444.049 4.909 50 10 IJGE CC1(CBr)CCN(Cc2cc(I)ccc2Cl)CC1 2327397202 MVXHYLGOLJAWBQ-UHFFFAOYSA-N 442.566 4.942 50 10 IJGE O=C(COc1ccc(Br)cc1Cl)N/N=C/c1cccc(C(F)(F)F)c1 14017337 WFONWJWZAHACFN-GZIVZEMBSA-N 435.627 4.650 50 10 IJGE C/C(=N\NC(=O)c1ccco1)c1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2C)cc1 20352673 VDJSMGBTPQTZGX-KSXCTLEASA-N 439.899 4.801 50 10 IJGE COc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2Cl)c1 38650963 WJNLKCIRWRAYNL-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE CCN(CC)c1ccc(/C=N/NC(=O)c2cc3cc(Br)ccc3o2)c(O)c1 59303904 GEQWBYUQDKZDSH-WSDLNYQXSA-N 430.302 4.511 50 10 IJGE CCOc1ccc(-c2nc(C)c(C(=O)NNC(=O)c3oc4ccccc4c3C)s2)cc1 106011415 JYEYGPOWJSGZTM-UHFFFAOYSA-N 435.505 4.647 50 10 IJGE CCc1nn(C)c(CC(CBr)(CBr)c2ccccc2)c1Cl 118876400 LFLWQKDYLCWUDW-UHFFFAOYSA-N 434.603 4.906 50 10 IJGE ClCc1nc2c(Br)cccc2n1CC[C@H]1CN(Cc2ccccc2)CCO1 383766268 PSRZOHGKAPJPRF-KRWDZBQOSA-N 448.792 4.829 50 10 IJGE ClCc1nc2c(Br)cccc2n1C[C@@H]1CN(Cc2ccccc2)CCCO1 390602775 JZTMRIGUJJIJCZ-KRWDZBQOSA-N 448.792 4.829 50 10 IJGE Clc1ccc(CBr)c(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@@H]32)c1 404140875 FRZMKWZBIOKUCK-LEWJYISDSA-N 435.793 4.715 50 10 IJGE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NNc1cccc(C(F)(F)F)c1 743300104 YYIOTRCJSLJKLF-UHFFFAOYSA-N 431.443 4.630 50 10 IJGE Cc1csc(Sc2ccc(NC(=O)NNC(=O)c3cccc4cccnc34)c(C)c2)n1 756303190 XAAAWMJUJULGKJ-UHFFFAOYSA-N 449.561 4.926 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NCc2ccc3ccccc3c2)c(-c2ccccc2)n1 914482585 GHPAAZGZLGEMRW-LFVJCYFKSA-N 431.499 4.840 50 10 IJGE O=C(NN=Cc1ccc(Br)o1)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1 1084397761 XDKPNIXQOVGLPI-UHFFFAOYSA-N 446.688 4.712 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cccc(Oc3ccccc3C)c2)cc1 1627770429 GXWFWIQUIPCVCR-SFHVURJKSA-N 447.491 4.610 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@@]2(CCC[C@H]2Cl)C1 1918932509 ARJKBHRECRYAIF-RNCFNFMXSA-N 427.589 4.897 50 10 IJGE CCCC1CC(O[C@@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)C1 1987758433 CNAGAKPZLLFZEO-JTTJXQCZSA-N 437.362 4.786 50 10 IJGE Fc1cc(F)c([C@H](Br)c2cc(I)sn2)c(F)c1 2007644859 OESKVOFWSNAEMA-SNVBAGLBSA-N 434.018 4.649 50 10 IJGE CCC[C@H](CBr)CNC(=O)c1scc(Br)c1Br 2008118555 FPRCVSRFOBYDDK-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE COc1ccc([C@H](Br)[C@H]2C[C@H]2Br)c(OC)c1Br 2020150114 MAPZTKLXILMFIT-XKSSXDPKSA-N 428.946 4.686 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1C 2025940442 WTUXHFYOAJPPHE-QGZVFWFLSA-N 430.795 4.966 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H](Br)CC23CCC3)c1 2038052560 ZPHZPOVQDWVPJT-NSHDSACASA-N 440.550 4.837 50 10 IJGE Cc1csc([C@H](Br)c2cc(S(C)(=O)=O)cs2)c1Br 2039332839 STAOVJKZITYJPU-SNVBAGLBSA-N 430.208 4.768 50 10 IJGE O=C(CBr)c1cc(C(F)(F)F)cc(C(F)F)c1I 2060391759 CLLYPCPYGPXMJO-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE ClCc1ccc(CNc2ncc(I)cc2Br)cc1 2069525545 KDVZKONGNZSZMB-UHFFFAOYSA-N 437.506 4.800 50 10 IJGE CC(C)[C@@H](Br)C(=O)N1C[C@@H](NC(=O)OC(C)(C)C)CC12CCCCCC2 2106597077 NCLOKGIJTVNSBW-JKSUJKDBSA-N 431.415 4.625 50 10 IJGE O=S(=O)(c1ccc(F)c(CBr)c1F)N(Cc1ccccc1)CC1CCC1 2123269635 JMDXGMBDQGXIPI-UHFFFAOYSA-N 444.341 4.851 50 10 IJGE COc1cc(Cl)c([C@@H](Br)[C@H]2CCCCS2(=O)=O)cc1Br 2202349314 XMJIPEOBBJZTDT-CHWSQXEVSA-N 446.588 4.514 50 10 IJGE C[C@](CI)(O[C@@H]1[C@@H]2[C@H]3C[C@@H]4[C@H]([C@H]32)[C@@H]41)c1ccccc1Br 2208404055 BWOBTWGJKJTBCG-ANCFAQSSSA-N 445.138 4.626 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2CCC[C@H](C1)[C@@]21CC[C@@](C)(CI)O1 2249370456 VCNYSHGQBLHFEA-DPMWRWFOSA-N 449.373 4.833 50 10 IJGE C[C@@H](COC(F)F)O[C@@](C)(CI)c1ccccc1Br 2265058188 VRMQZDDBIXSOPV-ZANVPECISA-N 449.073 4.744 50 10 IJGE C=CC[C@]1(CBr)CCCN(Cc2ccc(I)cc2)C1 2272138860 QLWMSQLNFJGRIY-MRXNPFEDSA-N 434.159 4.844 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC2(CC2)C[C@H]1CBr 2285847206 XWUUWEHYASAFDJ-QMMMGPOBSA-N 425.523 4.631 50 10 IJGE C[C@H]1CN(CC2(CBr)CC(C)(C)C2)C[C@@H](C)N1C(=O)OCc1ccccc1 2304520495 JUSZVEDIJGAHAI-HDICACEKSA-N 437.422 4.919 50 10 IJGE CO[C@@H]1C[C@@]2([C@H](Br)Cc3cc(Br)cc(Br)c3)C[C@@H]12 2313495682 NZUWAWAFMZHAHD-DGAVXFQQSA-N 438.985 4.943 50 10 IJGE CC1CC(CBr)(N(C)Cc2ccc(Cl)c(I)c2)C1 2315555947 WYYWQAQZZYIIBU-UHFFFAOYSA-N 442.566 4.940 50 10 IJGE O=C(NN=Cc1ccc(Cl)c(Cl)c1)c1cccn(Cc2ccc(Cl)cc2)c1=O 2323651082 UNNCQRZAGNGJJR-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE COc1ccc(Cc2nc3ccc(C(=O)NN=Cc4ccccc4Cl)cc3[nH]2)cc1OC 2323720437 WADBYWNACIGBIB-UHFFFAOYSA-N 448.910 4.588 50 10 IJGE N#CC(=CNc1ccc(Oc2ccccc2)cc1)C(=O)N1CCN(Cc2ccccc2)CC1 2325448575 CBZIGVHSVBTITF-UHFFFAOYSA-N 438.531 4.643 50 10 IJGE CC(C)CN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2351885520 LAUGMEDNIQFRMJ-CRAIPNDOSA-N 439.385 4.764 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N(CCCBr)C1CCOCC1 2381031217 NGYSLBJHKODINY-UHFFFAOYSA-N 445.604 4.570 50 10 IJGE CCCOc1ccc(Br)cc1C(=O)NNC(=O)c1ccc(Cl)cc1Cl 14652630 SCFWBNOZQVGDHO-UHFFFAOYSA-N 446.128 4.620 50 10 IJGE CC(C)Oc1ccc(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1Br 14658901 LPKYQAWXFLVDNZ-UHFFFAOYSA-N 433.346 4.609 50 10 IJGE O=C(COc1ccc(Cl)cc1Cl)NNC(=O)Cc1coc2ccc3ccccc3c12 35548546 QCQVUQUBLZQXCE-UHFFFAOYSA-N 443.286 4.662 50 10 IJGE Cc1c(C(=O)Nc2ccccc2Cl)oc2c1/C(=N/NC(=O)c1ccc(O)cc1)CCC2 40812084 UNVBOLJOFKSJIB-NLRVBDNBSA-N 437.883 4.670 50 10 IJGE CCCOc1ccccc1/C=N\NC(=O)c1ccc2[nH]c(Cc3ccc(OC)cc3)nc2c1 169925605 KHLIHRRESFAYAD-PKAZHMFMSA-N 442.519 4.715 50 10 IJGE CCOC(=O)c1ccc(NC(=O)/C(C#N)=C\N[C@@H](CC)c2ccc3c(c2)CCCC3)cc1 217100007 DWJJBKDMLVVCAW-JFARUEAUSA-N 431.536 4.829 50 10 IJGE N#C/C(=C/NCc1ccccc1Br)C(=O)Nc1cccc(Cl)c1Cl 217129872 BEACATBUEHCEOK-BENRWUELSA-N 425.113 4.892 50 10 IJGE CCOc1ccc(CCN/C=C(/C#N)C(=O)Nc2cc(Cl)ccc2Cl)cc1OCC 217135129 VVGZYQDSGWSXCL-PEZBUJJGSA-N 448.350 4.969 50 10 IJGE CCOC(=O)c1ccc(-n2c(C)cc(C=NNC(=O)c3cc4c(s3)CCCC4)c2C)cc1 254826550 SFUPNIPRNQSMGV-UHFFFAOYSA-N 449.576 4.975 50 10 IJGE COc1cccc(C=NNC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1OC 254875149 XLQGQCROKLHUOM-UHFFFAOYSA-N 435.324 4.897 50 10 IJGE CC(=O)C(=O)CCC[C@@H]1C[C@@]2(C)C(=CC1=O)[C@H](Cl)C[C@H]1[C@@H]3CC[C@H](O)[C@@]3(C)CC[C@@H]12 328578071 WFQUYBYCFZVLQH-RNLUOBFRSA-N 435.004 4.651 50 10 IJGE Oc1ccc(Br)c([C@@H]2CN(Cc3ccccc3)C[C@H]2CBr)c1 382681068 BATZFQIYUFOEGO-RHSMWYFYSA-N 425.164 4.765 50 10 IJGE ClCc1ccc(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@H]32)c(Br)c1 404200906 RCLJMVMDVSUQBS-NHCUHLMSSA-N 435.793 4.668 50 10 IJGE O=c1sccn1CCC(CBr)(CBr)c1ccc(Cl)cc1 700206020 AZHKQEOQEFGNBH-UHFFFAOYSA-N 439.600 4.681 50 10 IJGE ClCc1cc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)ncc1Br 705846029 OMARHRHVHIUOLZ-LYSIVYOWSA-N 446.820 4.930 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CCn4c(C(C)C)nnc4[C@@H]3C)c2C)c1 784685118 DWNBZJIQFLIXJY-ALFKQNEGSA-N 442.567 4.628 50 10 IJGE CCCc1c(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cnn1-c1cccc(F)c1 799754043 BZNSHJSPHDJCDH-UHFFFAOYSA-N 431.393 4.611 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1 918558575 QXAFUJRJWIVNSH-HNNXBMFYSA-N 435.402 4.559 50 10 IJGE CC(C)c1ccc(C=NNC(=O)COc2ccc3c(c2Br)CCCC3)cc1 1084014801 QLXAIRHYNGVMNK-UHFFFAOYSA-N 429.358 4.980 50 10 IJGE COc1ccc(C(C)=NNC(=O)CCCSc2nc3ccccc3s2)cc1OC 1084142154 TVGOCILWSJKMHH-UHFFFAOYSA-N 429.567 4.726 50 10 IJGE C=CCC[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2)c1C)C(=O)OCC 1635699398 VXEDMCFCJZFSRY-QUYTYNJFSA-N 439.943 4.669 50 10 IJGE C[C@H](Oc1cccnc1NC(=O)Nc1ccc(SC#N)cc1)C(=O)Nc1ccccc1 1858834394 FGBNUOSTMNIMOZ-HNNXBMFYSA-N 433.493 4.705 50 10 IJGE CCOc1cc(NC(=O)[C@@H](Br)CC)c(OCC)cc1NC(=O)c1ccccc1 1859498637 JBGHQYPWVGWJIF-HNNXBMFYSA-N 449.345 4.848 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](OCC2CCCCCCC2)C1 1902602516 PJHYLGKKHZGQDJ-JKSUJKDBSA-N 437.362 4.786 50 10 IJGE Cc1nn(C)c(CN(Cc2ccccc2)[C@@H](CBr)C(C)C)c1Br 1915258372 XMIHMEAAULJJIM-INIZCTEOSA-N 443.227 4.913 50 10 IJGE O=S(=O)(c1ccc(Cl)s1)N(Cc1ccccc1)C1(CBr)CCC1 1915775327 ZEGLTBGZPALKBZ-UHFFFAOYSA-N 434.808 4.910 50 10 IJGE Brc1ccc([C@H](CI)O[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1 1917452362 FHBJDBGZROQISR-PVSUWSIZSA-N 433.127 4.986 50 10 IJGE CC(C)[C@H](CBr)CNC(=O)c1csc(Br)c1Br 1945189608 VFVZZADUROGDSK-SSDOTTSWSA-N 448.018 4.670 50 10 IJGE CCOC(=O)[C@@H](Cl)Cc1cc(Br)c(Br)c(Br)c1 1946435329 VATMLYYPAGAQDZ-VIFPVBQESA-N 449.364 4.687 50 10 IJGE CC1(C)OC[C@H](Cc2cc(Br)ccc2Br)[C@H]1Br 2006501609 USVRRMMUGULALU-JOYOIKCWSA-N 426.974 4.943 50 10 IJGE C[C@](CI)(OCCOCCOCc1ccccc1)c1ccccc1 2007814083 IYCZSDNHXGISBM-HXUWFJFHSA-N 440.321 4.587 50 10 IJGE BrCc1nnc(-c2c(Br)cccc2Br)n1C1CC1 2033095462 PDPXLURHMFVRGD-UHFFFAOYSA-N 435.945 4.700 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1ccc(Cl)c(Br)c1 2081236406 OWRNGCMWIIVPBD-QPUJVOFHSA-N 444.538 4.682 50 10 IJGE CCCN(CCCCl)C(=O)c1ccc(Br)cc1I 2086145988 UCZZYYUKFNVVMP-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC2(CC[C@H]1CCl)CC2 2097878231 XHNZMOAXEISPRP-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE CCC(CC)(CBr)CN1CCC(OCCCNC(=O)OC(C)(C)C)CC1 2106781725 KRQLLVYRZXZXOH-UHFFFAOYSA-N 435.447 4.584 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(CC2(CBr)CCCCC2)CCC1(F)F 2106785946 RFTQZRMVYAPWBL-HNNXBMFYSA-N 439.385 4.956 50 10 IJGE CO[C@]1(C(F)(F)F)C[C@H](C(=O)N(Cc2ccccc2)[C@H](CBr)C2CC2)C1 2125554950 BFZDENBCTCHFBJ-NUJGCVRESA-N 434.296 4.546 50 10 IJGE BrC1CCC2(CCCN2Cc2ccc(I)cc2)CC1 2137565354 NTPLVJBABDOZIS-UHFFFAOYSA-N 434.159 4.963 50 10 IJGE COc1ccc([C@H](Br)c2cn(C)nc2Br)c(Cl)c1Cl 2138628755 WONVNLMMJMTXBL-VIFPVBQESA-N 428.939 4.982 50 10 IJGE CSCC[C@@H](Cl)CCNc1ncc(C(F)(F)F)cc1I 2146553124 ANNJUDSYWVYDRQ-VIFPVBQESA-N 438.684 4.868 50 10 IJGE O=C(NC[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(CBr)cc1 2159220644 UTFSODJGKDOSLI-MMVMTREESA-N 427.386 4.755 50 10 IJGE CC(C)(C)OC(=O)N1CCCC12CCC(NC(=O)[C@H](Br)C1CCCC1)CC2 2167903770 VOFYNEWPGZHZQK-BQIYRTECSA-N 443.426 4.769 50 10 IJGE Cc1c(Cl)cc(C(=O)NCC2(F)CC(CBr)C2)cc1Br 2168545764 RSJHDNYIHZYWPH-UHFFFAOYSA-N 427.539 4.654 50 10 IJGE CCN([C@H](C)C1CCC1)S(=O)(=O)c1cc(CBr)sc1Br 2179774283 DWDAIKYBDHCMAN-SECBINFHSA-N 445.242 4.605 50 10 IJGE FC(F)(F)[C@H]1C[C@]1(CCl)CNCc1ccc(I)c(Cl)c1 2208027479 AGFWIZFMHMFGTC-RYUDHWBXSA-N 438.058 4.842 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1ccc2c(c1)OC(F)(F)O2 2231587813 YPBNDNPTRWBGQJ-HNNXBMFYSA-N 426.257 4.824 50 10 IJGE CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)C21CCC[C@@H](CI)O1 2249326889 DJXQVCSPTYMESE-DOWLLFGTSA-N 449.373 4.833 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CC(F)C2)[C@H](c2ccccc2)C1 2280358283 AEXLEQUYEWQYNW-WBTXTPOCSA-N 441.385 4.794 50 10 IJGE Cc1cc(Br)c(C)c([C@H](Cl)[C@H]2C[C@H](S(C)(=O)=O)C2)c1Br 2285396033 PSXGOHZXSMOWRN-GPCCPHFNSA-N 444.616 4.932 50 10 IJGE COC(=O)c1cc(NC=C(C#N)c2nc(-c3ccc(C)cc3C)cs2)cc(C(=O)OC)c1 2296038092 RLVRRLMCIOCYNO-UHFFFAOYSA-N 447.516 4.977 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=C(C#N)c3nn(-c4ccccc4)c(N)c3C#N)o2)cc1 2296676461 KJYXDRRGMHIQLT-UHFFFAOYSA-N 449.470 4.827 50 10 IJGE Clc1ccc(I)cc1COC[C@H](CBr)C1CC1 2307221981 ZWZPYAPKHGPOEL-NSHDSACASA-N 429.523 4.882 50 10 IJGE COc1ccc(CC(=O)NN=Cc2ccc(OCc3cccc(Cl)c3)c(OC)c2)cc1 2323335921 OKWWXOBEHQBAQK-UHFFFAOYSA-N 438.911 4.629 50 10 IJGE O=C1C(=Cc2cc(Cl)cc3c2OCOC3)Oc2cc(OC(=O)C(Cl)Cl)ccc21 2323752423 FLMSYLZUSPXMFT-UHFFFAOYSA-N 441.650 4.532 50 10 IJGE Clc1nccc(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c1CBr 2344698327 JLUJHRQIQYJZAP-ZWKOTPCHSA-N 434.809 4.978 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C2)C1 2345004704 NXVJZPTUFNPFDQ-SJORKVTESA-N 429.443 4.767 50 10 IJGE CCOc1ccc(C(=O)NNC(=O)c2ccc(-c3ccccc3)cc2)cc1Br 14770264 ULEJAPPXJSDBTD-UHFFFAOYSA-N 439.309 4.590 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccc(C)cc2)ccc1OCc1ccccc1Cl 40846816 FYKBINXYVMNHDB-VULFUBBASA-N 438.911 4.765 50 10 IJGE O=C(CCCNc1ccc(Br)cc1)N/N=C/c1cccc(Br)c1 59507506 IXMBTIRTXQUNHE-CIAFOILYSA-N 439.151 4.554 50 10 IJGE COc1ccc2c(c1)N(C)/C(=C1/S/C(=N/CCCl)N(Cc3ccccc3)C1=O)S2 103627789 RUHBMOZIONLIOK-WDIQAHRZSA-N 445.997 4.777 50 10 IJGE CO[C@@H]1[C@@H](Cl)C[C@H]1Oc1c(Br)cc(Br)cc1Br 252880862 ZNWVUAWDIOUXAI-IQJOONFLSA-N 449.364 4.748 50 10 IJGE CCn1c2ccccc2c2cc(NC(=O)CC(C)=NNC(=O)c3ccc(OC)cc3)ccc21 254290217 JRTCKKONIQZVBV-UHFFFAOYSA-N 442.519 4.958 50 10 IJGE COc1ccc(Br)cc1[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1CBr 394786971 PGARRXNQJLZMDY-FZMZJTMJSA-N 449.183 4.803 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1cccc([C@@H]2CCN(S(N)(=O)=O)c3ccccc32)c1 616588303 PXJNLEKSGHSNRL-FQEVSTJZSA-N 446.689 4.796 50 10 IJGE C[C@@H]1CN(C(=O)c2scc(Br)c2Br)CC[C@@H]1Br 707799491 DYOIJNMASKCYPW-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE C[C@@H](NC(=O)c1scc(Br)c1Br)C1(CBr)CC1 707836956 DOTHMFUTBAMGFA-ZCFIWIBFSA-N 446.002 4.567 50 10 IJGE CC[C@]1(C)[C@@H](Br)C[C@@H]1Oc1ccc(OC)c(I)c1 712929952 KDVYAEVJZWEBSF-MELADBBJSA-N 425.104 4.631 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@]2(CN(Cc3ccccc3)CCO2)C1 717534862 HPLZPEWAJOIBDB-QHCPKHFHSA-N 437.466 4.945 50 10 IJGE O=C(NNc1cc(Cl)ccn1)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 784856142 CWFNTJQSZYTRGZ-UHFFFAOYSA-N 435.698 4.791 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OCc2cc(-c3ccccc3)on2)c(-c2ccccc2)n1 800723273 FQSLDYJNDGJKFQ-KGENOOAVSA-N 449.470 4.769 50 10 IJGE O=C(NN=Cc1ccccc1OCc1ccccc1Cl)C(=O)Nc1ccccc1Cl 1084632395 YSYCVPGFJWWWTA-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE C=CCn1ncc2ccc(NC(=O)NNC(=O)c3sc4cc(F)ccc4c3Cl)cc21 1209767844 NJWOZEYCMSGZJB-UHFFFAOYSA-N 443.891 4.696 50 10 IJGE CC(C)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCN(C[C@H](CBr)C1CC1)CC2 1620662414 CZYYAPRTVHMBBW-ROUUACIJSA-N 429.443 4.765 50 10 IJGE O=S(=O)(c1ccc(F)cc1Br)N(Cc1ccccc1)[C@H](CCl)C1CC1 1915158532 DDBSYTFBBHVJSB-QGZVFWFLSA-N 446.769 4.797 50 10 IJGE CC[C@@H]1CN(C(=O)c2csc(Br)c2Br)C[C@@H]1Br 1945187634 YOJHLHXJDVCKAP-SVRRBLITSA-N 446.002 4.519 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)[C@@H]1CCN(C(=O)OCc2ccccc2)C1 1999500156 DICABYZBXSONSH-NHCUHLMSSA-N 431.374 4.508 50 10 IJGE CN[C@@H](c1ccc(Br)c(C)c1Br)[C@H]1C[C@@H](Br)C1 2024281157 CSJYJIRSJLKOTG-VYUIOLGVSA-N 425.990 4.954 50 10 IJGE CC[C@H](NC(=O)c1c(Br)cccc1Br)[C@H](Br)CC 2033085667 FVVWBIIESYCJPH-KCJUWKMLSA-N 441.989 4.894 50 10 IJGE CC(C)[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)CC[C@H]1C(F)(F)F 2044699514 LWTPHWACRTZSMA-KGLIPLIRSA-N 431.337 4.527 50 10 IJGE C[C@@H]1C[C@H](CBr)CN(Cc2ccc(I)c(Cl)c2)C1 2086652364 OSXXZCIWCSOWFR-ZYHUDNBSSA-N 442.566 4.798 50 10 IJGE ClCc1cnc(N2CC[C@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c(Br)c1 2092523126 FDAZPPSTLJIVTQ-RTBURBONSA-N 434.809 4.931 50 10 IJGE CCCN(C[C@@H](Br)C(F)(F)F)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2106784139 GKZBWQDQSKSWMF-IZGVIRRGSA-N 443.348 4.955 50 10 IJGE C[C@@H]1CN(C[C@@H](CBr)c2ccccc2)C[C@@H]1CCNC(=O)OC(C)(C)C 2106788177 NNKGCMSPEYGWPP-NZSAHSFTSA-N 425.411 4.648 50 10 IJGE O=C(N[C@H](CCl)c1ccsc1)c1cc(Cl)ccc1I 2119039843 QNRVVWSHCQMHFU-GFCCVEGCSA-N 426.106 4.716 50 10 IJGE O=S(=O)(c1ccc(CCl)c(Cl)c1)N(Cc1ccccc1)CC1CCOCC1 2152167552 GVEXTBYNNABFMO-UHFFFAOYSA-N 428.381 4.696 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CCC[C@H](NC(=O)c3ccc(CBr)cc3)[C@H]1CC2 2162493984 CRRMGIPCMHEPRJ-OKZBNKHCSA-N 437.378 4.632 50 10 IJGE CN(Cc1ccccc1)[C@H]1CCCCN(c2ccc([N+](=O)[O-])cc2CBr)C1 2169168445 UJDDIZYYYMTQQJ-FQEVSTJZSA-N 432.362 4.981 50 10 IJGE CN(C(=O)c1ccc(Br)cc1Cl)C1(CBr)CCSCC1 2171183015 WGTKINAKSZJZIY-UHFFFAOYSA-N 441.616 4.835 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(C[C@H](CBr)c2ccccc2)C2(CCC2)C1 2174539777 HVOZCPOLNFCGBC-HKUYNNGSSA-N 437.422 4.934 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2C[C@]1(Br)CC1(F)F 2202502173 BVOJOYNHQOMLLP-LLVKDONJSA-N 432.465 4.849 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@@H]2C[C@H](Br)CC[C@@H]21 2264507573 SCVGPZMGEACUJS-MRTMQBJTSA-N 427.589 4.942 50 10 IJGE C=CC[C@@]1(CCl)CCN(C(=O)c2cc(Br)sc2Br)C1 2272155718 GVFKZBOXJPDCAU-ZDUSSCGKSA-N 427.589 4.920 50 10 IJGE Brc1ccc([C@@H](CI)OC2(C3CCC3)COC2)cc1 2272915861 RDLLIWNUNFYFHO-CQSZACIVSA-N 437.115 4.511 50 10 IJGE COc1cc(Cn2c(Cl)nc(Cl)c2CBr)ccc1Br 2273861031 HWAVRYBZCAIEDW-UHFFFAOYSA-N 428.939 4.904 50 10 IJGE O=C(NCC[C@H]1CCC[C@@H]1Br)c1cc(F)c(Br)cc1Cl 2282984143 VNAITKKBAAANLX-SCZZXKLOSA-N 427.539 4.925 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@H](Br)CC12CCC2 2282989843 KVCLCKSXUIWEBF-MRVPVSSYSA-N 425.523 4.774 50 10 IJGE C[C@H](Cl)C[C@H]1CCCCN1C(=O)c1ccc(Cl)c(I)c1 2283652246 RSQFFNGVHBESQP-CMPLNLGQSA-N 426.125 4.957 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2cn(CCC#N)c3ccccc23)sc(C)c1C 2296819134 ZIJJAXWLIVWHGJ-UHFFFAOYSA-N 446.532 4.956 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)[C@@H]1CCC[C@@H]1Br 2300241302 XJASLUYEANKFFY-GXFFZTMASA-N 428.539 4.692 50 10 IJGE CN[C@H](c1c(C)cc(Br)c(F)c1Br)[C@H]1C[C@H]1Br 2301487732 TZTXUORLCRDFMJ-KJNMHVQDSA-N 429.953 4.703 50 10 IJGE C[C@@H](Cl)CN(Cc1ccc(I)c(Br)c1)C1CC1 2306218612 CDZHZRUQAHDKGD-SECBINFHSA-N 428.539 4.645 50 10 IJGE COc1cc(C=C(C#N)C(=O)N(C)C)c(Br)cc1OCc1ccc(Cl)cc1 2313567613 IWJBCVFKNSYFJH-UHFFFAOYSA-N 449.732 4.685 50 10 IJGE COc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccs2)cc1 2314634530 FOUBXOKWNIINKE-QHCPKHFHSA-N 430.485 4.594 50 10 IJGE C[C@H]([C@H](Cl)c1c(Cl)cc(Br)c(F)c1Br)S(C)(=O)=O 2315454148 UICPXRPRMPXYPY-MOFOKWOHSA-N 442.959 4.717 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@H](CBr)C12CC2 2327394329 DFOZSZLFLSUPGU-LLVKDONJSA-N 440.550 4.694 50 10 IJGE Cc1ccc(S(=O)(=O)NCC(O)=C(C#N)c2nc(-c3cc(C)ccc3C)cs2)cc1 2331320080 NNFNWGZITAMEMN-UHFFFAOYSA-N 439.562 4.507 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccccc4Cl)ccc32)cc1 38649218 MELYJTMDEJOVMQ-XMMPIXPASA-N 446.890 4.851 50 10 IJGE O=C(CCCCl)Nc1c(Br)cc(Br)cc1Br 70124992 GBTYRMKQVXPFNE-UHFFFAOYSA-N 434.353 4.932 50 10 IJGE CCCOc1ccc(/C=C\C(=O)Oc2ccc(/C=C(/C#N)C(=O)NC(C)C)cc2OC)cc1 206433421 BKUWYIYDTFPHJX-CUBOCRIMSA-N 448.519 4.534 50 10 IJGE C[C@@H]1CCC[C@@H](O[C@@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)C1 231314397 RWFABNWIWNJRNT-IIDMSEBBSA-N 437.362 4.786 50 10 IJGE O=C(NN=Cc1ccccc1Cl)c1ccc(C(=O)NN=Cc2ccccc2Cl)cc1 254369481 ZEUCPYISHYQQRJ-UHFFFAOYSA-N 439.302 4.521 50 10 IJGE O=[N+]([O-])c1cc(Br)cc(Cl)c1OC[C@H](Br)C(F)(F)F 311658685 FWSMRWRHJRPAGL-ZETCQYMHSA-N 427.398 4.715 50 10 IJGE CC[C@H](C)N(CCBr)C(=O)c1ccc(I)c(Cl)c1 385032600 HJUMKIYQSVJKLF-VIFPVBQESA-N 444.538 4.580 50 10 IJGE CC(C)N(C[C@H](C)Br)C(=O)c1cc(Br)cc(Br)c1 691343101 HYNFVBABWXWSPP-VIFPVBQESA-N 441.989 4.846 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1ccccc1-c1nc2ccccc2s1 755471871 VGGWESSQNAZAPX-UHFFFAOYSA-N 439.500 4.978 50 10 IJGE Cc1ccccc1CC(=O)NNC(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 756028330 CSVPTTKMHMYVCP-HNNXBMFYSA-N 438.380 4.676 50 10 IJGE C/C(C=NNC(=O)Cc1nc(O)c2c(C)c(C)sc2n1)=C\c1cccc(C(F)(F)F)c1 807952510 MSTOEZNOUUGOIF-NCTWZRLYSA-N 448.470 4.781 50 10 IJGE C/C(=C\c1ccncc1)C(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 1124293766 FTKNZYNHUKHCLA-JQIJEIRASA-N 437.952 4.892 50 10 IJGE O=C(CCc1ncc(-c2ccccc2Cl)o1)NNc1nc2ccccc2[nH]c1=S 1470319640 NBJIBNHBTIMTLR-UHFFFAOYSA-N 425.901 4.677 50 10 IJGE CCc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccc1OC)CCC2 1772745624 DGSKDZNPBBHTSG-UHFFFAOYSA-N 445.519 4.882 50 10 IJGE CCCc1nn(-c2ccc(Cl)cc2)c2c1[C@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865683137 GRIPFBKFCWEBPG-OAQYLSRUSA-N 433.943 4.762 50 10 IJGE CCCn1nc(C)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(OCc2ccccc2)c(OCC)c1 1865693347 IYSCDGNRXMLRQH-DEOSSOPVSA-N 444.535 4.797 50 10 IJGE CCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccccc1O)C(C#N)=C(N)O2 1865707666 CLQIWVUMMUCVBU-GOSISDBHSA-N 427.291 4.665 50 10 IJGE COc1ccc(OCC(=O)NNC(=O)c2ccc(SCC(C)C)cc2)c(C(C)(C)C)c1 1865758400 YERCCKAVYNVOHW-UHFFFAOYSA-N 444.597 4.581 50 10 IJGE Cc1nn(Cc2ccccc2)c2c1[C@H](NC(=O)/C(C#N)=C/c1ccc(Cl)cc1)CCC2 1866127906 LYOSXRCAQYDPBH-VOSMRYOYSA-N 430.939 4.994 50 10 IJGE COc1cccc(-c2csc(/C(C#N)=C(\O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)n2)c1 1872744565 YOZZOKQSMSAYMQ-HBWVRPOVSA-N 431.517 4.660 50 10 IJGE C[C@@]12CC[C@@](CCl)(C1)N(C(=O)c1csc(Br)c1Br)C2 1911528654 RJTVTYCSDABFPP-OLZOCXBDSA-N 427.589 4.897 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12 1917525365 JQQMZYNWIUUJHY-LTWPCNGHSA-N 445.138 4.954 50 10 IJGE O=S1(=O)CC[C@H]([C@H](Cl)c2c(Br)sc(Br)c2Cl)C1 1923037428 DCMDCFXWVHKFHK-NJGYIYPDSA-N 443.009 4.641 50 10 IJGE O=C(N[C@@H]1CC[C@@H](CBr)C1)c1cc(Br)c(Br)s1 1942368285 QVEOXVSVVDYRSD-RNFRBKRXSA-N 446.002 4.567 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC[C@H]2C[C@H]2C2CCC2)C1 2022600106 VWEQBDSRTYGLNK-JTDSTZFVSA-N 449.373 4.644 50 10 IJGE FC1(F)C[C@]1(Br)COc1cc(Br)ccc1CBr 2023778084 ASCDGKVFGLSXTK-JTQLQIEISA-N 434.900 4.896 50 10 IJGE BrC[C@]1(Cc2ccc(Br)cc2Br)C[C@]12CCOC2 2039024881 PDDSLEBFTQGUAZ-KBPBESRZSA-N 438.985 4.946 50 10 IJGE C[C@@H](NC(=O)[C@H](Br)C1CCCC1)c1csc(NC(=O)OC(C)(C)C)n1 2051203801 JPIWLELBWVIGFT-ZWNOBZJWSA-N 432.384 4.621 50 10 IJGE CN(C(=O)c1csc(Br)c1Br)[C@H](CCCl)C(F)F 2058235170 UGSFPNCNMVBYGO-ZCFIWIBFSA-N 425.520 4.608 50 10 IJGE Fc1ncc(Cl)cc1-n1nc(CBr)c(Br)c1C(F)(F)F 2078912410 NXLNFPFBHRHNHB-UHFFFAOYSA-N 437.416 4.736 50 10 IJGE CCCN(CC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)[C@H](Br)C1CCCC1 2167032607 NKTCGNBWFUGZBQ-GOSISDBHSA-N 445.442 4.826 50 10 IJGE O=C(c1cccc(OCc2ccccc2)c1)N1C[C@@]2(F)CCC[C@@]2(CBr)C1 2176642202 XHUNEAVMWJKWGN-YADHBBJMSA-N 432.333 4.995 50 10 IJGE CCCC[C@H](C)N(C)S(=O)(=O)c1ccc(Br)c(CBr)c1 2179950849 OTYLPPRMCPWJCY-NSHDSACASA-N 427.202 4.543 50 10 IJGE Cc1sc(Br)c([C@H](Br)[C@@]23CCC[C@H]2CS(=O)(=O)C3)c1C 2203025060 USXATHPBMTVARZ-VHRBIJSZSA-N 442.238 4.778 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)[C@@H](CBr)CC1CC1 2219033866 KJLXKWNAQAOCTD-GFCCVEGCSA-N 442.566 4.940 50 10 IJGE Cc1cc(Br)c(C(=O)NC2(CCBr)CCSCC2)s1 2229322353 IYBKMMSJDWZHJZ-UHFFFAOYSA-N 427.227 4.600 50 10 IJGE Fc1cc(Br)cc(F)c1CO[C@H](CCl)[C@H](Br)CCl 2259032480 ODBSTDOFKINZQN-LDYMZIIASA-N 426.910 4.854 50 10 IJGE CC(C)(C)N(CCBr)Cc1ccc(Cl)cc1I 2302327462 ZMLCXSQKQNYBBX-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE Cl[C@@H]1CCCC[C@@H]1NCc1ccc(I)c(Br)c1 2306232488 VLBUJJBDQGXRJA-YPMHNXCESA-N 428.539 4.693 50 10 IJGE O=C1C(=NNC(=O)C23CC4CC(CC(C4)C2)C3)c2ccccc2N1CC=Cc1ccccc1 2313646626 AUYDXBZWRHVONT-UHFFFAOYSA-N 439.559 4.783 50 10 IJGE CC1(C)C[C@@H](CBr)CN1Cc1ccc(Cl)c(I)c1 2315546185 DQUBEWDTMOIAQS-NSHDSACASA-N 442.566 4.940 50 10 IJGE CCC[C@H](CCBr)NC(=O)c1ccc(Cl)cc1I 2317776683 YXLFFMDEUWRXIM-SNVBAGLBSA-N 444.538 4.628 50 10 IJGE Clc1ccc(CN2C[C@@H](Br)C3(CCC3)C2)c(I)c1 2318557831 OUUDHWHJGGRGKZ-CYBMUJFWSA-N 440.550 4.694 50 10 IJGE Cc1ccc(C=NNC(=O)CSc2nc(O)c3c(-c4ccccc4)c(C)sc3n2)cc1 2320486446 VLIYVBOZGHDERC-UHFFFAOYSA-N 448.573 4.923 50 10 IJGE ClC[C@@H]1C[C@H]2CC[C@H]1N2Cc1ccc(I)c(Br)c1 2325217222 BWLYUSDRDHOPBL-MISXGVKJSA-N 440.550 4.645 50 10 IJGE CN(C[C@@](C)(CBr)C(C)(C)C)[C@H](CNC(=O)OC(C)(C)C)C(F)(F)F 2327107417 VUUFRUMPLIXEDM-MLGOLLRUSA-N 433.353 4.821 50 10 IJGE C[C@H](Br)[C@H]1CCCN(Cc2cc(I)ccc2Cl)C1 2327403115 LVGWVNVVWKCSGB-QWRGUYRKSA-N 442.566 4.940 50 10 IJGE N#CC(=C(O)CCc1nc2ccccc2[nH]c1=O)c1nc(-c2ccc(F)cc2F)cs1 2331292887 RGRVCSHAYSNERH-UHFFFAOYSA-N 436.443 4.750 50 10 IJGE O=C(NCC(F)(F)C(F)(F)CBr)c1cc(Br)c(Cl)s1 2336528886 GTRZUBCZXLITTL-UHFFFAOYSA-N 447.473 4.559 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Cl)C(C)(C)S(C)(=O)=O 2339650892 KDKJRSOCIVYMGJ-LLVKDONJSA-N 436.568 4.762 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)[C@@]1(C(=O)O)CCC(C)(C)C[C@H]1OCc1ccccc1 2378156733 QPUWQBALYRUTLC-MOXWOTFGSA-N 438.406 4.711 50 10 IJGE Cc1cccc(Cn2cc(/C=N\NC(=O)CC[C@H](O)c3ccccc3)c3ccccc32)c1 58888509 BKDLQPJGXQKYQF-VUMGZPTDSA-N 425.532 4.962 50 10 IJGE Cc1nn(-c2cccc([N+](=O)[O-])c2)c(C)c1/C=N/NC(=O)[C@@H](C)c1ccc(CC(C)C)cc1 59158305 RVWFHKYUUAWWBV-AEIQVQRHSA-N 447.539 4.850 50 10 IJGE CCN(C(=O)c1oc2c(c1C)/C(=N\NC(N)=O)CC(C)(C)C2)c1cccc2ccccc12 101110395 FUPBIOMOXHZCEG-IMRQLAEWSA-N 432.524 4.753 50 10 IJGE COc1ccc(OCc2ccc(I)cc2)c(CBr)c1 115098478 QFHZIVCZKZYIEI-UHFFFAOYSA-N 433.083 4.774 50 10 IJGE N#C/C(=C/c1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1)C(=O)NCc1ccccc1 208233566 DLLHMQQVJDGBEA-BXBOZWQASA-N 428.332 4.782 50 10 IJGE Cc1cccc(N2CCN(/C=C(/C#N)C(=O)N[C@@H](C)c3ccc4c(c3)CCCC4)CC2)c1C 217203926 YDADSGKPXAQJKV-VQGOXPAXSA-N 442.607 4.589 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)N/C=C(/C#N)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 217228595 PLWDYXJSNAZNEN-UZFBZYOGSA-N 428.876 4.652 50 10 IJGE CCC(CC)N(CCBr)S(=O)(=O)c1ccc(Cl)c(Br)c1 232900217 CGTRTYAZSLVVJQ-UHFFFAOYSA-N 447.620 4.677 50 10 IJGE CCn1c2ccccc2c2cc(NC(=O)CC(C)=NNC(=O)c3ccccc3O)ccc21 254804574 WELXBGLOQDWMGN-UHFFFAOYSA-N 428.492 4.655 50 10 IJGE CCC(CC)[C@@H](Br)CNS(=O)(=O)c1c(Cl)cccc1Br 312323035 HNLMGKUDYVPUGC-NSHDSACASA-N 447.620 4.581 50 10 IJGE CC(C)(C)C[C@H](CCl)NS(=O)(=O)c1cc(Br)ccc1Br 393428049 HEHVLDCYZMYYMQ-SNVBAGLBSA-N 447.620 4.534 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N[C@H](Cc2nccn2C)c2ccccc2)c(C)n1CC(C)C 744376268 WIGGYMOQEQVAAF-JXCKLXDISA-N 429.568 4.502 50 10 IJGE O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)NN=Cc1ccc(Cl)cc1Cl 1083875698 QXUFEQBEZDRROK-UHFFFAOYSA-N 441.321 4.754 50 10 IJGE Cc1cc(C=NNC(=O)[C@H]2COc3ccccc3O2)c(C)n1-c1cccc(Cl)c1Cl 1084348353 OYTHOMMBSNRJKN-HXUWFJFHSA-N 444.318 4.691 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@H](C)c2ccc3nc(O)oc3c2)c(C)n1-c1ccc(F)cc1 1131894300 HCZUHXKEANVCBJ-SKCQWOFPSA-N 444.466 4.864 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2oc3cc(OC)ccc3c2-c2ccccc2)c1 1558200008 QEHNJSSBTPXAPE-UHFFFAOYSA-N 441.512 4.721 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(Oc3cccc(C)c3)cc2)cc1 1562123749 YIGSOTJQEKAOML-SFHVURJKSA-N 447.491 4.610 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)c1ccc(S(=O)(=O)C(F)F)cc1 1915759352 BPLGGBIRDNEAQS-UHFFFAOYSA-N 432.330 4.863 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1Cc1cccc(Br)c1Br 1943884218 PBJBCEDPBMNCOB-MWLCHTKSSA-N 425.990 4.959 50 10 IJGE O=C(c1ccc(O)c(Br)c1)N(CCCBr)Cc1ccccc1 1961201788 XIVBOMQSGAQMBM-UHFFFAOYSA-N 427.136 4.582 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CC[C@@]23CC[C@@](C)(CI)O3)C1 1986985111 KTCGHSXRWHZOSI-BZSNNMDCSA-N 435.346 4.540 50 10 IJGE CCC[C@@H](CBr)CNC(=O)c1scc(Br)c1Br 2008118556 FPRCVSRFOBYDDK-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE CCC[C@@](C)(CBr)NC(=O)c1ccc(Br)cc1Br 2029945467 OZFPFYOYNNKGLM-ZDUSSCGKSA-N 441.989 4.895 50 10 IJGE Fc1cc(F)c(-n2nc(CBr)c(Br)c2C(F)(F)F)c(F)c1 2079232568 ZJFDWXPQZJTAMZ-UHFFFAOYSA-N 437.963 4.966 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)[C@@H](Br)C2CCCC2)n1 2082968118 SGBYXMVSNYXTQT-GWCFXTLKSA-N 432.384 4.621 50 10 IJGE CCC[C@@H]1CN(c2ncc(I)cc2Br)C[C@@H]1CCl 2084893743 NICSRKFNTFWTDE-ZJUUUORDSA-N 443.554 4.540 50 10 IJGE CCC(CC)(CBr)CN1C[C@@]23CCC[C@@]2(C1)CN(C(=O)OC(C)(C)C)C3 2106782508 QWZHBIBEJIKUFR-NHCUHLMSSA-N 429.443 4.911 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCCC[C@H]1CN(C[C@@H](CBr)c1ccccc1)C2 2169634114 OOQLNCGOWPUPJG-DXIQSLLYSA-N 437.422 4.934 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1 2226353709 HRPADLLNTPQMKT-IYBDPMFKSA-N 436.375 4.795 50 10 IJGE O=S(=O)(Nc1ccc(Cl)cc1CBr)c1sccc1Br 2231152783 NKAFJGQVDGFONY-UHFFFAOYSA-N 445.585 4.860 50 10 IJGE CC1(C)[C@H]2CC[C@@H](C2)[C@@]1(CI)O[C@@H]1CCN(Cc2ccccc2)C1 2250384992 DZWXRQWHWBSEQY-CTAFRAEOSA-N 439.381 4.907 50 10 IJGE CC(C)(C)OC(=O)N1CC[S@@](=O)(=NCCCCCCCBr)C(C)(C)C1 2263164087 CXFXGPMWHRGIHS-VWLOTQADSA-N 439.460 4.829 50 10 IJGE O=C(N[C@@]1(CCl)C[C@H]2CC[C@H]1C2)c1csc(Br)c1Br 2268610413 OPSYVSJMQKNKJY-UVPNAGLESA-N 427.589 4.801 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H]2CC[C@@H](Br)[C@H]1CC2 2285848824 ROMSHKFXCFWBQD-WIMUKIRHSA-N 425.523 4.772 50 10 IJGE CCCOc1ccc(C=C(C#N)C(=O)Nc2ccc(I)cc2C)cc1 2293190689 AAQOMBGAJNWIPN-UHFFFAOYSA-N 446.288 4.934 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)cc(Br)c1OC(C)=O 2297559172 XZMQBZXDBWHOMY-UHFFFAOYSA-N 443.297 4.627 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Cl)c(I)c2)C[C@H]1Br 2300237950 FBCKFNFWEPWEGG-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NCc1ccc(Cl)c(I)c1 2300241430 ZAYUDQAIRQGXLY-KOLCDFICSA-N 430.555 4.986 50 10 IJGE CC[C@@H]1CN(Cc2ccc(I)c(Br)c2)C[C@H]1Cl 2306219934 RLFQXMYCFOUYCD-ZYHUDNBSSA-N 428.539 4.503 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2CC(Br)C[C@@H]2C1 2327407184 PGTATQRPRDENLK-NXEZZACHSA-N 440.550 4.550 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC(F)(F)C[C@H]1CN(CC1(CBr)CCC1)C2 2344057433 SOFJWABSVQTVOV-KSSFIOAISA-N 437.369 4.566 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3[C@@H](CCC[C@H]3NC(=O)OC(C)(C)C)C2)C1 2345010084 JKJJDWNBDTYSGS-GVDBMIGSSA-N 429.443 4.813 50 10 IJGE FC(F)(F)[C@@H]1C[C@@]1(CCl)CNCc1ccc(Cl)c(I)c1 2362371372 PTQTZARHQVTGQM-VXGBXAGGSA-N 438.058 4.842 50 10 IJGE Cc1ccc([C@@H](C(=O)NC2CCC(C)CC2)N(Cc2ccccc2)C(=O)CCl)cc1 4672674 OVYQNCRALCOWQR-HTIOENIKSA-N 426.988 4.999 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)c2cccs2)cc1Br 14640690 KZQVJUPVRUQBKB-UHFFFAOYSA-N 425.348 4.545 50 10 IJGE Cc1ccc(OCCOc2ccc(/C=C(/C#N)C(=O)NCc3ccco3)cc2Cl)cc1 33534322 DUWWLNXFYUSCLK-UYRXBGFRSA-N 436.895 4.923 50 10 IJGE CCOC(=O)C1=C(c2ccc(OC)cc2)OC(N)=C(C#N)[C@@H]1c1ccc(Cl)c(Cl)c1 35576449 OXYIGKPVMSCGTP-SFHVURJKSA-N 445.302 4.784 50 10 IJGE CCCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(-c3ccc(C(=O)OCC)cc3)o2)C1=O 38603674 KRZHYKFAXGCVSK-XSFVSMFZSA-N 432.476 4.516 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(F)c2)cc1 38677973 WNVYKRXQZPTOQY-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@@H]2C)oc2c1/C(=N/NC(=O)c1cccs1)CCC2 40823679 HILMBUSTZOFXBC-JRFLEOCRSA-N 433.533 4.711 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2cccc(C(C)C)c2)c(OCC)c1 40867337 VYNKOEDULMSURR-UDWIEESQSA-N 437.492 4.663 50 10 IJGE COc1ccc(C(=O)N/N=C/c2cn(-c3ccccc3)nc2-c2cccc(C)c2)cc1OC 48572118 DJATXJMWNSQPET-JVWAILMASA-N 440.503 4.629 50 10 IJGE COc1ccc(NS(=O)(=O)c2ccc(N/C=C(/C#N)c3nc4ccccc4o3)cc2)cc1 108769348 NELHNRWZUFAWLF-NXVVXOECSA-N 446.488 4.614 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@H](CCBr)C1 125153634 JHSAMSZEMBWXEK-ZETCQYMHSA-N 446.002 4.520 50 10 IJGE CC(=O)N(N=Cc1ccc(Cl)cc1)C1=NN(C(C)=O)[C@@H](c2ccc(Cl)cc2)S1 254792886 SOCPILHROBFYQC-GOSISDBHSA-N 435.336 4.741 50 10 IJGE CC[C@H](NC(=O)c1cc(Br)ccc1Br)[C@H](Br)CC 313094316 VTXSXJMQDQFIMU-PWSUYJOCSA-N 441.989 4.894 50 10 IJGE CC1(C)OC[C@H](Cc2cc(Cl)ccc2I)[C@H]1Br 405540282 RMYOJPTYBICSLN-JOYOIKCWSA-N 429.523 4.676 50 10 IJGE CN(Cc1cc(Cl)ccc1I)C[C@@H](Br)C1CC1 690333493 RVYOBDCTOKTIJS-GFCCVEGCSA-N 428.539 4.550 50 10 IJGE CC(C)[C@@H](CCBr)NC(=O)c1scc(Br)c1Br 705396960 AKUKWLLGRHWJDV-MRVPVSSYSA-N 448.018 4.813 50 10 IJGE Fc1cc2nc(CCl)n(Cc3cnc(Br)s3)c2cc1Br 718872850 AXAMEBPSWQKBIM-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N(C)[C@H](c2ccccc2)C(F)(F)F)c(C)n1C[C@@H]1CCCO1 728499865 YMHXZYZQWPLQDR-FJYHIXCVSA-N 445.485 4.953 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)c(C(F)(F)F)c1 799383323 KMHIDZGTFLZKMN-UHFFFAOYSA-N 429.358 4.571 50 10 IJGE Cc1cc(Br)cc(Br)c1OCC(=O)NN=C1CCC[C@@H](C)C1 1084216082 LNEJYPQQINUPKD-SNVBAGLBSA-N 432.156 4.581 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1ccn(-c2ccc(Cl)cc2Cl)n1 1585173298 BDPMTIMVLCKMEA-UHFFFAOYSA-N 431.308 4.542 50 10 IJGE CCOc1c(C=NNC(=O)COc2ccc(Br)cc2C(C)C)cccc1OC 1772755603 NUHHBEAKNQCXHN-UHFFFAOYSA-N 449.345 4.509 50 10 IJGE Cc1nn(-c2ccccc2Cl)c2c1[C@@H](c1cccc(Br)c1)C(C#N)=C(N)O2 1865684027 LLDYWYYERAHWJR-SFHVURJKSA-N 441.716 4.815 50 10 IJGE COc1ccc(-c2nn(Cc3ccc(C)cc3)c3c2[C@H](c2ccncc2)C(C#N)=C(N)O3)cc1 1865701810 GALGSMIEYRIMNX-HSZRJFAPSA-N 449.514 4.529 50 10 IJGE Cc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865705366 TYAZGPZFFLFLFG-JOCHJYFZSA-N 434.927 4.899 50 10 IJGE CN(C[C@H]1C[C@@H]1Br)C(=O)C(C)(C)c1ccc(NC(=O)OC(C)(C)C)cc1 1887829640 LTKYKVWZSXCGDI-CJNGLKHVSA-N 425.367 4.553 50 10 IJGE C[C@@H](CCl)C(=O)Nc1cc(Br)c(Br)c(Br)c1 1938593500 FMFSMKNSGAEPQI-YFKPBYRVSA-N 434.353 4.788 50 10 IJGE CC[C@H](NC(=O)c1c(Br)cccc1Br)[C@@H](C)Br 1945321856 JAWXQZLYKKISMC-XCBNKYQSSA-N 427.962 4.503 50 10 IJGE O=C(CCl)c1c(C(F)(F)F)ccc(OC(F)(F)F)c1I 2055151161 ASUHYCCEKXNWPI-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE Cn1nc(COc2c(Br)cc(Cl)cc2CCl)cc1Br 2111922766 MUZAGRPUJGXOHW-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE CCN(CC)[C@H](C)CO[C@H](CI)c1ccc(Br)cc1 2119219563 ROAANOMPGYBNES-IUODEOHRSA-N 440.163 4.672 50 10 IJGE CC(C)(C)OC(=O)N1CCN(Cc2ccc(CBr)cc2)[C@@H](C(F)(F)F)C1 2130133651 WDJQPFCBRSFRIH-OAHLLOKOSA-N 437.300 4.565 50 10 IJGE CC(C)(C)OC(=O)NC1(C2CCN(C[C@@H](CBr)c3ccccc3)CC2)CC1 2163057747 DWXXUHXLSGUXJB-GOSISDBHSA-N 437.422 4.934 50 10 IJGE CC[C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CN1C[C@@H](CBr)c1ccccc1 2163065291 ZBJJAZGNGVDERD-IYWMVGAKSA-N 437.422 4.742 50 10 IJGE CN(CCCCCI)[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2211185028 HABJSEDOPNPLRQ-PMOLBWCYSA-N 426.386 4.719 50 10 IJGE C[C@@H]1C[C@@H](Br)[C@@H](C)N(Cc2ccc(I)c(Cl)c2)C1 2220345115 QPCKGZYYZODVLR-CKYFFXLPSA-N 442.566 4.938 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CCCOCC2)cc1I 2257374909 VWFRFSZLCPOBLB-IINYFYTJSA-N 425.104 4.553 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CC[C@@H]2[C@@H](CCN2C(=O)OC(C)(C)C)C1 2297084588 DKDNOIRHHSBGMX-YHUYYLMFSA-N 447.414 4.700 50 10 IJGE Fc1cccc(OCc2sccc2I)c1CBr 2301074706 VFGXULPNYIHXMB-UHFFFAOYSA-N 427.076 4.966 50 10 IJGE Cc1cc(C)nc(Sc2ccc(C=C(C#N)C(=O)Nc3ccccc3)cc2[N+](=O)[O-])n1 2313670552 FMNZNBWLZDBGRW-UHFFFAOYSA-N 431.477 4.699 50 10 IJGE Clc1ccc(CN2C[C@@H]3CC[C@H](C2)C3Br)cc1I 2315555359 PVIQBGOIJJTECF-BVUQATHDSA-N 440.550 4.550 50 10 IJGE CN(CC[C@H]1CCCCN1C[C@@]1(CBr)CC1(F)F)C(=O)OC(C)(C)C 2326919538 OHORWPHVPMRCIV-PBHICJAKSA-N 425.358 4.518 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@H]2CC[C@H]1[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]21 2353832317 YIYXKVWNFBMQHU-FQBWVUSXSA-N 429.443 4.621 50 10 IJGE CCCCOc1ccc(/C=N/NC(=O)CSc2nc3ccccc3s2)cc1OC 32519878 IYLUDVJKNSWLJL-LPYMAVHISA-N 429.567 4.726 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2ccccc2OCc2ccc(C)cc2)cc1 58895475 HWCJAWXFOTXCSY-UEYTXEIUSA-N 446.547 4.937 50 10 IJGE Cc1nc(Cn2c([C@H](C)Cl)nc3cc(I)c(F)cc32)cs1 97408899 SMTPTGXEANYWAQ-ZETCQYMHSA-N 435.693 4.893 50 10 IJGE COc1ccc(CN2C(=O)C(C#N)=C(C)/C(=C\c3ccc(-c4ccc(F)cc4)o3)C2=O)cc1 101340015 QJJFVZPKMUUCKG-LPYMAVHISA-N 442.446 4.887 50 10 IJGE Brc1ccc([C@H](CI)OC[C@@H]2CCCCO2)cc1 161961382 QYFTYLQVKMRDJE-KBPBESRZSA-N 425.104 4.511 50 10 IJGE COc1cc(Br)cc(/C=N\NC(=O)c2c(C)ccc3ccccc23)c1OC 169921580 RLAQTXQGIWIKJT-FMCGGJTJSA-N 427.298 4.692 50 10 IJGE CCOc1c(OC)cc(/C=N\NC(=O)Cc2cc(Cl)ccc2SCC)cc1OC 169922281 HMZVDJMDBXREDP-QRVIBDJDSA-N 436.961 4.561 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(-c3ccccc3)cc2)cc(Br)c1O 254395261 MICZLXPEISVECG-UHFFFAOYSA-N 425.282 4.594 50 10 IJGE CC(C)([C@@H](Br)c1scc(C(F)(F)F)c1Br)S(C)(=O)=O 306111361 UIWHHZODBDKLDR-QMMMGPOBSA-N 444.132 4.789 50 10 IJGE CC(C)[C@H](CBr)CNC(=O)c1cc(Br)cc(Br)c1 394185832 YKMOTUYPZSEUMA-SNVBAGLBSA-N 441.989 4.609 50 10 IJGE CC(C)[C@](C)(CBr)NC(=O)c1cc(Br)c(Br)s1 398553129 JGVBUWARKPKFMA-NSHDSACASA-N 448.018 4.813 50 10 IJGE CC(C)(C)N(CCBr)C(=O)c1cc(Br)ccc1Br 690980394 KQDLMKQRDNVBLY-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE FC(F)(F)C[C@H](CCl)Nc1ncc(C(F)(F)F)cc1I 717696556 MDCYMYAPXKCKKU-ZCFIWIBFSA-N 432.533 4.677 50 10 IJGE COc1ccc(COCc2cccc(NC(=O)NNC(=O)c3ccc(Cl)cc3)c2)cc1 756245077 LHLNWDAPUWSPLO-UHFFFAOYSA-N 439.899 4.532 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OCc2cccc(C#N)c2)c(-c2ccc(Cl)cc2)n1 782091222 DFQNRXKIOUWMCH-UDWIEESQSA-N 441.878 4.639 50 10 IJGE Cc1ccc(-n2c(C)cc(C=NNC(=O)C(=O)Nc3cc(Cl)ccc3C)c2C)c(C)c1 1083967822 BWLCZJLCXZCKPA-UHFFFAOYSA-N 436.943 4.762 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)[C@@H](Sc2ccc(F)cc2)c2ccccc2)c1 1154050246 HJIIVQPFUMGZGV-NRFANRHFSA-N 435.549 4.658 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)c2ccccc2)cc1 1866938412 DIWGOVQLKUPEAH-YTFSRNRJSA-N 445.519 4.999 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)c1ccccc1S(=O)(=O)C(F)(F)F 1914352231 DJNUBIQWFPGSOY-CYBMUJFWSA-N 436.293 4.770 50 10 IJGE O=C(N[C@H](CCl)CC1CCCC1)c1ccc(I)c(Cl)c1 1926735435 JCQNMVHIWYIBPV-LBPRGKRZSA-N 426.125 4.862 50 10 IJGE Cc1ccc(I)cc1-n1c(Cl)nc(Cl)c1CBr 2006646957 DUFSBMBTPYQCHN-UHFFFAOYSA-N 445.913 4.987 50 10 IJGE CCC(CC)[C@H](Cl)CNc1ncc(I)cc1Br 2015757500 URLRQOYLYCZORQ-LLVKDONJSA-N 431.543 4.904 50 10 IJGE C[C@H](CNC(=O)c1c(Br)cccc1Br)C[C@@H](C)Br 2033089481 UCFIWJITOCQWBN-DTWKUNHWSA-N 441.989 4.751 50 10 IJGE CC[C@H](Br)CN(CC)C(=O)c1cc(Cl)ccc1I 2044550373 KCRPQPDWONOCMI-VIFPVBQESA-N 444.538 4.580 50 10 IJGE C[C@@H](CCBr)CCN1CCC[C@@H](N(CC(F)F)C(=O)OC(C)(C)C)C1 2044698709 DTVJQJQSLPGATF-LSDHHAIUSA-N 427.374 4.764 50 10 IJGE C[C@H]1CCCN(c2ncc(I)cc2Br)[C@@H]1CCCl 2069527303 BDOXWSXEPSRBQB-JOYOIKCWSA-N 443.554 4.683 50 10 IJGE Brc1ccc(Br)c([C@H](Br)[C@@H]2CCn3ncnc3C2)c1 2108964067 ANFWJJNSZCVDGW-AMIZOPFISA-N 449.972 4.502 50 10 IJGE CC[C@@H]1CN(C(=O)[C@H](Br)C2CCCC2)[C@H](CC)CN1C(=O)OC(C)(C)C 2110715450 NLZHAXAACNTQOI-BRWVUGGUSA-N 431.415 4.577 50 10 IJGE CCn1cc([C@H](Cl)c2cc(Br)c(OC)cc2F)nc1Br 2202910052 ITHXNAFZMCDLAI-GFCCVEGCSA-N 426.511 4.904 50 10 IJGE CN(CCCCCI)[C@@H]1C[C@@H]2C[C@@H](OCc3ccccc3)C[C@H]21 2211185115 PDZIYSRHOPWTDI-MTQWCTHYSA-N 427.370 4.907 50 10 IJGE CO[C@@H]1CC[C@H]1COc1c(Br)cc(Br)cc1CBr 2220575495 JEQCABLWRGOZMU-QPUJVOFHSA-N 442.973 4.910 50 10 IJGE C[C@@H]1CCC[C@@H]([C@@H](Br)c2cc(I)cc3c2OCC3)O1 2226862866 DZVYWMTVAFEIMJ-IIMNLJJBSA-N 437.115 4.620 50 10 IJGE CN(C[C@H]1CC1(Br)Br)[C@H](CBr)c1ccccc1 2253362061 BZMJWRLGCQDSPJ-VXGBXAGGSA-N 425.990 4.560 50 10 IJGE C[C@@H](Br)[C@H](NC(=O)c1scc(Br)c1Cl)C(F)(F)F 2253534500 AVJYXDOYLPGAQF-NFNCENRGSA-N 429.483 4.608 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CCCCCCCBr)C2(CCOCC2)C1 2294695951 CAJUEYLAYKEJKT-GOSISDBHSA-N 447.458 4.728 50 10 IJGE CCOC(=O)N1CCc2cc(NC(=O)C(C#N)=Cc3cccc(Br)c3)ccc21 2329698964 RTANVRMVPQGGFK-UHFFFAOYSA-N 440.297 4.514 50 10 IJGE CN(Cc1c(Br)cccc1Br)c1ncc(CBr)cn1 2340585395 BCMZOTSOBKTXBT-UHFFFAOYSA-N 449.972 4.533 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@@H]1C[C@@H]2CCC[C@H](C1)C2(F)F 2369432904 IGWVSHRYELABCM-FCGDIQPGSA-N 444.360 4.935 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(OCc2cc(C(C)(F)F)ccn2)CC1 2381513646 ZOMFFVJQAHMSFN-UHFFFAOYSA-N 449.336 4.875 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(=O)Nc1ccc([N+](=O)[O-])cc1 33930309 CYGCSFSDQRXVPR-XFXZXTDPSA-N 438.783 4.962 50 10 IJGE N#C/C(=C/c1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 35484932 NESGVXVIMDVUFR-CYVLTUHYSA-N 435.443 4.993 50 10 IJGE CC(C)c1ccc(O[C@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccco2)cc1 38657561 AKJFVQDIBXHEPR-GYCJOSAFSA-N 444.487 4.994 50 10 IJGE CCc1cccc(OCC(=O)N/N=C/c2ccc(OCc3ccc(C)cc3)c(OC)c2)c1 40888542 QOOYGYFZVQXPCL-JVWAILMASA-N 432.520 4.674 50 10 IJGE Cc1sc(-n2c(C)cc(/C=N/NC(=O)CC[C@H](O)c3ccccc3)c2C)c(C#N)c1C 58890532 WEVJZUOCIHAGHU-RVWJGDDESA-N 434.565 4.608 50 10 IJGE N#C/C(=C/Nc1ccc2oc(=O)ccc2c1)c1nc(-c2cc3ccccc3oc2=O)cs1 102417915 UVLSWBCOMDLNRY-VBKFSLOCSA-N 439.452 4.999 50 10 IJGE C[C@@H](C[C@@H](C)Br)NC(=O)c1cc(Br)c(Br)s1 165526715 CDUMVHADGWRLIT-RITPCOANSA-N 433.991 4.565 50 10 IJGE CC(C)(C)S(=O)(=O)CCOc1c(Br)cc(CCl)cc1Br 232636001 VZXFDIFRXCAIDX-UHFFFAOYSA-N 448.604 4.543 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CCC[C@H](Br)CC1 378697453 LQZOEXPYQQGACW-VIFPVBQESA-N 439.973 4.601 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1C[C@H]1CCCN1Cc1ccccc1 390599810 VOPAPEKJAOVHKY-QGZVFWFLSA-N 433.781 4.640 50 10 IJGE O=C(N[C@@H]1CCC[C@@H](Br)C1)c1cc(Br)cc(Br)c1 694505942 MJJIVRHYXYXBDE-BXKDBHETSA-N 439.973 4.648 50 10 IJGE O=S1(=O)CCC[C@H]1CC(CBr)(CBr)C1CCCCCC1 696814551 ABHVSWARZAWIGN-AWEZNQCLSA-N 430.246 4.700 50 10 IJGE ClCCCc1nnc(-c2ccc(I)c(Br)c2)s1 721576399 GTCDDAPLZDKYFW-UHFFFAOYSA-N 443.535 4.744 50 10 IJGE N#Cc1c(F)ccc(C=NNC(=O)c2ccccc2OCc2ccc(F)cc2)c1Cl 761749116 UAHPCABCCXUCRF-UHFFFAOYSA-N 425.822 4.833 50 10 IJGE N#Cc1ccc(NNC(=O)NCc2ccnc(Oc3ccccc3F)c2)c(C(F)(F)F)c1 799631307 KCEQSAFBSIZJPU-UHFFFAOYSA-N 445.376 4.730 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccccc2NC(=O)c2cccs2)c(C(F)(F)F)c1 799753077 MAZMYNAQBALSRF-UHFFFAOYSA-N 430.411 4.648 50 10 IJGE CC(C)(C)OC(=O)c1cnc(C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)cn1 801653525 HAPOZBQVTTYDQV-MRXNPFEDSA-N 447.866 4.904 50 10 IJGE O=C(NN=Cc1cccc(OCc2ccccc2)c1)C(=O)Nc1cc(Cl)cc(Cl)c1 1084107939 NSQPUMZMRZMDEU-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2ccc(-c3cccc(Cl)c3)o2)cc1 1084247939 RMMVZZKBCOWBPG-NRFANRHFSA-N 426.900 4.963 50 10 IJGE C#Cc1ccc(CNC(=O)NNC(=O)c2ccc(COc3ccc4ccccc4c3)cc2)cc1 1672882390 GEXSJOZUMHONCU-UHFFFAOYSA-N 449.510 4.544 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)C(=NNC(=O)COc2ccccc2)CCC3)cc1 1772748680 CLMUVZRLHYQEPJ-UHFFFAOYSA-N 446.503 4.605 50 10 IJGE O=C(NNS(=O)(=O)c1ccccc1Cl)c1ccc(-c2ccc3ccccc3c2)s1 1860405347 JZMPHLLATIEDEX-UHFFFAOYSA-N 442.949 4.845 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1sccc1C)C(C#N)=C(N)O2 1865699240 ODRGBVHIYUZNHR-KRWDZBQOSA-N 428.920 4.874 50 10 IJGE COc1ccc(-c2ccc(C(=O)N/N=C\c3c(Cl)nc4scc(C)n34)c(C)n2)cc1 1865762173 RGVWGDGNHODWSJ-RMORIDSASA-N 439.928 4.501 50 10 IJGE CCC[C@H](CC)N(C)S(=O)(=O)c1cc(CBr)sc1Br 1879157275 YHBHTLNFOBIZJP-VIFPVBQESA-N 433.231 4.605 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1ccc(Br)s1 1916369625 HYVLJYWQUIMFKA-CYBMUJFWSA-N 447.192 4.563 50 10 IJGE O=C(N[C@H]1CC[C@H](CBr)C1)c1scc(Br)c1Br 1942372754 ZKOWEOHTYCJEBM-BQBZGAKWSA-N 446.002 4.567 50 10 IJGE C[C@H]1C[C@@H]1N(CCBr)Cc1ccc(Br)cc1Br 2002025356 BYFCEZCBOAJTME-ZANVPECISA-N 425.990 4.817 50 10 IJGE CC(C)(C)[C@@H](CCl)CNc1ncc(I)cc1Br 2015765866 HPQMGDCYFRWDLX-QMMMGPOBSA-N 431.543 4.762 50 10 IJGE C=CC[C@H](CBr)CNC(=O)c1cc(Br)c(Br)s1 2023521867 WNUZJEVMJDEJOS-SSDOTTSWSA-N 446.002 4.590 50 10 IJGE CCN(C[C@@H](Br)C(F)(F)F)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2044704732 GAJHDUBUSAMKBF-QNMSZWNNSA-N 429.321 4.565 50 10 IJGE CN(c1ncc(I)cc1Br)C1(CCl)CCCCC1 2069527663 CYZYFRYNVBVFNA-UHFFFAOYSA-N 443.554 4.827 50 10 IJGE Cc1ccc(Cn2nc(CCl)c(I)c2C(F)(F)F)c(F)c1 2079211384 QQUJVFAFUSYTQM-UHFFFAOYSA-N 432.586 4.741 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1cc(Br)ccc1Cl 2081235482 GPIVCYKPMACNHC-QPUJVOFHSA-N 444.538 4.682 50 10 IJGE BrC[C@@]12CCCC[C@H]1N(c1ccc(I)cn1)CCC2 2108957428 ZIWWOFXIICITLK-HIFRSBDPSA-N 435.147 4.610 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@H]2C[C@@H](Br)CC[C@H]2C1 2115941154 XGEJREGYESSHSH-YIZRAAEISA-N 427.589 4.800 50 10 IJGE Cl[C@@H]1Cc2ccccc2[C@H]1Nc1ncc(I)cc1Br 2133370367 ACZQYCJNORXCLD-CHWSQXEVSA-N 449.517 4.765 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CCC[C@@H](CN(C[C@H](CBr)CC3CC3)C1)C2 2135002295 VMNGYLDVIJLLTC-LQWHRVPQSA-N 429.443 4.815 50 10 IJGE CC[C@H](CCCCl)NS(=O)(=O)c1cc(Br)c(C)cc1Br 2154035066 FSQMUHOOJIMQQR-SNVBAGLBSA-N 447.620 4.596 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC2(CCC2)[C@H]1NC(=O)[C@H](Br)C1CCCC1 2167033555 RVYFYIRPYGYESJ-BBWFWOEESA-N 443.426 4.530 50 10 IJGE Cn1cc(Br)c(-n2c(CCl)nc3cc(Cl)c(Br)cc32)n1 2169015419 MHFSHYYLPWNKAV-UHFFFAOYSA-N 438.938 4.676 50 10 IJGE CC(C)[C@@H]1CN(c2cc([N+](=O)[O-])ccc2CBr)CCN1Cc1ccccc1 2176905040 QWCOXDYAIQSRGP-NRFANRHFSA-N 432.362 4.837 50 10 IJGE Brc1ccccc1[C@H](CI)OC1CC(n2ccnc2)C1 2183689728 UIRTUCYWJUIFDW-QOZQQMKHSA-N 447.114 4.542 50 10 IJGE O=C(c1ccc(Br)cc1Cl)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Br)C2 2190679448 QKLDQWMMZMZPIF-SKZLGDCLSA-N 425.523 4.581 50 10 IJGE CN([C@H]1CCCC1(C)C)S(=O)(=O)c1cc(CBr)sc1Br 2198043441 RPINHRWDMCDUHH-NSHDSACASA-N 445.242 4.605 50 10 IJGE CCC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C[C@@H](CBr)c1ccccc1 2231938884 CSUBDXGYCVEYCY-RTBURBONSA-N 425.411 4.887 50 10 IJGE C[C@@H]1[C@@H](Br)C[C@H]2CC[C@H]1N2C(=O)c1scc(Br)c1Cl 2264510438 UIWYLGARXOLUCY-BDNRQGISSA-N 427.589 4.941 50 10 IJGE CS(=O)(=O)c1cscc1[C@@H](Br)c1ccc(F)c(Br)c1 2272850958 BUPNQIWDAKKKIC-LBPRGKRZSA-N 428.142 4.538 50 10 IJGE Cc1cc(F)c(CBr)c(N2CC[C@@]3(CN(Cc4ccccc4)CCO3)C2)c1 2283385256 FVTURXPHUZAYRS-JOCHJYFZSA-N 433.365 4.510 50 10 IJGE Cc1cc(F)c(CBr)c(N2CC[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1 2283531297 JQFNTUHXFIVVCF-FGZHOGPDSA-N 433.365 4.509 50 10 IJGE C[C@H]1C[C@H](CBr)CN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285844570 OPECOIJNVRMNFH-DTWKUNHWSA-N 427.539 4.735 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1Cc1ccc(Cl)c(I)c1 2300238292 JDXRLXHALCYFLZ-KOLCDFICSA-N 428.539 4.692 50 10 IJGE C[C@@H]1CO[C@@](CBr)(Cc2ccc(Cl)cc2I)C1 2302315070 FLORSBXKPHIRFN-TVQRCGJNSA-N 429.523 4.677 50 10 IJGE CC1(C)[C@H](Br)CCN1Cc1cc(I)ccc1Cl 2307324040 HIWJSUUQTCKMLF-GFCCVEGCSA-N 428.539 4.692 50 10 IJGE BrC[C@H]1C[C@@H]2CN(Cc3c(Br)cccc3Br)C[C@H]12 2309714732 HKCQCAJBTUVTJR-GMTAPVOTSA-N 438.001 4.674 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2C[C@@H]2C(F)(F)F)cc1I 2313039161 HUJMBIBYOABKKU-VHSKPIJISA-N 435.021 4.934 50 10 IJGE CCc1ccc(N(C(=O)C(C#N)=Cc2ccccc2OC)S(=O)(=O)c2ccccc2)cc1 2314777462 GFQCMPPULIHCBT-UHFFFAOYSA-N 446.528 4.587 50 10 IJGE Clc1ccc(CN2CCC(CCBr)CC2)c(I)c1 2318540309 RICMIBCMTRLVEO-UHFFFAOYSA-N 442.566 4.942 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)C(C#N)=CN(Cc1ccccc1)c1ccccc1 2324430070 BZYDYVSGOIJIOO-UHFFFAOYSA-N 425.488 4.916 50 10 IJGE Cc1cc(C(=O)N2CCC[C@@H](Br)[C@@H]2C(F)(F)F)sc1Br 2370241068 JNSIUNUGOKAHCG-VXNVDRBHSA-N 435.103 4.749 50 10 IJGE CC[C@@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)COc1ccc(-c2ccccc2)cc1 9873663 UYAXXNKBKQAICV-UXHICEINSA-N 446.547 4.861 50 10 IJGE CCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(C)cc2)c1 38649260 VWOBTEHTEYFIOX-XMMPIXPASA-N 426.472 4.831 50 10 IJGE COc1ccc(CCNC(=O)/C(C#N)=C\c2cn(-c3ccccc3)nc2-c2ccccc2)cc1 96505760 CMVLEWHVYAPXHT-NKFKGCMQSA-N 448.526 4.814 50 10 IJGE C[C@H]1OCC[C@@]1(CBr)Cc1cc(Cl)ccc1I 405500654 CDCXTNSBVZFQLL-RNCFNFMXSA-N 429.523 4.677 50 10 IJGE C[C@@H](NC(=O)c1cc(Br)ccc1Br)C1(CBr)CC1 696075402 DOQDRNDLAYQLKQ-MRVPVSSYSA-N 439.973 4.505 50 10 IJGE CCC(CC)(CBr)NC(=O)c1scc(Br)c1Br 705400165 MKQDPCSWSCWFGI-UHFFFAOYSA-N 448.018 4.957 50 10 IJGE CC(C)N(CCCBr)C(=O)c1scc(Br)c1Br 705400240 NCRQTCCSMRNYHH-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCC[C@H](CBr)C1 705401937 SFCOHHFLAKBTTK-SSDOTTSWSA-N 446.002 4.520 50 10 IJGE Cc1ccc(-c2nc(C)c(C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)s2)c(C)c1 736696749 MXUDFXVGNICRDY-UHFFFAOYSA-N 444.564 4.961 50 10 IJGE Cc1ccc(NNC(=O)N[C@@H](C)c2sc(-c3ccc(Br)cc3)nc2C)nc1 740062174 LDTFTHRXGBOJMS-ZDUSSCGKSA-N 446.374 4.972 50 10 IJGE Cc1csc(CC(=O)NN=Cc2c(C)nn(-c3ccccc3)c2Oc2cccc(F)c2)n1 766692720 IYECHOCMOIGDTR-UHFFFAOYSA-N 449.511 4.570 50 10 IJGE CO[C@H]1CCCC(=NNC(=O)c2ccc(CN3C(=O)c4cccc5cccc3c45)cc2)C1 794465951 RHRZIHIRRHOXQQ-NRFANRHFSA-N 427.504 4.675 50 10 IJGE C=C(Cl)C[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(C2CCCCC2)c1C)C(=O)OCC 1132193083 UTXZGTNZHFTGKS-FNGUVFISSA-N 431.964 4.708 50 10 IJGE C#CCN(Cc1ccc(F)cc1)C(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(F)cc2)c1C 1357771267 OZRSOOBBRYADCW-JCMHNJIXSA-N 429.470 4.941 50 10 IJGE C#CCCOc1ccc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)nc3ccccc23)cc1 1521290066 PTRKCUGICAXTTR-UHFFFAOYSA-N 449.510 4.687 50 10 IJGE C=C[C@@H](CC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1 1624557215 IRWQIQQJFSIOGV-FQEVSTJZSA-N 436.515 4.660 50 10 IJGE Cn1cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2-c1ccc(Cl)cc1 1865699528 WIJYDTXVCHLXNC-FQEVSTJZSA-N 427.895 4.749 50 10 IJGE CCN(CC)Cc1ccc(/C=N\NC(=O)c2ccc(-c3ccccc3OC)nc2C)cc1 1865762455 HGNVIRKVQCBUTI-PKAZHMFMSA-N 430.552 4.671 50 10 IJGE Cc1ccc(S(=O)(=O)NC/C(O)=C(\C#N)c2nc(-c3cccc(Cl)c3)cs2)cc1 1872748301 RQDWSSBHKFKQIQ-ZPHPHTNESA-N 445.953 4.543 50 10 IJGE C[C@H](Br)C(C)(C)CNC(=O)c1ccc(Br)cc1Br 1913837342 DLTRHIRSYDPIQY-QMMMGPOBSA-N 441.989 4.751 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(F)c1 1915295714 MWZYMNQQCPNRRO-GOSISDBHSA-N 432.330 4.575 50 10 IJGE C[C@@H](Br)[C@@H]1CCN(C(=O)c2csc(Br)c2Br)C1 1945183593 JDVJYDWGLGKTFX-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE C[C@@H]1CCN(C(=O)c2csc(Br)c2Br)[C@@H]1CBr 1945189692 XSIWVBALLQIKIK-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE Brc1cccc(C[C@@H]2CCOCC[C@H]2Br)c1Br 2001020152 AHVXOTBCMPQZEA-GXSJLCMTSA-N 426.974 4.944 50 10 IJGE Fc1cc(Br)cc(N2CC=C(Br)CC2)c1CBr 2004045548 KIGSYWQWBUZOJY-UHFFFAOYSA-N 427.937 4.972 50 10 IJGE CC(C)N(CC1CCN(C(=O)OC(C)(C)C)CC1)C[C@H](Br)C(F)(F)F 2044707074 ZSFUXPSSCBGIBO-AWEZNQCLSA-N 431.337 4.670 50 10 IJGE O=C(CBr)c1ccc(Br)c(OC(F)(F)F)c1C(F)(F)F 2054795901 JGRJPNBSUXKVPH-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE CC[C@H]1CN(C(=O)OC(C)(C)C)[C@H](CC)CN1C(=O)[C@H](Br)C1CCCC1 2110715451 NLZHAXAACNTQOI-GVDBMIGSSA-N 431.415 4.577 50 10 IJGE COc1ccc(Cl)cc1[C@H](Br)c1nn(C)c(Cl)c1Br 2110720057 ALPREQCAGCTJJZ-VIFPVBQESA-N 428.939 4.982 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1cc(Br)ccc1F 2117896271 ZBAGHRKCMCVQBP-SNVBAGLBSA-N 442.110 4.702 50 10 IJGE COc1ccc([C@@H](Br)c2nn(C)cc2Br)c(Cl)c1Cl 2138621860 ZPUHXZDRLJVUCL-SECBINFHSA-N 428.939 4.982 50 10 IJGE CCN(CCCCCl)S(=O)(=O)c1cc(Br)c(C)cc1Br 2159110458 ZUGUTVPNFSNBMN-UHFFFAOYSA-N 447.620 4.550 50 10 IJGE O=C(c1cscc1Br)N1CCC(CBr)(CC(F)F)CC1 2188338564 ULLOCAWHVJVBDZ-UHFFFAOYSA-N 431.140 4.783 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)C[C@H](C)Br)c(Br)c1 2212701137 YNRSFNWSTLKRGT-ZDUSSCGKSA-N 441.163 4.884 50 10 IJGE F[C@H]1C[C@@H](Br)CN(Cc2c(Br)cccc2Br)C1 2213904185 QVEMLNSWHXBWKD-BDAKNGLRSA-N 429.953 4.519 50 10 IJGE CO[C@H]1CC[C@@H]1COc1c(Br)cc(Br)cc1CBr 2220575493 JEQCABLWRGOZMU-PELKAZGASA-N 442.973 4.910 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC2(C)CCCCC2)C1 2244591420 KAURDJMTOCYXCF-SFHVURJKSA-N 437.362 4.931 50 10 IJGE CCCC1(O[C@](C)(CI)c2ccccc2Br)COC1 2272852954 UYDZWPBJRWOBPO-CQSZACIVSA-N 439.131 4.685 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C2CCC1(CBr)CC2 2285959860 ROJQBQPJKUXXGK-UHFFFAOYSA-N 425.523 4.774 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)C1(CBr)CCC1 2300241311 XMAUOJJAEGSJMR-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE C[C@H]1OCC[C@@]1(CBr)Cc1ccc(Cl)c(I)c1 2300242377 JVBHTJSWJRSGKM-RNCFNFMXSA-N 429.523 4.677 50 10 IJGE COc1ccc(CCCCC[C@@H](Br)CN2C(=O)c3ccccc3C2=O)cc1 2303894574 QRFBZVQOEPFOSY-QGZVFWFLSA-N 430.342 4.858 50 10 IJGE CC(C)[C@@H](CBr)N(C)C(=O)c1cc(Br)cc(Br)c1 2318837405 ZJQYNHHQYOEZKP-GFCCVEGCSA-N 441.989 4.703 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2C[C@@H]1CN(CC1(CBr)CCCCCC1)C2 2333678697 ZSZQENBRCAIMLN-KZNAEPCWSA-N 429.443 4.957 50 10 IJGE CC[C@H](CBr)CN1CC[C@@H](CCNC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2337588333 XAPQGAIDLYBREZ-KFWWJZLASA-N 445.364 4.965 50 10 IJGE CC1(C)CCC[C@@](CBr)(Cc2ncc(I)cn2)CC1 2353311543 LVVQCVKKPHMBDT-HNNXBMFYSA-N 437.163 4.995 50 10 IJGE CCCCCCOc1ccccc1C(=O)NNC(=O)c1ccc(C)c(Br)c1 14032690 XLVGSKHRELYWDO-UHFFFAOYSA-N 433.346 4.791 50 10 IJGE COc1ccc(OCc2cccc(Br)c2)c(/C=N/NC(=O)c2ccccc2)c1 20228838 GNQPPDXJBRYZRC-ZVHZXABRSA-N 439.309 4.801 50 10 IJGE Cc1cccc(C)c1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cccs1 38656399 UCUQVIDFZZNRDH-QFIPXVFZSA-N 432.501 4.568 50 10 IJGE O=C(COc1ccc(Br)cc1Br)NN=C1CCCCCCC1 100431962 JIWKNRUKTLTBTP-UHFFFAOYSA-N 432.156 4.807 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Br)Cc3ccc(Cl)cc3)cc2[nH]1 109884121 XXCIFCRIEBQRQM-LLVKDONJSA-N 430.527 4.951 50 10 IJGE COc1ccc(C[C@@H](Br)c2cccc(I)c2)cc1OC 110295438 IVFQDZULWFBMPA-CQSZACIVSA-N 447.110 4.987 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CCCC[C@H]1CBr 232474684 MYTCUMZCLNGQBH-LBPRGKRZSA-N 439.973 4.601 50 10 IJGE O=C(NN=Cc1c2ccccc2cc2ccccc12)c1ccn(Cc2ccc([N+](=O)[O-])cc2)n1 254813477 OJZPMSHRFCTOGQ-UHFFFAOYSA-N 449.470 4.910 50 10 IJGE CC(C)(C)OC(=O)NN=C(C(=NNC(=O)OC(C)(C)C)c1ccccc1)c1ccccc1 254824772 KUJQBVCOFSPQNU-UHFFFAOYSA-N 438.528 4.844 50 10 IJGE CC(C)(C)[C@@H](Br)CNC(=O)c1cc(Br)cc(Br)c1 324397431 GQJVCWPVEZWUMZ-NSHDSACASA-N 441.989 4.751 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CBr)[C@H](c2cc(Br)ccc2F)C1 382696384 VPLRNTMYLKDETK-GXFFZTMASA-N 437.147 4.934 50 10 IJGE CC(C)CSCCn1c(CCl)nc2cc(I)c(F)cc21 397295948 ZAAJSVIXOXKXRI-UHFFFAOYSA-N 426.726 4.908 50 10 IJGE O=C(NNc1c(Cl)cc(Br)cc1Cl)C(=O)c1ccc2c(c1)CCC2 742005382 VLAKRQMAGSFXOX-UHFFFAOYSA-N 428.113 4.571 50 10 IJGE O=C(NN=C1CCC(O)(c2cccc(F)c2)CC1)c1ccc(Br)cc1Cl 783844641 APGMJWYSUQQBES-UHFFFAOYSA-N 439.712 4.789 50 10 IJGE CCc1ccc(OCC(=O)NN=Cc2c(OC)ccc3ccccc23)c(Br)c1 1084284266 BTNVPVHKWWKUTI-UHFFFAOYSA-N 441.325 4.702 50 10 IJGE C=C(C)CCC(=O)NNc1c(Br)cc(Br)cc1Br 1126492166 XTDANGHMUCJVFR-UHFFFAOYSA-N 440.961 4.774 50 10 IJGE CC(C)(C)Cc1nc(-c2ccc(C(=O)NNc3nc4ccccc4[nH]c3=S)cc2)no1 1301147156 AXUTVQCVHDPMRJ-UHFFFAOYSA-N 434.525 4.688 50 10 IJGE Cc1cc(/C=C(\C#N)c2nnc(-c3cn(C)c4ccccc34)o2)c(C)n1C[C@H]1CCCO1 1341502960 CUYIUQKCMVZABO-QDDTUJKSSA-N 427.508 4.890 50 10 IJGE O=C(NNc1cc(Br)ccc1F)c1ccc2c(c1)nc(O)n2C1CCCC1 1602949565 DSQDFQSJLATLTA-UHFFFAOYSA-N 433.281 4.516 50 10 IJGE CCc1nn(Cc2ccc(F)cc2)c2c1[C@@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865701543 XSIRSUPCFRNWOD-QHCPKHFHSA-N 445.542 4.697 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)/C=C/c1ccc(Cl)cc1 1865755471 ABVDMGZTEAZRLM-YIXHJXPBSA-N 426.303 4.838 50 10 IJGE CC[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1880757029 WEQGIGPVAGMLJH-ILXRZTDVSA-N 435.403 4.558 50 10 IJGE Clc1cc(I)c([C@@H](Br)[C@]23COC[C@H](C2)C3)s1 1900917834 BBLYASRTRRAFMC-DIMCTHFVSA-N 433.536 4.869 50 10 IJGE CCN[C@H](c1ccc(Br)c(C)c1Br)[C@@H]1C[C@@H]1Br 1911311447 ANFQLDIHMWHNLF-SUZMYJTESA-N 425.990 4.954 50 10 IJGE CCOc1c(C(=O)N(Cc2ccccc2)[C@H](C)CCBr)cccc1[N+](=O)[O-] 1915091091 SPTGCCKQILUZOQ-OAHLLOKOSA-N 435.318 4.809 50 10 IJGE Cc1cc(Br)c(F)c(C(=O)N(CCBr)Cc2ccccc2)c1 1928198587 XDPYDQDMBYWQDK-UHFFFAOYSA-N 429.127 4.934 50 10 IJGE CC(C)[C@H](Br)CCNC(=O)c1scc(Br)c1Br 1942750498 JZPFEPVRYLCACS-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE C[C@@H]1C[C@H](Br)CCN(c2ncc(Br)cc2Br)C1 1997236369 HZDZZTGZGNIAKZ-RKDXNWHRSA-N 426.978 4.606 50 10 IJGE ClC1CC([C@@H](Br)c2cc(I)cc3c2OCC3)C1 2020462270 ACIICTGKZJNIKC-SHVIVCPWSA-N 427.507 4.680 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1csc(Br)c1Br 2023036642 BSIRZXMEFMVRKD-HTRCEHHLSA-N 448.018 4.813 50 10 IJGE CN(C(=O)c1cccc(Br)c1Br)[C@H]1CCC[C@@H]1Br 2031477429 LULKMHDYRUVTBF-ONGXEEELSA-N 439.973 4.600 50 10 IJGE BrC[C@@H]1C[C@H]2CN(Cc3cc(Br)ccc3Br)C[C@H]12 2054712060 HWGQNTSNTSSKBD-OUJBWJOFSA-N 438.001 4.674 50 10 IJGE Fc1ccc2nc(CCl)n([C@]34C[C@H]3CN(Cc3ccccc3)C4)c2c1Br 2099679049 NJPRJXAYCAGYAM-XOBRGWDASA-N 434.740 4.908 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2151243310 KRJVCDPRAASVPP-KOUNCHBCSA-N 427.386 4.849 50 10 IJGE BrCC1(CN2CC[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)CCCCCC1 2185497217 OXODOBMXACLULM-VXKWHMMOSA-N 435.450 4.697 50 10 IJGE CCCC(CBr)(CCC)CN1CCC(CO)(CNC(=O)OC(C)(C)C)CC1 2202907482 PPWPKBHYAJIHCU-UHFFFAOYSA-N 449.474 4.567 50 10 IJGE O=C1Cc2cc([C@@H](Br)c3cc(Br)co3)c(Br)cc2N1 2270465625 RWFZMCNFVUJLQH-CYBMUJFWSA-N 449.924 4.784 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@H]2CC[C@@]1(CBr)C2 2282976588 VPORUGXBSUJKBM-RTHLEPHNSA-N 425.523 4.631 50 10 IJGE CC(C)(C)CN(CCCl)C(=O)Cc1cc(Br)cc(Br)c1 2295318053 VIVYKRIYTRFLLM-UHFFFAOYSA-N 425.592 4.868 50 10 IJGE CC(C)(C)N(CCBr)Cc1cc(I)ccc1Cl 2307327854 GQRAWXDAYVTZOJ-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE CC1=C(C#N)C(=O)N(C(C)C)C(=O)C1=Cc1cn(-c2ccccc2)nc1-c1ccc(C)cc1 2314609942 AHFZNTJWEQDRGR-UHFFFAOYSA-N 436.515 4.848 50 10 IJGE CCCCOc1ccc(C=C2C(=O)N(Cc3ccccc3)C(=O)C(C#N)=C2C)cc1OC 2314610468 IRKJODOSSIWADW-UHFFFAOYSA-N 430.504 4.667 50 10 IJGE C[C@H]1C[C@H](CBr)CN(Cc2cc(I)ccc2Cl)C1 2327397888 WTYYDNAJIVPWGR-WDEREUQCSA-N 442.566 4.798 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@H]2C[C@@H](Cl)CC[C@H]21 2328608292 HVZZYQREJPNWBP-OYNCUSHFSA-N 427.589 4.895 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)c3ccc([N+](=O)[O-])cc3)n2)c(OC)c1OC 2331412676 VILQNBUCUWLDNN-UHFFFAOYSA-N 439.449 4.694 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@H]2CC(F)(F)CC[C@]2(NC(=O)OC(C)(C)C)C1 2344076741 KYEWAMXMLVSLHE-RKVPGOIHSA-N 439.385 4.668 50 10 IJGE O=C(CCCCc1nc2ccccc2s1)NNC(=O)CC12CC3CC(CC(C3)C1)C2 8191135 BMDLHJBUTCTDAB-UHFFFAOYSA-N 425.598 4.763 50 10 IJGE Cc1ccccc1C(=O)NNC(=O)c1ccc(COc2cc(Cl)ccc2Cl)cc1 20418413 FLSLJWJYLJUVSW-UHFFFAOYSA-N 429.303 4.956 50 10 IJGE N#CC1=C(N)Oc2nc(=S)[nH]c(O)c2[C@H]1c1ccc(-c2cc(Cl)ccc2Cl)o1 34967379 IIZBZHOJTUANKS-CYBMUJFWSA-N 433.276 4.630 50 10 IJGE Cc1c(C(=O)Nc2cccc(C(F)(F)F)c2)oc2c1/C(=N/NC(=O)c1ccco1)CCC2 40814472 NFJFYHKQTXCOPF-JFLMPSFJSA-N 445.397 4.923 50 10 IJGE CC(C)(C)OC(=O)N1[C@@H](c2ccccc2)[C@@H](c2ccccc2)OC(=O)[C@H]1Br 85475101 NOVNBQKUIAJJBO-KSZLIROESA-N 432.314 4.984 50 10 IJGE N#C/C(=C(\O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O)c1ccc2ccccc2n1 105907126 YIRNAZDMNMQISK-LYBHJNIJSA-N 438.464 4.562 50 10 IJGE CC[C@H](CCBr)CNC(=O)c1ccc(Br)cc1Br 234005111 NCJYEYXOMXCSBD-SECBINFHSA-N 441.989 4.753 50 10 IJGE COc1cccc(C=NNC(=O)c2ccccc2)c1OCCCOc1cccc(C)c1C 254382701 VMVZTCPBMKLHJI-UHFFFAOYSA-N 432.520 4.924 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1nc(-c3ccccc3)cs1)[C@@H](Br)C2=O 256019034 HGDNFEWLXFNKEA-KPOBHBOGSA-N 433.371 4.908 50 10 IJGE CC(C)(C)N(CCBr)C(=O)c1ccc(Br)cc1Br 690979824 HSOOTDZYFYJQDE-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE O=C(c1ccccc1OCc1ccccc1)N1C[C@@H](CBr)[C@H](C(F)(F)F)C1 709889469 QUNANSMHRCZCDN-NVXWUHKLSA-N 442.275 4.911 50 10 IJGE Cc1ccc(F)c(NNC(=O)C(=O)Nc2cccc(Oc3ccnc4ccccc34)c2)c1 784885140 DZDPOSRROUVXFL-UHFFFAOYSA-N 430.439 4.556 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2Cl)[C@@H]1c1ccccn1 1865699708 AOFHFKRCXURTPU-FQEVSTJZSA-N 425.879 4.806 50 10 IJGE CCCOc1ccc(/C=N\NC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)cc1OC 1865762050 KRKPJTPBQVVACP-VYYCAZPPSA-N 439.462 4.897 50 10 IJGE COc1cccc(-c2nc(Nc3ccc(SC#N)cc3)cc(N3CCOC[C@H]3C)n2)c1 1868506398 WYNBHAFEQNPLNR-MRXNPFEDSA-N 433.537 4.694 50 10 IJGE CN(C(=O)c1cccc(Br)c1Br)C1(CBr)CCC1 1914993293 XIOWPLAJGBJFBN-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1ccccc1Br 1916374461 KCCQEFHTUJKMFZ-OAHLLOKOSA-N 441.163 4.501 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCCC2(CCC2)[C@@]12CC[C@H](CI)O2 1924804168 ZVJMHHSRMMWSMF-QMTMVMCOSA-N 449.373 4.834 50 10 IJGE C[C@H](Br)[C@@H]1CCN(Cc2c(Br)cccc2Br)C1 1945329814 PDLWXLWDPOPOEE-VHSXEESVSA-N 425.990 4.817 50 10 IJGE CC(C)[C@H](Br)[C@@H](C)NC(=O)c1cc(Br)c(Br)s1 1997051365 VQEFZFPMKFIXKY-MUWHJKNJSA-N 448.018 4.811 50 10 IJGE CC(C)[C@H](Br)[C@@H](C)NC(=O)c1csc(Br)c1Br 1997051484 WGVBYRPYCCXHDB-SVRRBLITSA-N 448.018 4.811 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCC2)C[C@H]1CC(F)(F)F 2119515931 QMGJAIKLHMQWNM-CQSZACIVSA-N 443.348 4.815 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ccccc2)CCN1Cc1ccc(CBr)cc1 2130156294 BULYISQHTGXQOF-LJQANCHMSA-N 427.308 4.830 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccccc2)CCN1c1cc(CCl)c(Br)cn1 2130166011 JTWJHNOQYCLZFR-INIZCTEOSA-N 448.714 4.836 50 10 IJGE C[C@@H](CN(C)S(=O)(=O)c1cc(CBr)sc1Br)C(C)(C)C 2179784608 BJGZHJKTMXHUAS-VIFPVBQESA-N 447.258 4.708 50 10 IJGE CCCC[C@@H](C)N(C)S(=O)(=O)c1ccc(CBr)cc1Br 2179861454 HOFLTRXNOLEUNN-LLVKDONJSA-N 427.202 4.543 50 10 IJGE Clc1c(Br)ccc(CBr)c1N1CC[C@H](c2nncs2)C1 2196555233 RSFGOUQHTGNHDP-VIFPVBQESA-N 437.588 4.843 50 10 IJGE Cc1ccc(C(=O)NCCCC(C)(C)CBr)cc1I 2224620090 ILNHKUORHZFXNY-UHFFFAOYSA-N 438.147 4.531 50 10 IJGE CCN[C@@H](Cc1cc(Br)cc(Br)c1)[C@H]1C[C@H](Br)C1 2263519522 SQANLMRKDWJQGL-BPNCWPANSA-N 440.017 4.906 50 10 IJGE C[C@@H]1CCCN(C(=O)c2ccc(Cl)c(I)c2)[C@H]1CCCl 2283660259 BWIUSEPHENKKJZ-YGRLFVJLSA-N 426.125 4.814 50 10 IJGE CC[C@H]1CCCCN1C=C(C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 2324605304 AWXWFHVZAFSZBD-SANMLTNESA-N 442.607 4.592 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)C(C#N)=CNCc1ccccc1Br 2325078808 AGSCIJKIDCIKNH-INIZCTEOSA-N 442.357 4.531 50 10 IJGE COc1cc(C=CC(=O)NCCCBr)ccc1OCc1ccc(Cl)cc1 2325141561 ZBAHNXBCPVUQQL-UHFFFAOYSA-N 438.749 4.842 50 10 IJGE Cc1ccc2nc(C(C#N)=Cc3cc(Br)c(O)c(Br)c3O)[nH]c2c1 2331018139 YIBVDJWAHZPUCA-UHFFFAOYSA-N 449.102 4.872 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@@H]1C[C@@H]2CCC[C@H](C1)C2(F)F 2369430752 IGWVSHRYELABCM-FCGDIQPGSA-N 444.360 4.935 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N[C@H](C)c3ccc4c(c3)OCO4)c2C)cc1 25584305 AOYWSSWXWWLCJJ-KKJJZKEWSA-N 443.503 4.616 50 10 IJGE COc1cc(C(=O)N/N=C/c2ccc(Sc3ccc(Cl)cc3)o2)cc(OC)c1OC 59517320 BPAZWYCTZAUYQR-FSJBWODESA-N 446.912 4.874 50 10 IJGE CC(C)(C)OCCO[C@@](C)(CI)c1ccccc1Br 162574402 GWRFWIAVZYLISS-HNNXBMFYSA-N 441.147 4.931 50 10 IJGE CCC(=O)[C@@H](Br)Cc1cc(OC)c(Br)cc1Br 232823437 ITBYNYPWZDUKCT-VIFPVBQESA-N 428.946 4.505 50 10 IJGE O=C(CBr)c1cc(OC(F)(F)F)cc(OC(F)F)c1Br 575683376 AGKKEMZHRKKSEH-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE O=C(NC1(CCBr)CCSCC1)c1cc(Cl)ccc1Br 719664813 HFBIKMXQLDJEDB-UHFFFAOYSA-N 441.616 4.883 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2csc(-c3ccccc3Cl)n2)c1C 736694924 MPWZUSKCKKLKLF-UHFFFAOYSA-N 436.928 4.689 50 10 IJGE N#C/C(=C\c1cc(I)cc([N+](=O)[O-])c1)C(=O)c1cc2ccccc2o1 811626402 HMFNNOVZGDPYLO-WLRTZDKTSA-N 444.184 4.735 50 10 IJGE Cc1ccc(NC(=O)C(=O)NN=Cc2cc(C)n(-c3cc(Cl)ccc3Cl)c2C)cc1 1083916213 VPEVDMPEZLNKTC-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE COc1ccc(C(CSc2nc3ccccc3s2)=NNC(=O)c2cccnc2)cc1 1083973192 XHLMVSHSMOPZFW-UHFFFAOYSA-N 434.546 4.626 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2ccc(-c3cccc(Cl)c3)o2)cc1 1084247940 RMMVZZKBCOWBPG-OAQYLSRUSA-N 426.900 4.963 50 10 IJGE C#C[C@@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc3ccccc23)c1C)C1CCOCC1 1532934032 JBYDNQFPOWMGMC-OGRZUZBBSA-N 437.543 4.699 50 10 IJGE Cc1c([C@@H]2CN(Cc3ccccc3)C[C@@H]2CI)cccc1[N+](=O)[O-] 1614628006 BHHVQEDPYLAGND-FUHWJXTLSA-N 436.293 4.554 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1cccc(OC)c1)C(C#N)=C(N)O2 1865711797 IFQXLZBIAGMPSL-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE CC(C)(C)OC(=O)NCC1CCC([C@H](CBr)NC(=O)OC(C)(C)C)CC1 1880762175 TVOGTOFWNWLOTP-NRXISQOPSA-N 435.403 4.606 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Cl)cc(C(=O)NC[C@@H]2C[C@H]2Br)cc1Cl 1910122953 LGLRLYYYVJOHDB-VHSXEESVSA-N 438.149 4.854 50 10 IJGE O=C(c1ccc(Br)c(O)c1)N(CCCBr)Cc1ccccc1 1914628461 UHRLVUUZTAKQHL-UHFFFAOYSA-N 427.136 4.582 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@@]2(CCC[C@H](CI)O2)C1 1939617852 FTMNDOJPRSFOLP-HDMKZQKVSA-N 437.362 4.834 50 10 IJGE CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)C[C@@H](Br)C(F)(F)F 1953584786 ORMURBSSTTVWDY-OAHLLOKOSA-N 439.316 4.729 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1C(=O)c1scc(Br)c1Br 2018105643 VYUOPUACMFUXEG-HTRCEHHLSA-N 446.002 4.661 50 10 IJGE Brc1ccc(CN2C[C@H](C3CC3)[C@@H](Br)C2)c(Br)c1 2031403280 PEVLKZWCQZKAIM-OCCSQVGLSA-N 438.001 4.817 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](C[S@](C)(=O)=NCC1(CBr)CCC1)C(C)(C)C 2044706533 VBYJQPOLEXXBBJ-SXBQZSJRSA-N 439.460 4.589 50 10 IJGE Br[C@H](Cc1nc2ccccc2o1)c1cc(I)sn1 2056487964 PZCPDMRLHPXGBR-SSDOTTSWSA-N 435.084 4.568 50 10 IJGE F[C@@H]([C@@H](Br)c1cc(I)cc2c1OCC2)C(F)(F)F 2059187376 OBEVXKBWTYXBFM-WPRPVWTQSA-N 438.984 4.563 50 10 IJGE O=C(CBr)c1cc(C(F)F)cc(I)c1C(F)(F)F 2060395623 UGKHDSXSLXTFIL-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE COc1ccc(C(F)(F)F)cc1-n1nc(CBr)c([N+](=O)[O-])c1C(F)(F)F 2079142136 VQEJRSYQFJJXEB-UHFFFAOYSA-N 448.117 4.722 50 10 IJGE C[C@]1(CCBr)CCN(Cc2ccc(I)c(Cl)c2)C1 2086654277 FCJLTQSRXWHJBQ-AWEZNQCLSA-N 442.566 4.942 50 10 IJGE Cc1c(Br)sc([C@@H](Cl)[C@H]2CCn3ncnc3C2)c1Br 2108968481 HQSZIJSWHRGJRJ-XVKPBYJWSA-N 425.577 4.716 50 10 IJGE ClCc1ccc(Br)c(N2CC[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)n1 2120532276 SIQWZUCQVHIPJH-MSOLQXFVSA-N 434.809 4.931 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1cc(F)c(Cl)cc1[N+](=O)[O-] 2125302399 RWJQJAKGYAIONE-UHFFFAOYSA-N 425.935 4.705 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)CC[C@H](CCNC(=O)OC(C)(C)C)C(C)(C)C 2196914474 NPPJXHUIIGBMFZ-BRWVUGGUSA-N 447.458 4.976 50 10 IJGE Cc1cccc(C(=O)N2[C@@H](CBr)CCC23CCC3)c1I 2205774293 YUOLAXQSZYMNSH-GFCCVEGCSA-N 448.142 4.522 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@H]2CCCS(=O)(=O)C2)c(C)c1Cl 2232511289 PUGWKOYHRLRMSR-GXFFZTMASA-N 444.616 4.980 50 10 IJGE Cc1cccc(C(=O)Nc2ccccc2CCBr)c1I 2239252199 WDTKZKGVVYGMLX-UHFFFAOYSA-N 444.110 4.789 50 10 IJGE CC(C)(C)OC(=O)N1[C@H](CNC(=O)[C@H](Br)C2CCCC2)C[C@H]2CCCC[C@H]21 2240968531 RHCOGNIATMOWMG-XMTFNYHQSA-N 443.426 4.625 50 10 IJGE O[C@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@@H](Br)C1 2250783746 SXXVMHVIYJSVOU-XOGFGSHOSA-N 434.900 4.697 50 10 IJGE CS(=O)(=O)[C@H]1C[C@H]([C@H](Br)c2cc(Br)c(Cl)cc2F)C1 2269773907 WBJCNZQKEMRKCX-WSFZALMZSA-N 434.552 4.501 50 10 IJGE COc1cc(F)c(CBr)c(N2[C@H]3CCC[C@@H]2CN(Cc2ccccc2)C3)c1 2283392150 OSXZLHCFRWLWSJ-HDICACEKSA-N 433.365 4.973 50 10 IJGE O=C(N1CCC[C@H]([C@H]2CCCCN2CCCCCCCBr)C1)C(F)(F)F 2294697554 COPYETOOTJCDMU-DLBZAZTESA-N 441.376 4.987 50 10 IJGE Cc1nc(C2CCN(C(=O)[C@H](Cl)C(C)C)CC2)ncc1C(=O)Nc1ccc(Cl)cc1 2296578455 VARIFEMCBFGWRY-LJQANCHMSA-N 449.382 4.660 50 10 IJGE C[C@H]1C[C@@H]1N(CCBr)Cc1ccc(Cl)cc1I 2302324931 BSMCCQTUTHQNRY-ZANVPECISA-N 428.539 4.550 50 10 IJGE C[C@H](Cl)C(C)(C)CNCc1ccc(I)c(Br)c1 2306223617 HNABOQLZPJIWMX-VIFPVBQESA-N 430.555 4.797 50 10 IJGE C=CCNC(=O)C(C#N)=Cc1cn(-c2ccccc2)nc1-c1cccc(OCCCC)c1 2314476293 MEAARBTXTPFBCA-UHFFFAOYSA-N 426.520 4.927 50 10 IJGE CCCC(CBr)(CBr)Cc1cc(OC)ncc1Br 2315345358 QCNMVKOWNKFPSZ-UHFFFAOYSA-N 444.005 4.972 50 10 IJGE Cl[C@H]1C[C@H]2C[C@H]1CN(Cc1ccc(I)c(Br)c1)C2 2325227274 YNQAYUDUAJDMNP-MDZLAQPJSA-N 440.550 4.503 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2328527845 MLRAEQSTVMHVHY-ZIAGYGMSSA-N 431.337 4.527 50 10 IJGE Cc1cc2c(c(=O)n1CCc1ccccc1)[C@@H](c1ccc(C(C)C)cc1)C(C#N)=C(N)O2 2213251 CHCIWTMBOKBMDL-DEOSSOPVSA-N 425.532 4.741 50 10 IJGE Cc1ccccc1C(=O)Nc1ccc(C(=O)N/N=C/c2ccc(Br)s2)cc1 12578633 DROOVGKSRZVQMS-WSDLNYQXSA-N 442.338 4.835 50 10 IJGE O=C(N/N=C/c1cccc(OCc2ccc(Cl)cc2Cl)c1)c1cc(O)ccc1O 20410653 LCZHZUNXYKBZKE-BHGWPJFGSA-N 431.275 4.748 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1 33339681 VXHXNBIZFVCTCD-SSZFMOIBSA-N 431.404 4.577 50 10 IJGE C[C@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccc(F)cc1 38652785 UUCIQEJGHDOMEW-LFVRLGFBSA-N 448.425 4.556 50 10 IJGE N#Cc1ccc(Cl)cc1-n1c(CCl)nc2cc(I)ccc21 97355358 XDSAGTFNLUIRLJ-UHFFFAOYSA-N 428.060 4.894 50 10 IJGE C[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C)CO[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C 196134048 KEOUSSOURMHEKN-YYIAUSFCSA-N 438.862 4.855 50 10 IJGE O=C(NC[C@@H]1CC[C@H](Br)C1)c1cc(Br)sc1Br 227675712 RBWGEZZGVODRME-RQJHMYQMSA-N 446.002 4.567 50 10 IJGE CC(=NNC(=O)CSc1nc2ccccc2n1Cc1ccccc1Cl)c1cccnc1 252625928 QSDITAUFPWORBL-UHFFFAOYSA-N 449.967 4.766 50 10 IJGE O=C(CBr)c1c(Br)ccc(Br)c1Br 575715056 RBWJJJSUNPLCHE-UHFFFAOYSA-N 435.735 4.552 50 10 IJGE CN([C@@H](CBr)C(C)(C)C)S(=O)(=O)c1c(Cl)cccc1Br 689228601 DGKLQIGLGRQKHP-NSHDSACASA-N 447.620 4.533 50 10 IJGE C[C@@H](Br)CN(C(=O)c1cc(Br)sc1Br)C1CC1 691355490 GWVQJOHFZHUFHR-ZCFIWIBFSA-N 446.002 4.661 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1 799421995 UPIVCHQWUAWOHL-UHFFFAOYSA-N 449.433 4.750 50 10 IJGE COc1ccc(-c2nc(C)c(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)s2)cc1 799754073 CYPPERIXXMKQSI-UHFFFAOYSA-N 432.427 4.775 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCCC(F)(F)C2)c(-c2ccccc2)n1 816789145 HTSXJYQMZPPGEL-ACRNLXFHSA-N 437.494 4.703 50 10 IJGE Cc1ccc(Cl)cc1NC(=O)C(=O)NN=Cc1cc(C)n(-c2c(C)cccc2C)c1C 1084431052 UUAUIRPIPYWAON-UHFFFAOYSA-N 436.943 4.762 50 10 IJGE C=CCN(CCC#N)C(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1468405969 SFTNCWAHJFDIIJ-CPNJWEJPSA-N 426.442 4.948 50 10 IJGE O=[N+]([O-])c1ccc(-n2nc(-c3ccccc3Br)cc2CCl)c([N+](=O)[O-])c1 1614817249 KHOPIUVXJKETDJ-UHFFFAOYSA-N 437.637 4.857 50 10 IJGE C=C(C)[C@H](NC(=O)NNc1c(F)cc(F)cc1Br)c1ccc(F)c(F)c1 1681551174 CHNZZVHWTRQABB-HNNXBMFYSA-N 432.215 4.949 50 10 IJGE Cc1nn(Cc2cccc(F)c2)c2c1[C@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 1865684994 CMKHTTDXXOLQTA-LJQANCHMSA-N 429.282 4.904 50 10 IJGE CCN(CC)Cc1ccc(/C=N\NC(=O)c2ccc(-c3cccc(OC)c3)nc2C)cc1 1865760558 DEYJXVHHVWEGOC-PKAZHMFMSA-N 430.552 4.671 50 10 IJGE CN(C)c1ccc(/C(O)=C(\C#N)c2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1[N+](=O)[O-] 1873940941 OJGVBIXIAUUQGS-CYVLTUHYSA-N 437.437 4.642 50 10 IJGE COC1(COc2c(Br)cc(Br)cc2CBr)CC1 2002507712 RQBMNIGUIHJJEY-UHFFFAOYSA-N 428.946 4.664 50 10 IJGE CN(CCCCCBr)Cc1ccc(I)c(Cl)c1 2026560220 IKHVYVLDYVXPNB-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE O=C(c1csc(Br)c1Br)N(CCCl)CC(F)(F)F 2032953753 PIMUTELGMQLJQJ-UHFFFAOYSA-N 429.483 4.516 50 10 IJGE O=C(CCl)c1c(OC(F)(F)F)ccc(I)c1C(F)(F)F 2055163453 SVIXYNOZQVLHKI-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(CBr)cc1OC 2059311653 ABNXDCHFGNFBIO-HNNXBMFYSA-N 426.376 4.580 50 10 IJGE Fc1cc2nc(CCl)n([C@]34C[C@@H]3CN(Cc3ccccc3)C4)c2cc1Br 2099678579 JQDNOAUTVVMUGW-VLIAUNLRSA-N 434.740 4.908 50 10 IJGE CC(C)[C@@H](Br)C(=O)N[C@@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21 2106200738 RTVVIEFLZWBVPZ-IAGOWNOFSA-N 425.367 4.947 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C(F)(F)F)N(C[C@H](CBr)C2CCC2)CC1 2106786979 WVGOPAOENYQNGZ-GJZGRUSLSA-N 443.348 4.671 50 10 IJGE Cc1c(Br)ccc([C@H](Cl)[C@H]2CCCCS2(=O)=O)c1Br 2138862155 FUQJKFGIPSJPBD-YPMHNXCESA-N 430.589 4.767 50 10 IJGE Fc1cncc(N2C[C@@]34CCC[C@]3(CN(Cc3ccccc3)C4)C2)c1CBr 2153340620 GYHSWWAGELRZAF-VXKWHMMOSA-N 430.365 4.608 50 10 IJGE C[C@H](CCBr)CCN1CC[C@@H](NC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2255000222 AKTHADSPCJDKQO-MGPQQGTHSA-N 431.337 4.718 50 10 IJGE Cc1cc([C@H](Br)c2cscc2S(C)(=O)=O)sc1Br 2260096542 QWSSOCDPXUTEQX-SNVBAGLBSA-N 430.208 4.768 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCC[C@@](F)(CBr)C1 2285845667 DJAQTTPKDOXRJN-CYBMUJFWSA-N 431.502 4.581 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2cc(Br)c(N3CCCC3)o2)cc1 2313565122 SXJLRAQNQBLUNS-UHFFFAOYSA-N 430.302 4.587 50 10 IJGE Cc1ccc(Cn2cccc(C(=O)NN=Cc3c(Cl)ccc(Cl)c3Cl)c2=O)cc1 2323647925 GAUUDGRJUOVGHU-UHFFFAOYSA-N 448.737 4.929 50 10 IJGE C[C@@H]1CC[C@@H](CBr)N(Cc2cc(I)ccc2Cl)C1 2327402151 UZYTZFMTMUXWNH-MFKMUULPSA-N 442.566 4.940 50 10 IJGE COc1cc(Cl)c([C@@H](Br)[C@]23COC[C@H]2C3(F)F)cc1Br 2358018375 GSUBOJBUGZUWIJ-UTUOFQBUSA-N 432.486 4.829 50 10 IJGE COc1cc(/C=C(/C#N)c2nc3ccccc3[nH]2)ccc1OCc1ccc(C(=O)O)cc1 6239355 RGIUIELPWQZGTH-UNOMPAQXSA-N 425.444 4.913 50 10 IJGE C=CCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C\c2ccc(C(C)C)cc2)c(OC)c1 34896123 NZOWAOVBMFEJIB-ILXONMBNSA-N 430.504 4.647 50 10 IJGE CCCOc1cc(/C=N\NC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)ccc1OC 169917935 NKCFSFIRRZGPAY-QRVIBDJDSA-N 426.542 4.625 50 10 IJGE CCOc1cc(/C=N/NC(=O)c2cc3ccccc3n2C)ccc1OCc1ccccc1 169925978 NKAZCEQUGBRXBG-WPWMEQJKSA-N 427.504 4.920 50 10 IJGE CCCOc1ccc(/C=C2\C(=O)N(CCc3ccccc3)C(=O)C(C#N)=C2C)cc1OCC 214350188 WIACLDJBRJXPBV-JWGURIENSA-N 444.531 4.709 50 10 IJGE COc1ccc([C@H](C)NC(=O)/C(C#N)=C\NC(c2ccccc2)c2ccccc2)cc1OC 217171199 REVBFFCHQQZQCW-FGLBZAAHSA-N 441.531 4.668 50 10 IJGE C=CCc1ccc(OCC(=O)NN=Cc2ccc(OCc3ccc(C)cc3)cc2)c(OC)c1 254405964 HBHBPEVMMAYEQF-UHFFFAOYSA-N 444.531 4.840 50 10 IJGE ClCc1cc2cc(I)cc(I)c2s1 306908871 GWMGSWVMRHMPKD-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE FC(F)(F)c1cc(Br)cnc1N1CCSC[C@H]1CCBr 689209100 KLZRMHSRQPCMBV-SECBINFHSA-N 434.119 4.570 50 10 IJGE O=C(N[C@H]1CCC[C@H]1CBr)c1scc(Br)c1Br 705515161 HXZUHVCTIQMIOD-XPUUQOCRSA-N 446.002 4.567 50 10 IJGE BrCc1cc(Br)c(OCC23CC(CO2)C3)c(Br)c1 716080446 SEVQKSLVYUIQTN-UHFFFAOYSA-N 440.957 4.664 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@H]2CC[C@@H](Cl)[C@H]1C2 721559262 HZQAYYJCQHGBND-SZEHBUNVSA-N 427.589 4.895 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2cc3c(nc2O)CCCC3)c(C)n1-c1ccccc1F 1437411902 ROBHLALCWDFLOF-XDHOZWIPSA-N 430.483 4.758 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNc1nc(-c2ccccn2)nc2c1CCC2 1654315673 AWQROEJDMGOGFA-SEYXRHQNSA-N 440.334 4.881 50 10 IJGE CCc1nn(Cc2ccccc2F)c2c1[C@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865704720 CKLGEUICFUEJCG-JOCHJYFZSA-N 432.499 4.638 50 10 IJGE COc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2cccc(Cl)c2)c1 1865711930 LPHUHDXNIHVXSI-INIZCTEOSA-N 446.816 4.771 50 10 IJGE CC[C@H](NC(=O)Cc1nc(-c2ccc(C)cc2)oc1C)C(=O)Nc1ccc(SC#N)cc1 1866652308 MDYJGVPWMMCTSA-FQEVSTJZSA-N 448.548 4.608 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@]23CCC[C@H](CI)O3)C1 1918346849 NZJDOOKFNPRUBB-ZTFGCOKTSA-N 435.346 4.540 50 10 IJGE C[C@H]1CCC[C@@](CI)(OCCOCCOCc2ccccc2)C1 1983390001 OJTGTPNGDIIKLD-PKOBYXMFSA-N 432.342 4.620 50 10 IJGE C[C@@]1(CCBr)CCN1C(=O)c1csc(Br)c1Br 2025223519 PBVPLBUVULNPNJ-LLVKDONJSA-N 446.002 4.663 50 10 IJGE CN(c1ncc(Br)cc1Br)C1(CCBr)CCC1 2025470421 BZZVCYWKUPQTLC-UHFFFAOYSA-N 426.978 4.751 50 10 IJGE CC1(C)C[C@@H](CBr)CN1Cc1cc(Cl)ccc1I 2064388803 LHDMPOFGGGKTGL-JTQLQIEISA-N 442.566 4.940 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1cc(Br)ccc1Br 2081243012 SUFHBTFZCIJLGP-QPUJVOFHSA-N 441.989 4.751 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C(=O)CCCCBr 2106773606 LUEWJKXLAHJYFL-UHFFFAOYSA-N 425.367 4.556 50 10 IJGE CN(c1ccc([N+](=O)[O-])cc1CBr)[C@@H]1CN(Cc2ccccc2)C(C)(C)C1 2154826026 AGARCHIQRUDQNU-IBGZPJMESA-N 432.362 4.979 50 10 IJGE CC(C)N(CC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)[C@@H](Br)C1CCCC1 2167032044 LFPCRTJBDCRKQS-SFHVURJKSA-N 445.442 4.824 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@@]2(F)CCC[C@@]2(CBr)C1 2176641184 SAECQLNAIZSIRZ-OLZOCXBDSA-N 445.579 4.893 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2N1C(=O)OC(C)(C)C 2196913234 CNCQUVONXAFDIT-JCECYMMASA-N 443.426 4.577 50 10 IJGE O=S(=O)(Cc1ccsc1Br)N(Cc1ccccc1)[C@H](CCl)C1CC1 2213760900 MWRZSGMWORTCLU-MRXNPFEDSA-N 448.835 4.860 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@@H]2C[C@@H](Br)CC[C@@H]21 2264507575 SCVGPZMGEACUJS-WEDXCCLWSA-N 427.589 4.942 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CCC[C@H](OC)C2)cc1I 2269536276 YNZWCLBEBANWIB-IFUGULHKSA-N 439.131 4.941 50 10 IJGE Brc1cccc(CN2C[C@H]3CC[C@H](Br)[C@H]3C2)c1Br 2308237453 MTBGMJXFWZPEPC-USWWRNFRSA-N 438.001 4.817 50 10 IJGE N#CC(=CNCCc1cccc(Br)c1)C(=O)Nc1ccccc1C(F)(F)F 2324305550 FJOVMCPWIQWVBY-UHFFFAOYSA-N 438.247 4.646 50 10 IJGE C[C@H]1C[C@@H](Cl)[C@H](C)CN1Cc1ccc(I)c(Br)c1 2325225725 IJDZHHXZYDXSSZ-GBIKHYSHSA-N 442.566 4.891 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@](C)(CBr)C(C)(C)C)CC(F)(F)C1 2327106508 NLVZERADZDWNBC-KRWDZBQOSA-N 427.374 4.622 50 10 IJGE N#C/C(C(=O)CSc1nnc(C2CC2)n1C1CC1)=C1\Nc2cc(Cl)ccc2S1 12791145 AUZZJMJRZWYIFH-AQTBWJFISA-N 429.958 4.758 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)COc3ccccc3Cl)ccc2[C@H]1c1cccs1 38656389 PBWAFLTYYOWNFP-OAQYLSRUSA-N 438.892 4.604 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccs2)cc1C 38656526 GPNAJDKQEPUEIX-HSZRJFAPSA-N 432.501 4.568 50 10 IJGE CCOCCCN(C(=O)CCl)[C@H](C(=O)N[C@H]1CCCC[C@@H]1C)c1ccccc1Cl 97914423 ZMXUFBUKLSDQGJ-LRQRDZAKSA-N 443.415 4.570 50 10 IJGE COC(=O)c1c(NC(=O)c2cc(=O)c3cc(Cl)ccc3o2)sc(/C(C)=C\C#N)c1C 103006587 JSRRZHGHHFOFIF-POHAHGRESA-N 442.880 4.782 50 10 IJGE CCCCCCOc1c(OC)cc(/C=C(/C#N)c2nc3ccccc3c(=O)[nH]2)cc1[N+](=O)[O-] 169940083 GCVYMKRCTGQIGS-ATVHPVEESA-N 448.479 4.863 50 10 IJGE CC[C@@H](NC(=O)c1ccc(Br)cc1Br)[C@H](C)Br 386698402 MGKOSQSAZZLPOH-WRWORJQWSA-N 427.962 4.503 50 10 IJGE CC(C)(CBr)CCCNS(=O)(=O)c1c(Cl)cccc1Br 393383597 TVUXHTROHXGUMW-UHFFFAOYSA-N 447.620 4.582 50 10 IJGE FC(F)Oc1cc(C(F)(F)F)c(CBr)cc1I 575723223 MVXJPWDGTCOAEY-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE Cc1cc(Br)c(S(=O)(=O)N(C)C(C)(C)CCCl)cc1Br 688420027 QIAOYHXSOZDTBZ-UHFFFAOYSA-N 447.620 4.548 50 10 IJGE Cc1cc(Br)c(C(=O)N2CCSC[C@@H]2CCBr)cc1Cl 689301229 ZXUVLOGEKRNHIA-JTQLQIEISA-N 441.616 4.754 50 10 IJGE CS(=O)(=O)CCCCC(CBr)(CBr)c1ccccc1Cl 706357231 IQJDEMQBYNIOLS-UHFFFAOYSA-N 446.632 4.583 50 10 IJGE CN(CC1CCN(Cc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1CBr 720016417 JODIRVLNJCMUFB-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE COc1ccccc1[C@H](NC(=O)NNC(=O)c1ccc(C(C)(C)C)cc1)c1ccccc1 731119215 ZMGTVJYYCOPLJA-HSZRJFAPSA-N 431.536 4.726 50 10 IJGE CCN(C(=O)/C(C#N)=C\c1cc(C)n([C@H](C)COC)c1C)[C@H](C)Cc1ccc(OC)cc1 731335421 OEGFATXGPYWJGV-AJBSKBNBSA-N 437.584 4.708 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCn4c(C(C)C)nnc4[C@@H]3C)c2C)cc1 784697871 FAKLJQFZKHXVLZ-ISXGRJCASA-N 442.567 4.628 50 10 IJGE CC(=O)Nc1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c(C(F)(F)F)c1 799384341 YGEDWRBQYGNIOG-UHFFFAOYSA-N 445.323 4.703 50 10 IJGE Cc1cccc(CN(C)C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)c1 914488540 FJVOUIFRGFQHDS-KGENOOAVSA-N 443.938 4.991 50 10 IJGE COc1cc([N+](=O)[O-])ccc1-n1c(C)cc(C=NNC(=O)c2cc3ccccc3o2)c1C 1084198713 NQGPMHNTVIVTKE-UHFFFAOYSA-N 432.436 4.521 50 10 IJGE Cc1ccc(Cl)cc1NNC(=O)CCc1nc(O)c2c3c(sc2n1)C[C@H](C)CC3 1304402334 LLFHWJUEJGHQLD-LLVKDONJSA-N 430.961 4.559 50 10 IJGE COc1ccccc1-c1ccc(C(=O)N/N=C\c2c(Cl)nc3scc(C)n23)c(C)n1 1865762670 VUOGNKOLJBELGH-RMORIDSASA-N 439.928 4.501 50 10 IJGE CCc1nn(C)c([C@H](Cl)c2cc(Br)c(OC)s2)c1Br 1877186924 XHBHAENBEMHWRZ-SNVBAGLBSA-N 428.577 4.906 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cc2c(s1)CCSC2 1916335355 QOISRTQUTUOFTE-INIZCTEOSA-N 440.428 4.590 50 10 IJGE CN(CCN(Cc1ccccc1)C(=O)N1CCC(Br)CC1)Cc1ccccc1 1955802967 TUQFNKKMQILWRV-UHFFFAOYSA-N 444.417 4.600 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](OC2CC3(CCCCC3)C2)[C@H](I)C1 1989967980 PKSVQMAAIXWSPV-CABCVRRESA-N 435.346 4.539 50 10 IJGE C[C@H]1CC[C@@H](CBr)N(c2ncc(Br)cc2Br)C1 2001930024 RAVYQUHCTIPMGV-WPRPVWTQSA-N 426.978 4.606 50 10 IJGE CCC[C@@H](CCCl)CNc1ncc(I)cc1Br 2015757713 WDFSRFSJOZUNKR-VIFPVBQESA-N 431.543 4.906 50 10 IJGE CCN1CCC[C@@H]([C@H](Br)c2cscc2OCc2ccccc2)S1(=O)=O 2038676931 LDNUXGNNBZRFCL-ZWKOTPCHSA-N 444.416 4.577 50 10 IJGE Brc1ccc(Br)c(CN2C[C@@H]3CC[C@H](C2)C3Br)c1 2054710602 YGKYZMQSOYOCEV-XFLKPENQSA-N 438.001 4.817 50 10 IJGE O=C(NC[C@H](Cl)CC(F)(F)F)c1cc(Br)c(Br)s1 2055503096 RMKSWLCDRKXNTO-SCSAIBSYSA-N 429.483 4.563 50 10 IJGE C=CC[C@H](CBr)CNC(=O)c1ccc(Br)cc1Br 2082056031 SWJVCFCDRMEZHX-SECBINFHSA-N 439.973 4.529 50 10 IJGE C[C@@H]1C[C@@H](CBr)CCN1Cc1ccc(I)c(Cl)c1 2086655554 OPRDITZKLDGTGO-MNOVXSKESA-N 442.566 4.940 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2[C@@H]1CN(Cc2ccccc2)C[C@H]1C 2096803839 TXHOZPNGXRLCOH-FZKQIMNGSA-N 433.781 4.934 50 10 IJGE C[C@@H]1CN(C[C@@H](Br)C(F)(F)F)c2ccccc2CN1C(=O)OC(C)(C)C 2106783749 CJTXTEIOSQWQDK-IUODEOHRSA-N 437.300 4.958 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C(F)(F)F)N(C[C@@H](CBr)C2CCC2)CC1 2106786978 WVGOPAOENYQNGZ-CABCVRRESA-N 443.348 4.671 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@@H]2CCCCN(C[C@H](CBr)CC3CC3)C2)C1 2112862131 ALYSOJNUSMAKAK-ZWKOTPCHSA-N 429.443 4.767 50 10 IJGE CCOCCOCCC(CBr)(CBr)c1cccc(Cl)c1 2143825952 MGEVDIHWJRTHIX-UHFFFAOYSA-N 428.592 4.811 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@H]1c1ccc(NC(=O)[C@H](Br)C2CCCC2)cc1 2167047801 LMTGBNWVOUJZNF-RCCFBDPRSA-N 437.378 4.959 50 10 IJGE CN(Cc1cn(C)nc1Br)c1ccc(F)c(Cl)c1CBr 2173264924 SMMWPSGDSNJBDX-UHFFFAOYSA-N 425.527 4.506 50 10 IJGE CCC[C@@H](CC)N(C)S(=O)(=O)c1ccc(CBr)cc1Br 2193557612 KJQOQGIHCFITTQ-GFCCVEGCSA-N 427.202 4.543 50 10 IJGE COc1cc(Br)c([C@H](Cl)C2CC(Br)C2)c(OC)c1OC 2196891642 UWHCBVJUXGVJPD-WZQIAMPNSA-N 428.548 4.928 50 10 IJGE Br[C@H]1CN(C[C@@H]2CC2(Br)Br)CC12CCCCC2 2213081640 DCXPXDISSHIQFU-QWRGUYRKSA-N 430.022 4.522 50 10 IJGE BrCC1CCC2(CC1)CCN(C[C@@H]1CC1(Br)Br)C2 2218005977 KILXYBKGPDURFZ-CPCZMJQVSA-N 444.049 4.770 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@@H]2CCC23CCC3)CC1 2247315730 FCCXRBCMQOJSHC-HNNXBMFYSA-N 449.373 4.788 50 10 IJGE CC[C@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@@H]1CBr 2285961186 XPUPATWTXPDDQO-IUCAKERBSA-N 427.539 4.735 50 10 IJGE CSCC[C@@H](Cl)CCNC(=O)Cc1cc(Br)cc(Br)c1 2295309688 MKCDOJZJAJTYQZ-ZDUSSCGKSA-N 443.632 4.621 50 10 IJGE CN(Cc1ccc(I)cc1)[C@@H](CBr)Cc1ccccc1 2296471608 LEDBNQWNIKBSPC-QGZVFWFLSA-N 444.154 4.729 50 10 IJGE CC(C)[C@H](Br)CN(C)Cc1ccc(Cl)c(I)c1 2300243139 RXRBWZVJUIYFGY-LLVKDONJSA-N 430.555 4.796 50 10 IJGE COc1c(Br)cc(C)c([C@@H](Br)C2COC2)c1Br 2301491688 HDYGWJAPEXCBPD-JTQLQIEISA-N 428.946 4.611 50 10 IJGE C=CC[C@H](CCl)CNCc1ccc(I)c(Br)c1 2306227449 LFEXPCSECRWSAR-LLVKDONJSA-N 428.539 4.574 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)C=Cc4ccccc4)ccc32)c1 2314634760 HQNUVXDWHKDHMD-SANMLTNESA-N 438.483 4.922 50 10 IJGE COc1cc(C=CC(=O)Oc2ccc(C=C(C#N)C#N)cc2)cc(Br)c1OC 2314785891 WQORLNGEUZVUJM-UHFFFAOYSA-N 439.265 4.516 50 10 IJGE CN[C@H](c1c(C)cc(Br)c(OC)c1Br)[C@@H]1C[C@@H]1Br 2317397954 GPLJDFMKDYREMF-LWINAJNOSA-N 441.989 4.573 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@@H](Br)[C@@H]2CC[C@@H]21 2359286351 XTXXMDROSCBPGS-HBSDOPKDSA-N 425.523 4.630 50 10 IJGE CC(C)(C)c1ccc(/C=N\NC(=O)Cn2cnc3scc(-c4ccccc4)c3c2=O)cc1 31829178 QTDKJNWQHYPDEJ-WKIKZPBSSA-N 444.560 4.573 50 10 IJGE ClCc1nc2cc(Br)cnc2n1-c1cccc(I)c1 98039895 JFCKUQQDVGPLRU-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE CCOc1cccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4Cl)nc3c2)c1O 169926683 ZVPKWTGXIJKFQB-DHRITJCHSA-N 434.883 4.752 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H]1Br)c1cc(Br)sc1Br 232464157 OIXCRWNNSIBCNG-XPUUQOCRSA-N 446.002 4.567 50 10 IJGE O=C(NN=Cc1ccc(OC(=O)c2cccs2)cc1)c1cc(Cl)c(O)c(Cl)c1 254386367 RYOMCHSEMQJSBS-UHFFFAOYSA-N 435.288 4.744 50 10 IJGE CC[C@@](C)(CO[C@@](C)(CI)c1ccccc1Br)OC 319264032 BYDPGBVDKWNUIC-GJZGRUSLSA-N 441.147 4.931 50 10 IJGE CC1(C)[C@@H](Br)CCN1Cc1cc(Cl)ccc1I 405326984 CWPTVUXEISFARE-LBPRGKRZSA-N 428.539 4.692 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccccc1[C@H]1COCCN1S(=O)(=O)c1ccccc1 616641536 LYXAJFQENZDFCO-JOCHJYFZSA-N 447.673 4.971 50 10 IJGE Cc1csc(=O)n1CCOc1c(Br)cc(Br)cc1CCl 700228197 RBFDPYVLXWZLNG-UHFFFAOYSA-N 441.572 4.561 50 10 IJGE CCc1cc(Br)ccc1NNC(=O)c1cccc(OCc2cscn2)c1 753173109 IAQBKZQIWYWGKQ-UHFFFAOYSA-N 432.343 4.804 50 10 IJGE CC1(c2cc(NC(=O)C(=O)NNc3c(Cl)cc(Cl)cc3Cl)no2)CCCC1 789746811 NBUHWDBRSLNGCS-UHFFFAOYSA-N 431.707 4.548 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2cc(Br)c(OC(C)C)c(OCC)c2)cc1 1084599391 UTRWCMSUELOUOZ-UHFFFAOYSA-N 449.345 4.798 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2cnc(O)c3ccccc23)c(C)n1-c1ccc(F)cc1 1558410305 USDKOTVWWCNRST-XDHOZWIPSA-N 440.478 4.710 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)c3cc(C)nc4ccccc34)cc2)cc1 1567963541 GCAHBURYFJOFEO-UHFFFAOYSA-N 439.471 4.613 50 10 IJGE Cn1cccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2-c1cccc(Cl)c1 1865699087 KIVVECPZARYHJK-HXUWFJFHSA-N 427.895 4.749 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccc(F)cc2)[C@H]1c1ccccc1O 1865708407 WERPYNKQPFZUBT-QFIPXVFZSA-N 438.462 4.661 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2C[C@@]23CCOC3)s1 1900920736 XQAKBTOFJIOLSL-PTHKFVFGSA-N 433.536 4.869 50 10 IJGE CN(C[C@@H]1C[C@H]1Br)c1cc(Br)cc(F)c1CBr 1910159071 FMWYMEJIVKHTTO-OIBJUYFYSA-N 429.953 4.703 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1C(=O)c1csc(Br)c1Br 1945183714 LYTHREHKWBPOGR-RNFRBKRXSA-N 446.002 4.661 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@H]2CC[C@H]3CC[C@H]2C3)C1 1947124336 RLGDHLKHQCFEJR-DRMAHVMPSA-N 449.373 4.786 50 10 IJGE O=S(=O)(c1ccsc1CBr)N(CCC(F)(F)F)Cc1ccccc1 2009665882 NSJVKQSHKRDUOQ-UHFFFAOYSA-N 442.322 4.786 50 10 IJGE ClC[C@H](Nc1ncc(I)cc1Br)C1CCCC1 2015757899 CIBFAWSSBUBIEC-NSHDSACASA-N 429.527 4.658 50 10 IJGE COc1ccc(-c2[nH]ncc2C=C(C#N)S(=O)(=O)c2cc(Cl)ccc2Cl)cc1 2041663661 KPNRWWDAKPBARV-UHFFFAOYSA-N 434.304 4.730 50 10 IJGE BrC[C@@H]1C[C@H]2CCC[C@@H]2N1c1ncc(Br)cc1Br 2046157275 LVOBCBPYPZIUAW-QRTLGDNMSA-N 438.989 4.749 50 10 IJGE ClCc1nc2ncccc2n1-c1ccc(I)c(Br)c1 2119399492 UGLQNNQJLZPIEJ-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE O=C([C@H](Br)C1CCCC1)N1CCC2(CCN(Cc3ccccc3)CC2)CC1 2167040079 NHVOKWQYXSHULN-OAQYLSRUSA-N 433.434 4.845 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CC[S@](=O)(=NCCCCCCBr)C1(C)C 2223292818 ZYVMCAHRJFOJPC-ODCWNRFASA-N 439.460 4.733 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@]2(CCC[C@H]2Br)C1 2264510003 PJZQVHSZEGBGTI-NOZJJQNGSA-N 427.589 4.944 50 10 IJGE C[C@@]1(CBr)CC(F)(F)CN1C(=O)c1scc(Br)c1Cl 2264515707 SZSLJTFQGIEXRN-JTQLQIEISA-N 437.531 4.799 50 10 IJGE FC(F)SCCCn1c(CCCl)nc2cc(I)ccc21 2279135199 MGWTYPJEYTXLOK-UHFFFAOYSA-N 430.689 4.768 50 10 IJGE Clc1ccc(CN2CCC[C@@H](Br)CC2)c(I)c1 2302336920 SCXGBYBTVHVIKN-LLVKDONJSA-N 428.539 4.694 50 10 IJGE COc1cc(C(=O)N[C@H](CCBr)COCc2ccccc2)sc1Cl 2303544369 BZQBGSPEWZYKJY-CYBMUJFWSA-N 432.767 4.510 50 10 IJGE C[C@H](Br)[C@H]1CCCN(Cc2ccc(Cl)cc2I)C1 2318539096 LBEBAAXUWKSKQD-QWRGUYRKSA-N 442.566 4.940 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2cccc(Br)c2)sc2c1CCC2 2329699431 WMSLWXDUOKIXKV-UHFFFAOYSA-N 445.338 4.722 50 10 IJGE COc1ccc(Cl)cc1[C@H](Cl)c1c(Br)c(Br)nn1C 2338723445 XGMNIRKGYPXJSG-JTQLQIEISA-N 428.939 4.935 50 10 IJGE COc1ccc2cc([C@H](C)C(=O)NNC(=O)CSc3ccc(Cl)cc3)ccc2c1 17185263 BXNGFMJLXLHHNM-AWEZNQCLSA-N 428.941 4.545 50 10 IJGE COc1ccc(/C(C#N)=C\c2ccc(OC(=O)COc3cccc(OC)c3)c(OC)c2)cc1 31902276 LBYGJUUCSIQPAA-MOSHPQCFSA-N 445.471 4.761 50 10 IJGE N#C/C(=C/c1ccc(OCc2ccc(Cl)cc2Cl)cc1)C(=O)NC[C@H]1CCCO1 96584978 SOJSGRGZALDMLE-PLMLNFJUSA-N 431.319 4.775 50 10 IJGE CO[C@@H]1CCC[C@@H](O[C@@H](CI)c2ccc(Br)cc2)C1 162368037 RUKSDQQSYFKXDI-KFWWJZLASA-N 439.131 4.899 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C\c2ccc(OCCC)cc2)cc1 207118509 SZSACGNWJAQWLZ-AAFZZKJISA-N 432.520 4.917 50 10 IJGE O=C(NN=Cc1ccccc1OCc1ccc(Br)cc1)c1ccc(F)cc1 252584479 AQJSRHQJTXTXIF-UHFFFAOYSA-N 427.273 4.931 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3ccccc3C)cc2OCC)cc1 254485475 YQOZEXTXDPYBCR-UHFFFAOYSA-N 446.503 4.776 50 10 IJGE COc1cc(C=NNC(=O)c2ccncc2)ccc1OCCOc1ccc(C(C)(C)C)cc1 254884178 NISUUIUFJHJRJK-UHFFFAOYSA-N 447.535 4.609 50 10 IJGE CC(C)(C)[C@H](CBr)NC(=O)c1cc(Br)cc(Br)c1 393965854 ZSQNYJPBHCFBJQ-NSHDSACASA-N 441.989 4.751 50 10 IJGE CCN(C(=O)c1cc(Br)ccc1I)C(C)(C)CCl 688344987 IVVJXBYUWOXGNB-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE C[C@H]1CC(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)C[C@H](C)C1 739653737 DMBPIKDKWOKRRL-JJLAUHSJSA-N 435.959 4.965 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)Nc2ccc(Br)cc2Cl)c1C 743807936 WROCJUFCFZIUEF-UHFFFAOYSA-N 447.724 4.720 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NC3(C(F)(F)F)CCOCC3)c2C)cc1 776967749 NTPMIJQXQCIETH-UYRXBGFRSA-N 431.458 4.537 50 10 IJGE Cc1cc(C)cc(-n2c(C)c(Br)c(C=NNC(=O)c3ccccc3O)c2C)c1 1084425727 IQSRJYWZCGDXRL-UHFFFAOYSA-N 440.341 4.943 50 10 IJGE Cc1cc(Br)ccc1NNC(=O)c1cccc2nc(O)n(CC(C)(C)C)c12 1295268321 GQFNYTYPGLECRX-UHFFFAOYSA-N 431.334 4.616 50 10 IJGE COc1ccc2nc(NNC(=O)c3ccc(-c4cccc(Cl)c4)nc3O)c(C)cc2c1 1637432116 BWYRJYDVNVNWCN-UHFFFAOYSA-N 434.883 4.730 50 10 IJGE Cc1cc(C)cc(-n2c(C)cc(C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)c2C)c1 1654340765 KQECWKOELGHZRA-UHFFFAOYSA-N 440.551 4.937 50 10 IJGE O=C(N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21)c1ccc(Cl)s1 1860822976 SBOQEXHPCUIBHB-NKFKGCMQSA-N 430.316 4.736 50 10 IJGE COc1ccc(-c2nn(Cc3ccccc3F)c3c2[C@@H](c2ccco2)C(C#N)=C(N)O3)cc1 1865697865 DGFCWNCNEDDKNL-OAQYLSRUSA-N 442.450 4.557 50 10 IJGE CCCc1nn(-c2ccc(Cl)cc2)c2c1[C@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865701803 FVJXJSRZPFRLNK-LJQANCHMSA-N 426.854 4.975 50 10 IJGE Cc1nn(-c2ccccc2Cl)c2c1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706143 OUHOGPFCYZGVAX-SFHVURJKSA-N 442.262 4.614 50 10 IJGE CCc1nn(-c2ccc(C)cc2)c2c1[C@@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 1865714564 MSEMWIPTWSOXBF-IBGZPJMESA-N 435.325 4.724 50 10 IJGE Brc1ccc([C@@H](CI)O[C@H]2COC3(CCC3)C2)cc1 1889721375 CSPOTDVWRRYCSG-ZIAGYGMSSA-N 437.115 4.653 50 10 IJGE C[C@](CCl)(CBr)OCc1cc(I)ccc1Cl 1904942663 MXHWBZJJPSEKOI-LLVKDONJSA-N 437.930 4.854 50 10 IJGE O=S(=O)(c1ccc(Br)s1)N(Cc1ccccc1)[C@@H](CCl)C1CC1 1915212841 YXOKKNYBAQMIOY-AWEZNQCLSA-N 434.808 4.719 50 10 IJGE O=S(=O)(c1cccc2ncccc12)N(Cc1ccccc1)C1(CBr)CCC1 1915755851 SCHOTERWOILRRS-UHFFFAOYSA-N 445.382 4.743 50 10 IJGE Cc1ccc(Br)c(N(C)C[C@H](Br)COCc2ccccc2)n1 1916343677 WBIQBLCCFWAAJR-HNNXBMFYSA-N 428.168 4.569 50 10 IJGE CN(CCN(Cc1ccccc1)C(=O)Cc1nc(CCl)cs1)Cc1ccccc1 1931964551 ZTJARXUGTAYXBI-UHFFFAOYSA-N 428.001 4.585 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](OC2CC3(C2)CC2(CCC2)C3)C1 2025070493 BFWJUXUDOZBRBR-LSDHHAIUSA-N 447.357 4.539 50 10 IJGE BrCC1CC2(C1)CN(Cc1ccc(Br)cc1Br)C2 2066494373 TXXTXTBJVKOEIV-UHFFFAOYSA-N 438.001 4.819 50 10 IJGE Cl[C@H]1CCN(c2ncc(I)cc2Br)C2(CCC2)C1 2069529484 QLHAKDWIPNVGMP-VIFPVBQESA-N 441.538 4.579 50 10 IJGE O=[N+]([O-])c1c(CBr)nn(-c2ccc(F)c(C(F)(F)F)c2)c1C(F)(F)F 2079145806 QIJZXXZYJLQGTC-UHFFFAOYSA-N 436.081 4.852 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H]1n1c(CCCl)nc2cncc(Br)c21 2095447763 MMQSNYGIMACYSD-KBXCAEBGSA-N 433.781 4.668 50 10 IJGE CC(C)[C@H](CBr)CN1CC[C@@H](C(F)(F)F)[C@@H](CNC(=O)OC(C)(C)C)C1 2106786449 UZOSVHJWNGWUKU-QLFBSQMISA-N 445.364 4.679 50 10 IJGE C[C@@H](CCCCCBr)NC(=O)c1ccc(F)cc1I 2117891669 AJJRMOKGFOWMEE-JTQLQIEISA-N 442.110 4.504 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@H]2C[C@@H](Br)C2)cc1C(F)(F)F 2126745758 YKVBUMZHLRYFGJ-PHIMTYICSA-N 437.256 4.708 50 10 IJGE O=C(c1csc(Br)c1Br)N1[C@H]2CC[C@@H]1C[C@@H](CCl)C2 2128158608 IDYAIDOJGCAWLI-PSVAKVPMSA-N 427.589 4.895 50 10 IJGE O=C(c1ccc(Br)c(Cl)c1)N1CC[C@H](Br)C(F)(F)CC1 2150018212 HIKJCJCZISSJRP-NSHDSACASA-N 431.502 4.737 50 10 IJGE Cn1nc([C@@H](Br)c2cc(Br)c3c(c2)CCO3)c(Cl)c1Cl 2150723018 MAFMPZDRPYIHDZ-VIFPVBQESA-N 440.950 4.909 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2C[C@H]1CCCN1Cc1ccccc1 2153120461 TVPSTKUOPIQCSS-QGZVFWFLSA-N 447.808 4.948 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)c1ccc2c(c1)CCCN2C(=O)OC(C)(C)C 2196914622 PDLAVJXHUAFBPY-CZIWCDLHSA-N 437.378 4.620 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)C[C@@H]1CC1(Br)Br 2208937839 ZVFKUUWRYANRID-YPMHNXCESA-N 440.017 4.778 50 10 IJGE Cc1ccc(I)c(C(=O)N[C@H](CCBr)C(C)(C)C)c1 2232157894 TWDUPOVINSUDDA-CYBMUJFWSA-N 438.147 4.529 50 10 IJGE Cc1sc(C(=O)N2CCC([C@@H](F)CBr)CC2)c(C)c1Br 2234476461 VSTUVKLHPUFMEE-NSHDSACASA-N 427.177 4.713 50 10 IJGE CC(C)CN(C[C@H](C)Br)c1ncc(Br)cc1Br 2250501553 UJQWNSHEJWPBFT-VIFPVBQESA-N 428.994 4.852 50 10 IJGE Br[C@H]1CCC2(CCN(C[C@@H]3CC3(Br)Br)CC2)C1 2250562860 MFYUNMRXWMDYHR-QWRGUYRKSA-N 430.022 4.522 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)[C@H]2CCCOC2)c1 2252836776 GUDHOBWPYWAJSX-GXFFZTMASA-N 426.974 4.944 50 10 IJGE CC[C@@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@H]1Br 2300237886 DKCPJRLZGAKZQI-GHMZBOCLSA-N 428.539 4.550 50 10 IJGE COc1cc(C=C(C#N)c2nc3ccccc3s2)ccc1OCC(=O)Nc1nccs1 2314488084 ITPHJMPXCKMTFB-UHFFFAOYSA-N 448.529 4.843 50 10 IJGE Clc1ccc(CN2CC[C@@H](CBr)C23CC3)cc1I 2315549858 XCWFOKXJMRLRQJ-NSHDSACASA-N 440.550 4.694 50 10 IJGE CNC(=O)c1ccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3cccc(Cl)c3)c2C)cc1 2319704029 PGCDERLLDWYUEU-UHFFFAOYSA-N 432.911 4.653 50 10 IJGE COc1cc(C=NNC(=O)Nc2ccccc2)cc([N+](=O)[O-])c1OCc1cccc(C)c1 2323063635 XTLGFEZXPDXYLY-UHFFFAOYSA-N 434.452 4.646 50 10 IJGE CCCN1C[C@@H](Cl)[C@@H](Cc2ccc(I)c(Br)c2)C1 2325210081 VDPWMCLKKZXSGU-WCQYABFASA-N 442.566 4.545 50 10 IJGE Cc1nsc(Br)c1C(=O)N(C)CC[C@@H](Br)c1cccs1 2366244048 ZPDFUFMRWPMWFE-SECBINFHSA-N 438.210 4.874 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)CCc1cc(Cl)cc(Cl)c1 2366852334 BCOBULSKXWGGKJ-QMTHXVAHSA-N 428.141 4.892 50 10 IJGE CN(CC1CC(Br)C1)[C@](C)(C(=O)O)c1ccc(OCc2ccccc2)cc1 2378576142 QFWDSVSJZLUCQY-FQVRHNBASA-N 432.358 4.671 50 10 IJGE CC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(COc3c(C)cccc3Cl)o2)cc1 9695074 HLOSUQGCQVRIRB-WYMPLXKRSA-N 425.872 4.543 50 10 IJGE CC(=O)Nc1cccc(C(=O)N/N=C/c2ccc(OCc3c(C)cccc3Cl)o2)c1 20291626 SVXIXUQWXHHTRA-WYMPLXKRSA-N 425.872 4.543 50 10 IJGE CCCOc1ccc(/C=C2/C(=O)N(Cc3ccc(F)cc3)C(=O)C(C#N)=C2C)cc1OCC 38608709 LHGGDOGTGDMPCQ-FYJGNVAPSA-N 448.494 4.806 50 10 IJGE CCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@@H](CCSC)c2nc3ccccc3[nH]2)c1C 39563692 FQEPYLXCAVSTEL-DJAVKIJBSA-N 435.597 4.909 50 10 IJGE Cc1c(C(=O)N2CCCC[C@@H]2C)oc2c1/C(=N/NC(=O)c1cccc(Cl)c1)CCC2 40813256 WHQWYEAZIVNKGO-GYQDZVIGSA-N 427.932 4.726 50 10 IJGE CCOc1cc(Br)c(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccc2)cc1OC 59297277 NMEHSHXJXOJACN-FBJMNJBLSA-N 429.314 4.641 50 10 IJGE CCOc1cc(OCC)c(/C=N/NC(=O)c2cc3ccccc3o2)cc1Br 59304346 WCSFQWNDCSBIIW-WSDLNYQXSA-N 431.286 4.757 50 10 IJGE CCOc1ccc(NC(=O)N/N=C/c2cccn2-c2ccc(Br)cc2)cc1 59678711 NRUYAJFXOUGXRI-HYARGMPZSA-N 427.302 4.794 50 10 IJGE BrC[C@H]1CCCCCN1c1ncc(Br)cc1Br 157403437 UCYCEIYLZRHREQ-SNVBAGLBSA-N 426.978 4.751 50 10 IJGE CC(C)OCCO[C@@](C)(CI)c1ccccc1Br 162068127 LKRAYQJIXYRMEB-AWEZNQCLSA-N 427.120 4.541 50 10 IJGE BrCC(CBr)(COCC1CC1)c1ccccc1Br 232469017 UMRLVDWHVZEVGY-UHFFFAOYSA-N 441.001 4.903 50 10 IJGE Cc1ccc(C)c(OCC(=O)NN=Cc2cccc(OC(=O)c3ccccc3Cl)c2)c1 252621510 NAFHRCFXXLUPCU-UHFFFAOYSA-N 436.895 4.705 50 10 IJGE CC(=NNC(=O)c1ccco1)c1cccc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2C)c1 254746000 ZGHVSTULTOWMPM-INIZCTEOSA-N 439.899 4.801 50 10 IJGE C[C@@]1(Cn2c(CCCl)nc3cc(Br)cnc32)CCN(Cc2ccccc2)C1 380231611 LEQIPXKZBDJPRP-OAQYLSRUSA-N 447.808 4.887 50 10 IJGE O=S(=O)(Nc1cccc(OCc2ccccc2)c1)c1ccc(CBr)cc1 388307583 BUHIBWMCPCTCLF-UHFFFAOYSA-N 432.339 4.961 50 10 IJGE Fc1cc2nc(CCl)n(C3[C@H]4CN(Cc5ccccc5)C[C@H]34)c2cc1Br 398452119 OJMUDXRUHSWAII-KBPBESRZSA-N 434.740 4.980 50 10 IJGE CC(C)(CBr)CCNCc1cc(Cl)ccc1I 405318849 YBSWQXKOPBDYNW-UHFFFAOYSA-N 430.555 4.845 50 10 IJGE Cc1sc(Br)cc1[C@H](Br)c1c(Br)cnn1C 693048584 VPEJFWQVIJGENK-VIFPVBQESA-N 428.975 4.799 50 10 IJGE CC(CBr)(CBr)NC(=O)c1ccc(Cl)cc1C(F)(F)F 712578004 BAIKXNGABFZSGX-UHFFFAOYSA-N 437.481 4.637 50 10 IJGE C[C@@]1(CBr)CCCN1C(=O)c1cc(Br)cc(Br)c1 723026692 MXFXRGRQPLDJAD-ZDUSSCGKSA-N 439.973 4.601 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)/C(=C\c2ccc(Cl)cc2)c2ccc(F)cc2)cc1 748156820 NNAYLSUDEKLOFD-STZFKDTASA-N 444.915 4.567 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1)N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 768474950 NETLFVYDRWDDAQ-MRXNPFEDSA-N 444.919 4.624 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2ccc(C(N)=O)c(Cl)c2)c(C)n1-c1ccc(F)cc1 914731903 CTVSYBDKQCPOQW-YBEGLDIGSA-N 436.874 4.531 50 10 IJGE CC(=NNC(=O)c1ccc(CSc2nncn2C)cc1)[C@H]1C[C@H]1c1ccccc1Cl 920360752 VARZKNCIHAHWSR-MOPGFXCFSA-N 439.972 4.670 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(Br)c3ccccc3c2)c1C 1648578358 ZEWDZRRXYSPNHI-UHFFFAOYSA-N 448.324 4.828 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2Cc1cccc(F)c1 1865691279 OJHKYRXGRRHIBO-QHCPKHFHSA-N 444.510 4.806 50 10 IJGE COc1cc(/C(O)=C(\C#N)c2nc(-c3ccc4c(c3)OCO4)cs2)cc(OC)c1OC 1872750355 CHACHLGMZINYOI-ZHZULCJRSA-N 438.461 4.514 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 1880762981 ZZPUHVIUKCZAAS-UONOGXRCSA-N 435.403 4.558 50 10 IJGE C[C@@H]1OCC[C@@]1(CBr)Cc1cc(Br)ccc1Br 2006502111 XPXBMFWAWUBHDO-ZANVPECISA-N 426.974 4.944 50 10 IJGE CC(C)N(C)C[C@H](Br)CCc1ccc(I)c(Cl)c1 2086647685 BVYFKVKRLHUUOO-GFCCVEGCSA-N 444.582 4.981 50 10 IJGE CN(C[C@H](Br)CCc1ccc(I)c(Cl)c1)C1CC1 2086650218 XUORMMOODASJGW-LLVKDONJSA-N 442.566 4.735 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@H]2CC[C@@H](Br)[C@H]1C2 2115946586 ZWWURSYFBDMXMT-NQMVMOMDSA-N 427.589 4.942 50 10 IJGE CCOc1ncc(COc2c(F)cc(Br)cc2CBr)s1 2239978239 QIKCVKACPLOUCP-UHFFFAOYSA-N 425.117 4.917 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1CBr)c1cc(Br)c(F)cc1Cl 2285843919 GFXDAOVBMTXDSP-OQPBUACISA-N 427.539 4.925 50 10 IJGE C[C@H]1CC[C@@H](CBr)CN1C(=O)c1cc(Br)c(F)cc1Cl 2285844638 PJVPIRAODZHHAI-IUCAKERBSA-N 427.539 4.877 50 10 IJGE CN(C=C(C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)C1CCCCC1 2318455542 VYDHQLXRGJRUII-UHFFFAOYSA-N 442.607 4.592 50 10 IJGE COc1ccc(OCCNC=C(C#N)C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1 2325141413 PJQNRNBMHOQGIE-UHFFFAOYSA-N 429.476 4.502 50 10 IJGE ClC[C@]12CC[C@@H]1CN(Cc1ccc(I)c(Br)c1)C2 2325211604 KFJFRLKHIZIYFO-RISCZKNCSA-N 440.550 4.505 50 10 IJGE COc1c(C)cc(C(=O)N[C@@H](CCBr)COCc2ccccc2)cc1Cl 2343417378 FPLKYZHCDOKASW-KRWDZBQOSA-N 440.765 4.757 50 10 IJGE COc1cc(C=NNC(=O)c2ccc3ccccc3c2)ccc1Oc1ccc([N+](=O)[O-])cn1 13142486 YXLUSRLFRMLITL-UHFFFAOYSA-N 442.431 4.708 50 10 IJGE aggregator O=C(OC[C@H]1CO[C@@](CBr)(c2cc(Cl)cc(Cl)c2)O1)c1ccccc1 21983157 JPFZAUHKNHKBLW-FUHWJXTLSA-N 446.124 4.814 50 10 IJGE CC[C@@H](C)c1nc(N2CCN(C(=O)CCCl)CC2)c2c3c(sc2n1)C[C@@H](C)CC3 35865716 YPNDOAIXAOVHJE-LSDHHAIUSA-N 435.037 4.607 50 10 IJGE O=C(/C=C/c1ccc(OCc2ccccc2)cc1)Nc1nnc(CCBr)s1 36238463 LUXVULFDBSRRBB-DHZHZOJOSA-N 444.354 4.706 50 10 IJGE Nc1c(NNC(=O)c2ccc(Cl)cc2)ncnc1NN(c1ccccc1)c1ccccc1 40777838 SERYQZOJLXHOEQ-UHFFFAOYSA-N 445.914 4.634 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccc1F)CCC2 40812340 OTRTVUXHTJQDRI-MTDXEUNCSA-N 449.482 4.767 50 10 IJGE CCOc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccs2)CCC3)cc1 40823738 XLURKHGCSZNZET-KOEQRZSOSA-N 437.521 4.771 50 10 IJGE Cc1ccnc(C2CCN(C(=O)/C(C#N)=C\c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)n1 754541813 SRDGPDAVAYABHM-JCMHNJIXSA-N 443.526 4.645 50 10 IJGE Cc1ccncc1[C@H](C)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 771378781 BZRFFQGDBDTXEB-LSPINASFSA-N 444.926 4.605 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(C(=O)NN=Cc3ccc(Br)cc3)cc2)c1 1084146346 QAVUPBMYQQHGOY-UHFFFAOYSA-N 436.309 4.774 50 10 IJGE C=CCOc1c(Cl)cc(/C=C(\C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1Cl 1084596629 PTHNSCUQCMLVNE-QGOAFFKASA-N 442.346 4.814 50 10 IJGE C=C(C)COc1cccc(NC(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)c1 1476104160 OCZJYVKSIFMORX-MRXNPFEDSA-N 431.920 4.532 50 10 IJGE C=C1CCC(CNC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)CC1 1645011094 FHQBRGBFEMHVTM-DEDYPNTBSA-N 433.943 4.887 50 10 IJGE COc1cccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4ccc(C)cc4)c(C)c32)c1 1772749448 LMNFKNQRZNLFDD-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE CCc1cccc(OCC(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)c1 1860391378 CYRHEKVZQFKSGR-UHFFFAOYSA-N 430.529 4.971 50 10 IJGE CCCOc1ccc(C(=O)N/N=C\c2cccc(OCc3ccccc3)c2)cc1[N+](=O)[O-] 1860774188 QGKPNXRYJAECAE-XYGWBWBKSA-N 433.464 4.727 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccccc2)cc1OCC 1865688242 NUKZSPHLCOTUQD-DEOSSOPVSA-N 444.535 4.646 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(C)cc2)cc1 1865692379 LRMKUSAAIJEIPK-DEOSSOPVSA-N 428.536 4.945 50 10 IJGE COC[C@@]1([C@H](Br)c2cc(Br)sc2Br)CCCO1 1943037279 RAVYERHCHFIRFZ-MWLCHTKSSA-N 449.002 4.905 50 10 IJGE CC(C)(C)N(CCBr)C(=O)c1csc(Br)c1Br 1945189590 UQUPQVNKIWAWBD-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE FC(F)Oc1cc(CBr)c(I)cc1OC(F)(F)F 2060222809 ZIVRFCQHSMBTKW-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE Cl[C@H]1CCC2(CCC2)N(c2ncc(I)cc2Br)C1 2069528989 OIGYDWGSYURSJL-VIFPVBQESA-N 441.538 4.579 50 10 IJGE CCc1nn(C)c(C(=O)N(Cc2ccccc2)[C@H](CCl)C(C)C)c1Br 2072300728 OSXPWUSLZCETRR-MRXNPFEDSA-N 426.786 4.651 50 10 IJGE CSc1ccc(-n2nc(CBr)c(Br)c2C(F)(F)F)cn1 2078911912 BUMJEWIAGSMADF-UHFFFAOYSA-N 431.075 4.665 50 10 IJGE CCOC(=O)c1sc(NC(=O)C(C#N)=Cc2ccccc2)nc1-c1ccc(OC)cc1 2085261748 GVVFMMNMJUVWSW-UHFFFAOYSA-N 433.489 4.541 50 10 IJGE CCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)c1ccc(CBr)cc1 2162912210 SEYCDSXBOQIBNM-GOSISDBHSA-N 439.394 4.833 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)C(C)(C)S(C)(=O)=O)c(C)c1Br 2227347546 JEQZBMNSJUXNEC-GFCCVEGCSA-N 432.605 4.932 50 10 IJGE Cc1ccc(NC(=O)C(C#N)=Cc2c(Oc3ccc(C)cc3)nc3ccccn3c2=O)cc1 2296543529 KHCMUMFETZFYCE-UHFFFAOYSA-N 436.471 4.649 50 10 IJGE Cc1cc(C=C(C#N)C(=O)OCC(=O)NC2CCCCCCC2)c(C)n1CCC(C)C 2297356703 RRQHJWMGDGMLOP-UHFFFAOYSA-N 427.589 4.830 50 10 IJGE CN(Cc1sccc1I)[C@H](CCBr)C(F)(F)F 2301069639 ZEIITRMYVAEWDO-SECBINFHSA-N 442.082 4.500 50 10 IJGE CN(Cc1cc(I)ccc1Cl)C[C@H]1C[C@@H](Br)C1 2307309951 OECKIACEEGCMSI-JGZJWPJOSA-N 428.539 4.550 50 10 IJGE Clc1ccc(I)cc1CN1CC2(CC2)C[C@@H]1CBr 2327388870 KCLYKSDSOPDECM-GFCCVEGCSA-N 440.550 4.694 50 10 IJGE CC1(C)CN(Cc2cc(I)ccc2Cl)CC[C@H]1Br 2327396929 JLEVUWJTYZTEOO-CYBMUJFWSA-N 442.566 4.940 50 10 IJGE Cc1nn(Cc2ccccc2)c2c1[C@H](NC(=O)C(C#N)=Cc1ccc(Cl)cc1)CCC2 2329645187 LYOSXRCAQYDPBH-JOCHJYFZSA-N 430.939 4.994 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)n2)cc1F 2331336925 KROODCTUJGEUFS-QGZVFWFLSA-N 449.507 4.799 50 10 IJGE CC1(C)CCC[C@](CBr)(Cc2ncc(I)cn2)CC1 2353311544 LVVQCVKKPHMBDT-OAHLLOKOSA-N 437.163 4.995 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1I)[C@@H]1CCCCC[C@@H]1Cl 2365582949 XMBRISNOODSXSV-GXTWGEPZSA-N 426.125 4.957 50 10 IJGE CC[C@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)c1ccccc1Br 10683796 QSYJMEYGESNHLV-KDOFPFPSSA-N 433.346 4.581 50 10 IJGE N#C/C(=C/c1cccc(OC(=O)CCCN2C(=O)c3ccccc3C2=O)c1)c1ccccc1 31902621 USBZNJBVTMZFKA-PGMHBOJBSA-N 436.467 4.733 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2cc(C)n(-c3ccccc3C)c2C)cc1 58893343 GYILDGDQNBHWHI-RWJNZEQESA-N 433.552 4.765 50 10 IJGE O=C(OCCC[PH](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1 105241814 FVUCLMNKVAVYJV-UHFFFAOYSA-N 426.496 4.960 50 10 IJGE O=c1c(Br)cc(Br)cn1CC1(CBr)CCCCC1 128485019 KWGMPEIBCGSMHC-UHFFFAOYSA-N 441.989 4.719 50 10 IJGE Cc1cc(S(=O)(=O)Nc2ccccc2CBr)sc1Br 136818760 VYOGJZDVGPVSQJ-UHFFFAOYSA-N 425.167 4.515 50 10 IJGE CCCOc1ccc(/C=C\C(=O)Oc2cccc(/C=C(/C#N)C(=O)OCC)c2)cc1OC 206683901 NMJSMTKFMQGULB-UIXWNZFTSA-N 435.476 4.573 50 10 IJGE COc1ccc(OC)c(NC(=O)/C(C#N)=C\Nc2ccc(Cl)cc2C(F)(F)F)c1 217217829 LRSIGCZZKYHJIC-KHPPLWFESA-N 425.794 4.834 50 10 IJGE CO[C@@H]1[C@@H](Cl)C[C@@H]1Oc1c(Br)cc(Br)cc1Br 229266645 ZNWVUAWDIOUXAI-ATZCPNFKSA-N 449.364 4.748 50 10 IJGE O=C(COc1ccc(Cl)cc1)NN=Cc1cccc(OC(=O)c2ccccc2Cl)c1 252612259 IRCSDGUXJWYIIA-UHFFFAOYSA-N 443.286 4.742 50 10 IJGE CCn1c(SCC(=O)NN=C/C(Br)=C\c2ccccc2)nc2ccccc21 254833708 KTYVWTHNWAAPIG-VWJKXXJMSA-N 443.370 4.686 50 10 IJGE CC1(C)CN(Cc2cc(Cl)ccc2I)C[C@H]1Br 405279873 AXGCXSWFIOFOJU-GFCCVEGCSA-N 428.539 4.550 50 10 IJGE C[C@]1(CBr)CCCN(Cc2cc(Cl)ccc2I)C1 688793720 QQFXWXUUFGVDGQ-CQSZACIVSA-N 442.566 4.942 50 10 IJGE CC(C)C[C@@H](C)O[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 725343877 UALACBCWDZQSGU-PBHICJAKSA-N 425.351 4.642 50 10 IJGE CCOc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)Nc3cnn(C)c3C3CC3)c2C)cc1 771488513 DZRCKMHNZPKTBX-DEDYPNTBSA-N 429.524 4.649 50 10 IJGE CCc1cccc(CC)c1NC(=O)/C(C#N)=C\c1ccc(C(=O)OC)cc1Br 789126391 GDXIHQUREKLAKN-WQRHYEAKSA-N 441.325 4.906 50 10 IJGE CCN(CC)c1ccc(-n2c(C)cc(C=NNC(=O)CC[C@H](O)c3ccccc3)c2C)cc1 1084359609 CFVPEPAKDXWMKK-SANMLTNESA-N 446.595 4.904 50 10 IJGE Cc1ccccc1-n1c(C)c(Br)c(C=NNC(=O)COc2ccccc2)c1C 1084565935 JYBYCCPWZFCZND-UHFFFAOYSA-N 440.341 4.694 50 10 IJGE O=C(NN=C(CSc1nc2ccccc2o1)c1ccccc1)c1cccc([N+](=O)[O-])c1 1084633687 QUGSDQPCPJDWHM-UHFFFAOYSA-N 432.461 4.662 50 10 IJGE C#CCCN(CCOC)C(=O)/C(C#N)=C\c1cc(C)n(-c2cccc3ccccc23)c1C 1131407315 AUVJUVDVSLIROP-MOHJPFBDSA-N 425.532 4.653 50 10 IJGE C=CC[C@@H]1CCCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)C1 1469920970 QRGWSUUOHLXIKL-WRDGEJPTSA-N 433.943 4.839 50 10 IJGE CCCc1sc(C(=O)NNc2nc(-c3ccccn3)nc(C)c2C)cc1Br 1558934501 CWFOASDAHQPAAJ-UHFFFAOYSA-N 446.374 4.689 50 10 IJGE O=C(CN(Cc1ccco1)c1cccc(Cl)c1)NNc1nc2ccccc2[nH]c1=S 1585173465 FRRBJKCHSODSQJ-UHFFFAOYSA-N 439.928 4.689 50 10 IJGE C=CCSc1ccccc1C(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1 1650623236 RLAYNCJCYAFIMU-UHFFFAOYSA-N 448.573 4.748 50 10 IJGE C#CCCCC(=O)NNC(=O)Nc1ccc(SCc2ccccc2)c(Br)c1 1673069514 FWXWVVQKAFTGMP-UHFFFAOYSA-N 446.370 4.698 50 10 IJGE Cc1ccc(CNC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2Cl)CCC3)cc1 1772744052 PJXRPIFOPTYRIK-UHFFFAOYSA-N 449.938 4.950 50 10 IJGE Cc1cccc(NC(=O)COc2cccnc2NC(=O)Nc2ccc(SC#N)cc2)c1 1858828368 IWUOCGDBIOAHFR-UHFFFAOYSA-N 433.493 4.625 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2cccc(F)c2)cc1 1865685901 ODNXACLQQCKDJY-QGZVFWFLSA-N 428.389 4.616 50 10 IJGE CCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@@H]2c1ccccc1OC(C)C 1865705284 QLCKBPXTYJYTCI-NRFANRHFSA-N 430.508 4.584 50 10 IJGE Cc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706141 ORSAPKOWRJYFFV-SFHVURJKSA-N 442.262 4.614 50 10 IJGE CC(C)[C@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1cc(Br)cs1 1915264567 WNQFNFIWBKXHID-HNNXBMFYSA-N 436.824 4.965 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cc(F)ccc1F 1915294968 FGFPBOLKGYEJBR-QGZVFWFLSA-N 432.330 4.575 50 10 IJGE C[C@@](CBr)(NC(=O)c1scc(Br)c1Br)C1CC1 1942785747 PVLYXEDXLDKWRF-NSHDSACASA-N 446.002 4.567 50 10 IJGE CN(CCCCCBr)C(=O)c1csc(Br)c1Br 1945188848 CLIALSDKNIOYLS-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE CN(CCN(C)C(=O)OCc1ccccc1)CC1(CBr)CCCCCC1 1981482715 NGDWLBFVXAACKK-UHFFFAOYSA-N 425.411 4.922 50 10 IJGE CC(C)[C@H](Br)[C@H](C)NC(=O)c1csc(Br)c1Br 1997051485 WGVBYRPYCCXHDB-XPUUQOCRSA-N 448.018 4.811 50 10 IJGE BrC[C@@H]1CN(Cc2cc(Br)ccc2Br)CCS1 2006498663 FQNAXLVMPXPJHL-LLVKDONJSA-N 444.030 4.524 50 10 IJGE ClC[C@@H](Nc1ncc(I)cc1Br)C1CCCC1 2015757898 CIBFAWSSBUBIEC-LLVKDONJSA-N 429.527 4.658 50 10 IJGE CCCN(CCCCl)C(=O)c1cc(I)ccc1Br 2032097687 PULSPAQJPDETKE-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C[C@@H](Br)C(F)(F)F)C2(CCCCC2)C1 2044696190 JVJVZFBPWCWNTM-CHWSQXEVSA-N 429.321 4.614 50 10 IJGE C[C@@]12CN(Cc3cccc(Br)c3Br)C[C@]1(CBr)C2 2046798889 QYSDSXVKGWBYQH-ZIAGYGMSSA-N 438.001 4.819 50 10 IJGE Cc1csc(C(=O)N[C@@H](C)CCCCCI)c1Br 2054169487 FORJQXWFCJUDQF-JTQLQIEISA-N 444.176 4.933 50 10 IJGE C[C@@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1cc(F)ccc1CBr 2059264530 HAPYSVRHHYNHIZ-AWEZNQCLSA-N 426.351 4.710 50 10 IJGE CC(C)[C@@H]1[C@H](Br)CCN1Cc1cc(Cl)ccc1I 2062184842 WQCBHMWTGUSQBC-TZMCWYRMSA-N 442.566 4.938 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1ccc(CSC(F)F)o1 2125293245 LNTJTEOOQVQLHQ-UHFFFAOYSA-N 428.592 4.731 50 10 IJGE O=C(c1cc(Cl)ccc1Br)N1CC[C@@H](Br)C(F)(F)CC1 2150019535 SKZFNYQKUXAREL-LLVKDONJSA-N 431.502 4.737 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@@H]1Cl)c1csc(Br)c1Br 2150344913 WIRBUVKPRLQCGR-JQWIXIFHSA-N 435.568 4.908 50 10 IJGE Fc1ccc(N2CCC[C@@]3(CN(Cc4ccccc4)CCO3)C2)c(CBr)c1 2151736817 BRGXBSRJEZKDOO-JOCHJYFZSA-N 433.365 4.592 50 10 IJGE Cc1cc(C(=O)N2C[C@]3(F)CCC[C@@]3(CBr)C2)c(Br)s1 2176637824 WZSQXIYDJSUIFY-ZIAGYGMSSA-N 425.161 4.548 50 10 IJGE Fc1cc2nc(CCl)n(C[C@]3(Br)CC3(F)F)c2cc1Br 2202503881 IFZDXPZBLLBPJV-LLVKDONJSA-N 432.465 4.849 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Cl)c2n1C[C@@H]1CC1(Br)Br 2224802186 CMHXGKPMZNAUMQ-RQJHMYQMSA-N 427.955 4.891 50 10 IJGE BrCC1(COCCOCCOCCOCc2ccccc2)CCCCCC1 2236092960 RRJSDNOBSVSYSM-UHFFFAOYSA-N 443.422 4.989 50 10 IJGE C[C@H](Br)[C@@H](NC(=O)c1scc(Br)c1Cl)C(F)(F)F 2253534499 AVJYXDOYLPGAQF-CLTAVNFZSA-N 429.483 4.608 50 10 IJGE C[C@@]12CC[C@@](CBr)(C1)N(C(=O)c1scc(Br)c1Cl)C2 2264504572 QOLMQAIDPUGGKC-OLZOCXBDSA-N 427.589 4.944 50 10 IJGE CC(C)c1cc(Br)cc(C(=O)N2CCC(I)CC2)c1 2266023111 MVTROUMMCAKJLP-UHFFFAOYSA-N 436.131 4.612 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@H](CBr)CC2CC2)[C@H](C(F)(F)F)C1 2266310760 SLLVYMVTFZWOBH-ZNMIVQPWSA-N 443.348 4.718 50 10 IJGE O=C(NCC[C@H]1CCC[C@H]1Br)c1cc(F)c(Br)cc1Cl 2282984139 VNAITKKBAAANLX-PSASIEDQSA-N 427.539 4.925 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2COc3ccccc32)cc1I 2285000176 SIQDDUQGJSRFIV-BLLLJJGKSA-N 445.094 4.912 50 10 IJGE CCCn1c(C)cc(C=C(C#N)C(=O)Nc2cc(C(F)(F)F)ccc2-n2cncn2)c1C 2297368766 JLZDCWJKVGPOSU-UHFFFAOYSA-N 442.445 4.660 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@@H]2CCCC[C@@H]3C[C@@H]32)CC1 2302658513 RWRYBCLCFKEFCP-OWCLPIDISA-N 449.373 4.786 50 10 IJGE CC(C)[C@@H](Cl)CCNCc1ccc(I)c(Br)c1 2306223179 BQXLEEFQPLFZBA-LBPRGKRZSA-N 430.555 4.797 50 10 IJGE O=S1(=O)C[C@@H]2[C@H]([C@@H](Cl)c3ccc(OCc4ccccc4)cc3Br)[C@@H]2C1 2314442394 BGFRUXVTGLZILK-NBMJBFSESA-N 441.774 4.599 50 10 IJGE Br[C@@H]1C[C@@H]2CCCC[C@H]2N(Cc2sccc2I)C1 2316765475 XMPVEOSHMSASMR-DMDPSCGWSA-N 440.188 4.881 50 10 IJGE Cl[C@@H]1CCN(Cc2ccc(I)c(Br)c2)C12CCC2 2325218645 QRSYYFGKYYRHJL-CYBMUJFWSA-N 440.550 4.790 50 10 IJGE N#CC(=C(O)CCN1C(=O)c2ccccc2C1=O)c1nc(-c2ccc(Cl)cc2)cs1 2331295780 DCSVWGWUIZWZNT-UHFFFAOYSA-N 435.892 4.942 50 10 IJGE Cc1ccc(N2C[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c(CBr)c1Cl 2335416160 WVPUHPABPRKCMO-WOJBJXKFSA-N 435.793 4.633 50 10 IJGE C[C@@H](Cl)c1ccccc1NS(=O)(=O)CCCCCCN1C(=O)c2ccccc2C1=O 2364195019 LYKBYYYKKKWJEH-MRXNPFEDSA-N 448.972 4.585 50 10 IJGE C[C@@H]1[C@@H](C)N(Cc2ccccc2)[C@H](C)CN1c1c(CBr)c(C(F)F)nn1C 2365337341 KCWWXWALZFGBKM-RBSFLKMASA-N 441.364 4.740 50 10 IJGE CC(C)c1ccc(/C=N/NC(=O)c2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3)c2)cc1 2754792 DBDCWUFRQRPTSD-MFKUBSTISA-N 430.464 4.734 50 10 IJGE O=C(NNC(=O)c1ccc(-c2ccccc2)cc1)c1ccc(NC(=O)C2CCCCC2)cc1 12487822 DIIZQSNSLDHXBE-UHFFFAOYSA-N 441.531 4.947 50 10 IJGE Cc1cc(C(=O)COC(=O)/C(C#N)=C\c2ccc(N(C)C)cc2)c(C)n1Cc1cccs1 97673952 BMCWXLFBPMCYPE-MOSHPQCFSA-N 447.560 4.614 50 10 IJGE CCCCCCOc1ccc(/C=N\NC(=O)c2ccc3nc(S)[nH]c3c2)cc1OC 169917671 UGOMQRHLFZYWGQ-UCQKPKSFSA-N 426.542 4.583 50 10 IJGE CCC[C@H](CCBr)CNS(=O)(=O)c1ccc(Br)cc1Cl 227505852 OPIJTBRMPWUWPO-SNVBAGLBSA-N 447.620 4.582 50 10 IJGE CO[C@H](C)CC(CBr)(CBr)c1ccc(Br)cc1 228630569 MUZKLTVZUFQBNN-SNVBAGLBSA-N 428.990 4.902 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@H](c2ccc(Br)cc2F)C1 382701732 OWVVUSAQDFMDSU-ZWNOBZJWSA-N 437.147 4.934 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(OC[C@@H]2C[C@H]3CCCC[C@@H]3O2)C1 393257658 AKAUOIZGPIFTER-NHAYFPRASA-N 432.399 4.515 50 10 IJGE C[C@H](CBr)[C@@H](C)Nc1ncc(C(F)(F)F)cc1I 686109203 PRBBXHWNSJIAPX-RNFRBKRXSA-N 437.041 4.536 50 10 IJGE CC(C)N(C[C@H](C)Br)C(=O)c1cc(Cl)ccc1I 691343149 IQPCEJXOLBHCGV-VIFPVBQESA-N 444.538 4.579 50 10 IJGE CN(C(=O)c1cc(Br)ccc1Br)[C@@H]1CCC[C@H]1Br 709269745 YLJLGIWXDBZCRK-VXGBXAGGSA-N 439.973 4.600 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCc3cc(O)nc4ccccc34)c2C)cc1 748331596 RIVMQTKCIOOJMQ-FYJGNVAPSA-N 436.515 4.880 50 10 IJGE C/C(=C/C(=O)NNC(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1OC(F)F 1556340961 OSPKFXPOBQYXGW-NTMALXAHSA-N 430.238 4.851 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2cnc(-c3cccc(Cl)c3)s2)c1C 1638346616 HEHZARXIIUEBFJ-UHFFFAOYSA-N 436.928 4.689 50 10 IJGE O=C(CSc1nc(-c2ccc(Cl)cc2)cs1)NN=Cc1ccccc1[N+](=O)[O-] 1772755140 PKCULTIFQDFPNG-UHFFFAOYSA-N 432.914 4.614 50 10 IJGE Cc1ccc(OCCCC(=O)NN=Cc2c(F)cccc2Cl)c(Br)c1 1772755780 RZDWIXCNIXFZDM-UHFFFAOYSA-N 427.701 4.859 50 10 IJGE COc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(Cl)c(Cl)c2)c1 1865711611 COXGGJDILZBWHJ-LJQANCHMSA-N 427.291 4.714 50 10 IJGE C=Cc1ccccc1OCC(=O)N[C@H](C(=O)Nc1ccc(SC#N)cc1)c1ccccc1 1867265835 PPVSYNWFLBKANX-DEOSSOPVSA-N 443.528 4.778 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCC[C@@]12CCN(C(=O)OC(C)(C)C)C2 1882088170 PAAMOTDITXEQDP-SXGZJXTBSA-N 447.414 4.702 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)C(=O)c1cc(Br)ccc1O 1914226423 FKCRFJWJYYYTOG-LBPRGKRZSA-N 427.136 4.581 50 10 IJGE Cc1cc(F)ccc1S(=O)(=O)N(Cc1ccccc1)[C@H](CBr)C(C)C 1915294973 FHGAEUXUSRYVBI-GOSISDBHSA-N 428.367 4.745 50 10 IJGE Clc1ccc(C(CBr)(CBr)CC[C@@H]2COCCO2)cc1 1916660872 UVOGJEUJKDFLLG-CQSZACIVSA-N 426.576 4.563 50 10 IJGE Clc1nc(Cl)n(-c2ccc(I)cc2)c1CBr 1982552739 FSGCPNKHWUSUMP-UHFFFAOYSA-N 431.886 4.679 50 10 IJGE CC1(CBr)CC(NC(=O)c2csc(Br)c2Br)C1 2006994113 IXTCEHBQXKPFEJ-UHFFFAOYSA-N 446.002 4.567 50 10 IJGE C[C@@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)[C@H](CBr)C1CC1 2009644928 GTCKKELGBRFEFH-KBXCAEBGSA-N 428.417 4.815 50 10 IJGE O=C(N[C@H]1CC[C@H](CBr)C1)c1cccc(Br)c1Br 2031482293 QKSDVOSGBJSLOC-IUCAKERBSA-N 439.973 4.505 50 10 IJGE CC1([C@@H](CBr)NC(=O)c2cc(Br)ccc2Br)CC1 2033130048 MRFPPRWDVUKCSF-LLVKDONJSA-N 439.973 4.505 50 10 IJGE CCn1nnc(Br)c1C[C@H](Br)c1ccc(Br)cc1 2050569846 BZVHATMLESIMDC-JTQLQIEISA-N 437.961 4.502 50 10 IJGE O=C(OCc1ccccc1)N1CC2(CC=CCN2Cc2ccc(CBr)cc2)C1 2086549780 TZJAUQDRFPIBKN-UHFFFAOYSA-N 441.369 4.735 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Br)c2n1Cc1nccn1Cc1ccccc1 2095445788 MDEANMPMOAFPFY-CYBMUJFWSA-N 430.737 4.787 50 10 IJGE Cc1cc(C(=O)N[C@@H](CBr)CC(C)(C)C)ccc1I 2142113046 LSKBYMNPAVREQH-GFCCVEGCSA-N 438.147 4.529 50 10 IJGE CO[C@@H]1CN(CC2(CBr)CCCCCC2)[C@](C)(CNC(=O)OC(C)(C)C)C1 2163061332 GFMFJRNWCRRKAJ-PXNSSMCTSA-N 447.458 4.726 50 10 IJGE Cn1nc([C@@H](Br)c2cc(Cl)cc3c2OCC3)c(Br)c1Cl 2167047943 MWFBVGPDHHLCHW-VIFPVBQESA-N 440.950 4.909 50 10 IJGE O=C(NC[C@@]12CCC[C@@]1(CBr)C2)c1scc(Br)c1Cl 2264504060 LVLWKVBTIWLKDM-STQMWFEESA-N 427.589 4.849 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@H]2CCCCS2(=O)=O)c(C)c1F 2279145131 VDNJECLKUPSOQJ-DGCLKSJQSA-N 428.161 4.608 50 10 IJGE CC1(C)C[C@H](NC(=O)c2ccc(Cl)c(I)c2)C[C@H](Cl)C1 2283661214 GFOSPJVTEOFJOW-WDEREUQCSA-N 426.125 4.861 50 10 IJGE O=C(N[C@@H]1CC[C@H]2C[C@]21CBr)c1cc(Br)c(F)cc1Cl 2285963907 RAVSBVAIYTZLSY-DSBAHLMNSA-N 425.523 4.535 50 10 IJGE N#CC(=CNc1ccccc1N1CCOCC1)C(=O)Nc1ccc(Oc2ccccc2)cc1 2325141335 WNRGOSKTNOQFTG-UHFFFAOYSA-N 440.503 4.774 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)CNC(=O)c3ccc(Cl)cc3)n2)cc1 2331273667 LYHRVFNAALSNKE-UHFFFAOYSA-N 425.897 4.695 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)CN3C(=O)c4ccccc4C3=O)n2)c(C)c1C 2331361294 FZUCKGIPEQLBPS-UHFFFAOYSA-N 445.500 4.524 50 10 IJGE CC[C@H](CBr)CN1CC[C@H](CCNC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2337614538 XAPQGAIDLYBREZ-ILXRZTDVSA-N 445.364 4.965 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ccc(Cl)cc2I)C[C@H]1CCl 2366680340 QSAWGPNYUATGKF-KOLCDFICSA-N 438.058 4.794 50 10 IJGE CCOc1ccccc1-c1cc(C(=O)NN=Cc2ccc3c(c2)OCO3)c2ccccc2n1 8671569 CFAHHVLAVLQUGX-UHFFFAOYSA-N 439.471 4.793 50 10 IJGE aggregator CC[C@H](C)c1ccccc1OCC(=O)NNC(=O)c1ccccc1OCCc1ccccc1 10508849 MEOKZVGRUTZPPV-FQEVSTJZSA-N 446.547 4.662 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2OC)cc1 38650004 OWPPMMRITHTDGA-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccco2)cc1 38657487 WBQSCVLNFOCJRO-XMMPIXPASA-N 444.487 4.780 50 10 IJGE O=C(CCCSc1nc2ccc([N+](=O)[O-])cc2s1)N/N=C/c1cccc(Cl)c1 58990515 DUHBKQCYFPSNQC-RGVLZGJSSA-N 434.930 4.881 50 10 IJGE COc1cc(/C=N/NC(=O)c2cc3ccccc3o2)ccc1OCc1ccc([N+](=O)[O-])cc1 59305058 SIOGJGUKARZVPE-AFUMVMLFSA-N 445.431 4.693 50 10 IJGE CC[C@H](C)N1C(=O)C(C#N)=C(C)/C(=C/c2cn(-c3ccccc3)nc2-c2ccccc2)C1=O 214253999 HINKOWOJWQJQDD-JYBCESJWSA-N 436.515 4.930 50 10 IJGE CCOc1ccc(-c2cc(C(=O)NN=Cc3ccccc3OCc3ccccc3)[nH]n2)cc1 254412171 KRCBDCUJFYLDML-UHFFFAOYSA-N 440.503 4.818 50 10 IJGE Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NN=C3CCCc4ccccc43)c2)c(C)c1 254521439 DASDDZSOZAFJSL-UHFFFAOYSA-N 447.560 4.575 50 10 IJGE CC[C@@](C)(CO[C@@H](CI)c1ccccc1Br)OC 319061830 HPUWMUSDAXZJIJ-KBPBESRZSA-N 427.120 4.757 50 10 IJGE O=C(OCc1ccccc1)N1C[C@@H](CI)[C@@H](c2ccccc2F)C1 382697092 SOXDARICFPJRGU-WBVHZDCISA-N 439.268 4.613 50 10 IJGE CC(C)CCCCCC(CBr)(CBr)[C@H]1CCS(=O)(=O)C1 383579038 VQMUWXFOBYAGJH-AWEZNQCLSA-N 432.262 4.804 50 10 IJGE CC1(C)C[C@@H](Cl)CCN(C(=O)c2ccc(I)c(Cl)c2)C1 395351950 SDUAUMIZNMWAMM-NSHDSACASA-N 426.125 4.814 50 10 IJGE C[C@H]1CC[C@H](Br)CN1C(=O)c1cc(Br)c(Br)s1 399471262 MOXIEHQGSQFOFR-BQBZGAKWSA-N 446.002 4.661 50 10 IJGE CC(C)(C)N(CCCBr)S(=O)(=O)c1ccc(Br)cc1Cl 691006605 OBGOTMBQGFLXAG-UHFFFAOYSA-N 447.620 4.677 50 10 IJGE BrCc1c(N2CC[C@@H]3[C@@H](CCCN3Cc3ccccc3)C2)nc2sccn12 715015001 MYSHJBWHNYNPAQ-ZWKOTPCHSA-N 445.430 4.782 50 10 IJGE C[C@H](NC(=O)NNC(=O)Cc1ccccc1F)c1ccccc1-c1ccc(Cl)cc1 740060958 BIYZFTPBGFRCPI-HNNXBMFYSA-N 425.891 4.780 50 10 IJGE O=C(Cc1c[nH]c2cc(Br)ccc12)Oc1ccc([N+](=O)[O-])c2ncccc12 770127484 PTGJVWVUCOXEBR-UHFFFAOYSA-N 426.226 4.535 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2C[C@@H]3[C@H]4CC[C@@H](C4)[C@H]3C2)c(-c2ccc(Cl)cc2)n1 818447622 AUVZHJNHQNBHBI-IRCKANPWSA-N 445.954 4.529 50 10 IJGE C#Cc1ccc(NC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)c(Cl)c1 1467402910 KSZYBZQSQMAQHI-UHFFFAOYSA-N 440.714 4.640 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNc1cc(OC)ccc1Br 1570384735 NZGDXDQNKPPISW-UHFFFAOYSA-N 445.235 4.798 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2cccnc2O)c(C)n1-c1cccc(Cl)c1Cl 1596034502 WZHZYNLJSGBCND-LICLKQGHSA-N 441.318 4.725 50 10 IJGE C#C[C@H](CCC)NC(=O)NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1 1683680747 GOBRDLUVJLXIMQ-HSZRJFAPSA-N 441.531 4.679 50 10 IJGE COc1cccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4cccc(C)c4)c(C)c32)c1 1772750196 WZNLWPTVRRABBN-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2)[C@@H]1c1ccc2c(c1)OCCO2 1865698640 ZIEXEHACVUZOJL-HSZRJFAPSA-N 448.482 4.529 50 10 IJGE COC(=O)c1c(NC(=O)CBr)sc(C)c1-c1ccc(Br)cc1 1866000432 MTOIQIUEBAFMRX-UHFFFAOYSA-N 447.148 4.606 50 10 IJGE CC1(CCCO[C@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)CC1 1902022889 CHISZJLBSTWRAM-SFHVURJKSA-N 437.362 4.788 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)Cc1c(Cl)ccc(Cl)c1F 1905405354 OJWHSRNOOHYJFW-VIFPVBQESA-N 431.088 4.735 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@@H](CCl)C2(CCC2)C1 1914487058 QDCZWNCXTVFLAN-MRVPVSSYSA-N 427.589 4.754 50 10 IJGE Cc1c(Br)sc([C@H](Br)[C@H]2OCCO[C@H]2C)c1Br 1922921425 QPBZUYFAPBEDSW-ZQARSLAVSA-N 449.002 4.821 50 10 IJGE O=C(NC1CCC(Br)CC1)c1csc(Br)c1Br 1945188955 FMNSGZBPNDFHMQ-UHFFFAOYSA-N 446.002 4.709 50 10 IJGE O=S(=O)(c1ccc(Br)c(CCl)c1)N(Cc1ccccc1)CC(F)F 1946836285 VFWACZGKCGFBDR-UHFFFAOYSA-N 438.721 4.644 50 10 IJGE CC[C@H](CCCBr)NC(=O)c1csc(Br)c1Br 1948444928 KWGFUFZUMORCOM-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE CC(C)[C@@H](CI)NCc1ccc(Cl)c(Br)c1F 2001884530 SWNCJZWLIWTWHC-SNVBAGLBSA-N 434.518 4.791 50 10 IJGE O=S(=O)(c1ccc(CBr)cc1Cl)N(Cc1ccccc1)C1CCC1 2009621440 GDOBSBSPRGABBB-UHFFFAOYSA-N 428.779 4.978 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](O[C@@H]2CCC[C@H]3CCCC[C@H]32)C1 2022999283 SXDJZCXEBNAURT-NQNKBUKLSA-N 449.373 4.785 50 10 IJGE CCC[C@H](CBr)CN=[S@@]1(=O)CC[C@@H](CNC(=O)OC(C)(C)C)C1(C)C 2044704295 BMWWOLRVRLWJND-OKXMYEFYSA-N 439.460 4.589 50 10 IJGE CC(C)(CBr)CN1CC[C@@H](C(F)(F)F)C[C@@H]1CNC(=O)OC(C)(C)C 2045432409 UOPHITFVYIRDRB-CHWSQXEVSA-N 431.337 4.575 50 10 IJGE COCCOCCN(Cc1ccccc1)c1cc(Br)cc(F)c1CCl 2051132536 BYOHHOXIDBRPFP-UHFFFAOYSA-N 430.745 4.997 50 10 IJGE Cc1cc(Br)c(CCl)c(-n2nc(C)c(I)c2C)c1 2053204428 YRAOXRXRJTUBFO-UHFFFAOYSA-N 439.522 4.903 50 10 IJGE FC1(CBr)CCN(Cc2cc(Br)ccc2Br)CC1 2054718317 NBAOZOHSQQFTFC-UHFFFAOYSA-N 443.980 4.911 50 10 IJGE C[C@H]1[C@@H](n2c(CCCl)nc3cncc(Br)c32)CCN1Cc1ccccc1 2095446706 ZMLYCNKIFIDWBX-KSSFIOAISA-N 433.781 4.811 50 10 IJGE CC(C)N(C[C@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2110714121 ANVSGBFTPKKSBO-IAGOWNOFSA-N 431.415 4.577 50 10 IJGE COc1cc(Cl)c([C@H](Cl)c2cn(C)nc2Br)cc1Br 2137656505 PPBHBHASFOQAGC-NSHDSACASA-N 428.939 4.935 50 10 IJGE CCc1sc(Br)cc1[C@@H](Br)c1cccc(S(C)(=O)=O)c1 2146828557 SPFXMKZMDNGQQY-AWEZNQCLSA-N 438.206 4.961 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1CN(C(=O)c1ccc(CBr)cc1)C1CC1 2162912588 XNCAZIMFJMTESI-SFHVURJKSA-N 437.378 4.586 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)c2ccc(CBr)cc2)C2(CCC2)C1 2169197607 BKJIMVWRDNUECQ-KRWDZBQOSA-N 437.378 4.634 50 10 IJGE Cc1ccc(I)c([C@H](Br)c2ccc3c(c2)OCCO3)c1 2240997927 WJJDUJRQVISQBN-MRXNPFEDSA-N 445.094 4.855 50 10 IJGE CCn1nc(C)c(CBr)c1N1CCN(Cc2ccccc2)[C@](C)(C2CC2)C1 2281304202 TVEDASNEIAXKMX-QFIPXVFZSA-N 431.422 4.597 50 10 IJGE C[C@H](Cl)COCc1cn(-c2c(Br)cc(Cl)cc2Br)nn1 2295829568 YICZQNINSBVHET-ZETCQYMHSA-N 443.954 4.590 50 10 IJGE N#CC(=Cc1cn(CC(=O)Nc2ccccc2)c2ccccc12)C(=O)NC1CCCCC1 2297533770 YEGVHPVPGDULRL-UHFFFAOYSA-N 426.520 4.636 50 10 IJGE CC1(C)OC[C@H](Cc2ccc(Cl)c(I)c2)[C@@H]1Br 2300239091 UDQRTZLWPLMQSE-CABZTGNLSA-N 429.523 4.676 50 10 IJGE Clc1ccc(CN2CCC[C@@H](CBr)C2)c(I)c1 2302326167 NFDSHMVNQFGIQW-JTQLQIEISA-N 428.539 4.552 50 10 IJGE Clc1ccc(CN2CCC[C@H](Br)CC2)c(I)c1 2302336921 SCXGBYBTVHVIKN-NSHDSACASA-N 428.539 4.694 50 10 IJGE C[C@@H](CCCCl)CNCc1ccc(I)c(Br)c1 2306224008 LWFLXDMWCJQBSQ-JTQLQIEISA-N 430.555 4.798 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)COc2ccc(C(C)C)c(C)c2)cc1 2314785150 VJLBJHHQGRYIRR-UHFFFAOYSA-N 434.536 4.926 50 10 IJGE ClCc1ncccc1OCc1ccc(I)c(Br)c1 2325385902 HAUVKBACNUHHRP-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@H](Br)CC12CC2 2327401566 QTSHOYKGCLKMHL-NSHDSACASA-N 440.550 4.837 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@H]2C[C@H](Cl)CC[C@H]21 2328781523 WTQBECOTSTZUCA-QXFUBDJGSA-N 427.589 4.895 50 10 IJGE CC(C)COC(=O)c1ccc(NC(=O)C(C#N)=Cc2ccc(Br)cc2)cc1 2329662211 GCRYTEYCBMFOOG-UHFFFAOYSA-N 427.298 4.808 50 10 IJGE CC[C@@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)COc1ccccc1-c1ccccc1 9871216 QGFQIWPSOWBSHS-WOJBJXKFSA-N 446.547 4.861 50 10 IJGE Cc1cc(Br)cc(Br)c1OCC(=O)N/N=C1/CCC[C@@H](C)C1 34967452 LNEJYPQQINUPKD-ICHPLGEASA-N 432.156 4.581 50 10 IJGE CCOc1ccc(-n2c(SCC(=O)NN)nc(-c3ccccc3)c2-c2ccccc2)cc1 35666755 BIJJBHGDOVYGKZ-UHFFFAOYSA-N 444.560 4.687 50 10 IJGE Cc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)NCc4ccccc4Cl)c(C)c32)cc1 40804436 DUYWADHHLNUZKK-VFCFBJKWSA-N 449.938 4.950 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2OC)CCC3)cc1 40813242 RNNVSOKWFYQBHP-NHFJDJAPSA-N 446.503 4.849 50 10 IJGE CC(C)Cc1ccc(-c2csc(/C(C#N)=C\Nc3ccc4c(c3)C(=O)NC4=O)n2)cc1 97472376 YJZDBOWOCURWNL-ATVHPVEESA-N 428.517 4.869 50 10 IJGE Cc1cccc(C(=O)Oc2ccc(C=NNC(=O)c3cc(Cl)c(O)c(Cl)c3)cc2)c1 254818925 RQGDYXKEJQLCSI-UHFFFAOYSA-N 443.286 4.991 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N1CCCC[C@H]1C[C@H](C)Br 312939722 HPDCDBCEPDGCFL-ONGXEEELSA-N 445.242 4.536 50 10 IJGE C[C@H]1CC[C@H](CBr)CN1c1ncc(Br)cc1Br 688663829 IIZNUDUMGKPSLK-DTWKUNHWSA-N 426.978 4.606 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)/C=C\c2ccc(-c3ccccc3Cl)s2)cc1 748162052 XPPKLUPIQABPPU-LCYFTJDESA-N 432.954 4.629 50 10 IJGE CCc1cc(NNC(=O)/C=C(/c2ccc(Cl)cc2)C(F)(F)F)nc(-c2ccccn2)n1 771008902 NKPJHZVWSZAHFK-VBKFSLOCSA-N 447.848 4.843 50 10 IJGE C[C@@H](OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1)c1cccnc1 781865623 BVRBAFLLZWCCLE-PUMYGXPMSA-N 431.883 4.724 50 10 IJGE C/C(=C\c1cccc(Cl)c1)C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1 1523453259 OVKXDWOIMKJBPG-DTQAZKPQSA-N 438.886 4.923 50 10 IJGE CCCc1nn(Cc2ccc(F)cc2)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865698893 FTUZMPZEFXQQSU-QHCPKHFHSA-N 441.510 4.733 50 10 IJGE CCCc1nn(-c2ccc(OC)cc2)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699402 SSEFGOZMIOEAEF-HSZRJFAPSA-N 439.519 4.543 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C[C@@H]1CN(C(=O)OC(C)(C)C)C(C)(C)C1 1881244840 WYJXHRWVZKTXLM-UONOGXRCSA-N 435.403 4.700 50 10 IJGE C[C@@H]1CCN(C(=O)OC(C)(C)C)CC[C@@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1881376152 ODPQXSWOBMRZOS-ILXRZTDVSA-N 435.403 4.558 50 10 IJGE C[C@H]1CN(Cc2ccc(Br)cc2Br)C[C@H]1CBr 1943857496 DMFWXCKZWAHMRO-GXSJLCMTSA-N 425.990 4.674 50 10 IJGE C[C@@H]1C[C@@H](Br)CN(C(=O)c2csc(Br)c2Br)C1 1945186978 PAQXOWJQYRCRBC-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE C[C@H]1CN(C(=O)c2csc(Br)c2Br)CC[C@H]1Br 1945189437 QMQKPDOGNHQBPS-POYBYMJQSA-N 446.002 4.519 50 10 IJGE CN(Cc1c(Br)cccc1Br)CC1CC(Br)C1 1945333250 NINGGHKKOWDOGP-UHFFFAOYSA-N 425.990 4.817 50 10 IJGE Clc1ccc(I)c(C[C@]2(CBr)CC=CCO2)c1 1946375207 QLVMTRQNMUGMDC-ZDUSSCGKSA-N 427.507 4.597 50 10 IJGE CC[C@@H](CCCBr)NC(=O)c1cc(Br)c(Br)s1 1948445270 OMTPHUUNVLKCPI-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OCC[C@]23CCC[C@H]2C3)C1 2011683788 ARRNLCHUGQTMJK-ZYSHUDEJSA-N 449.373 4.788 50 10 IJGE O=C(CBr)c1cc(C(F)(F)F)cc(OC(F)(F)F)c1Br 2054796403 FBIVJMDTTSPSNM-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE C[C@@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1ccc(CBr)cc1F 2059264391 FFQAXFQOJSZKSK-AWEZNQCLSA-N 426.351 4.710 50 10 IJGE CC(C)(C)c1cc(-n2nc(CCl)c(I)c2C(F)(F)F)ccn1 2078889882 BVNCOVQOPBNGNK-UHFFFAOYSA-N 443.638 4.927 50 10 IJGE CC1(C)C[C@H](O[C@](C)(CI)c2ccccc2Br)CO1 2115709186 YVUGRGWQWZEZHE-XHDPSFHLSA-N 439.131 4.683 50 10 IJGE Cc1cc(CN(C)c2ncc(Br)c(CCl)n2)sc1Br 2137590288 HLTURIZVELZNRT-UHFFFAOYSA-N 425.577 4.747 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1ccc(CBr)cc1 2162912258 SUKPSXQCMFBQIO-ZWKOTPCHSA-N 437.378 4.586 50 10 IJGE Cc1nn(C)c(N2CCC[C@]3(CCCN(Cc4ccccc4)C3)C2)c1CBr 2163308200 UXBHBCTXZQIWDE-QFIPXVFZSA-N 431.422 4.506 50 10 IJGE CC1(C)CN(Cc2ccccc2)CCN(c2cc([N+](=O)[O-])ccc2CBr)C1 2176908540 LEEJITNBMAJZPI-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE O=S(=O)(c1cc(CBr)sc1Br)N1C2CCCC1CCC2 2179786830 GRMPDNHGRQZPHV-UHFFFAOYSA-N 443.226 4.501 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)C(C)(C)c1ccc(NC(=O)OC(C)(C)C)cc1 2196915468 YTYAYFUNJZCXFJ-FZNQNYSPSA-N 439.394 4.943 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCC(OCCCCl)CC1 2207523216 FSPMQKOMURHQDN-UHFFFAOYSA-N 445.604 4.523 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ccc2c(c1)OC(F)(F)O2 2231587816 YPBNDNPTRWBGQJ-OAHLLOKOSA-N 426.257 4.824 50 10 IJGE CC(C)C[C@@H](CBr)CNC(=O)Cc1ccc(Br)cc1Cl 2237439533 IGDQNNPSJOWVCW-NSHDSACASA-N 425.592 4.818 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCCCN(C(=O)OC(C)(C)C)CC1 2242080368 ODIDSQCRJOWPHZ-CABCVRRESA-N 435.403 4.702 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCCCBr)[C@H](C(F)(F)F)C1 2263152066 PJDXXPDPVQOWAE-AWEZNQCLSA-N 431.337 4.815 50 10 IJGE O=C(N1CCC[C@@H](C2CCN(CCCCCCCBr)CC2)C1)C(F)(F)F 2294698791 KCHCRIRQIWQGTD-QGZVFWFLSA-N 441.376 4.845 50 10 IJGE COC(=O)c1ccc(-c2ccc(C=C(C#N)C(=O)Nc3nc4ccccc4s3)o2)cc1 2297500425 YYGRYTFUQVCEFI-UHFFFAOYSA-N 429.457 4.889 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@@H]2C[C@H]3CC[C@H](C3)C2)C1 2299587477 RFFHPKYENXLARC-MKSNKDDYSA-N 449.373 4.786 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)[C@@H]2C2CC2)cc1I 2315547947 AYOBKWUKOLRENI-FZMZJTMJSA-N 440.550 4.692 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)C(C#N)=CN[C@H](CC)c1ccc2c(c1)CCCC2 2324428705 NEJGLLCPCMQIEI-HSZRJFAPSA-N 431.536 4.829 50 10 IJGE C[C@@H]1C[C@H](Cl)CCN(Cc2ccc(I)c(Br)c2)C1 2325223232 WQESIQPSZKYYPA-ZYHUDNBSSA-N 442.566 4.893 50 10 IJGE N#CC(=C(O)[C@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2ccc(F)c(F)c2)cs1 2331351905 LLVFXWQXWDQFFD-INIZCTEOSA-N 437.471 4.930 50 10 IJGE CC(C)[C@@H](Cl)C(C)(C)CNC(=O)c1cc(Cl)ccc1I 2365854395 DLPWWVONIBDIML-CYBMUJFWSA-N 428.141 4.964 50 10 IJGE CCCCCOc1ccccc1C(=O)NNC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 14035787 DVLQOEXPEKFJMZ-AWEZNQCLSA-N 439.339 4.791 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1nc(-c3ccccc3)cs1)[C@H](Br)C2=O 35548685 HGDNFEWLXFNKEA-XMCHAPAWSA-N 433.371 4.908 50 10 IJGE Cc1cc(Br)c(NC(=O)Cc2nc(CCl)cs2)c(Br)c1 37302782 MFOATJULWCDHPO-UHFFFAOYSA-N 438.572 4.897 50 10 IJGE CSc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccccc4)ccc32)cc1 38682137 VGKRULHHJVLVDT-XMMPIXPASA-N 444.512 4.611 50 10 IJGE CCCCc1ccc(Nc2ncnc(NNC(=O)c3ccccc3Cl)c2[N+](=O)[O-])cc1 40581286 GMBIKGHIBGQOAT-UHFFFAOYSA-N 440.891 4.881 50 10 IJGE COc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3ccc(C)c(C)c3)c(C)c21 40813156 XCIITNBDGXODHJ-VFCFBJKWSA-N 445.519 4.936 50 10 IJGE O=C(N/N=C/C=C\c1ccccc1)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1 96398896 WGKLJUJAFSGPNM-MIKDHBJQSA-N 439.924 4.570 50 10 IJGE CC1(C)CC(N/C=C(/C#N)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC(C)(C)N1 217249844 UGKAJKGXGGKYCP-QXMHVHEDSA-N 428.886 4.604 50 10 IJGE CC(C)(C)C(=O)[C@@H](Br)Cc1ccc(I)cc1Cl 232154667 DIJNLTVAUOUEMG-JTQLQIEISA-N 429.523 4.866 50 10 IJGE O=C(COc1cccc2ccccc12)NN=Cc1cc([N+](=O)[O-])ccc1N1CCCCCC1 254592121 IWAMUMMWXFKMKK-UHFFFAOYSA-N 446.507 4.658 50 10 IJGE CC(=NNC(=O)c1cc(-c2ccccc2)nc2c(Cl)cccc12)c1c(O)cc(C)oc1=O 254872363 WUGNNGNONFKNCT-UHFFFAOYSA-N 447.878 4.676 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CI)[C@H](c2ccc(Cl)cc2F)C1 382682288 CKLMSHNOHAGMEP-ZWNOBZJWSA-N 439.696 4.865 50 10 IJGE Cc1ccsc1[C@H]1CN(C(=O)OCc2ccccc2)C[C@H]1CI 394745637 ZZVIBZWGJIRFHP-CVEARBPZSA-N 441.334 4.844 50 10 IJGE Cn1ncc(Br)c1[C@@H](Br)c1ccc(F)c(Br)c1F 691561649 PEXIAAMWGGHYSE-QMMMGPOBSA-N 444.899 4.708 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cccn2[C@H](C)Cc2ccccc2)c1C 774307852 OHSIVIVCOJQILV-QGZVFWFLSA-N 426.524 4.518 50 10 IJGE COc1cc(NNC(=O)C2C[C@@H]3CCC[C@H](C2)C3NC(=O)OC(C)(C)C)ccc1Cl 803262219 XIKLIBUFMDSLGZ-WWMCIYDGSA-N 437.968 4.511 50 10 IJGE CC(C)(C)c1ccc(C=NNC(=O)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1 1084422515 XVDYFQXMXOQWLN-UHFFFAOYSA-N 425.838 4.745 50 10 IJGE CC(=O)CCc1ccc(O[C@@H](C)C(=O)N2CCC[C@H](O[Si](C)(C)C(C)(C)C)C2)cc1 1275314398 KRKBVWLBHPIFDW-UGKGYDQZSA-N 433.665 4.988 50 10 IJGE C=CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccc(Br)cc1CC 1295571265 CQEYBVPVCITRGB-QGZVFWFLSA-N 440.382 4.704 50 10 IJGE Cc1c(C(=O)N2CCCC[C@H]2C)oc2c1C(=NNC(=O)c1ccccc1Cl)CCC2 1772744201 SCZAAMASHUQROM-CQSZACIVSA-N 427.932 4.726 50 10 IJGE COc1ccc(OCCOc2cccnc2NC(=O)Nc2ccc(SC#N)cc2)cc1 1858853201 NSRQGIRJCVJUFP-UHFFFAOYSA-N 436.493 4.765 50 10 IJGE C[C@H](C(=O)N(C)C[C@H]1C[C@H](Br)C1)c1ccc(NC(=O)OC(C)(C)C)cc1 1887822818 GIQDESXJXHTLPZ-DZKIICNBSA-N 425.367 4.769 50 10 IJGE CC(C)[C@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1cccc(Br)c1 1915276806 UQCAJMMXLYURGM-SFHVURJKSA-N 430.795 4.903 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)C2(CBr)CCC2)cc1[N+](=O)[O-] 1915750279 UBZLWVAXYYYJID-UHFFFAOYSA-N 433.302 4.563 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC12CCC1(CCC[C@H](CI)O1)CC2 1937362662 ZINODGJPXGHBKU-JDPPGYRCSA-N 435.346 4.587 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1F 2008322130 PZTIHRMGFSGBRT-AWEZNQCLSA-N 434.758 4.844 50 10 IJGE C[C@H](Br)[C@H]1CCCN1Cc1ccc(Br)cc1Br 2018114577 GDYLARCLVJXEGU-TVQRCGJNSA-N 425.990 4.959 50 10 IJGE C[C@H](C[C@H](Br)c1cc(I)cc2c1OCC2)C(F)F 2036589973 CWPYRQSEFHZLDJ-HQJQHLMTSA-N 431.058 4.953 50 10 IJGE O=C(NCCCCCCI)c1c(Cl)cccc1Br 2050312406 GYDSRVOIZQBVBO-UHFFFAOYSA-N 444.538 4.828 50 10 IJGE C[C@@H]1C[C@H](C(F)(F)F)N(CCCCCBr)CCN1C(=O)OC(C)(C)C 2058048111 BDORDEALMATYHR-ZIAGYGMSSA-N 431.337 4.814 50 10 IJGE Brc1cccc(Br)c1CN1CC[C@H](Br)[C@H]1C1CC1 2067014903 FENHIIRXWTXIOA-UONOGXRCSA-N 438.001 4.959 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1cc(Br)ccc1Br 2081239492 SUFHBTFZCIJLGP-PRHODGIISA-N 441.989 4.751 50 10 IJGE CCC(CC)N(CC)S(=O)(=O)c1cc(CBr)sc1Br 2123200535 JDNACKJWGNQDJO-UHFFFAOYSA-N 433.231 4.605 50 10 IJGE CC(C)(C)OC(=O)N1CCN(Cc2ccc(CBr)cc2)C[C@H]1C(F)(F)F 2130170453 RGCYPZGNROUTPK-HNNXBMFYSA-N 437.300 4.565 50 10 IJGE CCCC1(NC(=O)c2ccc(CBr)cc2)CCN(C(=O)OC(C)(C)C)CC1 2162599508 FKLBVJLTUPGVRN-UHFFFAOYSA-N 439.394 4.881 50 10 IJGE Cc1cc(S(=O)(=O)N(C)[C@@H]2CCCCC[C@H]2Br)sc1Br 2172543412 KPQBFXAIXBBNNG-GHMZBOCLSA-N 445.242 4.536 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@@]2(CCl)CCC[C@]2(F)C1 2176634434 CMQUZBPWVDEINZ-STQMWFEESA-N 445.579 4.846 50 10 IJGE CC1(C)CCCN(C(=O)c2ccc(I)c(Cl)c2)[C@@H]1CCl 2185811440 IOAMIJKVARNCSJ-CYBMUJFWSA-N 426.125 4.814 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)C1CC2(C1)C(F)(F)C21CCC1 2195138240 PEKIYZUWDZMZJX-OHTSDLOESA-N 442.344 4.641 50 10 IJGE C[C@@H](C(=O)N(C)C[C@H]1C[C@@H](Br)C1)[C@H](NC(=O)OC(C)(C)C)c1ccccc1 2196913801 HLBLTTPJGGXVQV-LMSBXDPUSA-N 439.394 4.520 50 10 IJGE Cc1cc(Br)c([C@H](Cl)C2(S(C)(=O)=O)CC2)c(C)c1Br 2227350870 IYUYCSFFDQYJMY-LBPRGKRZSA-N 430.589 4.686 50 10 IJGE CC1(C)CCN(Cc2ccccc2)CCN1c1ccc([N+](=O)[O-])c(CBr)c1 2239859719 DIWUDXWOPXTVDV-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2[C@H](CBr)NC(=O)OC(C)(C)C 2241740019 VSTCTWNVWWBEOZ-LXINESAQSA-N 447.414 4.604 50 10 IJGE Fc1cccc([C@@H](CI)O[C@H]2CCN(Cc3ccccc3)C2)c1 2244768829 CVDBIPRHEZHKJQ-RBUKOAKNSA-N 425.285 4.593 50 10 IJGE COc1cc(OC)c([C@@H](Br)C2(Br)CC2)cc1Br 2252882513 GWSWASQTPFKFEK-LLVKDONJSA-N 428.946 4.830 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(CCCCCCBr)[C@H](C(F)(F)F)C1 2255000969 HZXOXVWUTVYDKI-KBPBESRZSA-N 431.337 4.862 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1C(=O)c1cc(Br)cc(Br)c1 2260379070 KVQBKLVHPJOXIY-NWDGAFQWSA-N 439.973 4.600 50 10 IJGE CC[C@]12CO[C@]([C@H](Br)c3ccc(OC)c(I)c3)(C1)C2 2269547523 CYDLMDFOVWXKKS-KFWWJZLASA-N 437.115 4.695 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2[C@H](C)O[C@H](C)[C@@H]2C)cc1I 2269554892 UQOGYWBLLHJWQD-WIWFPBMBSA-N 439.131 4.795 50 10 IJGE CCCN(Cc1ccc(I)c(Br)c1)C[C@@H](C)Cl 2306218931 GQJOORISLWAYGK-SNVBAGLBSA-N 430.555 4.893 50 10 IJGE COc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccs2)cc1 2314634529 FOUBXOKWNIINKE-HSZRJFAPSA-N 430.485 4.594 50 10 IJGE O=C(NN=Cc1ccccc1Cl)c1cccn(Cc2ccc(Cl)c(Cl)c2)c1=O 2323651808 HYSQVSSHKVQYNH-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE C[C@H](NC(=O)C(C#N)=CNCc1cccc(Br)c1)C12CC3CC(CC(C3)C1)C2 2324904656 XESQDPCCCJMCET-KZZKVKKMSA-N 442.401 4.667 50 10 IJGE C[C@@H]1CCCN(Cc2cc(I)ccc2Cl)[C@@H]1CBr 2327402895 JKQXYBWFZBMSDH-QMTHXVAHSA-N 442.566 4.940 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@@H]1CCC[C@]2(C1)CC2(F)F 2343415232 ZVABWCUJHVWNDV-AOIWGVFYSA-N 430.333 4.689 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@H]3CCC[C@]32CNC(=O)OC(C)(C)C)C1 2345008338 NOXAHXXFVPKXOA-KKSFZXQISA-N 429.443 4.957 50 10 IJGE FC1(F)C[C@]12C[C@H]2CO[C@H](CI)c1cccc(Br)c1 2352458050 AMORPLRLLIOZDW-UHTWSYAYSA-N 443.069 4.987 50 10 IJGE O=C(CBr)Nc1ccc(Cl)cc1C(=O)c1ccc(Br)cc1 28166877 WTPPPZKEVVVXLX-UHFFFAOYSA-N 431.511 4.667 50 10 IJGE CCCOc1ccc(/C=N/NC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cc1OCC 57599512 BHJVRWNKTUQYCL-NUGSKGIGSA-N 445.734 4.575 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc(C(=O)O)cc2)o1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 103485467 NUDOJONHRJASAX-ZROIWOOFSA-N 437.795 4.752 50 10 IJGE Cc1cc(I)ccc1NC(=O)/C(C#N)=C\Nc1c(C)cccc1C 217254281 AGVFHEAVTVQTFM-PTNGSMBKSA-N 431.277 4.675 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CCCC[C@H]1CBr 232474737 MABYBKRPEPBKFR-JTQLQIEISA-N 439.973 4.601 50 10 IJGE CN(CCCCCBr)C(=O)c1ccc(Br)cc1Br 234281760 NHZAVSAJCFHROX-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2)ccc1OCCCOc1cc(C)ccc1C 254300866 SMDIEFJOGIOTGA-UHFFFAOYSA-N 432.520 4.924 50 10 IJGE CCOc1cc(C=NNC(=O)COc2cc(C)cc(C)c2)ccc1OCc1ccccc1 254378152 DKWPFSXPIUIZHO-UHFFFAOYSA-N 432.520 4.810 50 10 IJGE Cc1ccc(C(C)C)c(OCC(=O)NN=Cc2ccc(OC(=O)c3cccs3)cc2)c1 254712346 FWXMZVIIAMAMER-UHFFFAOYSA-N 436.533 4.928 50 10 IJGE CCCc1ccc(OCC(=O)NN=Cc2ccc(OC(=O)/C=C\c3ccccc3)cc2)cc1 263622529 PEZCYCWBWSKAEQ-HHTLAINHSA-N 442.515 4.787 50 10 IJGE CC[C@H](NC(=O)c1ccc(Br)cc1Br)[C@H](Br)CC 313101130 ZEBBUBVZIBZSAJ-PWSUYJOCSA-N 441.989 4.894 50 10 IJGE COCc1nc(COc2c(F)cc(Br)cc2CBr)cs1 715764258 UCGKBZSNUXAGBR-UHFFFAOYSA-N 425.117 4.665 50 10 IJGE CCOc1ccc(C(C)(C)C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1OCC 799747983 MAYCUIWPPPCECS-UHFFFAOYSA-N 435.446 4.795 50 10 IJGE Cc1ccc(-c2ccc(C=NNC(=O)CC[C@@H](O)c3ccccc3)o2)c(Br)c1 1084216205 MZUNPSFAMXXKQA-HXUWFJFHSA-N 441.325 4.981 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865684373 XQYGHRYRWJYDIV-QFIPXVFZSA-N 447.970 4.821 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865712749 GSGLJKRZSNFGCP-HXUWFJFHSA-N 449.898 4.664 50 10 IJGE CC(C)CSc1ccc(C(=O)NNC(=O)CCc2ccccc2Br)cc1 1865758362 WRKIOEIOPZRRCD-UHFFFAOYSA-N 435.387 4.591 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)NNC(=O)CCCSc1ccccc1 1865759655 LFUIIIVDKXGIMP-UHFFFAOYSA-N 441.503 4.669 50 10 IJGE C[C@@H]1C[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)C1 1880756376 SYHMFMOZVXLZJT-QLFBSQMISA-N 435.403 4.558 50 10 IJGE C[C@@H]1C[C@H](CBr)CCN1c1ncc(Br)cc1Br 1907067161 WFTHFWUFBVJOGT-RKDXNWHRSA-N 426.978 4.606 50 10 IJGE COc1cc(C(=O)N(Cc2ccccc2)C2(CBr)CCC2)ccc1[N+](=O)[O-] 1915749071 DENIXLVRCWVHNR-UHFFFAOYSA-N 433.302 4.563 50 10 IJGE BrCCCN(Cc1cccc(Br)c1Br)C1CC1 1943884511 QYHBGLYCTPJGIS-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE C[C@@H]1CN(c2ncc(Br)cc2Br)[C@H](C)C[C@H]1Br 1944576314 PTSZRRRDHGQCMU-NQMVMOMDSA-N 426.978 4.605 50 10 IJGE CC(C)N1C[C@H](c2c(Br)cccc2Br)[C@@H](Br)C1 1950852596 ZVENDVCXTRCZRS-CABZTGNLSA-N 425.990 4.783 50 10 IJGE O=C(NCCNC(=O)[C@H](Cl)c1ccccc1)OCC1c2ccccc2-c2ccccc21 1956262756 YAUUBCCAYFNNNR-HSZRJFAPSA-N 434.923 4.621 50 10 IJGE Clc1ccc(I)c(C[C@@H]2CCOCC[C@@H]2Br)c1 2001019242 YDWJYFLZEMWIRU-CABZTGNLSA-N 429.523 4.677 50 10 IJGE CC[C@@H](C)[C@@H](Br)CNC(=O)c1cc(Br)cc(Br)c1 2029977042 ILGDGQZSEBOVDJ-PELKAZGASA-N 441.989 4.751 50 10 IJGE C[C@](CBr)(NC(=O)c1cccc(Br)c1Br)C1CC1 2031482784 WULKPCRZETXCMO-CYBMUJFWSA-N 439.973 4.505 50 10 IJGE Cc1nn(CC2(CBr)CCCCCC2)c(C)c1I 2032918402 OFLCSQGSGVCQSQ-UHFFFAOYSA-N 425.152 4.840 50 10 IJGE CC(C)[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]1C(F)(F)F 2052478964 MHVPIROERSSLMB-MCIONIFRSA-N 431.337 4.526 50 10 IJGE FC(F)c1c(Br)cc(CBr)cc1I 2054780637 DJYGOEWNEKKBFL-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE CN(C(=O)c1cc(Br)c(Br)s1)[C@@H](CCCl)C(F)F 2058230901 CWPYOPOCNMSIOE-LURJTMIESA-N 425.520 4.608 50 10 IJGE CC(C)[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(CBr)cc1F 2059265135 PYBUMDPQNAJFLT-HNNXBMFYSA-N 428.367 4.956 50 10 IJGE CCC[C@@H](CBr)CN=[S@](=O)(CCNC(=O)OC(C)(C)C)c1ccccc1 2107397842 WXEDOQCPLLCNGB-QMTYFTJSSA-N 447.439 4.849 50 10 IJGE CCCOC1([C@H](Br)c2cc(I)cc3c2OCC3)CC1 2110255731 NVVJKBRLIHRVJK-CQSZACIVSA-N 437.115 4.621 50 10 IJGE CC(C)(C)OC(=O)Nc1cc(F)cc(CNC(=O)[C@H](Br)C2CCCC2)c1 2110727036 HIGOELDLAMKUNI-MRXNPFEDSA-N 429.330 4.743 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@@H]1CCN(C[C@@H](CBr)c2ccccc2)C1 2139885928 WLVWRXYXAKDJJV-QZTJIDSGSA-N 425.411 4.790 50 10 IJGE CC[C@@H]1CCN(C(=O)c2ccc(CBr)cc2)[C@H](CNC(=O)OC(C)(C)C)C1 2162912401 VFNZBGCFAIYJQU-QAPCUYQASA-N 439.394 4.737 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1[C@H]2CCC[C@@H]1CN(Cc1ccccc1)C2 2226318378 BWOJZFVCWFVWBJ-IYBDPMFKSA-N 436.375 4.795 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1C(=O)c1csc(Br)c1Br 2251003580 PSLRLSGXKIZOCA-YUMQZZPRSA-N 446.002 4.661 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCS[C@H](CCBr)C1 2282974141 FPEIUJPVRAMUNL-MRVPVSSYSA-N 445.579 4.584 50 10 IJGE COC(=O)c1cc(C(C)C)sc1NC(=O)C(C#N)=Cc1c[nH]nc1-c1ccc(F)cc1 2295650065 QHWHGCJVWISHHN-UHFFFAOYSA-N 438.484 4.733 50 10 IJGE CC(C)[C@@H](CBr)N(C)C(=O)c1cccc(Br)c1Br 2318855565 SQTSCLPDGIIGCP-LLVKDONJSA-N 441.989 4.703 50 10 IJGE CC(C)N(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2326915121 OHOSGQNKJDIBFH-WMLDXEAASA-N 425.358 4.517 50 10 IJGE N#CC(=C(O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2ccc(F)cc2F)cs1 2331286646 TYTLZLLMVSAGBG-OAHLLOKOSA-N 437.471 4.930 50 10 IJGE N#CC(=C(O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1nc(-c2ccc(F)c(F)c2)cs1 2331352405 RPQPDXPZJFDXFS-UHFFFAOYSA-N 430.348 4.855 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)CN(C)Cc1nn(C)c(Cl)c1Br 2365904267 HZYBGRSIAUUSCC-GFCCVEGCSA-N 429.628 4.714 50 10 IJGE COCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C[C@@](C)(CBr)C(C)(C)C 2380165131 QGWXHCFTNWTEFS-DYESRHJHSA-N 449.474 4.782 50 10 IJGE CCCCOc1ccc(/C=C(/C#N)c2nc3ncc(Br)cc3[nH]2)cc1OC 5918748 JCFPECLZUUNMOF-ZSOIEALJSA-N 427.302 4.972 50 10 IJGE N#C/C(=C/c1ccc(OC(=O)c2ccco2)cc1)C(=O)Nc1ccccc1Br 7003542 KYCGSAYTNZIAMV-QINSGFPZSA-N 437.249 4.807 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)Cc3ccc(Cl)cc3)ccc2[C@@H]1c1ccccc1F 38652324 BBUJPYIHEMQRTI-QHCPKHFHSA-N 434.854 4.845 50 10 IJGE COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(SC)cc2)cc1 38682054 RZMXHJNGYMAXGQ-HSZRJFAPSA-N 444.512 4.854 50 10 IJGE COc1cc(/C=N\NC(=O)CC[C@H](O)c2ccccc2)ccc1OCc1ccc(C)cc1 58889682 UEZYKXUSOLAUGK-WCFTWNFSSA-N 432.520 4.547 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2ccc(-c3cccc(Cl)c3)o2)cc1 58893134 RMMVZZKBCOWBPG-BABSMXRMSA-N 426.900 4.963 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)CCCOc2ccc(C)cc2)c(OCC)c1 98027892 NMXGWQXEWHQBST-HKWRFOASSA-N 437.492 4.628 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\N[C@@H](CC)c1ccc2c(c1)CCCC2 217154849 NEJGLLCPCMQIEI-RVQWUSFHSA-N 431.536 4.829 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)/C(C#N)=C\Nc1ccccc1Br 217186712 GXTWFRDIGVGUEU-WSTOHFRZSA-N 428.330 4.853 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@@H]1Cl)c1cc(Br)sc1Br 379725106 KRGDFAIUKUNJMY-JQWIXIFHSA-N 435.568 4.908 50 10 IJGE Oc1cc([C@@H]2CN(Cc3ccccc3)C[C@H]2CBr)ccc1Br 382676585 TZYRQJAGRHEFIY-CVEARBPZSA-N 425.164 4.765 50 10 IJGE Cc1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CCl)cc1I 382702427 PKJFIBOOAWTCCL-ZIAGYGMSSA-N 435.733 4.789 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1Cc1cc(Cl)ccc1I 405305840 QFKHXFSZJIXGPU-MWLCHTKSSA-N 428.539 4.692 50 10 IJGE FC(F)c1cc(I)cc(CBr)c1Br 575688047 ZAEAMQDOONFDIM-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE FC(F)Oc1ccc(CBr)c(I)c1C(F)(F)F 575723193 LHMKGBCQMZQYRW-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE C[C@]1(CBr)CCN(C(=O)c2scc(Br)c2Br)C1 705493649 VJTRMNGNQLJMHO-LLVKDONJSA-N 446.002 4.520 50 10 IJGE Clc1cccc(C(CBr)(CBr)CCO[C@H]2CCOC2)c1 724985513 NEEZRKNEMKWIPZ-AWEZNQCLSA-N 426.576 4.563 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2nnc(C(C)(C)C)s2)c(C)n1-c1ccc(F)cc1 758626654 BDPGBFFZOFWVMO-GZTJUZNOSA-N 437.544 4.606 50 10 IJGE Cc1ccc2nc(CNC(=O)C(=O)Nc3ccc(S(F)(F)(F)(F)F)cc3)[nH]c2c1 773350967 GYLVEFSPJJLEGB-UHFFFAOYSA-N 434.390 4.784 50 10 IJGE CCc1ccc(-c2nc(C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)cs2)cc1 1339306946 GQTLAGLJVRHWIN-UHFFFAOYSA-N 430.537 4.598 50 10 IJGE C#CC[C@H]1CCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1438021307 UZZJTGFTVCQNFX-YNGKYYQNSA-N 436.353 4.635 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2c(C)cccc2Br)cc1)[C@@H]1C[C@@H]1C 1662058834 MSDSSUIYSHZUGD-SCLBCKFNSA-N 431.334 4.667 50 10 IJGE Cc1c(C(=O)N2CCC(C)CC2)oc2c1C(=NNC(=O)c1ccc(Cl)cc1)CCC2 1772744077 RQOWKIXDWRGNOG-UHFFFAOYSA-N 427.932 4.584 50 10 IJGE CCc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2O)CCC3)cc1 1772751375 AAVGOKYGCMFHIW-UHFFFAOYSA-N 431.492 4.579 50 10 IJGE Cc1ccsc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2-c1ccc(Br)cc1 1865699170 MVFJGSWOEAIMLF-INIZCTEOSA-N 427.327 4.531 50 10 IJGE CCCCCOc1ccc(/C=N/NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)cc1OC 1873794561 OOVWLPSCLGNVBB-CNQUNWPHSA-N 449.592 4.654 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C2CCN(C[C@@H](CBr)CC3CC3)CC2)C1 1879198036 HVXIRLVUDPOZQW-IEBWSBKVSA-N 429.443 4.767 50 10 IJGE C[C@H](c1ccncc1Br)[C@@H](Br)c1nn(C)cc1Br 1924058241 VJCJQSZQIIOGAG-RDDDGLTNSA-N 437.961 4.580 50 10 IJGE CC(C)(C)OC(=O)NC1(C2CCN(C[C@H](CBr)C3CCC3)CC2)CCC1 1966520743 WUHBJHURXOCSPD-KRWDZBQOSA-N 429.443 4.957 50 10 IJGE Brc1ccc(CN2C[C@H]3[C@H](Br)CC[C@H]3C2)c(Br)c1 2031402842 LVAIOBHNIRAOHB-ZWKOPEQDSA-N 438.001 4.817 50 10 IJGE C[C@H](Br)CN(C(=O)c1cccc(Br)c1Br)C1CC1 2031478209 PWKXPHXZVMUVQG-QMMMGPOBSA-N 439.973 4.600 50 10 IJGE CC(C)[C@H](Br)[C@@H](C)NC(=O)c1c(Br)cccc1Br 2041305134 VXDKTOJJHCAOCM-PELKAZGASA-N 441.989 4.749 50 10 IJGE CC(C)(C)OC(=O)N(CC(F)F)[C@H]1CCCN(CC2(CBr)CCC2)C1 2044698690 DRDRZXARTQMIDT-AWEZNQCLSA-N 425.358 4.518 50 10 IJGE COc1ccc(S(=O)(=O)N(Cc2ccccc2)C(C)(C)C)cc1CBr 2059311745 AVEOADTWNMTYTA-UHFFFAOYSA-N 426.376 4.580 50 10 IJGE O=C(CBr)c1cc(I)cc(C(F)F)c1C(F)(F)F 2060393431 DSECYBQVEDWSQQ-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CCCN(C[C@H](CBr)C3CCC3)C2)C1 2106784709 KPPHQYQFAOHADQ-RXVVDRJESA-N 429.443 4.911 50 10 IJGE Cn1ncc(Cl)c1COc1c(Br)cc(CCl)cc1Br 2111948279 MVJHUCHFKWBRQG-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE CCCOc1ccc(S(=O)(=O)N(Cc2ccccc2)C2CC2)cc1CBr 2123254469 MGKOGKXAEGCGIA-UHFFFAOYSA-N 438.387 4.724 50 10 IJGE O=S1(=O)CCC[C@H]([C@H](Br)c2csc3c(Br)cccc23)C1 2146094565 HVBPVBAJIHMVSY-ZANVPECISA-N 438.206 4.925 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(CC2(CBr)CCCCC2)C1 2163061863 IMOUUZJZAOEFKI-OKYOBFRVSA-N 441.454 4.909 50 10 IJGE Cc1c(Br)sc([C@H](Cl)c2cnn(C)c2I)c1C 2213633736 XAXZAFVALUHKNA-MRVPVSSYSA-N 445.551 4.794 50 10 IJGE Cc1cc(Br)c([C@H](Br)C(C)(C)S(C)(=O)=O)c(C)c1Cl 2224317299 MEVUWRXRULFIKY-LBPRGKRZSA-N 432.605 4.979 50 10 IJGE COCC12CC([C@@H](Cl)c3cc(Br)c(Br)cc3F)(CO1)C2 2233969681 LQLVFHYRRJVOIF-HSBZDZAISA-N 428.523 4.826 50 10 IJGE CCCN(CCCBr)C(=O)c1ccc(Cl)c(I)c1 2256400372 VCHBFXBGGKSANK-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE CC[C@@H]1CC[C@H]([C@@H](Br)c2ccc(OC)c(I)c2)O1 2257356111 RLWUWJSKOKDKEF-HONMWMINSA-N 425.104 4.693 50 10 IJGE CC(C)(C)C1(O[C@H](CI)c2ccccc2Br)COC1 2272928519 BCAZZOMQCJVRKN-CYBMUJFWSA-N 439.131 4.757 50 10 IJGE O=C(NC[C@H]1CCC[C@@H]1CBr)c1cc(F)c(Br)cc1Cl 2282969518 DCSFZMSJSHZIIH-RKDXNWHRSA-N 427.539 4.783 50 10 IJGE CN(CC(C)(C)CI)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 2306817298 YIINVYAIIULHRB-MRXNPFEDSA-N 446.373 4.645 50 10 IJGE CC1(C)CN(Cc2cc(I)ccc2Cl)C[C@@H]1Br 2307329026 VBFDWGGJIMFXFF-LBPRGKRZSA-N 428.539 4.550 50 10 IJGE N#CC(=Cc1cn(Cc2ccccc2F)c2ccc(Br)cc12)C(=O)NC1CC1 2313624327 PPFNBTLJSPPUNG-UHFFFAOYSA-N 438.300 4.777 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc(OC)c(OC(C)C)c2)sc(C)c1C 2314572341 YVDKUFDWBSWMPV-UHFFFAOYSA-N 442.537 4.883 50 10 IJGE CCOCCCN1C(=O)C(=Cc2ccc(OCc3ccc(C)cc3)cc2)C(C)=C(C#N)C1=O 2314618868 VULVRQFSADAVLE-UHFFFAOYSA-N 444.531 4.593 50 10 IJGE CCCOc1ccc(C=CC(=O)Oc2ccc(C=C(C#N)C(=O)NC(C)C)cc2OC)cc1 2314739905 BKUWYIYDTFPHJX-UHFFFAOYSA-N 448.519 4.534 50 10 IJGE CCC[C@@](C)(CBr)NC(=O)c1ccc(Cl)cc1I 2317772710 GMVNNVZSCCMWRE-ZDUSSCGKSA-N 444.538 4.628 50 10 IJGE CCN(CC)C[C@H](Br)CCc1cc(I)ccc1Cl 2327408091 ZBUQLFGHSIDRKU-GFCCVEGCSA-N 444.582 4.983 50 10 IJGE Cc1cc(=O)oc2cc(OCC(=O)NN=Cc3ccc(-c4ccccc4Cl)o3)ccc12 2328791988 NUZGJWYOKLNXNL-UHFFFAOYSA-N 436.851 4.544 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Cl)c1cc(Cl)cc2c1OCC2 2364228188 JTZFNQOTPHDABE-SNVBAGLBSA-N 440.950 4.862 50 10 IJGE Cc1cc(Oc2ncnc(NNC(=O)c3ccccc3Cl)c2[N+](=O)[O-])cc(C)c1Cl 40658299 IBUIYJZIRQAGJT-UHFFFAOYSA-N 448.266 4.858 50 10 IJGE CCOC(=O)c1c(NC(=O)N/N=C/c2c(F)cccc2Cl)sc2c1CC[C@@H](C)C2 40851480 CRHOUMWPZOOICV-QQUGTJAQSA-N 437.924 4.998 50 10 IJGE COC(=O)c1ccc(C(=O)OC)c(N/C=C(/C#N)c2nc(-c3ccc(C)cc3C)cs2)c1 102416974 XFEYJABSIYESPR-ATVHPVEESA-N 447.516 4.977 50 10 IJGE N#C/C(=C/NCc1ccc2c(c1)OCO2)C(=O)Nc1ccccc1Sc1ccccc1 217243408 SBWPDIFPDWKYLI-SDXDJHTJSA-N 429.501 4.702 50 10 IJGE Cc1cc(C)c2c(-n3cccc3)c(C(=O)NN=Cc3c[nH]nc3-c3ccsc3)sc2n1 254840584 FCTXTZDAOHXALG-UHFFFAOYSA-N 446.561 4.919 50 10 IJGE CN(C(=O)c1cc(Br)sc1Br)[C@@H]1CCC[C@@H]1Br 709101708 GDOIVCXYYAHHMH-JGVFFNPUSA-N 446.002 4.661 50 10 IJGE Cc1ccc(NNC(=O)N[C@H](C)c2nc(-c3ccc(Br)cc3)cs2)nc1 763718516 XDMNBAIFVHBPGB-GFCCVEGCSA-N 432.347 4.663 50 10 IJGE Cc1cc(SC(C)(C)C)ccc1NC(=O)C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 763794812 DUZWNSBYDAAOSZ-UHFFFAOYSA-N 441.597 4.583 50 10 IJGE Cc1cc(Br)c(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)cc1Cl 806888198 KMNPUSFRZMNQGZ-UHFFFAOYSA-N 446.736 4.637 50 10 IJGE C#CCn1ccc(CN(CC)C(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Cl)cc3)c2C)n1 1128671602 CPOBGNFZXAJJDJ-RCCKNPSSSA-N 445.954 4.533 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)[C@@H]2CCCC[C@@H]2c2nc3ccccc3s2)c1 1303280410 HUSZWXQXJOEASO-MSOLQXFVSA-N 434.590 4.569 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)[C@@H](c1c(F)cccc1Cl)N1CCCCC1 1633440189 VITYNFXTACXAII-GOSISDBHSA-N 445.951 4.755 50 10 IJGE CCc1cc(Br)ccc1OCC(=O)NN=Cc1c(Cl)cccc1Cl 1772755935 VCESTQLMYQJBGQ-UHFFFAOYSA-N 430.129 4.847 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2)[C@H]1c1cc(Cl)ccc1O 1865688852 CLAPHAVPBQWPTN-INIZCTEOSA-N 446.816 4.527 50 10 IJGE COc1ccc(C(CCNC(=O)/C(C#N)=C/c2ccccc2)c2ccc(OC)cc2)cc1 1868026037 HBQJKJWWSMTBKF-PTGBLXJZSA-N 426.516 4.949 50 10 IJGE Brc1cccnc1C[C@H](Br)c1cnsc1Br 1900466138 BNCNOEILNWLWSN-QMMMGPOBSA-N 426.959 4.742 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccccc1Br 1902796468 MRUUZGKHYMKVDH-HNNXBMFYSA-N 441.163 4.549 50 10 IJGE O=C(N[C@@H](CBr)C1CCC1)c1csc(Br)c1Br 1945183596 JFMVJUMGLLBNBL-QMMMGPOBSA-N 446.002 4.567 50 10 IJGE CCOc1ccccc1-n1nc(CCl)c(I)c1C(F)(F)F 2079212703 ZCNKITGMGKJJES-UHFFFAOYSA-N 430.595 4.633 50 10 IJGE CC(C)[C@H](CBr)CN1CC[C@](NC(=O)OC(C)(C)C)(c2ccccc2)C1 2106780831 BWIQFJRDDBQJIM-DYESRHJHSA-N 425.411 4.779 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@H](C)[C@H](NC(=O)C(F)(F)F)[C@H]1C 2106781015 DPEVQDHCVKLEQT-ZNMIVQPWSA-N 429.365 4.745 50 10 IJGE Cc1cc(N2C[C@@]34CCC[C@]3(CN(Cc3ccccc3)C4)C2)ncc1CBr 2153341612 RYGWAILGKBVLQV-GOTSBHOMSA-N 426.402 4.777 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2[C@]12C[C@@H]1CN(Cc1ccccc1)C2 2224708269 HNVQFSXSHRBAHW-VLIAUNLRSA-N 434.740 4.908 50 10 IJGE COc1ccc([C@H](Br)c2ccsc2OC)cc1I 2257355124 HFGSUNAWNGMFAS-LBPRGKRZSA-N 439.112 4.854 50 10 IJGE CC(C)(C)CCN(CCBr)C(=O)c1ccc(I)cc1 2274140243 ODTJSWSOAZWATK-UHFFFAOYSA-N 438.147 4.565 50 10 IJGE Cc1cc(S(=O)(=O)N(C[C@@H](C)Br)CC(C)(C)C)sc1Br 2288028431 UIBUDBGVCRZGCA-SNVBAGLBSA-N 447.258 4.639 50 10 IJGE C[C@@H](Br)COCc1cn(-c2c(Cl)cc(Br)cc2Cl)nn1 2295834287 ZVAPUVCMRGTIDI-SSDOTTSWSA-N 443.954 4.637 50 10 IJGE CN(Cc1ccc(Cl)cc1I)C[C@H]1C[C@H](Br)C1 2302306828 IITQFRHCYCSZFK-HOMQSWHASA-N 428.539 4.550 50 10 IJGE Cc1cccc(Oc2nc3ccccn3c(=O)c2C=C(C#N)c2nc3ccccc3n2C)c1 2314436860 QSPHPMUTZKXADV-UHFFFAOYSA-N 433.471 4.746 50 10 IJGE COc1cc(C=CC#N)ccc1OC(=O)C=Cc1cc(Br)c(OC)c(OC)c1 2314795785 PUWSLFXCJWYHIT-UHFFFAOYSA-N 444.281 4.630 50 10 IJGE Cc1ccc2nc(-c3ccc(NC=C(C#N)C(=O)NCc4cccnc4)cc3)sc2c1 2324745336 UAXZZZJQDXJBIQ-UHFFFAOYSA-N 425.517 4.803 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@H]3CCCN(C(=O)OC(C)(C)C)[C@H]3C2)C1 2345005084 TZGDZUDFVANYRG-IRXDYDNUSA-N 429.443 4.909 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc(F)c(C(F)(F)F)c1 2369430435 CVTQONVFGBTLPH-OAHLLOKOSA-N 448.254 4.945 50 10 IJGE Cc1cc(C(=O)N[C@@H](CCBr)COCc2ccccc2)c2ccccc2n1 2369431401 QLLVZKLOIKXXNU-SFHVURJKSA-N 427.342 4.643 50 10 IJGE FC(F)(F)c1ccc(CBr)c(N2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)n1 2369843362 UWPQPEWZBNQTGW-IRXDYDNUSA-N 440.307 4.564 50 10 IJGE CC(=O)c1cccc(N2Cc3ccccc3/C2=N/C(=O)/C(C#N)=C/c2ccc3c(c2)OCO3)c1 12658229 BNBOOSJKKXCBFD-PRMXKNKOSA-N 449.466 4.518 50 10 IJGE C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)COc1ccccc1-c1ccccc1 14665637 CTXMXOUREYMKMJ-LJQANCHMSA-N 446.547 4.645 50 10 IJGE COc1ccc(/C=N/NC(=O)Cc2ccc(F)cc2)cc1COc1ccccc1Cl 27500451 OGWQOKRFISTNTH-VULFUBBASA-N 426.875 4.760 50 10 IJGE CCCN1CC2=C(OC(N)=C(C#N)[C@H]2c2ccc(OC)cc2)/C(=C\c2ccc(OC)cc2)C1 33934638 FVBNCSSBLXIBEE-POWJVNAZSA-N 443.547 4.575 50 10 IJGE CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3cccc(OC)c3)ccc21 38650438 XCDKKPKYPZGQAO-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE COc1cccc(/C(C)=N\NC(=O)CCCSc2nc3ccc([N+](=O)[O-])cc3s2)c1 58991943 URQZFFBXSKRDKM-XKZIYDEJSA-N 444.538 4.626 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Br)c3c(F)cccc3Cl)cc2[nH]1 109884320 WRGMTMLKRITTRA-ZDUSSCGKSA-N 434.490 4.896 50 10 IJGE COc1ccc(C[C@H](Br)c2ccccc2I)cc1OC 110295304 YGDOQHHPGTWDRV-ZDUSSCGKSA-N 447.110 4.987 50 10 IJGE CCN1C(=O)C(C#N)=C(C)/C(=C/c2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)C1=O 214211081 AZWQKOLPNXPNOI-BKUYFWCQSA-N 448.482 4.898 50 10 IJGE COc1cccc(C=NNC(=O)c2ccccc2-n2cccc2)c1OCc1ccccc1 252623149 OLBBRCOKKMOFTQ-UHFFFAOYSA-N 425.488 4.829 50 10 IJGE C[C@H]1C[C@H](O[C@@H](CI)c2ccccc2Br)C[C@@H](C)O1 253137111 TWLLMFGTHBPAND-OXIQGZBJSA-N 439.131 4.898 50 10 IJGE COc1ccc([C@@H](Br)c2sccc2I)c(OC)c1 310834034 KWAGELHKTHVERW-GFCCVEGCSA-N 439.112 4.854 50 10 IJGE CC[C@H](NC(=O)c1cc(Br)cc(Br)c1)[C@@H](C)Br 395378106 RPQWUGKCGRNPQM-HQJQHLMTSA-N 427.962 4.503 50 10 IJGE CC[C@H](C[C@@H](C)Br)NC(=O)c1cc(Br)sc1Br 716854916 KSRUUOYQWVVOLG-RNFRBKRXSA-N 448.018 4.955 50 10 IJGE C[C@@H](Oc1ccccc1NC(=O)NNC(=O)c1cccc2cccnc12)c1ccccc1 756585958 OEJKYCWLYWVDQN-QGZVFWFLSA-N 426.476 4.841 50 10 IJGE C[C@H](OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)c1ccc(F)cc1F 920155668 BPEADYPLAWORAJ-JIHKLPAASA-N 432.430 4.953 50 10 IJGE O=C(COc1ccccc1)NN=Cc1ccccc1OCc1cccc(Br)c1 1083895589 KFAACMYEPPCVJI-UHFFFAOYSA-N 439.309 4.557 50 10 IJGE CCOc1ccc(Br)cc1C=NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1 1084160064 VUTNBURGIXNQAK-OAHLLOKOSA-N 441.325 4.919 50 10 IJGE Cc1ccc(-n2nc(C)c(C=NNC(=O)COc3ccc(Cl)cc3Cl)c2C)cc1 1084354907 IAMLRKYDJSCQDG-UHFFFAOYSA-N 431.323 4.633 50 10 IJGE Cc1nc(NCC(=O)NNc2cc(F)ccc2F)c2cc(-c3ccccc3)sc2n1 1158126838 AUBJJHOCIDLWOD-UHFFFAOYSA-N 425.464 4.500 50 10 IJGE Cc1ccc(Oc2ccccc2CC(=O)NNc2nc(-c3cccnc3)nc(C)c2C)cc1 1306608518 NFRILDVMOUBUOL-UHFFFAOYSA-N 439.519 4.942 50 10 IJGE C#CC[C@]1(C(=O)NNc2ccccc2Cc2ccccc2)CCCN1C(=O)OC(C)(C)C 1639907601 IQLPONCBNJPOIF-AREMUKBSSA-N 433.552 4.514 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)Cn1ccc2ccccc21)c1ccc(C(F)(F)F)cc1 1679304818 KCHNCBLVZFMDOK-IBGZPJMESA-N 444.457 4.698 50 10 IJGE CCCCOc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)OCC)CCC3)cc1 1772750883 BFADQZNROIDNLM-UHFFFAOYSA-N 427.501 4.806 50 10 IJGE COc1ccc2ccccc2c1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1cccc(F)c1 1865688345 PVQMGQPOKHMELI-XMMPIXPASA-N 440.478 4.759 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865712959 MVMPPHFYFBTQNR-QFIPXVFZSA-N 437.459 4.714 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1C[C@H]2CN(C(=O)OC(C)(C)C)C[C@]2(C)C1 1882084950 PMEYSZZCTATQBV-ODCFSMADSA-N 447.414 4.558 50 10 IJGE O=S1(=O)CC[C@H]([C@@H](Cl)c2c(Br)sc(Br)c2Cl)C1 1923037429 DCMDCFXWVHKFHK-UJURSFKZSA-N 443.009 4.641 50 10 IJGE FC(F)C[C@H](CBr)NCc1ccc(Br)cc1Br 1943852555 VEOCFHQYPPNNFP-SECBINFHSA-N 435.932 4.720 50 10 IJGE ClCCCc1nnc(-c2ccc(Br)cc2I)s1 2026220690 GOYXSWBFHCRZCM-UHFFFAOYSA-N 443.535 4.744 50 10 IJGE CC1([C@H](CBr)NCc2ccc(I)c(Cl)c2)CC1 2026567248 QIIHGJJPXWTQIM-LBPRGKRZSA-N 428.539 4.598 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cc(F)c(F)cc1Cl 2049598833 ZKOLEZOFCMWNFB-ZDUSSCGKSA-N 432.692 4.671 50 10 IJGE O=C(CBr)c1cc(OC(F)(F)F)c(C(F)(F)F)cc1Br 2054797455 WDVIUJUAHDPRIF-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE C[C@@H](CC1CCN(C[C@@H](Br)C(F)(F)F)CC1)N(C)C(=O)OC(C)(C)C 2083282378 LYZHBSBWNMBBRT-GXTWGEPZSA-N 431.337 4.670 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@@H]2C[C@H](Cl)CC[C@@H]21 2093947452 WTQBECOTSTZUCA-MRTMQBJTSA-N 427.589 4.895 50 10 IJGE CC(C)(C)OC(=O)NCCC1CCN(C[C@@H](CBr)c2ccccc2)CC1 2106786297 UHAMHYLWVDQLND-LJQANCHMSA-N 425.411 4.792 50 10 IJGE Br[C@H](Cc1ccc2c(c1)CCO2)c1ccccc1I 2112338289 KGWZQLIKBADUEX-CQSZACIVSA-N 429.095 4.905 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)C2CCC2)C[C@H]1CC(F)(F)F 2119514984 MXRNDGGGSFXHMR-LSDHHAIUSA-N 443.348 4.671 50 10 IJGE ClCc1ccc(Br)cc1N1CC[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2129053713 NTMFDZZHTMJVOM-NHCUHLMSSA-N 435.793 4.668 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCCC2)[C@@H](C(F)(F)F)C1 2130132565 KPODKWLOABDODC-CQSZACIVSA-N 443.348 4.815 50 10 IJGE Cn1nc([C@H](Br)c2cc(Br)c3c(c2)CCO3)c(Cl)c1Cl 2150723017 MAFMPZDRPYIHDZ-SECBINFHSA-N 440.950 4.909 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@](CNC(=O)C(F)(F)F)(C2CC2)C1 2163061245 FODZHIBQPHSZRL-GOSISDBHSA-N 441.376 4.749 50 10 IJGE FC(F)(CBr)[C@H]1CCN(c2ncc(Br)c3ccsc23)C1 2197760710 DDPOOZXUGXMCGN-QMMMGPOBSA-N 426.124 4.915 50 10 IJGE FC1(F)C[C@]1(Br)Cn1c(CCCl)nc2c(Br)cccc21 2202503540 GVMPLNYIDCGGAZ-LBPRGKRZSA-N 428.502 4.753 50 10 IJGE CC(C)(C)[C@]1(CBr)CCN(C[C@@H]2CC2(Br)Br)C1 2213091306 MMPKHOISHZNSBJ-JQWIXIFHSA-N 432.038 4.626 50 10 IJGE Cc1c(Br)sc([C@H](Br)c2nn(C)nc2Br)c1C 2214372054 BWMAZEKLYWTWDN-ZCFIWIBFSA-N 443.990 4.503 50 10 IJGE CCOCc1cc(Br)c([C@H](Cl)c2c(Br)cnn2C)s1 2224774922 RGSBAPOZNYRMRX-SNVBAGLBSA-N 428.577 4.871 50 10 IJGE CCC1(CC)[C@@H](Br)C[C@H]1OCCOCCOCCOCc1ccccc1 2227781651 ZRGPUVUKJWVPLW-VQTJNVASSA-N 429.395 4.595 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CCCCCCBr)C[C@@H]1c1ccccc1 2231090865 XKCBFDKJKXAQFH-RTBURBONSA-N 425.411 4.934 50 10 IJGE CO[C@@H]1CC[C@@H]1[C@@H](Br)Cc1cc(Br)cc(Br)c1 2252830037 NIDKIDIXPNHEBP-FRRDWIJNSA-N 426.974 4.943 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@@H]1[C@H]2COC[C@H]21 2259998711 GXHKSPZWQIISJB-CVUZSJFPSA-N 446.911 4.818 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282978936 SSKTWNSABAYLIR-RKDXNWHRSA-N 427.539 4.877 50 10 IJGE O=C(NCC[C@@H]1CCC[C@@H]1Br)c1cc(F)c(Br)cc1Cl 2282984151 VNAITKKBAAANLX-WPRPVWTQSA-N 427.539 4.925 50 10 IJGE CC(C)(C)[C@H](CCl)CNC(=O)Cc1cc(Br)cc(Br)c1 2295310052 RKWDWFQUUZDXQZ-LLVKDONJSA-N 425.592 4.771 50 10 IJGE BrC[C@@H]1[C@@H]2CC[C@@H](C2)N1Cc1cccc(Br)c1Br 2310098626 BWBSJFBMEZZJTR-SUZMYJTESA-N 438.001 4.959 50 10 IJGE CCOc1ccc(N2C(=O)[C@@H](CC)SC2=C(C#N)C(=O)N[C@@H](C)c2ccccc2)cc1 2314594058 YICHTOFEFGIBLM-HRAATJIYSA-N 435.549 4.556 50 10 IJGE CC1(C)[C@@H](CBr)CCN1Cc1ccc(Cl)c(I)c1 2315553598 UVJAPEUCPTYDFI-LLVKDONJSA-N 442.566 4.940 50 10 IJGE BrC[C@@H]1C[C@@H]2CCCC[C@@H]2N1Cc1sccc1I 2316760798 YGOJSMAHYKGBKT-GVXVVHGQSA-N 440.188 4.881 50 10 IJGE CCCOc1c(OC)cc(C=NNC(=O)Cc2cc(Cl)ccc2SC)cc1OC 2323680463 DYVDQLJOEAXDEX-UHFFFAOYSA-N 436.961 4.561 50 10 IJGE N#CC(=CNCCc1ccc(Br)cc1)C(=O)Nc1ccc(Cl)c(Cl)c1 2324269516 LSOJPWJKFDKJNR-UHFFFAOYSA-N 439.140 4.934 50 10 IJGE COc1cccc(-c2csc(C(C#N)=C(O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3C)n2)c1 2331249095 NMSJMINTHLVNMV-UHFFFAOYSA-N 438.421 4.893 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1 2340260441 BFLXZTXDMBTXGF-HRAATJIYSA-N 435.793 4.954 50 10 IJGE C[C@H]1[C@H](C)N(C(=O)c2cc(F)c(Br)cc2Cl)CC[C@H]1Br 2370651737 WPBAWYKMCQBBNY-OYNCUSHFSA-N 427.539 4.876 50 10 IJGE COc1ccc(/C=N/NC(=O)COc2ccc(-c3ccccc3)cc2)cc1Br 3202411 HOPVTTIZIACHAE-ZVHZXABRSA-N 439.309 4.654 50 10 IJGE Cc1ccc(C(=O)NNc2ncnc(Nc3ccc(Cl)c(Cl)c3)c2[N+](=O)[O-])cc1 40591496 BQQXYVUYPMVGNS-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE CCCOc1ccc(C(=O)NN=Cc2ccc(OC(=O)c3ccc(OCC)cc3)cc2)cc1 254506491 OHGGYTFKUWTRQW-UHFFFAOYSA-N 446.503 4.857 50 10 IJGE CCCCOc1ccc(OCC(=O)NN=Cc2c[nH]c3ccc(Br)cc23)cc1 254619503 RGRZWMOQJORQAI-UHFFFAOYSA-N 444.329 4.638 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1ccccc1[C@@H]1Cc2ccccc2N(S(N)(=O)=O)C1 616593995 RUZRMBAGLFUBQI-HXUWFJFHSA-N 446.689 4.601 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@]3(CCC[C@@H](CI)O3)[C@H]1C2 721763091 SNUUCJRAYQEFJU-FSZRXZPDSA-N 435.346 4.539 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H](C)CC(C)C)C(=O)OC(C)(C)C 725343888 VNSWBFAULCWVQD-YOEHRIQHSA-N 427.367 4.888 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cccnc2SCC2CCCCC2)c1C 736694372 YMXBRZGMJPMTLR-UHFFFAOYSA-N 448.596 4.980 50 10 IJGE COc1ccc2c(c1)c(C(=O)NNC(=O)c1cccc3cccnc13)c(C)n2C1CCCC1 741679123 KOEBEJQFPAWYMY-UHFFFAOYSA-N 442.519 4.696 50 10 IJGE Cn1ccnc1C[C@H](NC(=O)NN(Cc1ccccc1)c1ccccc1)c1ccccc1 745910516 TZJDSNKWEVZHIB-DEOSSOPVSA-N 425.536 4.625 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccc(F)cc1 1540465813 KSHZEDFIQSLGOV-VLGSPTGOSA-N 440.478 4.543 50 10 IJGE C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccccc1Oc1ccccc1 1644535336 YJXPTFQUUGJWIQ-GOSISDBHSA-N 431.920 4.958 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2cc(-c3cccs3)nc3ccc(C)cc23)c1 1651317837 UCTMBORNBPSRKJ-UHFFFAOYSA-N 442.569 4.884 50 10 IJGE COc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccc(C)c2)CCC3)cc1 1772745144 TVOWHEUXCVYFQL-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE CC[C@H](Oc1cccnc1NC(=O)Nc1ccc(SC#N)cc1)C(=O)OCC(C)C 1858856738 XHRFEJHXTLBESX-KRWDZBQOSA-N 428.514 4.655 50 10 IJGE COc1cc(CNCCC(=O)Nc2ccc(SC#N)cc2)ccc1OCc1ccccc1 1860714217 QYVAKCLWECEVCW-UHFFFAOYSA-N 447.560 4.966 50 10 IJGE CCc1nn(Cc2ccc(F)cc2)c2c1[C@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 1865685759 MLHBHHHLQJCFMH-SFHVURJKSA-N 426.854 4.644 50 10 IJGE CCc1nc(Nc2ccc(SC#N)cc2)cc(N2CCN(C)[C@@H](c3ccccc3)C2)n1 1868278113 SIGSKKTZMTWZMN-OAQYLSRUSA-N 430.581 4.849 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(O[C@@H]2COC3(CCCCC3)C2)CC1 1879028413 CKZBAZHXQMMWOH-INIZCTEOSA-N 432.399 4.659 50 10 IJGE C[C@@H]1C[C@@H]([C@H](CBr)NC(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)C1 1880756374 SYHMFMOZVXLZJT-ILXRZTDVSA-N 435.403 4.558 50 10 IJGE CCc1nn(-c2cccc(C)c2CBr)c(CC)c1I 1887326154 OWLVLELSNJWVNK-UHFFFAOYSA-N 433.131 4.805 50 10 IJGE C=C[C@H](Br)CCc1ccc(I)c(Br)c1 1893241256 GWWDIRSAAUTTME-VIFPVBQESA-N 429.921 4.936 50 10 IJGE N#C[C@H]1CN(c2ccc(CBr)cc2C(F)(F)F)CCN1Cc1ccccc1 1914893758 ZBDIXLDYWKVGBO-KRWDZBQOSA-N 438.291 4.815 50 10 IJGE F[C@]1(CBr)CCCN(Cc2cc(Cl)ccc2I)C1 2039786282 BEVGNGJDIPMUCJ-ZDUSSCGKSA-N 446.529 4.644 50 10 IJGE CC(C)c1cncc(-n2nc(CCl)c(I)c2C(F)(F)F)c1 2078889622 VCTHGIDVAXHSDK-UHFFFAOYSA-N 429.611 4.753 50 10 IJGE CCC[C@](C)(CCl)NC(=O)c1ccc(Br)cc1I 2086144552 BGOJLQZNQVSSJN-CYBMUJFWSA-N 444.538 4.581 50 10 IJGE Cl[C@H](c1cc2c(cc1Br)OCCO2)c1sncc1Br 2088928044 WBCWTAWTZKYUNN-LLVKDONJSA-N 425.529 4.768 50 10 IJGE Cl[C@@H](c1cc2c(cc1Br)OCCO2)c1sncc1Br 2088928045 WBCWTAWTZKYUNN-NSHDSACASA-N 425.529 4.768 50 10 IJGE CN(Cc1c(Cl)cnn1C)c1cc(Br)cc(F)c1CBr 2170693547 LCEYPJOHKGBLIM-UHFFFAOYSA-N 425.527 4.506 50 10 IJGE CC(C)(C)OC(=O)N[C@@]12CCC[C@@H](CN(C[C@H](CBr)c3ccccc3)C1)C2 2207053898 UXQKOFLOTUNIDG-ZWCUEREDSA-N 437.422 4.934 50 10 IJGE CC(C)(C)OC(=O)NCCN(CCCCCI)c1ccccc1 2211189998 KVLLCHAGJNXXEE-UHFFFAOYSA-N 432.346 4.623 50 10 IJGE C[C@H](Cl)c1nc2cc(Cl)cnc2n1C[C@@H]1CC1(Br)Br 2224805403 MZXRHZAWRKTRTA-BQBZGAKWSA-N 427.955 4.891 50 10 IJGE Cc1sc(C(=O)N2[C@H]3CC[C@H]2[C@@H](F)[C@H](Br)C3)c(C)c1Br 2234464374 NHZQBBQMKMMKPM-WYFGTUCQSA-N 425.161 4.606 50 10 IJGE CCCC1(O[C@H](CI)c2ccccc2Br)COC1 2260091328 MEMOZVOBQOWUTK-CYBMUJFWSA-N 425.104 4.511 50 10 IJGE O=C(NCC1(CCl)CC(F)(F)C1)c1cc(Br)cc(Br)c1 2281660761 FNQYIKVQEONPLJ-UHFFFAOYSA-N 431.502 4.596 50 10 IJGE O=C(NCC1(CBr)CC(F)(F)C1)c1ccc(Br)c(Cl)c1 2281664099 UXWQWFBTVXZPMY-UHFFFAOYSA-N 431.502 4.643 50 10 IJGE C[C@@H](Br)C1CCN(C(=O)c2cc(F)c(Br)cc2Cl)CC1 2282982626 LEDKQXJPHUZRDR-MRVPVSSYSA-N 427.539 4.877 50 10 IJGE O=C(NC[C@H]1CCC[C@@H](Br)C1)c1cc(Br)c(F)cc1Cl 2285956924 CCXNOLSZAGDMEU-DTWKUNHWSA-N 427.539 4.925 50 10 IJGE C[C@@H](Br)CN(C(C)(C)C)S(=O)(=O)c1c(Cl)cccc1Br 2288120634 HUGYTUCSUKLVRQ-SECBINFHSA-N 447.620 4.675 50 10 IJGE BrC[C@H]1C[C@@H]2CC[C@H]1N2Cc1c(Br)cccc1Br 2308524105 BZZZDRLABOYARP-ISTVAULSSA-N 438.001 4.959 50 10 IJGE Clc1ccc(C[C@]2(CBr)C[C@@]23CCOC3)cc1I 2315554320 DGIXSKRMAANWTR-ZIAGYGMSSA-N 441.534 4.679 50 10 IJGE COc1ccc(C(C#N)=Cc2ccc(OC(=O)COc3ccccc3OC)c(OC)c2)cc1 2320506792 RRKNINFOCWOJED-UHFFFAOYSA-N 445.471 4.761 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NN=C(C)c3ccc4c(c3)CCN4C(C)=O)c(C)n2)cc1 2321274839 JDMGEJSOLZZFLW-UHFFFAOYSA-N 440.547 4.682 50 10 IJGE N#CC(=CNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1cccc(C(=O)O)c1 2324097938 WIMXPPHVVBAULM-UHFFFAOYSA-N 443.303 4.880 50 10 IJGE C[C@H]1CCCN(Cc2ccc(I)c(Br)c2)[C@H]1CCl 2325224055 SQKGOAGKKIYWKD-HZMBPMFUSA-N 442.566 4.893 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NN=Cc1ccc(Cl)c(Cl)c1 2328826267 UXBDVLGAAAXRLT-SFHVURJKSA-N 436.339 4.580 50 10 IJGE CC1(C(=O)N[C@H](CCBr)COCc2ccccc2)CC2(CC(F)(F)C2)C1 2343414496 OOGRZQLCRJSKTM-MRXNPFEDSA-N 430.333 4.689 50 10 IJGE CCCN(CCC)c1ccc(/C=N/NC(=O)[C@H]2COc3cc4ccccc4cc3O2)cc1 2935970 OQQPIKJTFYEBIY-JOWQQVNMSA-N 431.536 4.756 50 10 IJGE COc1ccccc1OCCn1cc(/C=C(/C#N)C(=O)NCc2ccco2)c2ccccc21 33932100 PXMVHXMJVWCZIQ-CYVLTUHYSA-N 441.487 4.545 50 10 IJGE CC(C)c1ccc(NC(=O)/C(C#N)=C\c2ccccc2OCC(=O)Nc2nccs2)cc1 35519759 LOSFHFGCZQZQFV-UYRXBGFRSA-N 446.532 4.830 50 10 IJGE C=CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(C)cc4)ccc32)c1 40529769 HBZBOGMKEQTURZ-RUZDIDTESA-N 438.483 4.997 50 10 IJGE Cc1ccc(C(=O)NNc2ncnc(Nc3ccc(Cl)c(C(F)(F)F)c3)c2N)cc1 40784202 KERWXGBRDVQTLQ-UHFFFAOYSA-N 436.825 4.540 50 10 IJGE CCOc1ccc(OCC(=O)N/N=C/c2ccc(OCc3ccc(C)cc3)c(OC)c2)cc1 40911199 YNCZUJJDWZJAEY-JVWAILMASA-N 448.519 4.510 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2ccc(OCc3ccccc3)cc2)cc1 58892678 PABYZRPXJGATLQ-JZXRGVEXSA-N 432.520 4.628 50 10 IJGE C[C@H](SCc1ccccc1)C(=O)N/N=C1/C(=O)N(Cc2ccccc2F)c2ccccc21 59147259 QPSFJZWZCDPGLV-UOIURVPMSA-N 447.535 4.515 50 10 IJGE COc1ccccc1NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(NC(C)=O)cc2)c1C 96663309 PQFCUGJKAXPMMP-ZHZULCJRSA-N 428.492 4.607 50 10 IJGE CCCOc1cccc(/C=N/NC(=O)c2cc(-c3ccccc3)nc(N3CCCCC3)n2)c1 169927428 DFFYADXDQXTQDP-ZXVVBBHZSA-N 443.551 4.687 50 10 IJGE C[C@@H](Br)[C@@](Br)(CBr)C(=O)Oc1ccccc1Cl 205782700 CRFLXWUXTJXTLN-HQJQHLMTSA-N 449.364 4.557 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Br)c3ccc(F)c(Cl)c3)cc2[nH]1 212533205 ONRWTMPHCMDEBH-ZDUSSCGKSA-N 434.490 4.896 50 10 IJGE O=[N+]([O-])c1ccc(Oc2cccc(I)c2)c(CBr)c1 218203878 HVIUDTAAFDNOPI-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2ccc(OCc3cccc(OC)c3)cc2)cc1 254481685 HMYQOBLWIZVFEO-UHFFFAOYSA-N 431.536 4.884 50 10 IJGE CSc1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CI)cc1 382700829 YJEHPILNCCOHBA-DZGCQCFKSA-N 433.355 4.794 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2ccc3c(ccn3Cc3ccccc3)c2)c1C 762870509 IECBHSUVQRQRCR-UHFFFAOYSA-N 448.530 4.915 50 10 IJGE COc1ccccc1C(=O)NN=Cc1ccccc1OCc1ccc(Br)cc1 1084343092 FJUSCCHUVGUKNA-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE CCCOC(=O)c1ccc(OCC(=O)NN=C(C)C(c2ccccc2)c2ccccc2)cc1 1084498055 FEHFQGSSPFXHGM-UHFFFAOYSA-N 444.531 4.956 50 10 IJGE CC(=O)c1cc2c(cc1NC(=O)/C(C#N)=C\c1cc(C)n(-c3ccc(F)cc3)c1C)OCO2 1124454966 MBXAUJLKRKBCHP-NVMNQCDNSA-N 445.450 4.710 50 10 IJGE CCCCc1ccc(NC(=S)NNC(=O)c2cc(-c3ccccc3)c(C)nc2O)cc1 1135758306 LKIHTAYYMVNAKD-UHFFFAOYSA-N 434.565 4.737 50 10 IJGE C/C(=C\c1cccnc1)C(=O)NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1 1348508618 MEPMTLZKYPLWRW-OBGWFSINSA-N 435.549 4.584 50 10 IJGE C=CCNC(=O)c1ccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(C)c3)c2C)cc1 1356379996 PNTDAYSURAKJTJ-KQWNVCNZSA-N 438.531 4.864 50 10 IJGE C#CCN(C[C@@H](CBr)C1CC1)[C@H]1CCOc2ccc(Br)cc21 1473168326 OCUQRFINBVKEAB-PBHICJAKSA-N 427.180 4.629 50 10 IJGE CCOc1ccc2ccccc2c1C=NNC(=O)COc1ccccc1Br 1772754292 VFRIJYVOOARTFS-UHFFFAOYSA-N 427.298 4.530 50 10 IJGE Cc1nn(Cc2ccccc2F)c2c1[C@@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2 1865711282 UWFATEZYINLKKM-IBGZPJMESA-N 428.389 4.616 50 10 IJGE Cc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccccc2F)c1 1865711375 WOCMWOJSPMHVMP-QGZVFWFLSA-N 428.389 4.616 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)c1ccc(F)cc1F 1865759610 JONTWBGHCOVBNL-UHFFFAOYSA-N 436.245 4.717 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCN(C(=O)OC(C)(C)C)C2(CCC2)C1 1882567124 PBGAZOHXZWGXSQ-GJZGRUSLSA-N 447.414 4.844 50 10 IJGE C[C@H]([C@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1)[C@H](CBr)NC(=O)OC(C)(C)C 1884034203 GLUDYOZOFOXJDC-WCVJEAGWSA-N 449.430 4.994 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C[C@]1(C)CCCCN1C(=O)OC(C)(C)C 1890137062 YPTRTPCCFTYWJA-LIRRHRJNSA-N 435.403 4.844 50 10 IJGE C[C@]1([C@@H](Br)c2cc(I)cc3c2OCC3)CCCCO1 1908094172 JGOQHDFURWZVCX-LSDHHAIUSA-N 437.115 4.621 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)CN1c1cc(CBr)sc1[N+](=O)[O-] 1921470453 QQHKJIUAIPFJAO-CABCVRRESA-N 438.391 4.898 50 10 IJGE C[C@H]([C@H](Br)c1c(Cl)sc(Br)c1Cl)S(C)(=O)=O 1925575456 XYQMSUGPLHULBH-WUJLRWPWSA-N 430.998 4.687 50 10 IJGE Brc1cccc(Br)c1[C@H]1CC[C@H](CI)O1 1931393613 BJPZZFPHTQEYAV-GMSGAONNSA-N 445.920 4.867 50 10 IJGE C[C@@H]1[C@H](CBr)CCN1Cc1ccc(Br)cc1Br 1943858580 INMVUCYWQDLNQX-ZJUUUORDSA-N 425.990 4.817 50 10 IJGE C[C@H]1CO[C@](CBr)(Cc2ccc(I)c(Cl)c2)C1 2026563464 KIDUIYOPAFYDLC-RNCFNFMXSA-N 429.523 4.677 50 10 IJGE CCCN(CCCBr)C(=O)c1cc(Br)cc(Br)c1 2032093887 HPYUDUQUUGKUPW-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1c(Br)sc(C)c1C 2081237674 ZMHWKONJPPWLRO-XCBNKYQSSA-N 444.176 4.707 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1ccc(Br)cc1Br 2081239063 NPBOCIFIHFJWON-PRHODGIISA-N 441.989 4.751 50 10 IJGE FC1(F)[C@@H]([C@@H](Br)c2cc(I)cc3c2OCC3)C12CC2 2095597153 RBTPIKNIKZJEGC-JQWIXIFHSA-N 441.053 4.707 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN(C[C@H](CBr)C2CCC2)C1 2106787294 YOTOJZRMPYNTQL-GBESFXJTSA-N 429.443 4.909 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@H](Cl)C2(CCCC2)C1 2117747645 ACVVFNMGPXKIBQ-VIFPVBQESA-N 427.589 4.897 50 10 IJGE CN(C(=O)c1cc(Cl)ccc1I)C1(CCl)CC(C)(C)C1 2164567872 OQUIBXSQGIQLPX-UHFFFAOYSA-N 426.125 4.814 50 10 IJGE CN(Cc1ccccc1)[C@H]1CCCCN(c2nc3ccccn3c2CBr)C1 2169166491 NAPIOIRCSZTOJJ-IBGZPJMESA-N 427.390 4.720 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)c(Br)cc2n1Cc1cnns1 2234055804 DPYHYPJDKKXNRG-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE CCC[C@H](CBr)CN1CC[C@H](NC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2254964928 RNBGRPSWKPEBFA-RDBSUJKOSA-N 431.337 4.718 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CCCN(CC3(CBr)CC(F)C3)C2)C1 2265631655 FXQKSODVSFHXBV-NQKNOSNGSA-N 433.406 4.613 50 10 IJGE COc1ccc([C@H](Br)c2cnc(Cl)n2C)c(Br)c1Cl 2268266581 UHCTVDHTQRHDRJ-VIFPVBQESA-N 428.939 4.982 50 10 IJGE C[C@@H](Br)CCCN(C)C(=O)c1ccc(Cl)cc1I 2317773910 GCUROCQDRYOGAK-SECBINFHSA-N 444.538 4.580 50 10 IJGE COc1ccc(OC)c(NC(=O)C(C#N)=CNc2ccc(Cl)cc2C(F)(F)F)c1 2325162060 LRSIGCZZKYHJIC-UHFFFAOYSA-N 425.794 4.834 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@H](NC(=O)OC(C)(C)C)C3(CCC3)C2)C1 2345008227 MEAPHDZHTJPZPM-MRXNPFEDSA-N 429.443 4.957 50 10 IJGE Cn1nc(C(F)F)c(CBr)c1N1CCN(Cc2ccccc2)CC(C)(C)C1 2365330995 XHSWWYQXQJXBLV-UHFFFAOYSA-N 441.364 4.601 50 10 IJGE Cc1scc(C(=O)NCC2(F)CCC(CBr)CC2)c1Br 2369604004 NGGZTTOZQXRSDI-UHFFFAOYSA-N 427.177 4.842 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2cc(I)ccc2Cl)C[C@H]1CCl 2380521640 IYIOLAHOXYXDEP-KOLCDFICSA-N 438.058 4.794 50 10 IJGE O=C(NN=Cc1ccc(OC(=O)c2cccc3ccccc23)cc1)c1ccc2c(c1)OCO2 8405363 CQMIZIRLIGTRRO-UHFFFAOYSA-N 438.439 4.552 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](CC)C(=O)NNC(=O)COc1ccc2ccccc2c1 10682937 VTTATCKEERUFMV-FDDCHVKYSA-N 434.536 4.737 50 10 IJGE CCN(CC)Cc1cc(C=NNC(=O)C2c3ccccc3Oc3ccccc32)ccc1OC 19638567 AUROXGBKTGRQSO-UHFFFAOYSA-N 443.547 4.925 50 10 IJGE C/C(=N\NC(=O)CCCOc1ccc(Cl)cc1C)c1cccc(NC(=O)C2CC2)c1 20352744 VCXQPRHMIYUWPC-WGOQTCKBSA-N 427.932 4.696 50 10 IJGE COc1ccc(/C=N/NC(=O)COc2ccccc2-c2ccccc2)cc1Br 40902925 MDLQJUBPCUDOTF-ZVHZXABRSA-N 439.309 4.654 50 10 IJGE COc1ccccc1CN(C(=O)CCl)[C@H](C(=O)NC1CCCC1)c1ccc(Cl)cc1 97915034 ZMPHQDYJMDXKQG-QFIPXVFZSA-N 449.378 4.716 50 10 IJGE CC1CCC(CBr)(NC(=O)c2c(F)cc(Br)cc2F)CC1 125262265 DRAILZLWLCEAGF-UHFFFAOYSA-N 425.111 4.801 50 10 IJGE CCOC(=O)c1ccc(NC(=O)/C(C#N)=C\Nc2ccc(Cl)cc2C(F)(F)F)cc1 217105458 UQHWQLPOLGPFGP-QBFSEMIESA-N 437.805 4.994 50 10 IJGE O=C(c1ccc(I)c(Cl)c1)N(CCCl)C1CCCCC1 232347665 VEAZYEVUDJFSAG-UHFFFAOYSA-N 426.125 4.958 50 10 IJGE CC(C)C[C@@H](CBr)NC(=O)c1cc(Br)sc1Br 232588343 QVRVCDFPQCSXFN-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE Cn1ncc([C@@H](Br)Cc2ccc3ccccc3c2)c1I 379228032 XTUQGSQZHAMFKH-HNNXBMFYSA-N 441.110 4.857 50 10 IJGE CC(C)[C@](C)(CBr)NC(=O)c1cc(Br)sc1Br 398541103 FUJFSHJUGFJNBP-NSHDSACASA-N 448.018 4.813 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@@H]2CC[C@H](Cl)C[C@H]2C1 398701147 LTRMSERPTBWTTI-CIUDSAMLSA-N 427.589 4.753 50 10 IJGE O=S1(=O)CCC[C@@H]1CC(CBr)(CBr)C1CCCCCC1 696814555 ABHVSWARZAWIGN-CQSZACIVSA-N 430.246 4.700 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N(C)Cc2cn(C)nc2C(F)(F)F)c(C)n1C1CCCCC1 749872267 WAQBIWJUKQKHFK-WQRHYEAKSA-N 447.505 4.928 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N[C@H]2CCCC(F)(F)C2)c(-c2ccc(Cl)cc2)n1 769341261 CSVKHZCYEBVYJX-QMDZLVRISA-N 443.885 4.718 50 10 IJGE CCCCc1oc2ccccc2c1/C=C/C(=O)NNc1nc(O)c2cnn(C(C)(C)C)c2n1 770964374 AHGBYTWSUIDGEO-OUKQBFOZSA-N 448.527 4.532 50 10 IJGE N#Cc1cccc(OCc2cccc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c2)c1 799751652 QUCRKEZSPROYLI-UHFFFAOYSA-N 436.393 4.785 50 10 IJGE NC(=O)NN=Cc1cc(-c2ccccc2)n(-c2ccc([N+](=O)[O-])cc2)c1-c1ccccc1 1083920123 BPWSTWGSQUAIME-UHFFFAOYSA-N 425.448 4.722 50 10 IJGE CC(=O)c1ccc(CCNC(=O)NNc2c(Cl)cc(Br)cc2Cl)cc1 1251700792 MHJCOPGERLKHNF-UHFFFAOYSA-N 445.144 4.827 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNC(=O)c1ccc(Br)s1 1540418095 LMSCDKNNVNTJHY-FPLPWBNLSA-N 434.142 4.682 50 10 IJGE Cc1c(C(=O)NNC(=O)Nc2c(Cl)cc(Cl)cc2Cl)nc(O)c2ccccc12 1617621842 PZAOBOLONHBJBC-UHFFFAOYSA-N 439.686 4.676 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(OCC)c(OC)c1 1865694820 CLZZUHOXQUVAJD-NRFANRHFSA-N 430.508 4.586 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1cccc(F)c1)C(C#N)=C(N)O2 1865710969 MQNBERNPHVJPSN-LJQANCHMSA-N 426.854 4.644 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)C1 1882085889 XCFHIJWDSLCXJM-HRCADAONSA-N 449.430 4.996 50 10 IJGE F[C@]1(CBr)CCN(Cc2ccc(Br)cc2Br)C1 1917144278 ADSLXEYMNCQXGG-LBPRGKRZSA-N 429.953 4.521 50 10 IJGE C[C@@H]1OCCO[C@@H]1[C@H](Br)c1cc(Br)c(Br)s1 1935543615 RZCGAFWUBMKJAJ-NGESMGFYSA-N 434.975 4.513 50 10 IJGE C[C@@H]1OCCO[C@H]1[C@@H](Br)c1cc(Br)c(Br)s1 1935543616 RZCGAFWUBMKJAJ-WLGLDCGKSA-N 434.975 4.513 50 10 IJGE FC(F)OCCOc1c(Br)cc(CBr)cc1Br 1945105036 FTDOHFYYGJBOSC-UHFFFAOYSA-N 438.888 4.725 50 10 IJGE C[C@@H](NC(=O)c1csc(Br)c1Br)C1(CBr)CC1 1945187282 SQCYHWHBUMYWOJ-ZCFIWIBFSA-N 446.002 4.567 50 10 IJGE CCN(CC)C(=C(C#N)C(=O)COC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(F)cc1 2040469729 KFTGMODCLAVDGG-UHFFFAOYSA-N 438.543 4.731 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3[C@@H](Br)CC[C@H]3C2)c1 2054715843 ZMRNBMFDAFSOSV-BHYNMZESSA-N 438.001 4.817 50 10 IJGE C[C@@H]1CCCN(c2ncc(I)cc2Br)[C@@H]1CCCl 2069527301 BDOXWSXEPSRBQB-BXKDBHETSA-N 443.554 4.683 50 10 IJGE Brc1cccc(CN2CC[C@H](Br)[C@@H]3CC[C@H]32)c1Br 2069997351 SUBTVUVWIDRIJW-GMXVVIOVSA-N 438.001 4.959 50 10 IJGE CC(C)[C@H](CCN(C)C(=O)c1ccc(CBr)cc1)NC(=O)OC(C)(C)C 2106647745 WMVCPMWGGCDGII-KRWDZBQOSA-N 427.383 4.593 50 10 IJGE CCC[C@H](CBr)CN1CC[C@](NC(=O)OC(C)(C)C)(c2ccccc2)C1 2106783140 XFNARTGVMCBXKB-DYESRHJHSA-N 425.411 4.924 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN(C[C@H](CBr)CC2CC2)C1 2112870046 ZGLHYTBCQUCLKP-GBESFXJTSA-N 429.443 4.909 50 10 IJGE Brc1ccc([C@H](Br)[C@@H]2CCn3ncnc3C2)c(Br)c1 2138874465 WNFDRFCNOZNGDM-AMIZOPFISA-N 449.972 4.502 50 10 IJGE CCCN(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)CC1(CBr)CCOCC1 2163060529 BFGYUMYLNKYQIS-SFHVURJKSA-N 447.458 4.537 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](NC(=O)[C@H](Br)C2CCCC2)CC12CCCCC2 2167034742 YATJRCIJLBNTKL-IAGOWNOFSA-N 443.426 4.769 50 10 IJGE ClCCc1nc2cc(I)ccc2n1Cc1cc(Cl)ns1 2167208413 UQLCWOCEVPZNQJ-UHFFFAOYSA-N 438.121 4.580 50 10 IJGE CCN([C@@H](C)C1CCC1)S(=O)(=O)c1cc(CBr)sc1Br 2179774284 DWDAIKYBDHCMAN-VIFPVBQESA-N 445.242 4.605 50 10 IJGE CC(C)(CBr)CCCNC(=O)Cc1ccc(Br)cc1Cl 2237441004 OPVFHNYQJCMLSZ-UHFFFAOYSA-N 425.592 4.963 50 10 IJGE COc1ccc(CBr)c(N(C)[C@@H]2C[C@@H]3C[C@H](OCc4ccccc4)C[C@@H]32)n1 2239875663 BEQCAULSAXHUSB-LWYYNNOASA-N 431.374 4.805 50 10 IJGE COC[C@]1(C)C[C@@]1(CBr)Cc1cc(Cl)ccc1I 2257075769 UYCXXYXHKCGUDX-UONOGXRCSA-N 443.550 4.925 50 10 IJGE COc1ccc([C@H](Br)C[C@@H]2OCC[C@@H]2C)cc1I 2257368795 JQFGWWIVUJZPRR-PXWWUCIGSA-N 425.104 4.551 50 10 IJGE COc1ccc([C@@H](Br)[C@@]23CC[C@@](C)(C2)OC3)cc1I 2269545622 MMXUBOOCYBCOFZ-ILXRZTDVSA-N 437.115 4.695 50 10 IJGE CCn1nc(C)c(CBr)c1N(C)[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2281306656 OASQNPMVTCYEJT-PMOLBWCYSA-N 431.422 4.738 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@H](Br)C12CCC2 2282986600 SKBOZFMMLGJJNH-LBPRGKRZSA-N 425.523 4.774 50 10 IJGE CS(=O)(=O)[C@H]1C[C@H]([C@H](Br)c2csc3c(Br)cccc23)C1 2285291073 NLMVWDNIEUKBFV-RVBZMBCESA-N 438.206 4.923 50 10 IJGE CCC(CC)(CCl)CNC(=O)Cc1cc(Br)cc(Br)c1 2295316051 TULRZORCTCIKBA-UHFFFAOYSA-N 425.592 4.916 50 10 IJGE CC1([C@H](Cl)c2ccc(OCc3ccccc3)cc2Br)CS(=O)(=O)C1 2299489951 URORNSYFAWWLDU-QGZVFWFLSA-N 429.763 4.743 50 10 IJGE CC(C)[C@H](CBr)N(C)Cc1cc(I)ccc1Cl 2307327716 DQPWSGNKILSWDI-ZDUSSCGKSA-N 430.555 4.796 50 10 IJGE C[C@H](Br)CN(Cc1cc(I)ccc1Cl)C1CC1 2307329237 YDKXLPAQSLKIQT-VIFPVBQESA-N 428.539 4.692 50 10 IJGE CN(Cc1cc(I)ccc1Cl)C1(CCBr)CC1 2307329468 ABEYSEVVFAEOCH-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE COc1cc(C=C(C#N)C(=O)N(C)C)cc(Br)c1OCc1ccc(Cl)cc1 2313567768 KJUOOODIDANORM-UHFFFAOYSA-N 449.732 4.685 50 10 IJGE N#CC(=CNCCc1ccccc1Br)C(=O)Nc1ccccc1C(F)(F)F 2324305590 MEPIHIAZIYHVRX-UHFFFAOYSA-N 438.247 4.646 50 10 IJGE C[C@@H](NC(=O)C(C#N)=CN1CCN(c2cccc(Cl)c2)CC1)c1ccc2c(c1)CCCC2 2325118604 SGGHRRGAKKWKQJ-LJQANCHMSA-N 448.998 4.626 50 10 IJGE ClC[C@H]1CCC[C@@H](NCc2ccc(I)c(Br)c2)C1 2325212607 PNWDULMKGUQMPU-CMPLNLGQSA-N 442.566 4.941 50 10 IJGE CC(C)N(C)C[C@@H](Cl)CCc1ccc(I)c(Br)c1 2325223640 QDHDAHBZRPTZIY-LBPRGKRZSA-N 444.582 4.934 50 10 IJGE Cc1ccc(N2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c(CBr)c1Cl 2335416158 WVPUHPABPRKCMO-UXHICEINSA-N 435.793 4.633 50 10 IJGE COc1ccc([C@H](Br)C23CC(C[C@@H](C)O2)C3)cc1I 2342244789 UOGAYOLPCKPSHU-AYBBVMILSA-N 437.115 4.693 50 10 IJGE FC(F)(F)[C@H]1[C@H](Br)CCCN1Cc1ccc(I)cc1 2344184055 IKFJFBNSKNQVFN-VXGBXAGGSA-N 448.064 4.581 50 10 IJGE CC[C@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)COc1ccc(Cl)c(C)c1 10682210 GVUPPJVYHLZEOC-QRWLVFNGSA-N 432.948 4.546 50 10 IJGE CCOC(=O)/C(C#N)=C1/C(=O)N2c3c1cc(CC)cc3[C@](C)(c1ccccc1)CC2(C)C 17095921 PVJCWBMUANSRIN-MCKWJCLXSA-N 428.532 4.924 50 10 IJGE Cn1c(/C(C#N)=C\c2c(Oc3ccccc3F)nc3ccccn3c2=O)nc2ccccc21 35549756 OHAJNAGWTTXGDU-PEZBUJJGSA-N 437.434 4.577 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccccc4)ccc32)cc1 38650733 FBADVSKGAGRUOY-AREMUKBSSA-N 440.499 4.842 50 10 IJGE CCOc1ccc(/C=N/NC(=O)COc2ccc(Br)cc2C(C)(C)C)cc1 40910481 QHLGOODCOLHHEK-YDZHTSKRSA-N 433.346 4.674 50 10 IJGE N#C/C(=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21)c1nnc2n1CCCCC2 96838187 LTCKFEWHZQLPDC-RELWKKBWSA-N 429.911 4.639 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C\c2c(Oc3ccc(C)cc3)nc3ccccn3c2=O)cc1 102684217 KHCMUMFETZFYCE-CYVLTUHYSA-N 436.471 4.649 50 10 IJGE O=S(=O)(Nc1cccc(CCCBr)c1)c1ccc(Br)s1 139452123 HVZJJYGRNLJTSM-UHFFFAOYSA-N 439.194 4.639 50 10 IJGE Cc1nn(C)c(Cl)c1CC(CBr)(CBr)c1ccc(F)cc1 167849714 FOZFAWNCHJLIMJ-UHFFFAOYSA-N 438.566 4.791 50 10 IJGE C[C@H](Br)C[C@H](C)NC(=O)c1cc(Br)cc(Br)c1 235404959 YEOLVBNHBIJVCA-YUMQZZPRSA-N 427.962 4.503 50 10 IJGE O=C(CCCC[C@@H]1CCSS1)N1CC[C@H](Oc2ncccc2Br)C1 238815050 BFZOJZIJAOLYMV-UONOGXRCSA-N 431.421 4.538 50 10 IJGE C[C@H]([C@@H](Br)c1cc(I)cc2c1OCC2)C(C)(F)F 385682523 CSQPCJXJIDQDLK-RDDDGLTNSA-N 431.058 4.953 50 10 IJGE O=C(c1cc(Br)sc1Br)N(CCCBr)C1CC1 404244010 GKMQKSZPVLWJKI-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE CCCCOCCCNC(=O)c1cccc(NC(=O)Nc2ccc(SC#N)cc2)c1 586700754 SLJQNJQLNNDCJA-UHFFFAOYSA-N 426.542 4.840 50 10 IJGE CN(C(=O)c1cc(Br)cc(Br)c1)[C@@H]1CCC[C@H]1Br 709265250 BZOKVKMMKONBCN-VXGBXAGGSA-N 439.973 4.600 50 10 IJGE CC(C)(C)S(=O)(=O)CCC(CBr)(CBr)C1CCCCC1 711295353 RXKFPJDXVAWOFY-UHFFFAOYSA-N 432.262 4.946 50 10 IJGE Cc1ccc(COc2ccccc2/C=C(\C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1 1084263213 URYUBJLFTSCEIY-NCELDCMTSA-N 437.543 4.830 50 10 IJGE C[C@@H](SCc1nc(O)c2ccccc2n1)C(=O)N1CC[C@H](O[Si](C)(C)C(C)(C)C)C1 1557691313 YQUSCSUTQZZFSI-CVEARBPZSA-N 447.677 4.580 50 10 IJGE CC(=O)CCC(C)(C)C(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 1587236765 VLZBVHKNMPVXKP-UHFFFAOYSA-N 432.973 4.789 50 10 IJGE Cc1ccc(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2F)cc1 1865701642 AGNSILZGVAUBTC-KRWDZBQOSA-N 446.379 4.755 50 10 IJGE CCCc1nn(Cc2ccccc2)c2c1[C@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865705292 QOBUZHSNTOBDLY-HSZRJFAPSA-N 428.536 4.889 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)[C@H]3CC(=O)N(C(C)(C)C)C3)n2)cc1Cl 1872757361 BTYOXXZYCAJBMD-ISNHLSKGSA-N 431.945 4.912 50 10 IJGE O=C(N[C@@H](CBr)CC1CCOCC1)c1cscc1OCc1ccccc1 1883268808 IRRBWTBVCDHRRC-QGZVFWFLSA-N 438.387 4.637 50 10 IJGE Brc1cc([C@H](Br)[C@H]2[C@H]3COCC[C@H]32)c(Br)s1 1895906045 BMPRUVOYPXQRCN-KUBHLMPHSA-N 430.987 4.992 50 10 IJGE BrCC[C@H]1CCCN1Cc1ccc(Br)cc1Br 1943840738 DKDBWWDGQRPVRB-GFCCVEGCSA-N 425.990 4.961 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc([C@@]2(C)CC[C@H](CI)O2)cc1 1987516537 ADSVXUJSQKRPMU-CRAIPNDOSA-N 431.314 4.541 50 10 IJGE C[C@@H](CCCCBr)NC(=O)c1c(Br)cccc1Br 2033089739 WYKJOLFLSBQUAE-VIFPVBQESA-N 441.989 4.895 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@H](Cl)C(F)(F)CC1 2093612929 FZBNXVKMULXVQW-QMMMGPOBSA-N 437.531 4.752 50 10 IJGE Br[C@H](Cc1ccc2ccccc2n1)c1cc(I)sn1 2120031251 HQMIRCWHQXNOQL-LLVKDONJSA-N 445.123 4.975 50 10 IJGE COc1ccc(OC)c([C@@H](Br)Cc2ccccc2I)c1 2143868407 OALOQBGIZVTOPP-AWEZNQCLSA-N 447.110 4.987 50 10 IJGE ClCc1nc(N2CCC[C@@]3(CCCN(Cc4ccccc4)C3)C2)ncc1Br 2163326329 VKTUEKGHIYFIPT-OAQYLSRUSA-N 449.824 4.861 50 10 IJGE O=C(NC[C@@H]1CN(CC2(CBr)CCCCCC2)CC12CCC2)C(F)(F)F 2174052866 DHEUMOOLUMYRRP-OAHLLOKOSA-N 439.360 4.503 50 10 IJGE CC[C@H]1CC[C@H](C)N(S(=O)(=O)c2cc(CBr)sc2Br)C1 2179788147 YOPMJMHMOPRVLL-UWVGGRQHSA-N 445.242 4.605 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1sc(C)c(Br)c1C 2218969684 PCALAXHLSFYJFH-XCBNKYQSSA-N 444.176 4.707 50 10 IJGE C[C@H](Cl)c1nc2cncnc2n1Cc1scc(Br)c1Br 2235294755 UWTBFNZUHAXWAS-LURJTMIESA-N 436.560 4.761 50 10 IJGE C[C@@H](Br)CN(CCC(C)(C)C)c1ccc(I)cn1 2259670801 WLISSJICQQOPFS-LLVKDONJSA-N 425.152 4.712 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282978365 MEXQCRBINDOQAB-BDAKNGLRSA-N 427.539 4.735 50 10 IJGE CCCN(Cc1cc(I)ccc1Cl)C[C@@H](C)Br 2307334059 LVURYFVGIXYCIB-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE C[C@@H]1CC[C@@](CCl)(NCc2ccc(I)c(Br)c2)C1 2325232870 GYFLPNKNLCVKEW-QMTHXVAHSA-N 442.566 4.941 50 10 IJGE CN(Cc1cc(I)ccc1Cl)[C@H](CBr)CC1CC1 2327410225 YHWPCIFCXBLYOZ-ZDUSSCGKSA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)Nc1nc2cc(NC(=O)C3CC(Br)C3)ccc2s1 2328526080 QPHGHRLTTHBNQD-UHFFFAOYSA-N 426.336 4.755 50 10 IJGE FC(F)(CI)C(F)(F)CNCCc1cc(Cl)cc(Cl)c1 2361674988 QXBQVLPJHHHYJD-UHFFFAOYSA-N 444.037 4.831 50 10 IJGE COc1ccc(-n2c(-c3ccc(OCCCl)cc3)nc3c(OC)cccc3c2=O)cc1 34752989 KVKJQWUMMMBTJX-UHFFFAOYSA-N 436.895 4.688 50 10 IJGE CC1(C)C[C@H](NC(=O)NC[C@]2(c3ccc(F)cc3F)CC2(C)C)C[C@](C)(CN=C=O)C1 170290747 NHKOTQILITZNSV-DPSWKAHMSA-N 433.543 4.853 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)/C(C#N)=C\Nc1cc([N+](=O)[O-])ccc1Cl 217184055 WLBFVWIMKPOUOV-UZFBZYOGSA-N 428.876 4.652 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)N[C@@H]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OCc1ccccc1 254438949 IVJIXOYYIQIRPV-GBGLKESISA-N 449.507 4.784 50 10 IJGE Cc1ccc(S(=O)(=O)Oc2cccc(C=NNC(=O)c3cccc4ccccc34)c2)cc1 254440658 DWXVODYOZYEMDU-UHFFFAOYSA-N 444.512 4.680 50 10 IJGE N#C/C(=C1\CCN(C(=O)OCc2ccccc2)C1)c1ccc(I)cc1 309949328 FIMZNAMPQIDMTD-ZPHPHTNESA-N 444.272 4.611 50 10 IJGE Cn1cc(COc2c(Br)cc(Cl)cc2CCl)c(Br)n1 708094329 OPSXKRQUOAGAOS-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE C[C@@H](Br)[C@@H]1CCN(C(=O)c2cc(Br)sc2Br)C1 719965779 CBXNUAWTXBTBSE-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE O=C(Nc1cccc(CCBr)c1)c1cccc(F)c1I 721694497 ZHLFPJDXRRRMFL-UHFFFAOYSA-N 448.073 4.620 50 10 IJGE Cc1ccccc1C1(CNC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)CC1 726564323 HECOLSZIRJLCOU-CJLVFECKSA-N 435.531 4.527 50 10 IJGE Cc1cnn(-c2ccc(C(=O)NNc3ccc(Br)cc3C(F)(F)F)cc2)c1 731479279 XRUAOAXGHNTJLC-UHFFFAOYSA-N 439.235 4.719 50 10 IJGE O=C(NNc1ccc(Br)cc1F)C1CCN(c2nc3ccccc3s2)CC1 748204088 RLYODEZXEHVRGT-UHFFFAOYSA-N 449.349 4.558 50 10 IJGE CC(/C=C(/C#N)c1nnc(N2CCOCC2)n1-c1ccccc1)=C\c1ccc(Cl)cc1 753714011 LLLYUMKUCOTIJE-IMNZKGOKSA-N 431.927 4.768 50 10 IJGE CC(C)c1cccc(C(C)C)c1NC(=O)C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799840884 RPXVPASUJJMOQP-UHFFFAOYSA-N 432.446 4.906 50 10 IJGE O=C(CCC(=O)Nc1ccc(Cl)cc1Cl)NN=Cc1c(O)ccc2ccccc12 1084411875 FADHMRPPZYMJHD-UHFFFAOYSA-N 430.291 4.721 50 10 IJGE COC(=O)c1ccccc1-c1ccccc1C(=O)NNc1nc2ccccc2[nH]c1=S 1470320117 VUIZOWKHBGJWNF-UHFFFAOYSA-N 430.489 4.503 50 10 IJGE Cc1cccc(NC(=O)COc2cccnc2NC(=O)Nc2ccc(SC#N)cc2)c1C 1858826068 SIKIYKOXEAPTRW-UHFFFAOYSA-N 447.520 4.933 50 10 IJGE CN(CC(C)(C)CI)C1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 1904651988 WDLDGLPJWIYGLZ-DFNIBXOVSA-N 426.386 4.575 50 10 IJGE C[C@@H](Br)C(C)(C)CNC(=O)c1cc(Br)sc1Br 1913831914 VMCSTOKHTKUEHP-ZCFIWIBFSA-N 448.018 4.813 50 10 IJGE ClC[C@H]1CCC[C@H]1CNc1ncc(I)cc1Br 2015756442 FZGZDCFPRMNWBX-BDAKNGLRSA-N 429.527 4.516 50 10 IJGE ClC[C@H]1CCC[C@@H](Nc2ncc(I)cc2Br)C1 2015756765 KNBBZGZARIHSLV-WCBMZHEXSA-N 429.527 4.658 50 10 IJGE CC(C)[C@H](CBr)CNC(=O)c1c(Br)cccc1Br 2033086220 JWGXXXKKRWORMK-SECBINFHSA-N 441.989 4.609 50 10 IJGE C[C@H]1C[C@@H](C(F)(F)F)N(CCCCCBr)CCN1C(=O)OC(C)(C)C 2058048108 BDORDEALMATYHR-KBPBESRZSA-N 431.337 4.814 50 10 IJGE Brc1cccc(Br)c1CN1CC[C@@H](Br)[C@H]1C1CC1 2067014904 FENHIIRXWTXIOA-ZIAGYGMSSA-N 438.001 4.959 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC2(CCC2)C[C@H]1CCl 2095167636 FCJRDTZTIZZBAO-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE CCC[C@H](CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2106784532 JHXQNCDZAXHVAK-NZSAHSFTSA-N 425.411 4.790 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CCC[C@]2(CCN(Cc3ccccc3)C2)C1 2163326286 LXDOTAGZFKNUAP-HSZRJFAPSA-N 427.386 4.710 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1ccc2cc(O)ccc2c1 2184259329 YZLYHPBEZQFVGY-HXUWFJFHSA-N 428.326 4.598 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2ccc(CBr)cc2)[C@H]1C(C)(C)C 2192487585 HBYSACTZZCLXHZ-IRXDYDNUSA-N 439.394 4.735 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2N1C(=O)OC(C)(C)C 2196906337 CNCQUVONXAFDIT-OAGCAAQDSA-N 443.426 4.577 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CC[C@@H](C(F)(F)CCl)C1 2197765268 AVRXIZMVXMLRGF-MRVPVSSYSA-N 431.502 4.548 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@H]1CCCC[C@@H]1N(C)C(=O)c1ccc(CBr)cc1 2203609228 JNODMMIPNNRXSM-ROUUACIJSA-N 439.394 4.832 50 10 IJGE CN(CCCCCI)[C@@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2211188417 ZIVLWOFUJXFYCT-HZPDHXFCSA-N 438.394 4.607 50 10 IJGE O=C(c1c(F)cc(Br)c(F)c1Br)C1CC(Br)C1 2250817778 LDANZXVXFQRZNZ-UHFFFAOYSA-N 432.884 4.846 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1Cc1cccc(Br)c1Br 2251035888 AILKASXZBYKHFN-ZYHUDNBSSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(CCCCCCBr)[C@H](C(F)(F)F)C1 2255000970 HZXOXVWUTVYDKI-KGLIPLIRSA-N 431.337 4.862 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)C=Cc3ccccc3)ccc2[C@@H]1c1ccc(F)cc1F 2297718085 DFOGBTCPGTVAAS-DEOSSOPVSA-N 430.410 4.802 50 10 IJGE C[C@@H]1[C@@H](CBr)CCN1Cc1cc(I)ccc1Cl 2307327538 BTQMMOLYAIEKEE-NXEZZACHSA-N 428.539 4.550 50 10 IJGE CCNC(=O)c1c(NC(=O)C(C#N)=Cc2c(C)[nH]c3ccccc23)sc2c1CCCC2 2314656401 VALQNKFGXSVOBO-UHFFFAOYSA-N 432.549 4.712 50 10 IJGE COc1ccc(OC)c(CC(O)=C(C#N)c2nc(-c3ccc(OC)cc3OC)cs2)c1 2331385776 IRUXVRXNFLYPMO-UHFFFAOYSA-N 438.505 4.880 50 10 IJGE CCN(c1c(CBr)c(C(F)F)nn1C)C1CCN(Cc2ccccc2)CC1 2365330552 OXGKAMUCTVZEFF-UHFFFAOYSA-N 441.364 4.744 50 10 IJGE CC1(C)CCC[C@]1(CCl)NC(=O)c1ccc(Cl)cc1I 2365591752 IMKMYZDSNMIRMI-OAHLLOKOSA-N 426.125 4.862 50 10 IJGE O=C(N[C@H](CCl)C1CCCCC1)c1ccc(Cl)cc1I 2365594584 AAWOTLPOXGUGJO-CQSZACIVSA-N 426.125 4.862 50 10 IJGE CCc1ccc(Oc2ncnc(NNC(=O)c3cccc4ccccc34)c2[N+](=O)[O-])cc1 40658765 KAPQMGYQUYSGCO-UHFFFAOYSA-N 429.436 4.650 50 10 IJGE CCCCOC(=O)c1ccccc1N/C=C(/C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 217234221 UJYZTPZKRNETHN-YPKPFQOOSA-N 442.859 4.663 50 10 IJGE CCC[C@H](Br)CNC(=O)c1cc(Br)cc(Br)c1 233326209 OPFLQNNTYOYGOW-VIFPVBQESA-N 427.962 4.505 50 10 IJGE Cn1ncc([C@H](Br)c2ccc(F)c(Br)c2)c1Br 383258490 SJYPIESTPOUQOC-SNVBAGLBSA-N 426.909 4.569 50 10 IJGE COC1CCC(O[C@@H](CI)c2ccc(Br)cc2)CC1 686232064 TUKVSNSCOMZPSX-NRXISQOPSA-N 439.131 4.899 50 10 IJGE FC(F)(F)c1cc(Br)cnc1N1CCSC[C@@H]1CCBr 689209101 KLZRMHSRQPCMBV-VIFPVBQESA-N 434.119 4.570 50 10 IJGE Fc1ccc2nc(CCl)n(Cc3ncc(Br)s3)c2c1Br 714932935 MSFWZDOFQXJAJO-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE O=C(CCOc1ccccc1)NNC(=O)Nc1cccc(S(F)(F)(F)(F)F)c1 762966573 STROIODLCMZECR-UHFFFAOYSA-N 425.379 4.966 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCc2ccc(-c3csc(C)n3)cc2)c1C 790483179 CHJJMPPCSRGFEI-HPMPDSITSA-N 448.592 4.968 50 10 IJGE COc1cccc(C(=O)NN(C(=O)c2ccc(Cl)c3c2CC(C)(C)O3)C(C)(C)C)c1C 1088691034 VMXIVKJONNUZOP-UHFFFAOYSA-N 444.959 4.956 50 10 IJGE C=C(C)[C@H](CC(=O)NNC(=O)c1cc(-c2ccccc2Cl)nc2ccccc12)OCC 1608431979 JENSRFYSFWYYCU-QFIPXVFZSA-N 437.927 4.688 50 10 IJGE C=CCCCCCCCNC(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1 1683131589 RUUPACVMTQITNF-UHFFFAOYSA-N 439.585 4.866 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccn2)c1 1865692960 GWCFVKGTDVQLEZ-HSZRJFAPSA-N 449.514 4.941 50 10 IJGE Cn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@@H]2c1cccc(OCc2ccccc2)c1 1865711831 IVAVWGHCEUIISG-QHCPKHFHSA-N 434.499 4.884 50 10 IJGE COc1cc(/C=C/C(=O)NCCCBr)ccc1OCc1ccc(Cl)cc1 1865907504 ZBAHNXBCPVUQQL-UXBLZVDNSA-N 438.749 4.842 50 10 IJGE CC[C@@](C)(NC(=O)[C@@H](c1ccc(OC)cc1)C(C)C)C(=O)Nc1ccc(SC#N)cc1 1866978900 GDLSPVIGACSGMO-ZJSXRUAMSA-N 439.581 4.932 50 10 IJGE Cc1c(Br)sc([C@H](Br)[C@@H]2[C@H]3COC[C@H]32)c1Br 1922895750 YSULNWHTEVGMOS-UTSKPXGSSA-N 430.987 4.910 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC12CCC1(CCC[C@@H](CI)O1)CC2 1937362660 ZINODGJPXGHBKU-BULQSVBWSA-N 435.346 4.587 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1Br)c1csc(Br)c1Br 1945183302 BSRJBCQWHREPKW-YUMQZZPRSA-N 446.002 4.709 50 10 IJGE CC1(C)C[C@H](Br)CCN1c1ncc(Br)cc1Br 2003744929 RJSYIPMKNYXXBC-MRVPVSSYSA-N 426.978 4.749 50 10 IJGE CCC[C@@H](CBr)CNC(=O)c1cc(Br)sc1Br 2008108944 NJDPUWOADARGBY-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE C[C@@H](CCCBr)CNC(=O)c1c(Br)cccc1Br 2033086270 KIVNFONOOCPUBL-VIFPVBQESA-N 441.989 4.753 50 10 IJGE O=C(N[C@@H]1CCC[C@H]1CBr)c1c(Br)cccc1Br 2033096903 ZRADXYIKRYGNJS-GZMMTYOYSA-N 439.973 4.505 50 10 IJGE BrC[C@@H]1C[C@@H]2CN(Cc3cc(Br)ccc3Br)C[C@H]21 2054712057 HWGQNTSNTSSKBD-CWSCBRNRSA-N 438.001 4.674 50 10 IJGE Cc1cc(Br)c([C@H](Br)C2COCCOC2)cc1Br 2083298285 MFDRXIKVOXHSIA-CYBMUJFWSA-N 442.973 4.619 50 10 IJGE C[C@@]1(n2c(CCCl)nc3cncc(Br)c32)CCN(Cc2ccccc2)C1 2095438536 XHDBGWJQKSZLKX-HXUWFJFHSA-N 433.781 4.596 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@H]2CCC[C@@]2(CBr)C1 2115939478 DWLJLYYSMQDWKA-AMIZOPFISA-N 427.589 4.801 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@H]2CCC[C@]2(CBr)C1 2115939480 DWLJLYYSMQDWKA-OQPBUACISA-N 427.589 4.801 50 10 IJGE C[C@@H]1C[C@@H](C)N(Cc2ccc(CBr)cc2)C[C@@H]1CNC(=O)OC(C)(C)C 2126464446 AWBYEQPUWLYJBV-MDZRGWNJSA-N 425.411 4.953 50 10 IJGE Brc1cccc([C@H](CI)OCCOCCC2CC2)c1 2127763309 KFLCDYVPYRXNGB-HNNXBMFYSA-N 439.131 4.759 50 10 IJGE C[C@]1(CCl)CC(F)(F)CN1C(=O)c1cc(Br)cc(Br)c1 2159055470 WRIDHGGVLIEEDM-GFCCVEGCSA-N 431.502 4.690 50 10 IJGE CCCc1ncc(CC(CBr)(CBr)C2CCOCC2)s1 2172950486 HTCNWANWQSGFEC-UHFFFAOYSA-N 425.230 4.841 50 10 IJGE CO[C@@H]1C[C@]2([C@@H](Br)Cc3cc(Br)cc(Br)c3)C[C@H]12 2263525627 NZUWAWAFMZHAHD-YIYPIFLZSA-N 438.985 4.943 50 10 IJGE Cc1cncc(CO[C@H](CI)c2cccc(Br)c2)c1 2279035227 XOVWGTSTDDDSLO-OAHLLOKOSA-N 432.099 4.845 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)NCCc2ccccc2)ccc1OCc1ccccc1 2293402370 RQMNYTAETACPQR-UHFFFAOYSA-N 426.516 4.930 50 10 IJGE CC(=O)N(C(=O)C(C#N)=CNc1ccccc1Sc1ccccc1)c1ccc(N)cc1 2324170049 QQUQJWARVKTAFI-UHFFFAOYSA-N 428.517 4.819 50 10 IJGE C[C@H](C(O)=C(C#N)c1nc(-c2c[nH]c3ccccc23)cs1)N1C(=O)c2ccccc2C1=O 2331346613 FPBRFBVTFLOQAA-CYBMUJFWSA-N 440.484 4.769 50 10 IJGE CCOc1ccc([C@@H](Br)c2nn(C)c(Cl)c2Br)c(F)c1 2367468359 FDUHNRAHZPADPJ-SNVBAGLBSA-N 426.511 4.858 50 10 IJGE N#C/C(=C\c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1)c1nc(O)c2ccccc2n1 34988290 SVFLCXGBCJJJMR-GHRIWEEISA-N 440.434 4.556 50 10 IJGE Cc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)N3c4ccccc4C[C@@H]3C)c(C)c21 40811484 VLQAVMHUYZUAAL-ZCZMWGMNSA-N 441.531 4.958 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)CN(C(=O)c2ccccc2)c2ccccc2C)cc1 254744135 QRUMEIIVDKCKCW-UHFFFAOYSA-N 442.563 4.638 50 10 IJGE CC(C)(C)OC(=O)NCCN1CCNC[C@@H]1c1ccccc1CO[Si](C)(C)C(C)(C)C 616636049 JEYLQDLKNCQJEU-OAQYLSRUSA-N 449.712 4.679 50 10 IJGE C[C@H](Br)CCN(C)C(=O)c1scc(Br)c1Br 705509460 DESCZGFDGTVPHF-LURJTMIESA-N 433.991 4.519 50 10 IJGE C[C@@]1(CBr)CCCN1Cc1cc(Cl)ccc1I 723029398 YZCVORPSBUDZDG-ZDUSSCGKSA-N 428.539 4.694 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1ccccc1-c1cc(F)c(F)c(F)c1 756853936 AXMKDXLYDWPODB-UHFFFAOYSA-N 436.393 4.786 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=S)Nc3ccc(Cl)cc3Cl)n[nH]2)cc1C 764501857 DJFLQAZEUJWTKD-UHFFFAOYSA-N 434.352 4.632 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C(C)(C)c2ccc(OCC(C)C)cc2)c1C 769114712 DJLRONFICFTMNM-UHFFFAOYSA-N 433.556 4.611 50 10 IJGE CC(C)c1nc(C(=O)Oc2ccc([N+](=O)[O-])c3ncccc23)nn1-c1ccccc1Cl 770128480 KFBIECDZFJZQQW-UHFFFAOYSA-N 437.843 4.720 50 10 IJGE O=C(NNc1ccc(Br)c(F)c1)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 771680461 CNWWJRLZCACAED-NWDGAFQWSA-N 433.199 4.734 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NCc2cccc(C(F)(F)F)c2)c(-c2ccccc2)n1 914460594 GNQWXKWPVIYVGS-CPNJWEJPSA-N 449.436 4.706 50 10 IJGE C=CCCO[C@H](C)C(=O)NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1 1124339893 IBWDDUGMCFJIAQ-HXUWFJFHSA-N 444.531 4.675 50 10 IJGE O=C(NNC(=O)c1ccc(Br)cc1)N[C@@H](c1ccc(Cl)cc1)C1CCC1 1251668840 IHTWVYXQYDABQX-QGZVFWFLSA-N 436.737 4.588 50 10 IJGE C=CCNC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(C)cc2)c1C 1524971549 LUPLTAPVKSZZSR-JWGURIENSA-N 438.531 4.864 50 10 IJGE CC(=O)c1ccc(CCNC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(C)cc3)c2C)cc1 1546115454 GKDUGJUDUMQSFD-XYGWBWBKSA-N 425.532 4.871 50 10 IJGE C=CCOc1cn(-c2ccccc2)nc1C(=O)NNc1ccc(Cl)c(Br)c1 1652556582 RRPMJEHWLXGXDT-UHFFFAOYSA-N 447.720 4.610 50 10 IJGE CC(=O)c1cc(Br)ccc1OS(=O)(=O)c1ccc(CCCCl)cc1 1661027286 CDVXTJTZCQQGQI-UHFFFAOYSA-N 431.735 4.591 50 10 IJGE COc1ccc(-c2ccc(C(=O)NNC(=O)c3ccccc3SCC(C)C)c(C)n2)cc1 1865756867 ARYMUCYJVZGZPR-UHFFFAOYSA-N 449.576 4.889 50 10 IJGE Cc1nc(-c2ccc(F)cc2)ccc1C(=O)N/N=C\c1c(Cl)nc2scc(C)n12 1865760511 BBYPTBUROSVWNN-AQHIEDMUSA-N 427.892 4.631 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)NCC2(c3ccc(Cl)cc3Cl)CC2)cc1OC 1866130205 HFPWPRZEYMUTTG-OQLLNIDSSA-N 431.319 4.766 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cccc(Br)c1 1902796738 QRUOCHMLRVQZFG-KRWDZBQOSA-N 441.163 4.549 50 10 IJGE BrC[C@@H]1CN(c2ncc(Br)cc2Br)CC12CCC2 1914506899 IKCIRXCHJDNKLT-SECBINFHSA-N 438.989 4.608 50 10 IJGE CN(Cc1cc(Br)ccc1Br)CC1CC(Br)C1 2006504136 WKNVMXHDCAPPPR-UHFFFAOYSA-N 425.990 4.817 50 10 IJGE Clc1cc(C[C@@H]2CCOCC[C@H]2Br)ccc1I 2026571286 YUQYUVSWUWHYIS-WDEREUQCSA-N 429.523 4.677 50 10 IJGE CC[C@@H](C)[C@@H](CI)NCc1ccc(Br)c(F)c1F 2081255857 RRXMLSONUCJZGR-LDYMZIIASA-N 432.090 4.667 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1Cc1nccn1Cc1ccccc1 2095445789 MDEANMPMOAFPFY-ZDUSSCGKSA-N 430.737 4.787 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CC2(CBr)CCCC2)C[C@H]1c1ccccc1 2163057774 DZQFOAFMWBTDRN-RBUKOAKNSA-N 437.422 4.934 50 10 IJGE CCN(C(=O)[C@@H](Br)C1CCCC1)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2167032512 MXWWIJZUNCMJSM-WFFDWFOESA-N 443.426 4.719 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H]2CCO[C@@]2(CNC(=O)OC(C)(C)C)C1 2175181488 HUVSPNZXADXXCV-UTKZUKDTSA-N 447.458 4.584 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@@H]1C[C@@H](C(C)(C)C)CN(C(=O)OC(C)(C)C)C1 2196908354 XFGRECCYHAZLPH-VQHPVUNQSA-N 445.442 4.538 50 10 IJGE C[C@@H]1[C@@H](NC(=O)OC(C)(C)C)CC[C@H](C(=O)N(C)C[C@H]2C[C@@H](Br)C2)C1(C)C 2196913595 DZNBBBUSGFIMGW-UUAJXVIYSA-N 445.442 4.584 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@@H]1CCCN(CCCCCCBr)C1 2231088631 PPJWUCFWGHSUMT-OAHLLOKOSA-N 429.403 4.891 50 10 IJGE Fc1ccc2nc(CCCl)n(C[C@@H]3CC3(Br)Br)c2c1F 2233038211 FVIGMRSXLVHXMR-ZETCQYMHSA-N 428.502 4.602 50 10 IJGE ClCCc1nc2cc(Br)c(Br)cc2n1Cc1ccsn1 2234062195 AIGPLHCIZZEBHM-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE C[C@@H]1CCCN(Cc2sccc2I)[C@@H]1CCBr 2301072791 AVZPSZPRONWYFH-ZYHUDNBSSA-N 428.177 4.738 50 10 IJGE Clc1cc(CN2CC[C@@H](Br)[C@@H]3CC[C@@H]32)ccc1I 2312131043 SHTGRVROTYVGOM-WDMOLILDSA-N 440.550 4.692 50 10 IJGE C[C@@H](Br)CCCN(C)C(=O)c1cc(Br)cc(Br)c1 2314466923 TYFKVJOVCVDOTG-SECBINFHSA-N 441.989 4.847 50 10 IJGE CCCOc1ccc(C=C2C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)cc1OCC 2314616498 CCDPENMHHOJJGO-UHFFFAOYSA-N 444.531 4.975 50 10 IJGE Clc1ccc(CN2C[C@H]3CC(Br)C[C@@H]3C2)cc1I 2315546829 MIVSYEIDNCKZQH-GHMZBOCLSA-N 440.550 4.550 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)cc1OC 2321215919 XVMHWQGCHIHSNB-UHFFFAOYSA-N 425.435 4.506 50 10 IJGE N#CC(=CNCCc1cccc(Br)c1)C(=O)Nc1cc(Cl)ccc1Cl 2324392464 FYXGVMYGCBAELU-UHFFFAOYSA-N 439.140 4.934 50 10 IJGE CC[C@H]1CN(C[C@@]2(CBr)CC2(F)F)[C@H](CC)CN1C(=O)OC(C)(C)C 2326918559 AOZVQFAQQQWRSE-KEYYUXOJSA-N 425.358 4.517 50 10 IJGE C[C@]1(CBr)C=CCCN1Cc1cc(I)ccc1Cl 2327409831 SKJRJWHHIJKCHO-CQSZACIVSA-N 440.550 4.860 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1CN(CC1CC1)C[C@]1(CBr)CC1(F)F 2351888905 LTFHGVBNERIYBK-MAUKXSAKSA-N 437.369 4.518 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N(CCCBr)C1CCOCC1 2352863972 JRTRVMLFRRBLGI-UHFFFAOYSA-N 438.387 4.733 50 10 IJGE CCOc1ccc([C@H](Br)c2nn(C)c(Cl)c2Br)c(F)c1 2367468358 FDUHNRAHZPADPJ-JTQLQIEISA-N 426.511 4.858 50 10 IJGE C[C@@H](Cl)CN(C(=O)c1ccc(Cl)cc1I)C1CCCC1 2368844159 HZNCUKUTXYFNFQ-SNVBAGLBSA-N 426.125 4.957 50 10 IJGE O=C(NC1CCCCC1)[C@@H](c1ccccc1F)N(CCc1ccccc1)C(=O)CCl 3033933 CLSXQNJASVGLQW-HSZRJFAPSA-N 430.951 4.626 50 10 IJGE CCOc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc(OCc3ccccc3)cc2)cc1 12579180 CFPLKQXWIANXMM-OVVQPSECSA-N 445.519 4.533 50 10 IJGE Cc1ccc(-c2ccc(/C=N/NC(=O)Nc3ccc(Br)cc3)o2)cc1C(=O)O 59104569 PMBZWURAWHVUNC-SSDVNMTOSA-N 442.269 4.871 50 10 IJGE O=C(NC[C@@H](c1ccccc1)N1CCCC1)[C@@H](Br)Cc1ccccc1Cl 96568402 KBFBQYDRGNTRKT-ICSRJNTNSA-N 435.793 4.599 50 10 IJGE O=C(NC1CCC(Br)CC1)c1cc(Br)c(Br)s1 139694976 VEBKWNKGXPHZHZ-UHFFFAOYSA-N 446.002 4.709 50 10 IJGE COc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)/C=C\c4ccc(C)cc4)ccc32)c1 205641520 NERVJLNDTKMNAS-MLPQPIHFSA-N 438.483 4.841 50 10 IJGE O=C(NC[C@H]1CCC[C@H]1Br)c1ccc(Br)cc1Br 232451512 DTCNKDCCAWKDNG-LDYMZIIASA-N 439.973 4.505 50 10 IJGE Cc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)c2ccc(Br)o2)cc1 254501169 LZSQIAUJZAMIJA-UHFFFAOYSA-N 449.308 4.967 50 10 IJGE aggregator O=C(CCC(=O)Nc1ccc(Cl)cc1Cl)NN=Cc1cc(Cl)cc(Cl)c1O 254619228 ZMXIYMKEVBSJQE-UHFFFAOYSA-N 449.121 4.875 50 10 IJGE ClCc1c(I)sc2cc(I)ccc12 307205010 HAXJIQVWCWNJJV-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CN(C(=O)c1ccc(Br)cc1Br)[C@H]1CCC[C@H]1Br 709268703 RVBXEELKOPVBRN-PWSUYJOCSA-N 439.973 4.600 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])c2ncccc12)c1nc(-c2cccs2)n(-c2ccccc2)n1 770136177 MXAGOJRXBDCIOS-UHFFFAOYSA-N 443.444 4.671 50 10 IJGE Cc1ccc(C=NNC(=O)c2ccc(NC(=O)c3ccc(Br)cc3)cc2)cc1 1083949766 OFQAFWSQBANRIQ-UHFFFAOYSA-N 436.309 4.774 50 10 IJGE COc1cc(C=NNC(=O)Nc2ccc(C)c(C)c2)ccc1OCc1cccc(C(=O)O)c1 1084101025 QPPYBYPLAGKMGW-UHFFFAOYSA-N 447.491 4.745 50 10 IJGE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)c1cc2c(s1)CCCCC2 1440374114 CDSZDEKXEGIBRM-ACCUITESSA-N 438.471 4.780 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1)c1cccc(C(F)(F)F)c1 1587210972 OUTUJSFZTXNKKC-DTQAZKPQSA-N 434.458 4.995 50 10 IJGE Cc1c(C(=O)N(C)Cc2ccccc2)oc2c1C(=NNC(=O)c1ccc(Cl)cc1)CCC2 1772743667 IEKGGXTYLMHXHL-UHFFFAOYSA-N 449.938 4.984 50 10 IJGE N#C/C(=C\c1cccc(Br)c1)C(=O)NCC1(c2ccc(F)c(F)c2F)CC1 1866131068 XAFYEIHRWRQLID-MDWZMJQESA-N 435.243 4.621 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)c3cc(OC)c(OC)cc3[N+](=O)[O-])n2)cc1 1872746076 QHBILUGJOHFZOU-HKWRFOASSA-N 439.449 4.694 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1 1914354543 ZPQVBQNOLDMXTB-LBPRGKRZSA-N 437.186 4.968 50 10 IJGE CC(C)(CCS(=O)(=O)N(Cc1ccccc1)C1(CBr)CCC1)C1CC1 1915749065 DCIIOJCPBQHWIE-UHFFFAOYSA-N 428.436 4.962 50 10 IJGE O=S(=O)(N[C@@H](CBr)CC1CCCCC1)c1cscc1Br 1926787764 WKEQIQNQINWGHY-LLVKDONJSA-N 445.242 4.523 50 10 IJGE IC[C@@H]1CCC[C@]2(CN(Cc3ccccc3)C3(CCCC3)C2)O1 1939534593 CYHWHSYVHRKIOY-ICSRJNTNSA-N 425.354 4.948 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1Cc1ccc(Br)cc1Br 1943860918 ZNZLZCNEOVRLTP-SKDRFNHKSA-N 425.990 4.959 50 10 IJGE CC[C@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@@H]1Br 2026563379 JOBNCRMMKBCHIK-QWRGUYRKSA-N 428.539 4.550 50 10 IJGE CCC[C@](C)(CCl)NC(=O)c1cc(I)ccc1Br 2029944266 HVCMBNDSBSKUPP-CYBMUJFWSA-N 444.538 4.581 50 10 IJGE O=C(N[C@H](CBr)CC1CC1)c1cccc(Br)c1Br 2031482739 WFWQYMQTOXFXIA-VIFPVBQESA-N 439.973 4.505 50 10 IJGE Cn1ncc(C[C@@H](CBr)c2ccccc2Br)c1Br 2053031696 UPAAAVQDALSOGN-VIFPVBQESA-N 436.973 4.666 50 10 IJGE C[C@]1(NC(=O)c2cccc(Br)c2Br)CCC[C@@H]1Br 2062579204 SIPOSFBIPPOYSU-GWCFXTLKSA-N 439.973 4.648 50 10 IJGE CN(C(=O)c1cc(Br)ccc1Br)C1(CCBr)CC1 2069688457 RAFRDNRZDPIDAF-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE C=CC[C@@H](CBr)CNC(=O)c1cccc(Br)c1Br 2082046529 JXDNGRDXPDQGTR-VIFPVBQESA-N 439.973 4.529 50 10 IJGE CN(C[C@@]1(Br)CC1(F)F)c1cccc(Br)c1CBr 2082522183 SLVPZLZXCPCYQF-NSHDSACASA-N 447.943 4.953 50 10 IJGE CC1(C)OCCO[C@@H]1[C@H](Br)c1ccc(Br)cc1Br 2083338156 MBMADQFAWJWPLW-VXGBXAGGSA-N 442.973 4.842 50 10 IJGE Clc1cc(CN2C[C@H]3[C@H](Br)CC[C@H]3C2)ccc1I 2086662443 VFACIXPHLFXCFA-QJPTWQEYSA-N 440.550 4.550 50 10 IJGE CS(=O)(=O)c1sccc1[C@H](Br)c1ccc(F)c(Br)c1 2094149050 NZPJFFJCQUCVFK-LLVKDONJSA-N 428.142 4.538 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCCCN1C[C@@H](CBr)c1ccccc1 2106781555 IXIXHGIKZONTMK-MOPGFXCFSA-N 425.411 4.934 50 10 IJGE Cc1nn(C)c2sc(C(=O)N(Cc3ccccc3)[C@@H](CBr)C3CC3)cc12 2118614072 RAHFCGCAWGDIJV-KRWDZBQOSA-N 432.387 4.759 50 10 IJGE C[C@@H](CCCl)C(=O)N(CCCNC(=O)OC(C)(C)C)c1cccc(Br)c1 2126194924 LDZBQYRGHWMFMF-AWEZNQCLSA-N 447.801 4.962 50 10 IJGE Cc1cc(Br)c(C)c([C@H](Cl)C2(C)CS(=O)(=O)C2)c1Br 2136383767 IGZUGIZUIRMFMB-LBPRGKRZSA-N 430.589 4.543 50 10 IJGE O=C(N[C@H]1C[C@H]2CC[C@H]1[C@H](Cl)C2)c1cc(Br)c(Br)s1 2139718994 LNJWTCZECUITQO-MFDQJXRNSA-N 427.589 4.799 50 10 IJGE COCC(CCOc1c(Br)cc(Br)cc1CCl)COC 2187552597 WBRNEKLQLAGELZ-UHFFFAOYSA-N 430.564 4.628 50 10 IJGE Clc1cccc(C[C@]23CO[C@](CI)(C2)C3)c1Br 2216264701 ZUJKWDCHZQDMMI-BETUJISGSA-N 427.507 4.629 50 10 IJGE Fc1cc(-c2ncc(CBr)c(C(F)F)n2)ccc1I 2228788309 NLPKNTDOVRIGDQ-UHFFFAOYSA-N 443.004 4.720 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)C[C@@H](C)Br)c(Cl)c1OC 2256333798 SIBZZHIWEXVWPM-CYBMUJFWSA-N 426.738 4.783 50 10 IJGE CN(Cc1ccc(CBr)cc1)Cc1cccc(I)c1 2265621232 VSHQSSPBFUHEDZ-UHFFFAOYSA-N 430.127 4.818 50 10 IJGE O=C1COc2ccc([C@H](Br)c3scc(Br)c3Cl)cc2N1 2279284604 YQMUWCFMHDBTEH-NSHDSACASA-N 437.540 4.979 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@@H](CBr)C12CC2 2282990274 PRPKETXOPDZYDN-QMMMGPOBSA-N 425.523 4.631 50 10 IJGE CC1(C)CCCN(C(=O)c2ccc(Cl)c(I)c2)[C@H]1CCl 2283670470 TYANKUQNYLXWQA-ZDUSSCGKSA-N 426.125 4.814 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@@H](C)[C@@H]1Br 2315552048 YXABYJGQXJUCIT-MSRIBSCDSA-N 442.566 4.796 50 10 IJGE COC(=O)c1ccc(C=C(C#N)c2nc(-c3ccc(OC)c(OC)c3OC)cs2)cc1 2331492862 WOKIQDIHFFIDEU-UHFFFAOYSA-N 436.489 4.687 50 10 IJGE CCN(CC)c1cc(OC)c(/C=C(/C#N)C(=O)NCc2cccs2)cc1Br 33339513 PYOMMMDFPDHVKX-DHDCSXOGSA-N 448.386 4.589 50 10 IJGE Cc1c(C(=O)N2CCCCC2)oc2c1/C(=N/NC(=O)c1ccc(Cl)cc1Cl)CCC2 40813704 JZPNKKDFOQHVQA-KOEQRZSOSA-N 448.350 4.991 50 10 IJGE Cc1nn(C)c(Oc2c(Br)cc([N+](=O)[O-])cc2Br)c1CCl 50441428 SRRRDIJJKYSCRW-UHFFFAOYSA-N 439.491 4.693 50 10 IJGE CC1=C(C#N)C(=O)N(C(C)C)C(=O)/C1=C/c1ccc(-c2ccc(Br)cc2)o1 101333943 ZOPCXYPPAUWXMI-LICLKQGHSA-N 425.282 4.710 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3cccs3)n2-c2ccc(C)cc2)cc1 254551151 ZUNVNEBEARENQD-UHFFFAOYSA-N 447.589 4.855 50 10 IJGE C[C@H]1[C@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1cc(Br)c(Br)s1 686184351 CJXOSNOUTPMAOY-MVHNUAHISA-N 427.589 4.894 50 10 IJGE FC(F)(F)C[C@@H](CCl)Nc1ncc(C(F)(F)F)cc1I 717696555 MDCYMYAPXKCKKU-LURJTMIESA-N 432.533 4.677 50 10 IJGE Cc1ccccc1NNC(=O)c1ccc(C)c(S(=O)(=O)Nc2cc(Cl)ccc2F)c1 746681817 AKHKHPPQISTRLP-UHFFFAOYSA-N 447.919 4.654 50 10 IJGE Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)NNC(=O)c1ccc(Cl)cc1 755936963 DVOWZTQFGLFCGS-UHFFFAOYSA-N 437.887 4.759 50 10 IJGE CCn1c(O)nnc1C1CCN(C(=O)c2ccc(S(F)(F)(F)(F)F)cc2)CC1 760374072 RUJLOESPENJXLH-UHFFFAOYSA-N 426.411 4.681 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=S)Nc3ccc(SC(F)F)cc3)n[nH]2)cc1C 764504995 RMRCVEBRABIXCC-UHFFFAOYSA-N 447.536 4.640 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@H]1CCCN(C(=O)c2ccc3c(c2)nc(O)n3CC2CC2)C1 1275312878 AYGCCNKYTFILRL-SFHVURJKSA-N 429.637 4.778 50 10 IJGE C=CCC[C@@H](C(=O)NNC(=O)COc1ccccc1Cc1ccccc1)c1ccccc1 1306168796 QCJICTBWKJPPPM-XMMPIXPASA-N 428.532 4.554 50 10 IJGE C#C[C@@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Br)cc2)c1C)C(C)(C)C 1460801687 MDOWPAVKQBEMGM-DILWRCETSA-N 438.369 4.928 50 10 IJGE C#CCCCC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)C[C@@H](C)C2 1558513245 PRKYRPALKOKPIL-FXBHHXAOSA-N 427.504 4.515 50 10 IJGE C/C(=C/C(=O)NNc1ccccc1I)c1ccc(C(F)(F)F)cc1 1644637523 OIPAIISUYANCGV-KHPPLWFESA-N 446.210 4.857 50 10 IJGE C#Cc1ccc(NC(=O)CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)cc1 1648498476 INEWQVAKVYZFKL-UHFFFAOYSA-N 427.620 4.573 50 10 IJGE CCc1nn(Cc2ccccc2)c2c1[C@H](c1c(OC)ccc3ccccc13)C(C#N)=C(N)O2 1865687930 DGNDVSQMZWXHBD-DEOSSOPVSA-N 436.515 4.874 50 10 IJGE CCCCCCOc1ccc(/C=N/NC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1OC 1873795166 UVJKAXWFZBKJJV-HLNOYYKJSA-N 447.576 4.504 50 10 IJGE C[C@@H]1CCN(C(=O)OC(C)(C)C)CC[C@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1881376155 ODPQXSWOBMRZOS-RBSFLKMASA-N 435.403 4.558 50 10 IJGE CCCN[C@H](c1sc(Cl)cc1I)[C@@H]1C[C@@H]1Br 1901025476 GZIGEAGFEHTDAC-FWWHASMVSA-N 434.568 4.830 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@@H](C)N(C(=O)OCc2ccccc2)[C@H](C)C1 1905533907 ZHOGIWKHWDFXBC-QWFCFKBJSA-N 425.411 4.775 50 10 IJGE C[C@@]1(CCl)CN(c2cc(Br)c(Br)c(Br)c2)C1=O 1946527080 BOQGLNMZHRDVDR-LLVKDONJSA-N 446.364 4.566 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]3(CC[C@@H](CI)O3)C[C@@H]21 1979566491 JXTHQTSGRCEHRL-LLDVTBCESA-N 435.346 4.539 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1Cc1ccc(I)c(Cl)c1 2026564473 UCTMFOFJFVPYPY-KOLCDFICSA-N 428.539 4.692 50 10 IJGE CC(C)(CBr)CCNC(=O)c1c(Br)cccc1Br 2033086899 QXEKYHPQOMVCJH-UHFFFAOYSA-N 441.989 4.753 50 10 IJGE COC[C@H](C)OC[C@H](Br)Cc1c(Br)cccc1Br 2038123959 NNGANZYNVDRZNS-VHSXEESVSA-N 444.989 4.569 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cc(F)cc(F)c1 2065844785 KYSKPFCFSIBZEH-SFHVURJKSA-N 432.330 4.575 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1C(=O)c1cc(Br)ccc1Br 2073311423 AIHGTFHEDNNWML-UFBFGSQYSA-N 439.973 4.600 50 10 IJGE FC(F)(F)c1ccc(CBr)c(N2CC3(CN(Cc4ccccc4)C3)C2)c1 2099578005 VVINUNZSETWQFX-UHFFFAOYSA-N 425.292 4.923 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1CC[C@H]2CN(Cc3ccccc3)C[C@@H]2C1 2112432252 WILGEOBMXGCNPG-JKSUJKDBSA-N 436.375 4.510 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccccc2)CCN1c1nc(CCl)ccc1Br 2130165199 DKTDUKZNZHQOBH-INIZCTEOSA-N 448.714 4.836 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1CCCl)c1ccc(I)c(Cl)c1 2146741767 ZGTOTBDCYAJNTD-IINYFYTJSA-N 426.125 4.862 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]2CC[C@H](C1)N2C[C@@H](CBr)c1ccccc1 2163063016 OCYAALMBQCSBHF-AFYVEPGGSA-N 437.422 4.933 50 10 IJGE C[C@@H](CCCCCCl)NS(=O)(=O)c1cc(Br)ccc1Br 2174524560 UDCOSPOJRLZPDE-JTQLQIEISA-N 447.620 4.678 50 10 IJGE Brc1cccc([C@H](CI)O[C@H]2C[C@@H](n3cccn3)C2)c1 2183683696 BCGWNUDVGGRIAS-ZNMIVQPWSA-N 447.114 4.542 50 10 IJGE CN[C@@H](c1cc(Br)c(Br)cc1F)C1CC(Br)C1 2213492614 QSDACTGOASFQRX-LBVLNNNDSA-N 429.953 4.785 50 10 IJGE COc1ccc(Br)cc1S(=O)(=O)N(Cc1ccccc1)[C@H](C)CCCl 2220398597 FFTOCFFKACDWBT-CQSZACIVSA-N 446.794 4.666 50 10 IJGE C[C@@H]1[C@@H](C(F)(F)F)N(CCCCCCBr)CCN1C(=O)OC(C)(C)C 2223289496 IQQYXMIJIUWUIV-KGLIPLIRSA-N 431.337 4.814 50 10 IJGE Cc1cncc(CO[C@@H](CI)c2ccc(Br)cc2)c1 2279030837 QQJYRMFFTHAVSV-HNNXBMFYSA-N 432.099 4.845 50 10 IJGE CC(C)(C)CCN(CCBr)Cc1sccc1I 2301077642 ZADAAWASXRGWNE-UHFFFAOYSA-N 430.193 4.986 50 10 IJGE CCOC(=O)CN(C(=O)C(C#N)=Cc1ccc(Br)cc1)c1ccc(Cl)cc1 2324499161 JABURVZVHRXMGI-UHFFFAOYSA-N 447.716 4.606 50 10 IJGE CC(C)N(Cc1ccccc1)C(=O)C(C#N)=CNc1ccc(I)cc1 2324523008 OZQJWPSMERIKQE-UHFFFAOYSA-N 445.304 4.548 50 10 IJGE CCCc1sc(Br)cc1[C@H](Br)C1(S(C)(=O)=O)CCC1 2338030225 SHELVJVXTSZZLP-LBPRGKRZSA-N 430.227 4.866 50 10 IJGE C#CCN(C[C@](C)(CBr)C(C)(C)C)C1CCN(C(=O)OC(C)(C)C)CC1 2352080543 LUIWADCSCDCGIS-NRFANRHFSA-N 429.443 4.768 50 10 IJGE C=CCOc1ccc(Br)c(/C=N/NC(=O)CCc2c[nH]c3ccccc23)c1 20161115 VMMRFVIHFWYECC-ZVHZXABRSA-N 426.314 4.578 50 10 IJGE CN(Cc1cccc(Cl)c1)S(=O)(=O)c1cc(CCl)sc1Br 91269734 YEUTVDXCMQSFMH-UHFFFAOYSA-N 429.188 4.724 50 10 IJGE Cc1ccc(NC(=O)COc2ccc(/C=C(/C#N)C(=O)N[C@@H]3CCCC[C@@H]3C)cc2)cc1 96836418 LTHDIUBJMWFOSZ-LBLCZORZSA-N 431.536 4.614 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)Nc1ccc(CBr)cc1 136877423 JMIVXDALKUUCNN-UHFFFAOYSA-N 425.167 4.515 50 10 IJGE COc1cc(/C=N\NC(=O)c2cccc(N)c2)ccc1OCc1ccc(Cl)c(Cl)c1 169894129 FBXSSECWAFVAQE-ZRGSRPPYSA-N 444.318 4.927 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C\c2ccc(OCC)cc2)c(OC)c1 207114526 LYPLVHWODADJOM-POVPUTRVSA-N 448.519 4.536 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2cccc(OC)c2)sc2c1CC[C@H](CC)C2 209406448 PHMPDLINOGNYPN-ZCQLHAAUSA-N 438.549 4.994 50 10 IJGE Cc1ccc(N/C=C(/C#N)C(=O)Nc2ccc(I)cc2C)c(C)c1 217253889 UIHVGAUQCPUXBW-PTNGSMBKSA-N 431.277 4.675 50 10 IJGE CN(C(=O)c1cc(Br)sc1Br)C(C)(C)CBr 234250942 TUSMRGQVTAMOEV-UHFFFAOYSA-N 433.991 4.519 50 10 IJGE O=C(c1cc(Br)sc1Br)N(CCCl)CC(F)(F)F 236126656 ODOALNVUNDRSJH-UHFFFAOYSA-N 429.483 4.516 50 10 IJGE COc1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)NN=C(C)/C=C/c2ccccc2)cc1 254380805 NCHREFJEXWKMQY-ONBZISEOSA-N 439.515 4.672 50 10 IJGE C[C@H](Cl)c1nc(N)nc(Nc2c(Br)cc(Cl)cc2Br)n1 313570987 VVZPZWWYVPNZPP-BYPYZUCNSA-N 441.942 4.676 50 10 IJGE C[C@@H]1CCN(Cc2cc(Cl)ccc2I)C[C@@H]1CBr 700418765 NLUJKPKURYOOAX-PWSUYJOCSA-N 442.566 4.798 50 10 IJGE C[C@H](NC(=O)NNC(=O)c1ccc(Cl)cc1)c1ccc(OCc2ccc(F)cc2)cc1 728753923 ZPAMHTFZMABPCF-HNNXBMFYSA-N 441.890 4.763 50 10 IJGE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)CSc1ccc(Cl)cc1 1538914921 OMAYLADORAXDNA-ZRDIBKRKSA-N 444.862 4.582 50 10 IJGE BrC[C@H](CN1CCc2nc[nH]c2[C@H]1c1ccc(Br)cc1)C1CC1 1660254934 LYKWDHALISAPTQ-RDTXWAMCSA-N 439.195 4.541 50 10 IJGE Cc1ccc(C(=O)NN=C2CCCc3oc(C(=O)N4CCc5ccccc5C4)c(C)c32)cc1 1772744873 MJFSJKKXKUDPHQ-UHFFFAOYSA-N 441.531 4.565 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)N/N=C\c1ccc(Cl)c([N+](=O)[O-])c1 1865762155 QMTJPQBHMKASFH-VROXFSQNSA-N 430.798 4.661 50 10 IJGE C[C@H]([C@@H]1CCCN(C(=O)OC(C)(C)C)C1)[C@@H](CBr)NC(=O)OC(C)(C)C 1880760295 FPNHVPCILULRSL-RBSFLKMASA-N 435.403 4.558 50 10 IJGE CN(CC(C)(C)CI)C1CCC(N(C)C(=O)OC(C)(C)C)CC1 1904651832 URAOWASHMKZCLT-UHFFFAOYSA-N 438.394 4.558 50 10 IJGE Cc1nsc(Br)c1[C@H](Cl)c1cc2nc(O)[nH]c2cc1Br 1912982406 MBAHCICSLCXUSB-SNVBAGLBSA-N 437.544 4.887 50 10 IJGE C[C@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1Cl 1914349824 CVCLTHLCOXTETL-GFCCVEGCSA-N 437.186 4.921 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1Cc1ccc(Br)cc1Br 2018116689 GDYLARCLVJXEGU-RNCFNFMXSA-N 425.990 4.959 50 10 IJGE CC[C@H](C)[C@H](CBr)NC(=O)c1cc(Br)c(Br)s1 2023035742 NYOZWUFIHZODIH-XPUUQOCRSA-N 448.018 4.813 50 10 IJGE Brc1cnc(N2[C@H]3CCC[C@H](Br)[C@H]2CC3)c(Br)c1 2036550903 BVHINAFBPLXCLH-JBLDHEPKSA-N 438.989 4.891 50 10 IJGE CN1C(=C(C#N)C(=O)COC(=O)CSc2ccccc2Cl)Sc2ccccc21 2040817542 HGAFUXPOWVHYAW-UHFFFAOYSA-N 430.938 4.522 50 10 IJGE CC[C@@H](CBr)CN(C1CC1)[C@@H](CCNC(=O)OC(C)(C)C)C(F)(F)F 2044706439 UGSYAVODDZPSOI-JSGCOSHPSA-N 431.337 4.718 50 10 IJGE COc1cc(C)c(-n2nc(CBr)c(Br)c2C(F)(F)F)c(C)n1 2078914149 MSDHBJSPCVEBQD-UHFFFAOYSA-N 443.061 4.569 50 10 IJGE C[C@H]1C[C@H](Br)CCN(Cc2ccc(I)c(Cl)c2)C1 2086652303 OLYMQZPQEKQFLV-CMPLNLGQSA-N 442.566 4.940 50 10 IJGE O=S1(=O)CCC[C@H]([C@H](Br)c2cc(C3CC3)c(Br)s2)C1 2094669680 STHYTFJVENCBDG-CABZTGNLSA-N 428.211 4.649 50 10 IJGE ClCCc1nc2cncc(Br)c2n1C[C@@H]1CCCN1Cc1ccccc1 2095447950 OQJSENGTSKITKI-INIZCTEOSA-N 433.781 4.640 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CN(CCCCCCCCCBr)CCO2)C1 2163059556 UNRDVSQTKOAHLZ-NRFANRHFSA-N 447.458 4.824 50 10 IJGE O=S(=O)(c1cc(CBr)sc1Br)N1CCCC12CCCC2 2179786848 GVZWMJJIOWAPTE-UHFFFAOYSA-N 443.226 4.503 50 10 IJGE ClCc1nc2cc(Br)cnc2n1CCc1csc(Br)c1 2185151971 RWWAMGFHJVFYBA-UHFFFAOYSA-N 435.572 4.999 50 10 IJGE COC[C@@](C)(CC(CBr)(CBr)c1ccc(Cl)cc1)OC 2198252105 MTQFCLTUIFXKHN-CQSZACIVSA-N 428.592 4.809 50 10 IJGE COc1cc(F)c([C@@H](Cl)c2c(Br)c(C)nn2C)cc1Br 2202902552 RXMUFYMBWFVWEK-GFCCVEGCSA-N 426.511 4.729 50 10 IJGE Br[C@@H]1CC[C@@H]2CCCN(C[C@@H]3CC3(Br)Br)[C@H]2C1 2213090380 FGXZEGDEHZEFQA-YFKTTZPYSA-N 430.022 4.520 50 10 IJGE Cc1cc(Br)c([C@@H](Br)[C@@H]2COCCO2)c(C)c1Br 2220147526 IUDFZUIJBWUPLD-GWCFXTLKSA-N 442.973 4.680 50 10 IJGE Cc1cc(F)c(CBr)c(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1 2283531304 JQFNTUHXFIVVCF-YADHBBJMSA-N 433.365 4.509 50 10 IJGE CC(C)[C@H]1[C@@H](Br)CCN1C(=O)c1cc(Br)c(F)cc1Cl 2285846820 SIAPUQAAFVJCRD-ZANVPECISA-N 427.539 4.876 50 10 IJGE CC(C)(C)C[C@@H](CCl)NC(=O)Cc1cc(Br)cc(Br)c1 2295316388 XPUPXFAXOSLLPJ-ZDUSSCGKSA-N 425.592 4.914 50 10 IJGE C[C@@H]1CN(Cc2sccc2I)CC[C@@H]1CCBr 2301072458 YCFSCHLCGMDEKD-MNOVXSKESA-N 428.177 4.596 50 10 IJGE ClC[C@@H](CC1CC1)NCc1ccc(I)c(Br)c1 2306222277 RXWZOOGIVCDKHB-LLVKDONJSA-N 428.539 4.551 50 10 IJGE CC1(C)[C@@H](Br)CCN1Cc1cc(I)ccc1Cl 2307324041 HIWJSUUQTCKMLF-LBPRGKRZSA-N 428.539 4.692 50 10 IJGE CCCOc1c(OC)cc(C=NNC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)cc1[N+](=O)[O-] 2323138479 AACRTWSRDCKDMW-MDQWUCQQSA-N 443.544 4.839 50 10 IJGE N#CC(=Cc1cccc(F)c1)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 2324510622 CMVKPQHFEIVAJP-UHFFFAOYSA-N 425.507 4.666 50 10 IJGE F[C@@]1(CCl)CCCN(Cc2ccc(I)c(Br)c2)C1 2325225684 HWJYRCRYEKTLID-CYBMUJFWSA-N 446.529 4.597 50 10 IJGE Cl[C@H]1CCN(Cc2ccc(I)c(Br)c2)[C@@H]1C1CC1 2325234536 YUUWROIBNOEDTI-GXTWGEPZSA-N 440.550 4.645 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H](C)N(c2c(CBr)c(C(F)F)nn2C)C1 2365332642 JYFAUFRTDQJENX-GJZGRUSLSA-N 441.364 4.599 50 10 IJGE Cc1cc(S(=O)(=O)Nc2cccc(CBr)c2)sc1Br 137114405 KPXODZXGOXPHCR-UHFFFAOYSA-N 425.167 4.515 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)c3c2[C@H](c2ccc(F)cc2)C(C#N)=C(N)O3)cc1 143643352 RCVFMHJNRULPOD-JOCHJYFZSA-N 438.462 4.905 50 10 IJGE C[C@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2Br)CC[C@@H]1Br 167754338 MNMZEMUHLNUMDD-KWQFWETISA-N 429.074 4.713 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccccc2N)ccc1OCc1ccc(C(C)(C)C)cc1 169893776 NWQQEARFYUYJRI-NTFVMDSBSA-N 431.536 4.918 50 10 IJGE CC(C)COc1c(Cl)cc(/C=N\NC(=O)c2ccc3nc(N)sc3c2)cc1Cl 169916859 VDGJRIHZTHQXDL-NYAPKIOYSA-N 437.352 4.984 50 10 IJGE CCCCCOc1ccc(/C=N\NC(=O)c2ccc3nc(S)[nH]c3c2)cc1OCC 169917537 XOAIFCHBVVLEBY-UCQKPKSFSA-N 426.542 4.583 50 10 IJGE CCCOc1ccc(/C=N\NC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc1[N+](=O)[O-] 169917892 YOCXEAAOORBSGY-UUYOSTAYSA-N 441.513 4.524 50 10 IJGE CCN(CC)c1ccc(N/C=C(/C#N)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 217229602 DLACYVYGJVQROM-SQFISAMPSA-N 427.892 4.861 50 10 IJGE CC(C)N(CCCBr)C(=O)c1ccc(I)c(Cl)c1 232347940 FQMFEKUIVMDBCR-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE FC1(F)CC([C@@H](Br)c2cc(I)cc3c2OCC3)C1 383349125 DEMXJOAGPHBWNQ-LLVKDONJSA-N 429.042 4.707 50 10 IJGE O=C(c1ccc(Br)cc1Cl)N1CCC(F)(F)[C@H](CBr)C1 404023343 ZQFJGMXDULCWLN-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE C[C@H]1C[C@H](Br)CCN1Cc1cc(Cl)ccc1I 705503742 YENMUOVVAMKURH-GXSJLCMTSA-N 428.539 4.692 50 10 IJGE CCS[C@@H]1CC[C@@H](N(C)C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)C1 742908419 AYHNZJINOYGQME-ZSJUVENKSA-N 433.581 4.503 50 10 IJGE Cc1nc(-c2ccc(NC(=O)NNC(=O)c3cc(-c4ccc(C)c(C)c4)[nH]n3)cc2)cs1 755550793 PXALOHQGEYRZGZ-UHFFFAOYSA-N 446.536 4.592 50 10 IJGE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NNc1ccccc1OC(F)(F)F 779200452 DVDYLXRHZHLFJN-UHFFFAOYSA-N 447.442 4.510 50 10 IJGE O=C(NNc1c(Br)cccc1Br)c1c[nH]c2cccc(F)c12 801502118 YWJCUXYEUVJBAZ-UHFFFAOYSA-N 427.071 4.589 50 10 IJGE C#CCn1ccc(CN(CC)C(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(Cl)c3)c2C)n1 1297349908 JSTCDORVBJJRNE-STZFKDTASA-N 445.954 4.533 50 10 IJGE O=C(NNC(=O)c1ccccc1Sc1ccccc1)c1ccc(Br)cc1 1318748934 OIRRRHXTXVNDRH-UHFFFAOYSA-N 427.323 4.675 50 10 IJGE C=CCOc1ccccc1CNC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(OC)cc2)c1C 1360571719 CANJZHILCPCAHP-XQNSMLJCSA-N 441.531 4.891 50 10 IJGE CCc1cccc(C)c1NC(=S)NNC(=O)c1ccc(-c2cccc(Cl)c2)nc1O 1539202592 JUHAPWGYLDUAEW-UHFFFAOYSA-N 440.956 4.610 50 10 IJGE COc1ccc(-n2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2ccccc2Cl)cc1 1865686577 YAKNNYIKQFJIRQ-INIZCTEOSA-N 446.816 4.771 50 10 IJGE CCCc1nn(Cc2cccc(F)c2)c2c1[C@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865700405 SCDRKUVDAFMEQK-QFIPXVFZSA-N 427.483 4.722 50 10 IJGE COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2Cc1ccccc1 1865710222 RBMKZSVOZBVKRJ-HSZRJFAPSA-N 434.499 4.825 50 10 IJGE Cc1nn(-c2ccc(Cl)cc2)c2c1[C@@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 1865714781 PZKJRQVNCILFNP-SFHVURJKSA-N 441.716 4.815 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)c1ccccc1Br 1865755302 QSGVHKHXWOPIJV-UHFFFAOYSA-N 444.716 4.548 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)c1cc2ccccc2[nH]1 1865759664 LPKDJXDCHBCHTA-UHFFFAOYSA-N 439.302 4.920 50 10 IJGE C[C@@H](NC(=O)c1ccccc1OCc1ccccc1)c1nnc(CBr)s1 1877571370 OHLUBGLSLGRBGK-CYBMUJFWSA-N 432.343 4.503 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)C(=O)c1ccc(Br)c(O)c1 1914230223 VIMRGFNWTVWKEQ-LBPRGKRZSA-N 427.136 4.581 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2cnccc12 1915300442 OAQKLYPTFRAAKU-HXUWFJFHSA-N 447.398 4.845 50 10 IJGE C[C@@]1([C@@H](Br)c2sc(Br)cc2Br)COCCO1 1992638162 IISFXCVDSRYNAH-UWVGGRQHSA-N 434.975 4.515 50 10 IJGE CC1(C)C[C@@H](O[C@@H](CI)c2ccccc2Br)CO1 2052239228 FMGDJCILVOVKEZ-MFKMUULPSA-N 425.104 4.509 50 10 IJGE C[C@@H]1CCCN(c2ncc(I)cc2Br)[C@H]1CCCl 2069527304 BDOXWSXEPSRBQB-SKDRFNHKSA-N 443.554 4.683 50 10 IJGE CC(C)(C)[C@H]1C[C@H](CBr)CN(c2ccc(I)cn2)C1 2108720060 PCBXGYVOKCRXKN-NEPJUHHUSA-N 437.163 4.570 50 10 IJGE CN(C(=O)OC(C)(C)C)C1CCC(N(C)C(=O)[C@@H](Br)C2CCCC2)CC1 2110715564 OGDNCNDRSBBEHQ-JCYILVPMSA-N 431.415 4.577 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]32 2134557597 JNXUHLJRJVSLGQ-IUERJPNZSA-N 431.111 4.564 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CNC(=O)c1ccc(CBr)cc1)c1ccccc1 2162494721 MFRXLMWNWGIVMA-SFHVURJKSA-N 433.346 4.577 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1C(=O)c1ccc(CBr)cc1 2162870923 GTOXSEBJVMDZAY-SFHVURJKSA-N 439.394 4.689 50 10 IJGE CC(C)(C)OC(=O)N1CCCN(C[C@H](CBr)c2ccccc2)CC(F)(F)C1 2163063138 OMGDLIINGPCBAI-KRWDZBQOSA-N 447.364 4.743 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CCCCCCCCCBr)[C@]2(CCOC2)C1 2163065084 XHFKGESHXVHHSC-WIYYLYMNSA-N 447.458 4.870 50 10 IJGE BrC[C@H]1CC2(CCCC2)CN1C[C@@H]1CC1(Br)Br 2213087927 KKLRHUCHHBDFDF-WDEREUQCSA-N 430.022 4.522 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1ccc(C(F)(F)F)s1 2263311820 NAPRGCYQQOPRLZ-CYBMUJFWSA-N 436.293 4.819 50 10 IJGE CC1CC(CBr)(CN(CC2CCN(C(=O)OC(C)(C)C)CC2)C2CC2)C1 2265311909 MKHHDFTZOMABMM-UHFFFAOYSA-N 429.443 4.909 50 10 IJGE CCC(CBr)(CBr)NC(=O)c1cc(Cl)c(Cl)cc1C 2270961211 VWXYCFYKKGINDC-UHFFFAOYSA-N 431.983 4.970 50 10 IJGE N#CC(C(=O)Nc1ccc(F)cc1)=C1S[C@@H](Cc2ccccc2)C(=O)N1c1ccccc1 2296552195 WFBDMLGIYWDYGW-QFIPXVFZSA-N 443.503 4.891 50 10 IJGE CNC(=O)C(C#N)=Cc1ccc(-c2ccc(C34CC5CC(CC(C5)C3)C4)cc2[N+](=O)[O-])o1 2313549288 RVJHGAUXLYIKHJ-UHFFFAOYSA-N 431.492 4.976 50 10 IJGE COc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)C=Cc3ccc(C)cc3)ccc21 2314634288 XKTDVQKFUKOBGM-AREMUKBSSA-N 438.483 4.841 50 10 IJGE CCOC(=O)C(C#N)=Cc1cccc(OC(=O)[C@H](C)Oc2cc(C)c(Cl)c(C)c2)c1 2314770764 YVSPMBGSZGBZGD-INIZCTEOSA-N 427.884 4.800 50 10 IJGE C[C@@H]1CCCN(Cc2ccc(Cl)c(I)c2)[C@H]1CBr 2315551760 VTJJWNVPRASOKG-YGRLFVJLSA-N 442.566 4.940 50 10 IJGE C[C@@]1(CNCc2ccc(I)c(Br)c2)CCC[C@@H]1Cl 2325228413 HSQRPGSIEWRLIT-KBPBESRZSA-N 442.566 4.941 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1Cc2ccccc2N(C[C@]2(CBr)CC2(F)F)C1 2379985100 FKMHLIJIPJELIU-AUUYWEPGSA-N 445.348 4.610 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4F)ccc32)cc1 38685904 JQZCTJJOPVHPRM-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE CCCCOc1ccc(/C=C\C(=O)Oc2ccc(/C=C(\C#N)C(=O)OCC)cc2OC)cc1 206271356 BRECDANOPXUCHT-POVPUTRVSA-N 449.503 4.963 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1Br)c1cc(Br)cc(Br)c1 232486872 IIULIMXBGJAWFJ-VXGBXAGGSA-N 439.973 4.648 50 10 IJGE CCC(CBr)(CBr)NC(=O)Cc1ccc(Cl)c(Cl)c1 232843074 PDYPYRIURXUKNY-UHFFFAOYSA-N 431.983 4.591 50 10 IJGE CCn1c(SCC(=O)NN=Cc2sccc2C)nnc1-c1ccc(C(C)(C)C)cc1 254824466 FKDPQHYDNSRBPJ-UHFFFAOYSA-N 441.626 4.875 50 10 IJGE COc1ccc(OC)c(C=NNC(=O)COc2ccc(C(C)(C)CC(C)(C)C)cc2)c1 256017544 RSDDOCMRUGGXBW-UHFFFAOYSA-N 426.557 4.947 50 10 IJGE C[C@H](Br)CN(C(=O)c1ccc(Br)cc1Br)C1CC1 691365092 MCZWTTPQWDBZPT-QMMMGPOBSA-N 439.973 4.600 50 10 IJGE O=C(NNc1ccc(F)cc1Br)c1cnc(-c2ccc(F)c(F)c2)s1 780655789 ADPDURCORPPBBY-UHFFFAOYSA-N 428.233 4.747 50 10 IJGE CSc1ccc([C@H](C)NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cc1 799038050 FHVUMZDHLCJTNX-IGCAKMCNSA-N 441.560 4.970 50 10 IJGE CC(=C/c1cccc(C(F)(F)F)c1)/C=C(\C#N)C(=O)Nc1ccc(C(=O)N(C)C)cc1 806571393 UROAHFUVQAFCMI-DARJFKRNSA-N 427.426 4.899 50 10 IJGE CCOC(=O)[C@](C)(CC)n1nc([C@H](C)O[Si](C)(C)C)nc1[C@H](C)O[Si](C)(C)C 1078341119 OEWOHBKIZHWRIV-DOXZYTNZSA-N 429.710 4.791 50 10 IJGE Cc1ccc(N(CC(=O)NN=C2CCCC[C@@H]2C)S(=O)(=O)c2ccccc2)cc1Cl 1084598976 LIEVUWRKBIIYEL-KRWDZBQOSA-N 447.988 4.526 50 10 IJGE CC(C)(C)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC=C(C#N)CC1 1295164068 CCBTUKYUWNPEBF-XMMPIXPASA-N 443.547 4.622 50 10 IJGE CC(=O)c1ccc(CCNC(=O)/C(C#N)=C\c2cc(C)n(-c3ccccc3F)c2C)cc1 1466358982 ULTWUXLVHGBHSK-HAHDFKILSA-N 429.495 4.702 50 10 IJGE C=C(C)[C@H](CC(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12)OCC 1625006979 YLBRCGVKMJWGFY-QFIPXVFZSA-N 437.927 4.688 50 10 IJGE Cc1cccc(NNC(=O)CSCc2nc(O)c3c4c(sc3n2)CCCC4)c1Cl 1646168663 LVNWVZUCNPMHIP-UHFFFAOYSA-N 449.001 4.614 50 10 IJGE CCOC(=O)NN=C1CCCc2oc(C(=O)NN(c3ccccc3)c3ccccc3)c(C)c21 1772750901 CEEZLIPFKULNOJ-UHFFFAOYSA-N 446.507 4.858 50 10 IJGE COc1ccc(C(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)cc1OC 1860391428 GMGBVKKXWYTVCG-UHFFFAOYSA-N 432.501 4.660 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccc(Cl)cc2)[C@@H]1c1cccnc1 1865699729 BAIFXXDNTUURJC-OAQYLSRUSA-N 439.906 4.865 50 10 IJGE Cc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2cc(Br)ccc2F)cc1 1865702535 WQOCZSRXPRTHBH-IBGZPJMESA-N 439.288 4.609 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1cccc(F)c1)C(C#N)=C(N)O2 1865710968 MQNBERNPHVJPSN-IBGZPJMESA-N 426.854 4.644 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCC2(CCC2)N(C(=O)OC(C)(C)C)C1 1882087389 JJLGRYLEHNPUCR-GJZGRUSLSA-N 447.414 4.844 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CC[C@H]2C[C@H]2C1)C(=O)OC(C)(C)C 1917418954 CNVKOIXZDYYZHY-AFIMGQEJSA-N 437.362 4.642 50 10 IJGE CN(Cc1cccc(Br)c1Br)C[C@@H](Br)C1CC1 1943885509 WKMGEMBEOICBLY-GFCCVEGCSA-N 425.990 4.817 50 10 IJGE O=C(NC[C@@H](Br)C1CCC1)c1csc(Br)c1Br 1945186765 MJBDXIUKHYQECT-MRVPVSSYSA-N 446.002 4.567 50 10 IJGE Cc1c(Cl)cc(CN[C@H](CI)C(C)C)cc1Br 2002244498 OWUKMIBKXJKWQT-CYBMUJFWSA-N 430.555 4.960 50 10 IJGE Cc1cc(CNCCSSCCNC(=O)OC(C)(C)C)ccc1Br 2010825400 KMEIYHPHFMAWNY-UHFFFAOYSA-N 435.453 4.753 50 10 IJGE C[C@@]1(CBr)CCN(Cc2ccc(I)c(Cl)c2)C1 2026567337 QYLIYRIEEWFYEQ-ZDUSSCGKSA-N 428.539 4.552 50 10 IJGE COCCOC[C@H](Br)CCc1cc(Br)ccc1Br 2054719294 RICGCVKVAXFMAP-GFCCVEGCSA-N 444.989 4.571 50 10 IJGE BrC[C@]1(Cc2cc(Br)ccc2Br)C[C@]12CCOC2 2054720900 ZYXFZFAZPQZGMP-KBPBESRZSA-N 438.985 4.946 50 10 IJGE CC(C)Cc1cc(CBr)n(Cc2ccc(I)cc2)n1 2070049062 SSOCZAKVNLCUTP-UHFFFAOYSA-N 433.131 4.629 50 10 IJGE CC(C)[C@@H](Br)C(=O)N1C[C@H](NC(=O)OC(C)(C)C)CC12CCCCCC2 2106597076 NCLOKGIJTVNSBW-HZPDHXFCSA-N 431.415 4.625 50 10 IJGE Cc1cc(C(=O)N2C3CCC2([C@@H](C)Br)CC3)ccc1I 2207097646 QWGNEAFRLSERLQ-FFKNIBCLSA-N 448.142 4.520 50 10 IJGE Fc1cc(Br)cc2c1nc(CCCl)n2-c1cnn(Cc2ccccc2)c1 2224706121 JEEVNUNWWRKNRB-UHFFFAOYSA-N 433.712 4.953 50 10 IJGE O=[N+]([O-])c1cc(N2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)ccc1CBr 2234714216 CBSLUYSADQFSLV-BGYRXZFFSA-N 430.346 4.733 50 10 IJGE CCN[C@H](Cc1cc(Br)cc(Br)c1)[C@H]1C[C@H](Br)C1 2263519524 SQANLMRKDWJQGL-LERXQTSPSA-N 440.017 4.906 50 10 IJGE Cc1ccc(CBr)cc1NC(=O)c1ccc(I)cc1 2278649123 BUVFTDZKFSJQJH-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE C[C@H]1C[C@@H](Br)CCN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282977529 CXJDJEDVPSJWJQ-IUCAKERBSA-N 427.539 4.877 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl 2314345941 ZCXSBFOQXCCYTF-UHFFFAOYSA-N 431.758 4.933 50 10 IJGE CC[C@H]1[C@@H](CBr)CCN1Cc1ccc(Cl)cc1I 2318526369 IUMAXGBHBHRXTJ-YGRLFVJLSA-N 442.566 4.940 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccsc1C(F)(F)F 2320357550 CHOKNUNKYGKAOO-ZDUSSCGKSA-N 436.293 4.867 50 10 IJGE N#CC(=Cc1ccc(Br)cc1)C(=O)NCC1(c2ccc(F)c(F)c2F)CC1 2329659983 KFZWLKDBDIQOIU-UHFFFAOYSA-N 435.243 4.621 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H](CNC(=O)OC(C)(C)C)C3(CCC3)C2)C1 2345004356 JOLRCGFMWVMOCM-MRXNPFEDSA-N 429.443 4.815 50 10 IJGE CC[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CN1CC1(CBr)CC(C)(C)C1 2345009462 DWCUKJCUEJZORF-IXDOHACOSA-N 429.443 4.765 50 10 IJGE O=C(NNC(=O)C(c1ccccc1)c1ccccc1)c1ccc(NC(=O)c2ccccc2)cc1 13982192 JJCVXOYNWOVBCM-UHFFFAOYSA-N 449.510 4.532 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)c2ccc(C)c(Br)c2)cc1 14025460 KHRRWRUPJWQXGB-UHFFFAOYSA-N 433.346 4.791 50 10 IJGE CCOC(=O)C1=C(c2ccc(OC)cc2)OC(N)=C(C#N)[C@@H]1c1c(Cl)cccc1Cl 35576443 MWMJYZDMBDLOMI-QGZVFWFLSA-N 445.302 4.784 50 10 IJGE CSc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4F)ccc32)cc1 38682537 QWFZVWIOFUWTOX-QFIPXVFZSA-N 432.476 4.985 50 10 IJGE O=C1COc2ccc([C@H](Br)c3ccc(Br)cc3Cl)cc2N1 40288760 QEWWFDZGEWHFAT-HNNXBMFYSA-N 431.511 4.918 50 10 IJGE COc1ccc(C(=O)Nc2ccc(P(=O)(c3ccccc3)c3ccccc3)cc2)cc1 196129608 AJYWQFWUMFDDIF-UHFFFAOYSA-N 427.440 4.587 50 10 IJGE COc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccs2)cc1 205646788 FOUBXOKWNIINKE-PNTRTRKCSA-N 430.485 4.594 50 10 IJGE CC(C)N(CCCBr)C(=O)c1cc(Br)cc(Br)c1 232649089 AMZSRFSBGCBIHZ-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE C[C@@H]1CCN(C(=O)c2cc(Br)sc2Br)[C@H]1CBr 235335092 GMWDNJCIFSZZJE-SVRRBLITSA-N 446.002 4.519 50 10 IJGE O=C(NN=Cc1ccc(I)o1)c1cc2c(ccc3ccccc32)o1 252597250 CQLKEAWENSYUGF-UHFFFAOYSA-N 430.201 4.548 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N=CN3CCCC3)Oc3c2c(C)nn3-c2ccccc2)cc1 254434909 RTSROBOITGWNOH-DEOSSOPVSA-N 439.519 4.573 50 10 IJGE C[C@@]1(CI)CC[C@@](C)(c2ccc(I)cc2)O1 309350935 BSPLKVLJVCEUMH-STQMWFEESA-N 442.078 4.511 50 10 IJGE CO[C@@H](CO[C@H](CI)c1cccc(Br)c1)C(C)C 386715836 WRZBIAFXWXDCEV-KGLIPLIRSA-N 427.120 4.613 50 10 IJGE CN(Cc1cc(Cl)ccc1I)C[C@@H]1CCC[C@H]1Br 708342398 RUWHNOFWARTHMX-GXFFZTMASA-N 442.566 4.940 50 10 IJGE O=C(Cc1ccc(Cl)c(F)c1)NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl 790513165 NGDRWYMXTDGUCU-UHFFFAOYSA-N 440.249 4.712 50 10 IJGE O=C(NNc1cccc(F)c1Br)c1cc2ccc(C(F)(F)F)cc2nc1O 1594533968 MNNRBQDMWPWBPB-UHFFFAOYSA-N 444.182 4.618 50 10 IJGE Cc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccccc1F)C(C#N)=C(N)O2 1865681554 QJTDMWXOFOCPIQ-IBGZPJMESA-N 429.282 4.904 50 10 IJGE Cc1ccc(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2c[nH]c3ccccc23)cc1 1865700434 SSVHTXIVUFEQGG-IBGZPJMESA-N 449.436 4.958 50 10 IJGE N#C/C(=C(/O)CN1C(=O)COc2ccc(Cl)cc21)c1nc(-c2cccs2)cs1 1872750234 CRRPREBWCBSPAS-QINSGFPZSA-N 429.910 4.743 50 10 IJGE C[C@@H](c1ccc(F)c(Br)c1)[C@@H](CBr)NC(=O)OC(C)(C)C 1885093147 KWYIBMHSWPUJPS-TVQRCGJNSA-N 425.136 4.980 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2cnccc12 1915095136 SDARCXYDDOVCKA-MRXNPFEDSA-N 433.371 4.599 50 10 IJGE O=C(Nc1ccc(F)c(CBr)c1)c1sccc1I 1924909075 DKVBSTWZUHSOKM-UHFFFAOYSA-N 440.075 4.639 50 10 IJGE Cn1nc([C@H](Br)c2ccc(F)c(Br)c2F)cc1Br 2033080748 WULSTMWBDWMMNX-SECBINFHSA-N 444.899 4.708 50 10 IJGE O=C(N[C@H](CBr)C1CCC1)c1c(Br)cccc1Br 2033086280 KLTCRHZKYIXYOL-LLVKDONJSA-N 439.973 4.505 50 10 IJGE Clc1c(Br)sc(Br)c1[C@H](Cl)[C@@H]1CO[C@@H]2COC[C@H]21 2040325988 OKHHADRTWKEMMJ-LENIQADQSA-N 436.980 4.868 50 10 IJGE Brc1cccc(Br)c1CN1C[C@@H]2C[C@H](C[C@H]2Br)C1 2045154733 RGIPIERHXFRDBS-ISTVAULSSA-N 438.001 4.817 50 10 IJGE FC(F)Oc1cc(CBr)cc(OC(F)(F)F)c1I 2060219792 GQSFQUNALCJZJD-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE O=C(c1sccc1I)N1CCCC[C@H]1CCCBr 2085689112 XFXKCXGYFBRMHK-JTQLQIEISA-N 442.160 4.523 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@H]2CC[C@@H](Cl)[C@H]1C2 2093944880 RDZFBNGIKDXERR-SZEHBUNVSA-N 427.589 4.895 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@@H]2CCC[C@@H](Cl)[C@H]2C1 2094592417 VXXHBTGOQSJNEW-OYNCUSHFSA-N 427.589 4.753 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2Cc1nccn1Cc1ccccc1 2096814974 UCNFDUPBZUXRNV-UHFFFAOYSA-N 430.737 4.534 50 10 IJGE Br[C@@H](CCc1ccc(I)cc1)CN1CCCCCC1 2099448635 ADVWRPDDKQJKKX-HNNXBMFYSA-N 436.175 4.863 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 2106784871 LRLFSRRTUKYDFU-IPMKNSEASA-N 425.411 4.933 50 10 IJGE COc1cc(Cl)c([C@@H](Br)c2cnc(Cl)n2C)cc1Br 2137644761 GBOVWZRVAWGPAM-LLVKDONJSA-N 428.939 4.982 50 10 IJGE CN([C@H]1CC[C@H]1OCc1ccccc1)S(=O)(=O)c1cc(Cl)cc(CCl)c1F 2156443216 PYYDVSQGNWTJAX-DLBZAZTESA-N 432.344 4.586 50 10 IJGE CN(Cc1ccc(CNC(=O)[C@H](Br)C2CCCC2)cc1)C(=O)OC(C)(C)C 2167032976 OWOAXIOGILPAQI-GOSISDBHSA-N 439.394 4.623 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H]2CCO[C@@]2(CNC(=O)OC(C)(C)C)C1 2175181491 HUVSPNZXADXXCV-UWJYYQICSA-N 447.458 4.584 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2C1[C@@H]2CN(Cc3ccccc3)C[C@@H]12 2224711556 XNQQAOFOCRIJIH-HUUCEWRRSA-N 434.740 4.980 50 10 IJGE O=[N+]([O-])c1cc(CBr)ccc1N1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1 2234715502 NFABKHJSAHTZJC-KDURUIRLSA-N 430.346 4.733 50 10 IJGE Cc1ccc(I)c(C(=O)N2C[C@@H](Br)CC23CCCC3)c1 2241039188 JDIIABPAYSZAAT-LBPRGKRZSA-N 448.142 4.522 50 10 IJGE ICCCCN1CCC[C@]2(CCCN(Cc3ccccc3)C2)C1 2243591791 ZJRHLTLBVALBQB-FQEVSTJZSA-N 426.386 4.580 50 10 IJGE CCCN(C[C@H](C)Cl)C(=O)c1ccc(Br)cc1I 2259769240 MTAPSPMXYRSVDO-VIFPVBQESA-N 444.538 4.533 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@H]2[C@H]3CCOC[C@H]32)c1 2263519218 OVIPCZRMKQZRID-RFQIPJPRSA-N 438.985 4.800 50 10 IJGE CN(CC1(CBr)CC(F)C1)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 2265631916 ICRIZTLWKPGNKK-OHTSDLOESA-N 429.374 4.697 50 10 IJGE COc1ccc(CNC(=O)C(C#N)=Cc2ccc(OCc3ccc(C)cc3)c(OC)c2)cc1 2313681078 FGQKMUKVKLYGLJ-UHFFFAOYSA-N 442.515 4.815 50 10 IJGE CC1=C(C#N)C(=O)N([C@H](C)c2ccccc2)C(=O)C1=CNc1cccc(Br)c1 2314585691 MYSKRYPPLPCIJB-OAHLLOKOSA-N 436.309 4.715 50 10 IJGE Cc1ccc(COc2ccccc2C=NNC(=O)c2cc(-c3cccs3)nc(O)n2)cc1 2323700787 GCQQXWLZAUAKMD-UHFFFAOYSA-N 444.516 4.562 50 10 IJGE COc1cc(C=NNC(=O)Nc2ccccc2C)cc([N+](=O)[O-])c1OCc1ccccc1C 2323840024 BFFHAEPTZWNXHM-UHFFFAOYSA-N 448.479 4.955 50 10 IJGE COc1cc(Cl)c([C@H](Cl)c2c(Br)ncn2C)cc1Br 2337275534 WNVZFUWXAMOUGQ-JTQLQIEISA-N 428.939 4.935 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Br)c3ccc(Cl)cc3F)cc2[nH]1 109884262 IWSWAUSJBPAZTE-CYBMUJFWSA-N 434.490 4.896 50 10 IJGE CC[C@@](C)(CBr)NC(=O)c1cc(Br)ccc1Br 161224019 ZUIFRHWASCKUHM-LBPRGKRZSA-N 427.962 4.505 50 10 IJGE O=C=NC[C@H]1CCC[C@H](CNC(=O)N2CCC(c3cc4cc(Cl)ccc4[nH]3)CC2)C1 170288670 JDNVHLFPNWZRHW-IRXDYDNUSA-N 428.964 4.853 50 10 IJGE Fc1cc2c(cc1I)nc(CCCl)n2CC1CCSCC1 229327538 GJLFXKVQQHWEFR-UHFFFAOYSA-N 438.737 4.705 50 10 IJGE COc1cc([C@H](C)[C@@H](Br)C(C)=O)c(Br)cc1Br 234800439 GGFFTIGDJMAKSZ-PWCHPLFNSA-N 428.946 4.676 50 10 IJGE O=C(COc1ccc2ccccc2c1)NN=Cc1ccc(OC(=O)c2ccccc2F)cc1 254738649 IHPYLZGMUSMAIO-UHFFFAOYSA-N 442.446 4.727 50 10 IJGE C[C@H](Br)C[C@H](C)CNC(=O)c1cc(Br)c(Br)s1 397720111 JNCYKQMZADKNJF-BQBZGAKWSA-N 448.018 4.813 50 10 IJGE ClCc1ccc(Br)cc1N1CCO[C@H]2CCN(Cc3ccccc3)C[C@H]21 404140999 FUMMNFMIXLGDHS-RTWAWAEBSA-N 435.793 4.668 50 10 IJGE FC(F)(F)c1cc(Br)c(I)cc1CBr 575691896 PONYYAWHWKBCQC-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1ccccc1[C@@H]1CCc2ccccc2N1S(N)(=O)=O 616594426 HGBJSSXGFVKICJ-QFIPXVFZSA-N 446.689 4.948 50 10 IJGE CC(C)[C@@H](CBr)CNC(=O)c1scc(Br)c1Br 705438909 MBCCJWFCWMTAEH-ZETCQYMHSA-N 448.018 4.670 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1nc3sccn3c1CBr)C2 705962856 MORLNJHKIVSHQH-OYRHEFFESA-N 445.430 4.639 50 10 IJGE N#Cc1ccc(NNC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)c(C(F)(F)F)c1 799750640 JSHIIQUXWMBHMK-QWHCGFSZSA-N 429.320 4.722 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Oc2ccc(-c3nnco3)cc2)c(C)n1-c1ccc(F)cc1 904536833 DKQXIRSBBSTFKU-UNOMPAQXSA-N 428.423 4.796 50 10 IJGE COc1cc(Cl)c(Br)cc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 1256581147 LIBDCGISYCOSNM-UHFFFAOYSA-N 448.626 4.758 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2cnc(-c3ccccc3)s2)c(C)n1C[C@@H]1CCCO1 1318996309 DFDMDFNXEMUYNX-ATEMXAKRSA-N 446.576 4.631 50 10 IJGE C#CCC1(NC(=O)/C(C#N)=C\c2cc(C)n(-c3cccc4ccccc34)c2C)CCOCC1 1535310820 UHNQWQCHMGLDEO-MOHJPFBDSA-N 437.543 4.843 50 10 IJGE C=CC[C@@H](C(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(C)c1C)c1ccccc1 1628001298 WLSMZARSCMWFCI-OAQYLSRUSA-N 438.531 4.806 50 10 IJGE O=C(CCSCc1nc(O)c2ccccc2n1)NNc1ccccc1Oc1ccccc1 1640865858 IYTCEBWPQYTMKV-UHFFFAOYSA-N 446.532 4.894 50 10 IJGE C=C[C@@H](CC(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1)c1ccccc1 1641052936 QATKQLFJLYEYQQ-KRWDZBQOSA-N 430.533 4.516 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2ccc(Br)cc2Cl)cc1)C1CC1 1671944943 NOHWVKRVWJJJAN-UHFFFAOYSA-N 437.725 4.766 50 10 IJGE CC(C)(C)c1ccc(OCCCC(=O)NN=Cc2cccc(O)c2)c(Br)c1 1772755521 KQWDQGWLUFHWCP-UHFFFAOYSA-N 433.346 4.762 50 10 IJGE CCCc1nn(Cc2ccccc2F)c2c1[C@@H](c1ccc(OCC)cc1)C(C#N)=C(N)O2 1865694352 UFSCPXSKSRQJJT-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)n2)cc1C 1872746405 GQVDHJLBEBYKMP-MNDPQUGUSA-N 438.421 4.893 50 10 IJGE CC1(C)C[C@@H](N(Cc2ccccc2)S(=O)(=O)c2ccc(Cl)c(CCl)c2)CO1 1915480547 JMMRDEUSJXZSCI-QGZVFWFLSA-N 428.381 4.837 50 10 IJGE O=S1(=O)CC[C@@H]([C@H](Br)c2c(Cl)sc(Br)c2Cl)C1 1925570090 AYWSGRDPSPNCHS-XINAWCOVSA-N 443.009 4.688 50 10 IJGE CC(C)[C@@H](Br)CCNC(=O)c1scc(Br)c1Br 1942750499 JZPFEPVRYLCACS-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@H]2CCCCN(C[C@@H](CBr)C3CCC3)C2)C1 1966480596 CKNFHIVAFWRPCS-ZWKOTPCHSA-N 429.443 4.767 50 10 IJGE ClCc1c(Cl)ncn1-c1ccc(Br)c(I)c1 1982521542 FGYVNYSWDFHYLV-UHFFFAOYSA-N 431.886 4.632 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC[C@](C)(CI)O2)[C@H]2CCCC[C@@H]21 1984441676 MTIUHMJLFWCYBJ-LBTBCDHLSA-N 435.346 4.539 50 10 IJGE O=S(=O)([C@@H]1CC[C@@H](CBr)C1)N(Cc1ccccc1)Cc1cccs1 2009647589 VLJWKEBWDRUKKN-SJLPKXTDSA-N 428.417 4.644 50 10 IJGE CC(F)(F)C[C@@H](CCl)Nc1ncc(I)cc1Br 2015758645 KRJUICBQSBZBEJ-ZETCQYMHSA-N 439.469 4.513 50 10 IJGE C[C@@H]1CCN(Cc2ccc(I)c(Cl)c2)[C@@H]1CBr 2026561966 WWPKRCZCWARDEC-NOZJJQNGSA-N 428.539 4.550 50 10 IJGE ClCC12CCC(Nc3ncc(I)cc3Br)(CC1)C2 2069531791 NGAVUAWVYGANGW-UHFFFAOYSA-N 441.538 4.802 50 10 IJGE CSc1ccc(-n2nc(CCl)c(I)c2C(F)(F)F)cc1 2079210332 OMVXCHGLGAQGPN-UHFFFAOYSA-N 432.636 4.956 50 10 IJGE CN(C[C@@]1(Br)CC1(F)F)c1ccc(CBr)cc1Br 2082521153 BYGZFXLYPOHSPS-NSHDSACASA-N 447.943 4.953 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCC2(CC1)C[C@@H]2CCl 2092482941 ZLPNLAUUNYAPJE-MRVPVSSYSA-N 427.589 4.754 50 10 IJGE CN(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@H](CBr)c1ccccc1 2106787140 YCMBKVIFNOTWIF-HKUYNNGSSA-N 425.411 4.744 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1N(C(=O)c2ccc(CBr)cc2)CCCC1(C)C 2184381685 OTPUTRUDXSOLEG-QGZVFWFLSA-N 439.394 4.737 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCC2(CCOCC2)N(C[C@@H](CBr)C(C)(C)C)C1 2193493718 FBKMIIYSTZPDKW-SJORKVTESA-N 447.458 4.582 50 10 IJGE CCn1ncc(Br)c1[C@@H](Cl)c1cc(Br)c(OC)cc1F 2202902677 UCLDHHCJGFUQKA-LBPRGKRZSA-N 426.511 4.904 50 10 IJGE CC[C@H]1CN(C(=O)OC(C)(C)C)[C@H](CC)CN1CCCCCI 2211186177 NMBIUTJIEXVITN-JKSUJKDBSA-N 438.394 4.702 50 10 IJGE Cc1c(Br)cccc1CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1Br 2243596333 HWSXCAXEWKASPF-HUUCEWRRSA-N 449.183 4.657 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CSC[C@H]1CC1(C2)C[C@]1(CBr)C(F)(F)F 2249373699 BBLPYIAVTSVCTC-UEKVPHQBSA-N 430.330 4.835 50 10 IJGE COc1ccc([C@@H](Br)CC[C@H]2CCOC2)cc1I 2257367814 ODVPGGDUDBWSAM-JQWIXIFHSA-N 425.104 4.553 50 10 IJGE COCCCCCO[C@@H](CI)c1ccccc1Br 2258908581 ALVDKPBSCGYYOW-AWEZNQCLSA-N 427.120 4.759 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@@H](Br)CC2(CCC2)C1 2264509966 PDFGZMWBLMKRFE-QMMMGPOBSA-N 427.589 4.944 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2C[C@H](C)O[C@H](C)C2)cc1I 2269555931 KCQPSNMVCAVRTB-GOMXZESMSA-N 439.131 4.939 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@@H](Br)[C@H]1C1CC1 2282967957 QCWZHQUQBRWJGL-NOZJJQNGSA-N 425.523 4.630 50 10 IJGE Cc1ccc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)c(CBr)n1 2287030541 JOHCSSOHEYYGNN-AQCRLBJHSA-N 426.402 4.632 50 10 IJGE O=C(CSc1nnc(SCc2ccccc2)s1)NN=CC=Cc1ccccc1 2293430005 SLEGIGLFCOOTKS-UHFFFAOYSA-N 426.592 4.738 50 10 IJGE CCCn1c(C)cc(C=C(C#N)C(=O)OCC(=O)Nc2cc(C)c(Cl)cc2OC)c1C 2297356597 HFXOQTNUEPIYIA-UHFFFAOYSA-N 443.931 4.574 50 10 IJGE ClC[C@H]1CC[C@@H](NCc2ccc(I)c(Br)c2)C1 2306223857 KEYMPUOBCSFENO-GXSJLCMTSA-N 428.539 4.551 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)C=Cc2ccc(Cl)cc2)c(OC)c1 2314777211 SYKAXKSTQXKOSA-UHFFFAOYSA-N 438.911 4.791 50 10 IJGE Clc1ccc(CN2CC[C@@H](Br)CC23CC3)c(I)c1 2318524782 RXLIXXIBERNVKZ-LLVKDONJSA-N 440.550 4.837 50 10 IJGE C[C@@H]1[C@H](Br)CCN(Cc2ccc(Cl)cc2I)[C@@H]1C 2321306384 YFTBTTSOKDTQCS-OPQQBVKSSA-N 442.566 4.938 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc1Br 2323606949 RTNUHRBJHQWQNU-UHFFFAOYSA-N 447.358 4.598 50 10 IJGE Cn1nc(C(F)F)c(CBr)c1N(Cc1ccccc1)[C@H]1COC(C)(C)C1 2339727004 IDYWETAKDNQYTA-CQSZACIVSA-N 428.321 4.827 50 10 IJGE COc1cc(CBr)cc(N(C)C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)n1 2364780316 CDVRTIVLQMHEHG-YOFSQIOKSA-N 430.390 4.617 50 10 IJGE O=C(NC1CCCC1)[C@@H](c1ccc(Cl)cc1)N(Cc1cccs1)C(=O)CCl 3039462 HHACKPFXKXOFAP-LJQANCHMSA-N 425.381 4.769 50 10 IJGE CCCCSc1nc(C)cc(SCC(=O)N/N=C/c2c(O)ccc3ccccc23)n1 8952545 WXCJORRIAMMSHG-YDZHTSKRSA-N 440.594 4.778 50 10 IJGE CCCCOc1ccc(/C=C(\C#N)C(=O)Oc2ccc3c4c(c(=O)oc3c2)CCC4)cc1 40864725 SRRVIHAWKADCKI-NBVRZTHBSA-N 429.472 4.973 50 10 IJGE COc1cc(/C=N/NC(=O)c2cc3ccccc3o2)ccc1OCc1ccc2c(c1)OCO2 59304168 ACTILONOYUNBNX-LGJNPRDNSA-N 444.443 4.513 50 10 IJGE Cc1nn(C)c(Cl)c1CC(CBr)(CBr)c1ccccc1F 167850570 UADHRCASMOLSOK-UHFFFAOYSA-N 438.566 4.791 50 10 IJGE N#C/C(=C/N(CCO)Cc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1 217243652 ZOMBQGFWGXMKDE-VZCXRCSSSA-N 429.545 4.678 50 10 IJGE CCCCCCCCOc1ccc(OCC(=O)NN=Cc2ccc3c(c2)OCO3)cc1 252622538 NXRFPWMCEOICPQ-UHFFFAOYSA-N 426.513 4.684 50 10 IJGE COc1cccc([C@@H]2CN(Cc3ccccc3)C[C@H]2CI)c1Cl 382721745 NUIORNMZHPJLSV-NVXWUHKLSA-N 441.740 4.999 50 10 IJGE C[C@@H](CO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1)C1CCC1 398340406 CYBJLGOSXPASNF-KBXCAEBGSA-N 437.362 4.644 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1C(=O)c1cc(Br)cc(Br)c1 705610514 DDFUWQGADIAAHR-SCZZXKLOSA-N 439.973 4.600 50 10 IJGE COc1ccc(C(=O)NN=Cc2cn(-c3ccccc3)nc2-c2ccc(C)cc2)c(OC)c1 729933544 HUVJQXMVYJSUHO-UHFFFAOYSA-N 440.503 4.629 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1)N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 768474949 NETLFVYDRWDDAQ-INIZCTEOSA-N 444.919 4.624 50 10 IJGE CN(C(=O)c1cccs1)c1ccccc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799754948 WCCYKTXADQCZIU-UHFFFAOYSA-N 444.438 4.672 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@H]1CCN(C(=O)c2ccc3c(c2)nc(O)n3CC(F)(F)F)C1 1470551475 OQLGXIVOFWGCII-AWEZNQCLSA-N 443.542 4.541 50 10 IJGE O=C(NNc1ccc(OCC(F)(F)F)cc1)c1cc2ccc(C(F)(F)F)cc2nc1O 1630977630 SQJYZCLYHLIAAE-UHFFFAOYSA-N 445.319 4.657 50 10 IJGE CC(=O)c1ccc(CNC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Cl)cc3)c2C)nc1C 1636439470 NEFUYUNJTYSLMI-UDWIEESQSA-N 446.938 4.877 50 10 IJGE C#Cc1ccc(NC(=O)NNC(=O)c2ccc(COc3ccc4ccccc4c3)cc2)cc1 1675409378 NCOUDXALBQCSDV-UHFFFAOYSA-N 435.483 4.867 50 10 IJGE Cc1c(C(=O)Nc2ccc(F)cc2F)oc2c1C(=NNC(=O)Cc1ccccc1)CCC2 1772749074 HACVJGTXPAPGHU-UHFFFAOYSA-N 437.446 4.518 50 10 IJGE O=C(c1cc(F)c(Br)cc1O)N(CCCBr)Cc1ccccc1 1901222569 IEYMPXRNHHIWPR-UHFFFAOYSA-N 445.126 4.721 50 10 IJGE CN(CCN(Cc1ccccc1)c1ncc(CBr)cn1)Cc1ccccc1 1931965052 HTLCANOJQPNFGO-UHFFFAOYSA-N 425.374 4.510 50 10 IJGE FC(F)CN(CCBr)Cc1ccc(Br)cc1Br 1943839692 BPXMLNCSTUIDHR-UHFFFAOYSA-N 435.932 4.674 50 10 IJGE C=CCC(CBr)(CBr)Cc1c(Br)cnn1CC 1945478563 MCNJQNNSXYZVET-UHFFFAOYSA-N 428.994 4.560 50 10 IJGE CC(C)(C)OC(=O)NCCN(Cc1ccccc1)C[C@@H](CBr)CC1CC1 1953667409 SNZLAGPATHKRNN-LJQANCHMSA-N 425.411 4.825 50 10 IJGE O=C(N[C@@H]1CC[C@H](CBr)C1)c1c(Br)cccc1Br 2033091274 OYFCYVDNKOTMNP-DTWKUNHWSA-N 439.973 4.505 50 10 IJGE CC(C)[C@H](CBr)CN1CCCCN(C(=O)OC(C)(C)C)CC(F)(F)C1 2046339759 PZKIIRXXSORGIF-OAHLLOKOSA-N 427.374 4.622 50 10 IJGE CC1(C)C[C@H](O[C@H](CI)c2ccccc2Br)CO1 2052239227 FMGDJCILVOVKEZ-GXFFZTMASA-N 425.104 4.509 50 10 IJGE BrC[C@H]1C[C@@]2(CCN2Cc2ccc(Br)cc2Br)C1 2061792744 HKCORIMTNFNEMC-YPFXGUDJSA-N 438.001 4.961 50 10 IJGE CN(C[C@@H]1CCCCN1C[C@H](CBr)c1ccccc1)C(=O)OC(C)(C)C 2106782099 NWRZSTADIMWZRY-OALUTQOASA-N 425.411 4.887 50 10 IJGE BrC[C@]12CCCC[C@H]1N(c1ccc(I)cn1)CCC2 2108957429 ZIWWOFXIICITLK-UKRRQHHQSA-N 435.147 4.610 50 10 IJGE FCC12CC(COc3c(Br)cc(CCl)cc3Br)(CO1)C2 2202753192 BOWAONDCBDRHFZ-UHFFFAOYSA-N 428.523 4.848 50 10 IJGE COc1cccc(N2C[C@]3(C)CN(Cc4ccccc4)C[C@@]3(C)C2)c1CBr 2203190647 SAZJKHWFFMSSCM-GOTSBHOMSA-N 429.402 4.939 50 10 IJGE CCN(C[C@@](C)(CI)O[C@@H]1C[C@H]2CC[C@H]1C2)C(=O)OC(C)(C)C 2212690723 OGTHHNSKLDEBPI-OIPACUDHSA-N 437.362 4.642 50 10 IJGE COc1c(Br)cc([C@H](Br)[C@H]2C[C@@H]2Br)c(OC)c1C 2263577954 ZNTCMGDIAZZPQD-OVYXKVPISA-N 442.973 4.994 50 10 IJGE COc1ccc(CNC(=O)C(C#N)=Cc2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)o2)cc1 2294187487 WEBLOQSIAVQSFD-UHFFFAOYSA-N 437.839 4.740 50 10 IJGE COc1cc(C=C(C#N)c2nc3ccccc3[nH]2)c(Br)c(Br)c1O 2297532859 RUIZOXMVRBYAJJ-UHFFFAOYSA-N 449.102 4.866 50 10 IJGE Clc1ccc(C[C@H]2CCOCC[C@H]2Br)c(I)c1 2302330020 XYFNERUYMSJCOT-BXKDBHETSA-N 429.523 4.677 50 10 IJGE O=S1(=O)CC[C@H]1[C@@H](Br)c1c(F)cc(Cl)c(Br)c1Cl 2313742361 FYTNEYZMMATPDR-IMTBSYHQSA-N 440.943 4.518 50 10 IJGE N#CC(=Cc1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 2314480742 NESGVXVIMDVUFR-UHFFFAOYSA-N 435.443 4.993 50 10 IJGE Clc1ccc(CN2C[C@H](Br)C3(CCC3)C2)cc1I 2315554793 JNSDYXNGUKJFEW-ZDUSSCGKSA-N 440.550 4.694 50 10 IJGE Clc1ccc(CN2CC[C@@H](Br)[C@@H]3CC[C@@H]32)c(I)c1 2318524252 LYJLRIZEFTZIQM-SCRDCRAPSA-N 440.550 4.692 50 10 IJGE CCCCOC(=O)c1ccccc1NC=C(C#N)C(=O)Nc1cccc2c(O)cccc12 2324915362 MGUYYHILIXYGAO-UHFFFAOYSA-N 429.476 4.960 50 10 IJGE C[C@@H](Br)C1CCN(Cc2cc(I)ccc2Cl)CC1 2327408926 HKAUYBOZNUZZJM-SNVBAGLBSA-N 442.566 4.940 50 10 IJGE N#CC(=Cc1cccc(Br)c1)C(=O)Nc1c(Cl)cc(Cl)cc1C(=O)O 2329696412 PKAPFHLCGIBUMV-UHFFFAOYSA-N 440.080 5.000 50 10 IJGE COc1ccc([C@H](Cl)c2c(Br)c(Br)nn2C)cc1Cl 2338722336 LUWMLZQEMUZQIM-JTQLQIEISA-N 428.939 4.935 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)C1 2345004514 LSDVTRQIECAYGW-HXUWFJFHSA-N 429.443 4.911 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N(C[C@H](C)Br)C1CCCC1 2368873586 PCRBWTVCTWGZFU-VIFPVBQESA-N 445.242 4.536 50 10 IJGE Cc1cc(C(=O)N2CCC[C@@H](Br)[C@H]2C(F)(F)F)c(Br)s1 2370247023 ISVHYPXGFDSRQT-BDAKNGLRSA-N 435.103 4.749 50 10 IJGE CCOc1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)cc1 855521 OPTFPJYNVCUPER-XDHOZWIPSA-N 429.476 4.767 50 10 IJGE CC(C)[C@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)NN=Cc1ccccc1Cl 6190641 DZPVMTOBSVJQPD-DEOSSOPVSA-N 447.966 4.763 50 10 IJGE CC[C@H]1CCC/C1=N\NC(=O)COc1c(C)cc(Br)cc1Br 12486934 OBBZSPMYKYLWLU-FXONDUCNSA-N 432.156 4.581 50 10 IJGE COc1ccc(Br)c(C=NNC(=O)COc2ccc(-c3ccccc3)cc2)c1 15985895 ARCOQVXHCNOVPV-UHFFFAOYSA-N 439.309 4.654 50 10 IJGE COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(SC)cc2)cc1 38682058 RZMXHJNGYMAXGQ-QHCPKHFHSA-N 444.512 4.854 50 10 IJGE O=C(N/N=C/c1ccccc1F)c1ccccc1OCc1cccc(Br)c1 96095867 KSJBFVFSOVBHPU-ZMOGYAJESA-N 427.273 4.931 50 10 IJGE CCCCCCCCCCCCCC(=O)NNC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1 100443190 GKYKQBFORPWSEI-QHCPKHFHSA-N 443.632 4.884 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C\c2cn(-c3ccccc3)nc2-c2ccc(C)cc2)C1=O 101332753 MJTWKPVDLODIFQ-HZHRSRAPSA-N 436.515 4.850 50 10 IJGE COc1ccc([C@H](C)N/C=C(/C#N)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)cc1OC 217200761 JKBSTEFYNKKDKT-GQYDPSLTSA-N 433.552 4.518 50 10 IJGE CCO[C@@H]1[C@@H](Br)C[C@H]1Oc1c(Br)cccc1Br 252840347 CSFWSAAYDONJIV-HOSYDEDBSA-N 428.946 4.531 50 10 IJGE FC(F)Oc1cc(CBr)cc(I)c1C(F)(F)F 575723644 RYWLXMYKQODXFX-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE Cc1cnc2c(c1)nc(CCl)n2CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 705870519 XDHFRVNQJBDIHI-UHFFFAOYSA-N 446.982 4.950 50 10 IJGE O=C(NCC1(CBr)CCC1)c1cc(Br)c(Br)s1 717621844 KYECVOSBDXUITO-UHFFFAOYSA-N 446.002 4.568 50 10 IJGE O=C(NC1(CCBr)CCSCC1)c1ccc(Cl)c(Br)c1 719666289 QMSVUZWPQPCGNC-UHFFFAOYSA-N 441.616 4.883 50 10 IJGE CCOc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CBr)cc1OCC 725392528 UWZFLZDXUFJQKO-HOTGVXAUSA-N 428.367 4.829 50 10 IJGE Cn1cc(C(=O)NNC(=O)[C@@H](Sc2ccccc2F)c2ccccc2)c2ccccc21 729965992 BEYOOGOMKJWISQ-QFIPXVFZSA-N 433.508 4.612 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNc1ccc(Br)c(F)c1)O[C@H](C)C2 771678489 FSUDFVCKSGFSPG-WPGHFRTFSA-N 449.320 4.557 50 10 IJGE Cc1csc(Sc2ccc(NC(=O)C(=O)NNc3ccccc3C)cc2Cl)n1 783327365 HERUGSQLCXERKX-UHFFFAOYSA-N 432.958 4.646 50 10 IJGE Cc1ccc(NNC(=O)C(=O)Nc2ccc(Oc3cc(Cl)ccc3Cl)c(F)c2)nc1 783494682 LVFQKRPLKKMHBZ-UHFFFAOYSA-N 449.269 4.710 50 10 IJGE O=C(NNC(=O)N(Cc1ccccc1C(F)(F)F)CC1CC1)c1cccc2cccnc12 805027110 GAFWEPIPNMAOHC-UHFFFAOYSA-N 442.441 4.520 50 10 IJGE O=C(NN=Cc1cc(Cl)cc(Cl)c1O)c1ccc(NC(=O)c2ccccc2)cc1 1084224151 PQQQUKDYRYRLHH-UHFFFAOYSA-N 428.275 4.715 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2cnc(-c3ccccc3)s2)c(C)n1C[C@H]1CCCO1 1318996314 DFDMDFNXEMUYNX-UHSICZIDSA-N 446.576 4.631 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccccc2F)cc1 1865692200 KKVDILRDNPRGJZ-QHCPKHFHSA-N 432.499 4.776 50 10 IJGE Cc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865713289 VRPGBEROZBQWPM-SFHVURJKSA-N 442.262 4.614 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1880757523 YPWMAWCHGXYQFG-KKUMJFAQSA-N 435.403 4.606 50 10 IJGE BrC[C@H]1CCCN(Cc2c(Br)cccc2Br)C1 1945332419 CEPPKZFUNGGBNS-SNVBAGLBSA-N 425.990 4.819 50 10 IJGE CO[C@H](C)CCOc1c(Br)cc(CBr)cc1Br 2001105592 MTXZATPIXQIDOI-MRVPVSSYSA-N 430.962 4.910 50 10 IJGE C[C@@]1(CCBr)CCN1Cc1cc(Cl)ccc1I 2025218686 LXCHDGJIHRPXPL-CYBMUJFWSA-N 428.539 4.694 50 10 IJGE FC1(F)[C@@H]2COC[C@@]21[C@@H](Br)c1cc(Br)ccc1Br 2043521224 PNPOBFVPGYGCTJ-VWYCJHECSA-N 446.911 4.929 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CCCC[C@@H](Br)C1 2050104615 NXDACEXGKNRVPE-SECBINFHSA-N 439.973 4.601 50 10 IJGE COc1ccc(C2=CSC(=C(C#N)C(=O)c3cc([N+](=O)[O-])ccc3Cl)N2)cc1OC 2053510785 RNTPSNYNPYRNLH-UHFFFAOYSA-N 443.868 4.518 50 10 IJGE Fc1nc(-n2nc(CCl)c(Br)c2C(F)(F)F)ccc1C(F)(F)F 2078864919 DOVXKGSXPVDDCY-UHFFFAOYSA-N 426.517 4.945 50 10 IJGE ClCc1cnc(N2CC[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c(Br)c1 2092523123 FDAZPPSTLJIVTQ-MOPGFXCFSA-N 434.809 4.931 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1ccc(F)c(Br)c1 2117892893 GHROKYJJSJJPNF-JTQLQIEISA-N 442.110 4.702 50 10 IJGE C[C@@H](c1cscc1Br)N(C)c1ncc(Br)c(CCl)n1 2130029926 GENJNMGCBOBCIP-ZETCQYMHSA-N 425.577 4.999 50 10 IJGE Cl[C@H]1Cc2ccccc2[C@@H]1Nc1ncc(I)cc1Br 2133370370 ACZQYCJNORXCLD-STQMWFEESA-N 449.517 4.765 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)cnc2n1CCc1cnn(Cc2ccccc2)c1 2146275918 ACFKITGKNNRZAO-CQSZACIVSA-N 444.764 4.981 50 10 IJGE CC(C)(C)OC(=O)N1CCO[C@H]2CCN(CCCCCCCCCBr)C[C@@H]21 2163064501 UUKSCLHJPBZZPL-OALUTQOASA-N 447.458 4.822 50 10 IJGE COc1ccc([C@@H](Br)c2ccc(OC)c(I)c2)cc1 2269552886 NOOBAHUUIJHILX-OAHLLOKOSA-N 433.083 4.793 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1Cc2ccccc2N(CC2(CBr)CC(F)C2)C1 2280358619 FGGQVAVNOGUCAW-FPPRHVDESA-N 441.385 4.703 50 10 IJGE O=C(NC[C@@H](Br)CC(F)(F)F)c1cc(F)c(Br)cc1Cl 2282982424 DLNVUWJEIGFLLB-YFKPBYRVSA-N 441.444 4.687 50 10 IJGE C[C@H]1CC[C@H](CBr)N(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285960286 UJMDLTRKCBQDQY-DTWKUNHWSA-N 427.539 4.877 50 10 IJGE COc1cc(C=CC(=O)Cl)cc(I)c1OCc1ccccc1C 2293940984 SIZLCWAWDHSXNA-UHFFFAOYSA-N 442.680 4.966 50 10 IJGE Cc1ccc(C(C)C)c(OCCOc2ccc(Br)cc2C=C(C#N)C(N)=O)c1 2294593219 ISSIPUOJNPYGHJ-UHFFFAOYSA-N 443.341 4.731 50 10 IJGE CCOc1cc(C=NNC(=O)CSc2nc3ccccc3[nH]2)cc(Cl)c1OC(C)C 2323081380 BRTUURWDSCMNKS-UHFFFAOYSA-N 446.960 4.645 50 10 IJGE Cc1ccc(Cl)cc1NC(=O)C(C#N)=CNc1ccc(I)cc1 2325145630 ORUPPXVHJATVOO-UHFFFAOYSA-N 437.668 4.711 50 10 IJGE CC(C)C[C@@H](CBr)CN1CC(F)(F)[C@](C)(CNC(=O)OC(C)(C)C)C1 2328529966 ZIKFORBNHNCZBD-WMLDXEAASA-N 427.374 4.526 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C)CN(Cc2ccc(CBr)cc2)CC1(F)F 2351603453 JPHGJFSDOMDWCU-SFHVURJKSA-N 433.337 4.563 50 10 IJGE C[C@@H](Oc1ccc(F)cc1)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccccc1F 38652095 QPUXZJUMBALCMO-FATZIPQQSA-N 448.425 4.556 50 10 IJGE CCCCCN1C(=O)C(C#N)=C(C)/C(=C\Nc2ccccc2C(=O)c2ccccc2)C1=O 39894506 CQQGLRRXVCJLQW-OQKWZONESA-N 427.504 4.612 50 10 IJGE CCOC(=O)c1ccsc1NC(=O)/C(C#N)=C\c1ccc(COc2ccccc2C)o1 98063469 MSGCRJOFSKPDQK-VBKFSLOCSA-N 436.489 4.951 50 10 IJGE COc1ccc2c(c1)N(C)/C(=C1\S/C(=N/CCCl)N(Cc3ccccc3)C1=O)S2 103627793 RUHBMOZIONLIOK-VOUFPMFESA-N 445.997 4.777 50 10 IJGE C[C@H](Br)c1ccccc1NS(=O)(=O)c1ccc(Br)cc1F 162310174 FVJLISANTIIJCT-VIFPVBQESA-N 437.128 4.845 50 10 IJGE CC(C)COc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4O)nc3c2)cc1 169926517 MRNNCAWOEBUWMX-VULFUBBASA-N 428.492 4.734 50 10 IJGE CCOc1cc(/C=C(/C#N)c2nc3ccccc3c(=O)[nH]2)cc(Br)c1OCC 169941373 JKPCOCJKEHZGMA-ZROIWOOFSA-N 440.297 4.547 50 10 IJGE COC(C)(C)CCO[C@@H](CI)c1cccc(Br)c1 234674315 IOIJKYHCVXAQKW-ZDUSSCGKSA-N 427.120 4.757 50 10 IJGE COc1cc(N/C=C(/C#N)C(=O)Nc2ccccc2C(F)(F)F)c(OC)cc1Cl 253320656 QDFQOSOELLMSQW-KHPPLWFESA-N 425.794 4.834 50 10 IJGE Cc1cccc(C(O)(C(=O)NN=C(c2ccccc2)c2cccnc2)c2cccc(C)c2)c1 254714170 HBNSRQFXRFFPBT-UHFFFAOYSA-N 435.527 4.503 50 10 IJGE ClCc1nc2cc(Br)ccc2n1CC[C@H]1CN(Cc2ccccc2)CCO1 381937801 UKYJXAKHFGKKTE-SFHVURJKSA-N 448.792 4.829 50 10 IJGE Clc1ccc(I)c(CN2CCC(CBr)CC2)c1 405347767 RLIONTHEZFCDCS-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE Cc1cc(Br)c([C@@H](Br)c2c(Br)cnn2C)s1 693046212 GQWSFQXPJBKFHG-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1Cc1cc(Cl)ccc1I 705503768 YENMUOVVAMKURH-KOLCDFICSA-N 428.539 4.692 50 10 IJGE O=S(=O)(N[C@H](CCBr)C1CCCCC1)c1ccc(Br)s1 725077571 POTWEHSXBADYTP-LLVKDONJSA-N 445.242 4.523 50 10 IJGE Cc1ccc([N+](=O)[O-])cc1[C@@H]1CN(Cc2ccccc2)C[C@@H]1CI 725379751 JNVWRXKGYWAYJR-QFBILLFUSA-N 436.293 4.554 50 10 IJGE COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)NNC(=O)CCOc2ccccc2)cc1 743572312 AZPKFJBRNYNJGE-IBGZPJMESA-N 447.535 4.565 50 10 IJGE Cc1coc(-c2cccc(NC(=O)/C(C#N)=C/c3cn(CCC#N)nc3-c3ccccc3)c2)n1 758877144 BWOGPUOZDWKZAK-FYJGNVAPSA-N 448.486 4.973 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OCc2c(F)cccc2Cl)c(-c2ccccc2)n1 761409106 BBLKHMRVNZIMBD-SFQUDFHCSA-N 434.858 4.907 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CCn4c(C(C)C)nnc4[C@H]3C)c2C)c1 784685120 DWNBZJIQFLIXJY-IDCRMVTHSA-N 442.567 4.628 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2cc(C3CC3)nn2-c2ccccc2)c(C(F)(F)F)c1 799382704 ROWNMAANAAGRHU-UHFFFAOYSA-N 426.402 4.789 50 10 IJGE CCCCC(C)=NNC(=O)CN(c1ccc(C)cc1)S(=O)(=O)c1ccc(Cl)cc1 1084478580 OYTWWJCHGKYKED-UHFFFAOYSA-N 435.977 4.526 50 10 IJGE COc1ccccc1CN(C[C@@H](CBr)C1CC1)c1ccc2nc(O)[nH]c2c1 1167788632 CHTWCEPADQXMSH-MRXNPFEDSA-N 430.346 4.705 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1ncoc1-c1cccc(C(F)(F)F)c1 1301148945 YVPPCSTYTOKTLH-UHFFFAOYSA-N 431.399 4.723 50 10 IJGE C#CCOc1cccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(OC)cc3)c2C)c1 1529312551 IWITZUBQQXMACK-QNGOZBTKSA-N 425.488 4.660 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNc2cccc(Br)c2)s1 1545945190 IMXKQVXLIINSBX-UHFFFAOYSA-N 432.796 4.744 50 10 IJGE CC(C)c1sc(NC(=O)CN(C)NC(=O)OCc2ccccc2)nc1-c1ccccc1 1654344994 ABRJSWAYUIVWRP-UHFFFAOYSA-N 438.553 4.645 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)COc2ccccc2)CCC3)c1C 1772750106 UHOSQKZFCBTMPA-UHFFFAOYSA-N 445.519 4.693 50 10 IJGE COCCOc1ccc(/C=C(\C#N)C(=O)NCC2(c3ccc(Cl)cc3Cl)CC2)cc1 1866214035 OQCQDMURCZPAGS-SFQUDFHCSA-N 445.346 4.774 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCCN(C(=O)OC(C)(C)C)C12CCC2 1883670721 QRCQUKAFHSBSDD-GJZGRUSLSA-N 447.414 4.844 50 10 IJGE Brc1ccc([C@H](CI)O[C@H]2COC3(CCC3)C2)cc1 1889721373 CSPOTDVWRRYCSG-KGLIPLIRSA-N 437.115 4.653 50 10 IJGE CCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)CC(C)(C)CI 1904650878 KRCFXOOSKZVABX-HNNXBMFYSA-N 438.394 4.559 50 10 IJGE Cc1ccnc(N(C)C[C@H](Br)COCc2ccccc2)c1Br 1916348061 MAYVYUAKCSWYBI-HNNXBMFYSA-N 428.168 4.569 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cscc1Br 1916363602 BRROKRLQEFDGGI-ZDUSSCGKSA-N 447.192 4.563 50 10 IJGE CC1(C)CN(Cc2cccc(Br)c2Br)C[C@@H]1Br 1943883309 ZFBXQVXVKXEZJS-NSHDSACASA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]3(CCC[C@@H](CI)O3)C[C@@H]21 2001949850 IHTRXGZPLWAVEL-PASDCYSWSA-N 449.373 4.929 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@@H]1Cc1cc(Br)ccc1Br 2007127207 CVIZFQSHBGPERX-XHVZSJERSA-N 426.974 4.943 50 10 IJGE C=CCC[C@H](CBr)NC(=O)c1cc(Br)c(Br)s1 2019475001 JHAOMHZUTAXFBD-SSDOTTSWSA-N 446.002 4.733 50 10 IJGE CC[C@@H](COC)O[C@](C)(CI)c1ccccc1Br 2033504630 NLTJAMLJHDOVTP-SMDDNHRTSA-N 427.120 4.541 50 10 IJGE CCCC(CBr)(CCC)CN=[S@](C)(=O)C[C@@H](C)NC(=O)OC(C)(C)C 2044700050 PEVPUJDDSROZHR-SGANQWHYSA-N 441.476 4.979 50 10 IJGE C[C@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1cc(F)ccc1CBr 2059264531 HAPYSVRHHYNHIZ-CQSZACIVSA-N 426.351 4.710 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@H]2[C@@H](Cl)CCC[C@H]2C1 2094583820 LTPNHPKYMFNLBR-SFGNSQDASA-N 427.589 4.753 50 10 IJGE O=C(NC[C@@]1(CCl)CC12CCC2)c1csc(Br)c1Br 2097910154 JWQWURQCVPSODC-ZDUSSCGKSA-N 427.589 4.802 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@@H]2CCC[C@]2(CCl)C1 2103173920 XRJXQZHXOMBVJT-SDBXPKJASA-N 427.589 4.754 50 10 IJGE CCC(CC)(CBr)CN1C[C@H](CNC(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1 2106783773 COBWLEDGNFHTNF-KBPBESRZSA-N 445.364 4.823 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CN(C[C@H](CBr)C2CCC2)C2CC2)CC1 2106786045 DJIFKMBIKTUSJZ-SFHVURJKSA-N 429.443 4.909 50 10 IJGE C[C@@H](CCCCCI)NCCOc1ccc(Br)cc1 2117887944 RRYNTAAJDGVIMZ-ZDUSSCGKSA-N 440.163 4.801 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2Cc1cnc(Br)s1 2153127357 ZXCCWDRWFXYENF-UHFFFAOYSA-N 436.560 4.508 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CCC([C@H](F)CCl)CC1 2163239113 WAQKWHHSDMJQBS-CYBMUJFWSA-N 427.539 4.641 50 10 IJGE Cn1ncc(Br)c1-n1c(CCl)nc2cc(Cl)c(Br)cc21 2169015527 NRKLKKNSLJMJMT-UHFFFAOYSA-N 438.938 4.676 50 10 IJGE Brc1cccc([C@@H](CI)O[C@H]2C[C@@H](n3cccn3)C2)c1 2183683694 BCGWNUDVGGRIAS-QLFBSQMISA-N 447.114 4.542 50 10 IJGE COCC12CC([C@@H](Br)c3cc(Cl)c(Br)cc3F)(CO1)C2 2206084515 UPXNDEKWMINHJI-HSBZDZAISA-N 428.523 4.873 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N1CCCC[C@H]1CCCBr 2206669574 SYJHJFPNJPGONZ-NSHDSACASA-N 445.242 4.537 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)C(=O)c1cc(F)c(Br)cc1F 2255687620 KCIOQYMFSQKMJG-ZDUSSCGKSA-N 432.692 4.624 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@H]1[C@H]2COC[C@H]21 2259998713 GXHKSPZWQIISJB-LRXXKQTNSA-N 446.911 4.818 50 10 IJGE COc1cc(F)c(CBr)c(N2C[C@H]3CN(Cc4ccccc4)C[C@]3(C)C2)c1 2283391741 JZFJTEOZOMXDRP-VGOFRKELSA-N 433.365 4.688 50 10 IJGE Cc1c(CBr)cccc1NC(=O)c1cc(I)ccc1F 2283563357 YVHVSQXEOAVTNC-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE Cc1cc(Br)c(F)c(C(=O)N[C@H](CCCl)COCc2ccccc2)c1 2320557873 JOQACENIGISYOR-OAHLLOKOSA-N 428.729 4.841 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)C(C#N)=CNc1ccc(Cl)c([N+](=O)[O-])c1 2325306960 TUFJKQOKXNRLHD-UHFFFAOYSA-N 442.859 4.663 50 10 IJGE N#CC(=Cc1ccccc1)C(=O)Nc1c(Br)cc(C#N)cc1Br 2325309787 WVMQWQBTRKJCMS-UHFFFAOYSA-N 431.087 4.629 50 10 IJGE CC(C)[C@H](Cl)C(C)(C)CNC(=O)c1cc(Cl)ccc1I 2365854396 DLPWWVONIBDIML-ZDUSSCGKSA-N 428.141 4.964 50 10 IJGE CC[C@H](C)c1ccccc1OCC(=O)NNC(=O)c1ccccc1OCc1ccccc1 14030743 KVXGTYUTBMMFSE-IBGZPJMESA-N 432.520 4.619 50 10 IJGE C/C(=N\NC(=O)C1CCN(Cc2ccc(Br)cc2)CC1)c1ccc(C)cc1 33304407 IVVCQKDPIMVTCY-JJIBRWJFSA-N 428.374 4.510 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NC2CCCCCC2)ccc1OC(=O)c1cccc(C)c1 96504381 JMICNIIDPABRRA-QNGOZBTKSA-N 432.520 4.969 50 10 IJGE COCCCC(CBr)(CBr)c1ccccc1Br 118672039 NPNCCZJKZMUUOE-UHFFFAOYSA-N 428.990 4.903 50 10 IJGE CCOC(=O)c1ccc(NC(=O)/C(C#N)=C\N(Cc2ccccc2)c2ccccc2)cc1 217103756 PXAKOYCVZOIQGY-QOCHGBHMSA-N 425.488 4.916 50 10 IJGE C[C@H](CCCBr)NC(=O)c1cc(Br)cc(Br)c1 235419761 MJPWSUIQSFBUNR-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE CCN(C[C@@](C)(CI)O[C@@H](C)C1CCC1)C(=O)OC(C)(C)C 719774208 FLFADVPGZPNYSR-SUMWQHHRSA-N 425.351 4.642 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OCc2cc(-c3ccccc3)no2)c(-c2ccccc2)n1 808433258 FXYORFLNZYVZMD-KGENOOAVSA-N 449.470 4.769 50 10 IJGE C[C@H](CBr)[C@H]1CCCCN1c1ncc(Br)cc1Br 829246383 LJNHJXNVENQVLV-BXKDBHETSA-N 441.005 4.997 50 10 IJGE O=C(NN=Cc1cc(Cl)cc(Cl)c1O)c1cc2cc(Br)ccc2o1 1083961835 MDCMKHXKFPCMCH-UHFFFAOYSA-N 428.069 4.972 50 10 IJGE COc1ccc(C(C)=NNC(=O)COc2ccc(C(C)C)cc2Br)c(OC)c1 1084460005 UJFNYAZYUCJWMB-UHFFFAOYSA-N 449.345 4.509 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNC(=O)[C@H](C)Oc1cccc(Cl)c1 1270896416 CZCLWFMADLAXPT-MMRAYRKESA-N 427.715 4.665 50 10 IJGE CCOc1ccccc1[C@@H](CC(C)C)NC(=O)NNC(=O)c1ccc(Br)cc1 1318867559 VPJWEWIMMMICGL-GOSISDBHSA-N 448.361 4.579 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)COc1ccccc1-c1ccccc1)c1ccccc1 1478257183 JLZOOAKFLLNZQS-QHCPKHFHSA-N 429.520 4.770 50 10 IJGE Cc1ccc(C(=O)NN=C2CCCc3oc(C(=O)N(C)Cc4ccccc4)c(C)c32)cc1 1772744818 KECCTHXRVMGOSU-UHFFFAOYSA-N 429.520 4.639 50 10 IJGE CCc1nn(-c2ccc(Br)cc2)c2c1[C@H](c1ccccc1C)C(C#N)=C(N)O2 1865712657 DVJKJJLCWCBCHC-LJQANCHMSA-N 435.325 4.724 50 10 IJGE Cc1nncn1C1CCN(c2cc(Nc3ccc(SC#N)cc3)nc(C(C)(C)C)n2)CC1 1868341826 ANUNAIQZAOCWHV-UHFFFAOYSA-N 448.600 4.832 50 10 IJGE C[C@@H](C(=O)N(C)CC1CC(Br)C1)c1ccc(NC(=O)OC(C)(C)C)cc1 1887829164 GIQDESXJXHTLPZ-VQCLRJIVSA-N 425.367 4.769 50 10 IJGE Clc1ccc(OCCOCCI)c(Br)c1Cl 1904654984 CNGGCHHJMTZABG-UHFFFAOYSA-N 439.902 4.586 50 10 IJGE COc1cc(F)c([C@H](Br)c2c(C)nsc2Br)cc1OC 1912980052 FRYFSWILFPGSGI-LBPRGKRZSA-N 425.117 4.855 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)c1ccccc1S(=O)(=O)C(F)F 1915086003 CCHDMGXDXQWBSH-AWEZNQCLSA-N 432.330 4.863 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1nscc1Br 1915256754 CXBCCQWPQWDZPR-CQSZACIVSA-N 446.208 4.968 50 10 IJGE Cn1cc(Br)c(CN(Cc2ccccc2)C2(CBr)CCC2)n1 1915750575 WMTBGHNJXNRMQT-UHFFFAOYSA-N 427.184 4.502 50 10 IJGE Cc1c(Br)c(CN(Cc2ccccc2)C(C)(C)CBr)nn1C 1915755738 QTKLSSBIKGAYAJ-UHFFFAOYSA-N 429.200 4.667 50 10 IJGE CC1(C)[C@@H](Br)CCN1C(=O)c1csc(Br)c1Br 1945189711 YCRHYPZSIWHMMQ-ZETCQYMHSA-N 446.002 4.661 50 10 IJGE CCC[C@H](Br)CNC(=O)c1c(Br)cccc1Br 1945333632 SQMVGANMAZGVIC-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCC3(CCC[C@H](CI)O3)CC2)C1 1950141620 SDZUVIAMDROOMR-VNCLNFNDSA-N 449.373 4.931 50 10 IJGE CC1CCC(CI)(OCCOCCOCc2ccccc2)CC1 1983389673 IKJWGXMSIAJWJU-UHFFFAOYSA-N 432.342 4.620 50 10 IJGE Brc1ccc(Br)c(C[C@H]2CCOCC[C@H]2Br)c1 2006499063 HWGYORZNZLLSPA-NOZJJQNGSA-N 426.974 4.944 50 10 IJGE CC(C)[C@H](Br)CCNC(=O)c1ccc(Br)cc1Br 2029915705 BFIKLKWUXYRDAP-LLVKDONJSA-N 441.989 4.751 50 10 IJGE C[C@@](CCl)(NC(=O)c1csc(Br)c1Br)C(F)(F)F 2043177619 WGGAYUYCRUIOMH-QMMMGPOBSA-N 429.483 4.563 50 10 IJGE BrCC1CC2(C1)CN(Cc1c(Br)cccc1Br)C2 2066493225 BLGAACBMPBSJDT-UHFFFAOYSA-N 438.001 4.819 50 10 IJGE CC(C)N(C[C@@H](C)Cl)C(=O)c1ccc(Br)cc1I 2086150821 GMSFOLWIOOFXRF-SECBINFHSA-N 444.538 4.532 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1cccc(NC(=O)N2CCC(Br)CC2)c1 2106204383 VCZGBCDFZCZGDY-ZDUSSCGKSA-N 426.355 4.664 50 10 IJGE CC(C)(C)OC(=O)NCCN(C[C@@H](CBr)c1ccccc1)CC(F)(F)F 2106789098 WDGQMGVDYPAMIL-OAHLLOKOSA-N 439.316 4.554 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2[C@H]1CN(Cc2ccccc2)C[C@H]1C 2128517322 FRWWMBVEEMMWTO-DYVFJYSZSA-N 433.781 4.934 50 10 IJGE O=C1COc2ccc([C@H](Br)c3cc(Br)c(Cl)s3)cc2N1 2172569026 IUKIWOBUCMAISR-LBPRGKRZSA-N 437.540 4.979 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H]2CCO[C@]2(CNC(=O)OC(C)(C)C)C1 2175181484 HUVSPNZXADXXCV-DYESRHJHSA-N 447.458 4.584 50 10 IJGE CN(C(=O)[C@@H](Br)C1CCCC1)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 2197469238 KJSNSOOSOLFAIH-MSOLQXFVSA-N 439.394 4.665 50 10 IJGE COC[C@]12C[C@]([C@@H](Br)c3cc(Cl)c(Br)cc3F)(CO1)C2 2206079260 UPXNDEKWMINHJI-IHRRRGAJSA-N 428.523 4.873 50 10 IJGE CCC(CC)[C@@H](Br)CNC(=O)Cc1ccc(Br)cc1Cl 2237436666 NDOLCSIUQJWAPI-ZDUSSCGKSA-N 425.592 4.961 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1cccc(Cl)c1Br 2256123939 SHCUIXKSAAPZOD-LDYMZIIASA-N 444.538 4.682 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1C(=O)c1ccc(Br)cc1Br 2260376568 AMLHQKQNQCYLPW-ZYHUDNBSSA-N 439.973 4.600 50 10 IJGE C[C@H]1CO[C@@](CCl)(Cc2ccc(I)c(Br)c2)C1 2306226156 HJYLTHHUSPWVJA-NOZJJQNGSA-N 429.523 4.630 50 10 IJGE CC1=C(C#N)C(=O)N(C2CCCCC2)C(=O)C1=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 2314617162 RXMZFLYNJQANCS-UHFFFAOYSA-N 431.448 4.780 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)NN=Cc1ccccc1Br 2321215928 ZJZWGHPHCSMQMU-UHFFFAOYSA-N 430.252 4.862 50 10 IJGE COc1ccc([C@H](C)NC=C(C#N)C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)cc1OC 2325108047 JKBSTEFYNKKDKT-ROUUACIJSA-N 433.552 4.518 50 10 IJGE CC1(C)[C@@H](Cl)C[C@H]1CNCc1ccc(I)c(Br)c1 2325218119 LNBVTGFISHWDII-GWCFXTLKSA-N 442.566 4.797 50 10 IJGE C=CC[C@H](Cl)[C@@H]1CCN1Cc1ccc(I)c(Br)c1 2325230215 RJTIXYRCIUQDPB-JSGCOSHPSA-N 440.550 4.812 50 10 IJGE N#CC(=CNc1ccc(Cl)c(C(F)(F)F)c1)C(=O)N1CCN(Cc2ccccc2)CC1 2325448733 LWNXGMHDBSRFFM-UHFFFAOYSA-N 448.876 4.523 50 10 IJGE O=C(NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21)c1ccc2cc[nH]c2c1 2326843772 GBILQPYOSOXZTK-UHFFFAOYSA-N 428.879 4.502 50 10 IJGE CCN(c1ccccc1)S(=O)(=O)c1ccccc1NC(=O)C(C#N)=Cc1ccc(C)cc1 2329631821 PLPSBROWMSLZLX-UHFFFAOYSA-N 445.544 4.756 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@@H]1CCl 2362380222 PZPKWIPSMRAJBB-VHSXEESVSA-N 438.058 4.794 50 10 IJGE CN(Cc1c(Br)cccc1Br)c1nc(C(=O)CCl)cs1 2366134767 GUUOWNABVPBGAR-UHFFFAOYSA-N 438.572 4.726 50 10 IJGE O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)CCc1ccccc1Cl 10458742 VKCJHQWTOHVWKB-UHFFFAOYSA-N 429.731 4.586 50 10 IJGE Cc1ccc(NC(=O)CCC(=O)N/N=C/c2cccc(OCc3ccccc3)c2)c(C)c1 12574439 ZBXXSYQWANSXGP-WPWMEQJKSA-N 429.520 4.751 50 10 IJGE N#C/C(=C/c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1)c1nc(O)c2ccccc2n1 34988289 SVFLCXGBCJJJMR-LGMDPLHJSA-N 440.434 4.556 50 10 IJGE N#C/C(=C\c1ccc(-c2ccccc2[N+](=O)[O-])o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 35518223 AGNJPCQBXRRFNQ-FMIVXFBMSA-N 438.783 4.962 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4[N+](=O)[O-])ccc32)cc1 38677102 QNMAXFPLIRQMPA-HSZRJFAPSA-N 441.443 4.595 50 10 IJGE Cc1cc(C)cc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)Cc2ccccc2)CCC3)c1 40815689 MNUXYDYQKFDFPJ-SGWCAAJKSA-N 429.520 4.856 50 10 IJGE Cc1cccc(OCCCC(=O)Oc2ccc(/C=C(\C#N)C(=O)NCc3ccco3)cc2)c1 40935021 JMWFLFMFQCNRHZ-LTGZKZEYSA-N 444.487 4.576 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2ccc(-c3ccc(C(C)=O)cc3)o2)cc1 58894772 VLKVNDWDJFUCQF-IPLHSMHLSA-N 434.492 4.512 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc1COc1ccc(C(C)(C)C)cc1 58976448 VIXRYCONVCDEJH-FTAOIEMSSA-N 448.563 4.774 50 10 IJGE COc1ccc(/C=N/NC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)c(Br)c1O 169889105 ZMKGYHYOGAIFBY-XQFVPSOISA-N 435.362 4.610 50 10 IJGE CCOc1ccc2ccccc2c1/C=N\NC(=O)c1cccn(Cc2ccc(C)cc2)c1=O 169919993 JSABQTCVIYXZAF-QRQIAZFYSA-N 439.515 4.521 50 10 IJGE CC(=NNC(=O)c1cccc(Br)c1)c1cccc(NC(=O)c2ccc(C)o2)c1 252639695 YMUMOWZENSQDKN-UHFFFAOYSA-N 440.297 4.757 50 10 IJGE Cc1sc([C@@H](Br)c2cnn(C)c2Br)cc1Br 379220336 SKXOUCSTELOCLO-VIFPVBQESA-N 428.975 4.799 50 10 IJGE O=C(N[C@@H](CCl)C1CCCCC1)c1cc(Cl)ccc1I 386038013 AGQGNGMMOOWUMX-AWEZNQCLSA-N 426.125 4.862 50 10 IJGE C[C@@H]1CCCC[C@H]1O[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 725343870 LGQMFVQUMSCBDO-RKVPGOIHSA-N 437.362 4.786 50 10 IJGE Cc1cccc(Oc2ccc(NC(=O)NNC(=O)c3cccc4cccnc34)cn2)c1C 756733077 MNDQUKKEYPIBEQ-UHFFFAOYSA-N 427.464 4.505 50 10 IJGE Cc1noc(C)c1CSc1ncccc1C(=O)Oc1ccc([N+](=O)[O-])c2ncccc12 770136199 NLZSWKAVVVYXNF-UHFFFAOYSA-N 436.449 4.654 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1OCc1ccc(F)cc1 1084087689 FKGHEOBPDLTISU-WQRHYEAKSA-N 447.422 4.867 50 10 IJGE CC(=O)c1ccc(Br)c(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1 1208488265 AKNLREDVZLFLQP-UHFFFAOYSA-N 441.207 4.691 50 10 IJGE CC(=O)c1oc2cc(C)ccc2c1CC(=O)NNc1ccc(-c2ccc(Cl)s2)nn1 1306866598 AIPSTUKCSNAKFC-UHFFFAOYSA-N 440.912 4.802 50 10 IJGE CC(=O)c1cccc(O[C@@H](C)C(=O)NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 1468388492 GQTJGNLSHCOSHO-NSHDSACASA-N 434.336 4.837 50 10 IJGE C#CCCCC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1)C[C@@H](C)C2 1597394171 QHZSTOIQJYRAOF-SRIJWZPRSA-N 437.543 4.922 50 10 IJGE C=CC1(CC(=O)N2CCC[C@H](O[Si](C)(C)C(C)(C)C)C2)CN(C(=O)OC(C)(C)C)C1 1642182283 RMVCONLEYYPRGK-SFHVURJKSA-N 438.685 4.812 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccccc2)cc1OCC 1865689248 NHBPIWGOTNHDOL-HSZRJFAPSA-N 444.535 4.509 50 10 IJGE CCc1nn(-c2ccccc2Cl)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699064 KCGRDFCDMVWXLE-NRFANRHFSA-N 429.911 4.798 50 10 IJGE CC(C)c1csc(/C(C#N)=C(\O)[C@H](Cc2ccccc2)N2C(=O)c3ccccc3C2=O)n1 1872750193 AVJNVSCUSGVHTI-NNWMPZTLSA-N 443.528 4.967 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cc(C(F)(F)F)ccc1F 1916354720 LCZBUVWEIKXJNW-HNNXBMFYSA-N 448.254 4.897 50 10 IJGE BrCC[C@@H](NCc1ccc(Br)cc1Br)C1CC1 1943842700 HIEPBZRWCIQSIX-CYBMUJFWSA-N 425.990 4.865 50 10 IJGE C[C@H]1[C@@H](CBr)CCN1Cc1cccc(Br)c1Br 1943880167 AZPGTAPQPPANDR-VHSXEESVSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@H](CI)O2)CC12CCC2 1986112750 SSZRSNPAETYZOM-RDTXWAMCSA-N 435.346 4.683 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](O[C@@H]2CCC[C@H]3CCCC[C@@H]32)C1 2022999282 SXDJZCXEBNAURT-DRRXZNNHSA-N 449.373 4.785 50 10 IJGE O=C(CBr)c1ccc(Br)c(OC(F)(F)F)c1Br 2054922978 VTTMQHQPAUYWLO-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE CCC[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](CC(F)(F)F)C1 2055949140 RYWDPEYSSGBSRT-KGLIPLIRSA-N 431.337 4.671 50 10 IJGE O=S(=O)(c1cc(F)c(Cl)c(CBr)c1)N(Cc1ccccc1)CC1CC1 2059314670 OJSVHYRRZJQKAV-UHFFFAOYSA-N 446.769 4.975 50 10 IJGE COc1cccc(Cn2nc(CBr)c(Br)c2C(F)(F)F)c1 2079233523 XWABTEBYKUKOGO-UHFFFAOYSA-N 428.046 4.616 50 10 IJGE CS(=O)(=O)c1sccc1[C@@H](Br)c1ccc(F)c(Br)c1 2094149051 NZPJFFJCQUCVFK-NSHDSACASA-N 428.142 4.538 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C(F)(F)F)N(CC2(CBr)CCCC2)CC1 2106784802 LESRNAKKTJQQLN-AWEZNQCLSA-N 443.348 4.815 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@@H](Br)[C@H]1CCCCS1(=O)=O 2137644665 ZIGHWSFNISNRKX-CHWSQXEVSA-N 430.589 4.814 50 10 IJGE CCCC(CBr)(CCC)CN(C1CN(C(=O)OC(C)(C)C)C1)[C@H]1CCOC1 2163063712 QZNXFEQOHKHGHN-KRWDZBQOSA-N 447.458 4.678 50 10 IJGE O=C(Nc1cc(Cl)cc(Br)c1OC(F)F)[C@H]1C[C@H](Br)C1 2196897034 ULSJADVUJAWYMQ-IZLXSQMJSA-N 433.474 4.816 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CCCCCCBr)CC[C@@H]1C(F)(F)F 2231105232 YVXJEUYTSRWDJT-CABCVRRESA-N 445.364 4.967 50 10 IJGE CCN(C[C@](C)(CI)OC[C@H]1CCC1(C)C)C(=O)OC(C)(C)C 2243126527 JYEFIORPJBXXAG-KDOFPFPSSA-N 439.378 4.890 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(CCCCCCBr)[C@@H](C(F)(F)F)C1 2255000971 HZXOXVWUTVYDKI-UONOGXRCSA-N 431.337 4.862 50 10 IJGE CCOc1c(Br)cc(Br)cc1CN[C@H]1C[C@H](Br)C1 2263405831 XUTMJBLTHICVSC-XYPYZODXSA-N 441.989 4.626 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCCN(CC2(CBr)CC(F)C2)C1 2265638370 LXIOIPKYZBOOPH-HMFCVHIJSA-N 433.406 4.611 50 10 IJGE COc1ccc(C[C@@H](Br)c2ccc(OC)c(I)c2)cc1 2284998615 LWCLYVQMIAJCBQ-CQSZACIVSA-N 447.110 4.987 50 10 IJGE Br[C@@H]1C[C@@H]2CCCC[C@@H]2N(Cc2sccc2I)C1 2316765476 XMPVEOSHMSASMR-LOWVWBTDSA-N 440.188 4.881 50 10 IJGE Cc1cccc(N2CCN(C=C(C#N)C(=O)N[C@@H](C)C34CC5CC(CC(C5)C3)C4)CC2)c1C 2318467644 DZQHPNHIQJQZHB-WKDXJVAJSA-N 446.639 4.554 50 10 IJGE O=C(Cc1c(F)cccc1Cl)N[C@H](CCBr)COCc1ccccc1 2320360169 JEWBGIRRVGNJBI-OAHLLOKOSA-N 428.729 4.508 50 10 IJGE COc1ccc2c(c1)c(C=C1Oc3cc(OC(=O)C(Cl)Cl)ccc3C1=O)cn2C 2323758629 ROGJQCIVSWODFV-UHFFFAOYSA-N 432.259 4.512 50 10 IJGE C[C@]12CN(Cc3cc(I)ccc3Cl)C[C@@]1(CBr)C2 2327401901 TUEMFSRGBGSDFO-KBPBESRZSA-N 440.550 4.552 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cccc(OC(F)(F)F)c1 2369430400 CHFULHDHORXPPH-MRXNPFEDSA-N 446.263 4.685 50 10 IJGE CCn1nc(C)c(CCl)c1OCc1cc(I)ccc1Cl 2380353791 PYIDZMZYISBBTA-UHFFFAOYSA-N 425.097 4.787 50 10 IJGE CCCCCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC)c(OC)c2)cc1 40858368 YXRHQIXHDJVAAC-HMMYKYKNSA-N 436.508 4.987 50 10 IJGE O=C(N/N=C(/CSc1nc2ccccc2o1)c1ccc([N+](=O)[O-])cc1)c1ccccc1 59460638 OXOFZRUXTUFCFW-CLCOLTQESA-N 432.461 4.662 50 10 IJGE O=C(N/N=C/c1cc(Cl)ccc1O)c1ccc(NC(=O)c2cccc(Cl)c2)cc1 97729961 UUWBGKPXVNGRDV-WYMPLXKRSA-N 428.275 4.715 50 10 IJGE COc1cc(Cl)c([C@@H](Cl)c2cnn(C)c2I)cc1Cl 379220677 SQYPSSSUSCXIHY-LLVKDONJSA-N 431.488 4.668 50 10 IJGE O=C(N[C@H]1CCC[C@@H](Br)C1)c1cc(Br)cc(Br)c1 694505960 MJJIVRHYXYXBDE-SKDRFNHKSA-N 439.973 4.648 50 10 IJGE C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1nc2cc(Cl)ccc2cc1C 1137831135 NIDVFDMGHWMSAR-INIZCTEOSA-N 439.343 4.676 50 10 IJGE C#C[C@@H](NC(=O)NNc1c(Cl)cc(Br)cc1Cl)c1ccc(F)cc1 1252431063 CSPXVIOLQCLLFG-CQSZACIVSA-N 431.092 4.896 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2cc(Cl)ccc2SC2CCCC2)c1 1471691311 AJPUMTOBKPBQGM-UHFFFAOYSA-N 429.998 4.987 50 10 IJGE Cc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865688825 BZLNUEIJGDGVSZ-LJQANCHMSA-N 445.281 4.610 50 10 IJGE CCCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3C)cc1 1865694216 VYTQKXPNPURKEP-JOCHJYFZSA-N 444.535 4.883 50 10 IJGE CCCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1cccnc1)C(C#N)=C(N)O2 1865699874 FMTZXMIMMBYDJR-GOSISDBHSA-N 426.307 4.745 50 10 IJGE COCCOc1ccc(/C=C(\C#N)C(=O)N(Cc2ccccc2)Cc2ccccc2)cc1 1866385902 NFYZRQQJYPKGMP-XIEYBQDHSA-N 426.516 4.848 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCN(Cc2ccccc2)CC12CCC2 1882089158 XQBQRENXRXFAPO-MOPGFXCFSA-N 437.422 4.967 50 10 IJGE Cc1csc(C)c1S(=O)(=O)N(Cc1ccccc1)[C@@H](CBr)C(C)C 1915307041 CXNOBDBTMJPKCX-KRWDZBQOSA-N 430.433 4.975 50 10 IJGE C[C@@H](CS(=O)(=O)N(Cc1ccccc1)C1(CBr)CCC1)c1ccccc1 1915754885 FLFDMKWNASRCEM-SFHVURJKSA-N 436.415 4.940 50 10 IJGE O=C(NC1(C(F)(F)F)CCC(Br)CC1)c1csc(Br)c1 1924692392 JKGOAPHIYMCVDI-UHFFFAOYSA-N 435.103 4.879 50 10 IJGE CCCC(CBr)(CBr)Cc1nn(CC)cc1Br 2010550232 OPZLMOWMHYYQAR-UHFFFAOYSA-N 431.010 4.784 50 10 IJGE CO[C@H]1C[C@H]1COc1c(Br)cc(Br)cc1CBr 2014582837 LNZGJOWARFCBFW-KWQFWETISA-N 428.946 4.520 50 10 IJGE O=Cc1cc(Br)cc(Br)c1OCC1CC(Br)C1 2020213114 DZCWOAHMVGLTRD-UHFFFAOYSA-N 426.930 4.576 50 10 IJGE Cc1cc(Br)ccc1S(=O)(=O)N(Cc1ccccc1)C(C)(C)CCl 2025940009 SAVPGRMXOCTIBE-UHFFFAOYSA-N 430.795 4.966 50 10 IJGE CCOC(C)(C)CO[C@@H](CI)c1ccccc1Br 2033158472 HBUSKEDYZDDHFS-ZDUSSCGKSA-N 427.120 4.757 50 10 IJGE Cl[C@@H]1CCN(c2ncc(I)cc2Br)C2(CCC2)C1 2069529483 QLHAKDWIPNVGMP-SECBINFHSA-N 441.538 4.579 50 10 IJGE ClCC1CCC(CNc2ncc(I)cc2Br)CC1 2069533312 GJFYNYNKGJNTGZ-UHFFFAOYSA-N 443.554 4.906 50 10 IJGE COc1ccc(-n2nc(CBr)c(Br)c2C(F)(F)F)cc1C 2079236109 NUBXIEVMBIZJQS-UHFFFAOYSA-N 428.046 4.866 50 10 IJGE C[C@@H]1CCc2nn(-c3cc(C(F)(F)F)cc(Br)n3)c(CBr)c21 2080517352 JNPQMUNTBGCFHD-SSDOTTSWSA-N 439.073 4.993 50 10 IJGE ClCCc1nc2ccc(Br)cc2n1Cc1nccn1Cc1ccccc1 2090021709 OSIOOTPRMBKENW-UHFFFAOYSA-N 429.749 4.873 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H]1Cn1c(CCl)nc2cncc(Br)c21 2095438907 BRUVVZIVWNFKPC-HOCLYGCPSA-N 433.781 4.701 50 10 IJGE C[C@H](CCBr)CCN1CC[C@@H](C(F)(F)F)C[C@@H]1CNC(=O)OC(C)(C)C 2107584865 NUYVLALBNLAOAN-RBSFLKMASA-N 445.364 4.965 50 10 IJGE O=C(c1cc(Cl)cc(Br)c1)N1CCC([C@@H](F)CBr)CC1 2163246663 RVKDJTHCHVISCW-ZDUSSCGKSA-N 427.539 4.688 50 10 IJGE C[C@@H]1[C@@H](NC(=O)OC(C)(C)C)CC[C@@H](C(=O)N(C)C[C@H]2C[C@@H](Br)C2)C1(C)C 2196913592 DZNBBBUSGFIMGW-NRKLIOEPSA-N 445.442 4.584 50 10 IJGE BrC[C@]12CCCC[C@@H]1N(C[C@H]1CC1(Br)Br)CCC2 2218007183 QZQUBPIDIXSMNO-FRRDWIJNSA-N 444.049 4.912 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2C[C@H]1CN(CC1(CBr)CCCCCC1)C2 2226527389 ZSZQENBRCAIMLN-FGTMMUONSA-N 429.443 4.957 50 10 IJGE CCOCc1cc(Br)c([C@H](Br)[C@@]23COC[C@H]2C3(F)F)s1 2233017388 XJOHFQODAUTSHF-ADEWGFFLSA-N 432.124 4.765 50 10 IJGE C[C@H](COC(F)F)O[C@@H](CI)c1ccccc1Br 2253912356 AMDMUCJMAWFAHM-KCJUWKMLSA-N 435.046 4.570 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@@H]1[C@H]2CCO[C@H]21 2259994927 NAMSQMASLSWLRX-AXMNTDEYSA-N 446.911 4.961 50 10 IJGE C[C@@H](CC1CCN(CC2(CBr)CC(F)C2)CC1)N(C)C(=O)OC(C)(C)C 2265632146 KWTYNCITDJQWPW-FVWXCPNNSA-N 435.422 4.857 50 10 IJGE COc1ccc([C@@H](Br)c2c(Cl)cnn2C)c(Br)c1Cl 2268267483 FOTMGQOBTIZESG-SNVBAGLBSA-N 428.939 4.982 50 10 IJGE C[C@]1(CCBr)CCN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285835827 SULDFVYEPJPIPG-AWEZNQCLSA-N 427.539 4.879 50 10 IJGE CCCCCOc1ccc(C=C(C#N)C(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc1 2296495446 IRZCOLZGZWNRPQ-UHFFFAOYSA-N 437.565 4.840 50 10 IJGE C[C@@H]1CC[C@H](CBr)CN1Cc1ccc(Cl)c(I)c1 2315551062 LMKNPSMLJDSSOF-ZYHUDNBSSA-N 442.566 4.940 50 10 IJGE CCCO[C@@H]1[C@@H](Br)C[C@H]1Oc1cc(Br)cc(Br)c1 2316829346 PHMQHQOSLDAXHO-YNEHKIRRSA-N 442.973 4.921 50 10 IJGE CC[C@H](Br)[C@@H](CC)NC(=O)c1ccc(Cl)cc1I 2317771904 VYSPFMUNCSLQGD-CMPLNLGQSA-N 444.538 4.627 50 10 IJGE Cc1c(Br)ccc(OCC(C)(C)CI)c1[N+](=O)[O-] 2326699786 QQQRZEPZTWGFSB-UHFFFAOYSA-N 428.064 4.506 50 10 IJGE COc1ccc(/C(C#N)=C\c2ccc(OC(=O)c3ccc4c(c3)OCO4)cc2)cc1OC 31901030 QTYCGDXLXOUVCL-ODLFYWEKSA-N 429.428 4.716 50 10 IJGE O=C1COc2ccc([C@H](Cl)c3cc(Br)c(Br)s3)cc2N1 128544620 MPURZJXDPBCKCK-LBPRGKRZSA-N 437.540 4.932 50 10 IJGE CC(C)(C)[Si](OCc1ccc(Br)nc1)(c1ccccc1)c1ccccc1 197378073 FQUIHUGNBPHCSA-UHFFFAOYSA-N 426.430 4.921 50 10 IJGE CCCCOc1ccc(/C=C\C(=O)Oc2ccc(/C=C(\C#N)C(=O)OC)cc2OC)cc1 206272443 GRRJRDJHMBRNNS-DSIZLIJGSA-N 435.476 4.573 50 10 IJGE CCCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3cccc(OC)c3)cc2)cc1 254698381 XGHCYRCFFFHCMS-UHFFFAOYSA-N 446.503 4.857 50 10 IJGE Cc1cccc(NCC(=O)NN=C2C(=O)N(Cc3cccc4ccccc34)c3ccccc32)c1 254700018 XIOHAVOJYDADSN-UHFFFAOYSA-N 448.526 4.627 50 10 IJGE C[C@H](Br)C[C@@H]1CCCCCN1S(=O)(=O)c1cc(Br)cs1 312503987 RAOWCHVCUHCCER-JQWIXIFHSA-N 445.242 4.617 50 10 IJGE CC(C)(C)[C@@H](CBr)NC(=O)c1cc(Br)c(Br)s1 393951355 QCKRCNFFBWOLGB-MRVPVSSYSA-N 448.018 4.813 50 10 IJGE FC(F)(F)c1cnc(N(CCCl)Cc2ccccc2)c(I)c1 686111593 MBIJQZHGNGAXHD-UHFFFAOYSA-N 440.634 4.950 50 10 IJGE ClCc1nc2cccc(Br)c2n1CC[C@H]1CN(Cc2ccccc2)CCO1 697743134 LBENYRYKICZIIM-KRWDZBQOSA-N 448.792 4.829 50 10 IJGE O=C(NN=Cc1ccccc1OCc1ccccc1)c1ccn(Cc2ccc(Cl)cc2)n1 1084024416 BEQPXAVXUBUHNJ-UHFFFAOYSA-N 444.922 4.928 50 10 IJGE C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)C(=O)NN=C(c1ccccc1)c1ccccc1 1141361469 NVTIRTLKHWYYLX-IBGZPJMESA-N 427.932 4.591 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cc(Cl)ccc2SC(C)C)cc1 1200243356 GVMVVBWGBIDVLX-CQSZACIVSA-N 449.960 4.663 50 10 IJGE C#CCN(C(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C)[C@@H]1CCCc2ccccc21 1463010051 TWAWSPJXNKTCJR-YNLVEQEMSA-N 441.575 4.730 50 10 IJGE C#CC[C@@H](CCOC)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1530713173 OIJNQLITWGARQE-LJLZWOEMSA-N 444.362 4.853 50 10 IJGE Cc1cccc(COc2ccccc2C=NNC(=O)CSc2nc3ccccc3[nH]2)c1 1772760584 WWPVTXZXAAWQJF-UHFFFAOYSA-N 430.533 4.693 50 10 IJGE O[C@H](c1c(Br)sc(Br)c1Br)[C@@H]1C[C@@H]1Cl 1893453263 LVNZMIRTJIAHCU-KMYHCQSRSA-N 425.367 4.696 50 10 IJGE CCC[C@H](Br)CNC(=O)c1csc(Br)c1Br 1937739223 ZPOVWLXOTGAXFX-LURJTMIESA-N 433.991 4.567 50 10 IJGE C[C@H](Br)[C@@H]1CCN(Cc2ccc(Br)cc2Br)C1 1943846801 MEEJJFJDEYRKLP-VHSXEESVSA-N 425.990 4.817 50 10 IJGE CC[C@@H](NC(=O)c1cccc(Br)c1Br)[C@H](C)Br 1943907976 XVZKVUHZRNZZDD-OIBJUYFYSA-N 427.962 4.503 50 10 IJGE CC(C)(C)OC(=O)NCCCN(CCBr)c1cccc(Br)c1 1959568417 MPSVPNLRRIONEY-UHFFFAOYSA-N 436.188 4.565 50 10 IJGE O=C(CCl)c1cc(C(F)(F)F)c(OC(F)(F)F)cc1I 2055152009 WPOQMLWFUBLAAT-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1c(Cl)cccc1Br 2081246894 RGAPWSCIGDPMHQ-LDYMZIIASA-N 444.538 4.682 50 10 IJGE CCC[C@]1(CNC(=O)[C@H](Br)C2CCCC2)CCCN1C(=O)OC(C)(C)C 2110720099 BEONVKSVOQMOTD-OXQOHEQNSA-N 431.415 4.626 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CCN(CC1(CBr)CCOCC1)C2 2163057473 BTKKOBHYYWMHDO-UHFFFAOYSA-N 439.394 4.583 50 10 IJGE ClCCCOC1CCN(Cc2cc(Br)ccc2Br)CC1 2207525040 RUQQTCZOEULJRP-UHFFFAOYSA-N 425.592 4.822 50 10 IJGE C[C@@H]1COC[C@H]1[C@@H](Br)Cc1cc(Br)cc(Br)c1 2252838385 CDFORUCKTMRVTB-WQHBLYJGSA-N 426.974 4.800 50 10 IJGE COc1ccc([C@H](Cl)c2nn(C)cc2Br)c(Br)c1Cl 2268259737 NWFCYVVYKCDDNO-JTQLQIEISA-N 428.939 4.935 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H]1CBr)c1cc(F)c(Br)cc1Cl 2282969515 DCSFZMSJSHZIIH-BDAKNGLRSA-N 427.539 4.783 50 10 IJGE Cc1cc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)cc(CBr)n1 2288422656 NIFUGVQEKCGCEG-PVSGBFIBSA-N 426.402 4.632 50 10 IJGE O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)NN=CC=Cc1ccccc1 2293582605 LCZAOQXPIKJIQX-UHFFFAOYSA-N 439.544 4.842 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)Nc2ccc(CC)cc2)cc(Br)c1OC 2293665237 GYUPIPBGEMJDRY-UHFFFAOYSA-N 429.314 4.964 50 10 IJGE COc1ccc(-c2cc(C(=O)NN=CC=Cc3ccco3)c3ccccc3n2)c(OC)c1 2295312298 BOARPFLFGYMSOK-UHFFFAOYSA-N 427.460 4.941 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)C=Cc3cccs3)ccc2[C@@H]1c1ccc(F)cc1F 2297640451 KXXRABGILWHZJH-QFIPXVFZSA-N 436.439 4.863 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@@H]2C[C@H]3CC[C@H](C3)C2)CC1 2299581611 AQCXOLHURUDJPK-ZSHCYNCHSA-N 449.373 4.786 50 10 IJGE N#CC(=Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 2314486013 AGNJPCQBXRRFNQ-UHFFFAOYSA-N 438.783 4.962 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC=C(C#N)C(=O)N1CCC(Cc2ccccc2)CC1 2324765212 JCXJBLBTIHMJQI-NRFANRHFSA-N 431.580 4.933 50 10 IJGE CC[C@H](NC(=O)C(C#N)=CNc1cc(Br)ccn1)c1ccc2c(c1)CCCC2 2325092830 WYAQDPMUVQMYKB-FQEVSTJZSA-N 439.357 4.810 50 10 IJGE FC(F)(CI)C(F)(F)CNCc1cc(Cl)ccc1Cl 2336531100 DRFQFCPPFUULPR-UHFFFAOYSA-N 430.010 4.789 50 10 IJGE Cc1cccc(COc2ccccc2/C=N/NC(=O)CSc2nc3ccccc3[nH]2)c1 32520591 WWPVTXZXAAWQJF-AFUMVMLFSA-N 430.533 4.693 50 10 IJGE C[C@@H](Cl)C(=O)N1CCN(c2nc(C3CCCCC3)nc3sc4c(c23)CCCC4)CC1 35849092 VHZIEYMQDGMCJY-OAHLLOKOSA-N 447.048 4.894 50 10 IJGE Cc1c(Cl)cccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccco1)CCC2 40814422 XORYUVHPKIIEIX-PCLIKHOPSA-N 425.872 4.866 50 10 IJGE CCc1cc(Br)ccc1NS(=O)(=O)c1ccc(CBr)cc1 128367738 HOWIHBFJNNGTAL-UHFFFAOYSA-N 433.165 4.707 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2cccc(OC)c2)sc2c1CC[C@@H](CC)C2 209406414 PHMPDLINOGNYPN-QJISPJEISA-N 438.549 4.994 50 10 IJGE CC(=NNC(=O)CCCCC(=O)NN=C(C)c1ccc(C)cc1C)c1ccc(C)cc1C 252638777 YGNPWGWPJHVKCE-UHFFFAOYSA-N 434.584 4.861 50 10 IJGE CC(=NNC(=O)c1cc(C)nc2c1c(C)nn2-c1ccccc1)c1cccc(OC(F)F)c1 254556480 SBEPTPZMVXISCX-UHFFFAOYSA-N 449.461 4.793 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@@H](c2ccc(Br)c(O)c2)C1 382673326 GEWMQEMTOOHNRI-VXGBXAGGSA-N 435.156 4.500 50 10 IJGE Oc1c(Br)cccc1[C@@H]1CN(Cc2ccccc2)C[C@H]1CBr 382694357 WWEJURUDFAPOPH-GDBMZVCRSA-N 425.164 4.765 50 10 IJGE O=C(NC1(CBr)CCCCCC1)c1ccc(I)cc1 713458889 RPILCRZGOZLMKV-UHFFFAOYSA-N 436.131 4.509 50 10 IJGE COc1ccc(OC(F)F)c(C=NNC(=O)c2ccccc2OCc2ccc(F)cc2)c1 732924495 VSFQFIVKNFXLMP-UHFFFAOYSA-N 444.409 4.779 50 10 IJGE CCc1c(C)nn(-c2cccc(C(=O)NNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])c2)c1C 766753827 JLBBAJHXNDHVNB-UHFFFAOYSA-N 447.417 4.735 50 10 IJGE O=C(CCCSc1nc2ccc([N+](=O)[O-])cc2s1)NN=C/C=C/c1ccccc1 1083977600 HFFKTEDUCDDMQT-ORQBTTOASA-N 426.523 4.892 50 10 IJGE Cc1cc(C=NNC(=O)c2cccs2)c(C)n1-c1ccc(I)cc1 1084161796 RIRVPQRAKHAEOH-UHFFFAOYSA-N 449.317 4.524 50 10 IJGE C#Cc1ccc(NC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)c(Cl)c1 1220235495 WPEGZZZBXRHAKK-UHFFFAOYSA-N 430.851 4.596 50 10 IJGE C#CCCCCC(=O)NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1 1351033231 OJOYDYMCPLNYHL-UHFFFAOYSA-N 426.516 4.887 50 10 IJGE C=C(C)[C@H](NC(=O)NNc1cc(OC)ccc1Br)c1ccc(F)c(F)c1 1469857755 XAYPBBQLWVKELI-KRWDZBQOSA-N 426.261 4.679 50 10 IJGE COc1ccc2nc(NNC(=O)c3cc4cccc(C(F)(F)F)c4nc3O)c(C)cc2c1 1546235803 MXQTTXWEACQGQN-UHFFFAOYSA-N 442.397 4.581 50 10 IJGE FC(F)Oc1ccccc1[C@H]1CN(Cc2ccccc2)C[C@H]1CI 1614623385 CVEIPZQVFJEYQT-WBVHZDCISA-N 443.275 4.939 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1cccc(F)c1 1624296279 JSWWDLWMHWKECL-DTQAZKPQSA-N 438.886 4.923 50 10 IJGE C=C(C)[C@H](NC(=O)NNC(=O)c1ccc(-n2c(C)ccc2C)cc1)c1ccc(F)c(F)c1 1634436223 WOFYXWSZBOEWPL-QFIPXVFZSA-N 438.478 4.634 50 10 IJGE CC(=O)c1c(C)cc(NC(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)cc1C 1674157491 QWNHPNQHQMUSCA-UHFFFAOYSA-N 425.485 4.840 50 10 IJGE Cc1c(C(=O)Oc2ccc3ccccc3c2)oc2c1C(=NNC(=O)c1ccccn1)CCC2 1772747525 QAYBYJNUZUIWJE-UHFFFAOYSA-N 439.471 4.826 50 10 IJGE C[C@H]1CN(c2cc(Nc3ccc(SC#N)cc3)nc(-c3cccnc3)n2)C(C)(C)CO1 1868564789 FHAZABBHLINEOP-INIZCTEOSA-N 432.553 4.859 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Cl)CCc1cc(Cl)cc(Br)c1 1905405752 PXQKOCQVNNIBRY-CYBMUJFWSA-N 427.125 4.939 50 10 IJGE Cc1sc(C)c(S(=O)(=O)NC2(C)CCC(Br)CC2)c1Br 1924744286 LFBZZAYQPXPRGD-UHFFFAOYSA-N 445.242 4.502 50 10 IJGE O=C(N[C@@H]1CC[C@@H](CBr)C1)c1csc(Br)c1Br 1945189758 ZDMOCNPKJLZXAF-RNFRBKRXSA-N 446.002 4.567 50 10 IJGE C[C@H](Br)CN(Cc1ccc(I)c(Cl)c1)C1CC1 2026567472 SDSCJWKUICPQSU-VIFPVBQESA-N 428.539 4.692 50 10 IJGE O=C(NCC[C@H](Br)C1CC1)c1cc(Br)ccc1Br 2029911947 OSAMLUWLXPJFRR-NSHDSACASA-N 439.973 4.505 50 10 IJGE O=C(NC1CCC(Br)CC1)c1cccc(Br)c1Br 2031487419 UGFNDROMEDGJEC-UHFFFAOYSA-N 439.973 4.648 50 10 IJGE CC[C@@H](COC)O[C@@](C)(CI)c1ccccc1Br 2033504628 NLTJAMLJHDOVTP-FZMZJTMJSA-N 427.120 4.541 50 10 IJGE ClCc1nc2cc(I)ccc2n1C[C@H]1C[C@H](Br)C1 2076270317 WDPRFYLUBOWVSF-KYZUINATSA-N 439.522 4.553 50 10 IJGE CCCn1cc(S(=O)(=O)N(Cc2ccccc2)CC2CCC2)cc1CBr 2123269056 HBPRDKQMIKDTKG-UHFFFAOYSA-N 439.419 4.784 50 10 IJGE C[C@@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)cc(F)c1F 2123269832 KYPOYGRVLYQAIH-ZDUSSCGKSA-N 444.341 4.849 50 10 IJGE C[C@@H](c1nscc1Br)N(C)c1nc(CCl)ccc1Br 2130018705 LNZLUELOFJGTSQ-ZETCQYMHSA-N 425.577 4.999 50 10 IJGE CC(C)(C)OC(=O)N1CC[S@@](=O)(=NCc2ccc(CBr)cc2)C(C)(C)C1 2132804999 QNYKWFONBJTKIE-SANMLTNESA-N 445.423 4.579 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 2163057292 AFUWIXNZVOOGJH-LEAZDLGRSA-N 437.422 4.885 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@H]1c1ccc(NC(=O)[C@@H](Br)C2CCCC2)cc1 2167047798 LMTGBNWVOUJZNF-KSZLIROESA-N 437.378 4.959 50 10 IJGE O=C(N[C@@H]1CCN(Cc2ccccc2)C2(CCC2)C1)c1ccc(CBr)cc1 2173443398 JMXGOFIBGIYKMR-OAQYLSRUSA-N 427.386 4.899 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CN(CCCCCCCCCBr)C[C@H]1CCO2 2175184361 VEVBXYLABDKOOQ-NQIIRXRSSA-N 447.458 4.728 50 10 IJGE CN(C(=O)[C@H](Br)C1CCCC1)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 2197469241 KJSNSOOSOLFAIH-ZWKOTPCHSA-N 439.394 4.665 50 10 IJGE Cc1cc(Cl)cc(C(=O)N(C)C[C@@H]2C[C@H]2Br)c1NC(=O)OC(C)(C)C 2223980527 DJNZTLUDLLMTAW-SMDDNHRTSA-N 431.758 4.851 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1Cc1cc(Br)ccc1Br 2251042875 VGDHPHOUPFCVSI-CHWSQXEVSA-N 425.990 4.959 50 10 IJGE O=C(NC[C@]1(CBr)CC12CCC2)c1scc(Br)c1Cl 2264516279 YIEQFIQNKYRMPK-CYBMUJFWSA-N 427.589 4.849 50 10 IJGE C[C@@H](CCCCCBr)NC(=O)c1c(F)cccc1I 2267671778 XYBDUWNITHIBLQ-JTQLQIEISA-N 442.110 4.504 50 10 IJGE CN(C[C@H]1C[C@@H]1Br)C(=O)CCCCCCCCCNC(=O)OC(C)(C)C 2269414617 GGLMPIVHSDTTFG-SJORKVTESA-N 433.431 4.874 50 10 IJGE CC[C@H](Br)[C@H]1CCCCN1Cc1sccc1I 2301072125 VJXFBYOQNNKJDA-CMPLNLGQSA-N 428.177 4.881 50 10 IJGE COc1ccc(CCCCC[C@H](Br)CN2C(=O)c3ccccc3C2=O)cc1 2303894573 QRFBZVQOEPFOSY-KRWDZBQOSA-N 430.342 4.858 50 10 IJGE FC1(F)CC[C@H]1CO[C@H](CI)c1ccc(Br)cc1 2313734612 YKYCLKCTVCZGEU-CMPLNLGQSA-N 431.058 4.987 50 10 IJGE COC[C@]1(C)C[C@]1(CBr)Cc1ccc(Cl)cc1I 2318546611 UPFDGTDFYPRGCK-KBPBESRZSA-N 443.550 4.925 50 10 IJGE C[C@H](Br)CC1C[C@@H]2CC[C@H](C1)N2C[C@@H]1CC1(Br)Br 2318712593 PFIKSWVGGACBKN-HNMFLPSRSA-N 444.049 4.909 50 10 IJGE COc1ccc(CC(=O)Oc2ccc(C=C(C#N)c3ccc(OC)cc3)cc2OC)cc1 2320506479 KLOFROMCAJFLBQ-UHFFFAOYSA-N 429.472 4.925 50 10 IJGE COc1ccc(NC=C(C#N)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1OC 2325381968 VQARRJGCEQEKPG-UHFFFAOYSA-N 425.794 4.834 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)[C@H]3CC(=O)N(C(C)(C)C)C3)n2)c(C)c1C 2331362333 XPCRDBPXJZWZKY-HNNXBMFYSA-N 425.554 4.875 50 10 IJGE COc1cc([C@@H](Cl)c2cc(I)sn2)c(OC)cc1Cl 2338224989 FHHNDBWVYQFIOT-GFCCVEGCSA-N 430.094 4.747 50 10 IJGE CC1CC(CBr)(CN(C)C2C[C@@H]3C[C@H](C2)CN(C(=O)OC(C)(C)C)C3)C1 2339979656 SXSXHVWBHNIGMW-WHWMZARZSA-N 429.443 4.765 50 10 IJGE Cc1ccc(/C=C(/C#N)C(=O)Nc2ccc(NC(=O)/C(C#N)=C\c3ccc(C)o3)cc2)o1 8660901 LOTIUWJADRPXEQ-WHYMJUELSA-N 426.432 4.581 50 10 IJGE O=C(CCC(=O)Nc1ccccc1Cl)N/N=C/c1ccc(OCc2ccccc2)cc1 12579827 YKKLBWNFZVHODV-WGOQTCKBSA-N 435.911 4.788 50 10 IJGE O=C(NNC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)c1ccc(Cl)cc1 16202482 NWDYEPLKWVVOIE-UHFFFAOYSA-N 435.789 4.621 50 10 IJGE CCCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccc(C)cc3)c(OC)c2)C1=O 38603732 YLMXGASWDXZPLS-HYARGMPZSA-N 444.531 4.975 50 10 IJGE Cc1ccccc1NC(=O)/C(C#N)=C\c1c(Oc2ccccc2)nc2c(C)cccn2c1=O 39858499 RKWZINWZRRUTKF-CYVLTUHYSA-N 436.471 4.649 50 10 IJGE CCc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(OC)cc1)CCC2 40813814 DXQBNOAXOZTIIO-SGWCAAJKSA-N 445.519 4.882 50 10 IJGE COc1ccc(/C=N/NC(=O)c2ccccc2OCc2ccc(Br)cc2)cc1 96095913 MSFISSALOYPBAH-ZVHZXABRSA-N 439.309 4.801 50 10 IJGE O=C1NCCc2ccc([C@H](Cl)c3cc(Br)c(Br)s3)cc21 128567088 OBZMUJKYHNNTGR-LBPRGKRZSA-N 435.568 4.887 50 10 IJGE O=C(N/N=C\c1cccc(Br)c1)c1ccc2[nH]c(Cc3ccccc3)nc2c1 169925932 CUPDHURJLDXPOZ-OYKKKHCWSA-N 433.309 4.680 50 10 IJGE COc1cc(N/C=C(/C#N)C(=O)N2CCC(Cc3ccccc3)CC2)c(OC)cc1Cl 216888340 WWPQTRISRRHQEW-MNDPQUGUSA-N 439.943 4.658 50 10 IJGE N#C/C(=C/Nc1ccccc1Sc1ccccc1)C(=O)NCc1ccc2c(c1)OCO2 216997390 OIIVDGUNRJFKPM-SDXDJHTJSA-N 429.501 4.702 50 10 IJGE Cc1cccc(N2CCN(/C=C(/C#N)C(=O)N[C@@H](C)C34CC5CC(CC(C5)C3)C4)CC2)c1C 217054873 DZQHPNHIQJQZHB-JXPVDOJRSA-N 446.639 4.554 50 10 IJGE CCCCN(CCBr)C(=O)c1ccc(Br)cc1Br 232952158 GWHSUDLMGYHLBZ-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1 251348768 MCTGXALYZVQMRM-GBESFXJTSA-N 434.536 4.736 50 10 IJGE Brc1ccc([C@@H](CI)OCCOC2CCC2)cc1 400776872 QCEDTJZKVWLDMH-CQSZACIVSA-N 425.104 4.511 50 10 IJGE CCC[C@H](CCBr)NC(=O)c1cc(Br)ccc1Br 716857488 YWOABCHVWMLBKY-SNVBAGLBSA-N 441.989 4.895 50 10 IJGE Cc1ccccc1SCC(=O)NN=Cc1ccc(OCc2nc3ccccc3[nH]2)cc1 1084267637 JCHUHWOWUFETSR-UHFFFAOYSA-N 430.533 4.693 50 10 IJGE C=CCc1cc(/C=C(\C#N)C(=O)Nc2ccc(Br)cc2)cc(OCC)c1O 1084346807 RNAVCFOEYGJULE-LFIBNONCSA-N 427.298 4.828 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCc3cc4ccccc4nc3O)c2C)cc1 1440211754 OOETXAIOGCWCGP-HMAPJEAMSA-N 436.515 4.880 50 10 IJGE C#CCN(CC#N)C(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Cl)c(C(F)(F)F)c2)c1C 1459372158 HYXDPVNZOLOSAC-GZTJUZNOSA-N 444.844 4.659 50 10 IJGE CC(C)(C)OC(=O)Nc1cc(F)ccc1C(=O)NNc1nc2ccccc2[nH]c1=S 1640946931 KXAIQHTXVGDIOI-UHFFFAOYSA-N 429.477 4.535 50 10 IJGE CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NNc1ccc(OCc2ccccc2)cc1 1646171813 LCEVFDUZLRRQNO-VWLOTQADSA-N 427.504 4.673 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)COc2ccccc2)CCC3)cc1C 1772749914 RODVTHHFJZGOPP-UHFFFAOYSA-N 445.519 4.693 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(F)c2)[C@@H]1c1ccccc1Cl 1865684980 CJPGUJLIDYQLBD-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE COc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2c(OC)ccc3ccccc23)cc1 1865688538 UOFLAAKUNPCKGR-DEOSSOPVSA-N 438.487 4.569 50 10 IJGE CCc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699259 ORVYVDMYHUCUSY-QFIPXVFZSA-N 443.938 4.857 50 10 IJGE CC(C)(CI)CN(CCNC(=O)OC(C)(C)C)C1CCCCC1 1904653837 QGEOGCBAQWZQRP-UHFFFAOYSA-N 438.394 4.607 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OCC[C@@]23CCC[C@@H]2C3)C1 1908614335 ARRNLCHUGQTMJK-ATZDWAIDSA-N 449.373 4.788 50 10 IJGE Cc1cc(Br)sc1[C@@H](Br)c1c(Br)cnn1C 1939448285 APCUGDMEDUCOMR-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE Cc1cc(C(=O)N[C@@H](C)CCCCCI)c(Br)s1 2054170729 NWHSYVZSJWVPJH-VIFPVBQESA-N 444.176 4.933 50 10 IJGE Brc1ccc(Br)c(C[C@@H]2CN(C3CC3)C[C@H]2Br)c1 2054717873 KARYEAKOYJHGRR-QMTHXVAHSA-N 438.001 4.612 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)cnc2n1Cc1nccn1Cc1ccccc1 2090022422 WGFBIYGUYDUWDJ-CYBMUJFWSA-N 430.737 4.787 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCC2(CC1)C[C@H]2CCl 2092486376 BDHYYIXMHFALII-QMMMGPOBSA-N 427.589 4.754 50 10 IJGE O=S1(=O)CCC([C@H](Br)c2cc(C3CC3)c(Br)s2)CC1 2094667937 BEBKGGTXBJMSCC-LBPRGKRZSA-N 428.211 4.649 50 10 IJGE Brc1ccc([C@H](CI)OC[C@@H]2C3C[C@@H]4C2[C@@H]4C3)cc1 2134517754 KAVAGYWYUXTZBU-XRWMESCXSA-N 433.127 4.844 50 10 IJGE CCOCc1cc(Br)c([C@@H](Br)[C@@]2(COC)CCCO2)s1 2233033829 RTXRUHFHVVEGFY-KGLIPLIRSA-N 428.186 4.679 50 10 IJGE Cc1c(Br)sc([C@H](Br)[C@@]23CCC[C@@H]2CS(=O)(=O)C3)c1C 2234212174 CHAKOKARWRQJAP-SCDSUCTJSA-N 442.238 4.778 50 10 IJGE COc1ccc(Oc2ccc(OC)c(I)c2)c(CBr)c1 2235963068 KTSJHSHSUMKASA-UHFFFAOYSA-N 449.082 4.996 50 10 IJGE CC(C)(C)OC(=O)N1[C@H](CNC(=O)[C@@H](Br)C2CCCC2)C[C@@H]2CCCC[C@@H]21 2240973053 RHCOGNIATMOWMG-XSLAGTTESA-N 443.426 4.625 50 10 IJGE CC(C)N(C[C@H](C)Br)C(=O)c1ccc(Cl)c(I)c1 2256381984 IJIKVLPNRXJNJW-VIFPVBQESA-N 444.538 4.579 50 10 IJGE CC1CC(CBr)(CN2CCCC[C@H](C3CN(C(=O)OC(C)(C)C)C3)C2)C1 2265304401 OVILUZKRMVWBIN-BATSVXPKSA-N 429.443 4.767 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@H](CBr)C(C)(C)C)[C@@H](C(F)(F)F)C1 2266272049 JXKBBDFTBUTAJS-MGPQQGTHSA-N 445.364 4.964 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2C[C@H]3O[C@H]2[C@H]2C[C@H]23)s1 2300953539 KNSVWDFOLQYMSV-XIMCKNQDSA-N 445.547 4.866 50 10 IJGE Clc1nc(OCc2cccc(I)c2)sc1CBr 2302782634 KIHZFOZGMXYDTJ-UHFFFAOYSA-N 444.519 4.875 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)[C@@]23CCOC[C@@H]2C3)c1 2313495582 KVWWWOSXTRKMGS-ZLKJLUDKSA-N 438.985 4.944 50 10 IJGE Cc1cccc(N2CCN(C=C(C#N)C(=O)Nc3ccc(Cl)cc3Cl)CC2)c1C 2318455698 ZCVVYVQITKIUHY-UHFFFAOYSA-N 429.351 4.778 50 10 IJGE ClC[C@@H]1CCC[C@@H](NCc2ccc(I)c(Br)c2)C1 2325212610 PNWDULMKGUQMPU-ZYHUDNBSSA-N 442.566 4.941 50 10 IJGE COC[C@@H]1C[C@H](Br)[C@@H](Cc2cc(I)ccc2Cl)C1 2327404988 AAXUFZHFKDVLRG-CWSCBRNRSA-N 443.550 4.923 50 10 IJGE CCOc1ccc(-c2csc(C(C#N)=Cc3cc4c(cc3[N+](=O)[O-])OCCO4)n2)cc1 2331441005 LQAULSCBIWGMKM-UHFFFAOYSA-N 435.461 4.952 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCN(CC2CC(Br)C2)[C@H](C(F)(F)F)C1 2337544378 BGHUALQPXGHHBK-URGYJCLVSA-N 443.348 4.718 50 10 IJGE FC(F)(F)[C@@H]1C[C@]1(CCl)CNCc1ccc(Cl)cc1I 2366702342 QVORCVSMOYJSNL-NEPJUHHUSA-N 438.058 4.842 50 10 IJGE FC(F)(F)[C@H]1[C@@H](Br)CCCN1Cc1ncc(Br)cc1Cl 2370295048 QEQIHSJKSGHWLU-GZMMTYOYSA-N 436.497 4.788 50 10 IJGE Cc1cnc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)cc1CBr 2380364281 CPSZGYWDTUQFFN-YJMBLLCNSA-N 426.402 4.632 50 10 IJGE Cc1cc(C)nc(SCC(=O)NN=Cc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)n1 5185392 FCKZIZWFROPPLV-UHFFFAOYSA-N 428.602 4.636 50 10 IJGE COc1cc(/C=C(/C#N)c2ccccc2OC)ccc1OC(=O)c1cccc([N+](=O)[O-])c1 31902018 IFXWROIDEFCZEF-PDGQHHTCSA-N 430.416 4.895 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C/c2ccc(OCC)cc2)c(OC)c1 40970906 LYPLVHWODADJOM-SVWIXSIKSA-N 448.519 4.536 50 10 IJGE CCN(C[C@](C)(CI)OCCCC(C)C)C(=O)OC(C)(C)C 231313627 PJRLFDUFEKXJSJ-KRWDZBQOSA-N 427.367 4.890 50 10 IJGE BrCc1nnc(-c2cc(Br)cc(Br)c2)n1C1CC1 232453572 AUTAINFMAMGGGD-UHFFFAOYSA-N 435.945 4.700 50 10 IJGE O=S(=O)(c1ccc(Cl)c(CCl)c1Cl)N1CC[C@H](COCc2ccccc2)C1 383993794 JSHLIQRBVGWRRH-HNNXBMFYSA-N 448.799 4.960 50 10 IJGE C[C@H](Br)CN(C(=O)c1cc(Br)ccc1Br)C1CC1 691366109 SDGDOTZUZUTGNT-QMMMGPOBSA-N 439.973 4.600 50 10 IJGE CC[C@H](Br)[C@@H](C)NC(=O)c1scc(Br)c1Br 705439962 VIYCEHLOTFOBBE-RITPCOANSA-N 433.991 4.565 50 10 IJGE C[C@H](O[C@](C)(CI)CNC(=O)OC(C)(C)C)C1CCCCC1 719737162 PYLMBVDLSRSLJB-SUMWQHHRSA-N 425.351 4.690 50 10 IJGE Cc1cccc2c(CCC(=O)NNC(=O)c3ccccc3OCc3ccc(F)cc3)c[nH]c12 741517836 MPBPCSKICTZAJD-UHFFFAOYSA-N 445.494 4.588 50 10 IJGE C/C(=C/c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1 1529781970 AUFBQXVOOBILTF-PEZBUJJGSA-N 438.886 4.923 50 10 IJGE N#C/C(C(=O)CSc1nc(O)c2ccc(Cl)cc2n1)=C1/Nc2ccccc2S1 1656291370 JVXBPJCLFUBIFY-LDADJPATSA-N 426.910 4.603 50 10 IJGE Cc1c(C(=O)NC(C)C)oc2c1C(=NNC(=O)c1ccc(-c3ccccc3)cc1)CCC2 1772748401 WXJOIQAEITXGDU-UHFFFAOYSA-N 429.520 4.864 50 10 IJGE Cc1cc(C)cc(OC(=O)c2oc3c(c2C)C(=NNC(=O)COc2ccccc2)CCC3)c1 1772748663 CHJRVJIDDTUYDV-UHFFFAOYSA-N 446.503 4.660 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](NC(=O)[C@H]2C[C@H]2c2ccccc2)c2ccccc2)cc1 1867051715 FFRHISWFNFRRMI-RJGXRXQPSA-N 427.529 4.859 50 10 IJGE O=C(Nc1c(Br)cc(Cl)cc1Br)[C@@H]1C[C@H]1Br 1897149807 ABXSVQVHHDREPG-PHDIDXHHSA-N 432.337 4.587 50 10 IJGE Cn1cc(CN(Cc2ccccc2)C2(CBr)CCC2)c(Br)n1 1915756223 VPLJGEBKWRUHRO-UHFFFAOYSA-N 427.184 4.502 50 10 IJGE CC(C)(CCl)N(Cc1ccccc1)C(=O)c1ccc(I)cc1 1915771185 KPRIYIWOXVVVGO-UHFFFAOYSA-N 427.713 4.951 50 10 IJGE CCN(C[C@@](C)(CI)O[C@@H]1CC[C@H]2C[C@@H]1C2)C(=O)OC(C)(C)C 1992237248 GECLQWOQRQVTTH-BASYENTBSA-N 437.362 4.642 50 10 IJGE CN(CCCCCCl)C(=O)c1ccc(Br)cc1I 2086147064 IQRPEFUUULRQNR-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE C[C@@H](Br)[C@H]1CCCN(Cc2ccc(I)c(Cl)c2)C1 2086658684 POHZFWBMBXZTAF-PWSUYJOCSA-N 442.566 4.940 50 10 IJGE CCCN(C(=O)[C@@H](Br)C(C)C)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2106775156 UZGYNORMWFFLNF-WFVVYAPDSA-N 431.415 4.575 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]1CC(NC(=O)c1ccc(CBr)cc1)C2 2162599266 FBOUPUOYHLMKAR-ROUUACIJSA-N 437.378 4.632 50 10 IJGE Oc1nc([C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)nc(C2CC2)c1CBr 2187326641 VDVRVSLWNVAUDB-BCDXTJNWSA-N 428.374 4.865 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)c2ccccc21 2196906238 BFOUODMDMMTSQO-DQPZFDDXSA-N 437.378 4.547 50 10 IJGE Cc1sc(C(=O)N(C)[C@H](CCBr)C(F)(F)F)c(C)c1Br 2234469096 IVBAQCMOIGRJNY-MRVPVSSYSA-N 437.119 4.915 50 10 IJGE CCOc1cc(Cl)c([C@H](Br)c2nn(C)nc2Br)cc1Cl 2235269107 KKFZQJRKDYYCHT-JTQLQIEISA-N 443.954 4.767 50 10 IJGE Cc1c(Br)cccc1CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1Br 2243596331 HWSXCAXEWKASPF-CABCVRRESA-N 449.183 4.657 50 10 IJGE CCCN(Cc1ccc(I)c(Cl)c1)C[C@H](C)Br 2250510867 WNRHXEFUECNLLU-JTQLQIEISA-N 430.555 4.940 50 10 IJGE CC[C@@H]1OCC[C@H]1[C@@H](Br)c1ccc(OC)c(I)c1 2257368514 HYCZZOSFQFKUEG-OSMZGAPFSA-N 425.104 4.551 50 10 IJGE Cc1cc(F)c(Br)cc1C(=O)N(C)C[C@H](Cl)COCc1ccccc1 2258016734 PGIMIXGLQVTXKV-HNNXBMFYSA-N 428.729 4.793 50 10 IJGE CC1(C)OCCN(Cc2ccc(Cl)c(Br)c2F)[C@H]1CBr 2282821414 ZOPRLOIWXVQLDL-NSHDSACASA-N 429.555 4.616 50 10 IJGE COc1ccc(-c2n[nH]cc2C=C(C#N)C(=O)Nc2cccc(C(F)(F)F)c2)cc1OC 2295326998 YPXOTAXLHCMHOG-UHFFFAOYSA-N 442.397 4.658 50 10 IJGE COC(=O)c1cccc(Cn2cc(C=C(C#N)C(=O)NCc3ccccc3)c3ccccc32)c1 2313738631 LFAMLTGRDDLCBN-UHFFFAOYSA-N 449.510 4.700 50 10 IJGE CCCCCCOc1c(OC)cc(C=NNC(=O)c2ccccc2Cl)cc1[N+](=O)[O-] 2323078682 NCEIRTNJADBWGG-UHFFFAOYSA-N 433.892 4.980 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)C(C#N)=CNCc1cccc(Br)c1 2325079183 YBGCIOWNBRAJJF-MRXNPFEDSA-N 442.357 4.531 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@](C)(CBr)C(C)(C)C)CC(F)(F)C1 2327080858 QSEVDSOMLSIWRS-GUYCJALGSA-N 427.374 4.668 50 10 IJGE Cc1cc(C)c2nc(-n3ncc(C#N)c3NC(=O)/C(C#N)=C/c3ccccc3)cc(C)c2c1 12241680 CHEHKPJIPIVPDF-UDWIEESQSA-N 432.487 4.763 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3cccc(Cl)c3)ccc2[C@@H]1c1ccc([N+](=O)[O-])cc1 38654950 PRUNFELZUHCAKE-NRFANRHFSA-N 447.834 4.686 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4OC)ccc32)c1 38684840 SUCHQEJUDYYGSB-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4F)ccc32)c1 40530165 AQCOGWQZUIWVJD-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE CCCCCN1C(=O)/C(=N\NC(=O)/C=C/c2ccccc2)c2cc(Br)ccc21 40840328 ZAEUFQOQIMEYCH-QYABLYEPSA-N 440.341 4.520 50 10 IJGE Cc1ncsc1Cn1c([C@H](C)Cl)nc2cc(I)c(F)cc21 97409205 MVHKYBMYOOPYPJ-ZETCQYMHSA-N 435.693 4.893 50 10 IJGE CCC[C@@H](CCBr)CNS(=O)(=O)c1c(Cl)cccc1Br 312359771 OEFKYTWFXKMJFX-JTQLQIEISA-N 447.620 4.582 50 10 IJGE C[C@H]1[C@H](Br)CCCN1C(=O)c1cc(Br)sc1Br 384540823 LPZPUUJGPMXDCS-POYBYMJQSA-N 446.002 4.661 50 10 IJGE C[C@@H]1CN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)CCC1(F)F 753016377 GHDYJHBCMHAYKR-QAEAHILHSA-N 443.885 4.528 50 10 IJGE C=CCOc1c(Br)cc(C=NNC(=O)c2cccs2)cc1Br 1084073682 BBTXIVSPUFOCIX-UHFFFAOYSA-N 444.148 4.602 50 10 IJGE C#CCN(Cc1ccc(F)cc1)C(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(OC)cc2)c1C 1527472739 KKJFOIWPFPGLFG-KQWNVCNZSA-N 441.506 4.811 50 10 IJGE C=CCn1cc2ccc(NC(=O)/C(C#N)=C/c3cn(CCC#N)nc3-c3ccccc3)cc2n1 1635708692 YEAMJVUIVCVODY-KGENOOAVSA-N 447.502 4.545 50 10 IJGE Cc1ccc2c(c1)C(=NNC(=O)[C@H](C)Oc1ccc(Cl)cc1C)C(=O)N2CCC(C)C 1772720256 HAEWBBSGLMVXCT-KRWDZBQOSA-N 441.959 4.637 50 10 IJGE CCCCCOc1ccc(C=NNC(=O)COc2ccc(Br)cc2)cc1OC 1772752830 IYCAUNKUZVSEHL-UHFFFAOYSA-N 449.345 4.556 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccc(Cl)cc2)[C@H]1c1cccnc1 1865699688 ABXJHTYLCCVIEM-FQEVSTJZSA-N 425.879 4.806 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2cccc(Cl)c2)[C@H]1c1cccnc1 1865700436 SVVBJMKFRVHBFS-FQEVSTJZSA-N 425.879 4.806 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(Br)cc2)cc1 1865709421 VHUPNVLGVIMINY-FQEVSTJZSA-N 435.325 4.724 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C1CCC2(CC1)C[C@H]2NC(=O)OC(C)(C)C 1882086484 BYNTVTULGGYWAK-YCTJDYOESA-N 447.414 4.748 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cccc(C(F)(F)F)c1 1914341591 MEALYDCZEAIXOT-ZDUSSCGKSA-N 436.293 4.680 50 10 IJGE CC(C)(CCBr)NC(=O)c1cccc(Br)c1Br 1943887437 QLPFQKLAEHCGOY-UHFFFAOYSA-N 427.962 4.505 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@H](CI)O2)[C@H]1C(C)(C)C 1987729209 ZDOYXACJADMYEF-PMUMKWKESA-N 437.362 4.785 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]3(CC[C@](C)(CI)O3)C[C@@H]21 2001952404 RDNNIRCHJFVSKB-OHQAAIJDSA-N 449.373 4.929 50 10 IJGE Clc1ccc(I)c(CN2CCCC[C@@H](Br)C2)c1 2003413285 WDMOVRZFGUBGQG-LLVKDONJSA-N 428.539 4.694 50 10 IJGE O=S(=O)(c1ccc(CBr)s1)N(CCC(F)(F)F)Cc1ccccc1 2009639475 BVFCZRZONLAUQA-UHFFFAOYSA-N 442.322 4.786 50 10 IJGE O=C(N[C@H]1CCC[C@@H]1CBr)c1cccc(Br)c1Br 2031485353 HRTWKRXWDOENKN-KCJUWKMLSA-N 439.973 4.505 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CBr)c1F)N(Cc1ccccc1)CC1CC1 2059313069 TVDOLJOGFYNYCH-UHFFFAOYSA-N 446.769 4.975 50 10 IJGE CC[C@H](Cl)[C@@H]1CCCCN1c1ncc(I)cc1Br 2069530441 XDJJMJVVMUTLKO-RYUDHWBXSA-N 443.554 4.825 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@@H](Br)[C@H]1CCCS(=O)(=O)C1 2137655363 LTMSBUORCPEWDW-ZANVPECISA-N 430.589 4.672 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1Cc1sncc1Br 2151793957 UBNJUGGHFNDDBX-LURJTMIESA-N 436.560 4.761 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Br)c2n1Cc1sncc1Br 2151793958 UBNJUGGHFNDDBX-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@@H](CNC(=O)OC(C)(C)C)CC1CCCCC1 2196914589 OWCWBHWREAIJEH-KURKYZTESA-N 445.442 4.730 50 10 IJGE CCC[C@@H]1CN(C(=O)c2cc(Cl)ccc2I)C[C@@H]1CCl 2205699841 ZYDFSJJBSIDMEW-MNOVXSKESA-N 426.125 4.672 50 10 IJGE O=C(Nc1ccccc1CBr)c1cccc(F)c1I 2230679327 LFBXIBJBYGALLT-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE FC(F)(F)CC1(CBr)CCN(Cc2nscc2Br)CC1 2235378743 IFIRBIFWGLGYSI-UHFFFAOYSA-N 436.135 4.835 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@H]2C[C@@H](Br)CC[C@H]2C1 2264503121 CIMVVBUVZFYWEX-YIZRAAEISA-N 427.589 4.800 50 10 IJGE C=CC[C@]1(CBr)CCCN1C(=O)c1cccc(C)c1I 2287755465 PIJAPSZPVZGDFF-MRXNPFEDSA-N 448.142 4.545 50 10 IJGE CCCc1cc(C(=O)OC)c(NC(=O)C(C#N)=Cc2c[nH]nc2-c2ccc(CC)cc2)s1 2295347893 OKNVSXPWHLIMQF-UHFFFAOYSA-N 448.548 4.985 50 10 IJGE CCc1ccc(-c2csc(C(C#N)=CNc3cc(C(=O)OC)ccc3C(=O)OC)n2)cc1 2295945849 HGQVLVGOHVLVBP-UHFFFAOYSA-N 447.516 4.922 50 10 IJGE COc1ccc(-c2csc(C(C#N)=CNc3cc([N+](=O)[O-])ccc3F)n2)cc1OC 2296789996 IBBAENDSOXOUHO-UHFFFAOYSA-N 426.429 4.851 50 10 IJGE CC1(C)C[C@H](Br)CCN(Cc2sccc2I)C1 2301074466 SDZQSAZIFVRNDV-SNVBAGLBSA-N 428.177 4.738 50 10 IJGE Clc1ccc(COc2cccnc2CBr)c(I)c1 2317813180 YRQPZMNKZMKASL-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1c(F)ccc(Cl)c1F 2320361422 RPRIGHJYZQYPRF-ZDUSSCGKSA-N 432.692 4.718 50 10 IJGE Cc1ccc(N2C[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)c(CBr)c1Cl 2335416157 WVPUHPABPRKCMO-PMACEKPBSA-N 435.793 4.633 50 10 IJGE CN(C)c1ccc(C(=O)N/N=C2\C(=O)N(Cc3cccc4ccccc34)c3ccccc32)cc1 59151925 LSUILPOXZFVKQZ-WCTVFOPTSA-N 448.526 4.587 50 10 IJGE CCCOc1ccccc1/C=C(/C#N)C(=O)Nc1sc2c(c1C(=O)OC)CC[C@H](C)C2 206982381 ZVJQKPGLVNVDCW-SUCHYCSPSA-N 438.549 4.994 50 10 IJGE COc1ccc([C@@H](C)NC(=O)/C(C#N)=C\N(c2ccccc2)c2ccc(N)cc2)cc1OC 217173158 IDQUXMWUQJQGSS-FBKQIBBUSA-N 442.519 4.709 50 10 IJGE O=C(NCCCCCBr)c1cc(Br)sc1Br 232475431 MHJBZBVYZBCASO-UHFFFAOYSA-N 433.991 4.568 50 10 IJGE Cc1ccc(Cn2c(SCC(=O)NN=Cc3ccc(F)cc3)nc3ccccc32)cc1 254832892 UGKUYTVSCASFEH-UHFFFAOYSA-N 432.524 4.775 50 10 IJGE CC[C@H](Cl)CCCNC(=O)c1cc(I)ccc1Br 398455100 FXSKXUJLVABBFA-VIFPVBQESA-N 444.538 4.581 50 10 IJGE FC(F)Oc1c(I)ccc(C(F)(F)F)c1CBr 575723226 NAEOURVRPASMSK-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N(C[C@@H]2CCCO2)c2ccncc2)c(C)n1-c1ccccc1F 733969725 AIHATYLUYITYDK-RNHBDSLOSA-N 444.510 4.747 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(Br)cc3ccccc23)c1C 736694243 SHFZZKWHCWOGTQ-UHFFFAOYSA-N 448.324 4.828 50 10 IJGE CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNc1cccc(F)c1F 743724757 STGGVUCPSHROSF-MRXNPFEDSA-N 430.282 4.559 50 10 IJGE Cc1c(Cl)cccc1NNC(=O)CCc1nc(O)c2c3c(sc2n1)C[C@@H](C)CC3 748543880 YWETVLLRRSPGKK-NSHDSACASA-N 430.961 4.559 50 10 IJGE O=C1CCN1c1ccc(NS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)cc1 799126301 ALIFCUKMMJLAHR-UHFFFAOYSA-N 428.404 4.882 50 10 IJGE Cc1cc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)ccc1NC(=O)c1ccco1 799393390 NRYOQXYUDXSTAS-UHFFFAOYSA-N 443.385 4.879 50 10 IJGE CC(=NNC(=O)Cc1nc(O)c2c(C)c(C)sc2n1)[C@@H]1C[C@H]1c1ccccc1Cl 920365630 SUOAQANSJDPLPM-GJZGRUSLSA-N 428.945 4.505 50 10 IJGE O=C(CSCc1ccccc1)NN=C1C(=O)N(C/C=C\c2ccccc2)c2ccccc21 1084358185 DGJLTZVDEHXVQX-IHSPHDILSA-N 441.556 4.500 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cccc(Oc3cccc(C)c3)c2)cc1 1208493910 XHJDXXUFICYVPT-SFHVURJKSA-N 447.491 4.610 50 10 IJGE C=CCOc1ccccc1CNC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(OC)cc2)c1C 1360571718 CANJZHILCPCAHP-KQWNVCNZSA-N 441.531 4.891 50 10 IJGE C=C[C@@H]1OCC[C@H]1CNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc3ccccc23)c1C 1529258428 QUCDJRAQOAKUSC-WEQKZPJVSA-N 425.532 4.862 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccc3nc(O)oc3c2)c(C)n1-c1ccccc1F 1534335190 YWMFPDVSENTWTE-BKQORJHRSA-N 444.466 4.864 50 10 IJGE CCOC(=O)c1cnn(-c2ccc3ccccc3n2)c1N/C(C=O)=C\c1ccccc1C 1859490636 YJRLGPVBTANFOM-ZHZULCJRSA-N 426.476 4.558 50 10 IJGE CCc1nn(-c2ccccc2)c2c1[C@H](c1cc(Br)ccc1F)C(C#N)=C(N)O2 1865702690 ZJGBUTUINSPVDQ-GOSISDBHSA-N 439.288 4.554 50 10 IJGE N#C/C(=C(/O)CNC(=O)c1ccc(Cl)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 1872746913 FMYNSAGALWWQMA-VLGSPTGOSA-N 440.868 4.594 50 10 IJGE C[C@@](CCl)(CBr)OCc1cc(I)ccc1Cl 1904942664 MXHWBZJJPSEKOI-NSHDSACASA-N 437.930 4.854 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C2CCN(C[C@H](CBr)C3CCC3)CC2)C1 1966288536 QYPWQSPSDJLHCQ-OALUTQOASA-N 429.443 4.767 50 10 IJGE C[C@]1(CCBr)CCN(c2ncc(Br)cc2Br)C1 2014782617 JBRDBLOSTHQXQP-LBPRGKRZSA-N 426.978 4.608 50 10 IJGE CN(Cc1ccc(Br)cc1Br)C[C@H]1C[C@@H](Br)C1 2020194925 RIMICJLDDYJPQR-WVSHTKLVSA-N 425.990 4.817 50 10 IJGE CCC(CC)(CBr)CN=[S@@](C)(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2044697368 TZOJBXPVARXHBY-MQNRADLISA-N 439.460 4.685 50 10 IJGE C[C@H]1CN(c2ncc(Br)cc2Br)CC[C@@H]1CCBr 2052374859 OEGDCDSSRGGVJW-UWVGGRQHSA-N 441.005 4.854 50 10 IJGE CCCN1C[C@H](Cc2cc(Br)ccc2Br)[C@@H](Br)C1 2054715935 AKKHQXUCHCTBTK-FZMZJTMJSA-N 440.017 4.859 50 10 IJGE O=S1(=O)CCC[C@@H]([C@@H](Br)c2cc(C3CC3)c(Br)s2)C1 2094669679 STHYTFJVENCBDG-BXKDBHETSA-N 428.211 4.649 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@@H]2CCC[C@@]2(CCl)C1 2103173918 XRJXQZHXOMBVJT-ISVAXAHUSA-N 427.589 4.754 50 10 IJGE Cc1c(Cl)cc(C(=O)N2CCS[C@@H](CCBr)C2)cc1Br 2167383623 KUXZCBUHKZKTNM-NSHDSACASA-N 441.616 4.754 50 10 IJGE Brc1ccc([C@@H](CI)O[C@H]2C[C@H](n3ccnc3)C2)cc1 2183660604 MJACKOHVGCGINK-RBSFLKMASA-N 447.114 4.542 50 10 IJGE O=C(c1csc(Br)c1)N1CCC(CBr)(CC(F)F)CC1 2188341543 MQLXPXWEHVWJFL-UHFFFAOYSA-N 431.140 4.783 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CC[C@@H](C(F)(F)CCl)C1 2197765580 FLHYRSLEYKOJJV-MRVPVSSYSA-N 431.502 4.548 50 10 IJGE FC(F)(F)CC1(CBr)CCN(Cc2cc(Br)sn2)CC1 2204643635 WFYKAIWXQPVCOD-UHFFFAOYSA-N 436.135 4.835 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@@H]1CCl 2208030625 TZHFOYZPOLTWCK-UWVGGRQHSA-N 438.058 4.794 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OCCCCC2CC2)CC1 2212365734 ZLMIACDUNJGNPV-UHFFFAOYSA-N 437.362 4.788 50 10 IJGE O=S(=O)(Cc1cccc(Br)c1)N(Cc1ccccc1)[C@@H](CCl)C1CC1 2218987475 LQXREENPMWABIN-IBGZPJMESA-N 442.806 4.799 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CCCCCCBr)CC[C@@H]1C(F)(F)F 2231105233 YVXJEUYTSRWDJT-GJZGRUSLSA-N 445.364 4.967 50 10 IJGE Cc1ccc([C@H](Br)c2ccc3nc(O)oc3c2)cc1I 2232832720 GDRPTLYWFDDHQG-AWEZNQCLSA-N 444.066 4.931 50 10 IJGE CO[C@H]1C[C@@H]([C@@H](Br)Cc2ccc(Br)cc2Cl)C[C@H]1OC 2237443316 INZPGAIWBBCWQU-FATJJJSSSA-N 426.576 4.849 50 10 IJGE Cc1ccc(I)c(C(=O)N2[C@H]3CCC[C@@H](Br)[C@H]2CC3)c1 2240903116 IOJVHFNXPXCYEU-NJZAAPMLSA-N 448.142 4.520 50 10 IJGE COc1cc(F)c(CBr)c(N2CC[C@H]3CN(Cc4ccccc4)C[C@H]3C2)c1 2283544969 LGYOLISWBQSQKR-ROUUACIJSA-N 433.365 4.688 50 10 IJGE CC(C)(C)OC(=O)NCc1cc(F)ccc1NC(=O)c1ccc(CBr)cc1 2283881355 IJVZSOALMPKUHP-UHFFFAOYSA-N 437.309 4.998 50 10 IJGE CN(CC1(CBr)CCCCCC1)C[C@@]1(O)CCCN(Cc2ccccc2)C1 2286347574 DVUNHFIDTBNUKQ-QHCPKHFHSA-N 437.466 4.681 50 10 IJGE O=C(N1CCC[C@@H]([C@H]2CCCCN2CCCCCCCBr)C1)C(F)(F)F 2294697555 COPYETOOTJCDMU-IAGOWNOFSA-N 441.376 4.987 50 10 IJGE C[C@@H](Cl)[C@@H]1CCN(Cc2ccc(I)c(Br)c2)C1 2306221850 MQZYPVMYADIOQN-MWLCHTKSSA-N 428.539 4.503 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)C[C@@H]1CCC[C@@H]1Br 2315551293 PDAWWMSQVKAPDG-RYUDHWBXSA-N 442.566 4.940 50 10 IJGE O=C(Cc1ccc(Br)cc1Cl)N[C@@H](CCCl)COCc1ccccc1 2320563446 UUQOURJNONKAFD-KRWDZBQOSA-N 445.184 4.976 50 10 IJGE C[C@@H]1[C@H](Br)CCN(Cc2ccc(Cl)c(I)c2)[C@@H]1C 2321336558 XIGDWMOTOXKORG-HOSYDEDBSA-N 442.566 4.938 50 10 IJGE Cl[C@H]1CC[C@H]2C[C@H]1CN2Cc1ccc(I)c(Br)c1 2325205978 ABDDRNRMIBDMLX-GVXVVHGQSA-N 440.550 4.645 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H](Br)CC12CCC2 2327403387 BMHRWVVQGIBWIU-NSHDSACASA-N 440.550 4.837 50 10 IJGE COCCOc1ccc(C=C(C#N)C(=O)Nc2ccccc2-c2ccccc2OC)cc1 2331123086 BMOSKHXSFVKMEW-UHFFFAOYSA-N 428.488 4.933 50 10 IJGE COC(=O)c1c(NC(=O)Cc2ccc(Br)cc2)sc(C(C)=CC#N)c1C 2331558886 ORLXFRYEXQCJAS-UHFFFAOYSA-N 433.327 4.714 50 10 IJGE C[C@@](CI)(OCc1ccccn1)c1ccccc1Br 2340144196 LFCBMUMIWOUAGT-HNNXBMFYSA-N 432.099 4.711 50 10 IJGE C[C@H](Br)CCCc1cn(Cc2sc(Cl)cc2Br)nn1 2346070114 KLYRITDNSLLKHD-QMMMGPOBSA-N 427.593 4.910 50 10 IJGE COc1ccc2nc(N(/N=C/c3ccco3)C(=O)c3cc4ccccc4oc3=O)sc2c1 9629127 ZERMAQZAKITMAN-ZMOGYAJESA-N 445.456 4.685 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)NC2CCCCC2)ccc1OCCOc1ccccc1 34696875 SBRZKXIWYBNVPR-FXBPSFAMSA-N 434.536 4.899 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccc(OC(F)(F)F)cc1)[C@H](Br)C2=O 39881032 NLJRATGURPTVHS-JLZZUVOBSA-N 434.252 4.683 50 10 IJGE CCOc1ccc2ccccc2c1C=NNC(=O)Cn1c(-c2ccccn2)nc2ccccc21 254734903 OGEJEFVFRBEJHA-UHFFFAOYSA-N 449.514 4.801 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2CCOCc1ccccc1 389966352 NFTRDIWUOMFJIS-UHFFFAOYSA-N 444.675 4.736 50 10 IJGE C[C@H]1[C@@H](C)N(c2ccc([N+](=O)[O-])c(CBr)c2)C[C@@H](C)N1Cc1ccccc1 404289077 UCIWFFUQEFYXSY-IXDOHACOSA-N 432.362 4.977 50 10 IJGE O=C(N[C@H]1CCC[C@@H]1CBr)c1scc(Br)c1Br 705515159 HXZUHVCTIQMIOD-SVRRBLITSA-N 446.002 4.567 50 10 IJGE CC(=NNC(=O)CSc1nnc(-c2ccccc2)n1-c1ccccc1)c1ccc(F)cc1 725274054 RMDBUPRBRVXMQP-UHFFFAOYSA-N 445.523 4.706 50 10 IJGE CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNc1c(F)cccc1F 735699869 BDIOFDNIEACRSN-INIZCTEOSA-N 430.282 4.559 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)O[C@H]([C@H]2CCOC2)C(F)(F)F)c(C)n1-c1ccc(F)cc1 778021180 DKANOAVUZYSBQW-YLKVKHQGSA-N 436.405 4.651 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccccc2OCCOc2ccccc2)c(C(F)(F)F)c1 799747588 FDUYGOURMYXDLG-UHFFFAOYSA-N 441.409 4.792 50 10 IJGE CC(C)Oc1ccc(COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cc1 918532662 CFPGUDPEDUYFSG-PXLXIMEGSA-N 440.503 4.901 50 10 IJGE O=C(COc1ccccc1)NN=Cc1ccc(OCc2ccc(Br)cc2)cc1 1084015484 VMSOYHSHCWKXFE-UHFFFAOYSA-N 439.309 4.557 50 10 IJGE O=C(CSCc1cccc(Br)c1)NN=Cc1ccccc1Br 1084052508 UZAHMWCGVCZHEH-UHFFFAOYSA-N 442.176 4.595 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc(C[C@H](CBr)NC(=O)OC(C)(C)C)c1 1880768517 XXWUSPJRWATFGF-OAHLLOKOSA-N 429.355 4.864 50 10 IJGE C[C@@H]1[C@H](OC2(CI)CCN(C(=O)OC(C)(C)C)CC2)CC1(C)C 1901818118 FRIGVPBAHSLATE-ZIAGYGMSSA-N 437.362 4.642 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)c1ccc(S(=O)(=O)C(F)(F)F)cc1 1914651049 LKODZZHRBRECJA-CYBMUJFWSA-N 436.293 4.770 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1ccc2c(c1)CCCC2 1915089284 WYJFWCHPAUGOTP-HXUWFJFHSA-N 436.415 4.930 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCCC2(CCC2)[C@]12CC[C@H](CI)O2 1924804165 ZVJMHHSRMMWSMF-KHYOSLBOSA-N 449.373 4.834 50 10 IJGE BrC[C@H]1CSCCN1Cc1ccc(Br)cc1Br 1943858701 JMDKMLYRFJOWQG-NSHDSACASA-N 444.030 4.524 50 10 IJGE CN(Cc1ccc(Br)cc1Br)[C@@H]1CCC[C@H]1Br 1943859020 LXCFZMXYPMBYLP-DGCLKSJQSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(Br)cc1)[C@H](Br)CF 1952042496 NHWBCXCIKRXQHK-OLZOCXBDSA-N 425.136 4.618 50 10 IJGE CC[C@H](Br)CN(CC)Cc1cc(Cl)ccc1I 1999380656 STXSCOKWJXXHLI-NSHDSACASA-N 430.555 4.940 50 10 IJGE FC1(F)C[C@]1(Br)COc1ccc(CBr)cc1Br 2023774343 IZRIZESEIPLLGG-JTQLQIEISA-N 434.900 4.896 50 10 IJGE CN(c1ncc(Br)cc1Br)C1(CBr)CC(C)(C)C1 2046095359 MBJUYKMQWBBJSN-UHFFFAOYSA-N 441.005 4.997 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3CC(Br)C[C@@H]3C2)c1 2065404232 RTMUOWYFXYLCLG-NXEZZACHSA-N 438.001 4.817 50 10 IJGE Brc1cccc(Br)c1CN1CC[C@H](Br)[C@H]2CC[C@H]21 2069996687 OIXIQOWSAGMFCH-BIGNPOOSSA-N 438.001 4.959 50 10 IJGE CC(C)[C@@H]1[C@@H](Br)CCN1Cc1ccc(I)c(Cl)c1 2086660069 BELXRWUUXCNYJB-SMDDNHRTSA-N 442.566 4.938 50 10 IJGE CC1(C)[C@H]([C@H](Br)c2cc(I)cc3c2OCC3)C1(F)F 2097390566 NCBXUFRWPRJXOV-PWSUYJOCSA-N 443.069 4.953 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1CN(CC1CC1)C[C@H](CBr)C1CCC1 2106785547 PKKZTIGBQNSNCK-OALUTQOASA-N 429.443 4.909 50 10 IJGE C[C@@]1(CBr)CC(F)(F)CN1C(=O)c1cc(Cl)cc(Br)c1 2159049624 POBKLQCWPJEOFC-LBPRGKRZSA-N 431.502 4.737 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(C[C@H](CBr)c3ccccc3)C[C@H]21 2163062170 KFICIVNFKTUHGZ-IYWMVGAKSA-N 437.422 4.790 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@@H]1CC2(CCC2)CO1 2166445578 XLKHHUZSVINTRD-UONOGXRCSA-N 449.126 4.621 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C[C@@H](CBr)C2CCC2)C1 2185499689 HEAXZXPHQLWYGH-HZPDHXFCSA-N 441.414 4.747 50 10 IJGE C[C@@H]1O[C@@]2([C@H](Br)c3cc(I)cc4c3OCC4)CC[C@H]1C2 2199182274 DDWNYEZFDCIGDR-NAMSACQYSA-N 449.126 4.620 50 10 IJGE CN[C@@H](c1cc(Br)c(Br)cc1F)[C@H]1C[C@@H](Br)C1 2213490342 QSDACTGOASFQRX-KEHGIVTQSA-N 429.953 4.785 50 10 IJGE COc1ccc([C@H](Cl)c2cocc2Br)cc1I 2249413973 ONBATBOBFADVCH-LBPRGKRZSA-N 427.463 4.984 50 10 IJGE COCCCCCO[C@H](CI)c1ccccc1Br 2258908582 ALVDKPBSCGYYOW-CQSZACIVSA-N 427.120 4.759 50 10 IJGE CC1CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]2C(F)(F)F)C1 2265307680 JHXYSBWUZZVTIN-CWVKQELPSA-N 443.348 4.670 50 10 IJGE CN(C(=O)c1cc(F)c(Br)cc1Cl)[C@H](CBr)CC1CC1 2282972754 TYMYMSJBDMRVIL-VIFPVBQESA-N 427.539 4.877 50 10 IJGE C[C@H]1CN(C(=O)c2ccc(Cl)c(I)c2)CC[C@@H]1CCCl 2283654756 FDEPOMWAMZTRET-QWRGUYRKSA-N 426.125 4.672 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2cccc(C(=O)O)c2)ccc1OCc1ccc(F)cc1 2295459668 LPDULGUBLXXTES-UHFFFAOYSA-N 446.434 4.657 50 10 IJGE N#CC(=Cc1c[nH]nc1-c1ccc2c(c1)OCO2)C(=O)Nc1cc(Cl)ccc1Cl 2297443487 NBYUSLMSBRLWLF-UHFFFAOYSA-N 427.247 4.658 50 10 IJGE COc1cc(OC)c([C@@H](Br)[C@@H]2C[C@@H]2Br)cc1Br 2298803488 POXXVJRTSXOOMH-SVERMHFZSA-N 428.946 4.686 50 10 IJGE Cn1c(C(C#N)=Cc2c(Oc3ccccc3F)nc3ccccn3c2=O)nc2ccccc21 2314436845 OHAJNAGWTTXGDU-UHFFFAOYSA-N 437.434 4.577 50 10 IJGE COc1ccc(C(C#N)=Cc2cccc(OC(=O)c3ccc([N+](=O)[O-])cc3)c2)cc1OC 2320511384 RWKFCFILIXNLEU-UHFFFAOYSA-N 430.416 4.895 50 10 IJGE Cc1ccc(C)c(NC=C(C#N)C(=O)Nc2ccc(I)cc2C)c1 2325408241 OIRHSETXYQKMGT-UHFFFAOYSA-N 431.277 4.675 50 10 IJGE CCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2326919755 QKPUMSRVAKVENA-YOEHRIQHSA-N 425.358 4.518 50 10 IJGE C=CC[C@@H](Br)[C@H]1CCN1Cc1cc(I)ccc1Cl 2327397193 MSVWNNXDIJAGPV-TZMCWYRMSA-N 440.550 4.859 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)N/N=C\c3ccc(F)cc3)n2-c2ccccc2)cc1 33089358 MZRMJQMNZJIJCR-YSMPRRRNSA-N 445.523 4.624 50 10 IJGE CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=C/c1ccccc1OCc1ccc(C(=O)O)cc1 34869014 FRHACJYUOLWMAI-RGVLZGJSSA-N 448.482 4.972 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(OC)c4)ccc32)cc1 38685629 WZQFXXFKWCGIND-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)CSc2ccc(Cl)cc2)cc1 40994407 SNDXREKNZMHJCH-GHRIWEEISA-N 428.941 4.861 50 10 IJGE C[C@]12CC[C@H]3c4ccc(O)c(Br)c4CC[C@H]3[C@H]1C[C@@H](Br)C2=O 44963131 WALNGSHUZXVAOU-KRMRSOFFSA-N 428.164 4.953 50 10 IJGE in-vitro CCCCCCCCC(CBr)(CBr)[C@H]1CCS(=O)(=O)C1 118875277 AUUNGJDWVUCHOT-AWEZNQCLSA-N 432.262 4.948 50 10 IJGE CCOc1ccc(/C=N\NC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)c(OCC)c1 169917884 JKIQDQIGXSIKJO-QRVIBDJDSA-N 426.542 4.625 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2c(C)ccc3ccccc23)cc(Br)c1O 169921812 SJAUHGISJZHQAG-FMCGGJTJSA-N 427.298 4.779 50 10 IJGE COc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4Cl)nc3c2)cc1[N+](=O)[O-] 169926691 FHBJMNYSIGWRLB-WYMPLXKRSA-N 449.854 4.564 50 10 IJGE O=C(N[C@@H]1CCC[C@@H]1CBr)c1cc(Br)cc(Br)c1 231548405 JDDLGYWLIDIMCA-PRHODGIISA-N 439.973 4.505 50 10 IJGE CCCCN(CCBr)C(=O)c1cc(Cl)ccc1I 232951416 VECKRTAIPKHXBV-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE Cc1ccc([N+](=O)[O-])cc1-c1ccc(C=NNC(=O)Cc2cccc(C(F)(F)F)c2)o1 254624214 OYULSXAYBSFGBB-UHFFFAOYSA-N 431.370 4.875 50 10 IJGE CC(=O)[C@@H](Br)[C@H](C)c1ccc(I)cc1Br 300916715 VMTGDOVUPIPFMX-KBUNVGBDSA-N 445.920 4.510 50 10 IJGE CC1(C)CC[C@H](CBr)N(c2ncc(Br)cc2Br)C1 706196400 QIBUMSGJBKXDFI-SNVBAGLBSA-N 441.005 4.997 50 10 IJGE Cc1ccc([C@H](Cl)c2cnn(C)c2I)c(C)c1Br 719617428 QEXIBCAQIBEQNW-LBPRGKRZSA-N 439.522 4.732 50 10 IJGE COc1ccc(CC(=O)NN=Cc2ccc(OCc3ccc(Cl)cc3)cc2)cc1OC 1084517869 WRXSBTUDSVFLMR-UHFFFAOYSA-N 438.911 4.629 50 10 IJGE C#CCN(C(=O)/C(C#N)=C/c1cc(C)n([C@H](C)COC)c1C)[C@@H]1CCCc2ccccc21 1617567227 UWWLKOKVOJYIBW-RJDAIPCTSA-N 429.564 4.759 50 10 IJGE Cc1cnc(SCC(=O)N(N=Cc2ccccc2)c2cccc(C(F)(F)F)c2)nc1O 1651998410 IXJARVFZVNKFEW-UHFFFAOYSA-N 446.454 4.669 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccncc2)CCC3)cc1Cl 1772745453 AHVJPKFGWNYCNE-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)[C@@H](C)Oc3ccc(Cl)cc3)c(C)n2)cc1 1865758480 CJBWNBILMQGUIW-MRXNPFEDSA-N 437.927 4.501 50 10 IJGE O=C(COc1ccccc1)N/N=C/c1cn(CCOc2ccc(Cl)cc2)c2ccccc12 1865762361 BCFWRAZDYHHZPX-JVWAILMASA-N 447.922 4.903 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)Cc1cc(Br)ccc1Br 1882068029 UGJPFEVZUJEGQF-NSHDSACASA-N 427.564 4.886 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CC[C@@]12CCCN(C(=O)OC(C)(C)C)C2 1882689742 FIIMAYPOMNZIEW-STXHMFSFSA-N 447.414 4.702 50 10 IJGE O[C@H](c1c(Cl)cc(Br)c(F)c1Br)[C@H]1C[C@@H]1Br 1900375752 GGWIZLHMYKUPFF-UKGLUQRTSA-N 437.328 4.821 50 10 IJGE C[C@H]1[C@H](CBr)CCN1C(=O)c1csc(Br)c1Br 1945189474 RBIAUFVFQHAGTK-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1C(=O)c1cc(Br)c(Br)s1 2018122766 BASOYSWSNXWEHH-HTRCEHHLSA-N 446.002 4.661 50 10 IJGE Cc1c(C=C(C#N)c2nnc3n2CCCCC3)c2ccccn2c1C(=O)c1ccc(F)cc1 2059845796 ZCEDZHSPGITWIL-UHFFFAOYSA-N 439.494 5.000 50 10 IJGE CCc1nc(Br)c(Br)n1C[C@H](C)c1nc(CCl)cs1 2109993794 CSXDBGCMPRSQBQ-ZETCQYMHSA-N 427.593 4.970 50 10 IJGE Br[C@H](Cc1cc2ccccc2cn1)c1cc(I)sn1 2120029946 AEUVREUASPZBOW-GFCCVEGCSA-N 445.123 4.975 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccccc2)CCN1c1ncc(CCl)cc1Br 2130166101 KVDUEUKMWOOKTG-INIZCTEOSA-N 448.714 4.836 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1Cc1cscc1Br 2154090356 HIYVMFXIQCDXKI-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CC(C)(C)OC(=O)N1CC(C2CCN(C[C@@H](CBr)c3ccccc3)CC2)C1 2176944549 LUGNPSSNKQRPJG-LJQANCHMSA-N 437.422 4.744 50 10 IJGE C[C@@H](C1CCCC1)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2179786285 YKLZRZGZGJBYFT-VIFPVBQESA-N 445.242 4.605 50 10 IJGE BrC[C@@H]1CCc2nc(C3C[C@@H]4CC[C@H](C3)N4Cc3ccccc3)ncc2C1 2187368130 KSKFHLXIAGUNPY-GAUHOVIDSA-N 426.402 4.887 50 10 IJGE COc1cc(F)c(Cl)cc1[C@H](Br)c1c(C)nn(C)c1Br 2207376967 GXJBXKUKJLPCIP-LBPRGKRZSA-N 426.511 4.776 50 10 IJGE Cc1ccc(I)c(C(=O)NCC(C)(C)C[C@@H](C)Br)c1 2232159629 YMJVSGRNYLINMB-LLVKDONJSA-N 438.147 4.529 50 10 IJGE C=CC[C@]1(CBr)CCCN1c1ncc(Br)cc1Br 2259501822 WDCHSSRRIPOSRZ-CYBMUJFWSA-N 438.989 4.917 50 10 IJGE Cc1cc(CBr)cnc1N(C)Cc1cccc(I)c1 2265533702 XQJANJVFMMMDQH-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE CC[C@]12CO[C@]([C@@H](Br)c3ccc(OC)c(I)c3)(C1)C2 2269547525 CYDLMDFOVWXKKS-SOUVJXGZSA-N 437.115 4.695 50 10 IJGE O=C(N[C@H]1CC[C@@H](CBr)CC1)c1cc(F)c(Br)cc1Cl 2282968217 USSZNSQKXYNOEI-DTORHVGOSA-N 427.539 4.925 50 10 IJGE CS(=O)(=O)C1([C@H](Cl)c2cc(Br)ccc2OCc2ccccc2)CC1 2299489490 PVSGJLWWJYDCPG-QGZVFWFLSA-N 429.763 4.885 50 10 IJGE C[C@H]1C[C@@H](Br)CN(Cc2ccc(Cl)c(I)c2)C1 2300237880 DJKXQCNOGPSMFO-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE ClC[C@@]1(Cc2ccc(I)c(Br)c2)CCCOC1 2306222282 SBSSMCDGIGIOFP-ZDUSSCGKSA-N 429.523 4.632 50 10 IJGE COc1cc(C=C(C#N)C(=O)N(C)C)cc(Cl)c1OCc1ccc(Br)cc1 2313567641 JLBXSOHRSCWNTO-UHFFFAOYSA-N 449.732 4.685 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@H]2[C@@H](CBr)C3)c(I)c1 2318546489 SQECZVSKQWJOEB-OSMZGAPFSA-N 440.550 4.692 50 10 IJGE CCCN(C[C@@]1(CBr)CC1(F)F)C1CCN(C(=O)OC(C)(C)C)CC1 2326919853 RSQDUZDOMUDNIX-KRWDZBQOSA-N 425.358 4.518 50 10 IJGE C[C@@]12CN(Cc3cc(I)ccc3Cl)C[C@]1(CBr)C2 2327401908 TUEMFSRGBGSDFO-ZIAGYGMSSA-N 440.550 4.552 50 10 IJGE Fc1c(CNCC(F)(F)C(F)(F)CBr)ccc(Cl)c1Br 2361685980 DFZKELUFDCNFOV-UHFFFAOYSA-N 445.451 4.997 50 10 IJGE COc1ccccc1[C@@H](CBr)OCc1cccc(I)c1 2367344348 NTDZAGSYDVDZLI-MRXNPFEDSA-N 447.110 4.953 50 10 IJGE CCCCOc1ccc(/C=C(/C#N)C(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C)C3)cc1 35253604 LPYWLVSRMUSQDE-WIZMWCRPSA-N 437.565 4.696 50 10 IJGE C[C@H](Oc1ccc(F)cc1)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccccc1F 38652092 QPUXZJUMBALCMO-PSLXWICFSA-N 448.425 4.556 50 10 IJGE Cc1c(C(=O)N(C)c2ccccc2)oc2c1/C(=N/NC(=O)c1ccccc1Cl)CCC2 40812672 WTTUCCVAZRHYSA-LGUFXXKBSA-N 435.911 4.988 50 10 IJGE O=C(Nc1ccc(CCBr)cc1)c1csc(I)c1 121939270 QFYSTIYSPXWVBO-UHFFFAOYSA-N 436.112 4.542 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C\c2ccc(-c3ccc(C)cc3[N+](=O)[O-])o2)c([N+](=O)[O-])c1 209389339 VQYVYILRKZYBMO-PTNGSMBKSA-N 432.392 4.926 50 10 IJGE CCOc1ccc(CCN/C=C(/C#N)C(=O)Nc2cccc(C(F)(F)F)c2)cc1OCC 217146453 XOKABUKNOVTOQX-ICFOKQHNSA-N 447.457 4.681 50 10 IJGE CC(C)(CCBr)CNC(=O)c1cc(Br)sc1Br 227909435 BAFHLOGOVXAODC-UHFFFAOYSA-N 448.018 4.814 50 10 IJGE CC1=CC(=NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)CC(C)(C)C1 252511458 HANWTBQMSARDNB-UHFFFAOYSA-N 445.972 4.993 50 10 IJGE CC1CCC(OC2(CI)CCN(C(=O)OC(C)(C)C)CC2)CC1 685992997 CICSAFMZZADBTG-UHFFFAOYSA-N 437.362 4.786 50 10 IJGE CC1(C)CC[C@H](CCl)N(C(=O)c2cc(Cl)ccc2I)C1 701593841 FATDEFPRTGHYPV-LLVKDONJSA-N 426.125 4.814 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2Cc1sncc1Br 722791280 FHXCIGGNGVNGRO-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE CS(=O)(=O)c1ccccc1NNC(=O)/C(=C\c1ccc(Cl)cc1)c1ccc(F)cc1 766668998 CLBYEGJFDBMEIF-RGEXLXHISA-N 444.915 4.567 50 10 IJGE Cc1cccc(COc2cccc(CC(=O)NNc3nc4ccccc4[nH]c3=S)c2)c1 1470319048 ANCSUSFWRPMZLZ-UHFFFAOYSA-N 430.533 4.866 50 10 IJGE CCCCCCOc1ccc([C@@H]2CN(C(C)=O)C[C@@H]2CI)cc1 1614613626 ANFSMNPFVMKKKV-HKUYNNGSSA-N 429.342 4.643 50 10 IJGE C=C(C)[C@@H](NC(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1)c1ccc(F)c(F)c1 1680280755 PTPJTTDKYXMYEI-IVZQSRNASA-N 439.462 4.533 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)COc1cc(C)ccc1C)c1ccc(C(F)(F)F)cc1 1680854578 GASUNJIDLQPWTM-LJQANCHMSA-N 449.473 4.739 50 10 IJGE Cc1ccc(CCC(=O)N/N=C2\C(=O)N(Cc3ccccc3Cl)c3ccccc32)cc1 1860823176 WGDAAAMBTVNLEX-COOPMVRXSA-N 431.923 4.648 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2cccc(Cl)c2)[C@H]1c1ccncc1 1865699796 CUPQLEYTVFGZGC-FQEVSTJZSA-N 425.879 4.806 50 10 IJGE CCc1nn(CC)c2c1[C@@H](c1ccc(N(CC)Cc3ccccc3)cc1)C(C#N)=C(N)O2 1865707501 YCLXGJHHSINWMR-QHCPKHFHSA-N 427.552 4.710 50 10 IJGE CCOC(=O)c1c(NC(=O)CCCCl)sc(C(=O)OCCc2ccccc2)c1C 1865986738 MHDACNMXFOQFPA-UHFFFAOYSA-N 437.945 4.590 50 10 IJGE Cc1ccccc1COc1ccc(/C=N/NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc1 1873795225 CMPPYNFEBWFLHJ-WGLQLPMYSA-N 439.556 4.573 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N(CCBr)CCC(C)C)c1Br 1924448507 ZPZZUOSHZPAGHR-UHFFFAOYSA-N 447.258 4.559 50 10 IJGE BrC[C@@H](CC1CC1)NCc1cc(Br)ccc1Br 2006499276 IWQPBHDATBNKHY-GFCCVEGCSA-N 425.990 4.865 50 10 IJGE CN(Cc1cccc(Br)c1Br)C1CC(CBr)C1 2018088540 YWOALUWKWOXQII-UHFFFAOYSA-N 425.990 4.817 50 10 IJGE BrC[C@]1(Cc2ccc(Br)cc2Br)C[C@@]12CCOC2 2039024882 PDDSLEBFTQGUAZ-KGLIPLIRSA-N 438.985 4.946 50 10 IJGE CN(C(=O)c1c(Br)cccc1Br)C1(CCBr)CC1 2069693942 NJPTUJBVDPOBQH-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE CC[C@@H](Cl)CN(CC)C(=O)c1ccc(Br)cc1I 2086148640 DLLVQWWKHQJTGT-SNVBAGLBSA-N 444.538 4.533 50 10 IJGE Cc1sc([C@H](Br)[C@@]23CCC[C@H]2CS(=O)(=O)C3)c(Br)c1C 2279098730 YPNFBNACAKYXJP-LEWSCRJBSA-N 442.238 4.778 50 10 IJGE N#CC(=Cc1cn(CCOc2ccccc2Cl)c2ccccc12)C(=O)NC[C@@H]1CCCO1 2297456344 JVEGPGLMYWFXSW-FQEVSTJZSA-N 449.938 4.576 50 10 IJGE CCN[C@@H](Cc1cc(Br)cc(Br)c1)[C@@H]1C[C@H]1Br 2298801763 ZETWPHLJUMJUKF-UPJWGTAASA-N 425.990 4.516 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)CC1(CBr)CC1 2300240837 QYRVJKFWNVDWAS-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE BrC[C@@]12CCCC[C@@H]1CN(Cc1sccc1I)C2 2316760760 XVXCKBPGEICPBH-BXUZGUMPSA-N 440.188 4.740 50 10 IJGE CC(C)(C)[C@@]1(CBr)CCN(Cc2sccc2I)C1 2316762697 TWSQATLWDQMTOC-CQSZACIVSA-N 442.204 4.986 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Br)C1[C@@H]2COC[C@@H]12 2317420280 NBKGETAOAXXVAW-AMXGMDGSSA-N 442.948 4.988 50 10 IJGE C[C@H]1CC[C@H](CBr)N(Cc2ccc(Cl)cc2I)C1 2318512123 QAWYCTGPHUYIOR-GXFFZTMASA-N 442.566 4.940 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ccccc2)CCN1c1ccnc(Cl)c1CBr 2328556932 UJVIXCOYUBLOCM-MRXNPFEDSA-N 448.714 4.883 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@H]2C[C@@H](Cl)CC[C@H]21 2328611008 CBMSRTQSYNZESJ-OYNCUSHFSA-N 427.589 4.895 50 10 IJGE Cn1nc(C(F)(F)F)c(CBr)c1N1CC[C@]1(C)CCOCc1ccccc1 2365253569 UKEREBPKQQJKGC-GOSISDBHSA-N 446.311 4.910 50 10 IJGE C[C@H](CCl)[C@H]1CCCCN1C(=O)c1ccc(Cl)cc1I 2365594116 XPUWRFVHCZAVOW-QMTHXVAHSA-N 426.125 4.814 50 10 IJGE Cc1c(Br)csc1C(=O)N1CCC[C@H](Br)[C@H]1C(F)(F)F 2370259864 BKIYNZAHPWKZQZ-XVKPBYJWSA-N 435.103 4.749 50 10 IJGE CC(C)(C)OC(=O)N1CCOCC12CCN(C[C@@](C)(CBr)C(C)(C)C)CC2 2380179402 IFQZXDCTPDKRIQ-HXUWFJFHSA-N 447.458 4.536 50 10 IJGE COc1ccc(CN(C(=O)CCl)[C@H](C(=O)NC2CCCCC2)c2cccs2)cc1 3033967 ANRWOGLZFAYXEB-NRFANRHFSA-N 434.989 4.514 50 10 IJGE COc1ccc(/C(C#N)=C\c2ccc(OC(=O)Cc3ccccc3)c(OC)c2)cc1OC 31902056 KETVEHONOSATIQ-BKUYFWCQSA-N 429.472 4.925 50 10 IJGE O=C(Cn1cc(/C=N/NC(=O)c2cc3ccccc3o2)c2ccccc21)Nc1ccccc1 33351722 UGHAJCHLIOJIKY-JFLMPSFJSA-N 436.471 4.790 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2cc(C)ccc2C(C)C)c(OC)c1 40853326 RJZKWORQONOANL-XDHOZWIPSA-N 437.492 4.582 50 10 IJGE Cc1cc(C)c(N/C=C(/C#N)C(=O)Nc2ccc(I)cc2C)c(C)c1 217253854 VJJCIFPEXPHFJS-WJDWOHSUSA-N 445.304 4.983 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccncc2)ccc1OCCCOc1cc(C)cc(C)c1 254511145 TUYMQRKNRSGQHV-UHFFFAOYSA-N 447.535 4.709 50 10 IJGE CCc1ccc(O[C@@H](C)C(=O)NN=Cc2ccc(OCc3ccccc3)c(OC)c2)cc1 256018505 NHOZFMVNCPMRIS-IBGZPJMESA-N 432.520 4.754 50 10 IJGE CC[C@@H](Cl)[C@@H](CC)NC(=O)c1cc(Br)ccc1I 313089170 FTBGDIYTZNVNMR-ZYHUDNBSSA-N 444.538 4.580 50 10 IJGE CC[C@@H](Br)[C@@H](CC)NC(=O)c1ccc(Br)cc1Br 313101131 ZEBBUBVZIBZSAJ-ZYHUDNBSSA-N 441.989 4.894 50 10 IJGE CC[C@H](Br)[C@@H](C)NC(=O)c1cc(Br)ccc1Br 386799695 PWDOOPOTVDQXPK-XCBNKYQSSA-N 427.962 4.503 50 10 IJGE COC[C@H](O[C@H](CI)c1ccccc1Br)C(C)C 404098853 CETVZCLLSJIIMQ-KGLIPLIRSA-N 427.120 4.613 50 10 IJGE CC1(C)C[C@H](NC(=O)c2cc(Cl)ccc2I)C[C@H](Cl)C1 693879473 UBCKBUDEUYODDJ-WDEREUQCSA-N 426.125 4.861 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)Oc1ccc([N+](=O)[O-])c3ncccc13)O[C@H](C)C2 770137153 UFLRLNZUNPJZCH-SKDZVZGDSA-N 434.448 4.574 50 10 IJGE O=C(CCC(=O)Nc1ccc(Cl)cc1Cl)NN=Cc1ccc(Br)cc1 1084438393 YCWWTEJNHMGSSG-UHFFFAOYSA-N 443.128 4.625 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2cnc(O)c3ccccc23)c(C)n1-c1ccccc1F 1178115351 WHPFJQARUINWQP-UNOMPAQXSA-N 440.478 4.710 50 10 IJGE CC(C)(C)[Si](C)(C)OCC1CCN(c2nc(O)c3cnn(-c4ccccc4)c3n2)CC1 1651240263 GXAABPZUEYWXOT-UHFFFAOYSA-N 439.636 4.759 50 10 IJGE C#C[C@@H](NC(=O)NNc1cccc(OC(F)F)c1Br)c1ccc(Cl)cc1 1686918227 HRQOWMYMVLBJQF-GFCCVEGCSA-N 444.663 4.705 50 10 IJGE Cc1c(C(=O)Nc2ccccn2)oc2c1C(=NNC(=O)c1cccc3ccccc13)CCC2 1772747552 JCGUGVYDEZCLIA-UHFFFAOYSA-N 438.487 4.859 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(C)cc2)cc1OCC 1865687956 DZMHGRASUDIKKN-DEOSSOPVSA-N 444.535 4.895 50 10 IJGE Cc1ccc(/C=C(\C#N)C(=O)Nc2c(Br)cc(C#N)cc2Br)cc1 1866127020 CWWPMSJXTPHMSU-MKMNVTDBSA-N 445.114 4.937 50 10 IJGE CC(C)(C)OC(=O)NCCCCCC(=O)N/N=C/c1cccc(OCc2ccccc2)c1 1873792815 NRACCJJXRIAMIU-OVVQPSECSA-N 439.556 4.801 50 10 IJGE C[C@@]1([C@@H](Br)c2cc(I)cc3c2OCC3)CCCCO1 1908094170 JGOQHDFURWZVCX-GJZGRUSLSA-N 437.115 4.621 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1nscc1Br 1915107856 XOOBHHKJZGVCSW-LBPRGKRZSA-N 432.181 4.722 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@@]2(CCC[C@H]2Cl)C1 1918907785 HNZHUDAXOAPHIM-MFKMUULPSA-N 427.589 4.897 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]3(CCC[C@H](CI)O3)CC[C@@H]21 1935705004 BJUPSZIDYHZWDY-ZXFNITATSA-N 435.346 4.539 50 10 IJGE C[C@@]1(CBr)CCCN1Cc1cccc(Br)c1Br 1943883295 ZBHSXPGANNVPAX-ZDUSSCGKSA-N 425.990 4.961 50 10 IJGE Cc1cc(F)cc(C)c1[C@H](Br)c1cc(I)sn1 2007645834 UKSTXYVIQBMCSE-GFCCVEGCSA-N 426.092 4.988 50 10 IJGE C[C@]1(CBr)C[C@H](NC(=O)c2csc(Br)c2Br)C1 2009759811 IXTCEHBQXKPFEJ-MHWOZMEASA-N 446.002 4.567 50 10 IJGE C[C@]1(NC(=O)c2csc(Br)c2Br)CCC[C@H]1Br 2011549666 UUAYGRIYEWXSLM-HQJQHLMTSA-N 446.002 4.709 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN1Cc1ccc(I)c(Cl)c1 2026565474 BNODJRLATPDSNQ-KOLCDFICSA-N 428.539 4.550 50 10 IJGE BrCc1nnc(-c2cccc(Br)c2Br)n1C1CC1 2031484676 NPCUYNBNULOXMU-UHFFFAOYSA-N 435.945 4.700 50 10 IJGE Brc1cccc(Br)c1C[C@H]1CN(C2CC2)C[C@@H]1Br 2039251074 OBAUIHLUUKNTAH-XPTSAGLGSA-N 438.001 4.612 50 10 IJGE O=C(NN=CC1=C(N2CCOCC2)C(=Cc2ccc(Cl)cc2Cl)CC1)c1ccco1 2053622938 WFXJULYNRQCVAN-UHFFFAOYSA-N 446.334 4.766 50 10 IJGE CC1(CBr)CC(NC(=O)c2ccc(Br)cc2Br)C1 2055634748 VNUMRQUEZXCKJB-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE O=C(CBr)c1cc(C(F)F)c(I)cc1C(F)(F)F 2060392464 PSFFZYJLTZRKGB-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE CN(CC1CCN(C[C@H](CBr)c2ccccc2)CC1)C(=O)OC(C)(C)C 2106787068 HHPPXZYYWGMYHU-IBGZPJMESA-N 425.411 4.744 50 10 IJGE Brc1ccccc1[C@H](CI)O[C@H]1C[C@H](n2cccn2)C1 2183664777 KRLRHOHQAXNBBU-HUBLWGQQSA-N 447.114 4.542 50 10 IJGE CCCCCCN(C)S(=O)(=O)c1ccc(CBr)c(Br)c1 2196730331 UUOYMZCQOZWAFT-UHFFFAOYSA-N 427.202 4.545 50 10 IJGE CC[C@H](COC)Oc1c(Br)cc(CBr)cc1Br 2217085603 FZNSNAPNXKAFKC-SECBINFHSA-N 430.962 4.910 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2C[C@@]1(Br)CC1(F)F 2232913564 FTZRUYNUCIQFNT-NSHDSACASA-N 432.465 4.849 50 10 IJGE Cc1sc(C(=O)NCC2(CBr)CC(F)(F)C2)c(Br)c1C 2281656108 GMRPPYABCQNMRM-UHFFFAOYSA-N 431.140 4.668 50 10 IJGE N#CC(=Cc1ccc(OCc2ccc(Cl)cc2Cl)cc1)C(=O)NC[C@H]1CCCO1 2294156144 SOJSGRGZALDMLE-HXUWFJFHSA-N 431.319 4.775 50 10 IJGE C[C@]1(CCBr)CCN1Cc1cc(I)ccc1Cl 2307330293 LZMJYGLJJNMYLA-ZDUSSCGKSA-N 428.539 4.694 50 10 IJGE ClC[C@]12C[C@H](CCN1Cc1ccc(I)c(Br)c1)C2 2325214269 OAPFJJORWPGCSQ-VDISTLRHSA-N 440.550 4.647 50 10 IJGE CC(C)C[C@@H](CBr)CN1CC(F)(F)[C@@](C)(CNC(=O)OC(C)(C)C)C1 2328529967 ZIKFORBNHNCZBD-YOEHRIQHSA-N 427.374 4.526 50 10 IJGE CC(C)(CBr)CN1CC[C@@H](CCNC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2337588287 WOUHHHWZYVYFGR-ZIAGYGMSSA-N 445.364 4.965 50 10 IJGE Clc1cc(Br)c(CN2CCO[C@@H]3C[C@H](CBr)C[C@@H]32)s1 2345956435 AIUDXXPSNCVGLT-DVVUODLYSA-N 429.605 4.538 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@@H](Cl)[C@@H]1COC2(CCC2)CO1 2364176998 ZYGAGDOPVOCRCH-QWHCGFSZSA-N 428.523 4.969 50 10 IJGE CC[C@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)COc1ccc(C(C)C)cc1 10682433 OYAXSZSZAUYTMM-GCJKJVERSA-N 426.557 4.707 50 10 IJGE COc1ccc(/C(C)=N/NC(=O)COc2ccc3ccccc3c2Br)cc1 12575986 WPLRPACZFRNPIX-OEAKJJBVSA-N 427.298 4.530 50 10 IJGE Cc1cccn2c(=O)c(/C=C(/C#N)c3nc4ccccc4s3)c(N3CCCCC3)nc12 34377841 RHWOKQHQEQZJBH-VKAVYKQESA-N 427.533 4.667 50 10 IJGE Cc1cc(C)cc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccs2)c1 38656517 LSSRBTUEHIVMOI-HSZRJFAPSA-N 432.501 4.568 50 10 IJGE O=[N+]([O-])c1ccc(C[C@H](Br)c2ccc(I)cc2)cc1 110298178 QXZJIUVGNCPURG-AWEZNQCLSA-N 432.055 4.878 50 10 IJGE O=C(NC[C@@H]1CCC[C@H]1Br)c1cc(Br)c(Br)s1 124332318 VRPZWHFWJSDCHT-NKWVEPMBSA-N 446.002 4.567 50 10 IJGE CCOC(=O)/C(C#N)=C\c1cccc(OC(=O)/C=C/c2ccc(OCC)c(OCC)c2)c1 206692828 ANRYBALTKYHNEK-VBHDBXHXSA-N 435.476 4.573 50 10 IJGE C[C@@H](CBr)CCCNC(=O)c1cc(Br)cc(Br)c1 228283200 QSCJRGRXBJMTTE-SECBINFHSA-N 441.989 4.753 50 10 IJGE COc1cc([C@@H](C)[C@@H](Br)C(C)=O)c(Br)cc1Br 234848583 GGFFTIGDJMAKSZ-SREIQFSDSA-N 428.946 4.676 50 10 IJGE Cc1cc([N+](=O)[O-])c2[nH]c(C(=O)NN=Cc3ccccc3C(=O)O)c(-c3ccccc3)c2c1 254406433 LSTBSWLNZNIPAD-UHFFFAOYSA-N 442.431 4.514 50 10 IJGE C[C@@H]1C[C@H](O[C@](C)(CI)CNC(=O)OC(C)(C)C)CC(C)(C)C1 299976416 CMQDLGHMLAEVLC-QWQRMKEZSA-N 439.378 4.936 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1Cc1cnn(Cc2ccccc2)c1 390386375 DINGKDHKYPHFRU-ZDUSSCGKSA-N 430.737 4.787 50 10 IJGE Cc1cc(C(=O)CBr)cc(SC(F)(F)F)c1I 575709411 PIANFCFIWBOQLR-UHFFFAOYSA-N 439.034 4.789 50 10 IJGE Clc1cc2c(cc1[C@H](Br)c1ncsc1Br)OCCO2 698653545 KLUARNKLQREOFH-JTQLQIEISA-N 425.529 4.815 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@@H]1Cl)c1scc(Br)c1Br 705419655 ORLRPIIJKOTBTM-JQWIXIFHSA-N 435.568 4.908 50 10 IJGE CC[C@H](CBr)N(C)C(=O)c1scc(Br)c1Br 705425021 JGEBXRNPEXLVDJ-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE CCOc1ccc(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)Nc2c(C(C)=O)oc3ccccc23)cc1 744569580 FNSIMMPZBWBLFX-CQUHBBLWSA-N 446.459 4.511 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2CCC(CC(F)(F)F)CC2)c(-c2ccccc2)n1 803673727 IDIFWGJBBKHYGV-UYRXBGFRSA-N 441.457 4.562 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NCc2ccccc2C(F)(F)F)c(-c2ccccc2)n1 914474011 HDVOEHVODFMZNN-CPNJWEJPSA-N 449.436 4.706 50 10 IJGE Cc1ccc(Cl)cc1NC(=O)C(=O)NN=Cc1cc(C)n(-c2ccccc2Cl)c1C 1084173030 BWVOBEUSKKQZKY-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE CCCCCOc1ccccc1C(=O)NN=Cc1c(C)nn(-c2cccc([N+](=O)[O-])c2)c1C 1084242533 RSSIRRMFHQGSBL-UHFFFAOYSA-N 449.511 4.730 50 10 IJGE O=C(NN=Cc1ccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1)c1cc2ccccc2o1 1084483896 VOHNXVHPDDJFBD-UHFFFAOYSA-N 446.375 4.805 50 10 IJGE O=C(CSc1cc(Cl)cc(Cl)c1)NNC(=O)Nc1cccc(C(F)(F)F)c1 1088721062 YNMNCQMMLFCZOQ-UHFFFAOYSA-N 438.258 4.957 50 10 IJGE CSc1nc(O)c(C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)cc1C#N 1124716501 ONWVKSZQRVPLQQ-HNNXBMFYSA-N 433.864 4.852 50 10 IJGE Cc1cc(Cl)ccc1NNC(=O)[C@@H](C)SCc1nc(O)c2c(C)c(C)sc2n1 1303446965 KBUGPWLZKWEYDU-GFCCVEGCSA-N 436.990 4.741 50 10 IJGE CC(C)(C)OC(=O)NCC1(CC(=O)NNc2nc3ccccc3[nH]c2=S)CCCCC1 1641877353 NJFYHWXZOGRZLF-UHFFFAOYSA-N 445.589 4.601 50 10 IJGE C#CC1CCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)CC1 1643525498 JPDCEJGFZOMPHK-MOSHPQCFSA-N 425.454 4.892 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]2C[C@@H]2c2ccccc2)cc1 1867059926 YMMWUPFIKJPLJD-SGNDLWITSA-N 441.556 4.729 50 10 IJGE CCOC(=O)Oc1ccc(C(=O)Nc2sc(/C(C)=C/C#N)c(C)c2C(=O)OC)cc1 1873427337 NUBHDAMOMZKJLS-ZRDIBKRKSA-N 428.466 4.558 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1ccc(Br)cc1Cl 1882087696 LPSASXSHNRDWEB-LLVKDONJSA-N 427.564 4.933 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)Cc1ccccc1F 1915299832 JBEYTEFWNLRBMD-LJQANCHMSA-N 428.367 4.577 50 10 IJGE O=C(N[C@H]1CC[C@@H](CBr)C1)c1scc(Br)c1Br 1942368910 ZKOWEOHTYCJEBM-RQJHMYQMSA-N 446.002 4.567 50 10 IJGE CN(Cc1cc(Br)ccc1Br)CC1(CBr)CC1 2006501330 VKJNYMGLZBCJCJ-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE BrC[C@@H]1CCCCN1Cc1cc(Br)ccc1Br 2006504211 XHJIKSOZCCHMSY-LBPRGKRZSA-N 425.990 4.961 50 10 IJGE C[C@@H]1[C@H]([C@H](Br)c2cc(I)cc3c2OCC3)C1(F)F 2036071420 MXOHZRFKGVLELC-DIMCTHFVSA-N 429.042 4.563 50 10 IJGE BrC[C@@H]1[C@H]2CC[C@@H](C2)N1Cc1ccc(Br)cc1Br 2058371294 YWDCFVZHITUXKP-DUFXMDAXSA-N 438.001 4.959 50 10 IJGE F[C@@H]1CCO[C@@H]1COc1c(Br)cc(CBr)cc1Br 2058657252 XRMGIIKQHPYGJB-GHMZBOCLSA-N 446.936 4.612 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1ccc(Br)cc1Br 2081239064 NPBOCIFIHFJWON-QPUJVOFHSA-N 441.989 4.751 50 10 IJGE Cc1cc(Br)c([C@@H](Br)C2COCCOC2)cc1Br 2083298286 MFDRXIKVOXHSIA-ZDUSSCGKSA-N 442.973 4.619 50 10 IJGE Cn1cc(Br)c(CC(CCl)(CCl)c2ccccc2Br)n1 2143633259 HEPKKXUVPZPNOZ-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE Cc1cc(N2CCOCC23CCN(Cc2ccccc2)CC3)ccc1CBr 2163147556 NADMTLAXUGXERL-UHFFFAOYSA-N 429.402 4.761 50 10 IJGE O=C(NC[C@@H]1CCCC[C@@H](Cl)C1)c1cc(Cl)ccc1I 2163753131 FXVYDARRJQNUMY-GHMZBOCLSA-N 426.125 4.862 50 10 IJGE CCC[C@@H](CC)N(C)S(=O)(=O)c1cc(CBr)ccc1Br 2193558878 ZNZVPGCXYWDKML-GFCCVEGCSA-N 427.202 4.543 50 10 IJGE C[C@@H]1O[C@@]2([C@@H](Br)c3cc(I)cc4c3OCC4)CC[C@H]1C2 2199182264 DDWNYEZFDCIGDR-JIVACREVSA-N 449.126 4.620 50 10 IJGE COc1cc(N2CCCN(Cc3ccccc3)CC(F)(F)C2)ccc1CBr 2204541442 NBGMNQPFDMKWGV-UHFFFAOYSA-N 439.344 4.938 50 10 IJGE CCN(C[C@@](C)(CI)OC[C@H]1CCC1(C)C)C(=O)OC(C)(C)C 2243126529 JYEFIORPJBXXAG-RDTXWAMCSA-N 439.378 4.890 50 10 IJGE CO[C@@H]1C[C@@H]1[C@@H](Br)c1c(F)cc(Br)c(F)c1Br 2250745351 KNNSQSXLHQOBLJ-ZJKWWJTRSA-N 434.900 4.961 50 10 IJGE O=C(c1cccc(Cl)c1Br)N1CC[C@H](C(F)(F)CBr)C1 2283182050 ACOWELCVZKVHDF-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE CC[C@@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@@H]1CBr 2285961181 XPUPATWTXPDDQO-BDAKNGLRSA-N 427.539 4.735 50 10 IJGE O=C(Cc1ccc(Br)c2ccccc12)NN=CC=Cc1ccc2c(c1)OCO2 2293420538 LFHFXEHKNSOKLQ-UHFFFAOYSA-N 437.293 4.689 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=CC=Cc3ccco3)n2-c2ccccc2)cc1 2293452837 WNBBXQWHFLDWQT-UHFFFAOYSA-N 443.532 4.743 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@H]1[C@@H]2CCO[C@@H]21 2313272379 NAMSQMASLSWLRX-XIKHUYFJSA-N 446.911 4.961 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc(OC)cc2)sc2c1CC[C@@H](CC)C2 2314571854 NFTPQYXLHDZGNG-OAHLLOKOSA-N 438.549 4.994 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)C=Cc4ccccc4)ccc32)cc1 2314640697 OKQPNENPIVUNBJ-SANMLTNESA-N 438.483 4.922 50 10 IJGE Clc1ccc(CN2C[C@H]3C[C@H](Br)C[C@H]3C2)cc1I 2315548923 MIVSYEIDNCKZQH-GDNZZTSVSA-N 440.550 4.550 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCN(CCCCBr)[C@H](C(F)(F)F)C1 2315835032 TXQZSYPZXSZKSI-KGLIPLIRSA-N 431.337 4.719 50 10 IJGE Br[C@@H]1CC[C@H]2CCN(Cc3sccc3I)C[C@@H]2C1 2316764707 PICONBPJPZEKTG-SDDRHHMPSA-N 440.188 4.738 50 10 IJGE FC(F)(F)c1ccc(CBr)c(OCCOCCOCc2ccccc2)n1 2343809522 QLMCGODIRBGXNB-UHFFFAOYSA-N 434.252 4.608 50 10 IJGE CC(C)[C@H](Cl)C(C)(C)NC(=O)Cc1cc(Br)cc(Br)c1 2365948117 KABJYWYZLAIKOY-AWEZNQCLSA-N 425.592 4.912 50 10 IJGE O=[N+]([O-])c1cc(Br)cc(Cl)c1OC[C@@]1(CBr)CC1(F)F 2379906944 ZXDXJXTZRFYZIQ-JTQLQIEISA-N 435.446 4.810 50 10 IJGE CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(NC(=O)c3cccc(C)c3)cc2)c(O)c1 12577346 MHQHVQQVRUPLQU-WPWMEQJKSA-N 444.535 4.563 50 10 IJGE Cc1cc(Br)c(NC(=O)[C@H](Br)C(C)C)c(Br)c1 20487712 APXMFZJILHDFBO-SNVBAGLBSA-N 427.962 4.878 50 10 IJGE Cc1cccc(NC(=O)/C(C#N)=C/c2c(Oc3ccccc3)nc3c(C)cccn3c2=O)c1 39992810 CAMOBSARGCSFBG-XDJHFCHBSA-N 436.471 4.649 50 10 IJGE COc1ccc(NC(=O)/C(C#N)=C\Nc2ccc(Cl)cc2C(F)(F)F)cc1OC 216740597 XMFKZHJKMYTFNS-KHPPLWFESA-N 425.794 4.834 50 10 IJGE CN(CCCCCCl)C(=O)c1cc(Br)ccc1I 234290382 USLMJNHJBLVPTN-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE CC(=NNC(=O)c1ccco1)c1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2C)cc1 254821558 VDJSMGBTPQTZGX-MRXNPFEDSA-N 439.899 4.801 50 10 IJGE CC(=NNC(=O)c1cc(-c2cccc(OCc3ccccc3)c2)n[nH]1)c1cccc(O)c1 254847959 CPQZULMZKLHQOY-UHFFFAOYSA-N 426.476 4.515 50 10 IJGE Fc1ccccc1[C@@H](Br)c1cc(I)cc2c1OCC2 311601866 OLKHGFYBDHWQBS-CQSZACIVSA-N 433.058 4.850 50 10 IJGE CC(C)N(C[C@H](C)Br)C(=O)c1cc(Br)ccc1Br 691342374 DCYOZQQVRBSTMK-VIFPVBQESA-N 441.989 4.846 50 10 IJGE CCc1nnc(COc2c(Br)cc(Cl)cc2CBr)s1 708073563 RGIWRVXMKMYGAV-UHFFFAOYSA-N 426.561 4.990 50 10 IJGE CCC[C@H](CCBr)NCc1cc(Cl)ccc1I 716936403 SEVNHFFTSDUKGG-GFCCVEGCSA-N 430.555 4.988 50 10 IJGE CCCN(CCc1cccs1)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 768529980 AMFZJMYMKSXZSK-HEHNFIMWSA-N 443.576 4.914 50 10 IJGE C=CCc1cccc(C=NNC(=O)c2cccc(NC(=O)c3cccc(Cl)c3)c2)c1O 1081168675 CESWOUAVIMPEQO-UHFFFAOYSA-N 433.895 4.790 50 10 IJGE Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)NNc1nc2ccccc2[nH]c1=S 1167430327 BPXJQMBJCCDUTR-UHFFFAOYSA-N 425.514 4.705 50 10 IJGE O=C(Cc1cc2ccccc2c(O)n1)NNc1c(Cl)cc(Br)cc1Cl 1620425352 UBGYOXIUWGYPRS-UHFFFAOYSA-N 441.112 4.696 50 10 IJGE CCc1nn(Cc2ccc(C)cc2)c2c1[C@H](c1cccc(Br)c1)C(C#N)=C(N)O2 1865684482 QRTRRXGANCLPNP-HXUWFJFHSA-N 449.352 4.783 50 10 IJGE Cc1nnc([C@H](CC(=O)Nc2ccc(SC#N)cc2)c2cccc(Br)c2)o1 1868180924 ATHIENNVLCCOOV-QGZVFWFLSA-N 443.326 4.874 50 10 IJGE O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc2[nH]c3c(c2c1)CCCC3 1873498379 HTJBBRGAJVITRL-AFUMVMLFSA-N 428.448 4.979 50 10 IJGE CCCCCOc1ccc(/C=N/NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1OC 1873794983 LWQOPDVUEZMFAH-PTFSYIGCSA-N 449.592 4.654 50 10 IJGE CC(C)(C)CC1CC(O[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2I)C1 1987833962 OLUPIGLTQPSQMC-WUCCLRPBSA-N 437.362 4.641 50 10 IJGE CCC(CC)(CBr)CN=[S@](C)(=O)CCCCNC(=O)OC(C)(C)C 2001769951 SZRNYQODZINZOO-XMMPIXPASA-N 427.449 4.590 50 10 IJGE C[C@@H]1C[C@@H]1N(CCBr)C(=O)c1scc(Br)c1Br 2002041299 PMQAHDUEMWKQHE-SVRRBLITSA-N 446.002 4.519 50 10 IJGE C[C@@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)[C@H]1C[C@@H](CBr)C1 2009644194 HZQHVJRCLCJIJM-BHYGNILZSA-N 428.417 4.815 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1ccc(OCc2ccccc2)cc1 2023034395 SHNZBVDDBAFESQ-HNAYVOBHSA-N 437.321 4.845 50 10 IJGE CCC(CC)(CBr)CN(CCCNC(=O)OC(C)(C)C)CC(F)(F)F 2044704240 BBBDYTPWDLFXJO-UHFFFAOYSA-N 433.353 4.967 50 10 IJGE Brc1ccc(Br)c(CN2C[C@@H](Br)C3(CCC3)C2)c1 2054722498 SKGCJBVBKYTEGL-CYBMUJFWSA-N 438.001 4.961 50 10 IJGE Fc1cccc(F)c1Cn1nc(CBr)c(Br)c1C(F)(F)F 2079229141 FAEZACJSFAYYMA-UHFFFAOYSA-N 434.000 4.886 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1c(Br)cccc1Br 2081241072 DMCASVTVIOAAKP-GZMMTYOYSA-N 441.989 4.751 50 10 IJGE CC1(c2ncc(CBr)c(C(F)(F)F)n2)CCN(Cc2ccccc2)CC1 2099816567 IXCYVJLZMXKGMV-UHFFFAOYSA-N 428.296 4.944 50 10 IJGE C[C@H](CCBr)CCN1CC[C@](NC(=O)OC(C)(C)C)(c2ccccc2)C1 2106782525 QYDHKCAZHTVIAM-DYESRHJHSA-N 425.411 4.924 50 10 IJGE O=S(=O)(c1cc(CBr)cc(F)c1F)N(Cc1ccccc1)CC1CCC1 2123269792 KTLFLBNYFZQPSC-UHFFFAOYSA-N 444.341 4.851 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc(CCNC(=O)c2ccc(CBr)cc2)c1 2162488193 IXKVCCSYXOZZKY-UHFFFAOYSA-N 433.346 4.901 50 10 IJGE CN(c1c(CBr)ccc(Br)c1Cl)[C@@H]1COCCC1(F)F 2168228033 QDJBBJXUPGCGLN-SNVBAGLBSA-N 433.518 4.858 50 10 IJGE O=[N+]([O-])c1ccc(N2[C@H]3CCC[C@H]2CN(Cc2ccccc2)C3)c(CBr)c1 2182304644 TYLQQKOZIHYPJM-PMACEKPBSA-N 430.346 4.733 50 10 IJGE COc1cc(F)c(Br)cc1[C@H](Cl)c1c(Br)nn(C)c1C 2188146123 UXUDGCJLIMVHTN-LBPRGKRZSA-N 426.511 4.729 50 10 IJGE CCC[C@H](CC)N(C)S(=O)(=O)c1cc(CBr)ccc1Br 2193558879 ZNZVPGCXYWDKML-LBPRGKRZSA-N 427.202 4.543 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1[C@H](C)C[S@](C)=O 2234059304 IIJPSAIKNACZME-RDLWGGRYSA-N 442.604 4.801 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@]12CCC[C@@H](CN(C(=O)[C@H](Br)C3CCCC3)C1)C2 2234909196 KYLMLHFQWHDZRH-QLVMHMETSA-N 443.426 4.578 50 10 IJGE CCCN(CCCCI)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2243590673 IHUQICORGXKXQF-MRXNPFEDSA-N 438.394 4.561 50 10 IJGE CC[C@H]1[C@H](CBr)CCN1C(=O)c1cc(Br)c(F)cc1Cl 2285958890 RRHHDZLSIXRBMQ-SDBXPKJASA-N 427.539 4.877 50 10 IJGE C[P@]1(=O)C[C@H](Br)[C@H](Cc2ccc(Cl)c(I)c2)C1 2300238425 KSGOKAWHNQIJSU-GPHJXTMHSA-N 447.478 4.873 50 10 IJGE CC1(C)[C@@H](CCl)CCN1Cc1ccc(I)c(Br)c1 2325206855 LIAJZADZSHGYRG-LLVKDONJSA-N 442.566 4.893 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Br)c2)CC[C@H]1CCl 2325223197 WMLVMGAQWWHDNG-JQWIXIFHSA-N 442.566 4.751 50 10 IJGE C[C@H]1CC[C@@H](CCl)N(Cc2ccc(I)c(Br)c2)C1 2325226317 NHOUTCWKVCWZPN-JQWIXIFHSA-N 442.566 4.893 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)Nc3ccc([N+](=O)[O-])cc3C)o2)cc1 6599943 MMUWQBKGDCDBHG-AQTBWJFISA-N 445.431 4.886 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)COc3ccc(Cl)cc3)ccc2[C@H]1c1cccs1 38656209 PRBMOWNNCDFIJV-OAQYLSRUSA-N 438.892 4.604 50 10 IJGE CCOc1ccc(/C=N/NC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)cc1OC 40866548 RIJJSDJDHQLMTH-MTDXEUNCSA-N 446.547 4.949 50 10 IJGE O=C(N/N=C(/CSc1nc2ccccc2o1)c1ccccc1)c1cccc([N+](=O)[O-])c1 59460585 QUGSDQPCPJDWHM-CLCOLTQESA-N 432.461 4.662 50 10 IJGE CC[C@H](C)c1ccccc1OCC(=O)NNC(=O)[C@H](C)Oc1ccccc1[C@H](C)CC 251393963 XMLIQPCEBUCTLO-OTWHNJEPSA-N 426.557 4.707 50 10 IJGE O=C(NN=Cc1cccc2ccccc12)c1ccc(CN2CCN(c3ccccc3)CC2)cc1 254293865 VWYYUHOAROUAEF-UHFFFAOYSA-N 448.570 4.926 50 10 IJGE CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NN=Cc2cccc([N+](=O)[O-])c2O)cc1 254303168 GVGMSKKETZDLJW-UHFFFAOYSA-N 427.501 4.543 50 10 IJGE CC(=NNC(=O)c1cc(-c2ccc(-c3ccccc3)cc2)n[nH]1)c1cccc([N+](=O)[O-])c1 254387620 XPUOOFPFMORWIT-UHFFFAOYSA-N 425.448 4.806 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=NNC(=O)Cc3cccc4ccccc34)o2)cc1 254617513 UXBUEXSXWYWMHA-UHFFFAOYSA-N 426.472 4.969 50 10 IJGE CC(C)(C)[C@H]1CCc2[nH]nc(C(=O)NN=C/C(Br)=C\c3ccccc3)c2C1 254835789 AGJBWSPGTINURG-ZEECIPAXSA-N 429.362 4.712 50 10 IJGE Nc1c(Cl)cccc1[C@@H]1CN(Cc2ccccc2)C[C@H]1CI 394531076 XZLPRFLEYRUURX-GDBMZVCRSA-N 426.729 4.573 50 10 IJGE Cc1sc([C@@H](Br)c2nn(C)cc2Br)cc1Br 693104215 YDUFVEVVVQCZSW-SECBINFHSA-N 428.975 4.799 50 10 IJGE C[C@@H]1Cc2ccccc2[C@H]1NC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F 732491600 HAZRBABCGQXLRL-XNPNBVRTSA-N 442.890 4.894 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2cc(Br)cc3ccccc23)c1C 734259923 NYZQCNRTFKKSNL-UHFFFAOYSA-N 448.324 4.828 50 10 IJGE C/C(=C/C(=O)NNc1nc(-c2cccnc2)nc(C)c1C)c1ccc(C(F)(F)F)cc1 736694179 ZYHVEDCFIIPADZ-QBFSEMIESA-N 427.430 4.721 50 10 IJGE Cc1ccc(-n2nc(C)c(CC(=O)NNc3ncccc3C(F)(F)F)c2C)cc1Cl 740098479 XVEGBXAGEYREEQ-UHFFFAOYSA-N 437.853 4.551 50 10 IJGE CC(C)(C)[S@@](=O)Cc1cccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1 799400625 VKFOJZROCNGYHT-PMERELPUSA-N 438.475 4.773 50 10 IJGE C=CCOc1ccccc1C=NNC(=O)c1ccc(CSc2nc(C)cc(C)n2)cc1 916294767 HWUJKSLZQZWSGC-UHFFFAOYSA-N 432.549 4.714 50 10 IJGE O=C1C(=NNC(=O)C23CC4CC(CC(C4)C2)C3)c2ccccc2N1C/C=C/c1ccccc1 1083994036 AUYDXBZWRHVONT-ITTNBNRRSA-N 439.559 4.783 50 10 IJGE Cc1ccc(C)c(-n2c(C)c(Br)c(C=NNC(=O)c3ccncc3)c2C)c1 1084491659 CNQHYTCMQOEVAI-UHFFFAOYSA-N 425.330 4.632 50 10 IJGE C=C(C)[C@@H](CC(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1)OCC 1124293712 BZLYEQPYLCRVAS-HXUWFJFHSA-N 432.973 4.765 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)c1ccccc1Cl 1350374824 LOLWNKYUNUAVRM-JQIJEIRASA-N 438.886 4.923 50 10 IJGE CC(=O)c1cc(F)c(O)c(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccccc3F)c2C)c1 1635383034 KMVZGAMMFOPXGS-NVMNQCDNSA-N 435.430 4.826 50 10 IJGE C=CC[C@@H](CO)CNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1637571006 JSMWSOFPFMWGLR-VHWUNXFSSA-N 432.351 4.609 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1cccc(Cl)c1 1865691472 SRHLRVCGPKMBJS-JOCHJYFZSA-N 432.911 4.676 50 10 IJGE CCCc1nn(Cc2cccc(F)c2)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699623 YMRRKDUHFPOJFB-QHCPKHFHSA-N 441.510 4.733 50 10 IJGE CCCOc1ccccc1/C=C/C(=O)NNC(=O)c1ccc(-c2ccc(C)c(C)c2)nc1C 1865756191 LCTBVFXKJYDXLP-NTCAYCPXSA-N 443.547 4.937 50 10 IJGE CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(Br)cc2)c(Cl)c1 1866128799 MQZMMBPUEGAOKV-NTEUORMPSA-N 433.689 4.825 50 10 IJGE N#C/C(=C(/O)CN1C(=O)c2ccccc2C1=O)c1nc(-c2ccc(Cl)s2)cs1 1872758431 ZQJOEBQXRNWLFU-OWBHPGMISA-N 427.894 4.614 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)c1ccc(I)cn1 1915086909 OLBOSDYUUWQJTP-AWEZNQCLSA-N 445.142 4.866 50 10 IJGE O=S(=O)(c1ccc2c(c1)CCC2)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915173549 ZGYVGVJYTHVJTQ-NRFANRHFSA-N 434.399 4.540 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)S(=O)(=O)c1cc(F)ccc1Cl 1915771937 RXZOBMKZZUPMJH-UHFFFAOYSA-N 434.758 4.844 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1csc(Br)c1 1916369640 ICGABJLUXMWENY-CQSZACIVSA-N 447.192 4.563 50 10 IJGE O=C(Cc1ccccc1I)Nc1ccc(F)c(CBr)c1 1924903887 IUJKLCCHNRWNMU-UHFFFAOYSA-N 448.073 4.506 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1Cc1c(Br)cccc1Br 1945328305 ATZSMXUSFBYLIA-UWVGGRQHSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1ncc(Br)cc1Cl 1985347799 YXJPADBAUYKHBX-UHFFFAOYSA-N 442.832 4.816 50 10 IJGE CC[C@H](C)[C@@H](CBr)NCc1cc(Cl)ccc1I 2023040728 IRSPPFOLIIMJDR-TVQRCGJNSA-N 430.555 4.844 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Br)c2cccc(Br)c2F)c1 2093074756 PLBOFHFABZCTGI-NSHDSACASA-N 428.142 4.538 50 10 IJGE FC1(F)[C@@H]([C@H](Br)c2cc(I)cc3c2OCC3)C12CC2 2095597154 RBTPIKNIKZJEGC-PWSUYJOCSA-N 441.053 4.707 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)C1(CNC(=O)OC(C)(C)C)CCCC1 2106789536 ZCYVUPYZFUIBET-SFHVURJKSA-N 425.411 4.934 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC2(CCl)CCC1CC2 2122356659 UINZAMHIJWNEIT-UHFFFAOYSA-N 427.589 4.897 50 10 IJGE Cc1cc(S(=O)(=O)N(C)C2(CBr)CCCCC2)sc1Br 2170291473 JZVVOXAEVGXCED-UHFFFAOYSA-N 445.242 4.537 50 10 IJGE COCC1(COC)C[C@H](Cl)[C@@H](c2c(Br)cccc2Br)C1 2190817577 QEGTUCLFWNXXHF-GWCFXTLKSA-N 426.576 4.976 50 10 IJGE CN(CC[C@H](O)c1ccc(Br)cc1Cl)C[C@H]1C[C@@H](Br)C1 2196945375 SPADZOUKYRKVOP-NVBFEUDRSA-N 425.592 4.631 50 10 IJGE Cc1cc(C(=O)N2C[C@H](Br)CCC23CCC3)ccc1I 2207106286 WTVSGQVXNJFOLJ-CYBMUJFWSA-N 448.142 4.522 50 10 IJGE COCC12CC([C@H](Cl)c3cc(Br)c(Br)cc3F)(CO1)C2 2233969686 LQLVFHYRRJVOIF-IYXRBSQSSA-N 428.523 4.826 50 10 IJGE Cc1c(Br)csc1C(=O)N1C[C@@]2(CBr)CCC[C@]2(F)C1 2234508768 WXEJUKRRGJOQPR-KBPBESRZSA-N 425.161 4.548 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@H]2CCCC23CCC3)C1 2250323843 XKZSFBCMWVIVCM-KXBFYZLASA-N 449.373 4.931 50 10 IJGE CCCN(C[C@@H](C)Br)C(=O)c1cc(Br)c(Br)s1 2250570027 QVAKIPIZWGSIIW-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CCO[C@@H](C)C2)cc1I 2257365328 QNBRUDDEYHKCLH-CHIMOYNISA-N 425.104 4.551 50 10 IJGE CS(=O)(=O)[C@H]1C[C@H]([C@H](Br)c2cc(C3CC3)c(Br)s2)C1 2269772733 RZFANTJQAJOMMD-AUTRQRHGSA-N 428.211 4.647 50 10 IJGE CS(=O)(=O)[C@H]1C[C@H]([C@@H](Br)c2cc(C3CC3)c(Br)s2)C1 2269772734 RZFANTJQAJOMMD-KBVBSXBZSA-N 428.211 4.647 50 10 IJGE CC(C)(C)OC(=O)N[C@@]1(c2ccccc2)CCN(CC2(CBr)CC(F)C2)C1 2280359914 QBXLDHFEDNAQBR-JITJBCMDSA-N 441.385 4.626 50 10 IJGE COc1ccc(OC)c(NC=C(C#N)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c1 2318463034 VMYAEMXLRMHVMS-UHFFFAOYSA-N 425.794 4.834 50 10 IJGE C[C@]12CN(Cc3ccc(Cl)cc3I)C[C@]1(CBr)C2 2318557594 MTFFCAWCDQNIBZ-UONOGXRCSA-N 440.550 4.552 50 10 IJGE Cc1ccc2nc(-c3ccc(NC=C(C#N)C(=O)NCCCCCC(=O)O)cc3)sc2c1 2324989819 WBBMOUJUICDLIH-UHFFFAOYSA-N 448.548 4.852 50 10 IJGE C[C@]1(CCl)C=CCCN1Cc1ccc(I)c(Br)c1 2325207686 QTPBOYQUWBQYOA-CQSZACIVSA-N 440.550 4.813 50 10 IJGE COc1ccc(-c2csc(C(C#N)=Cc3cc4c(cc3[N+](=O)[O-])OCCO4)n2)cc1C 2331429779 BTRPYHCHRJAHQD-UHFFFAOYSA-N 435.461 4.871 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCN(C[C@H]2C[C@H](Br)C2)[C@@H](C(F)(F)F)C1 2337681806 BGHUALQPXGHHBK-ZQDZILKHSA-N 443.348 4.718 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)[C@](C)(C(=O)O)c1ccc(OCc2ccccc2)cc1 2374470230 QFWDSVSJZLUCQY-KPLVRAHFSA-N 432.358 4.671 50 10 IJGE C/C(=N/NC(=O)c1ccc(OCC(=O)N2[C@H](C)CCC[C@H]2C)cc1)c1ccc(Cl)s1 33496925 DSXACJQJAYZSOK-RSONKESFSA-N 447.988 4.724 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(F)cc1)CCC2 40811875 MDRZDOYZWVHMTE-MTDXEUNCSA-N 449.482 4.767 50 10 IJGE O=S(=O)(Nc1cc(Cl)ccc1Br)c1ccc(CBr)cc1 125863305 RFGUTDLMRQYTFT-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE COc1ccc([C@H](Br)c2sccc2I)c(OC)c1 310834035 KWAGELHKTHVERW-LBPRGKRZSA-N 439.112 4.854 50 10 IJGE ClCc1nc2ccncc2n1-c1ccc(Br)c(I)c1 312003328 UZPKHZJVIBDLEQ-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE ClCc1ccc(N2CC[C@@H](N3CCN(Cc4ccccc4)CC3)C2)c(Br)c1 312628955 IJCXQTLOVDKKLJ-HXUWFJFHSA-N 448.836 4.584 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1 714994279 IUIMBSXRFBHHQZ-FGZHOGPDSA-N 427.386 4.708 50 10 IJGE N#Cc1ccccc1COc1cccc(C=NNC(=O)c2ccccc2Br)c1 731313467 ZRSVJPLEZPGRLI-UHFFFAOYSA-N 434.293 4.664 50 10 IJGE Cc1cccc(NC(=S)NNC(=O)[C@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)c1 732576940 DIYVSZDCFALDFS-PKTZIBPZSA-N 431.561 4.695 50 10 IJGE Cc1ccc(C(=O)Nc2ccccc2C(=O)NN=Cc2ccc(Br)cc2)cc1 1084402075 UGDIOPHUGUEBJT-UHFFFAOYSA-N 436.309 4.774 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)O[C@@H]3N=C(/C(C#N)=C/c4ccc(Cl)cc4)S[C@H]32)cc1 1088740829 VTBXPKSDIVVDMG-SSXALPEISA-N 448.935 4.603 50 10 IJGE C=CC(C)(C)CCNC(=O)NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1 1313065002 ORDPMINGSXZOFD-UHFFFAOYSA-N 429.586 4.871 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)c3c2[C@@H](c2ccccc2F)C(C#N)=C(N)O3)cc1 1865682989 CJWNQOPCAOQQPZ-QFIPXVFZSA-N 438.462 4.905 50 10 IJGE COc1ccc(-c2ccc(C(=O)NNC(=O)CCCSc3ccc(C)cc3)c(C)n2)cc1 1865756865 AQQJOUWABTWRTP-UHFFFAOYSA-N 449.576 4.708 50 10 IJGE CC[C@](C)(NC(=O)c1nc(C(C)(C)C)n2ccccc12)C(=O)Nc1ccc(SC#N)cc1 1866874532 IACCAWVBTKBHPV-DEOSSOPVSA-N 449.580 4.742 50 10 IJGE COc1cccc(-c2csc(/C(C#N)=C(\O)c3cc(OC)c(OC)cc3[N+](=O)[O-])n2)c1 1872744310 MCICIRLGUFDADI-HKWRFOASSA-N 439.449 4.694 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CCl)Cc1cc(Br)cc(Br)c1 1882074304 KGLZCVBZKLAYSF-GFCCVEGCSA-N 427.564 4.886 50 10 IJGE CN(C[C@H](CBr)C1CCC1)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 1890233069 DZCOWXGQYACLGZ-RBUKOAKNSA-N 425.411 4.995 50 10 IJGE CCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)CC(C)(C)CI 1904650879 KRCFXOOSKZVABX-OAHLLOKOSA-N 438.394 4.559 50 10 IJGE CCn1nc(C)c(Br)c1CN(Cc1ccccc1)C[C@@H](C)Br 1914639841 VBFYSZLDMQGGDK-CYBMUJFWSA-N 429.200 4.760 50 10 IJGE BrCCN(Cc1c(Br)cccc1Br)CC1CC1 1945321767 IRJPDXMQZXQGDW-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE CC1([C@H](CBr)NC(=O)c2cc(Br)c(Br)s2)CC1 1945361035 IVZWXQSSZQHYDJ-QMMMGPOBSA-N 446.002 4.567 50 10 IJGE C[C@@H](CCBr)CCN1CCC[C@@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2044704358 BYPPGCDBOPCJDF-XJKSGUPXSA-N 431.337 4.719 50 10 IJGE BrCCN(Cc1ccc(I)cc1)Cc1ccsc1 2051461688 JNTFNAIRWBVMNQ-UHFFFAOYSA-N 436.156 4.750 50 10 IJGE CC(F)(F)C[C@@H](CBr)NC(=O)c1cc(Br)c(Cl)s1 2052454438 RYZBTYSFMANVOA-YFKPBYRVSA-N 425.520 4.703 50 10 IJGE Cc1c([C@@H](Br)Cc2ccc(Br)cc2)c(Br)nn1C 2067854857 KDEGIQLPLIGLCG-NSHDSACASA-N 436.973 4.932 50 10 IJGE Cc1nn(C)c([C@@H](Br)Cc2ccc(Br)cc2)c1Br 2072306792 LMIDZTVLVXWCEB-NSHDSACASA-N 436.973 4.932 50 10 IJGE COc1cccc(-n2nc(CCl)c(I)c2C(F)(F)F)c1C 2079213697 MRSJOKZCRHXQAY-UHFFFAOYSA-N 430.595 4.552 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCCO2)C[C@@]2(C1)C[C@@]2(CBr)C(F)(F)F 2083259144 GULBALNQZJCQIM-JYJNAYRXSA-N 428.289 4.510 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2C[C@@H]1CCN(Cc2ccccc2)C1 2153120811 XRCYGPWKZZVKEK-QGZVFWFLSA-N 447.808 4.806 50 10 IJGE CC(C)N(C[C@@H]1CCCN(CC2(CBr)CCOCC2)C1)C(=O)OC(C)(C)C 2163058681 MPSGCDVSYNFVKN-GOSISDBHSA-N 447.458 4.536 50 10 IJGE Clc1cc(Br)cc(CN2CCC(COCCBr)CC2)c1 2167397607 DNYLNTFNAOKEOR-UHFFFAOYSA-N 425.592 4.726 50 10 IJGE O=C(NCC[C@@H]1CCCC[C@@H]1Cl)c1cc(Cl)ccc1I 2179638742 RVJOYGLBLHWYJU-GWCFXTLKSA-N 426.125 4.862 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@@H]1CCCN(CC2(CBr)CCCC2)C1 2185503745 VHKUGBGZBBPXMW-OAHLLOKOSA-N 441.414 4.891 50 10 IJGE C[C@@]1([C@@H](Br)c2cc(Br)c(Br)cc2F)COCCO1 2218602500 FXUNIPMIFSCJRI-RYUDHWBXSA-N 446.936 4.592 50 10 IJGE Cc1sc(C(=O)N2CC[C@@](CBr)(C(F)(F)F)C2)cc1Br 2234471735 UCFQHCJZAYCGKV-NSHDSACASA-N 435.103 4.609 50 10 IJGE Cc1cc(Br)c(C(=O)NC[C@]2(F)CC[C@H](CBr)CC2)s1 2237613007 XLSSCSGOWQWRGI-YPFXGUDJSA-N 427.177 4.842 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCC2(CC(Br)C2)C1 2282966693 KXUGLFAVZZWBTJ-UHFFFAOYSA-N 425.523 4.631 50 10 IJGE C[C@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@H](C)C1Br 2282978532 OGSBDOITQWXBCR-YUMQZZPRSA-N 427.539 4.733 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC2(CC2)C[C@@H]1CBr 2282978930 SSHQJOXUSOIBMS-MRVPVSSYSA-N 425.523 4.631 50 10 IJGE Cc1cc(S(=O)(=O)N(CCBr)CCC(C)(C)C)sc1Br 2289884918 CTFZAURPRAALOP-UHFFFAOYSA-N 447.258 4.641 50 10 IJGE CCCN(Cc1ccc(Cl)c(I)c1)C[C@H](C)Br 2300239570 ZXIHNDUGUDHWMV-JTQLQIEISA-N 430.555 4.940 50 10 IJGE C[C@@H]1C[C@H](Br)CN(Cc2ccc(Cl)cc2I)C1 2302326535 QCHHYVFWQAHTFM-KOLCDFICSA-N 428.539 4.550 50 10 IJGE COc1cc(C=NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OCc1cc(C)ccc1C 2322975119 BPOHXOGIMDFCRC-UHFFFAOYSA-N 433.464 4.563 50 10 IJGE CCOc1cc(C=C(C#N)c2nc(O)c3ccccc3n2)cc(Br)c1OC 2323870656 OMBYRCDEHWHSHP-UHFFFAOYSA-N 426.270 4.569 50 10 IJGE Cc1cccc(NC=C(C#N)C(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c1 2324603009 PVAQPTBVPGPMCN-UHFFFAOYSA-N 436.559 4.748 50 10 IJGE CCCN(c1cc(CBr)cc(OC)n1)C1CCN(Cc2ccccc2)CC1 2364795259 MVBYGWDHBARCQZ-UHFFFAOYSA-N 432.406 4.866 50 10 IJGE CCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)c1 38652984 AWGHJSOGFSIZTA-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE Cc1c(Cl)cccc1Nc1ncnc(NNC(=O)c2cccc(Cl)c2)c1[N+](=O)[O-] 40588518 MIFFMSPUAOFBQP-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE Cc1ccc(C)c(Nc2ncnc(NNC(=O)c3cccc4ccccc34)c2[N+](=O)[O-])c1 40592174 NWZOVEAOACBZOW-UHFFFAOYSA-N 428.452 4.655 50 10 IJGE COc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4ccc(C)c(C)c4)c(C)c32)c1 40822239 CJWOBVFADQEUTJ-SGWCAAJKSA-N 445.519 4.936 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2ccc(Cl)cc2Cl)cc1 40978131 GUAWWMKEYYKXQG-LFIBNONCSA-N 447.318 4.801 50 10 IJGE C=C(C)CSc1nnc(SCC(=O)/C(C#N)=C2/Sc3ccccc3N2C)s1 96812254 MIIPWFLJTIVBNP-FOWTUZBSSA-N 432.621 4.845 50 10 IJGE CCOC(=O)/C(C#N)=C1\C(=O)N2c3c1cc(CC)cc3[C@@](C)(c1ccccc1)CC2(C)C 104389695 PVJCWBMUANSRIN-JRPHYPICSA-N 428.532 4.924 50 10 IJGE N#C/C(=C\c1ccccc1)C(=O)/N=C1\N=C/C(=N/Nc2cccc(C(F)(F)F)c2)S1 135790071 QGWOUCXNHWZOSJ-CQYQEFJSSA-N 427.411 4.738 50 10 IJGE CCC(CC)[C@H](Br)CNC(=O)c1cccc(C)c1I 230659577 IGDQQKJMQNRHNX-CYBMUJFWSA-N 438.147 4.529 50 10 IJGE C[C@@H](Br)C[C@@H]1CCCCCN1S(=O)(=O)c1ccc(Br)s1 312913615 AVXNUSNYZOZZGB-MNOVXSKESA-N 445.242 4.617 50 10 IJGE CC[C@H](NC(=O)c1cc(Br)cc(Br)c1)[C@H](Br)CC 313095281 WAPKEZUIWZEDRQ-NEPJUHHUSA-N 441.989 4.894 50 10 IJGE CCCC[C@@H](Cl)CC[C@@H](COC(=O)CCc1ccccc1)C(=O)CCCNC(C)=O 585667011 NMCYRDUXKPNNTK-FCHUYYIVSA-N 438.008 4.842 50 10 IJGE CC[C@@H](NC(=O)c1scc(Br)c1Br)[C@@H](C)Br 705423750 FQBUJUVMNBVAJE-IYSWYEEDSA-N 433.991 4.565 50 10 IJGE ClCc1cc(Br)cnc1N1C[C@H]2CC[C@H]1[C@H]1CN(Cc3ccccc3)C[C@H]21 705845705 MJTIVOOVTXBNOW-DBOLQNLKSA-N 446.820 4.930 50 10 IJGE N#Cc1ccc(NNC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)c(C(F)(F)F)c1 799752387 IFYBRIMAGXARKO-UHFFFAOYSA-N 434.805 4.961 50 10 IJGE C#CCO[C@@H](C)C(=O)Nc1ccc(Br)cc1CO[Si](C)(C)C(C)(C)C 1523669134 RFPYSVCZBOWRRW-AWEZNQCLSA-N 426.427 4.948 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)[C@H](Oc2ccc(Cl)cc2C)c2ccccc2)c1 1644011714 NEDFNEDUUSXPNN-JOCHJYFZSA-N 449.963 4.768 50 10 IJGE CCc1cc(Br)ccc1OCC(=O)NN=Cc1ccc(Cl)cc1Cl 1772755365 CSOIUITXPWBJEQ-UHFFFAOYSA-N 430.129 4.847 50 10 IJGE N#CSc1ccc(NC(=O)C2CCN(C(=O)/C=C/c3ccc(Cl)cc3)CC2)cc1 1860594602 CLNMBTXXSPBFOO-XCVCLJGOSA-N 425.941 4.804 50 10 IJGE COc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2ccccc2F)cc1 1865681520 POUAEBLJPJITSR-JOCHJYFZSA-N 438.462 4.905 50 10 IJGE CCc1nn(-c2ccc(Br)cc2)c2c1[C@@H](c1ccc(F)cc1)C(C#N)=C(N)O2 1865708442 WYBKJQRPDLKGEX-SFHVURJKSA-N 439.288 4.554 50 10 IJGE CCCCCOc1ccc(/C=N/NC(=O)CCCCCNC(=O)OC(C)(C)C)cc1OC 1873795195 BKBZLIYHANFJNX-NLRVBDNBSA-N 449.592 4.799 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)C(=O)Cc1ccccc1Br 1914639158 RKZCBWYCMNPIAN-CQSZACIVSA-N 425.164 4.804 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(O)c(Br)c1 1980635029 NLNIRAJJFUYBKF-HNNXBMFYSA-N 441.163 4.971 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H]2C[C@H]1[C@@H]2NC(=O)OCc1ccccc1 1999499714 BRCAFDKGKXCDPK-HSALFYBXSA-N 437.422 4.967 50 10 IJGE CC(C)[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]1C(F)(F)F 2052478965 MHVPIROERSSLMB-MGPQQGTHSA-N 431.337 4.526 50 10 IJGE BrC[C@@H]1C[C@@H]2CN(Cc3cc(Br)ccc3Br)C[C@@H]21 2054712059 HWGQNTSNTSSKBD-OPQQBVKSSA-N 438.001 4.674 50 10 IJGE CCCn1cc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)CC)cc1CBr 2059312606 NIBSWMOHMLTCNA-INIZCTEOSA-N 427.408 4.782 50 10 IJGE O=C(N[C@H]1C[C@H](CCBr)C1)c1cccc(Br)c1Br 2078355534 IOUWFOFCIRKJOL-KYZUINATSA-N 439.973 4.505 50 10 IJGE CCN1CCC[C@H]([C@H](Br)c2ccc(OCc3ccccc3)cc2)S1(=O)=O 2089514915 NKTSMIVRXDFADE-WOJBJXKFSA-N 438.387 4.516 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1Cc1ccn(Cc2ccccc2)n1 2095435859 DZXNUTGWAGPUSX-ZDUSSCGKSA-N 430.737 4.787 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]23CCC[C@]2(CN(CC2(CBr)CCCC2)C3)C1 2106782570 RLIBIYUSAYWVHB-SFTDATJTSA-N 427.427 4.665 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](C(F)(F)F)CCN1C[C@H](CBr)C1CC1 2107587290 UQDODWPJUPPSQF-KKUMJFAQSA-N 443.348 4.575 50 10 IJGE Cc1c(Br)cccc1C(=O)N[C@H](C)CCCCCI 2117892245 COTVCANPGQXXHZ-LLVKDONJSA-N 438.147 4.871 50 10 IJGE CCN(C[C@@](C)(CBr)OCCCN1CCCCCC1)C(=O)OC(C)(C)C 2119265417 XDQPSRFVZRCTHI-HXUWFJFHSA-N 435.447 4.680 50 10 IJGE CN([C@H]1CC(C)(C)[C@@H]1OCc1ccccc1)S(=O)(=O)c1ccc(CCCl)s1 2156442678 OAHABEBKXKFXLP-PKOBYXMFSA-N 428.019 4.534 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@@]2(F)CCC[C@@]2(CCl)C1 2176642004 WYSPWLGDTPJHNK-OLZOCXBDSA-N 445.579 4.846 50 10 IJGE CC[C@@H](C1CCC1)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2179775478 LIHZFVDSVFXJKE-NSHDSACASA-N 445.242 4.605 50 10 IJGE Brc1ccc([C@H](CI)O[C@H]2C[C@@H](n3cccn3)C2)cc1 2183684827 JCPWYXUSTDHFDR-ZNMIVQPWSA-N 447.114 4.542 50 10 IJGE ClCc1ccc(OCCOCCOCCOCc2ccccc2)c(Br)c1 2227769746 BKUPHNNVYPNDGK-UHFFFAOYSA-N 443.765 4.817 50 10 IJGE Cc1ccc(I)c(C(=O)Nc2ccc(CCBr)cc2)c1 2240925443 YKSQGDNZJUJGTE-UHFFFAOYSA-N 444.110 4.789 50 10 IJGE CC1CC(CBr)(CN2CCC[C@H](N(CC(F)F)C(=O)OC(C)(C)C)C2)C1 2265309367 FRVNBNWULGMMMC-HVEKOLDVSA-N 439.385 4.764 50 10 IJGE COC[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)N(CCCCCCCCCBr)C1 2289509262 UEPQSYZHJQZMHA-OALUTQOASA-N 449.474 4.974 50 10 IJGE C[C@@]1(CCBr)CCN1Cc1ccc(Cl)c(I)c1 2300237688 CBCNQRJBWHPKEY-CYBMUJFWSA-N 428.539 4.694 50 10 IJGE CN(Cc1cc(I)ccc1Cl)C[C@H](Br)C1CC1 2307326863 UCWNHPHHYIZRPM-LBPRGKRZSA-N 428.539 4.550 50 10 IJGE Cc1ccccc1SCC(=O)NN=C1C(=O)N(CC=Cc2ccccc2)c2ccccc21 2313649698 CUHQAGXZJPLLRX-UHFFFAOYSA-N 441.556 4.668 50 10 IJGE C[C@H]1[C@@H](Cl)C[C@@H](C)CN1Cc1ccc(I)c(Br)c1 2325227850 FABXNCDPWHGFCD-NRUUGDAUSA-N 442.566 4.891 50 10 IJGE CCCN(CC(C)(C)CNC(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2326915594 RJZHETAXUMPBGM-QGZVFWFLSA-N 427.374 4.670 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)[C@]12CO[C@](C(F)(F)F)(C1)C2 2338484310 VXMBFGNJMHJCCD-SZMVWBNQSA-N 434.296 4.546 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC(F)(F)C[C@@H]1CN(CC1(CBr)CCC1)C2 2344057432 SOFJWABSVQTVOV-KDOFPFPSSA-N 437.369 4.566 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@H]1CN(C[C@]1(CBr)CC1(F)F)C1CC1 2351887625 BBRKVRRRRXPJSM-MAUKXSAKSA-N 437.369 4.661 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@@]23CCC[C@@]2(C1)CN(C(=O)OC(C)(C)C)C3 2353822699 QRTGUCLWVFJISJ-DUXKGJEZSA-N 429.443 4.767 50 10 IJGE CC[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)COc1ccc(C(C)C)cc1 14768331 FRIAIHZQTGKZOM-VWLOTQADSA-N 446.547 4.861 50 10 IJGE O=C(N/N=C/c1ccccc1F)c1cccc(NC(=O)c2cccc(Br)c2)c1 27520138 VSNOQZCIFDVMTN-ZMOGYAJESA-N 440.272 4.604 50 10 IJGE Cc1ccsc1CN(Cc1ccccc1)C(=O)CN(C(=O)C(C)(C)CCl)C1CC1 33533791 LKIONVLYCHULIM-UHFFFAOYSA-N 433.017 4.841 50 10 IJGE Cc1ccc(C(=O)N/N=C2/C(=O)N(Cc3ccccc3Cl)c3ccccc32)cc1Cl 59153167 XPNAWJVILUJWFQ-YYADALCUSA-N 438.314 4.983 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3ccc([N+](=O)[O-])cc3C)c2C)cc1 96401920 ZVJSKGGYEQLMBW-UYRXBGFRSA-N 430.464 4.865 50 10 IJGE CN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)/C(C#N)=C2\Nc3ccccc3S2)cc1 100564034 NLHXSPNKQXQFOS-FCDQGJHFSA-N 447.541 4.647 50 10 IJGE O=C(OCC1c2ccccc2-c2ccccc21)N1CCC[C@@H](I)C1 306441587 JEPZWBKDDHHWQB-CQSZACIVSA-N 433.289 4.835 50 10 IJGE ClCc1ccc(Br)cc1N1CC[C@H](N2CCN(Cc3ccccc3)CC2)C1 312608348 GNNWXMSTQQLJFJ-NRFANRHFSA-N 448.836 4.584 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1Cc1sncc1Br 722789660 CKXQVMNBLSHYFB-LURJTMIESA-N 436.560 4.761 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cc2c(Br)cccc2[nH]1 725881409 KENWYYNUVDRUNY-UHFFFAOYSA-N 443.179 4.614 50 10 IJGE CC(=O)N(C)c1cccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(C)cc3)c2C)c1 744777239 QRWSSSDSMBHQHU-HMAPJEAMSA-N 426.520 4.931 50 10 IJGE CN(C)Cc1cnc(/C=C(/C#N)C(=O)Nc2nc(-c3ccccc3Cl)cs2)s1 794696577 HDGMASWNDKXPPY-GHXNOFRVSA-N 429.958 4.527 50 10 IJGE COc1cccc(COc2ccccc2C=NNC(=O)COc2ccc3ccccc3c2)c1 1083899665 IWUASTIAANEEBI-UHFFFAOYSA-N 440.499 4.957 50 10 IJGE COc1cccc(NC(=O)/C(C#N)=C/c2ccccc2OCc2ccc(C(=O)O)cc2)c1 1083928585 BSAQXEPTBICVLT-DEDYPNTBSA-N 428.444 4.518 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc3ccc(Br)cc3c2)c1C 1654343958 OVIDRSMQGPUKLH-UHFFFAOYSA-N 448.324 4.828 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2)[C@@H]1c1cc(Cl)ccc1O 1865688853 CLAPHAVPBQWPTN-MRXNPFEDSA-N 446.816 4.527 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@@H](c1ccc(O)c(OC)c1)C(C#N)=C(N)O2 1865706427 WJDYIMQLMRKMOB-QHCPKHFHSA-N 438.487 4.520 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)NNC(=O)CCCc1ccc(Cl)cc1 1865759813 TVDMTBKFEGSMMM-UHFFFAOYSA-N 443.881 4.773 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)N/N=C\c1ccc2c(c1)OCO2 1865762354 AVLRTPDYFMWCKV-VROXFSQNSA-N 428.275 4.856 50 10 IJGE N#C/C(=C(/O)CNC(=O)c1ccccc1)c1nc(-c2cccc(Br)c2)cs1 1872747061 MDSAPPBIRIBHML-VLGSPTGOSA-N 440.322 4.795 50 10 IJGE O=C(N[C@@H](CCCl)C(F)(F)F)c1cc(Br)c(Br)s1 1918557422 YQSCPPXNWVXQHF-LURJTMIESA-N 429.483 4.563 50 10 IJGE CC(C)(C)OC(=O)N(CC(F)F)[C@@H]1CCCN(C[C@@H](CBr)C2CCC2)C1 1966430715 PHXYRYRIJCZVOE-HZPDHXFCSA-N 439.385 4.764 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1Cc1ccc(Br)cc1Br 2018116691 GDYLARCLVJXEGU-ZANVPECISA-N 425.990 4.959 50 10 IJGE CC1(C)C[C@H](Br)CN1C(=O)c1cccc(Br)c1Br 2037325392 NCRNCTSYKTVIQU-QMMMGPOBSA-N 439.973 4.600 50 10 IJGE CCC(CC)(CBr)CN1C[C@H]2CC[C@H]1[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]21 2106788018 MFZNLYYGKOTNNM-TVFCKZIOSA-N 429.443 4.765 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CN(C[C@H](CBr)c3ccccc3)CC[C@@H]21 2163062388 LAYMKFRTRNRVAS-AABGKKOBSA-N 437.422 4.887 50 10 IJGE CCCN(C(C)(C)C)S(=O)(=O)c1ccc(CBr)c(Br)c1 2179954394 NMAZZVMVBXKAFP-UHFFFAOYSA-N 427.202 4.543 50 10 IJGE CCN(c1ccc(CBr)c([N+](=O)[O-])c1)C1CCN(Cc2ccccc2)CC1 2188578309 TYGNGVGXXZSEBR-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE O=S1(=O)CCCC[C@@H]1[C@@H](Cl)c1cc(Br)c(Br)cc1F 2225633499 KBWSUAWJUKUKOQ-NEPJUHHUSA-N 434.552 4.598 50 10 IJGE Cc1ccc(I)c(C(=O)Nc2ccc(CBr)cc2)c1 2232156400 IGEKWICCWURANS-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE C[C@H](CC[S@](C)=O)n1c(CCl)nc2cc(Br)c(Br)cc21 2234063425 DHRHVKQDBGRZDV-SQFXPLBJSA-N 442.604 4.630 50 10 IJGE Cc1sc(Br)c(C)c1[C@H](Br)[C@]12CCC[C@H]1CS(=O)(=O)C2 2234237627 SSDLHLGEZCAMJV-JKOKRWQUSA-N 442.238 4.778 50 10 IJGE CC[C@@H](Cl)[C@H]1CCCCN1C(=O)c1ccc(Cl)c(I)c1 2283654852 FNGQYKCGRPRRAR-BXUZGUMPSA-N 426.125 4.957 50 10 IJGE COc1ccccc1OCCn1cc(C=C(C#N)C(=O)NCc2ccco2)c2ccccc21 2294581391 PXMVHXMJVWCZIQ-UHFFFAOYSA-N 441.487 4.545 50 10 IJGE CC1(C)OCCC[C@]1(CBr)Cc1sccc1I 2301052029 BTRRDDGOIRQFPO-CYBMUJFWSA-N 429.161 4.866 50 10 IJGE CC(C)(C)N(CCCl)Cc1ccc(I)c(Br)c1 2306224133 NEGKJIYGGQZWIX-UHFFFAOYSA-N 430.555 4.893 50 10 IJGE CCCCc1ccc(C[C@@H]2SC(=C(C#N)C(=O)NC)N(c3ccc(C)c(C)c3)C2=O)cc1 2314594004 XLASURSBOZBCDV-QHCPKHFHSA-N 447.604 4.818 50 10 IJGE C[C@@H]1CCCN(Cc2ccc(Cl)cc2I)[C@@H]1CBr 2318542296 WFQLNXRNJQCLIR-QMTHXVAHSA-N 442.566 4.940 50 10 IJGE BrC[C@@H]1C[C@@H]2C[C@H](C1)CN(Cc1sccc1I)C2 2320231701 HVVLOVKNZDHOFC-CNDDSTCGSA-N 440.188 4.596 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Br)c2)C[C@@]1(C)CCl 2325214485 OSESQWUCQMPIII-IINYFYTJSA-N 442.566 4.751 50 10 IJGE COC[C@@]1(C)C[C@]1(CCl)Cc1ccc(I)c(Br)c1 2325224245 VOPWILIXJUTKQY-KGLIPLIRSA-N 443.550 4.878 50 10 IJGE Cc1ccc(C)c(-c2csc(C(C#N)=C(O)CCN3C(=O)c4ccccc4C3=O)n2)c1 2331319688 XHZHWHFGYVDYBO-UHFFFAOYSA-N 429.501 4.906 50 10 IJGE C[C@H](O[C@@H](CCl)[C@H](I)CCl)c1cccc(OC2CC2)c1 2368478135 APPUQEVKIUDZTM-VQISRLSMSA-N 429.125 4.955 50 10 IJGE Cc1c(Br)cc(NCC(=O)N/N=C2\CCCC[C@H]2C)cc1Br 33743719 ONZQALYADVSITK-LFVNQLLJSA-N 431.172 4.614 50 10 IJGE CC(C)Cc1ccc([C@H](C)C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cc1 66199212 LDNYHAXYJAAPRF-FQEVSTJZSA-N 430.548 4.882 50 10 IJGE CCc1ccc(N2C(=O)[C@@H](Cc3ccc(C(C)C)cc3)S/C2=C(/C#N)C(=O)NC)cc1 101240398 DOKQAWUAZFGGMU-CKVBZJJFSA-N 433.577 4.545 50 10 IJGE FC(F)(F)C(F)(F)[C@H](Br)c1cc2c(cc1Br)OCCO2 109865439 PCUKWQYWGAQCGL-SECBINFHSA-N 425.973 4.854 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1Br)c1cc(Br)cc(Br)c1 232461081 IIULIMXBGJAWFJ-NWDGAFQWSA-N 439.973 4.648 50 10 IJGE Cn1ncc([C@H](Br)c2cc(Cl)ccc2Cl)c1I 383249100 DTUBTOBWLOEREO-SNVBAGLBSA-N 445.913 4.816 50 10 IJGE O=C(CBr)c1cc(SC(F)(F)F)c(F)cc1I 575705290 VZOSZABWFUDITJ-UHFFFAOYSA-N 442.997 4.620 50 10 IJGE C[C@H](Br)C[C@@H](C)NC(=O)c1scc(Br)c1Br 705513502 PUWFRTSYXNGITC-NTSWFWBYSA-N 433.991 4.565 50 10 IJGE C[C@H](CCCCBr)NC(=O)c1scc(Br)c1Br 707838779 VUPYFMGQQZBGBI-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE Cc1ccc(F)c(NNC(=O)c2cc(I)c(Cl)cc2Cl)c1 787463892 HHRDEFQNARELJI-UHFFFAOYSA-N 439.055 4.802 50 10 IJGE N#Cc1ccc(NNC(=O)c2cccc(NC(=O)c3cccs3)c2)c(C(F)(F)F)c1 799750619 AXRDAVFJGMYKAS-UHFFFAOYSA-N 430.411 4.648 50 10 IJGE C[C@@H](NC(=O)C(=O)NN=Cc1ccc(-c2ccc(Cl)c(Cl)c2)o1)c1ccccc1 1084334492 OJCFUTGOXGMDTO-CYBMUJFWSA-N 430.291 4.581 50 10 IJGE C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CCC2=NNC(=O)c1cccc([N+](=O)[O-])c1 1084617546 PEVAPRZFSJGMGN-APDHKMKFSA-N 433.508 4.943 50 10 IJGE C=C(Cl)C[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(C2CCCCC2)c1C)C(=O)OCC 1132193087 UTXZGTNZHFTGKS-YMFQVDJJSA-N 431.964 4.708 50 10 IJGE C=CCC1(C(=O)NNC(=O)c2ccc(COc3ccc(OCC)cc3)cc2)CCCCC1 1349592856 CYINDTULNNJPJY-UHFFFAOYSA-N 436.552 4.952 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNc2ccccc2Br)s1 1446459289 LJMQVHDCKPSRRX-UHFFFAOYSA-N 432.796 4.744 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3ccc4nc(O)n(C)c4c3)c2C)cc1 1634785418 NKVQWWIKULJCNV-UNOMPAQXSA-N 425.492 4.541 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)C2(c3cccc(C(F)(F)F)c3)CCCC2)c1 1644011591 LBMPVEKTSOXCFK-UHFFFAOYSA-N 431.483 4.516 50 10 IJGE Cc1cc(Cl)ccc1NNC(=O)CCc1nc(O)c2c3c(sc2n1)C[C@H](C)CC3 1644396496 DGVUGPPZTYWMJY-LLVKDONJSA-N 430.961 4.559 50 10 IJGE COc1ccccc1C=NNC(=O)COc1ccc(-c2ccccc2)cc1Br 1772754861 YZXSMDMBXZRSJC-UHFFFAOYSA-N 439.309 4.654 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2CC(C)C 1865691537 VANRDIVAVGNDKO-QFIPXVFZSA-N 426.520 4.989 50 10 IJGE C[C@@H](/C(O)=C(\C#N)c1nc(-c2ccc(F)c(F)c2)cs1)N1C(=O)c2ccccc2C1=O 1872751799 UGEPUPRHUCIFKP-HSHIVQNRSA-N 437.427 4.566 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(CC3(CBr)CCC3)CC2)C1 1879207221 ZWJCTLRSDLJYCC-SFHVURJKSA-N 429.443 4.911 50 10 IJGE BrCCC=CCc1ccc(I)c(Br)c1 1893248127 WXTIQFFKMVZOLW-UHFFFAOYSA-N 429.921 4.937 50 10 IJGE CC[C@@H](Br)[C@@H](C)NC(=O)c1cccc(Br)c1Br 1943882782 HUUJUYFXYXPNOU-VXNVDRBHSA-N 427.962 4.503 50 10 IJGE CCC[C@@H](Br)CCNC(=O)c1csc(Br)c1Br 1945189422 QEALJWJTGWMBPD-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CCSC[C@H]1CCBr 1950312826 BSGOKUPRPKIVKG-OAHLLOKOSA-N 426.401 4.670 50 10 IJGE O=C(NC[C@@H]1CCC[C@H]1Br)c1cccc(Br)c1Br 2031487519 VMCDYFOMZHTKHW-WCBMZHEXSA-N 439.973 4.505 50 10 IJGE CCN(CC)C[C@H](Br)CCc1cc(Cl)ccc1I 2038160006 PDSNYUWQCITFQO-GFCCVEGCSA-N 444.582 4.983 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1C[C@@H](C(F)(F)F)[C@@H](CBr)C1 2107044733 ITKVKSUHBRBQGD-DZGCQCFKSA-N 448.304 4.973 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](C(C)(C)C)CN(C[C@H](CBr)C2CC2)C1 2108378903 XRLZGWMQSLDSDI-SZMVWBNQSA-N 431.459 4.916 50 10 IJGE O=C([C@H](Br)C1CCCC1)N1CCC[C@]2(CCCN(Cc3ccccc3)C2)C1 2167030757 AWWSIQXCRLJFKY-GGAORHGYSA-N 433.434 4.845 50 10 IJGE CO[C@H]1C[C@H]([C@H](Br)Cc2ccc(Br)cc2Cl)C[C@H]1OC 2237443318 INZPGAIWBBCWQU-LTZCYQRMSA-N 426.576 4.849 50 10 IJGE Cc1cc(Br)c(C(=O)NC[C@]2(CBr)C[C@@H]2C(F)(F)F)s1 2237621433 HMKSZNOOWWOHOK-GZMMTYOYSA-N 435.103 4.512 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCSC[C@@H]1CCBr 2282977676 DTRYEVNUQRBGRH-QMMMGPOBSA-N 445.579 4.584 50 10 IJGE CN(C)c1ccc(-n2cccc2C=C(C#N)C(=O)Nc2cccc(Br)c2)cc1 2294172008 SKSQGENFXYELMU-UHFFFAOYSA-N 435.325 4.851 50 10 IJGE Cc1ccc(C=C(C#N)C(=O)Nc2ccc(NC(=O)C(C#N)=Cc3ccc(C)o3)cc2)o1 2297307115 LOTIUWJADRPXEQ-UHFFFAOYSA-N 426.432 4.581 50 10 IJGE Clc1ccc(I)cc1COc1ncccc1CBr 2327242098 MPFAMASSMWSAOA-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE CN(Cc1ccccc1)[C@H]1CCCCN(c2c(CBr)c(C(F)F)nn2C)C1 2365333054 YDNLQCJJXPVAPC-INIZCTEOSA-N 441.364 4.744 50 10 IJGE CC[C@@H](C)c1ccccc1OCC(=O)NNC(=O)[C@H](C)Oc1ccc(-c2ccccc2)cc1 14038552 HFGTTWQNFRFWAZ-UXHICEINSA-N 446.547 4.861 50 10 IJGE CCCOc1cc(Br)c(/C=C(\C#N)C(=O)Nc2ccc(OC)cc2)cc1OC 38205618 QNTPKZDJOWFXQM-XNTDXEJSSA-N 445.313 4.801 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccs4)ccc32)cc1 38650638 TXHZBMNHUKBPMD-QFIPXVFZSA-N 432.501 4.974 50 10 IJGE Cc1ccc(-n2nc(C)c(/C=N/NC(=O)COc3ccc(C(C)(C)C)cc3)c2C)c(C)c1 59147919 RLIIETDPSZBHPT-JFLMPSFJSA-N 432.568 4.933 50 10 IJGE CC1=C(C#N)C(=O)N(C2CCCCC2)C(=O)/C1=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1 101339032 FCOXUCDNDFJBSV-CPNJWEJPSA-N 431.448 4.780 50 10 IJGE CCOc1ccc(CCN/C=C(/C#N)C(=O)Nc2ccccc2C(F)(F)F)cc1OCC 217062187 OONGXAAKBBMUKZ-ICFOKQHNSA-N 447.457 4.681 50 10 IJGE CC[C@](C)(CBr)NC(=O)c1ccc(Br)cc1Br 234115937 SOXBYXNIFJCWOC-GFCCVEGCSA-N 427.962 4.505 50 10 IJGE Cc1cc(C(=O)NCCCCCCI)sc1Br 235756370 XBSLOMRRQOJZSG-UHFFFAOYSA-N 430.149 4.544 50 10 IJGE CCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3ccc(C)cc3)cc2OC)cc1 254406224 SWFRVQAVJVUOEW-UHFFFAOYSA-N 446.503 4.776 50 10 IJGE O=C(NN=Cc1cn(Cc2ccccc2)nc1-c1ccccc1)c1ccc(Br)o1 254821917 PQWPGXYHDUQEOL-UHFFFAOYSA-N 449.308 4.718 50 10 IJGE Brc1ccccc1[C@@H](CI)OCCOC1CCC1 400736533 CWCZLSQLBYODEP-CQSZACIVSA-N 425.104 4.511 50 10 IJGE CC[C@@H](C[C@H](C)Br)NCc1cc(Cl)ccc1I 716806063 AZOXFHIADKBXIU-CABZTGNLSA-N 430.555 4.986 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc3ccc(OC(F)(F)F)cc3[nH]2)c(C(F)(F)F)c1 799751024 IOJHKXNEXIFXON-UHFFFAOYSA-N 428.292 4.714 50 10 IJGE O=C(NN=Cc1ccc(OCc2ccccc2Cl)cc1)C(=O)Nc1ccccc1Cl 1084365490 RUFDCZSYOVQSGC-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE CCOc1ccc(NC(=O)CCC(=O)NN=Cc2ccccc2OCc2ccccc2)cc1 1084376529 ROJUMGFAKWWVOZ-UHFFFAOYSA-N 445.519 4.533 50 10 IJGE CCc1cc(Br)cc2c1O[C@@]1(C=C2)CCN(C(=O)[C@@H](Br)CC)C1 1859497423 GALKTKCYSUTZKY-YJBOKZPZSA-N 443.179 4.562 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@H](c1ccccc1OC)C(C#N)=C(N)O2 1865710166 QAIMFPBIOSUDSJ-HSZRJFAPSA-N 428.536 4.728 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C1CC2(CCCN(C(=O)OC(C)(C)C)C2)C1 1882690453 NAEWJTSZDAHUST-CHWWFWEZSA-N 447.414 4.702 50 10 IJGE O=C(c1ncsc1Br)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915265116 OBPHXPWUPSIPGS-ZDUSSCGKSA-N 444.192 4.722 50 10 IJGE C[C@@H](NC(=O)c1cc(Br)sc1Br)C(C)(C)CBr 1942907452 ODCAOUBJMWGDGC-ZCFIWIBFSA-N 448.018 4.813 50 10 IJGE O=C(NC[C@@H]1CC[C@H](Br)C1)c1csc(Br)c1Br 1945188814 BRROOXSULZYQFH-RQJHMYQMSA-N 446.002 4.567 50 10 IJGE Cc1c([C@@H](Br)c2ccc(Br)s2)nn(C)c1Br 1980169698 CJOPKTDLWXYIJW-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCCC[C@@H](Br)C1 2003411229 ZQVUCOSRCDSFHD-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE BrCC1CCN(Cc2cc(Br)ccc2Br)CC1 2006503628 QGCXBZJPESHLRJ-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE CN(C[C@H]1C[C@@H]1Br)c1cc(Br)cc(F)c1CBr 2020222920 FMWYMEJIVKHTTO-XCBNKYQSSA-N 429.953 4.703 50 10 IJGE COC[C@]1([C@@H](Br)c2cc(Br)ccc2Br)CCCO1 2030231701 VRXFFDUSADJVKK-STQMWFEESA-N 442.973 4.843 50 10 IJGE CCCN1C[C@H](Br)[C@H](Cc2c(Br)cccc2Br)C1 2039264213 BWBBOYYVKFOVAZ-YGRLFVJLSA-N 440.017 4.859 50 10 IJGE CCCN1C[C@H](Br)[C@H](Cc2cc(Br)ccc2Br)C1 2054715936 AKKHQXUCHCTBTK-RISCZKNCSA-N 440.017 4.859 50 10 IJGE Cc1oc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)Cc1cccs1 2059277231 KLXHBYZMBGGOQA-UHFFFAOYSA-N 440.384 4.936 50 10 IJGE Clc1ccc(I)c(CN2CC[C@H](Br)[C@@H]3CC[C@H]32)c1 2069997358 SUBUTDZJHCNAMM-SGMGOOAPSA-N 440.550 4.692 50 10 IJGE CC1(C)CN(Cc2ccccc2)[C@@H](Cn2c(Cl)nc(Cl)c2CBr)CO1 2074185190 PFZQRKOQIQHLSR-AWEZNQCLSA-N 447.204 4.764 50 10 IJGE Br[C@H](Cc1ccccc1I)c1ncn2ccsc12 2083990333 IVGJPROKWLGUNH-SNVBAGLBSA-N 433.112 4.679 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Cl)c2)C[C@H]1CBr 2086653022 UVJYRBBVKHRMAA-LLVKDONJSA-N 442.566 4.798 50 10 IJGE FC(F)(F)[C@@H]1C[C@H]1[C@H](Br)c1cc(I)cc2c1OCC2 2100660417 SAIOROCHQLZHKD-IEBDPFPHSA-N 447.032 4.861 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2CN(CC3(CBr)CCCCC3)C[C@H]21 2106787577 IZTZDVJIFUCSMY-RCCFBDPRSA-N 429.443 4.957 50 10 IJGE CCc1ccc(NC(=O)[C@H](Br)C2CCCC2)cc1I 2128669005 CIWAGQFVHIQUQH-CQSZACIVSA-N 436.131 4.746 50 10 IJGE Fc1cc2nc(CCCl)n([C@]34C[C@H]3CN(Cc3ccccc3)C4)c2cc1Br 2155866937 YUHHGSAIWRLQHD-BTYIYWSLSA-N 448.767 4.950 50 10 IJGE Cc1csc(CCl)c1S(=O)(=O)N(C)[C@@H]1CC(C)(C)[C@H]1OCc1ccccc1 2156446150 ZQIMLIDZMNTCBV-APWZRJJASA-N 428.019 4.800 50 10 IJGE Cc1csc(C(=O)NCC2(F)CCC(CBr)CC2)c1Br 2178580905 JEMJCFLUOPHTJK-UHFFFAOYSA-N 427.177 4.842 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1CCc2sc(Br)cc2C1 2206353042 GIGYDEQKJHUCQJ-UHFFFAOYSA-N 438.166 4.938 50 10 IJGE Cc1sc(C(=O)N[C@H](C)CCCCCI)cc1Br 2218966669 ZQIXEEJNLGYDKF-SECBINFHSA-N 444.176 4.933 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1[C@H]1COC[C@@H]1F 2234067397 OAXHMQNFHOVKKB-HQLZOWSPSA-N 426.511 4.771 50 10 IJGE Cc1sc(Br)cc1[C@H](Br)c1cscc1S(C)(=O)=O 2260093947 DKMVHPVLRSQDBW-NSHDSACASA-N 430.208 4.768 50 10 IJGE CS(=O)(=O)C1([C@@H](Br)c2cc3sc(Br)cc3s2)CC1 2263615521 LIDGNQKQLJDDGH-JTQLQIEISA-N 430.208 4.739 50 10 IJGE O=C(c1ccc(Cl)c(I)c1)N1CCC[C@@H](CCCCl)C1 2283652689 YHTMRIFVWZOGLP-LLVKDONJSA-N 426.125 4.816 50 10 IJGE CC[C@H](NC(=O)C(C#N)=CN1CCN(c2ccc(F)cc2)CC1)c1ccc2c(c1)CCCC2 2325081375 BPGNWBAIFCEDEF-SANMLTNESA-N 446.570 4.501 50 10 IJGE CC(C)N(C[C@H]1CCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2326915117 OHOSGQNKJDIBFH-PBHICJAKSA-N 425.358 4.517 50 10 IJGE Cc1ccnc(CO[C@H](CI)c2cccc(Br)c2)c1 2343572338 CXBDJRMFDOEADI-OAHLLOKOSA-N 432.099 4.845 50 10 IJGE COc1cc(/C=N/NC(=O)COc2cccc(Cl)c2)ccc1OCc1ccccc1C 40911537 UXKACIUQVRCJBC-VULFUBBASA-N 438.911 4.765 50 10 IJGE CCOC(=O)/C(C#N)=C1\C(=O)N2c3c1cc(CC)cc3[C@](C)(c1ccccc1)CC2(C)C 104389702 PVJCWBMUANSRIN-GQPGBQDVSA-N 428.532 4.924 50 10 IJGE C[C@@H](C[C@@H](C)Br)NC(=O)c1cc(Br)ccc1Br 161233736 HIEDZMJJSGYNAK-SFYZADRCSA-N 427.962 4.503 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccco2)C(=O)/C1=C\c1ccc(OCc2ccc(C)cc2)cc1 214320157 WTAPMZJGSJGLRO-OYKKKHCWSA-N 438.483 4.960 50 10 IJGE CCCCc1ccc(NC(=O)/C(C#N)=C\NCCc2cccc(Br)c2)cc1 217171321 RZQNDOOHRGFFDY-MNDPQUGUSA-N 426.358 4.970 50 10 IJGE CC[C@@H](N/C=C(/C#N)C(=O)N[C@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 217171593 DVGWFEJTONCTNB-IGXFIWQZSA-N 447.579 4.908 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1)c1ccc(N2C(=O)CS[C@H]2c2ccccc2)cc1 252598903 DEHHBVFZHPUZPC-QHCPKHFHSA-N 435.936 4.883 50 10 IJGE Cc1ccc(NC(=O)COc2ccc(/C=C(/C#N)C(=O)N[C@@H]3CCCC[C@H]3C)cc2)cc1 254506148 LTHDIUBJMWFOSZ-ROJMBEOXSA-N 431.536 4.614 50 10 IJGE Cc1ccc([C@H](Br)c2cnn(C)c2I)c2ccccc12 379216850 QPRHCQBGDCTXCF-HNNXBMFYSA-N 441.110 4.971 50 10 IJGE N#C/C(=C1/CCN(C(=O)OCc2ccccc2)C1)c1cccc(I)c1 381953895 DLPOEMMHHZJCHX-HTXNQAPBSA-N 444.272 4.611 50 10 IJGE COC(C)(C)CO[C@@](C)(CI)c1ccccc1Br 386305013 IHNYMAWXWVYLOK-AWEZNQCLSA-N 427.120 4.541 50 10 IJGE CC(C)(C)C[C@@H](CBr)NS(=O)(=O)c1c(Cl)cccc1Br 393494185 OJYKKTRNBIFQFW-VIFPVBQESA-N 447.620 4.581 50 10 IJGE COc1cccc(C=NNC(=O)c2ccccc2)c1OCc1ccc(Br)cc1 725394107 NCDMFHRFQLWAFJ-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2csc(-c3cccc(Cl)c3)n2)c1C 736693830 SDHLAFJYKIYBIG-UHFFFAOYSA-N 436.928 4.689 50 10 IJGE O=C(Nc1ccccc1S[C@@H](Cl)C(F)(F)F)C(=O)N[C@@H]1CCCC(F)(F)C1 768757104 PQJACTULUKPCHM-YMTOWFKASA-N 430.826 4.539 50 10 IJGE Cc1ccc(C)c(-n2c(C)c(Br)c(C=NNC(=O)c3ccccc3O)c2C)c1 1083889382 MBGHVUKZSPUZQU-UHFFFAOYSA-N 440.341 4.943 50 10 IJGE O=C(NN=Cc1cccn1-c1ccc(Cl)cc1)C(O)(c1ccccc1)c1ccccc1 1083902075 OZAGHXRTHIMBRP-UHFFFAOYSA-N 429.907 4.517 50 10 IJGE N#C/C(=C\c1ccc(OCc2ccc(F)cc2)cc1)C(=O)N1CCN(c2ccccc2)CC1 1084129444 AVWTWMYBTBVBRB-PTGBLXJZSA-N 441.506 4.660 50 10 IJGE O=C(CCCC(=O)Nc1ccc(Br)cc1)NN=Cc1c(F)cccc1Cl 1084361838 IRKOCTQSEFZPND-UHFFFAOYSA-N 440.700 4.501 50 10 IJGE COc1ccc(-c2nn(Cc3ccccc3)c3c2[C@@H](c2ccccc2)C(C#N)=C(N)O3)cc1 1865680838 XEJOQXGWBOEVQZ-QHCPKHFHSA-N 434.499 4.825 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2c(F)cccc2Cl)[C@H]1c1ccc[nH]1 1865709393 BGNGHAYDSFLHTA-HXUWFJFHSA-N 445.885 4.937 50 10 IJGE COc1ccc(OC)c(/C(C)=N/NC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)c1 1865763617 UPAUNBSUVNIKIT-MZJWZYIUSA-N 425.435 4.506 50 10 IJGE CC(C)[C@H](CBr)CN(OCc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 1881878171 HCVWLUZOBWSJDS-GOSISDBHSA-N 441.410 4.707 50 10 IJGE FC(F)(F)[C@H](Br)COc1cc(Br)cc(Br)c1 1901041334 DUCAJCVLFIIIQU-MRVPVSSYSA-N 426.852 4.916 50 10 IJGE O=S(=O)(c1ccc(Cl)s1)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915166613 RFQRXYNFKHFETN-CQSZACIVSA-N 434.808 4.766 50 10 IJGE Brc1cccnc1C[C@H](Br)c1csnc1Br 1925225726 LFEBRXRDXPCQEC-QMMMGPOBSA-N 426.959 4.742 50 10 IJGE Cc1sc(Br)cc1[C@@H](Br)c1cc(Br)n(C)n1 1937822171 UWDZADKAUAUUTR-SNVBAGLBSA-N 428.975 4.799 50 10 IJGE C[C@@H]1CCN(Cc2cccc(Br)c2Br)[C@@H]1CBr 1943882389 VQKKCWFYRIBITM-BXKDBHETSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@](C)(CI)O2)[C@H]1C(C)(C)C 1987727472 NJCTUSFVHJYWTR-FSPWUOQZSA-N 437.362 4.785 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@H]([C@@]2(C)CC[C@@](C)(CI)O2)CC1 1993736342 WAQQOMDDQRBYFY-DFEHZGFQSA-N 437.362 4.833 50 10 IJGE CCC(CC)[C@@H](Cl)CNc1ncc(I)cc1Br 2015757501 URLRQOYLYCZORQ-NSHDSACASA-N 431.543 4.904 50 10 IJGE BrC[C@@H]1C[C@H]2CC[C@H]1N2Cc1cc(Br)ccc1Br 2054718316 MZYRRXFRWMTFOW-MRCXROJRSA-N 438.001 4.959 50 10 IJGE O=C(NC[C@H](Cl)CC(F)(F)F)c1cc(Br)sc1Br 2055502507 LQPPJWFEECUIMV-SCSAIBSYSA-N 429.483 4.563 50 10 IJGE CC(C)[C@H](CBr)CN=[S@](=O)(C(C)C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2063273395 MHDGDVSDYCKBCW-TWKFVSLJSA-N 439.460 4.539 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1cc(C(F)(F)F)n(C)n1 2102479678 NZLKZMOFWORWNL-HNNXBMFYSA-N 432.284 4.501 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCCN1C[C@@H](CBr)c1ccccc1 2106786541 VEBMUCKHVKVALD-QXAKKESOSA-N 425.411 4.933 50 10 IJGE CCCN(C[C@H](CBr)c1ccccc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2106788991 VIGYTBNNHSMCOS-RBUKOAKNSA-N 425.411 4.887 50 10 IJGE BrC[C@@]12CCC[C@H]1N(Cc1ccc(I)cc1)CCC2 2108953147 SMHBMOMNRINQNQ-CVEARBPZSA-N 434.159 4.821 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@](C)(CBr)C(F)(F)F)cc1Cl 2161365339 MEIQEOFKHNAXHC-LLVKDONJSA-N 437.481 4.857 50 10 IJGE O=C(NC[C@]12CC[C@H]1CCCN2CC1(CBr)CCCCCC1)C(F)(F)F 2163059775 WHRVKECWQYAVCE-CRAIPNDOSA-N 439.360 4.645 50 10 IJGE FC(F)(F)c1cnc(N[C@@H](CCl)c2cscn2)c(I)c1 2175673386 ALPRNXHUDKKTNR-QMMMGPOBSA-N 433.624 4.554 50 10 IJGE CC[C@H]1CC[C@@H](C)N(S(=O)(=O)c2cc(CBr)sc2Br)C1 2179788149 YOPMJMHMOPRVLL-ZJUUUORDSA-N 445.242 4.605 50 10 IJGE CC(C)(C)[C@]1(CBr)CCN(C[C@H]2CC2(Br)Br)C1 2213091307 MMPKHOISHZNSBJ-PWSUYJOCSA-N 432.038 4.626 50 10 IJGE Clc1cc(Br)ccc1CC12COC(CI)(C1)C2 2216261691 JHIQWARURPMUPL-UHFFFAOYSA-N 427.507 4.629 50 10 IJGE C[C@@H]1OCCO[C@H]1[C@H](Br)c1cc(Br)c(Br)cc1F 2218606583 SEYMZHFHFUTAGO-ZYDDLXRUSA-N 446.936 4.591 50 10 IJGE C[C@H]1[C@H](Br)C[C@@H](C)CN1Cc1cc(Cl)ccc1I 2220346362 YNTIKWMUSNMOHT-GBIKHYSHSA-N 442.566 4.938 50 10 IJGE C[C@@H](CC[S@@](C)=O)n1c(CCl)nc2cc(Br)c(Br)cc21 2234063423 DHRHVKQDBGRZDV-FFVOIRBGSA-N 442.604 4.630 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1[C@H]2CC[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C2 2241742119 VSTCTWNVWWBEOZ-LYYZXLFJSA-N 447.414 4.604 50 10 IJGE Fc1cccc([C@H](CI)O[C@@H]2CCN(Cc3ccccc3)C2)c1 2244798872 CVDBIPRHEZHKJQ-MOPGFXCFSA-N 425.285 4.593 50 10 IJGE CCCCN(CCBr)C(=O)c1ccc(Cl)c(I)c1 2256391444 RTALOVQYZBAUIF-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE Cc1sc(Br)cc1[C@@H](Br)c1cscc1S(C)(=O)=O 2260093946 DKMVHPVLRSQDBW-LLVKDONJSA-N 430.208 4.768 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2CC3(CCC3)CO2)cc1I 2269557245 SXAALVYGLMQUFS-ZIAGYGMSSA-N 437.115 4.695 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1Cc1ccc(Cl)c(I)c1 2300238291 JDXRLXHALCYFLZ-GXSJLCMTSA-N 428.539 4.692 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccc(F)cc2)ccc1OCc1ccc(C(=O)O)cc1 2313574351 YVLTXBGSKLXUHO-UHFFFAOYSA-N 446.434 4.657 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)N[C@@H](C)c2ccccc2)c(Br)cc1OC 2313724692 UJRDRPMHOUQAJB-AWEZNQCLSA-N 429.314 4.641 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2CCC[C@H](C)O2)cc1I 2318714763 PDYJQQOQCHFTSE-QCZZGDTMSA-N 425.104 4.693 50 10 IJGE COc1cc(C(O)=C(C#N)c2nc(-c3ccc(F)c(F)c3)cs2)c([N+](=O)[O-])cc1OC 2331352448 XBQOVZLQGRLHOB-UHFFFAOYSA-N 445.403 4.964 50 10 IJGE CCC(CBr)(CBr)NC(=O)c1c(Cl)cc(F)cc1Cl 2340767113 JNFFKYCWFKPCDT-UHFFFAOYSA-N 435.946 4.801 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CCN(C[C@@]1(CBr)CC1(F)F)C2 2351889285 SQDUHHSBAVILOX-SFHVURJKSA-N 431.321 4.812 50 10 IJGE CC1(C)CN(S(=O)(=O)c2cc(CBr)sc2Br)C(C)(C)C1 2369682553 PTVQXANFSQKDNN-UHFFFAOYSA-N 445.242 4.605 50 10 IJGE N#C/C(=C/c1ccc(-c2cccc(F)c2)o1)C(=O)Nc1sc2c(c1C(N)=O)CCCC2 2708493 BESYJBAYLUMEHP-KAMYIIQDSA-N 435.480 4.671 50 10 IJGE C=CCNC(=O)/C(C#N)=C\c1ccc(OC(=O)c2ccc(-c3ccccc3)cc2)c(OC)c1 33860932 SETMEKUIMLCLFQ-KQWNVCNZSA-N 438.483 4.791 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(OC)cc4)ccc32)cc1 38685616 VHHOOCINGXTBRN-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE C[C@@H]1CC(O[C@H](CI)c2ccccc2Br)C[C@@H](C)O1 231320104 TWLLMFGTHBPAND-UEKVPHQBSA-N 439.131 4.898 50 10 IJGE CC1(C)CCC(O[C@](C)(CI)CNC(=O)OC(C)(C)C)CC1 231320581 FDGLCNLMWADERJ-QGZVFWFLSA-N 425.351 4.690 50 10 IJGE O=C(CBr)c1c(OC(F)F)cc(Br)cc1OC(F)(F)F 575681457 ZVXSQWOEPGGSCX-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE CC(C)[C@H]1CN(c2ccc([N+](=O)[O-])c(CBr)c2)CCN1Cc1ccccc1 704739845 OKAOAXAQNAJYON-OAQYLSRUSA-N 432.362 4.837 50 10 IJGE CC(=O)N(c1ccc(F)cc1)c1nc(C=NNC(=O)CCCc2cccs2)cs1 732529786 XKEZURDBVSREDJ-UHFFFAOYSA-N 430.530 4.501 50 10 IJGE Cc1cc(C(=O)NNC(=O)c2cccc3ccccc23)ccc1NC(=O)c1cccs1 759158182 MUBOZVATFMBYLQ-UHFFFAOYSA-N 429.501 4.537 50 10 IJGE Cc1ccc([C@H](NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c2ccccn2)cc1 799633364 ZSPPEGLWVRLSEY-FQEVSTJZSA-N 425.414 4.696 50 10 IJGE O=C(NN=C1CCN(CCc2ccccc2)CC1)c1cc(-c2ccncc2)nc2ccccc12 915934777 HKFADCPNSYLBFF-UHFFFAOYSA-N 449.558 4.721 50 10 IJGE CCOc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)c2ccncc2)cc1Cl 1081080156 PUYYHOYPFOSNJK-UHFFFAOYSA-N 445.910 4.750 50 10 IJGE O=C(NN=Cc1cccc(Oc2ccccc2)c1)c1cccc(I)c1 1083954556 QSDGWGZKRTYBJB-UHFFFAOYSA-N 442.256 4.847 50 10 IJGE N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NNC(=O)c2ccc(Br)cc2)cc1 1254703624 FMZXWEUNJLGEQO-FQEVSTJZSA-N 449.308 4.571 50 10 IJGE Cc1ccc(Cl)cc1NNC(=O)CCc1nc(O)c2c3c(sc2n1)C[C@@H](C)CC3 1304402335 LLFHWJUEJGHQLD-NSHDSACASA-N 430.961 4.559 50 10 IJGE C=CCOc1ccc(/C=C/C(=O)NNc2ccc(Br)cc2Cl)cc1OC 1569967809 SDHRJAUAXMMNSP-WEVVVXLNSA-N 437.721 4.832 50 10 IJGE CC(C)(C)c1ccc(OCCCC(=O)NCCCBr)c(Br)c1 1865929559 ITGQEZZUZJAGQJ-UHFFFAOYSA-N 435.200 4.807 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H]2CCCC[C@H]12 1882180527 OCJSJBOXUOBWQA-KLHDSHLOSA-N 447.414 4.700 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C1C[C@@H]2C[C@H](C1)CN(C(=O)OC(C)(C)C)C2 1887719652 QHLCSGVESYLMNN-QXULXFAOSA-N 447.414 4.558 50 10 IJGE O=S(=O)(c1ccc(Cl)s1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915166612 RFQRXYNFKHFETN-AWEZNQCLSA-N 434.808 4.766 50 10 IJGE O=C(c1ccc(C(F)(F)F)nc1)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915263933 IXKJOVWHXADFFO-MRXNPFEDSA-N 427.264 4.916 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1cnn(-c2ccccc2)c1 1915273505 MDFJNVLACSTHJH-OAQYLSRUSA-N 426.358 4.934 50 10 IJGE CC1(C)C[C@@H](N(Cc2ccccc2)S(=O)(=O)c2cc(CCl)ccc2Cl)CO1 1915482642 WKYITVYNIWVHEK-QGZVFWFLSA-N 428.381 4.837 50 10 IJGE C[C@H]1CC[C@H](Br)CN1C(=O)c1csc(Br)c1Br 1945186179 CQSHCLRPWQYFCK-BQBZGAKWSA-N 446.002 4.661 50 10 IJGE CC(C)(C)OC(=O)N1C[C@](C)([C@@H]2CC[C@@](C)(CI)O2)CC1(C)C 1992813775 LOOJEZCILXULAX-VHSSKADRSA-N 437.362 4.785 50 10 IJGE Cn1nc([C@@H](Br)c2ccc(F)c(Br)c2F)cc1Br 2033080749 WULSTMWBDWMMNX-VIFPVBQESA-N 444.899 4.708 50 10 IJGE CC(C)[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]1C(F)(F)F 2052478966 MHVPIROERSSLMB-MJBXVCDLSA-N 431.337 4.526 50 10 IJGE C[C@@H](Cl)C[C@@H]1CCCCN1c1ncc(I)cc1Br 2069526373 VFRNGUHKWCDXFN-KOLCDFICSA-N 443.554 4.825 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@H]2[C@H](Cl)CCC[C@H]2C1 2094588913 VSUDVRKYMGSWOV-QXFUBDJGSA-N 427.589 4.753 50 10 IJGE CC[C@H]1CN(C(=O)OC(C)(C)C)CCCN1C[C@@H](CBr)c1ccccc1 2106789388 YDMJCHRINQVOKQ-MOPGFXCFSA-N 425.411 4.887 50 10 IJGE COc1ccc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)CC1CCC1 2123271648 STGFKSJATIMFPU-UHFFFAOYSA-N 438.387 4.581 50 10 IJGE Cc1cc(Br)c(C)c([C@H](Cl)C(C)(C)S(C)(=O)=O)c1Br 2136372294 SSJBOTFEGVUWBA-LBPRGKRZSA-N 432.605 4.932 50 10 IJGE FC(F)(F)c1cc(CCl)nc(-c2ncc(Br)cc2Br)n1 2167099674 SBNCQWXMELLWGC-UHFFFAOYSA-N 431.437 4.821 50 10 IJGE C[C@](CI)(O[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1F 2250387492 PNDLOEOIRGLOPF-YLJYHZDGSA-N 439.312 4.767 50 10 IJGE C[C@@H](COC(F)F)O[C@@H](CI)c1cccc(Br)c1 2253922840 HIMGEKNIHNLMJF-KWQFWETISA-N 435.046 4.570 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2CCCOCC2)cc1I 2257374908 VWFRFSZLCPOBLB-HZMBPMFUSA-N 425.104 4.553 50 10 IJGE O=C(NC[C@H]1CCCC[C@@H]1Br)c1cc(F)c(Br)cc1Cl 2282972773 UDXVYGTVVJPIGZ-SCZZXKLOSA-N 427.539 4.925 50 10 IJGE O=C(N[C@@H](CCl)C1CCCCC1)c1ccc(Cl)c(I)c1 2283663571 NSVMKTIKHZSPCO-AWEZNQCLSA-N 426.125 4.862 50 10 IJGE C=CC[C@]1(CBr)CCCN1C(=O)c1cc(C)ccc1I 2287793993 VDMLHSNCVHFNMA-MRXNPFEDSA-N 448.142 4.545 50 10 IJGE CC1(C)OC[C@@H](Cc2ccc(Cl)c(I)c2)[C@@H]1Br 2300239093 UDQRTZLWPLMQSE-SKDRFNHKSA-N 429.523 4.676 50 10 IJGE Clc1ccc(CN2CCC[C@@H](CBr)CC2)c(I)c1 2318527060 QIHJGOTWUHCYKJ-LLVKDONJSA-N 442.566 4.942 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Br)c2)CC[C@@H]1CCl 2325223196 WMLVMGAQWWHDNG-CMPLNLGQSA-N 442.566 4.751 50 10 IJGE C[C@]1(CNCc2ccc(I)c(Br)c2)CCC[C@@H]1Cl 2325228415 HSQRPGSIEWRLIT-UONOGXRCSA-N 442.566 4.941 50 10 IJGE Clc1ccc(I)cc1CN1CCCC[C@H](CBr)C1 2327399826 WOVLVGOCCYBCTE-LLVKDONJSA-N 442.566 4.942 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C3N=C(N)c4ccccc4N3C3=C2C(=O)CC(C)(C)C3)cc1 3654535 SQNIBTPUSFZKDO-HSZRJFAPSA-N 438.531 4.786 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)C2CCCCC2)cc1Br 8565668 WKYZTXNYVIVJFD-UHFFFAOYSA-N 425.367 4.750 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2ncc(Cc3ccccc3Cl)s2)ccc1O 33858622 MOHXQNZZYOTVAO-NVNXTCNLSA-N 425.897 4.647 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C/c2ccc(OCC)c(OC)c2)cc1 40970717 HOLAPKBRACNSKU-SVWIXSIKSA-N 448.519 4.536 50 10 IJGE CS(=O)(=O)c1ccc([C@H](Br)c2cc(F)c(Br)cc2F)cc1 70474555 XZFJAGSCHPKNKM-AWEZNQCLSA-N 440.103 4.615 50 10 IJGE COc1ccc2nc(CCl)n(-c3cc(Br)ccc3Br)c2n1 157200990 BEVANCMSKVMSCD-UHFFFAOYSA-N 431.515 4.693 50 10 IJGE CCCOc1ccc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)cc1[N+](=O)[O-] 169891380 OXIZKCAUUKREEH-MLGZCZAZSA-N 434.496 4.754 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccccc4)nc3c2)cc(Cl)c1O 169925793 GPVBJOPPUXQOMZ-WGARJPEWSA-N 448.910 4.675 50 10 IJGE CC(C)(C)CCO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 231317878 OZQUHDLRAYEJPW-KRWDZBQOSA-N 425.351 4.644 50 10 IJGE Cc1ccc(NC(=O)CCC(=O)NN=Cc2ccc(OCc3ccccc3)cc2)c(C)c1 257351402 DXDDVABGLYFWLU-UHFFFAOYSA-N 429.520 4.751 50 10 IJGE CC[C@@H]1CCCC[C@H]1O[C@](C)(CI)CNC(=O)OC(C)(C)C 299979651 LGSLTZSJOZMFRC-CKEIUWERSA-N 425.351 4.690 50 10 IJGE O=C(Nc1cccc(CCBr)c1)c1sccc1I 313172880 MSVJGDQUDXLBNQ-UHFFFAOYSA-N 436.112 4.542 50 10 IJGE Clc1cc(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@@H]32)ccc1CBr 404156382 PVNGKUCAURVNAJ-LEWJYISDSA-N 435.793 4.715 50 10 IJGE C[C@@H](Br)[C@H]1CCCCN1c1ncc(Br)cc1Br 688877424 ZSPGQSJICNSECX-LDYMZIIASA-N 426.978 4.749 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1ncc(CCl)cc1Br)C2 705899503 ZKZGEYUEBORDDW-OYRHEFFESA-N 434.809 4.931 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)O[C@@H]2COc3cc(Cl)ccc32)c(-c2ccccc2)n1 774517495 GBXMVUIBRXVIFW-CJBPROBKSA-N 444.878 4.701 50 10 IJGE O=C(CCC(=O)Nc1ccc(Cl)cc1)NN=Cc1ccccc1OCc1ccccc1 1083990436 IIPFNQGJBDCPEF-UHFFFAOYSA-N 435.911 4.788 50 10 IJGE CC(=NNC(=O)CCCSc1nc2ccc([N+](=O)[O-])cc2s1)c1ccc(C)cc1 1084050468 LMHUWNGFZSVAST-UHFFFAOYSA-N 428.539 4.926 50 10 IJGE Cc1[nH]nc(O)c1NC(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1141578057 DKYAMWLGQPGOGQ-AUWJEWJLSA-N 430.295 4.684 50 10 IJGE CC(=O)c1oc2cc(C)ccc2c1CC(=O)NNC(=O)c1cc2c(s1)CCCCCC2 1650647539 DFNJMIQBUJHPKG-UHFFFAOYSA-N 438.549 4.668 50 10 IJGE O=C(CCCC[C@H]1CCSS1)NC1CCN(C(=O)c2c[nH]c3ccccc23)CC1 1860191790 FRMSVKODYSHKMA-KRWDZBQOSA-N 431.627 4.603 50 10 IJGE Cc1ccc(-c2csc(/C(C#N)=C(\O)[C@H](C)N3C(=O)c4ccccc4C3=O)n2)c(C)c1 1872748874 QQUCOSAEGFLJPN-AYAKEVCGSA-N 429.501 4.904 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CCl)Cc1cc(Br)ccc1Br 1882068026 UGJPFEVZUJEGQF-LLVKDONJSA-N 427.564 4.886 50 10 IJGE O=C(NCC1CCC(CCl)CC1)c1cc(Cl)ccc1I 1922694670 FGXHGDNTTSFPGN-UHFFFAOYSA-N 426.125 4.720 50 10 IJGE C[C@H]1CO[C@@](CBr)(Cc2ccc(Br)cc2Br)C1 1943840873 DUMBPKKZVPEOJK-NOZJJQNGSA-N 426.974 4.944 50 10 IJGE CCC[C@H]1C[C@@H]1COC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1993096498 DQEUQNPNHABYPM-LSDHHAIUSA-N 437.362 4.644 50 10 IJGE Clc1nc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)sc1CBr 1999619828 RSOFZFBCWBXFEM-GOSISDBHSA-N 426.811 4.794 50 10 IJGE ClC[C@H]1CC[C@@H](Nc2ncc(I)cc2Br)CC1 2015763244 WFKBAIARLUFBLD-WAAGHKOSSA-N 429.527 4.658 50 10 IJGE C[C@H](CNC(=O)c1cccc(Br)c1Br)C[C@@H](C)Br 2031477790 NVUQHAYURJJOLA-DTWKUNHWSA-N 441.989 4.751 50 10 IJGE CC(C)[C@@H](CBr)CNC(=O)c1c(Br)cccc1Br 2033086221 JWGXXXKKRWORMK-VIFPVBQESA-N 441.989 4.609 50 10 IJGE CCCN1C[C@H](Cc2cc(Cl)ccc2I)[C@@H](Br)C1 2039250369 JJIHQCPDDIBULH-AAEUAGOBSA-N 442.566 4.592 50 10 IJGE Brc1cccc(Br)c1C[C@@H]1CN(C2CC2)C[C@@H]1Br 2039251073 OBAUIHLUUKNTAH-OTYXRUKQSA-N 438.001 4.612 50 10 IJGE CCC(CC)(CBr)CN=S1(=O)CCC(CNC(=O)OC(C)(C)C)CC1 2044697102 RHTSVAJPOUBCIP-UHFFFAOYSA-N 439.460 4.590 50 10 IJGE CC[C@@H]1CCOC[C@@H]1O[C@H](CI)c1ccc(Br)cc1 2096206484 IHWRSSDSJJDEMW-DFBGVHRSSA-N 439.131 4.757 50 10 IJGE CCN(CCCOCc1ccccc1)S(=O)(=O)c1ccc(CBr)c(C)c1 2123199666 VYVXJOWWVRIOFV-UHFFFAOYSA-N 440.403 4.507 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@H](CCl)C12CCC2 2133828272 QRYIYGSRGNGNQL-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE Cc1cccc(C(=O)N2C3CCC2([C@@H](C)Br)CC3)c1I 2153387088 UZBXPMZWQAPHIB-OPGSHWCFSA-N 448.142 4.520 50 10 IJGE CC1(C)CCN(c2c(CBr)ccc(Br)c2Cl)CC[S@@]1=O 2154376299 SAXGMJJXYMNTPH-FQEVSTJZSA-N 443.632 4.735 50 10 IJGE CC(C)(C)[C@H]1C[C@H](CCl)CN(C(=O)c2csc(I)c2)C1 2165006147 FYUFVDYBWOBAAH-PWSUYJOCSA-N 425.763 4.716 50 10 IJGE CCCC1CC(N(C)S(=O)(=O)c2cc(CBr)sc2Br)C1 2180048874 UDDMHNLLIZPSBA-UHFFFAOYSA-N 445.242 4.605 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 2184941044 NXVHVTBJVOQZJE-IGOJGBNBSA-N 445.792 4.586 50 10 IJGE C[C@@H](CCCl)N(Cc1ccccc1)S(=O)(=O)Cc1ccsc1Br 2210633080 REERTXZUPVYLFB-ZDUSSCGKSA-N 436.824 4.860 50 10 IJGE Cc1sc(C(=O)NC[C@]2(CBr)C[C@H]2C(F)(F)F)cc1Br 2234474719 MMCTYTJYRIYZLE-MWLCHTKSSA-N 435.103 4.512 50 10 IJGE C[C@@H](Cl)c1nc2cncnc2n1Cc1scc(Br)c1Br 2235294757 UWTBFNZUHAXWAS-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE COc1cc(OC)c([C@H](Br)[C@H]2C[C@@H]2Br)cc1Br 2252870739 POXXVJRTSXOOMH-DCUMQYTISA-N 428.946 4.686 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CCO[C@H](C)C2)cc1I 2257365331 QNBRUDDEYHKCLH-UDZFHETQSA-N 425.104 4.551 50 10 IJGE CS(=O)(=O)C1CC([C@H](Br)c2cc(Cl)c(Br)cc2F)C1 2269790936 XXXNLJYUQDBXGD-FOEZSWGGSA-N 434.552 4.501 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@H](Br)C2(CC2)C1 2285959183 SQQQJZWCRFGLMC-LBPRGKRZSA-N 425.523 4.631 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)c(I)c2)[C@@H]1CBr 2300240118 IIFMWZOPXGXZNS-GFCCVEGCSA-N 428.539 4.550 50 10 IJGE C[C@]1(NCc2ccc(I)c(Br)c2)CCC[C@@H]1Cl 2306226707 HLCWOYUXGPRUMY-STQMWFEESA-N 428.539 4.693 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(C)C[C@H]2CC[C@H]1C[C@@]21CC[C@](C)(CI)O1 2307494023 AJJVEBQKRHMUPP-MFVLPEOLSA-N 449.373 4.833 50 10 IJGE COc1cc(F)c(CO[C@](C)(CBr)CNC(=O)OC(C)(C)C)c(Cl)c1 2317100872 DEQMXCMZKLRNLQ-QGZVFWFLSA-N 440.737 4.683 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cc(F)c(Cl)cc1F 2320356947 UIECDTKHVNUWFI-CYBMUJFWSA-N 432.692 4.718 50 10 IJGE C[C@H]1CCc2[nH]c3ccc(C(=O)NN=Cc4ccc(O)c(Br)c4)cc3c2C1 2323166666 MULCBXDFOJQCOS-LBPRGKRZSA-N 426.314 4.525 50 10 IJGE CC(C)COc1ccccc1C=NNC(=O)c1ccc2nc(Cc3ccccc3)[nH]c2c1 2323721461 XADZCRHQJWJJLP-UHFFFAOYSA-N 426.520 4.952 50 10 IJGE CCOc1c(Br)cc(C=NNC(=O)Nc2ccc(Cl)cc2)cc1OC 2323872457 AMYWHRQGOINGLN-UHFFFAOYSA-N 426.698 4.665 50 10 IJGE Cn1nc(Br)c([C@H](Br)CCc2cc(Cl)cc(Cl)c2)n1 2341190743 SPSBWRWPQWTMLT-SNVBAGLBSA-N 427.955 4.953 50 10 IJGE CCC[C@H](CBr)CN1C[C@H]2CC(F)(F)CC[C@@]2(NC(=O)OC(C)(C)C)C1 2344075177 CZZAEILPEZCQDD-IIDMSEBBSA-N 439.385 4.812 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@H](CN(C[C@@H](CBr)c3ccccc3)C1)C2 2358295460 UXQKOFLOTUNIDG-KPLVRAHFSA-N 437.422 4.934 50 10 IJGE CCOc1cccc(N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c1CBr 2367565085 IWXUEVJRWPNPPZ-VQTJNVASSA-N 429.402 4.939 50 10 IJGE Fc1cc(CNCC(F)(F)C(F)(F)CI)c(Cl)cc1Cl 2377409390 KSXGLLQMDFHTPN-UHFFFAOYSA-N 448.000 4.928 50 10 IJGE N#CC1=C2N=C(N)c3ccccc3N2C2=C(C(=O)CCC2)[C@@H]1c1ccc(Br)cc1 2500592 WECJIWRTRNOUGI-HXUWFJFHSA-N 445.320 4.514 50 10 IJGE CCOc1cc(/C=C2/C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)ccc1OCCC(C)C 38606950 GHQXKXYEANEMOM-FYJGNVAPSA-N 448.519 4.896 50 10 IJGE CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccc(OC)cc3)ccc21 38650433 UPCFKGHETSUEBI-XMMPIXPASA-N 442.471 4.531 50 10 IJGE COc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccc(Cl)cc1 38651287 BWALUABXMCYCFR-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE C=CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(C)cc4)ccc32)cc1 38657988 OTUGFROPIIFLNK-VWLOTQADSA-N 438.483 4.997 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4[N+](=O)[O-])ccc32)cc1 38677108 QNMAXFPLIRQMPA-QHCPKHFHSA-N 441.443 4.595 50 10 IJGE CCOc1ccc(OCC(=O)N/N=C/c2ccc(OCc3ccccc3Cl)cc2)cc1 40910658 YBTLJKXMULNUTD-CVKSISIWSA-N 438.911 4.847 50 10 IJGE O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)N/N=C/c1c(Cl)cccc1Cl 59507161 RNQKDSYNCJEDMX-FBCYGCLPSA-N 441.321 4.754 50 10 IJGE C[C@]1(Cn2c(CCCl)nc3cc(I)c(F)cc32)CCCS1 122559113 WYADROWQPHEVBI-OAHLLOKOSA-N 438.737 4.847 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C\c2ccc(OCC)cc2)c(OC)c1 207114487 LYPLVHWODADJOM-JPOGNWIISA-N 448.519 4.536 50 10 IJGE O=C(NN=Cc1c(O)c([N+](=O)[O-])cc2oc3c(c12)CCCC3)c1cccc2ccccc12 252600197 DOLIEJKLLOBPCK-UHFFFAOYSA-N 429.432 4.843 50 10 IJGE CC(=NNC(=O)/C(=C\C(C)=C/c1ccccc1)NC(=O)c1ccccc1)c1ccc(O)cc1 252622240 NRCONHIAHYHNKB-NQYFYOJOSA-N 439.515 4.650 50 10 IJGE CC(C)(CBr)CCCNS(=O)(=O)c1ccc(Cl)c(Br)c1 393387215 XUAIAEKBKVYABV-UHFFFAOYSA-N 447.620 4.582 50 10 IJGE C[C@H]1CN(C(=O)c2scc(Br)c2Br)CC[C@H]1Br 707799488 DYOIJNMASKCYPW-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CC[C@@H](C)C1)C(=O)OC(C)(C)C 721535858 NPTTWALUUPWSIT-CPUCHLNUSA-N 425.351 4.642 50 10 IJGE CCN(C(=O)/C(C#N)=C/c1cc(C)n([C@H](C)COC)c1C)[C@@H](C)Cc1ccc(OC)cc1 731335430 OEGFATXGPYWJGV-SPGMVNHYSA-N 437.584 4.708 50 10 IJGE Cc1c(Cl)cccc1NNC(=O)CCSCc1nc(O)c2c3c(sc2n1)CCC3 748532482 YXSXENJBYPBTSV-UHFFFAOYSA-N 449.001 4.614 50 10 IJGE C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F 792383463 CJKCWSYAPCDITB-NUPCCRGMSA-N 448.816 4.644 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)Nc2ccccc2Cc2ccccc2)cc1 822629350 FQVLLBMHSZBYDF-URPBSQGJSA-N 440.499 4.763 50 10 IJGE Cc1cccc(NNC(=O)CCSCc2nc(O)c3c4c(sc3n2)CCC4)c1Cl 1179800994 JBSHAYWMZAZUNS-UHFFFAOYSA-N 449.001 4.614 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cc(C)ccc2Oc2ccccc2)cc1 1310400101 MJCTYZMCAWWSAH-SFHVURJKSA-N 447.491 4.610 50 10 IJGE Cc1ccccc1COc1cccc(CC(=O)NNc2nc3ccccc3[nH]c2=S)c1 1585173248 ACIPUCOVWGWFIY-UHFFFAOYSA-N 430.533 4.866 50 10 IJGE C#CCOc1cc(F)ccc1NC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2 1667563438 XUDLBOAUKOWXCH-OAHLLOKOSA-N 443.544 4.517 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccccc2F)cc1 1865708773 FTPDHHCQRJXMOU-SFHVURJKSA-N 442.416 4.870 50 10 IJGE CCCCOCCOCCOCCN(Cc1ccccc1)[C@@H](CBr)C(C)C 1915266565 ATPPMMZRSVKGOO-QFIPXVFZSA-N 444.454 4.758 50 10 IJGE F[C@@]1(CBr)CCN(Cc2c(Br)cccc2Br)C1 1917118797 XXCWJHBLTJLTNG-GFCCVEGCSA-N 429.953 4.521 50 10 IJGE BrC[C@@H]1CN(Cc2cccc(Br)c2Br)CCS1 1943880460 FPEKYVCDPVEFFQ-SNVBAGLBSA-N 444.030 4.524 50 10 IJGE CC[C@H]1CN(Cc2c(Br)cccc2Br)C[C@H]1Br 1945324146 WFOBAURDAXMIKZ-TVQRCGJNSA-N 425.990 4.817 50 10 IJGE I[C@H]1CCCCCC[C@H]1OCCOCCOCc1ccccc1 1983389621 HBHBYWJSBNWFRC-RBUKOAKNSA-N 432.342 4.763 50 10 IJGE Cc1sc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)CC1CCC1 2009639354 AHPRYMRYKGLQFS-UHFFFAOYSA-N 428.417 4.942 50 10 IJGE CC(C)N(Cc1ccccc1)S(=O)(=O)c1cc(F)c(Cl)c(CBr)c1 2009658281 METSHXWPKFBLSW-UHFFFAOYSA-N 434.758 4.973 50 10 IJGE O=S(=O)(CCC(F)(F)CBr)N(Cc1ccccc1)Cc1cccs1 2009709109 OUDGOKAVXXTBMI-UHFFFAOYSA-N 438.359 4.500 50 10 IJGE CN(CC1(CBr)CCCCC1)[C@H](CNC(=O)OC(C)(C)C)C(F)(F)F 2044696814 OUQRJUDOXIHVFZ-CYBMUJFWSA-N 431.337 4.719 50 10 IJGE C[C@@H]1CCC[C@H](CNC(=O)OC(C)(C)C)N1C[C@@H](CBr)c1ccccc1 2106782412 QGGFAAGNVPNUHS-BHIYHBOVSA-N 425.411 4.933 50 10 IJGE CCC[C@H](CBr)CN1CCOc2ccc(CNC(=O)OC(C)(C)C)cc21 2106785262 OBMDPUPSZSCIOJ-MRXNPFEDSA-N 427.383 4.721 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H]1CN(CC3(CBr)CCCC3)C[C@H]21 2106786962 WPVIEJYMYSKPIB-BDXSIMOUSA-N 427.427 4.519 50 10 IJGE CC[C@@H]1CN(C[C@@H](CBr)c2ccccc2)CC[C@H]1NC(=O)OC(C)(C)C 2106789511 YYOBWZFDBJYRKL-BHIYHBOVSA-N 425.411 4.790 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCC([C@@H](F)CCl)CC1 2106949467 CJDSIUYEUHLKJQ-VIFPVBQESA-N 433.568 4.702 50 10 IJGE CC(C)(C)OC(=O)N1CCCc2ccc(NC(=O)N3CCC(Br)CC3)cc21 2162495333 SPUBCVKMJFKLTL-UHFFFAOYSA-N 438.366 4.766 50 10 IJGE O=C(c1ccccc1OCc1ccccc1)N1C[C@@]2(CBr)CCC[C@]2(F)C1 2176638591 BUMZYLLFDSGLJQ-VXKWHMMOSA-N 432.333 4.995 50 10 IJGE CC(C)CN(C[C@H](C)Br)S(=O)(=O)c1ccc(Cl)c(Br)c1 2288061549 SHLGVQMGBDIXRO-JTQLQIEISA-N 447.620 4.533 50 10 IJGE Clc1ccc(CN[C@H](CBr)C2CCC2)cc1I 2300240824 QVJRTDXCJVNDEY-CYBMUJFWSA-N 428.539 4.598 50 10 IJGE CC[C@@H](NC(=O)C(C#N)=CN[C@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 2318467220 CCDOGXUQFZICQM-HOYKHHGWSA-N 447.579 4.908 50 10 IJGE O=C(Cc1cccc(Cl)c1F)N[C@H](CCBr)COCc1ccccc1 2320360836 NXJUHTLLXGCPRW-MRXNPFEDSA-N 428.729 4.508 50 10 IJGE ClC[C@H]1[C@@H]2CC[C@@H](C2)N1Cc1ccc(I)c(Br)c1 2325210270 WURHHUBKHQKXMV-SUNKGSAMSA-N 440.550 4.645 50 10 IJGE COc1ccccc1-c1csc(C(C#N)=C(O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)n1 2331281975 OBEFMMCBGRRWSA-QGZVFWFLSA-N 431.517 4.660 50 10 IJGE COc1ccc([C@H](Br)C2(C(C)(C)OC)CC2)cc1I 2343666883 JYLRVQGLWJXFBY-ZDUSSCGKSA-N 439.131 4.941 50 10 IJGE COc1ccnc(N(C)[C@H]2C[C@@H]3C[C@@H](OCc4ccccc4)C[C@H]23)c1CBr 2359230451 SCIZSCMHJYXPHP-DMUMMCEESA-N 431.374 4.805 50 10 IJGE CCC(C)(C)c1ccc(OCC(=O)NNC(=O)c2ccc(OCc3ccccc3)cc2)cc1 8905765 XSTDXUWGFDXQIS-UHFFFAOYSA-N 446.547 4.793 50 10 IJGE O=C(CCCOc1ccc(Cl)cc1Cl)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 12577683 XKFUUWAYKOEKIE-UFFVCSGVSA-N 430.675 4.864 50 10 IJGE Cc1cccnc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(Cl)cc1)CCC2 40811601 KGLMHJDGNIAJEI-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE O=C(NN(Cc1ccccc1)Cc1ccccc1)c1ccccc1I 58135434 HFHVAJJNQIZJQO-UHFFFAOYSA-N 442.300 4.638 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C\Nc3cc4c(cc3C(C)=O)OCO4)n2)cc1OC 102420745 WEVMWUCXGLXFNN-GDNBJRDFSA-N 449.488 4.735 50 10 IJGE O=C1COc2ccc([C@@H](Cl)c3cc(Br)ccc3Br)cc2N1 161071546 ICTMADVLTHUAPS-OAHLLOKOSA-N 431.511 4.871 50 10 IJGE CCNC(=O)c1c(NC(=O)/C(C#N)=C/c2c(C)[nH]c3ccccc23)sc2c1CCCC2 208363611 VALQNKFGXSVOBO-NTCAYCPXSA-N 432.549 4.712 50 10 IJGE CCOC(=O)c1ccc(N/C=C(/C#N)C(=O)N[C@H](CC)c2ccc3c(c2)CCCC3)cc1 217188423 RYXYSYOVCWKATR-IAAPFODBSA-N 431.536 4.829 50 10 IJGE Cc1nn(C)c(Oc2ccc(Br)cc2Br)c1CBr 218322380 GORQEKUTWPJRGW-UHFFFAOYSA-N 438.945 4.941 50 10 IJGE C[C@H]1C[C@@H](C)C[C@H](O[C@](C)(CI)CNC(=O)OC(C)(C)C)C1 299983890 YCUQZFYPUPFWLH-XJIUQZFPSA-N 425.351 4.546 50 10 IJGE C[C@@H](Cl)C[C@@H]1CCCCN1C(=O)c1cc(Cl)ccc1I 312800221 ITSPXMFGTUGBIS-PWSUYJOCSA-N 426.125 4.957 50 10 IJGE C[C@@H](COC1(CI)CCN(C(=O)OC(C)(C)C)CC1)C1CCC1 398358596 MDXHVNCJOBKWMH-AWEZNQCLSA-N 437.362 4.644 50 10 IJGE C[C@H]1[C@@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1scc(Br)c1Br 686181243 MGSCPWFMYUXLMI-WPYKOPORSA-N 427.589 4.894 50 10 IJGE CC(C)(C)N(CCCBr)c1ncc(Br)cc1Br 691098594 PISYPABAYPMGBX-UHFFFAOYSA-N 428.994 4.997 50 10 IJGE CC[C@@H](Br)[C@H](C)NC(=O)c1scc(Br)c1Br 705439960 VIYCEHLOTFOBBE-NTSWFWBYSA-N 433.991 4.565 50 10 IJGE CN(C[C@H]1CCCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])c(CBr)c1 720017384 UUHYVZISJPVVMQ-GOSISDBHSA-N 432.362 4.838 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)OCc2nnc(C3CC3)n2C2CC2)c(C)n1-c1ccc(F)cc1 783107532 DFNMZOOFQRPPQD-UNOMPAQXSA-N 445.498 4.687 50 10 IJGE Cn1nccc1[C@@H]1CCCCN1S(=O)(=O)c1cccc(S(F)(F)(F)(F)F)c1 798473406 HYFIGJTZKGBHTH-HNNXBMFYSA-N 431.452 4.993 50 10 IJGE CCOc1cc(C=NNC(=O)c2cc3ccccc3o2)c(Br)c(Cl)c1O 1083961043 ZIWOLPJLXCYPGK-UHFFFAOYSA-N 437.677 4.717 50 10 IJGE COc1ccc(OCC(=O)NN=Cc2ccc(OCc3cccc4ccccc34)cc2)cc1 1084656037 UJFYKIIHOIPQJU-UHFFFAOYSA-N 440.499 4.957 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc3c(OC(F)(F)F)cccc3[nH]2)c(C(F)(F)F)c1 1327049599 SFHFVPZXQROJBE-UHFFFAOYSA-N 428.292 4.714 50 10 IJGE CC(=O)c1cc(C#N)ccc1NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccccc2F)c1C 1436276224 WMSWADUAKBNHMD-NDENLUEZSA-N 426.451 4.853 50 10 IJGE CC(=O)c1cc(C(=O)NNc2ccc(Br)cc2Cl)ccc1OC(C)C 1468629773 ULKWYOIADQQXJY-UHFFFAOYSA-N 425.710 4.849 50 10 IJGE N#CSc1ccc(NC(=O)Oc2ccc(CNC(=O)c3ccnc(Cl)c3)cc2)cc1 1858911843 YXWZQPXDXLTNEQ-UHFFFAOYSA-N 438.896 4.849 50 10 IJGE CCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@@H]2c1cc(Br)ccc1F 1865702176 OUYOPTNKFQRFKW-KRWDZBQOSA-N 439.288 4.690 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)CCC[C@@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1881164026 DEGRLXIRGIMRAB-ILXRZTDVSA-N 435.403 4.558 50 10 IJGE CN(C)CC(C)(C)CO[C@H](CI)c1ccc(Br)cc1 1899009823 IGYCVQXYBCSDFN-CQSZACIVSA-N 440.163 4.530 50 10 IJGE Cc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@H](CBr)C(C)C)c(F)c1 1915299972 KNFVQQGRLQBLDA-GOSISDBHSA-N 428.367 4.745 50 10 IJGE Cc1csc(C)c1S(=O)(=O)N(Cc1ccccc1)[C@H](CBr)C(C)C 1915307042 CXNOBDBTMJPKCX-QGZVFWFLSA-N 430.433 4.975 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cccc(C(F)(F)F)c1 1916346830 FMBCLGCFANMWDW-QGZVFWFLSA-N 430.264 4.758 50 10 IJGE CC[C@@H](C)[C@@H](Br)CNC(=O)c1csc(Br)c1Br 1945189002 GPFLUXXPYDCBDM-SVRRBLITSA-N 448.018 4.813 50 10 IJGE O=S(=O)(C1CC(OCc2ccccc2)C1)N(Cc1ccccc1)C1(CCl)CCC1 1958927874 GAGONQVLLIXXBK-UHFFFAOYSA-N 434.001 4.728 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@@H]1CCN(C(=O)OCc2ccccc2)C1 1999500155 DICABYZBXSONSH-LEWJYISDSA-N 431.374 4.508 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@@H]1Cc1c(Br)cccc1Br 2007135897 FADNZKRCBZVRFN-JRKPZEMJSA-N 426.974 4.943 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@H]1Cc1c(Br)cccc1Br 2007135898 FADNZKRCBZVRFN-MWODSPESSA-N 426.974 4.943 50 10 IJGE O=C(N[C@H]1CCC[C@@H]1CBr)c1c(Br)cccc1Br 2033096904 ZRADXYIKRYGNJS-KCJUWKMLSA-N 439.973 4.505 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CCS[C@@H](CCBr)C1 2052452687 AWHCTFQPZZXDLA-ZETCQYMHSA-N 433.618 4.507 50 10 IJGE Brc1cccc(Br)c1CN1CC[C@H](Br)[C@@H]2CC[C@H]21 2069996690 OIXIQOWSAGMFCH-QCZZGDTMSA-N 438.001 4.959 50 10 IJGE Cc1nccc(Cl)c1-n1nc(CBr)c(Br)c1C(F)(F)F 2078913049 FNOYLBYCMWIPEI-UHFFFAOYSA-N 433.453 4.905 50 10 IJGE CCc1nn(CC2(CBr)CCCCC2)c(CC)c1I 2093909755 PUGIHRHNKXTTBH-UHFFFAOYSA-N 439.179 4.958 50 10 IJGE COc1ccc([C@@H](Br)c2nn(C)c(Cl)c2Br)c(Cl)c1 2110721376 HPWDABZDITZMBI-SECBINFHSA-N 428.939 4.982 50 10 IJGE COc1ccc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)[C@@H](C)C(C)C 2123270851 ORLNXALLKNBUBC-INIZCTEOSA-N 440.403 4.826 50 10 IJGE CC1(C)CCC[C@]1(CCl)NC(=O)c1cc(Cl)ccc1I 2150543770 VAYKBECEFCKGQL-OAHLLOKOSA-N 426.125 4.862 50 10 IJGE C[C@H](CC(C)(C)C)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2179776452 UJORGXCGNSAANJ-SECBINFHSA-N 447.258 4.851 50 10 IJGE Fc1c(CN2CC[C@@H](OCCCBr)C2)ccc(Cl)c1Br 2207038445 NMHWSBBQFCVOSJ-LLVKDONJSA-N 429.555 4.618 50 10 IJGE O=S(=O)(Nc1ccc(Cl)cc1CBr)c1cscc1Br 2230990373 ZDVYZCHWXUFBJK-UHFFFAOYSA-N 445.585 4.860 50 10 IJGE CC1(C)CN(C(=O)c2ccc(I)c(Cl)c2)C[C@@H]1CCCl 2238467287 CYHNBALCQPXWCO-NSHDSACASA-N 426.125 4.672 50 10 IJGE O=S(=O)(Nc1ccc(Cl)cc1CBr)c1ccc(Br)cc1 2239460655 XTGYVXJIBSAJTD-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE CCn1nc(C)c(CBr)c1N(C)[C@@H]1C[C@@H]2C[C@H](OCc3ccccc3)C[C@H]21 2281304017 QNLLDGHPQMKYTK-CTAFRAEOSA-N 432.406 4.926 50 10 IJGE O=C(NC[C@H]1CCCC[C@H]1Br)c1cc(F)c(Br)cc1Cl 2282972772 UDXVYGTVVJPIGZ-PSASIEDQSA-N 427.539 4.925 50 10 IJGE CN(C(=O)c1ccc(Cl)c(I)c1)[C@H](CCCl)C(F)(F)F 2283661128 FMWYVAWNMPADKV-SNVBAGLBSA-N 440.030 4.576 50 10 IJGE C=CC[C@H](Br)[C@@H]1CCN1Cc1ccc(Cl)c(I)c1 2315549152 ORTOIOCMXGTPGR-FZMZJTMJSA-N 440.550 4.859 50 10 IJGE CC(C)(CI)COc1c(Br)cc(Cl)cc1[N+](=O)[O-] 2326710957 YXGPVVOERJJRCO-UHFFFAOYSA-N 448.482 4.851 50 10 IJGE COc1ccc(Cl)cc1N1C[C@H](C(O)=C(C#N)c2nc(C(C)(C)C)cs2)CC1=O 2331307227 TVCVEALVPCFDEN-GFCCVEGCSA-N 431.945 4.948 50 10 IJGE CC(C)(C)OC(=O)N[C@@]12CCCC[C@@H]1CN(C[C@H](CBr)c1ccccc1)C2 2355122094 OOQLNCGOWPUPJG-NNMXDRDESA-N 437.422 4.934 50 10 IJGE O=C(NCC[C@H]1CCCC[C@H]1Cl)c1ccc(Cl)cc1I 2365592376 PLPQHYLMEUHHPP-ZWNOBZJWSA-N 426.125 4.862 50 10 IJGE CCCCCCOc1ccc(Br)cc1C(=O)NNC(=O)C1CCCCC1 14648324 BNHKZHLIDAYVCE-UHFFFAOYSA-N 425.367 4.750 50 10 IJGE O=C(N/N=C\c1ccc(Oc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1)c1cccnc1 33625201 CJCWCACDSNGFPK-GATIEOLUSA-N 430.342 4.565 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(C)cc2)cc1 38649174 ZBXVJDBUWBPWBF-RUZDIDTESA-N 426.472 4.506 50 10 IJGE CCCCCOc1ccc(/C=N\NC(=O)CSc2nc3ccccc3[nH]2)cc1OCC 50954593 VVQSRHXOSHYUCD-IWIPYMOSSA-N 440.569 4.773 50 10 IJGE Fc1cc2c(cc1I)nc(CCCl)n2CCc1cccs1 97408422 VIYPWRSIRILAPF-UHFFFAOYSA-N 434.705 4.866 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)CCCOc2ccc(Cl)cc2)c(OC)c1 98026983 RTSJBLAYKBWEMT-LGMDPLHJSA-N 443.883 4.583 50 10 IJGE CCOC(=O)c1ccc(CN/C=C(/C#N)C(=O)N[C@@H](CC)c2ccc3c(c2)CCCC3)cc1 217193031 BFJXXEBYJRUMKG-IEUUHXEXSA-N 445.563 4.507 50 10 IJGE O=C(CBr)c1cc(OC(F)F)c(OC(F)(F)F)cc1Br 575686440 OCNIBCJNEGVSPS-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE Cc1ccc(F)c(NNC(=O)C(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)c1 784883774 GHXCMMMWANVYHL-UHFFFAOYSA-N 435.830 4.524 50 10 IJGE Cc1ccnc(Oc2ccc(NC(=O)NNc3ccc(C#N)cc3C(F)(F)F)cc2)n1 799403709 DKDKAUNKFSHSSA-UHFFFAOYSA-N 428.374 4.616 50 10 IJGE CCOc1ccccc1OCC(=O)NN=Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 918707859 FXQNYCVKNGIYOZ-UHFFFAOYSA-N 449.454 4.757 50 10 IJGE C=CCOc1ccc(Br)cc1C=NNC(=O)[C@H](C)Oc1cccc(Cl)c1 1084502757 RTNXWARWDNAZDP-ZDUSSCGKSA-N 437.721 4.585 50 10 IJGE Cc1ccc(C)c(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCN(c4ccccc4)CC3)c2C)c1 1084548771 DALCDBPHMJAUKY-XIEYBQDHSA-N 438.575 4.967 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)Cc3cccc4ccccc34)cc2)cc1 1124690714 DTGRZPRWBWRWAA-UHFFFAOYSA-N 438.483 4.838 50 10 IJGE C=CCC[C@@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(=O)OCC 1158280878 LXFBMNOYUZJFHM-PGPKDTDWSA-N 439.943 4.669 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C)c1ccccc1OC(F)F 1290210156 BVRKXIIHFLCKDE-SQFISAMPSA-N 439.462 4.560 50 10 IJGE CC(=O)N(C)c1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Cl)cc3)c2C)cn1 1436914094 WNTRDPLLUWVYOP-XDHOZWIPSA-N 447.926 4.671 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1 1622854500 HFIOSRWFGMFFGE-QGZVFWFLSA-N 425.529 4.756 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C)c1ccc(C(F)(F)F)cc1 1624323821 OBRHYJRSDJLDFL-SQFISAMPSA-N 441.453 4.977 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@H]1c1cccs1 1865698425 SZJKLOANGCJVAA-CQSZACIVSA-N 436.846 4.883 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2)[C@@H]1c1ccc([N+](=O)[O-])cc1 1865713263 VCXQHOQQMYMOGD-OAQYLSRUSA-N 435.443 4.666 50 10 IJGE CC1(C)C[C@H](Br)CN(c2ncc(Br)cc2Br)C1 1923180432 ONDHSEOZIPVAAL-VIFPVBQESA-N 426.978 4.606 50 10 IJGE O=S(=O)(c1ccc(Br)c(CCl)c1)N(Cc1ccccc1)C1CCC1 1946853580 CNZMINDIHFJBKB-UHFFFAOYSA-N 428.779 4.931 50 10 IJGE CCN(C[C@@](C)(CI)O[C@H]1CCCC1(F)F)C(=O)OC(C)(C)C 1991616948 QFSCVHVGCIUVSM-SWLSCSKDSA-N 447.304 4.642 50 10 IJGE CC(C)[C@@H](Br)CN(C)Cc1cc(Cl)ccc1I 2002416885 BYNQQLDLTNULSJ-LBPRGKRZSA-N 430.555 4.796 50 10 IJGE Clc1ccc(I)c(CN2CCC3(CC(Br)C3)C2)c1 2053751025 KHOIIJHWPWUTKW-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE Brc1ccccc1[C@@H](CI)OCCOC1CCCC1 2087345320 XHMQSYUCDDDFDH-OAHLLOKOSA-N 439.131 4.901 50 10 IJGE Clc1cc2c(cc1[C@@H](Br)c1sncc1Br)OCCO2 2088926671 AIBUTZWIDBWMHD-LLVKDONJSA-N 425.529 4.815 50 10 IJGE CC(C)(C)[C@@]1(CBr)CCN(Cc2ccc(I)cc2)C1 2104636318 WFWGJWKCCBPQEK-MRXNPFEDSA-N 436.175 4.924 50 10 IJGE CCCC(CBr)(CCC)CN(C)C[C@H]1COCCN1C(=O)OC(C)(C)C 2106788370 OYZCQZYIPYMCRL-KRWDZBQOSA-N 435.447 4.536 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1C1CCN(C[C@@H](CBr)CC2CC2)CC1 2112868198 HATOYQYVFVOVFT-MJGOQNOKSA-N 429.443 4.909 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1c(Cl)cccc1Br 2113165988 VJUFOTUUCYPZGL-VIFPVBQESA-N 429.605 4.739 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1[C@H]2CC[C@@H]1C[C@H](CBr)C2 2128155084 RAFBUFSHBZNMJZ-AYMMMOKOSA-N 427.589 4.942 50 10 IJGE ClCc1ccc(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)c(Br)c1 2129057295 UTAIQQYQKWMFPW-SFTDATJTSA-N 435.793 4.668 50 10 IJGE COc1cc(Cl)c([C@@H](Br)C2(S(C)(=O)=O)CCC2)cc1Br 2202367889 SXNNYJLVYMUKLR-GFCCVEGCSA-N 446.588 4.514 50 10 IJGE COc1cc(F)c(Cl)cc1[C@H](Br)c1c(Br)nn(C)c1C 2207379680 RIPKRQDZWMQHIZ-LBPRGKRZSA-N 426.511 4.776 50 10 IJGE CCC(CC)(CBr)CNC(=O)c1ccc(C)c(I)c1 2224617909 AWJNJRXCNMQNJR-UHFFFAOYSA-N 438.147 4.531 50 10 IJGE ClCc1nc2cc(Br)c(Br)cc2n1CCc1ccns1 2234056049 GBBYFRQZYHVAAB-UHFFFAOYSA-N 435.572 4.999 50 10 IJGE CCCN(c1nc(OC)ccc1CBr)C1CCN(Cc2ccccc2)CC1 2239878820 SAUFUHXBBSIQCF-UHFFFAOYSA-N 432.406 4.866 50 10 IJGE C[C@]1(CBr)C=CCCN1Cc1ccc(I)c(Cl)c1 2253525444 DDIVGNODKJFXLM-CQSZACIVSA-N 440.550 4.860 50 10 IJGE O=C(N[C@H]1CCC[C@@H](CBr)C1)c1cc(F)c(Br)cc1Cl 2282983543 QQJUHJPHMPFBKK-BDAKNGLRSA-N 427.539 4.925 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H]2CC[C@H](Br)[C@H]1CC2 2285848823 ROMSHKFXCFWBQD-DXVIDONBSA-N 425.523 4.772 50 10 IJGE CC1(C)CC(CBr)(NC(=O)c2cc(Br)c(F)cc2Cl)C1 2285848833 RRVBXXFUFLRRML-UHFFFAOYSA-N 427.539 4.925 50 10 IJGE C[C@@H](Cl)COCc1cn(-c2c(Br)cc(Cl)cc2Br)nn1 2295829567 YICZQNINSBVHET-SSDOTTSWSA-N 443.954 4.590 50 10 IJGE COc1c(Br)cc(C)c([C@H](O)[C@H]2C[C@H](Br)C2)c1Br 2317420914 USCQJUSIQDQCSQ-DNSOKLHBSA-N 442.973 4.736 50 10 IJGE CC(C)N1C[C@H](Br)[C@H](Cc2ccc(Cl)cc2I)C1 2318531152 IHPJNTLHYFUKDT-YPMHNXCESA-N 442.566 4.591 50 10 IJGE COc1ccc(-c2ccc(C(=O)NN=C(C)c3cc(F)ccc3F)c(C)n2)cc1OC 2321281153 VEJRXNPYHXWJAG-UHFFFAOYSA-N 425.435 4.506 50 10 IJGE CCOc1c(Cl)cc(C=NNC(=O)Cc2cc(Cl)ccc2SC)cc1OC 2323686491 FUJIDXZASLYUMP-UHFFFAOYSA-N 427.353 4.815 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)C(C#N)=CNc1ccc(Cl)c([N+](=O)[O-])c1 2325072312 LEMHRMGQYRLQDS-CQSZACIVSA-N 428.876 4.652 50 10 IJGE C[C@H]1C[C@H](CCl)CN(Cc2ccc(I)c(Br)c2)C1 2325206298 DBWYRXUTPLEYAZ-CMPLNLGQSA-N 442.566 4.751 50 10 IJGE Cl[C@@H]1CCCC[C@@H]1CNCc1ccc(I)c(Br)c1 2325211330 HQPBKAIHZRJFMW-DGCLKSJQSA-N 442.566 4.941 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@]23CCC[C@]2(C1)CN(C(=O)OC(C)(C)C)C3 2353822700 QRTGUCLWVFJISJ-QMMLZNLJSA-N 429.443 4.767 50 10 IJGE CC[C@H](Oc1ccccc1[C@@H](C)CC)C(=O)NNC(=O)COc1ccc(Cl)cc1C 10683235 XBHDUGVJSSMAKI-KXBFYZLASA-N 432.948 4.546 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(C(=O)N/N=C/c3ccc(Cl)c([N+](=O)[O-])c3)cc2)c1 12577388 ROLYMPNJTIHQBE-ZMOGYAJESA-N 436.855 4.573 50 10 IJGE COc1cc(/C=N/NC(=O)COc2cccc(C(C)C)c2)ccc1OCCc1ccccc1 40888756 DNZJHSVNMRBRRU-MTDXEUNCSA-N 446.547 4.969 50 10 IJGE CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=C/c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1 53287899 GWTUTWHLNGLOQB-GIJQJNRQSA-N 436.431 4.791 50 10 IJGE CC(=O)c1cccc(NC(=O)/C(C#N)=C\c2c[nH]nc2-c2ccc(Br)cc2)c1 98063481 FGPPIVNCVXEWRD-SXGWCWSVSA-N 435.281 4.587 50 10 IJGE CCCCCCCOc1ccc(C(=O)NNC(=O)COc2ccc(Cl)c(C)c2)cc1 100153540 YORRISUWQREVGZ-UHFFFAOYSA-N 432.948 4.838 50 10 IJGE C[C@@H](C[C@@H](C)Br)NC(=O)c1cc(Br)sc1Br 235188068 ZQHXDBBIEOENCO-RITPCOANSA-N 433.991 4.565 50 10 IJGE CCn1cc(C=NNC(=O)c2cc(-c3ccc(OC(C)C)cc3)nc3ccccc23)cn1 252628487 SRIZQDYEJIGLPY-UHFFFAOYSA-N 427.508 4.669 50 10 IJGE CCCCCCCCCCCCCC(=O)NCC(=O)NN=Cc1cc(OC)ccc1OC 254302006 QGHGSWDNDHSYDX-UHFFFAOYSA-N 447.620 4.971 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1[C@@H]1CCCN(Cc2ccccc2)C1 387053114 WHAUFEBXYVZHMK-QGZVFWFLSA-N 433.781 4.812 50 10 IJGE CC1(C)CC[C@@H](CBr)N(c2ncc(Br)cc2Br)C1 706196396 QIBUMSGJBKXDFI-JTQLQIEISA-N 441.005 4.997 50 10 IJGE C[C@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1ccc(Oc2ccccc2)cc1 726268640 GGIXSSRPNZEUSH-KRWDZBQOSA-N 426.476 4.732 50 10 IJGE O=C(CSc1ncnc2scc(-c3ccccc3)c12)NNc1cccc(F)c1F 743720793 GEDKQPUPFIRTEV-UHFFFAOYSA-N 428.489 4.872 50 10 IJGE O=C(NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1csc(Br)c1 804209070 KNSXIHMVMLTUEM-UHFFFAOYSA-N 443.248 4.743 50 10 IJGE CC(=NNC(=O)CN(c1ccc(C(C)C)cc1)S(=O)(=O)c1ccccc1)C(C)(C)C 1084425050 ZDMCHFXZPJQUHH-UHFFFAOYSA-N 429.586 4.544 50 10 IJGE CC(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)cs1 1457468423 YYHPIBNZRRHPCP-UHFFFAOYSA-N 449.919 4.894 50 10 IJGE CCOC(=O)NN=C1CCCc2oc(C(=O)Nc3ccc(C)cc3Br)c(C)c21 1772751270 LKYGYIOIRPBRGU-UHFFFAOYSA-N 448.317 4.698 50 10 IJGE CCc1nn(Cc2ccc(C)cc2)c2c1[C@@H](c1cccc(Br)c1)C(C#N)=C(N)O2 1865684479 QRTRRXGANCLPNP-FQEVSTJZSA-N 449.352 4.783 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2-c1ccc(C)cc1 1865691527 UVZVFCRJGPSFDZ-QHCPKHFHSA-N 426.520 4.916 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2Cl)[C@H]1c1ccccn1 1865700453 UGJRLKSPSSKTAB-OAQYLSRUSA-N 439.906 4.865 50 10 IJGE Cc1ccc(S(=O)(=O)NC/C(O)=C(\C#N)c2nc(-c3cc(C)ccc3C)cs2)cc1 1872749913 NNFNWGZITAMEMN-VZCXRCSSSA-N 439.562 4.507 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)[C@H]3CC(=O)N(Cc4ccccc4)C3)n2)cc1F 1872752603 KROODCTUJGEUFS-XBYUIDQRSA-N 449.507 4.799 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1cc(Br)sn1 1884458200 GDFDBHIZHRXDMB-NSHDSACASA-N 432.181 4.722 50 10 IJGE CCCN(CC(C)(C)CI)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1904652122 XCEDLQMKRRRZSE-OAHLLOKOSA-N 438.394 4.559 50 10 IJGE C[C@@H](Br)[C@H]1CCN(Cc2cccc(Br)c2Br)C1 1943905259 FPWOBAFPUZLJKM-ZJUUUORDSA-N 425.990 4.817 50 10 IJGE CC(C)(C)[C@@H](Br)CNC(=O)c1csc(Br)c1Br 1945188963 FSJUTUICKYZOHX-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE Cc1nn(C)c(Br)c1[C@H](Br)c1sccc1Br 1986901644 RFLWPRDIAKBWSF-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE FC1(F)C[C@@]1(Br)COc1ccc(Br)cc1CBr 2023779315 SDUFIADBBFKEDY-SNVBAGLBSA-N 434.900 4.896 50 10 IJGE CC(C)(CBr)[C@H]1CCCN1c1ncc(Br)cc1Br 2038314029 DLJOZRQVRWJAHB-LLVKDONJSA-N 441.005 4.997 50 10 IJGE CC1(C)C[C@H](CBr)CN1Cc1cc(Cl)ccc1I 2064388804 LHDMPOFGGGKTGL-SNVBAGLBSA-N 442.566 4.940 50 10 IJGE C[C@@H]1CC[C@H](CBr)N(Cc2ccc(I)c(Cl)c2)C1 2086651389 HMLLESSCWWOZEI-ZYHUDNBSSA-N 442.566 4.940 50 10 IJGE O=S1(=O)CCC[C@H]([C@@H](Br)c2cc(C3CC3)c(Br)s2)C1 2094669681 STHYTFJVENCBDG-JOYOIKCWSA-N 428.211 4.649 50 10 IJGE CS(=O)(=O)C1([C@H](Br)c2cc(Cl)c(Br)cc2F)CCC1 2110396496 GXTSYAMREGNWDZ-LLVKDONJSA-N 434.552 4.645 50 10 IJGE Brc1ccccc1[C@@H](CI)O[C@H]1C[C@H](n2cccn2)C1 2183664778 KRLRHOHQAXNBBU-LALPHHSUSA-N 447.114 4.542 50 10 IJGE Cc1sc(Br)c(C(=O)N2CC[C@H](C(F)(F)CBr)C2)c1C 2197752569 IOOIPOXFFSOLHD-VIFPVBQESA-N 431.140 4.620 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CC[C@H](C(F)(F)CCl)C1 2197766913 VPMVPPMEPOIXRX-VIFPVBQESA-N 431.502 4.548 50 10 IJGE C[C@H](CCCl)N(Cc1ccccc1)S(=O)(=O)Cc1ccsc1Br 2210633079 REERTXZUPVYLFB-CYBMUJFWSA-N 436.824 4.860 50 10 IJGE Br[C@@H]1CCC2(CCN(C[C@H]3CC3(Br)Br)CC2)C1 2250562858 MFYUNMRXWMDYHR-GHMZBOCLSA-N 430.022 4.522 50 10 IJGE Cc1c(CBr)cccc1NC(=O)c1sccc1I 2256320345 CQPDDDQBJXVZDB-UHFFFAOYSA-N 436.112 4.808 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CCC[C@H](C)O2)cc1I 2257355482 PDYJQQOQCHFTSE-FZZIBODNSA-N 425.104 4.693 50 10 IJGE COc1ccc([C@H](Br)C[C@H]2OCC[C@@H]2C)cc1I 2257368793 JQFGWWIVUJZPRR-DRCTWCGVSA-N 425.104 4.551 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCCCBr)[C@@H](C(F)(F)F)C1 2263152067 PJDXXPDPVQOWAE-CQSZACIVSA-N 431.337 4.815 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H](COC)C[C@H]1CNC(=O)OC(C)(C)C 2289589269 GMIGGMUGHGGDLS-MSOLQXFVSA-N 449.474 4.830 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)CCCOc2cccc(C)c2)c(OCC)c1 2293190744 ROWLQJXTMDOIAX-UHFFFAOYSA-N 437.492 4.628 50 10 IJGE COC(=O)c1cccc(Cn2cc(C=C(C#N)C(=O)NC3CCCCC3)c3ccccc32)c1 2313730200 DUIHFHQTEFNNSG-UHFFFAOYSA-N 441.531 4.832 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN(Cc2ccc(Cl)c(I)c2)C1 2315551479 RIYNGMFCEPXCMP-ZYHUDNBSSA-N 442.566 4.940 50 10 IJGE COc1ccc(C(C#N)=Cc2cccc(OC(=O)c3cccc(NC(C)=O)c3)c2)cc1OC 2320510761 BQUCYKCAQCQFGO-UHFFFAOYSA-N 442.471 4.946 50 10 IJGE COc1ccc([C@@H](C)NC=C(C#N)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)cc1OC 2325107946 JKBSTEFYNKKDKT-QZTJIDSGSA-N 433.552 4.518 50 10 IJGE CCOc1ccc(NC=C(C#N)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1OCC 2325215678 TVHDXDVHMVWSCN-UHFFFAOYSA-N 430.848 4.504 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@](C)(CBr)C(C)(C)C)C[C@@H]1C(F)F 2327116535 UTTCJVYBRFPHAJ-VEVIJQCQSA-N 427.374 4.524 50 10 IJGE Cc1sc([C@@H](Br)[C@]23CCC[C@H]2CS(=O)(=O)C3)c(Br)c1C 2358992467 YPNFBNACAKYXJP-GDLCADMTSA-N 442.238 4.778 50 10 IJGE COc1ccc(/C(C#N)=C\c2ccc(OC(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1OC 31901154 DPNMHPHFBSDSHL-UNOMPAQXSA-N 430.416 4.895 50 10 IJGE CC(C)c1ccc(NC(=O)/C(C#N)=C/c2ccccc2OCC(=O)Nc2nccs2)cc1 35519761 LOSFHFGCZQZQFV-CPNJWEJPSA-N 446.532 4.830 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2ccc(-c3ccc(C(C)=O)cc3)o2)cc1 58894773 VLKVNDWDJFUCQF-DGMIEQENSA-N 434.492 4.512 50 10 IJGE CCOc1ccc(/C=N/NC(=O)c2cc3cc(Br)ccc3o2)cc1OCC 59304327 CKRMGCIOBHKKAM-WSDLNYQXSA-N 431.286 4.757 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@H]1Br)c1ccc(Br)cc1Cl 123839052 FHNLBEXOWJRGEA-UKRRQHHQSA-N 429.539 4.893 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc(N)cc2)ccc1OCc1ccc(C(C)(C)C)cc1 169900208 BWMNXUBTHCAKJO-NTFVMDSBSA-N 431.536 4.918 50 10 IJGE CC(C)COc1c(Cl)cc(/C=N\NC(=O)c2ccc3nc(S)[nH]c3c2)cc1Cl 169917595 PCCPHOROXHQTQW-UYOCIXKTSA-N 437.352 4.957 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)CCCOc2ccc(C)cc2C)cc1 207144385 QOBZTQWOLWYODZ-XLNRJJMWSA-N 434.536 4.891 50 10 IJGE CC[C@H](C)N1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccccc3F)c(OC)c2)C1=O 214269425 MRWNDAGWSXQUNC-DEFALTHMSA-N 448.494 4.804 50 10 IJGE C[C@H](Br)C[C@H](C)NC(=O)c1cc(Br)sc1Br 235405062 ZQHXDBBIEOENCO-WDSKDSINSA-N 433.991 4.565 50 10 IJGE ClCc1nc2cccnc2n1-c1cc(Br)ccc1I 381633788 CDNDGWDZMVVNFF-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE COC1CCC(O[C@H](CI)c2ccc(Br)cc2)CC1 686232067 TUKVSNSCOMZPSX-YMAMQOFZSA-N 439.131 4.899 50 10 IJGE O=C(NNC(=O)c1cc(Cl)sc1Cl)c1ccc(Br)cc1Cl 728829087 WIQYGFCCSZUEJO-UHFFFAOYSA-N 428.522 4.546 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NNc1nc2ccccc2[nH]c1=S 1557584059 KAQGLGRNAOFVGC-UHFFFAOYSA-N 429.477 4.759 50 10 IJGE Cc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)Nc3ccc(Cl)cn3)c(C)c21 1772744484 YGFYMCRZJBKJLJ-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE N#C/C(=C(/O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2ccc(F)cc2F)cs1 1872818249 TYTLZLLMVSAGBG-VGLIXDPASA-N 437.471 4.930 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C[C@@H](CBr)NC(=O)OC(C)(C)C)cc1 1880768340 WQNBRTQWAXLGSH-HNNXBMFYSA-N 429.355 4.864 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)C(=O)c1cc(Br)ccc1Cl 1916355685 XONVEEMWIJQOJM-HNNXBMFYSA-N 431.157 4.999 50 10 IJGE CCN(C[C@](C)(CI)OCc1cccc(C)c1)C(=O)OC(C)(C)C 2024646647 HXMAQKHAZGZREY-IBGZPJMESA-N 447.357 4.962 50 10 IJGE CC(C)c1ccc(S(=O)(=O)c2ccc(NNC(=O)C=Cc3cccs3)cc2)cc1 2040437151 LAOIILGTOJOLGC-UHFFFAOYSA-N 426.563 4.861 50 10 IJGE CCN(C[C@H](Br)C(F)(F)F)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2044704731 GAJHDUBUSAMKBF-PIGZVRMJSA-N 429.321 4.565 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@@H](Cl)CC2(CCC2)C1 2095000375 RNBIMLGARGKWEH-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE Fc1cc(Br)c2nc(CCl)n([C@]34C[C@H]3CN(Cc3ccccc3)C4)c2c1 2099678029 FLXUPRSULGAOSP-XOBRGWDASA-N 434.740 4.908 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1CN(CC1CC1)C[C@@H](CBr)C1CCC1 2106785544 PKKZTIGBQNSNCK-MOPGFXCFSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCCC2)C[C@H](CBr)CC2CC2)C1 2112868283 IHNHLSQHNWRLNO-SFHVURJKSA-N 429.443 4.909 50 10 IJGE C[C@@]1(C(F)F)CN(c2c(CBr)ccc(Br)c2Cl)CCO1 2154373762 PQCRTZXIFXFWIC-ZDUSSCGKSA-N 433.518 4.858 50 10 IJGE CN(CC[C@H](O)c1ccc(Br)cc1Cl)C[C@H]1C[C@H](Br)C1 2196945377 SPADZOUKYRKVOP-WBIUFABUSA-N 425.592 4.631 50 10 IJGE Clc1cccc(CN2CCC(OCCCBr)CC2)c1Br 2207524786 PPKZDQUPUISRIT-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE Cc1ccc(C(=O)N(CCBr)c2ccccc2)cc1I 2232836540 INNSQCBFNGEARN-UHFFFAOYSA-N 444.110 4.641 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CCC(F)(F)[C@@H](CBr)C1 2264504974 UWWFWQVSYCLXLZ-LURJTMIESA-N 437.531 4.656 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N(CCBr)CC(F)(F)F 2282984586 XLJDIIDNKMJOGC-UHFFFAOYSA-N 441.444 4.641 50 10 IJGE C[C@]1(CCl)CCCN1Cc1ccc(I)c(Br)c1 2306218258 YAZBBWPYNDONSE-CYBMUJFWSA-N 428.539 4.647 50 10 IJGE C#CCOc1c(Cl)cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)cc1Br 2313567022 BFYANAFLKMJGJW-UHFFFAOYSA-N 429.701 4.969 50 10 IJGE COc1c(Br)cc(C)c([C@H](O)C2CC(Br)C2)c1Br 2317433890 USCQJUSIQDQCSQ-WZQIAMPNSA-N 442.973 4.736 50 10 IJGE CC(C)[C@@H]1C[C@H](Br)CN1Cc1ccc(Cl)cc1I 2321366864 ZNFBRLWPYLYYLL-FZMZJTMJSA-N 442.566 4.938 50 10 IJGE Cl[C@H]1C[C@H]2CC[C@H]1CN2Cc1ccc(I)c(Br)c1 2325212250 CYLPRZBVPCFMJK-LOWVWBTDSA-N 440.550 4.645 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@@H](Br)C12CCC2 2327403683 DGMJLYNWXJUKGJ-CYBMUJFWSA-N 440.550 4.837 50 10 IJGE CC(C)[C@H](Cl)C(C)(C)CNC(=O)c1ccc(I)c(Cl)c1 2365855418 LGBVQJVTMSNXOK-ZDUSSCGKSA-N 428.141 4.964 50 10 IJGE CCOc1cccc(N2C[C@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c1CBr 2367565086 IWXUEVJRWPNPPZ-WOJBJXKFSA-N 429.402 4.939 50 10 IJGE Fc1ccc(-n2c(CCCl)nc3cc(Br)cnc32)cc1Br 164247244 ZCMCYDHBNLKKMS-UHFFFAOYSA-N 433.506 4.866 50 10 IJGE CC[C@H](NC(=O)/C(C#N)=C\N1CCN(c2cccc(C)c2)CC1)c1ccc2c(c1)CCCC2 217192381 AMNIGJUDPRMYRK-ZKKRPBSMSA-N 442.607 4.671 50 10 IJGE C[C@H](Br)CN(C(=O)c1scc(Br)c1Br)C1CC1 705447724 LNRBLRDMAFFWKU-LURJTMIESA-N 446.002 4.661 50 10 IJGE Cc1csc(=O)n1CCOc1c(Br)cc(Cl)cc1CBr 708074528 CQWIHEAZRMMHFE-UHFFFAOYSA-N 441.572 4.608 50 10 IJGE CCC[C@@H](CCBr)NC(=O)c1cc(Br)sc1Br 716962606 RUJWNFVGFKFIBO-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE Cc1ccc(F)c(NNC(=O)c2cccc(NC(=O)c3cccc(Br)c3)c2)c1 760137322 HQYSGPMBPGFCQB-UHFFFAOYSA-N 442.288 4.906 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cccc(-c3nnco3)c2)c(C)n1-c1ccc(F)cc1 914573496 CTZJANOHKRYIGH-ODLFYWEKSA-N 427.439 4.829 50 10 IJGE C[C@H](Oc1ccc(OCc2ccccc2)cc1)C(=O)NN=Cc1cccc2cccnc12 1083986948 LESHKFCNVQMWEY-IBGZPJMESA-N 425.488 4.731 50 10 IJGE C=CCc1cc(/C=C(\C#N)C(=O)N(C)C)cc(Br)c1OCc1cccc(F)c1 1084479855 ATLHSLOAAPZUKP-VCHYOVAHSA-N 443.316 4.891 50 10 IJGE N#C/C(=C\c1ccccc1OCc1ccc(F)cc1)C(=O)N1CCN(c2ccccc2)CC1 1084545935 LZQFNMMBWZJABO-PTGBLXJZSA-N 441.506 4.660 50 10 IJGE C=CCNC(=S)NNC(=O)c1ccc(N[C@H](C)c2cc(Cl)ccc2Cl)c(C)c1 1538840888 BQHMCCVPVRFKHU-CYBMUJFWSA-N 437.396 4.770 50 10 IJGE Cc1cc(OCC(=O)NN=Cc2cccc(Cl)c2)c(Br)c(C)c1Cl 1772756527 MORXTUNFMNJOSO-UHFFFAOYSA-N 430.129 4.902 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc(-c3ccc4ccccc4c3)s2)cc([N+](=O)[O-])c1O 1860773542 ADFLZJRMAVNXQG-CFRMEGHHSA-N 447.472 4.955 50 10 IJGE CCc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865700546 WWOKWDRPHNIJPW-NRFANRHFSA-N 429.911 4.847 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2Cl)[C@H]1c1ccc[nH]1 1865709979 LPWHEXDMGSTYBW-HXUWFJFHSA-N 427.895 4.798 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)c1ccc(C(F)(F)F)cc1 1865755749 OEDKVYFLIYVHIC-UHFFFAOYSA-N 433.817 4.804 50 10 IJGE CC(C)CSc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1 1865757945 BTHZTIYZUUQVJV-CYBMUJFWSA-N 441.380 4.970 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC[C@@H]([C@H](CBr)NC(=O)OC(C)(C)C)C1 1880762270 UNFPNLMCTYVUDK-KFWWJZLASA-N 435.403 4.606 50 10 IJGE C[C@@H]([C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1)[C@H](CBr)NC(=O)OC(C)(C)C 1884025677 GLUDYOZOFOXJDC-VGWMRTNUSA-N 449.430 4.994 50 10 IJGE C[C@H](Br)C(C)(C)CNC(=O)c1scc(Br)c1Br 1913813326 GLJOKZGXJBBZDV-LURJTMIESA-N 448.018 4.813 50 10 IJGE CC[C@@H](C)[C@@H](Br)CNC(=O)c1scc(Br)c1Br 1942810442 MMWLZLROTVHZMH-RQJHMYQMSA-N 448.018 4.813 50 10 IJGE C[C@@H]1C[C@@H](Br)CN(Cc2c(Br)cccc2Br)C1 1945323838 UWFCMHQKWQWSOT-NXEZZACHSA-N 425.990 4.817 50 10 IJGE CC[C@@H](Cl)C(=O)Nc1cc(Br)c(Br)c(Br)c1 1976933357 OLLMLHRJUSDWAC-MRVPVSSYSA-N 434.353 4.930 50 10 IJGE Cc1cccc([C@@H](CI)OCCOCCOCc2ccccc2)c1 2007814356 OLLPUAARAZRSSU-HXUWFJFHSA-N 440.321 4.721 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1F 2008321463 IJTYRZWXBLNDEP-CYBMUJFWSA-N 434.758 4.844 50 10 IJGE CC[C@H](CCCBr)NC(=O)c1ccc(I)c(Cl)c1 2036513019 FECCUQCXEADPIY-SNVBAGLBSA-N 444.538 4.628 50 10 IJGE BrC[C@@]12CC[C@@H]1CN(Cc1cccc(Br)c1Br)C2 2078133626 OATOBIHOMWFZID-BXUZGUMPSA-N 438.001 4.819 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H](N(CC1(CBr)CCC1)C1CC1)C(F)(F)F 2106788950 UUFGEZBHBFXILB-CQSZACIVSA-N 443.348 4.862 50 10 IJGE CC(C)[C@H](CBr)CN1CCC[C@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2129043067 LKDPWCABKFYLOR-LSDHHAIUSA-N 429.403 4.603 50 10 IJGE CN(C(=O)OC(C)(C)C)C1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(CBr)cc1 2162871978 MOPXOSXLTHGLRA-JWTNVVGKSA-N 437.378 4.584 50 10 IJGE Cn1nc(CC(CCl)(CCl)c2cccc(Br)c2)cc1Br 2168208581 PRRDCQYJVUTJNQ-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@@H](CBr)CC(C)(F)F)cc1Cl 2169545717 ZQYPIEJKGXTJAW-MRVPVSSYSA-N 433.518 4.950 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@H]1CCCN(C[C@H](CBr)C(C)(C)C)C1 2185505346 ZLXNKCCOPZLIJS-GJZGRUSLSA-N 443.430 4.993 50 10 IJGE CC[C@H]1CCN(CCCCCI)[C@@H](CNC(=O)OC(C)(C)C)C1 2211188216 YYMMZOZSRWZETA-JKSUJKDBSA-N 438.394 4.607 50 10 IJGE COc1ccc([C@H](Br)C[C@@H]2CCCOCC2)cc1I 2269545034 LHNOESDXTWNGQN-DGCLKSJQSA-N 439.131 4.943 50 10 IJGE CC1CC(CBr)(CN2CC[C@](NC(=O)OC(C)(C)C)(c3ccccc3)C2)C1 2280055487 RKOIEWHORIEXIV-JHJOLFGTSA-N 437.422 4.924 50 10 IJGE CCOc1cccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3ccc([N+](=O)[O-])cc3)c2C)c1 2295086302 MPJUGKPXKBTFDV-UHFFFAOYSA-N 430.464 4.947 50 10 IJGE C=CCC[C@@H](CCl)NCc1ccc(I)c(Br)c1 2306216143 CFFKMMDOKHVCEI-NSHDSACASA-N 428.539 4.717 50 10 IJGE Clc1ccc(CN2[C@H](CBr)[C@H]3CC[C@@H]2C3)c(I)c1 2318523749 GWQQHBFQYLNNQP-MRCXROJRSA-N 440.550 4.692 50 10 IJGE CCCCCCCCCOc1ccc(C=NNC(=O)c2sc(=N)[nH]c2C)cc1OC 2323126798 BPYPMWSVWYROTM-UHFFFAOYSA-N 432.590 4.766 50 10 IJGE CC[C@@H](NC(=O)C(C#N)=CN1CCN(c2cccc(C)c2)CC1)c1ccc2c(c1)CCCC2 2325092623 AMNIGJUDPRMYRK-HHHXNRCGSA-N 442.607 4.671 50 10 IJGE CCN(C[C@]1(CBr)CC1(F)F)[C@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2351888375 WPFBGJDUADTSFN-RVKKMQEKSA-N 439.385 4.812 50 10 IJGE FC1(F)C[C@]12C[C@@H]2CO[C@@H](CI)c1ccccc1Br 2352505659 BOWCPUHVJBNJGG-ICCXJUOJSA-N 443.069 4.987 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)COc3ccccc3)ccc2[C@H]1c1ccccc1Cl 38650979 KCPMHKGAAFHOPR-HSZRJFAPSA-N 432.863 4.543 50 10 IJGE CCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)c1 38678222 TVHKJYLPRSJUSI-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccccc3F)c(OCC)c2)C1=O 214223583 KQMUDGQVOYRQRW-MOSHPQCFSA-N 448.494 4.806 50 10 IJGE O=C(c1sccc1I)N(CCBr)C1CCCCC1 310787831 ANKJLLSTSDTBRL-UHFFFAOYSA-N 442.160 4.523 50 10 IJGE CCc1ccc([C@H](Br)c2cc(I)cc3c2OCC3)o1 381822186 OANDVOBWKFCWDF-CQSZACIVSA-N 433.083 4.866 50 10 IJGE Cc1nn(C)c2c1nc(CCCl)n2CCCN(Cc1ccccc1)Cc1ccccc1 390516117 DVVNVBIPGBTLSW-UHFFFAOYSA-N 436.003 4.952 50 10 IJGE FC(F)c1cc(I)c(Br)cc1CBr 575684143 FXKIQRLGWDOFHN-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE CC(C)(CCBr)NC(=O)c1scc(Br)c1Br 705514603 SLBAJMDMMMTIGY-UHFFFAOYSA-N 433.991 4.567 50 10 IJGE Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)o1 742964853 KANJDFKZJXZFAC-VGOFRKELSA-N 446.551 4.558 50 10 IJGE N#Cc1ccc(NNC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)cc1C(F)(F)F 746891788 KCEHJZVERZINEG-UONOGXRCSA-N 429.320 4.722 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OCCCc2ccncc2)c(-c2ccc(Cl)cc2)n1 818022266 ASFKMXKYQXMGBI-HKWRFOASSA-N 445.910 4.595 50 10 IJGE C=CCc1ccc(OCC(=O)NN=Cc2ccccc2OCc2ccccc2)c(OC)c1 1084070754 XERVNCQTQFAKEH-UHFFFAOYSA-N 430.504 4.532 50 10 IJGE Cc1cc(C=NNC(=O)[C@H]2COc3ccccc3O2)c(C)n1-c1cc(Cl)ccc1Cl 1084279289 VHNNIQJXZOUVQI-OAQYLSRUSA-N 444.318 4.691 50 10 IJGE C=CCC[C@@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(=O)OCC 1158280881 LXFBMNOYUZJFHM-PZNLSKEWSA-N 439.943 4.669 50 10 IJGE Cc1cc(C)c(C(=O)NNc2nc(-c3ccccn3)nc(C)c2C)c(C)c1Br 1306590756 NFEDFCPUIKJNLC-UHFFFAOYSA-N 440.345 4.600 50 10 IJGE C=CCC[C@H](NC(=O)NNc1cc(C)nc(COCC)n1)c1ccc(C(F)(F)F)cc1 1469491894 RIWRXJHALCCTDZ-KRWDZBQOSA-N 437.466 4.674 50 10 IJGE C=CC[C@]1(C(=O)NNc2c(C)cccc2Br)CCCN1C(=O)OC(C)(C)C 1469852804 ZDQSPEGQAMMEGL-HXUWFJFHSA-N 438.366 4.546 50 10 IJGE C#CCCN(CCOC)C(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1533858990 JYKFJLYBYFUSAN-CPNJWEJPSA-N 444.362 4.806 50 10 IJGE COc1cccc(O[C@H](C)C(=O)NN=Cc2ccc(OCc3ccc(C)cc3)c(OC)c2)c1 1772756216 OTRQPGCLGVNXJV-LJQANCHMSA-N 448.519 4.509 50 10 IJGE N#CSc1ccc(NC(=O)Oc2ccc(CNC(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1 1858905725 HMVQDZTUVOYFFG-UHFFFAOYSA-N 448.460 4.709 50 10 IJGE CCCn1nc(CC)c2c1OC(N)=C(C#N)[C@H]2c1ccc(OCc2ccccc2C)cc1 1865703212 QEJWDNYOUCFBBS-HSZRJFAPSA-N 428.536 4.961 50 10 IJGE COc1ccc(C/C(O)=C(\C#N)c2nc(-c3ccc(OC)c(OC)c3)cs2)c(OC)c1 1872745351 JARGVVORIZORFP-ZPHPHTNESA-N 438.505 4.880 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCC2(CCC2)N(C(=O)OC(C)(C)C)C1 1882087390 JJLGRYLEHNPUCR-HUUCEWRRSA-N 447.414 4.844 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cccc2cccnc12 1915089485 ZNPXYDNCXWDLLB-SFHVURJKSA-N 433.371 4.599 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1Cc1cccc(Br)c1Br 1943880963 MFTQJWBARYDQTP-KOLCDFICSA-N 425.990 4.959 50 10 IJGE C[C@H]1C[C@H](CBr)CN1C(=O)c1cc(Br)sc1Br 1950506982 FGUAAPKYJRJPSM-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE Brc1cnc(N2CC[C@@H]3C[C@@H](Br)CC[C@@H]32)c(Br)c1 2027435466 OQEINYHFWQOWIS-PTRXPTGYSA-N 438.989 4.749 50 10 IJGE C[C@H](NC(=O)c1cccc(Br)c1Br)C(C)(C)CBr 2031482872 XUEGUZJLYDMSIT-QMMMGPOBSA-N 441.989 4.751 50 10 IJGE C[C@@H]1[C@@H]([C@@H](Br)c2cc(I)cc3c2OCC3)C1(F)F 2036071419 MXOHZRFKGVLELC-DADVEIPYSA-N 429.042 4.563 50 10 IJGE O=S1(=O)CCC([C@H](Br)c2cc(Cl)c(Br)cc2F)CC1 2089857374 LDOJIDDKDSRNRW-LBPRGKRZSA-N 434.552 4.502 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@@H]1CCC[C@]2(C1)CC2(F)F 2099946171 QGFUIUDQJTWKGI-AOIWGVFYSA-N 430.333 4.641 50 10 IJGE C[C@@H]1[C@H](C(F)(F)F)N(C[C@H](CBr)C(C)(C)C)CCN1C(=O)OC(C)(C)C 2115979581 JEFWMBDJVZTZFP-HZSPNIEDSA-N 445.364 4.916 50 10 IJGE COc1ccc(S(=O)(=O)N(Cc2ccccc2)C(C)(C)C)c(CCBr)c1 2123254068 ICORJNTYRGEVHI-UHFFFAOYSA-N 440.403 4.622 50 10 IJGE CCC[C@@]1(NC(=O)c2ccc(CBr)cc2)CCCN(C(=O)OC(C)(C)C)C1 2162592673 WRQATIFVPBZHBY-OAQYLSRUSA-N 439.394 4.881 50 10 IJGE CC(C)(C)[C@@H]1C[C@H](CCl)CN(C(=O)c2csc(I)c2)C1 2165006150 FYUFVDYBWOBAAH-ZYHUDNBSSA-N 425.763 4.716 50 10 IJGE CCC[C@H](CBr)CN1CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2254964926 RNBGRPSWKPEBFA-MCIONIFRSA-N 431.337 4.718 50 10 IJGE COc1ccc([C@H](Cl)c2cc(Br)n(C)n2)c(Br)c1Cl 2268265512 GUTQRKLWEWDSER-NSHDSACASA-N 428.939 4.935 50 10 IJGE O=C(c1ccc(Cl)c(I)c1)N(CCCl)C1CCCCC1 2283651952 NXZQQGCKRWNHAJ-UHFFFAOYSA-N 426.125 4.958 50 10 IJGE CC(C)CN(C[C@@H](C)Cl)C(=O)Cc1cc(Br)cc(Br)c1 2295315482 MFCWTDILXAFEPK-LLVKDONJSA-N 425.592 4.866 50 10 IJGE CC(C)(CI)CN1CCc2cccc(NC(=O)OC(C)(C)C)c2C1 2306818871 ONCHMNUVUVLFKN-UHFFFAOYSA-N 444.357 4.853 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)Nc2ccccc2F)cc(Br)c1OCC 2313631045 JIIZDBIIRHJOGT-UHFFFAOYSA-N 433.277 4.931 50 10 IJGE COc1cccc(C=NNC(=O)c2ccc3nc(-c4ccccc4Cl)[nH]c3c2)c1OC 2323743208 CULZOTQVGPHXCZ-UHFFFAOYSA-N 434.883 4.664 50 10 IJGE Cc1cc(NC=C(C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)ccc1Br 2325255416 CLHSFRFULSUJRG-UHFFFAOYSA-N 435.665 4.777 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2CC[C@@]2(CBr)C1 2327396085 ZLUBBQPNPHXYOF-BXUZGUMPSA-N 440.550 4.552 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H](Br)[C@H](C2CC2)C1 2327406986 XKWIXBAXPQPORB-STQMWFEESA-N 440.550 4.550 50 10 IJGE N[C@@H](Cc1ccccc1)C(=O)NN=Cc1ccc(OCc2ccc(Cl)cc2Cl)cc1 2328798651 DYDIWJUYFFUNNE-QFIPXVFZSA-N 442.346 4.593 50 10 IJGE Cc1cccc(CO[C@@H](CI)c2ccccc2Br)n1 2341907734 JBIFQFLEYHFZCO-HNNXBMFYSA-N 432.099 4.845 50 10 IJGE O=C(Nc1ccc(CBr)c(F)c1)c1ccc(I)cc1 2341936519 HTRXGNAJUJYAGN-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE C[C@@H]1CCCN(C[C@@]2(CBr)CC2(F)F)[C@H]1CCCNC(=O)OC(C)(C)C 2351886104 UATYCCRTQMMPJZ-VKJFTORMSA-N 439.385 4.812 50 10 IJGE CN(C)c1ccnc(N(C)[C@@H]2CN(Cc3ccccc3)C(C)(C)C2)c1CBr 2377474215 KDTVWPVXGIYXQD-SFHVURJKSA-N 431.422 4.532 50 10 IJGE CCOc1cccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C(=O)OC)c3)c2C)c1 1195453 SSUCHGGQSZDVPH-FYJGNVAPSA-N 443.503 4.825 50 10 IJGE O=C(NN=Cc1cn(Cc2ccc(Br)cc2)c2ccccc12)c1cccnc1 8445193 GGFSAHATZRDJSJ-UHFFFAOYSA-N 433.309 4.611 50 10 IJGE C/C(Nc1nc(-c2cc(C)n(Cc3ccccc3Cl)c2C)cs1)=C(/C#N)C(N)=O 8824738 JEGLZOWSFDTUEU-GHRIWEEISA-N 425.945 4.625 50 10 IJGE CC[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)COc1ccccc1C(C)C 14768304 DWAXYBWVBNEIMS-XMMPIXPASA-N 446.547 4.861 50 10 IJGE Cn1c(SCC(=O)NN=C(Cc2ccccc2)Cc2ccccc2)nc2ccccc21 20826832 HMMRDUXWOVLDAV-UHFFFAOYSA-N 428.561 4.623 50 10 IJGE COc1ccc2ccccc2c1/C=N/NC(=O)COc1c(C)cc(Br)cc1C 40888912 DGRZBIXYUYSATA-WYMPLXKRSA-N 441.325 4.757 50 10 IJGE COc1cc(/C=C\C(=O)c2ccc(O)c(CCCl)c2)c([N+](=O)[O-])cc1OC(F)F 98006561 WHLFZRYPXZUHDJ-RQOWECAXSA-N 427.787 4.588 50 10 IJGE COc1ccc(C(=O)[C@@H](Br)[C@@H](Br)c2ccc(OC)cc2)cc1 105418953 DTAHPGMKUAKDKW-HOTGVXAUSA-N 428.120 4.786 50 10 IJGE CC(C)c1ccccc1NC(=O)/C(C#N)=C\Nc1ccc(I)cc1 217122630 BIOVZZMFMDNCTJ-OWBHPGMISA-N 431.277 4.873 50 10 IJGE CC1(C)[C@@H](Br)CCN1C(=O)c1ccc(Br)cc1Br 311145963 ZNKSIJGPQPAILA-NSHDSACASA-N 439.973 4.600 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@@H](c2cc(F)ccc2Br)C1 382686479 FOELUJGETCSYIP-MFKMUULPSA-N 437.147 4.934 50 10 IJGE CCC[C@H](CCCl)NC(=O)c1cc(Br)ccc1I 716855485 NSFOCSLYVWSLQZ-SNVBAGLBSA-N 444.538 4.581 50 10 IJGE C[C@H](Br)CN(Cc1cc(Cl)ccc1I)C1CC1 821945288 QSXLLFCMXBOWGS-VIFPVBQESA-N 428.539 4.692 50 10 IJGE CC(=NNC(=O)c1ccc(CSc2nncn2C)cc1)[C@@H]1C[C@H]1c1ccccc1Cl 920360757 VARZKNCIHAHWSR-OALUTQOASA-N 439.972 4.670 50 10 IJGE COc1cc([N+](=O)[O-])ccc1-n1c(C)cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)c1C 1084083097 GWHWWEDEJGFVAQ-XDHOZWIPSA-N 430.464 4.865 50 10 IJGE Cc1ccc(-n2nc(C)c(C=NNC(=O)COc3ccc(C(C)(C)C)cc3)c2C)c(C)c1 1084104697 RLIIETDPSZBHPT-UHFFFAOYSA-N 432.568 4.933 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)/C(C#N)=C/c2cc(C)n(C3CCCCC3)c2C)c1 1154050663 TUFSTNUYUXPHPK-RCCKNPSSSA-N 445.592 4.516 50 10 IJGE C=CC[C@@H](C(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1)c1ccccc1 1558893044 VKPKAWGMDGMBLO-LJQANCHMSA-N 430.533 4.516 50 10 IJGE O=C(COc1ccccc1Br)NN=Cc1ccccc1OCc1ccccc1 1772754153 OZYNYFKICFPBPO-UHFFFAOYSA-N 439.309 4.557 50 10 IJGE C[C@H](Br)C(=O)N1CCC2(C=Cc3ccc(OCc4ccccc4)cc3O2)CC1 1859497979 RFHHKZAVKLYVTL-KRWDZBQOSA-N 442.353 4.816 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)c3ccc(Br)cc3)c(C)n2)cc1C 1865756293 QEUCPLBYTCRIIN-UHFFFAOYSA-N 438.325 4.511 50 10 IJGE CCOc1ccc(/C=N\NC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)cc1OCC 1865762011 INETVUYIMZCXMS-VYYCAZPPSA-N 439.462 4.897 50 10 IJGE Ic1cccc(CO[C@@H]2CCCC[C@@H]2I)c1 1902241699 UTIOICLQYZQIRS-QWHCGFSZSA-N 442.078 4.554 50 10 IJGE CC(C)[C@@H](Br)CN(C)C(=O)c1cc(Br)sc1Br 2002410410 JTNQWSZHAHPQPP-QMMMGPOBSA-N 448.018 4.765 50 10 IJGE Brc1cccc(CN2C[C@H]3C[C@@H](Br)C[C@H]2C3)c1Br 2031484949 FLBCNXROGHXEQD-MVWJERBFSA-N 438.001 4.959 50 10 IJGE C[C@@]12CN(Cc3ccc(Br)cc3Br)C[C@@]1(CBr)C2 2046797243 IIVVJVFMMMLZKH-KGLIPLIRSA-N 438.001 4.819 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCCN(c2ncc(Br)cc2CCl)C1 2096466949 ILHXOACTGGAARK-UHFFFAOYSA-N 444.751 4.931 50 10 IJGE Cc1cc(C(=O)N[C@H](CBr)CC(C)(C)C)ccc1I 2142113047 LSKBYMNPAVREQH-LBPRGKRZSA-N 438.147 4.529 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H](Br)C2CCCC2)c2ccccc2C1 2167032574 JYKVNLJHHVKDJQ-SFHVURJKSA-N 437.378 4.724 50 10 IJGE O=C(NC[C@H]1CN(CCCCCCCCCBr)CC12CCC2)C(F)(F)F 2174055008 ZRKFWYBSNUFYES-INIZCTEOSA-N 441.376 4.893 50 10 IJGE Cc1c(Cl)cc(C(=O)NC[C@@H](Br)CC(F)(F)F)cc1Br 2175688885 IADFVUAIZBIJPJ-QMMMGPOBSA-N 437.481 4.857 50 10 IJGE Cc1cccc(N2CCC[C@]3(CN(Cc4ccccc4)CCO3)C2)c1CBr 2196796895 UYWABVISWQYSRS-QHCPKHFHSA-N 429.402 4.761 50 10 IJGE Sc1nc2cc(Br)c(Br)cc2n1C[C@@H]1C[C@@H]1Br 2213495313 CJTDMPIOFZYFIX-WDSKDSINSA-N 440.986 4.633 50 10 IJGE FC(F)(F)C(F)(F)CCCO[C@H](CCl)[C@H](I)CCl 2223707396 MKQGGCCZWSDLFN-RNFRBKRXSA-N 428.994 4.631 50 10 IJGE CN(CC1(F)CCOCC1)c1c(CBr)ccc(Br)c1Cl 2238270219 OZXVADAEXYLLSE-UHFFFAOYSA-N 429.555 4.952 50 10 IJGE O=C(NC[C@H]1CCCN(CCCCCCCBr)C1)OCc1ccccc1 2245878761 JYFLDNVGSVWDSN-HXUWFJFHSA-N 425.411 4.970 50 10 IJGE C[C@H]1C[C@H](Br)[C@H](C)CN1C(=O)c1cc(F)c(Br)cc1Cl 2282974212 GAHOGMQXCMUXQX-WEDXCCLWSA-N 427.539 4.876 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2Cc3ccccc3O2)cc1I 2284998062 JPHWEYLIAXQRRT-JKSUJKDBSA-N 445.094 4.740 50 10 IJGE Clc1ccc(C[C@@]2(CBr)CCCCO2)cc1I 2300240888 RTIOLEURITWXTQ-CYBMUJFWSA-N 429.523 4.821 50 10 IJGE CCc1ccc([C@H](C)NC(=O)C(C#N)=CNc2ccc(I)cc2)cc1 2325103936 VNXIFEJLRSSVIM-AWEZNQCLSA-N 445.304 4.550 50 10 IJGE CC(C)N1C[C@H](Cl)[C@H](Cc2ccc(I)c(Br)c2)C1 2325209929 SXMYQBBEADDLON-YPMHNXCESA-N 442.566 4.544 50 10 IJGE CC1(C)[C@@H](Cl)C[C@@H]1CNCc1ccc(I)c(Br)c1 2325218121 LNBVTGFISHWDII-MFKMUULPSA-N 442.566 4.797 50 10 IJGE Cl[C@@H]1C[C@H]2C[C@H]1C[C@H]2NCc1ccc(I)c(Br)c1 2325227133 XGUNBOJZCMPMPQ-UZWIWUQPSA-N 440.550 4.549 50 10 IJGE CCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2OC)c1 38650061 GFJDMKSILRFXHE-XMMPIXPASA-N 442.471 4.531 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1S[C@H](C)C(=O)N/N=C(\C)CC(C)C 59915705 BBBBZQWOHRLHRW-DTVDJLOLSA-N 449.024 4.748 50 10 IJGE CCc1nn(C)c(CC(CBr)(CBr)C(C)C)c1Br 118670242 AEGGSWJBVPFSRA-UHFFFAOYSA-N 445.037 4.720 50 10 IJGE O=C(NC[C@H]1CCC[C@@H]1Br)c1cc(Br)ccc1Br 161223243 ITBFFJIRVKLPNX-KCJUWKMLSA-N 439.973 4.505 50 10 IJGE CCn1c(C)c(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4O)nc3c2)c2ccccc21 169926579 XOENAEFXCOQZSW-JFLMPSFJSA-N 437.503 4.982 50 10 IJGE CCOc1ccc(CCN/C=C(/C#N)C(=O)Nc2c(CC)cccc2CC)cc1OCC 217208356 SZTMYRGIJPAVOD-PYCFMQQDSA-N 435.568 4.787 50 10 IJGE Cc1cccc([C@@H](Br)c2ccc3c(c2)OCCO3)c1I 235994944 GPQMAXUZCRZAQO-HNNXBMFYSA-N 445.094 4.855 50 10 IJGE Cc1ccccc1OCC(=O)NN=C1C(=O)N(Cc2cccc3ccccc23)c2ccccc21 254745347 NRESOTLGKOWMQS-UHFFFAOYSA-N 449.510 4.594 50 10 IJGE Fc1ccc(I)cc1[C@H]1CN(Cc2ccccc2)C[C@H]1CCl 382733969 VZMGPBSLTNNRCJ-PBHICJAKSA-N 429.704 4.885 50 10 IJGE CC(C)(C)OC(=O)NCCN1CCN[C@@H](c2cccc(CO[Si](C)(C)C(C)(C)C)c2)C1 616652184 CGKAICWEQNGACG-OAQYLSRUSA-N 449.712 4.679 50 10 IJGE CC(C)(CCBr)CNC(=O)c1scc(Br)c1Br 705399380 JSBYMTRTRMPKTB-UHFFFAOYSA-N 448.018 4.814 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H]1Cn1c(CCCl)nc2cc(Br)cnc21 708568336 MUANAWMBGZQZLW-DOTOQJQBSA-N 447.808 4.743 50 10 IJGE N#Cc1ccc(Oc2ccc(NC(=O)NNc3ccc(C#N)cc3C(F)(F)F)cn2)cc1 799385878 ISJLCQVPDLVZJT-UHFFFAOYSA-N 438.369 4.785 50 10 IJGE C#CCCOc1ccc(C(=O)NNc2cc(C(F)(F)F)ccc2Br)cc1 1161997741 YOMDMUMQUHGFSI-UHFFFAOYSA-N 427.220 4.627 50 10 IJGE COc1ccc(-c2nc(C)c(C(=O)NNc3nc4ccccc4[nH]c3=S)s2)c(F)c1 1557584299 QEHRQJYIXJYWGR-UHFFFAOYSA-N 441.513 4.629 50 10 IJGE CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C[C@H](CBr)C3CC3)C2)CC1 1559992745 HMBSOFPBSHXCLK-OALUTQOASA-N 429.443 4.767 50 10 IJGE O=[N+]([O-])c1ccc(-n2nc(-c3cccc(I)c3)cc2CCl)cc1 1614821159 UGFDKEOITXKNAR-UHFFFAOYSA-N 439.640 4.791 50 10 IJGE COc1ccc(/C(C#N)=C/c2ccc(OC(=O)c3ccc4c(c3)OCO4)cc2)cc1OC 1615099386 QTYCGDXLXOUVCL-YBFXNURJSA-N 429.428 4.716 50 10 IJGE C=CCC(C)(C)CNC(=O)NNC(=O)c1ccc(COc2ccc3ccccc3c2)cc1 1635622102 NARQEWCGXTZUAO-UHFFFAOYSA-N 431.536 4.965 50 10 IJGE O=C(CCBr)c1cc(I)cc(SC(F)(F)F)c1 1848425802 ACUIIFCSRDOPBJ-UHFFFAOYSA-N 439.034 4.871 50 10 IJGE O=C(N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21)c1ccc(Cl)cc1F 1860822578 HASKCUGVQUVCGW-QOMWVZHYSA-N 442.277 4.813 50 10 IJGE COc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)cc1 1865710735 GQDYUNYCRNBCQD-QFIPXVFZSA-N 438.462 4.905 50 10 IJGE O=C(NCC1CC2(CC[C@H]2Cl)C1)c1csc(Br)c1Br 1882885866 AWCPLRCHBPCEDU-ZNZYBQRESA-N 427.589 4.801 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1ccc(F)c(C(F)(F)F)c1 1916355090 PQJNATWHXBSNPW-HNNXBMFYSA-N 448.254 4.897 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1F 2008322343 SHNVZKIJNUUGJS-AWEZNQCLSA-N 434.758 4.844 50 10 IJGE Cn1cc([C@H](Br)c2ccc(F)c(Br)c2F)c(Br)n1 2052975105 DUZGDQOCEMHMBS-MRVPVSSYSA-N 444.899 4.708 50 10 IJGE CCC[C@H](CBr)CNC(=O)c1cc(Br)ccc1Br 2057120168 OCOGDJZLARCGQB-SECBINFHSA-N 441.989 4.753 50 10 IJGE Cl[C@@H]1C[C@H](CNc2ncc(I)cc2Br)C12CCC2 2069527893 FLUSYVMSNDXYRF-LDYMZIIASA-N 441.538 4.658 50 10 IJGE C[C@@H]1C[C@@H](O[C@H](CI)c2ccc(Br)cc2)CCO1 2084724851 KKDBWCBDVCGCMY-DDTOSNHZSA-N 425.104 4.509 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CCCC2(CCC2)[C@@H]1NC(=O)CCCCBr 2106299201 VXCZMVXIQCKMGX-NVXWUHKLSA-N 431.415 4.532 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)[C@@H](CNC(=O)OC(C)(C)C)C(F)(F)F 2106783740 CJSGYLXJABUTCP-CABCVRRESA-N 439.316 4.553 50 10 IJGE COC1(CCNC(=O)OC(C)(C)C)CN(CCCCCCCCCBr)C1 2106784144 GMNXCLODKCQDHB-UHFFFAOYSA-N 435.447 4.728 50 10 IJGE CN(Cc1cccc(NC(=O)OC(C)(C)C)c1)CC1(CBr)CCOCC1 2106784411 ILCOYPWKMAMTED-UHFFFAOYSA-N 427.383 4.657 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)[C@H]1CC12CCC(F)(F)CC2 2107097566 ZFLAIGBIKVKAMU-IAGOWNOFSA-N 430.333 4.641 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2[C@@]1(C)CCN(Cc2ccccc2)C1 2128512342 VOMXNNDJDKPORR-FQEVSTJZSA-N 433.781 4.862 50 10 IJGE CC(C)N(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)CC1(CBr)CCOCC1 2163057793 FETRQJPJNFUDQA-SFHVURJKSA-N 447.458 4.678 50 10 IJGE CC(C)(C)OC(=O)N1CCCCN(CCCCCCBr)CC(F)(F)C1 2223282632 KRQZNUSWNBLITO-UHFFFAOYSA-N 427.374 4.910 50 10 IJGE CC[S@@](=O)CCn1c([C@H](C)Cl)nc2cc(Br)c(Br)cc21 2234059308 IJTSIKHNFHEYQM-FFVOIRBGSA-N 442.604 4.630 50 10 IJGE Cc1sc(C(=O)N2CC[C@@H](C(F)(F)CBr)C2)c(C)c1Br 2234467917 AJMAYRATRQMNSQ-SECBINFHSA-N 431.140 4.620 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Br)c1c(Cl)cnn1C 2264356791 QMMPPNUZJKBINA-JTQLQIEISA-N 428.939 4.982 50 10 IJGE CC(F)(F)C[C@@H](CBr)NC(=O)c1cc(F)c(Br)cc1Cl 2282980077 JFVOAFHXRYYWKE-LURJTMIESA-N 437.481 4.780 50 10 IJGE C=CCN1C(=O)C(=Cc2cn(-c3ccccc3)nc2-c2ccc(C)cc2)C(C)=C(C#N)C1=O 2314617390 XIUCXMNGCFGQTP-UHFFFAOYSA-N 434.499 4.626 50 10 IJGE N#CC(=C(O)CCN1C(=O)c2ccccc2C1=O)c1nc(-c2ccccc2Cl)cs1 2331265878 LDAKUFVEBLXEDR-UHFFFAOYSA-N 435.892 4.942 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCCN1C[C@@]1(CBr)CC1(F)F 2351886722 CZQFAQABKVBZLE-RKVPGOIHSA-N 437.369 4.661 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2c(CBr)c(C(F)F)nn2C)C1 2365332643 JYFAUFRTDQJENX-HUUCEWRRSA-N 441.364 4.599 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C)CN(C[C@H](CBr)c2ccccc2)CC1(F)F 2379683778 UBOLCKVPHBFFLE-LPHOPBHVSA-N 447.364 4.647 50 10 IJGE CCCCN(CCCC)Cc1ccc(C(=O)NNC(=S)Nc2ccc(C)c(C)c2)o1 4683333 NDDDWFMXVVEWQF-UHFFFAOYSA-N 430.618 4.930 50 10 IJGE CCOc1ccc(Br)cc1/C=N/NC(=O)COc1cccc2ccccc12 20177062 FJIIUPKZXZGDIQ-YDZHTSKRSA-N 427.298 4.530 50 10 IJGE N#C/C(=C/c1cccc([N+](=O)[O-])c1)c1nc(-c2cc3cc([N+](=O)[O-])ccc3oc2=O)cs1 33398840 LQTCZDZIIDJAIU-NSIKDUERSA-N 446.400 4.797 50 10 IJGE COc1cc(/C=N/NC(=O)COc2cc(C)cc(C)c2C)ccc1OCc1ccccc1 40888494 BPUGIRFUYDQQOM-JFLMPSFJSA-N 432.520 4.729 50 10 IJGE O=C(NC[C@H]1CCCC[C@@H]1CBr)c1c(F)cc(Br)cc1F 126942579 MTHVXDFHNKGBIH-NXEZZACHSA-N 425.111 4.658 50 10 IJGE CC(C)(C)C(=O)[C@@H](Br)Cc1ccc(Cl)cc1I 232218373 XJUUXCFIXTVHBP-JTQLQIEISA-N 429.523 4.866 50 10 IJGE COC(C)(C)CCO[C@H](CI)c1ccccc1Br 234694912 BUNYWTQMVANJSC-CYBMUJFWSA-N 427.120 4.757 50 10 IJGE COc1ccc(CCCC(=O)NN=Cc2ccc(OCc3ccccc3C#N)cc2)c(C)c1 254483198 WZBZTDYRYKGHFZ-UHFFFAOYSA-N 441.531 4.927 50 10 IJGE CCCCCCCCCCCCCC(=O)NCC(=O)NN=Cc1ccc(O)c(OC)c1 254493785 WOJQRMJJJLFZBF-UHFFFAOYSA-N 433.593 4.668 50 10 IJGE CC(=O)[C@H](Br)[C@@H](C)c1ccc(Br)c(I)c1 300904561 NERALXQNAKNEJQ-UPONEAKYSA-N 445.920 4.510 50 10 IJGE CC[C@H](NC(=O)c1ccc(I)c(Cl)c1)[C@H](Br)CC 313081029 ILBPJNOFDALHJM-SKDRFNHKSA-N 444.538 4.627 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@H](c2ccc(O)c(Br)c2)C1 382703215 DJVFIPJSKKFZPK-NEPJUHHUSA-N 435.156 4.500 50 10 IJGE CC[C@H](NC(=O)c1cc(Br)c(Br)s1)[C@H](C)Br 395706512 OHVGGBFPKZXDTG-FSPLSTOPSA-N 433.991 4.565 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)CSc1nnc(-c2cccs2)n1C1CC1 728463263 YNUBZKLMNUKDAA-UHFFFAOYSA-N 442.522 4.676 50 10 IJGE Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)NNC(=O)c3cccc4cccnc34)s2)cc1 730913377 GRYAVRDQMMJUAX-MRXNPFEDSA-N 445.548 4.680 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)Nc2cc(C3CCCCC3)[nH]n2)c(-c2ccccc2)n1 750069771 DVIPHJHNRRGGOK-ZHZULCJRSA-N 439.523 4.780 50 10 IJGE Cn1ncc(Br)c1/C=C(\C#N)C(=O)Nc1nc(-c2ccccc2Cl)cs1 779800004 VPCRPPWHYKLLNR-UXBLZVDNSA-N 448.733 4.505 50 10 IJGE CC(C)(C)OC(=O)N1Cc2ccc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)cc2C1 799750728 DQQGZLFMPLWXJL-UHFFFAOYSA-N 446.429 4.585 50 10 IJGE O=S(=O)(NC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)c1ccc(S(F)(F)(F)(F)F)cc1 808580951 HOOLBTFCVZDBRA-CPWXYTRJSA-N 433.464 4.706 50 10 IJGE O=C1C(=NNC(=O)C23CC4CC(CC(C4)C2)C3)c2ccccc2N1C/C=C\c1ccccc1 1083994035 AUYDXBZWRHVONT-CUPHYTQISA-N 439.559 4.783 50 10 IJGE Cc1ccc(NC(=O)C(=O)NN=Cc2cc(C)n(-c3ccccc3C(F)(F)F)c2C)cc1 1084073645 OIWAMXAMSSHWCD-UHFFFAOYSA-N 442.441 4.510 50 10 IJGE C=CCc1cc(C(=O)OC)cc(OC)c1OC(=O)/C(C#N)=C\c1cc(C)n(CCC)c1C 1531612881 PAAJMLKUIQDORV-BKUYFWCQSA-N 436.508 4.551 50 10 IJGE C=C[C@@H](CC(=O)NNc1nc2ccccc2c(=O)n1-c1ccc(C)cc1C)c1ccccc1 1565754471 DERYPJGHQFOBJE-FQEVSTJZSA-N 438.531 4.806 50 10 IJGE C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F 1657694585 DKJFVEIIUVGADX-OAHLLOKOSA-N 436.883 4.715 50 10 IJGE N#CSc1ccc(NC(=O)c2ccnc(NC(=O)COc3ccccc3Cl)c2)cc1 1860511715 NTTSIILTHSVXRB-UHFFFAOYSA-N 438.896 4.578 50 10 IJGE CCCc1nn(C)c2c1[C@H](c1ccc(OCc3ccccc3Cl)cc1)C(C#N)=C(N)O2 1865704591 ZJAZZGGZCKCJRF-OAQYLSRUSA-N 434.927 4.823 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccccc2Cl)[C@H]1c1ccc(F)cc1 1865707868 IFXBHIIPBYNVIP-HNNXBMFYSA-N 434.780 4.902 50 10 IJGE COCCOc1ccc(/C=C(\C#N)C(=O)NCc2ccc(-c3ccccc3OC)cc2)cc1 1866213989 MTJFEGOQGIODQD-HAVVHWLPSA-N 442.515 4.611 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2cnccc12 1915771770 PRKFBWFFZNVXGJ-UHFFFAOYSA-N 433.371 4.599 50 10 IJGE Brc1ccc(CN2C[C@@H](Br)CC3(CC3)C2)c(Br)c1 1925992122 BPGVYXCZSJMIAJ-LBPRGKRZSA-N 438.001 4.961 50 10 IJGE Cc1cnc(C(=O)N(Cc2ccccc2)[C@H](C)CCBr)c(Br)c1 1992737604 NVTDIYZLYVJBNU-CQSZACIVSA-N 440.179 4.968 50 10 IJGE CN(Cc1cc(Br)ccc1Br)CC(F)(F)CBr 2006500734 RIRXOGMSSDEGIH-UHFFFAOYSA-N 435.932 4.674 50 10 IJGE FC(F)(CBr)CCNCc1cccc(Br)c1Br 2012614492 FTOLRHKZROKKSO-UHFFFAOYSA-N 435.932 4.722 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1cc(Br)c(Br)s1 2023035740 NYOZWUFIHZODIH-HTRCEHHLSA-N 448.018 4.813 50 10 IJGE CC(C)(C)OC(=O)N1CC([S@](C)(=O)=NCCCCCCCCCBr)C1 2044697986 YEFIEXWHCBPDQM-VWLOTQADSA-N 439.460 4.829 50 10 IJGE CC(C)(C)c1ccnc(-n2nc(CCl)c(I)c2C(F)(F)F)c1 2078889070 JODSTIFCMPASGL-UHFFFAOYSA-N 443.638 4.927 50 10 IJGE COc1cc(OC)cc(-n2nc(CBr)c(Br)c2C(F)(F)F)c1 2079236112 NVWXGFFUVNAXEN-UHFFFAOYSA-N 444.045 4.566 50 10 IJGE C[C@H]1CCc2c1c(CBr)nn2-c1cc(C(F)(F)F)cc(Br)n1 2080672393 HEFSSBAOZHASNX-ZETCQYMHSA-N 439.073 4.993 50 10 IJGE ClCCc1nc2ccc(Br)cc2n1[C@]12C[C@@H]1CN(Cc1ccccc1)C2 2099679084 NRDZSEVNBIMTLU-IERDGZPVSA-N 430.777 4.811 50 10 IJGE Cc1cc(C(=O)NC2(CCBr)CCSCC2)c(Br)s1 2100998219 AWMPBQUPJYYVHY-UHFFFAOYSA-N 427.227 4.600 50 10 IJGE Cc1cc([C@H](Br)c2cc(I)cc3c2OCC3)oc1C 2132687451 VGMXVYHOYMLNPK-CQSZACIVSA-N 433.083 4.920 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CC[C@H](CCl)C(F)(F)C1 2146382431 HKFHKRVIRYNKFU-SECBINFHSA-N 431.502 4.548 50 10 IJGE Cc1csc(CBr)c1S(=O)(=O)N(C)c1ccc(Br)cc1 2179814390 BNMLRSVGQYCZKV-UHFFFAOYSA-N 439.194 4.539 50 10 IJGE FC1(F)C[C@]1(Br)Cn1c(CCCl)nc2cc(Br)ccc21 2202506397 QIJVBTCSGKAQKK-LBPRGKRZSA-N 428.502 4.753 50 10 IJGE Br[C@@H]1CC[C@@H]2CCCN(C[C@H]3CC3(Br)Br)[C@@H]2C1 2213090377 FGXZEGDEHZEFQA-IRCOFANPSA-N 430.022 4.520 50 10 IJGE CC1(C)CN(C(=O)c2cc(Cl)ccc2I)C[C@H]1CCCl 2238449938 NCDLAVPFYLPLPH-SNVBAGLBSA-N 426.125 4.672 50 10 IJGE CO[C@@H]1CC[C@@H]1[C@H](Br)Cc1cc(Br)cc(Br)c1 2252830038 NIDKIDIXPNHEBP-JHJVBQTASA-N 426.974 4.943 50 10 IJGE O=C(NC[C@H]1CCC[C@@H]1CBr)c1cc(Br)c(F)cc1Cl 2285957449 HPFOJUBSVQNWCA-RKDXNWHRSA-N 427.539 4.783 50 10 IJGE CC[C@H]1[C@H](Br)CCN1Cc1ccc(Cl)cc1I 2302325817 KPPFLPQBPPFPMZ-YPMHNXCESA-N 428.539 4.692 50 10 IJGE COc1cc(C=C(C#N)C(=O)NC(C)C)ccc1OC(=O)CCc1ccc(C(C)(C)C)cc1 2314790254 WVGZVYINHJWHJZ-UHFFFAOYSA-N 448.563 4.962 50 10 IJGE Cc1nc(Br)c([C@@H](Br)Cc2ccc(Br)cc2)n1C 2315580845 VOWJQCAHXOKTLK-NSHDSACASA-N 436.973 4.932 50 10 IJGE CC[C@H](NC(=O)C(C#N)=CN[C@@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 2318467240 CCDOGXUQFZICQM-UUOWRZLLSA-N 447.579 4.908 50 10 IJGE Cc1ccc(COc2ccccc2C=NNC(=O)CSc2nc3ccccc3n2C)cc1 2322910854 YNYMEOJDBJMHIS-UHFFFAOYSA-N 444.560 4.703 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Br)c2)C[C@@H](C)[C@@H]1Cl 2325215303 XSYGLMVSVHTLML-MSRIBSCDSA-N 442.566 4.749 50 10 IJGE CS(=O)(=O)Nc1ccc(C(O)=C(C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 2331295832 IZTCRXWSEFLGAB-UHFFFAOYSA-N 431.926 4.785 50 10 IJGE COc1c(F)c(F)cc(C(=O)N(Cc2ccccc2)[C@H](C)CCBr)c1F 2336107692 YRLZHQHYTITWPP-GFCCVEGCSA-N 430.264 4.928 50 10 IJGE CCN(C[C@](C)(CBr)OC[C@H](OC)c1ccccc1)C(=O)OC(C)(C)C 2336254891 BFYBTXCIEJPDNX-PXNSSMCTSA-N 430.383 4.801 50 10 IJGE CC(C)C[C@H](CBr)CN1CCC(c2n[nH]cc2NC(=O)OC(C)(C)C)CC1 2382185284 WLWATXUEGDNEMC-OAHLLOKOSA-N 443.430 4.993 50 10 IJGE CC1=C(C(=O)OCc2ccccc2)[C@@H](c2cncc(-c3ccc(F)cc3)c2)C(C#N)=C(N)O1 664507 MBWHPESITUNXKX-DEOSSOPVSA-N 441.462 4.713 50 10 IJGE C/C(=N/NC(=O)COc1ccc(C(C)(C)C)cc1Br)c1cccc([N+](=O)[O-])c1 5909904 WTFZVJKRLZHRDU-XKZIYDEJSA-N 448.317 4.574 50 10 IJGE COc1ccc(/C(C#N)=C\c2cccc(OC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)c2)cc1 31903192 SVMUYPBKHVBTKE-NVMNQCDNSA-N 445.387 4.795 50 10 IJGE COc1cc(Cl)cc(CBr)c1OCc1c(Br)c(C)nn1C 229101049 IWYHMGCPIOXTRL-UHFFFAOYSA-N 438.547 4.627 50 10 IJGE CO[C@@H]1CCC[C@H](O[C@H](CI)c2ccc(Br)cc2)C1 253135984 RUKSDQQSYFKXDI-QLFBSQMISA-N 439.131 4.899 50 10 IJGE CCOc1ccccc1C=NNC(=O)c1cc(-c2cccc(OCc3ccccc3)c2)n[nH]1 254478202 QSORWQFTRLGSNS-UHFFFAOYSA-N 440.503 4.818 50 10 IJGE BrCc1cc(Br)c(OCc2csnn2)c(Br)c1 310219542 MRPDZVSKSVVIAO-UHFFFAOYSA-N 442.958 4.537 50 10 IJGE O=C(Nc1cccc(CCBr)c1)c1csc(I)c1 313172842 MMGAXBHEWKRPME-UHFFFAOYSA-N 436.112 4.542 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@@H]1C(C)(C)[C@@]21CC[C@](C)(CI)O1 686237131 OGJSKSYHNJEXQC-TWKYDXJASA-N 449.373 4.785 50 10 IJGE CC1(C)C[C@H](Cl)C[C@H](NC(=O)c2ccc(I)c(Cl)c2)C1 703341853 QDUAMDVJHJGYEA-MNOVXSKESA-N 426.125 4.861 50 10 IJGE COc1ccc(C[C@@H](NC(=O)NNc2cccc(F)c2F)c2ccc(OC)cc2)cc1 745315403 VIMDZDGVPUKMDG-OAQYLSRUSA-N 427.451 4.592 50 10 IJGE O=C(NNc1ccc(Br)cc1F)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 748191381 MATHMSGTERGVHH-NEPJUHHUSA-N 433.199 4.734 50 10 IJGE CC(=O)N(c1cccc(Cl)c1)c1nc(C=NNC(=O)c2ccc(C)c(F)c2)cs1 774501992 JDHPADYPIRUGIG-UHFFFAOYSA-N 430.892 4.693 50 10 IJGE CC1(C)CN(C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)C[C@]2(CCOC2)O1 797612148 QUJPNCCMLLMTIC-PBHICJAKSA-N 438.899 4.708 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNc2nc3cc(Cl)ccc3cc2C)c(O)n1 1446838602 URDMMXFKTZBITJ-UHFFFAOYSA-N 434.883 4.730 50 10 IJGE C#C[C@@H](NC(=O)NNc1ccc(Br)cc1C(F)(F)F)c1ccc(F)cc1 1636548175 MSBASSBUCLHVQP-CQSZACIVSA-N 430.199 4.608 50 10 IJGE C=CCC[C@@H](NC(=O)NNc1ncc(Br)cn1)c1ccc(C(F)(F)F)cc1 1680854254 DHIJUQYZSLDRCY-CQSZACIVSA-N 444.255 4.592 50 10 IJGE Cc1cc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccc4ccccc24)CCC3)no1 1772749256 YXVLIQZAOUUOJA-UHFFFAOYSA-N 442.475 4.760 50 10 IJGE Cc1c(C(=O)N2CCCc3ccccc32)oc2c1C(=NNC(=O)Cc1ccccc1)CCC2 1772749683 XHJGIFKRGLAPNY-UHFFFAOYSA-N 441.531 4.580 50 10 IJGE Cc1ccc(OCCOc2cccnc2NC(=O)Oc2ccc([N+](=O)[O-])cc2F)cc1 1858691302 UDDCRZQHRNKDCP-UHFFFAOYSA-N 427.388 4.506 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccc(F)cc2)c1 1865694051 ORDBJBNDXMKVQU-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE Cc1nn(Cc2cccc(F)c2)c2c1[C@@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2 1865710682 FCDZWZZVIKIPJV-IBGZPJMESA-N 428.389 4.616 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)[C@@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1C 1872744723 FUJSQJAIUGODSE-WVCJAJDESA-N 445.500 4.605 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CCCC[C@H]1F)C(=O)OC(C)(C)C 1897216381 DCUGRMFOFCSVKP-CPUCHLNUSA-N 443.341 4.734 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ncccc1Br 1915128344 XBGHUXBMBIVMTB-CQSZACIVSA-N 426.152 4.660 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cccc(C(F)(F)F)c1F 1916354953 NXRUILZDBLIRBN-CQSZACIVSA-N 448.254 4.897 50 10 IJGE CC1(C)C[C@@H](Br)CN1Cc1ccc(Br)cc1Br 1949205923 WZGJSTRQLIFHBE-LLVKDONJSA-N 425.990 4.959 50 10 IJGE C[C@H](Br)[C@@H]1CCN(Cc2ccc(I)c(Cl)c2)C1 2026567406 RPIIJLQGTNTHLM-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE CCN(CC)CCN(Cc1ccccc1)c1cc(CBr)sc1[N+](=O)[O-] 2034739477 LWKMORCRIRCOSI-UHFFFAOYSA-N 426.380 4.900 50 10 IJGE C[C@H]1CCO[C@H]1COc1c(Br)cc(CBr)cc1Br 2034998023 ZYLONPISRDVGHN-UFBFGSQYSA-N 442.973 4.910 50 10 IJGE Cn1cc([C@H](Br)c2cc(F)c(Br)cc2F)c(Br)n1 2052973213 ZPFXWKZANLRGSG-SNVBAGLBSA-N 444.899 4.708 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cc(Cl)c(F)cc1F 2058880492 VFLVTXGEJWRHIE-CYBMUJFWSA-N 432.692 4.671 50 10 IJGE COc1cc(Br)c(C(=O)N(Cc2ccccc2)[C@H](C)CCl)cc1OC 2068779966 BQONIOIQJHPQKL-CYBMUJFWSA-N 426.738 4.736 50 10 IJGE COc1ccccc1Cn1nc(CBr)c(Br)c1C(F)(F)F 2079232887 HTYTWZWWWQOFIZ-UHFFFAOYSA-N 428.046 4.616 50 10 IJGE CCCN1C[C@H](Br)[C@H](Cc2ccc(I)c(Cl)c2)C1 2086651231 GMGJPDFAVFFBFF-NEPJUHHUSA-N 442.566 4.592 50 10 IJGE Brc1ccc([C@@H](CI)OCCOC2CCCC2)cc1 2087345194 WBDPMTOVDKQBFX-OAHLLOKOSA-N 439.131 4.901 50 10 IJGE CCC[C@H](CBr)CN1C[C@H](NC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2106784531 JHXQNCDZAXHVAK-NEWSRXKRSA-N 425.411 4.790 50 10 IJGE CO[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)N(CCCCCCCCCBr)C1 2106787617 JIMPOULOHNBECE-QZTJIDSGSA-N 435.447 4.726 50 10 IJGE Clc1ccc(N2CC[C@H]3OCCN(Cc4ccccc4)[C@H]3C2)c(CBr)c1 2129059161 YJQLHRCYMCVORV-LEWJYISDSA-N 435.793 4.715 50 10 IJGE CC(C)(C)OC(=O)N1CCO[C@H]2CCN(CCCCCCCCCBr)C[C@H]21 2163064499 UUKSCLHJPBZZPL-MOPGFXCFSA-N 447.458 4.822 50 10 IJGE FC(F)c1nc(CC(CBr)(CBr)C2CCOCC2)cs1 2188709679 ZTFUYDHFFAHSQQ-UHFFFAOYSA-N 433.156 4.826 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)c2ccccc21 2196912923 BFOUODMDMMTSQO-ZOBUZTSGSA-N 437.378 4.547 50 10 IJGE O=C(c1ccc(I)c(Cl)c1)N1CCCC[C@@H]1CCCCl 2206694333 OWADXAFGLSLHNP-GFCCVEGCSA-N 426.125 4.958 50 10 IJGE Clc1cc(Br)cc(C[C@]23CO[C@](CI)(C2)C3)c1 2216262025 MWNFRAZCLLAYTN-BETUJISGSA-N 427.507 4.629 50 10 IJGE C[C@@H]1OCCO[C@@H]1[C@H](Br)c1cc(Br)c(Br)cc1F 2218606580 SEYMZHFHFUTAGO-GHGOGRRBSA-N 446.936 4.591 50 10 IJGE Cc1cc(Br)c([C@H](Cl)[C@H]2CCCS2(=O)=O)c(C)c1Br 2227352054 BFGHKLRILDXXME-ZWNOBZJWSA-N 430.589 4.686 50 10 IJGE Br[C@H]1C[C@H](OCCOCCOCCOCc2ccccc2)C12CCCCC2 2236088535 IGWHWDYSBCDPOL-SFTDATJTSA-N 441.406 4.739 50 10 IJGE CCCN[C@H](Cc1cc(Br)cc(Br)c1)[C@H]1C[C@@H]1Br 2263513543 OYVMJDPUYKAONC-MELADBBJSA-N 440.017 4.906 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(CC2(CBr)CC(F)C2)c2ccccc21 2265632372 MORZVPJRWHKKHA-CZDRUDQFSA-N 427.358 4.976 50 10 IJGE Clc1ccc(CN[C@H](CBr)CC2CC2)cc1I 2300240013 GYGLMCKBHDSYBG-NSHDSACASA-N 428.539 4.598 50 10 IJGE Br[C@@H]1CC[C@H]2CCN(Cc3sccc3I)C[C@H]2C1 2316764706 PICONBPJPZEKTG-QJPTWQEYSA-N 440.188 4.738 50 10 IJGE CCCOc1ccccc1C=NNC(=O)c1cc(-c2ccccc2)nc(N2CCCCC2)n1 2323758224 CFWJLYQGROKDNW-UHFFFAOYSA-N 443.551 4.687 50 10 IJGE N#CC(=CNCCc1ccccc1Br)C(=O)Nc1ccc(Cl)cc1Cl 2324495765 ZKXQFCQCIDFCEI-UHFFFAOYSA-N 439.140 4.934 50 10 IJGE Clc1ccc(I)cc1C[C@]1(CBr)C[C@@]12CCOC2 2327399508 SFCWJDLSLCXHNE-ZIAGYGMSSA-N 441.534 4.679 50 10 IJGE COc1c(F)c(F)cc(CN(C)C[C@@H](Br)COCc2ccccc2)c1F 2339169088 MZQAFLNMXCCSFK-OAHLLOKOSA-N 432.280 4.525 50 10 IJGE Brc1cccc([C@@H](CI)OC[C@H]2O[C@H]3CC[C@H]2C3)c1 2352707574 LTXWNIGEHGMRFQ-SPWCGHHHSA-N 437.115 4.509 50 10 IJGE CN(C)c1nc(N)nc(/C(C#N)=C/c2ccc(-c3ccc(Cl)c(C(F)(F)F)c3)o2)n1 11297927 DPMOBNKXGRQEOL-YRNVUSSQSA-N 434.809 4.516 50 10 IJGE CCCOC(=O)c1ccc(OCC(=O)N/N=C(/C)c2ccc(-c3ccccc3)cc2)cc1 33565411 UTZBBSIXFPOSLZ-DIBXZPPDSA-N 430.504 4.840 50 10 IJGE O=S(=O)(NC[C@@H]1CCCC[C@@H]1Cl)c1c(Cl)cc(Br)cc1Cl 96873176 FHEPLKSZQNGDRC-WPRPVWTQSA-N 435.598 4.832 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc(Br)cc2)o1)C(=O)Nc1ccccc1C(=O)O 103485542 COVGLVNAHUPGAM-KAMYIIQDSA-N 437.249 4.953 50 10 IJGE COc1cc(Br)cc(/C=N/NC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)c1OC 169889120 SIKFMPFTDFKHBM-HHQKKNRLSA-N 449.389 4.913 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1OCc1cccc(F)c1 207162063 UBAMVQHKIOUQMA-ZDLGFXPLSA-N 447.422 4.867 50 10 IJGE COc1cc(N/C=C(/C#N)C(=O)Nc2cccc(C(F)(F)F)c2)c(OC)cc1Cl 217147215 JIWNWNUGNSAYMY-KHPPLWFESA-N 425.794 4.834 50 10 IJGE Brc1ccc([C@H]2CC[C@@H](CI)O2)cc1Br 306380986 ROYVKSLATFYQIG-GZMMTYOYSA-N 445.920 4.867 50 10 IJGE CC1(C)[C@H](Br)CCN1C(=O)c1cc(Br)cc(Br)c1 311137433 YAINNEJDUFGTGL-LLVKDONJSA-N 439.973 4.600 50 10 IJGE COc1cc(Br)ccc1[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1CBr 382681390 BIZZBRQVLVNZQA-FZMZJTMJSA-N 449.183 4.803 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1C(=O)c1ccc(Br)cc1Br 384217157 CPKJCZRNDFNPJV-KCJUWKMLSA-N 439.973 4.600 50 10 IJGE C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1[C@H](Br)c1cc(I)cc2c1OCC2 716444320 OGAQKQRVTFCCSD-BPDYJKDZSA-N 433.127 4.954 50 10 IJGE CC(C)(C)S(=O)(=O)CCC[C@@H](CBr)c1cccc(Br)c1 718760753 HQNKOGCKXNEMJA-ZDUSSCGKSA-N 426.214 4.921 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799752429 KEBQMBDGOIHIMA-UHFFFAOYSA-N 447.848 4.849 50 10 IJGE Cc1ccc(C(=O)NN=C2C(=O)N(C/C=C\c3ccccc3)c3ccccc32)cc1Cl 1084022909 HETOYGIHKJBIFZ-YBDNCTAXSA-N 429.907 4.843 50 10 IJGE Cc1c(C)c(C)c(CSCC(=O)NNS(=O)(=O)c2ccc(C(C)C)cc2)c(C)c1C 1088718308 DZYXRXAEXHXHAZ-UHFFFAOYSA-N 448.654 4.595 50 10 IJGE Cc1cc(Br)cc2cc(C(=O)NNc3nc4ccccc4[nH]c3=S)oc12 1148231852 YDADNNHPBNYLKC-UHFFFAOYSA-N 429.299 4.866 50 10 IJGE C=CCC[C@@H](C(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1)c1ccccc1 1182129766 ZWIJQLVPHBRNEL-RUZDIDTESA-N 439.515 4.501 50 10 IJGE C=CCC1(CNC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)CCCC1 1681081091 PMBHODQERJDACQ-UHFFFAOYSA-N 428.536 4.982 50 10 IJGE CN(C[C@@]1(C(C)(C)C)CC[C@@](C)(CI)O1)C(=O)OC(C)(C)C 1929974648 KJBZKPUYMUXCCM-DLBZAZTESA-N 425.351 4.642 50 10 IJGE C[C@H](Br)CN(Cc1ccc(Br)cc1Br)C1CC1 1943857122 CLEVGVLVFAZWQZ-VIFPVBQESA-N 425.990 4.959 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCc1nncs1 2013619492 HZOIKQASZUFVDG-UHFFFAOYSA-N 442.958 4.537 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1C(=O)c1cccc(Br)c1Br 2031480520 WKFSONRPLBIPCR-WPRPVWTQSA-N 439.973 4.600 50 10 IJGE CCC[C@H](Br)c1cn(-c2cc(I)ccc2Cl)nn1 2057426561 GULFJUGFAFMPTJ-VIFPVBQESA-N 440.510 4.761 50 10 IJGE BrC[C@@]12CC[C@H]1CN(Cc1cc(Br)ccc1Br)C2 2078148056 QYLSFTMWRGIKJP-SMDDNHRTSA-N 438.001 4.819 50 10 IJGE CN(C(=O)c1cc(Br)c(Cl)s1)[C@H](CCBr)C(F)(F)F 2122009378 QTOZVHACSNKWGN-SSDOTTSWSA-N 443.510 4.952 50 10 IJGE CC(C)(CBr)CN1C[C@@H](CNC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2129068440 QSPIRYBIWUHCCK-MSOLQXFVSA-N 425.411 4.648 50 10 IJGE Cc1cc(Br)c(CCl)c(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1 2185517149 XAWKNRZAJBSMEB-YADHBBJMSA-N 449.820 4.976 50 10 IJGE O=[N+]([O-])c1cc(Br)c(Br)cc1NC[C@H]1C[C@@H](Br)C1 2218662140 QITJUVAEXBIVJG-KNVOCYPGSA-N 442.933 4.705 50 10 IJGE CC(C)N(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)CC1(CBr)CC(F)C1 2265632869 QGYVGJOZSMSLAJ-GNZRSQJKSA-N 435.422 5.000 50 10 IJGE C[C@]12CO[C@](CO[C@@H](CI)c3ccccc3Br)(C1)C2 2266292447 YWKLQXMXVCZOMZ-SOUVJXGZSA-N 437.115 4.511 50 10 IJGE COc1ccc([C@H](Br)[C@]23CCC[C@H]2OCC3)cc1I 2269556771 RCWCIZPMSGUTEV-ILXRZTDVSA-N 437.115 4.695 50 10 IJGE Cl[C@@H]1CCCCN(Cc2ccc(I)c(Br)c2)C1 2306215866 ZVPCANANNLEYTG-LLVKDONJSA-N 428.539 4.647 50 10 IJGE C[C@@H]1C[C@H](CBr)CCN1Cc1ccc(Cl)c(I)c1 2315554271 CWFVZRIUSQSDMZ-GHMZBOCLSA-N 442.566 4.940 50 10 IJGE CCCN(CC1CCN(C(=O)OC(C)(C)C)CC1)C[C@]1(CBr)CC1(F)F 2351887993 SPPSOGRHFNQHKR-GOSISDBHSA-N 439.385 4.766 50 10 IJGE O=C(Cc1ccc2ccccc2c1)N[C@H](CCBr)COCc1ccccc1 2369433210 LIVXXICHIMBTRQ-JOCHJYFZSA-N 426.354 4.869 50 10 IJGE COc1ccc2nc(N(/N=C/c3ccc([N+](=O)[O-])o3)C(=O)c3cccs3)sc2c1 9629574 YFUHNYJJWWDGJQ-VXLYETTFSA-N 428.451 4.549 50 10 IJGE CCOc1ccccc1NC(=O)[C@H](NNC(=O)c1ccc(C(C)(C)C)cc1)c1ccccc1 24518221 QKSFAKQYXSTRTE-XMMPIXPASA-N 445.563 4.997 50 10 IJGE CCCCOc1ccc(/C=C2/C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)cc1OC 38608428 PIYWTEJLQHURIB-HYARGMPZSA-N 444.531 4.975 50 10 IJGE C#CCOc1c(Br)cc(/C=N/NC(=O)c2cc3ccccc3o2)cc1CC=C 59305153 UYOJHLMKDITLKK-ZVHZXABRSA-N 437.293 4.700 50 10 IJGE Cc1cc(I)ccc1NC(=O)c1ccc(CBr)cc1 228129842 LCAHXXHPAXEWJT-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE O=C(N[C@H]1CCC[C@H]1CBr)c1ccc(Br)cc1Br 231558857 PTRCBDTUAAFXJM-UFBFGSQYSA-N 439.973 4.505 50 10 IJGE BrCc1cc(Br)c(OC[C@H]2CCCOC2)c(Br)c1 690499773 ZVKBIKRJRPPFLW-VIFPVBQESA-N 442.973 4.912 50 10 IJGE Fc1cccc([C@H](Br)c2ccc3c(c2)OCCO3)c1I 721698137 NUBQLYPKRAGBJI-CQSZACIVSA-N 449.057 4.686 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)CSc1nnc(-c2cccc(C)c2)n1CC 746186100 XGMBYUABYGZLGR-UHFFFAOYSA-N 438.509 4.608 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NN=Cc3ccccc3[N+](=O)[O-])cc2)cc1 1084434244 KYLZNGNHPHTYIE-UHFFFAOYSA-N 444.491 4.909 50 10 IJGE C[C@H](SCc1nc(O)c2ccccc2n1)C(=O)NN=C(c1ccccc1)c1ccccc1 1351474278 DFBZZXYZAUMBNY-KRWDZBQOSA-N 442.544 4.526 50 10 IJGE CC(=O)N(Cc1ccc(NC(=O)NNc2ccccc2Cc2ccccc2)cc1)C1CC1 1667245264 CCXGAFOXCKSFJO-UHFFFAOYSA-N 428.536 4.937 50 10 IJGE Brc1ccc([C@H](CI)O[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1 1917452364 FHBJDBGZROQISR-QPCUURQASA-N 433.127 4.986 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]2(CCC[C@H](CI)O2)CCC12CCC2 1983724628 KTDLLRUQHWDDSS-RDTXWAMCSA-N 435.346 4.683 50 10 IJGE C[C@H](Br)[C@H]1CCCN1C(=O)c1cc(Br)sc1Br 2018105980 ADOIUOIDROCOHE-POYBYMJQSA-N 446.002 4.661 50 10 IJGE CC(C)N1C[C@H](Cc2ccc(Br)cc2Br)[C@@H](Br)C1 2039262901 RTHKVHHSGJOKAZ-FZMZJTMJSA-N 440.017 4.858 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@H]2[C@@H](Cl)CCC[C@H]2C1 2094583774 LOMRWTKBUAVRTD-XKSSXDPKSA-N 427.589 4.753 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CCC(COCCBr)CC1 2111107195 SPPPADFNICERGR-UHFFFAOYSA-N 438.387 4.591 50 10 IJGE Brc1ccccc1[C@H](CI)OCCOCCC1CC1 2127763894 MUHDBGYAVRMWCS-HNNXBMFYSA-N 439.131 4.759 50 10 IJGE C[C@@H](Br)C[C@@H]1CCCCCN1Cc1nn(C)c(Cl)c1Br 2152984852 IDHKJAFVJYDHJN-MNOVXSKESA-N 427.612 4.754 50 10 IJGE BrCc1ccc(CN2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)cc1 2182853731 FCXSKXLRNZSDIW-SBFWRKJZSA-N 425.414 4.924 50 10 IJGE CC1(C)OCCO[C@H]1COc1c(Br)cc(Br)cc1CCl 2186966336 AHMJVMSEXGIWTJ-LBPRGKRZSA-N 428.548 4.523 50 10 IJGE COc1ccc(C(C)C)cc1[C@@H](Br)c1cnn(C)c1I 2203872929 HWYNMRNRDXHJDA-CQSZACIVSA-N 449.130 4.641 50 10 IJGE C[C@@H]1COC[C@@H]1[C@@H](Br)Cc1cc(Br)cc(Br)c1 2252838383 CDFORUCKTMRVTB-JCOFBHIZSA-N 426.974 4.800 50 10 IJGE COCC1([C@H](Br)c2ccc(OC)c(I)c2)CCC1 2257369686 OHLDCYAOUOEVSS-CYBMUJFWSA-N 425.104 4.553 50 10 IJGE COc1ccc([C@H](Br)c2ccccc2OC)cc1I 2269556027 KUPRLQDNJGYWIP-HNNXBMFYSA-N 433.083 4.793 50 10 IJGE CC[C@@H]1[C@@H](CBr)CCN1Cc1ccc(Cl)cc1I 2318526368 IUMAXGBHBHRXTJ-QMTHXVAHSA-N 442.566 4.940 50 10 IJGE CC1(C)C[C@H](Br)CN(Cc2ccc(Cl)cc2I)C1 2318537213 DQOJINYPJLXSIK-NSHDSACASA-N 442.566 4.940 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@H](Br)[C@@H]2CC[C@H]21 2327406906 NCSLFPMEUMHIPP-SGMGOOAPSA-N 440.550 4.692 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Cl)c2ccc(Cl)cc2I)c1 2340066302 ZAOUFLCVDZONED-LBPRGKRZSA-N 447.146 4.738 50 10 IJGE COc1cc(Br)c(CCC(=O)Oc2ccc(/C=C\C#N)cc2OC)cc1OC 33374593 MUGCFTMNZBUEKW-PLNGDYQASA-N 446.297 4.550 50 10 IJGE Cc1ccnc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(Cl)cc2)CCC3)c1 40811711 BUVNJIIFVRFVAH-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE CCCCCCCC(=O)N/N=C/c1ccc(OC(=O)c2ccc(OC)c(OC)c2)cc1 100869895 PWTWZAWUHAJDQC-KOEQRZSOSA-N 426.513 4.734 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1Br)c1ccc(Br)c(C(F)(F)F)c1 123003354 LTZCKBYRXMMYFO-NWDGAFQWSA-N 429.074 4.904 50 10 IJGE O=C(N/N=C\c1ccc(Cl)cc1Cl)c1cccn(Cc2cccc(Cl)c2)c1=O 169920681 RWSZICOTCRCGEX-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE CC[C@](C)(CCCl)NS(=O)(=O)c1cc(Br)c(C)cc1Br 228588332 POFGXILOTBTYOP-CYBMUJFWSA-N 447.620 4.596 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N2[C@H]3CC[C@H]2CC(O)C3)c(C)n1-c1cccc(C(F)(F)F)c1 303782005 OMZZOGOXQHKKPL-IHAAZGMVSA-N 443.469 4.534 50 10 IJGE COc1ccc([C@H](Br)c2cc(I)cc3c2OCC3)cc1 379950720 DSWWUTQNWPVKLK-HNNXBMFYSA-N 445.094 4.719 50 10 IJGE CCCN(Cc1ccccc1)S(=O)(=O)c1cc(Br)cc(CCl)c1F 383645169 MPPBMGDLVCGBKZ-UHFFFAOYSA-N 434.758 4.928 50 10 IJGE CC[C@H](Br)CCCNC(=O)c1cc(Br)ccc1Br 398533365 CLCXDHLUUAFBIY-VIFPVBQESA-N 441.989 4.895 50 10 IJGE C[C@@H]1[C@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1scc(Br)c1Br 686181238 MGSCPWFMYUXLMI-KHUVANEUSA-N 427.589 4.894 50 10 IJGE CN(C(=O)c1cc(Br)c(Br)s1)[C@H]1CCC[C@H]1Br 709100575 AXRKAWNXHCYVIQ-SVRRBLITSA-N 446.002 4.661 50 10 IJGE Cc1cc(C(=O)NC2(CCBr)CCSCC2)sc1Br 719719841 MVIVUXGMCXTEBH-UHFFFAOYSA-N 427.227 4.600 50 10 IJGE CCOc1ccc(/C=C(\C#N)C(=O)N2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1 726536922 IWNMZEVJNAZBCB-CVNFFVDQSA-N 446.482 4.588 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])cc1Br)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 741442630 MMTAIRGNPUFWAW-RYUDHWBXSA-N 446.175 4.965 50 10 IJGE CCS[C@@H]1CC[C@@H](N(C)C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)C1 742908418 AYHNZJINOYGQME-OZHUDADTSA-N 433.581 4.503 50 10 IJGE O=C(Cc1csc(-c2cc(Br)cs2)n1)NNc1cccc(F)c1F 743720677 KQMSFDUMJJYEDR-UHFFFAOYSA-N 430.299 4.598 50 10 IJGE C/C(=C\C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)c1ccccc1C(F)(F)F 743832120 GIPHGOWEJNNPKF-ZHACJKMWSA-N 429.345 4.563 50 10 IJGE CN(C)NC(=O)Nc1cccc(NC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)c1 791273526 XEXHLOAPPNISNG-UHFFFAOYSA-N 426.423 4.608 50 10 IJGE CC(C)OCCOCc1cccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1 799394708 GMIWPXAAWQTZCF-UHFFFAOYSA-N 436.434 4.667 50 10 IJGE N#Cc1ccc(NNC(=O)c2cnn(-c3ccccc3)c2C(F)(F)F)c(C(F)(F)F)c1 799750162 XVLOFWVRNGATHQ-UHFFFAOYSA-N 439.319 4.538 50 10 IJGE O=C(NN=Cc1ccccc1)c1ccc(-c2ccc(C(=O)NN=Cc3ccccc3)cc2)cc1 1084512660 SGUAHSVZGWIRNV-UHFFFAOYSA-N 446.510 4.881 50 10 IJGE C=CC(C)(C)C(=O)NNc1c(Br)cc(Br)cc1Br 1435268905 GFPNJQTYLSVCRQ-UHFFFAOYSA-N 440.961 4.629 50 10 IJGE C#CCO[C@@H](C)C(=O)Nc1cc(Br)ccc1CO[Si](C)(C)C(C)(C)C 1539030708 YNROTVUOFPFQLU-AWEZNQCLSA-N 426.427 4.948 50 10 IJGE CC(=O)N(Cc1ccc(NC(=O)NNc2c(C)cccc2Br)cc1)C(C)C 1562368210 QTHPZFUMUSHSMQ-UHFFFAOYSA-N 433.350 4.663 50 10 IJGE CCCSc1ccccc1C(=O)NNC(=O)c1ccc(-c2ccccc2OC)nc1C 1865760288 QKFZINLCQJABLA-UHFFFAOYSA-N 435.549 4.643 50 10 IJGE C[C@@H](c1cc(F)ccc1Br)[C@H](CBr)NC(=O)OC(C)(C)C 1885094167 SLRVEVTZSCDBNW-ZANVPECISA-N 425.136 4.980 50 10 IJGE O=C(C(C(F)(F)F)C(F)(F)F)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915315820 YSUHOVJBDJOUIN-LBPRGKRZSA-N 432.202 4.930 50 10 IJGE Cc1sc(Br)cc1[C@H](Br)c1cc(Br)n(C)n1 1937822170 UWDZADKAUAUUTR-JTQLQIEISA-N 428.975 4.799 50 10 IJGE C[C@@]1(CBr)CCCN1Cc1c(Br)cccc1Br 1945333948 WZDIISWMEJSTLO-ZDUSSCGKSA-N 425.990 4.961 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@@]1(CC[C@@](C)(CI)O1)C2 1949547699 KWEFGRWYZOHEJZ-HKUYNNGSSA-N 449.373 4.931 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1snc(Cl)c1Cl 1979676541 CAVLAZIVMMBZSG-NSHDSACASA-N 438.174 4.502 50 10 IJGE CC[C@H]1CN(C(=O)OCc2ccccc2)[C@H](CC)CN1C(=O)CCCCBr 1999432081 YREMTLYKPOXNQY-RBUKOAKNSA-N 439.394 4.590 50 10 IJGE CCn1nnc(Br)c1C[C@@H](Br)c1ccc(Br)cc1 2050569847 BZVHATMLESIMDC-SNVBAGLBSA-N 437.961 4.502 50 10 IJGE CCC[C@H](CBr)CNC(=O)c1ccc(Br)cc1Br 2057121218 YSGBSDBDAHNTET-SECBINFHSA-N 441.989 4.753 50 10 IJGE Cc1nc2c(cc1Br)nc([C@H](C)Cl)n2CC1CN(Cc2ccccc2)C1 2096813041 IXHAHILIZYYNLQ-ZDUSSCGKSA-N 433.781 4.934 50 10 IJGE CC(C)(C)OC(=O)Nc1cc(F)cc(CNC(=O)[C@@H](Br)C2CCCC2)c1 2110727032 HIGOELDLAMKUNI-INIZCTEOSA-N 429.330 4.743 50 10 IJGE COc1cc(Cl)c([C@@H](Cl)c2cc(I)sn2)cc1OC 2120033602 UGXKSMWPYHXQLI-GFCCVEGCSA-N 430.094 4.747 50 10 IJGE CC(C)[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)n(C2CC2)c1 2123267593 ACIPQGXELPZUJC-INIZCTEOSA-N 439.419 4.953 50 10 IJGE O=C(N[C@H]1C[C@H]2CC[C@H]1[C@H](Cl)C2)c1csc(Br)c1Br 2139711436 BKFLMBXOZPBNMT-MFDQJXRNSA-N 427.589 4.799 50 10 IJGE O=C(N[C@H]1C[C@H]2CC[C@H]1[C@@H](Cl)C2)c1cc(Br)sc1Br 2139718512 IZMLLGPRBABDSL-YIKMNZTOSA-N 427.589 4.799 50 10 IJGE Cn1nc(COc2c(F)cc(CBr)cc2F)c(Br)c1Cl 2153004878 SOPMBKNHHRPBHR-UHFFFAOYSA-N 430.474 4.588 50 10 IJGE CN(CCCCCI)[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2211185027 HABJSEDOPNPLRQ-ACDBMABISA-N 426.386 4.719 50 10 IJGE Cc1cc(Br)c([C@H](Cl)[C@H]2CCS(=O)(=O)C2)c(C)c1Br 2227350179 VTRWQLFONXCIMS-TVQRCGJNSA-N 430.589 4.543 50 10 IJGE CC(C)[C@H](CBr)CN1CC[C@H](NC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2255002366 WMUCXYUNCDUUBN-RDBSUJKOSA-N 431.337 4.574 50 10 IJGE CC(C)(C)OC(=O)NCc1cc(F)cc(NC(=O)c2ccc(CBr)cc2)c1 2280493694 LTWNEMVMVKXJJM-UHFFFAOYSA-N 437.309 4.998 50 10 IJGE CCC[C@@H]1CN(C(=O)c2ccc(Cl)c(I)c2)C[C@H]1CCl 2283652329 SVTPFRAJBHKYBP-VXGBXAGGSA-N 426.125 4.672 50 10 IJGE Clc1ccc(CN2C[C@@H](Br)[C@@H](C3CC3)C2)c(I)c1 2318557924 POEJYIUZSMLGGP-CHWSQXEVSA-N 440.550 4.550 50 10 IJGE Cn1cc(I)c(CC2(CBr)CC3(CC4(CCC4)C3)C2)n1 2367496377 DBBQACLWNJTTOL-UHFFFAOYSA-N 449.174 4.693 50 10 IJGE COCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C[C@](C)(CBr)C(C)(C)C 2380165133 QGWXHCFTNWTEFS-UTKZUKDTSA-N 449.474 4.782 50 10 IJGE Cc1cccc(NC(=O)COc2ccc(/C=C(/C#N)c3nc(O)c4ccccc4n3)cc2)c1 34988283 ZXYSROAXKVHFIO-RGEXLXHISA-N 436.471 4.726 50 10 IJGE C[C@@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccccc1F 38652076 MOUPILQEYJUYHS-QKFKETGDSA-N 448.425 4.556 50 10 IJGE CCOc1ccc2ccccc2c1/C=N/NC(=O)COc1ccc(C)cc1Br 40912172 OVOKCEZNJCSTPS-ZMOGYAJESA-N 441.325 4.839 50 10 IJGE C=CCc1cccc(C=NNC(=O)[C@@H](C)Oc2ccc(OCc3ccccc3)cc2)c1O 254820657 VFYYVENQCWPRJH-LJQANCHMSA-N 430.504 4.617 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1)c1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1 263626769 YGGGHOSIAUGOBN-UHFFFAOYSA-N 448.331 4.558 50 10 IJGE CC[C@@H](Br)[C@@H](CC)NC(=O)c1cc(Br)sc1Br 313125238 VKWBVNKSVXRVMA-HTQZYQBOSA-N 448.018 4.955 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1[C@H]1CCCN(Cc2ccccc2)C1 387053109 WHAUFEBXYVZHMK-KRWDZBQOSA-N 433.781 4.812 50 10 IJGE ClCc1c(Br)cccc1N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21 404212717 XHRUVROZCUHHIJ-NHCUHLMSSA-N 435.793 4.668 50 10 IJGE FC(F)Oc1cc(CBr)c(I)c(C(F)(F)F)c1 575723205 MASHBVZWSNVRJQ-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1ccc2cc(Br)ccc2c1 757704360 UWYGOFBZBFFGPL-UHFFFAOYSA-N 435.281 4.617 50 10 IJGE COc1ccc(CNS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)cc1C#N 782986055 CEJOYQFHUMTNMM-UHFFFAOYSA-N 428.404 4.703 50 10 IJGE C/C(=C/C(=O)NNc1nc2ccccc2c(=O)n1-c1ccc(C(C)C)cc1)c1ccco1 1293481955 WBLZFUGPLLSRFA-ICFOKQHNSA-N 428.492 4.649 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2cnc(O)c3ccccc23)c(C)n1-c1ccc(F)cc1 1558410304 USDKOTVWWCNRST-UNOMPAQXSA-N 440.478 4.710 50 10 IJGE C/C(=C\C(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(C)c1C)c1cccs1 1633661222 KHQZHDQBZCEWEX-JQIJEIRASA-N 430.533 4.611 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)COc2ccccc2)CCC3)c(C)c1 1772748857 FFUMIUUVABCXTF-UHFFFAOYSA-N 445.519 4.693 50 10 IJGE O=C(N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21)c1c(F)cccc1Cl 1860822776 MOVYTMYKHSBLRM-QOMWVZHYSA-N 442.277 4.813 50 10 IJGE CCOc1cc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3CC(C)C)ccc1O 1865681180 HBAFRMNWAHQWDD-NRFANRHFSA-N 430.508 4.529 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865702545 WRESJAUBQFBCAT-LJQANCHMSA-N 444.844 4.783 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(Cl)c([N+](=O)[O-])c1 1865705779 FSCMDDMBAJAAOG-SFHVURJKSA-N 435.871 4.740 50 10 IJGE CCC[C@H](CCNC(=O)OC(C)(C)C)CCC(=O)N(C)C[C@H]1C[C@H](Br)C1 1887824408 ZGKIKPHXZLHQJE-ULQDDVLXSA-N 433.431 4.730 50 10 IJGE CCc1ccc(NC(=O)OC(C)(C)C)c(C(=O)N(C)C[C@H]2C[C@H](Br)C2)c1 1887833296 QMIRQGSRIMESMN-SHTZXODSSA-N 425.367 4.842 50 10 IJGE CCn1cc(Br)c([C@@H](Br)c2sccc2Br)n1 1985209357 JIYQQFQVSMXSPH-MRVPVSSYSA-N 428.975 4.974 50 10 IJGE C[C@H]1OCC[C@@]1(CBr)Cc1cc(Br)ccc1Br 2006502109 XPXBMFWAWUBHDO-RNCFNFMXSA-N 426.974 4.944 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1C(=O)c1csc(Br)c1Br 2018124042 WCMQEPFWOCKSAM-XPUUQOCRSA-N 446.002 4.661 50 10 IJGE O=C(N[C@H]1CC[C@@H](CBr)C1)c1cc(Br)cc(Br)c1 2029536099 PFHSBETYXBWJTK-PELKAZGASA-N 439.973 4.505 50 10 IJGE O=C(NCC1(CBr)CCC1)c1c(Br)cccc1Br 2033084788 ALZSQRXLHFKQGC-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE FC(F)(F)c1cc(CCl)c(I)cc1I 2060237708 RHYXARSIBRFJLC-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE O=C(Nc1ccc(Br)c(Br)c1)N1CCC(Br)CC1 2065988335 SHILOSQJKKGIDL-UHFFFAOYSA-N 440.961 4.603 50 10 IJGE COc1cccc(Cn2nc(CCl)c(I)c2C(F)(F)F)c1C 2079212584 WLPUJYUYYOIXGM-UHFFFAOYSA-N 444.622 4.611 50 10 IJGE CCC[C@@H](CCCl)NC(=O)c1ccc(Br)cc1I 2086154330 SMYOLVKVPKGJCK-JTQLQIEISA-N 444.538 4.581 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1C1CCN(C[C@H](CBr)CC2CC2)CC1 2112868196 HATOYQYVFVOVFT-HKUYNNGSSA-N 429.443 4.909 50 10 IJGE O=C(c1csc(Br)c1Br)N1[C@H]2CC[C@@H]1C[C@H](CCl)C2 2128149366 IDYAIDOJGCAWLI-AYMMMOKOSA-N 427.589 4.895 50 10 IJGE C[C@](CCl)(Nc1ncc(C(F)(F)F)cc1I)C(F)(F)F 2161366587 KUYKNRNULKDOKM-MRVPVSSYSA-N 432.533 4.677 50 10 IJGE O=C1NCCc2ccc([C@H](Br)c3cc(Br)c(Cl)s3)cc21 2172569538 OCIBGZAYJJDOCL-LBPRGKRZSA-N 435.568 4.934 50 10 IJGE Br[C@@H]1C[C@H](OCCOCCOCCOCc2ccccc2)C12CCCCC2 2236088534 IGWHWDYSBCDPOL-RTWAWAEBSA-N 441.406 4.739 50 10 IJGE Cc1ccc(I)c(C(=O)N2C[C@H](Br)CC23CCCC3)c1 2241039187 JDIIABPAYSZAAT-GFCCVEGCSA-N 448.142 4.522 50 10 IJGE CC(C=Cc1ccccc1)=NNC(=O)c1cc(Br)cc(Br)c1O 2297315138 LWXGXGIPOQABBW-UHFFFAOYSA-N 438.119 4.736 50 10 IJGE CC(C)c1ccc(C=C(C#N)C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)cc1 2297382304 ITUIFSCNMZQWSF-UHFFFAOYSA-N 437.565 4.530 50 10 IJGE C[C@@H](CBr)[C@H]1CCCCN1Cc1sccc1I 2301076164 IQPFYEVLNXZXNZ-CMPLNLGQSA-N 428.177 4.738 50 10 IJGE C[C@@H](Cl)[C@H]1CCCN1Cc1ccc(I)c(Br)c1 2306218054 WHYPROUWDJEDNE-NOZJJQNGSA-N 428.539 4.645 50 10 IJGE C[C@H]1CC[C@@H](CBr)CN1Cc1ccc(Cl)cc1I 2318529933 WVZQVBYWBBFMPZ-QWRGUYRKSA-N 442.566 4.940 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4)[nH]c3c2)c(Cl)c1OC 2323744849 KAPSCTBTMVHPAF-UHFFFAOYSA-N 434.883 4.664 50 10 IJGE CCc1ccccc1NC=C(C#N)C(=O)Nc1ccc(I)cc1C 2325408163 JCGQTZODKLTNMS-UHFFFAOYSA-N 431.277 4.620 50 10 IJGE Clc1ccc(I)cc1CN1[C@H]2CC[C@H](C2)[C@@H]1CBr 2327405673 DYOHSFPZHUHOQH-LQJRIPTKSA-N 440.550 4.692 50 10 IJGE COc1cc(C=C(C#N)c2nc3ccccc3n2C)ccc1OCC(=O)Nc1ccccc1 2331019711 ONJJWQJSJJIOSJ-UHFFFAOYSA-N 438.487 4.664 50 10 IJGE COc1cc(C(O)=C(C#N)c2nc(-c3ccc(F)cc3F)cs2)c([N+](=O)[O-])cc1OC 2331293013 JABBLUIGMLUBGU-UHFFFAOYSA-N 445.403 4.964 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)COc2ccccc2[C@@H](C)CC)cc1 14025342 UTMLLBSXUWBPGJ-IBGZPJMESA-N 426.557 4.999 50 10 IJGE COC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1ccc(OCc2ccc(F)cc2)cc1 33339020 WGRSULWHDLUJFH-RGEXLXHISA-N 430.435 4.737 50 10 IJGE O=C(CN(Cc1ccccc1)Cc1ccccc1)N/N=C/c1cccc(Br)c1 59154244 KAQJPVZCBICWON-MFKUBSTISA-N 436.353 4.602 50 10 IJGE O=C(NNC(=O)c1cc(-c2ccco2)nc2ccccc12)c1cnc(-c2cccs2)s1 110576805 MHFIVTPPUYXQLK-UHFFFAOYSA-N 446.513 4.755 50 10 IJGE CCCOc1ccccc1/C=C\C(=O)Oc1ccc(/C=C(/C#N)C(=O)OCC)cc1OCC 207003172 JKNUKPRYSBSRJH-NUOPWSFOSA-N 449.503 4.963 50 10 IJGE N#C/C(=C/NCc1ccc(Br)cc1)C(=O)NC(c1ccccc1)c1ccccc1 216980155 AAKYDYVXMATECF-FXBPSFAMSA-N 446.348 4.852 50 10 IJGE C[C@H]1CCCN(c2ncc(Br)cc2Br)[C@@H]1CCBr 700290424 DMRWQVLRZLZBCP-JOYOIKCWSA-N 441.005 4.997 50 10 IJGE O=S(=O)(NC1(CBr)CCCCCCC1)c1cc(Br)cs1 713473470 RTWJWLWTUFBZAU-UHFFFAOYSA-N 445.242 4.667 50 10 IJGE CC[C@@H](Cl)[C@@H](CC)NC(=O)c1ccc(I)c(Br)c1 721601176 FIVGPDPOXKIYHJ-ZYHUDNBSSA-N 444.538 4.580 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)Cn1c(-c2scnc2C)nc2ccccc21 744356109 FRVDPMMDYJDOAY-UHFFFAOYSA-N 434.477 4.711 50 10 IJGE CCOc1ccc(NNC(=O)C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cc2)cc1 815817206 IBZRIAOZAWEORQ-UHFFFAOYSA-N 425.872 4.613 50 10 IJGE CCc1ccc(OCC(=O)NN=Cc2ccccc2C(F)(F)F)c(Br)c1 1084654712 SMHHJYPCSWVGBY-UHFFFAOYSA-N 429.236 4.559 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cc3c(nc2O)CCCC3)c(C)n1-c1ccc(F)cc1 1538250364 WNZKOUOJMOLBJE-UNOMPAQXSA-N 430.483 4.758 50 10 IJGE C#CCOc1ccc(CNS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)cc1 1663997100 RKJSRYGQGBNYBE-UHFFFAOYSA-N 427.416 4.835 50 10 IJGE CCCCCCCC(=O)NN=Cc1ccc(OC(=O)c2ccc(OC)c(OC)c2)cc1 1772720484 PWTWZAWUHAJDQC-UHFFFAOYSA-N 426.513 4.734 50 10 IJGE O=C(COc1ccccc1Br)NN=Cc1ccc(OCc2ccccc2)cc1 1772754821 XFRIOGQKKOTJBW-UHFFFAOYSA-N 439.309 4.557 50 10 IJGE CCc1nn(C)c2c1[C@H](c1c(OCc3ccccc3)ccc3ccccc13)C(C#N)=C(N)O2 1865704130 OBNBOPYUQFNQBU-DEOSSOPVSA-N 436.515 4.933 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@@H]1c1cccc(F)c1 1865711027 OGXQEPVHFCVEMI-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE CC[C@@H](NC(=O)[C@@H](Cc1ccncc1)c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1866708602 WFHMPOQPMBULSE-XZOQPEGZSA-N 444.560 4.515 50 10 IJGE CC1(C)C[C@H](N(Cc2ccccc2)S(=O)(=O)c2ccc(CCl)c(Cl)c2)CO1 1915479691 FNNDYTMLBDBONI-KRWDZBQOSA-N 428.381 4.837 50 10 IJGE C[C@H]1[C@@H](CBr)CCN1Cc1ccc(Br)cc1Br 1943858579 INMVUCYWQDLNQX-VHSXEESVSA-N 425.990 4.817 50 10 IJGE C[C@@]1(CCBr)CCN1C(=O)c1scc(Br)c1Br 2025223744 NGIGNVDMFDCHHS-LLVKDONJSA-N 446.002 4.663 50 10 IJGE Clc1cc(CN2CC[C@H](CCBr)C2)ccc1I 2026563753 MVLIVNAAGFECOY-JTQLQIEISA-N 428.539 4.552 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCN(c2ncc(Br)cc2CCl)C1 2032233625 DVPOTWVTEYMSPD-UHFFFAOYSA-N 430.724 4.540 50 10 IJGE CN(C(=O)c1c(Br)cccc1Br)C(C)(C)CCBr 2033088876 MYXZCZAHBGWWBB-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE Cc1cc(C(=O)C(C#N)=Cc2ccc(O)c(Br)c2)c(C)n1CC(F)(F)F 2041454881 GZMPUZLZWOUALT-UHFFFAOYSA-N 427.220 4.925 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@H]1CN(C[C@@H](Br)C(F)(F)F)C1CC1 2044702030 XTIZRVSXWYNWLK-UONOGXRCSA-N 429.321 4.566 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCN(c2nc(CCl)ccc2Br)C1 2056935950 ZPECRVJGHIXAMY-UHFFFAOYSA-N 430.724 4.540 50 10 IJGE CCC[C@@H](CBr)CNC(=O)c1cccc(Br)c1Br 2057117504 NJZQJNOEOVNKTD-VIFPVBQESA-N 441.989 4.753 50 10 IJGE C[C@@H](Cl)[C@H](NC(=O)c1cc(Br)sc1Br)C(F)(F)F 2074732939 BDFJQRVPRFFHST-CVYQJGLWSA-N 429.483 4.561 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1ccc(Br)cc1Cl 2090383808 CDZGLRGZQBNAFF-SECBINFHSA-N 429.605 4.739 50 10 IJGE C[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)N(C[C@H](CBr)c2ccccc2)C1 2106787544 ZTURUBRGGVOLQK-NEWSRXKRSA-N 425.411 4.790 50 10 IJGE O=C(c1cc(Br)sc1Br)N1[C@H](CCl)C[C@H]2CCC[C@@H]21 2108400765 ZMAOCJZCAUCFQH-WEDXCCLWSA-N 427.589 4.895 50 10 IJGE C[C@@H](c1cc(Br)cs1)N(C)c1ncc(Br)c(CCl)n1 2130032845 RLQNLBOOJDQAMY-ZETCQYMHSA-N 425.577 4.999 50 10 IJGE Br[C@H](Cc1ccccc1I)c1ccc2c(c1)OCCO2 2143867640 FJVHGPTXWKAUJL-CYBMUJFWSA-N 445.094 4.741 50 10 IJGE CC(C)(C)OC(=O)N1CCc2ccc(NC(=O)[C@@H](Br)C3CCCC3)cc2C1 2167039271 HZKBPJJAEOBUOE-SFHVURJKSA-N 437.378 4.872 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1sc(C)c(Br)c1C 2218969683 PCALAXHLSFYJFH-OIBJUYFYSA-N 444.176 4.707 50 10 IJGE COc1ccc([C@@H](Cl)c2cc(Br)n(C)n2)c(Br)c1Cl 2268265511 GUTQRKLWEWDSER-LLVKDONJSA-N 428.939 4.935 50 10 IJGE C[C@H](CCl)[C@@H]1CCCCN1C(=O)c1ccc(Cl)c(I)c1 2283670667 UWRXSJFJURNKRY-YGRLFVJLSA-N 426.125 4.814 50 10 IJGE O=C(N[C@@H]1C[C@H]2C[C@H]1C[C@@H]2Br)c1cc(Br)c(F)cc1Cl 2285846739 RNXRPZWAXXDHIE-IOALNURASA-N 425.523 4.533 50 10 IJGE N#CC(=Cc1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1)C(=O)Nc1ccccc1C(=O)O 2297306962 MLHYMIKCHGPWBX-UHFFFAOYSA-N 437.795 4.752 50 10 IJGE COc1ccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3ccc([N+](=O)[O-])cc3C)c2C)cc1 2297327801 GIGWTSCIDJQWEX-UHFFFAOYSA-N 430.464 4.865 50 10 IJGE Cc1ccc(C)c(NC(=O)C(C#N)=Cc2ccc(Sc3ncccn3)c([N+](=O)[O-])c2)c1 2297617342 DMYCCGBIJYTNLS-UHFFFAOYSA-N 431.477 4.699 50 10 IJGE C=CC[C@]1(CBr)CCN(Cc2sccc2I)C1 2301071250 LQVSPKNGIWLSKN-CYBMUJFWSA-N 426.161 4.516 50 10 IJGE C[C@@H]1CO[C@](CCl)(Cc2ccc(I)c(Br)c2)C1 2306226166 HJYLTHHUSPWVJA-ZANVPECISA-N 429.523 4.630 50 10 IJGE C=CC[C@@H](Br)[C@H]1CCN1Cc1cc(Cl)ccc1I 2314264726 CJPLICBTMJPERN-TZMCWYRMSA-N 440.550 4.859 50 10 IJGE C[C@@H](CBr)CC1CN(Cc2ccc(Cl)c(I)c2)C1 2315550999 KUKDRSGLSMIJSZ-SNVBAGLBSA-N 442.566 4.798 50 10 IJGE Cc1cc(I)ccc1NC(=O)C(C#N)=CNC(C)(C)CC(C)(C)C 2325406496 TZESJGMDJHXKLP-UHFFFAOYSA-N 439.341 4.750 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(O[C@@H]2CCOc3ccccc32)C1 2340300324 XFENJBIVMNUGFK-XLIONFOSSA-N 426.351 4.691 50 10 IJGE Cc1cnc(N(C)Cc2ccccc2I)cc1CBr 2352280186 TZILDDCDYUXAME-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE ClCc1ccc(Br)c(Cl)c1N1CC(n2ccc(Br)n2)C1 2361656136 CFQSJKRQQYFOFQ-UHFFFAOYSA-N 439.966 4.862 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Cl)c1cc(F)c(F)c(F)c1F 2364226523 MSNSUUCWKIYFBX-ZCFIWIBFSA-N 436.428 4.830 50 10 IJGE Cc1c(CBr)ccc(NS(=O)(=O)c2ccc(Br)s2)c1C 2367941726 DFHXPIKEGOSMPI-UHFFFAOYSA-N 439.194 4.823 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3[C@H]4CC[C@@H]([C@H]3C2)N(C(=O)OC(C)(C)C)C4)C1 2371131630 PPUDINVNWYDILO-XSLAGTTESA-N 441.454 4.765 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)N/N=C2\CCCc3ccccc32)c(Br)c1 12403469 KUUQDSJPYIEALE-LYBHJNIJSA-N 429.358 4.982 50 10 IJGE COc1cccc(O[C@H](C)C(=O)N/N=C/c2cn(Cc3ccccc3)c3ccccc23)c1 40960946 MFMVEEPXWUDUTP-BWJYWGHISA-N 427.504 4.616 50 10 IJGE CCOc1cc(/C=N\NC(=O)Cc2cc(Cl)ccc2SC)cc(Cl)c1OC 169922750 CFFJXPHXBONPFI-JJFYIABZSA-N 427.353 4.815 50 10 IJGE CN(c1ccc([N+](=O)[O-])cc1C=NNC(=O)COc1ccc(Cl)cc1)C1CCCCC1 252596747 CMILCWARGGMRNY-UHFFFAOYSA-N 444.919 4.546 50 10 IJGE C[C@H](CC(C)(C)C)CC(CBr)(CBr)[C@H]1CCS(=O)(=O)C1 709256886 FYBGABQDHBNLID-OLZOCXBDSA-N 432.262 4.660 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)C(C)(C)c1ccccc1 764975346 BSVWVUBJBWTNLG-KTXUMSRNSA-N 437.547 4.853 50 10 IJGE Cc1ccccc1NNC(=O)C(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12 783325997 VBWKNJJUVVYSAQ-UHFFFAOYSA-N 430.439 4.556 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OC[C@H]2Cc3ccccc32)c(-c2ccc(Cl)cc2)n1 803218648 WCIKDLWQMIGDAM-CNSVBDKNSA-N 442.906 4.907 50 10 IJGE COc1ccc(C=NNC(=O)c2cccc(Br)c2)cc1OCc1ccccc1 1084467975 NFRCIZQNTGDOFZ-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE N#Cc1cccc(COc2ccccc2C=NNC(=O)c2ccccc2Br)c1 1084494926 JJPZPEPNFGPGEK-UHFFFAOYSA-N 434.293 4.664 50 10 IJGE C=CCn1c(SCC(=O)NN=C(c2ccccc2)c2ccccc2)nc2ccccc21 1643389060 RDBCIHKNIOFJJY-UHFFFAOYSA-N 426.545 4.883 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2-c1ccc(OC)cc1 1865691477 SXSUDJFAFOLBSB-QHCPKHFHSA-N 442.519 4.616 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865705883 IGOVPDUXWCOMOC-HXUWFJFHSA-N 449.898 4.664 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)c1ccc(I)cn1 1915762007 BTMBUKUHRIXTMH-UHFFFAOYSA-N 445.142 4.866 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]3(CCC[C@H](CI)O3)CC[C@H]21 1935704999 BJUPSZIDYHZWDY-ADAWSYLGSA-N 435.346 4.539 50 10 IJGE C[C@@H]1CO[C@@](CBr)(Cc2ccc(Br)cc2Br)C1 1943840875 DUMBPKKZVPEOJK-TVQRCGJNSA-N 426.974 4.944 50 10 IJGE C[C@]1(CBr)CCCN1C(=O)c1csc(Br)c1Br 1945190563 PDFDPWJIXYAOAT-LLVKDONJSA-N 446.002 4.663 50 10 IJGE CC(C)(C)OC(=O)N[C@@]1(c2ccccc2)CCN(C[C@H](CBr)C2CCC2)C1 1966413738 DEOZSRREHWLFGF-AVRDEDQJSA-N 437.422 4.924 50 10 IJGE C[C@]1(NC(=O)c2cc(Br)sc2Br)CCC[C@H]1Br 2011553898 AMZDSRUOCYZBBX-HQJQHLMTSA-N 446.002 4.709 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1Cc1c(Br)cccc1Br 2018114918 JXWPCVHTGKYFDE-NOZJJQNGSA-N 425.990 4.959 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1C(=O)c1cc(Br)c(Br)s1 2018122768 BASOYSWSNXWEHH-SVRRBLITSA-N 446.002 4.661 50 10 IJGE O=C(CBr)c1ccc(OC(F)(F)F)c(OC(F)F)c1Br 2054830163 DDAYVMSLAGEMFN-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE Cc1cc(Cl)ncc1-n1nc(CBr)c(Br)c1C(F)(F)F 2078913378 LECBWKFZTZAHIC-UHFFFAOYSA-N 433.453 4.905 50 10 IJGE CS(=O)(=O)c1csc([C@H](Br)c2cc(F)ccc2Br)c1 2093074107 IKNXIDNTOSDGJJ-GFCCVEGCSA-N 428.142 4.538 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@H](Cl)CC2(CCC2)C1 2094999027 GQQRMRFXDJLJLE-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE C[C@@H]1CCOC[C@@H]1O[C@](C)(CI)c1ccccc1Br 2096205179 YLIHSNZELNDMLJ-BYCMXARLSA-N 439.131 4.541 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2CN(CC3(CBr)CCCCCC3)C[C@]2(C)C1 2106784208 HBMXKOHILFDLHP-FXAWDEMLSA-N 429.443 4.911 50 10 IJGE C[C@H]1CN(C(=O)c2cc(Cl)ccc2I)CC[C@H]1CCCl 2172473460 KTYFLYMOIGGGFQ-WDEREUQCSA-N 426.125 4.672 50 10 IJGE Cc1cccc(C(=O)N2C[C@H](Br)CCC23CCC3)c1I 2174539390 DHHMWHKWZBZJDD-GFCCVEGCSA-N 448.142 4.522 50 10 IJGE CN[C@H](c1c(Br)cc(C)c(Br)c1C)[C@H]1C[C@H]1Br 2214654178 ZGQHTYQVBPUNJZ-RWEMILLDSA-N 425.990 4.872 50 10 IJGE Cc1ccc(I)c([C@H](Br)c2ccc3nc(O)oc3c2)c1 2241002169 TYWAYORHLJXCTJ-CQSZACIVSA-N 444.066 4.931 50 10 IJGE Fc1cccc([C@@H](CI)O[C@H]2CCN(Cc3ccccc3)C2)c1 2244798874 CVDBIPRHEZHKJQ-RBUKOAKNSA-N 425.285 4.593 50 10 IJGE CC(C)(C)OC(=O)NCc1cc(F)cc(NC(=O)[C@@H](Br)C2CCCC2)c1 2265786029 FWFHUGVRYGYJBV-INIZCTEOSA-N 429.330 4.743 50 10 IJGE O=S(=O)(c1cncc(CBr)c1)N(Cc1ccccc1)CC1CCCCC1 2268058352 BJGLOTHQWKXNBI-UHFFFAOYSA-N 437.403 4.748 50 10 IJGE CC[C@@H]1[C@H](CBr)CCN1C(=O)c1cc(F)c(Br)cc1Cl 2282978013 HZWBQYOTLUZQSZ-ISVAXAHUSA-N 427.539 4.877 50 10 IJGE COc1ccc(CNC(=O)C(C#N)=Cc2ccc(OCc3ccccc3F)c(OC)c2)cc1 2294168374 HRUFRDZVDJHSET-UHFFFAOYSA-N 446.478 4.645 50 10 IJGE N#CC(=Cc1cc(Br)cc(Br)c1O)C(=O)Nc1ccc(F)cc1 2297506193 AHMBNBJWUVFJJE-UHFFFAOYSA-N 440.066 4.602 50 10 IJGE C[C@H]1[C@H](Br)CCCN1Cc1ccc(Cl)cc1I 2302316571 XADUHQGSFJQNIK-JOYOIKCWSA-N 428.539 4.692 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@H](Cc2ccc(C)c(C)c2)C(=O)N1c1ccc(CC)cc1 2314593109 HQPFPKPDKGOTIJ-HSZRJFAPSA-N 445.588 4.594 50 10 IJGE BrC[C@]12C[C@H](CCN1Cc1c(Br)cccc1Br)C2 2315178547 MRTVGJODHHIWAF-WJONMLJTSA-N 438.001 4.961 50 10 IJGE Clc1ccc(CN2CCC[C@@H](CBr)CC2)cc1I 2315550930 JUIHRSUWSZRFHD-LLVKDONJSA-N 442.566 4.942 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)n2)cc1 2331273576 RBLYQYRLBVQZEW-GOSISDBHSA-N 431.517 4.660 50 10 IJGE CC[C@H](CBr)CN1CC[C@H](CCNC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2337614539 XAPQGAIDLYBREZ-QLFBSQMISA-N 445.364 4.965 50 10 IJGE O=C(N[C@H]1C[C@@H]2C[C@H]1C[C@H]2Br)c1cc(F)c(Br)cc1Cl 2359286120 JUORDSVHTGFGKE-FWAJVQJESA-N 425.523 4.533 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(O[C@H]2CCOc3ccc(F)cc32)CC1 2364533342 NZXAGXCCBGFHJS-KRWDZBQOSA-N 444.341 4.831 50 10 IJGE COc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(C)cc2)CCC3)cc1 40804734 GLAJIHNEIXIFFN-NHFJDJAPSA-N 431.492 4.628 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(F)cc2)CCC3)cc1 40811979 LZJWBQZKWICEHP-NHFJDJAPSA-N 434.467 4.979 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@H]1Cl)c1cc(Br)c(Br)s1 137615569 UGTRSIJUGNRNAL-PWSUYJOCSA-N 435.568 4.908 50 10 IJGE Brc1ccccc1[C@H](CI)OC[C@H]1CCCCO1 161968428 NVTFFMVTKMWZFF-RISCZKNCSA-N 425.104 4.511 50 10 IJGE Cc1cc(C)cc(N/C=C(/C#N)C(=O)Nc2ccc(I)cc2C)c1 217254181 JQPMSLLRGNCIIS-PTNGSMBKSA-N 431.277 4.675 50 10 IJGE CCC[C@H](CCBr)CNS(=O)(=O)c1ccc(Cl)c(Br)c1 227506212 BPWXBNUKXBRUBA-SNVBAGLBSA-N 447.620 4.582 50 10 IJGE CC[C@@](C)(CCBr)NC(=O)c1cc(Cl)ccc1I 228583222 OQHIPSFZCFQGKL-ZDUSSCGKSA-N 444.538 4.628 50 10 IJGE C[C@@H](Br)CCN(C)C(=O)c1cc(Br)sc1Br 235163042 BDLLYYDGNFLPSI-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE O=C(CCC(=O)Nc1cccc(Br)c1)NN=Cc1c(Cl)cccc1Cl 254709832 DWYIELJHKDAQHX-UHFFFAOYSA-N 443.128 4.625 50 10 IJGE BrCc1ccc(N2C[C@H]3C[C@H]2CN3Cc2ccccc2)cc1Br 381093847 XMZGUCKAAGDVSA-MSOLQXFVSA-N 436.191 4.807 50 10 IJGE Cc1cccc([C@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CI)c1 382695002 XSTBSIAYTHXGFT-RBUKOAKNSA-N 435.305 4.782 50 10 IJGE BrCc1cc(Br)cc(Br)c1OC1CCOCC1 384114906 YOLAUJXCRJMHJV-UHFFFAOYSA-N 428.946 4.664 50 10 IJGE O=C(CCCN1C(=O)c2ccccc2C1=O)Nc1ccccc1-c1nc(CCl)cs1 392923451 BLGIKRQFTTUZMQ-UHFFFAOYSA-N 439.924 4.564 50 10 IJGE FC(F)(F)c1cc(Br)c(I)c(CBr)c1 575693869 CHBLLPNGSSOYFQ-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE CC(C)(C)[C@@H](Br)CNC(=O)c1scc(Br)c1Br 705439301 OQFCCTTZCJGJBR-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE O=C(NN=Cc1ccc(OCc2ccccc2F)cc1)c1cccc(Br)c1 725405631 SFXZXYREDRQQKU-UHFFFAOYSA-N 427.273 4.931 50 10 IJGE C[C@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1ccccc1Oc1ccccc1 726273191 YTWLXAFRUVLHNF-KRWDZBQOSA-N 426.476 4.732 50 10 IJGE O=C(NNc1cccc(F)c1F)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccco1 743722867 YNNZUINUGOHSLQ-UHFFFAOYSA-N 445.429 4.775 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)OCc2noc(-c3ccccc3O)n2)c(C)n1CCC(C)C 782428620 YHTUDIINZLCLSC-UNOMPAQXSA-N 434.496 4.557 50 10 IJGE CCOc1ccc(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cc1F 918669573 FKRPFMGFPRWPRL-AQTBWJFISA-N 429.455 4.547 50 10 IJGE Cc1ccc(-c2nc(C)c(C(=O)NNc3nc(-c4ccccn4)nc(C)c3C)s2)cc1 1160813314 WTDMVMXBXPISQF-UHFFFAOYSA-N 430.537 4.653 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cnn(-c2ccc(Cl)cc2Cl)c1 1167430805 SQORLPOTUVVJRQ-UHFFFAOYSA-N 431.308 4.542 50 10 IJGE C/C(=C/C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl)c1ccc(F)cc1 1353130340 IXWLBLDMCHDVKW-QBFSEMIESA-N 425.287 4.542 50 10 IJGE CC(=O)N(c1cccc(Cl)c1)c1nc(CNC[C@]2(C)C[C@H]2Br)cs1 1474640813 NTQHVQRZBTUKAF-WBVHZDCISA-N 428.783 4.744 50 10 IJGE CC(=O)c1cccc(O[C@H](C)C(=O)NNc2cc(C(F)(F)F)ccc2Br)c1 1639275329 BPTVLWOPSPDNPF-LLVKDONJSA-N 445.235 4.581 50 10 IJGE CCCc1nn(-c2ccccc2)c2c1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706311 SRNSQKWTENOAIY-LJQANCHMSA-N 435.871 4.605 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)n2)cc1C 1872746441 IKPZUTDCSJIBND-GQEFARFYSA-N 445.544 4.969 50 10 IJGE C[C@H](NCc1ccc(Br)cc1Br)c1nnc(CCl)s1 1877574109 SKWHNGMCJPVJMC-ZETCQYMHSA-N 425.577 4.653 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CN(C(=O)OC(C)(C)C)[C@H]1C(C)(C)C 1881339346 KHJRFKRVDQLGRZ-MELADBBJSA-N 435.403 4.556 50 10 IJGE Cc1cc(Br)c(CBr)c(N(C)C[C@@H]2C[C@@H]2Br)c1 1910158826 AYFVBLBVJLEXOX-ONGXEEELSA-N 425.990 4.872 50 10 IJGE O=S(=O)(C1CC(OCc2ccccc2)C1)N(Cc1ccccc1)[C@@H](CCl)C1CC1 1958928514 PQHYRSWBGRYSFP-VNXZQDSDSA-N 434.001 4.584 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1C(=O)c1cc(Br)c(Br)s1 2018118417 BASOYSWSNXWEHH-SVRRBLITSA-N 446.002 4.661 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1Cc1ccc(I)c(Cl)c1 2026563770 MZEMDOMTOHQNAP-ZANVPECISA-N 428.539 4.692 50 10 IJGE CCCN(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C[C@H](Br)C(F)(F)F 2044700270 QAXHQFDYNUHLPX-KBPBESRZSA-N 431.337 4.814 50 10 IJGE CCO[C@H](C)c1nc(CN(C)C[C@@H](Br)COCc2ccccc2)cs1 2050592377 ZQSSAVVRTAQGSH-NVXWUHKLSA-N 427.408 4.653 50 10 IJGE C[C@@H]1CCN(Cc2ccc(I)c(Cl)c2)C[C@@H]1CBr 2086659011 SFHKLFZPQITKES-PWSUYJOCSA-N 442.566 4.798 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@H]1CCCN(C[C@H](Br)C(F)(F)F)C1 2106789425 YKAXEOQZXXIDGF-ZNMIVQPWSA-N 443.348 4.814 50 10 IJGE Cc1nn(C)c2sc(C(=O)N(Cc3ccccc3)[C@H](CBr)C3CC3)cc12 2118614073 RAHFCGCAWGDIJV-QGZVFWFLSA-N 432.387 4.759 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@H]1CCCCN1C[C@@H](CBr)C1CCC1 2128719417 FCLCXFSOVAOODS-HZPDHXFCSA-N 439.385 4.812 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@@H](Br)c2cc(Cl)c(Br)s2)C1 2137224445 BGFAHVSJLXOYHU-JWYUURKGSA-N 448.629 4.815 50 10 IJGE Fc1ccc(N2CCC[C@]3(CN(Cc4ccccc4)CCO3)C2)c(CBr)c1 2151736818 BRGXBSRJEZKDOO-QFIPXVFZSA-N 433.365 4.592 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](CN(C(=O)[C@H](Br)C2CCCC2)C2CC2)C1 2167033416 RACQLPPRUOBECR-MAUKXSAKSA-N 443.426 4.578 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)C1C[C@@H]2CC[C@H](C1)O2 2181337667 TXXKKHNJYLYLFN-LLTIUZATSA-N 449.126 4.620 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(C[C@@H](CBr)c3ccccc3)C[C@@H]2C1 2206174413 DBGXSTWZSRQNFE-IYWMVGAKSA-N 437.422 4.790 50 10 IJGE BrC[C@@]12CCCC[C@@H]1CN(Cc1ccc(I)cc1)C2 2230624055 QQEAUMLPPLYMGF-GDBMZVCRSA-N 434.159 4.678 50 10 IJGE CCC[C@@H](CCBr)NC(=O)c1ccc(Cl)c(I)c1 2256385263 JZEIYAROXOJCFG-JTQLQIEISA-N 444.538 4.628 50 10 IJGE CCCC1(O[C@@H](CI)c2ccccc2Br)COC1 2260091329 MEMOZVOBQOWUTK-ZDUSSCGKSA-N 425.104 4.511 50 10 IJGE COC1(COc2c(Br)cc(Cl)cc2CBr)CCOCC1 2280291719 NNHMWCHCOLYSSJ-UHFFFAOYSA-N 428.548 4.572 50 10 IJGE COc1ccc(NC(=O)C(C#N)=Cc2ccc(OCCOc3cccc(OC)c3)cc2)cc1 2293128367 MSQJHOBKCVVTHS-UHFFFAOYSA-N 444.487 4.707 50 10 IJGE CCC[C@@H](CBr)CN1CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2312817104 RNBGRPSWKPEBFA-MELADBBJSA-N 431.337 4.718 50 10 IJGE CC(=O)c1ccc(-c2ccc(C=C3C(=O)N(Cc4ccco4)C(=O)C(C#N)=C3C)o2)cc1 2314618866 VRWBGVQAMIHFEX-UHFFFAOYSA-N 426.428 4.535 50 10 IJGE CCCCCCCCCOc1ccc(C=NNC(=O)c2cccn(C)c2=O)cc1OCC 2323627733 PEFGEFBIBKGEDU-UHFFFAOYSA-N 441.572 4.677 50 10 IJGE C[C@@H](C(O)=C(C#N)c1nc(-c2ccccc2Cl)cs1)N1C(=O)c2ccccc2C1=O 2331265863 JIJDYTUOWCGQGP-LBPRGKRZSA-N 435.892 4.941 50 10 IJGE CCOc1ccc(-c2csc(C(C#N)=C(O)[C@@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1 2331305261 JTJOFCNHPTVQGE-CQSZACIVSA-N 445.500 4.686 50 10 IJGE CC(CBr)(CBr)NC(=O)CCc1cc(Cl)cc(Cl)c1 2341170533 ZZKBYYHLXUFAKF-UHFFFAOYSA-N 431.983 4.591 50 10 IJGE CC(C)C[C@@H](CBr)CN1C[C@]23CCC[C@]2(C1)CN(C(=O)OC(C)(C)C)C3 2353822702 QRTGUCLWVFJISJ-YYWHXJBOSA-N 429.443 4.767 50 10 IJGE CCCCOc1ccc(/C=C(/C#N)C(=O)Oc2cccc(/C=C(\C#N)C(=O)OCC)c2)cc1 33689071 QEMGNNAHVDNOKI-JDOZLOAYSA-N 444.487 4.848 50 10 IJGE COCCNC(=O)/C(C#N)=C\c1cn(Cc2ccc(Cl)c(Cl)c2)c2ccccc12 33935002 WXLBKOPPJHRNFZ-WJDWOHSUSA-N 428.319 4.666 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)COc2ccccc2)CCC3)cc1C 40816040 RODVTHHFJZGOPP-SGWCAAJKSA-N 445.519 4.693 50 10 IJGE COc1cccc(O[C@@H](C)C(=O)N/N=C/c2ccc(OCc3ccccc3Cl)cc2)c1 40960629 SFMZSNMXJIYCOX-AEIQVQRHSA-N 438.911 4.845 50 10 IJGE COc1cc(Cl)c(/C=N/NC(=O)c2ccc(NC(=O)C3CCCCC3)cc2)cc1OC 66202208 DMXBRALEVUMKNT-AFUMVMLFSA-N 443.931 4.640 50 10 IJGE COc1ccc(Cc2nc3cc(C(=O)N/N=C\c4cccc(OC(C)C)c4)ccc3[nH]2)cc1 169925546 KXSAZLQFZBNXHQ-YUMHPJSZSA-N 442.519 4.713 50 10 IJGE COc1ccc(/C=N/NC(=O)c2cc3ccccc3n2C)cc1OCc1ccc(C)cc1 169926004 GVBKVTXULDRHMZ-JVWAILMASA-N 427.504 4.838 50 10 IJGE C[C@@H]1C[C@H](O[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2I)CC(C)(C)C1 231313318 CYWJNCPXJSGFOO-CBBWQLFWSA-N 437.362 4.641 50 10 IJGE C[C@@H]1C[C@H](O[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2I)CC(C)(C)C1 299976521 CYWJNCPXJSGFOO-QPSCCSFWSA-N 437.362 4.641 50 10 IJGE CCOc1ccc([C@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)cc1OC 725446995 MTAMEOVTIYGAPT-RBUKOAKNSA-N 448.357 4.841 50 10 IJGE CC(=O)N(C)c1ccccc1NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(F)cc2)c1C 735640598 LBCFMZSDAKFTJI-XSFVSMFZSA-N 430.483 4.762 50 10 IJGE C[C@@H](NC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1)c1ccc(Cl)cc1Cl 743505051 AEHGGXOJQIYWFN-SECBINFHSA-N 433.242 4.692 50 10 IJGE Cc1cc(C(=O)NNc2ccc(Br)cc2F)ccc1NC(=O)c1cccs1 759656919 BCELEHMNOILUQT-UHFFFAOYSA-N 448.317 4.967 50 10 IJGE O=C(CSc1nnc(-c2ccco2)n1C1CCCCC1)NNc1cccc(Cl)c1 764715388 BWUWXNXSFPCVOS-UHFFFAOYSA-N 431.949 4.932 50 10 IJGE CSc1cnn(-c2ccccc2)c1NC(=O)NNc1ccc(C#N)cc1C(F)(F)F 799404363 SIQQQFFPRXXVHD-UHFFFAOYSA-N 432.431 4.633 50 10 IJGE CCOc1ccc(-c2nc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)cs2)cc1 799748547 RXLODFFIELROIY-UHFFFAOYSA-N 432.427 4.856 50 10 IJGE Cc1cc(C)cc(NC(=O)C(=O)NN=Cc2ccc(OCc3ccccc3Cl)cc2)c1 1083885877 ALNLHFSQSFLROT-UHFFFAOYSA-N 435.911 4.625 50 10 IJGE C#CC(C)(C)N(NC(=O)Nc1cc(F)ccc1F)C(=O)c1cc(Cl)cc(Cl)c1 1088680923 BPVDTQFYPDUIME-UHFFFAOYSA-N 426.250 4.862 50 10 IJGE Cc1nn(Cc2ccccc2F)c2c1[C@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 1865686723 ZSLWWQXKIQRRSK-LJQANCHMSA-N 429.282 4.904 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2-c1ccccn1 1865703199 POYATSNQKDPDQQ-QHCPKHFHSA-N 449.514 4.941 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] 1915095980 DFYCWWBFZPZHNG-CYBMUJFWSA-N 427.245 4.689 50 10 IJGE CC(C)(CCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1F 1915750646 WWTBOIBJHSIPIJ-UHFFFAOYSA-N 434.758 4.797 50 10 IJGE BrCC[C@H]1CCCN1Cc1cccc(Br)c1Br 1943881059 NEOMIKMBZBQTAL-LLVKDONJSA-N 425.990 4.961 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@@]21CC[C@@](C)(CI)O1 1987456097 OHNOMBTVSTVBAU-WMZOPIPTSA-N 435.346 4.540 50 10 IJGE CCCN(Cc1ccccc1)S(=O)(=O)c1ccc(OCC)c(CBr)c1 2059289370 QGHAIMXYFWBJGR-UHFFFAOYSA-N 426.376 4.581 50 10 IJGE ClCCc1cccc(Nc2ncc(I)cc2Br)c1 2069529713 SINCJLAASHSCAB-UHFFFAOYSA-N 437.506 4.974 50 10 IJGE CC(=O)[C@H](Br)[C@@H](C)c1ccc(C(F)(F)F)cc1I 2083649907 NHYBMOGTFIJWLF-UPONEAKYSA-N 435.021 4.766 50 10 IJGE C[C@@H]1C[C@H](n2c(CCCl)nc3cncc(Br)c32)CN1Cc1ccccc1 2095436934 LAMLRKMDQVSMAX-ZBFHGGJFSA-N 433.781 4.811 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCc2ccccc2N(C[C@H](Br)C(F)(F)F)C1 2106781517 INWWHRCNPURBFF-ZFWWWQNUSA-N 437.300 4.658 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 2106784110 GDNQZRZEIAZLPC-OALUTQOASA-N 425.411 4.887 50 10 IJGE C[C@H](CCCCCI)NCCOc1cccc(Br)c1 2117889539 WDKQCZDRGULCFZ-CYBMUJFWSA-N 440.163 4.801 50 10 IJGE ClCc1c(Br)cccc1N1CC[C@H]2OCCN(Cc3ccccc3)[C@H]2C1 2129055711 RWNCQYUZVUTZRN-LEWJYISDSA-N 435.793 4.668 50 10 IJGE CCCN(C1CCN(Cc2ccccc2)CC1)S(=O)(=O)c1ccsc1CCl 2143614094 JJTMPGKSFKXBAH-UHFFFAOYSA-N 427.035 4.552 50 10 IJGE C[C@@H]1CCCN(C(=O)c2ccc(CBr)cc2)[C@@H]1CCNC(=O)OC(C)(C)C 2163053583 ORAIENQOOKTILC-CRAIPNDOSA-N 439.394 4.737 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@H](CBr)C2CCC2)[C@@H](C(F)(F)F)C1 2266310595 QRPKYRVZWKAWNO-RRFJBIMHSA-N 443.348 4.718 50 10 IJGE CC(C)[C@@H](CBr)N(C)C(=O)c1cc(Br)sc1Br 2302536260 KUXWJUISNQTJOX-MRVPVSSYSA-N 448.018 4.765 50 10 IJGE COCCCN1C(=O)C(=Cc2ccc(-c3cccc(Cl)c3Cl)o2)C(C)=C(C#N)C1=O 2314617881 CIYVXUNPNOBXBQ-UHFFFAOYSA-N 445.302 4.882 50 10 IJGE N#CC(=CNCCc1ccc(Br)cc1)C(=O)Nc1cccc(C(F)(F)F)c1 2324412907 GZTWDCLUYGAYOU-UHFFFAOYSA-N 438.247 4.646 50 10 IJGE COc1cc(CBr)cc(N(C)[C@@H]2C[C@@H]3C[C@@H](OCc4ccccc4)C[C@H]32)n1 2364794815 IGTIUADAMJVDFB-MTQWCTHYSA-N 431.374 4.805 50 10 IJGE COc1ccc([C@H]2CC(=O)N3CN(c4cccc(Cl)c4)CSC3=C2C#N)cc1OC 9693113 VNGMFBXVPVLLGY-QGZVFWFLSA-N 441.940 4.577 50 10 IJGE COc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccccc1Cl 38650962 TUCHLZZQJWEMNO-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE Br[C@@H](c1ccc(I)cc1)c1ccc2c(c1)OCCO2 109851212 XETLBHRTLXHOJY-HNNXBMFYSA-N 431.067 4.547 50 10 IJGE CCCCN(CCCl)S(=O)(=O)c1cc(Br)c(C)cc1Br 155817819 RCFHVLSNJZFYBY-UHFFFAOYSA-N 447.620 4.550 50 10 IJGE CC[C@@H](Br)c1cn(-c2c(Br)cc(C)cc2Br)nn1 163051702 AUKVEPQJADMVAA-MRVPVSSYSA-N 437.961 4.947 50 10 IJGE CCCCCCOc1ccc(/C=C(/C#N)C(=O)Nc2nnc(C3CC3)s2)cc1OC 207200216 YDZZWOHMICHUGW-ATVHPVEESA-N 426.542 4.929 50 10 IJGE CCCOc1ccc(Br)cc1C=NNC(=O)[C@H](C)Oc1cccc(Cl)c1 252622547 NXXMBBDGUCEPJC-ZDUSSCGKSA-N 439.737 4.809 50 10 IJGE O=C(Cn1cc(C=NNC(=O)Nc2ccccc2)c2ccccc21)Nc1ccc(F)cc1 254386563 KKCKMYOZOMGUEJ-UHFFFAOYSA-N 429.455 4.575 50 10 IJGE COc1cc(C=NNC(=O)Cc2cccc3ccccc23)ccc1OC(=O)c1ccccc1 263631802 WPJGJUWLELAWOX-UHFFFAOYSA-N 438.483 4.760 50 10 IJGE O=S(=O)(NCCCN(Cc1ccccc1)Cc1ccccc1)c1cccc(CCl)c1 390525656 IVLLUJNDKHTTFB-UHFFFAOYSA-N 443.012 4.796 50 10 IJGE C[C@@H](Br)C[C@@H](C)Nc1ncc(C(F)(F)F)cc1I 686108134 ASMQZUUOHRZFOD-RNFRBKRXSA-N 437.041 4.679 50 10 IJGE O=C(NCC1(N(Cc2ccccc2)Cc2ccccc2)COC1)c1cccc(CCl)c1 705859931 GUKSHCCDQKECGN-UHFFFAOYSA-N 434.967 4.627 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)nn1)[C@@H](Oc1ccc(F)c(Cl)c1)c1ccccc1 755191821 SEOQXJHDMYRAAZ-KRWDZBQOSA-N 440.784 4.551 50 10 IJGE O=C(NNc1cccc(F)c1F)C(=O)Nc1cccc(Sc2ccc(Cl)cc2)c1 785017630 XYJGSVIYENRKSV-UHFFFAOYSA-N 433.867 4.851 50 10 IJGE COCCn1c(C)c(C)c2cc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)ccc21 799750337 DQBOBNMLPIDAGE-UHFFFAOYSA-N 430.430 4.552 50 10 IJGE CC(C)OCc1ccc(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cc1 919996440 FYOQRVLKPQEDQW-PXLXIMEGSA-N 439.519 4.934 50 10 IJGE Cc1cc(C=NNC(=O)CSCc2ccc([N+](=O)[O-])cc2)c(C)n1-c1ccc(F)cc1 1084008313 RYHOZGNCCHNWHB-UHFFFAOYSA-N 440.500 4.525 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](C(=O)NNc1nc2ccccc2[nH]c1=S)C1CCCCCC1 1470321673 WUBAVLLRBOEPCT-QGZVFWFLSA-N 445.589 4.599 50 10 IJGE C=CC[C@@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc3ccccc23)c1C)C(=O)OCC 1632655802 DNWZYZJEGVBWKG-GOOXQAOHSA-N 441.531 4.778 50 10 IJGE COc1cc(C=NNC(=O)COc2ccccc2Cl)ccc1OCc1ccc(C)cc1 1772754706 QMGFANUNAHECIX-UHFFFAOYSA-N 438.911 4.765 50 10 IJGE CCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1cc(C)ccc1O)C(C#N)=C(N)O2 1865687034 HWNITEXSOPTEOK-IBGZPJMESA-N 441.318 4.974 50 10 IJGE CC1(C)C[C@@H](Br)CN1Cc1cc(Cl)ccc1I 1949215733 OGMMAXDEKPCIFA-SNVBAGLBSA-N 428.539 4.692 50 10 IJGE CC[C@@H](CCCCl)NC(=O)c1ccc(I)c(Br)c1 2036516619 VBYHZFKIWYYVTB-JTQLQIEISA-N 444.538 4.581 50 10 IJGE BrCc1cc(C2CCC2)nn1Cc1ccccc1I 2070034504 QVYOOUPMBVRJSW-UHFFFAOYSA-N 431.115 4.698 50 10 IJGE COCc1ccccc1Cn1nc(CBr)c(Br)c1C(F)(F)F 2079228852 AQNXVEGOHPNCMO-UHFFFAOYSA-N 442.073 4.754 50 10 IJGE FC1(F)[C@@H]2COC[C@]21[C@H](Br)c1ccc(Br)cc1Br 2083331236 XDUYFOWUOBZVPV-GMTAPVOTSA-N 446.911 4.929 50 10 IJGE C[C@]1(CCBr)CCN1C(=O)c1cc(Br)cc(Br)c1 2084699429 HBHWTEUOUQOPQB-ZDUSSCGKSA-N 439.973 4.601 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CC2(CBr)CCCC2)C[C@@H]1c1ccccc1 2163057775 DZQFOAFMWBTDRN-RTBURBONSA-N 437.422 4.934 50 10 IJGE O=C(NCC[C@H]1CCCC[C@H]1Cl)c1cc(Cl)ccc1I 2179638745 RVJOYGLBLHWYJU-ZWNOBZJWSA-N 426.125 4.862 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@H]1CCCCN1C(=O)c1ccc(CBr)cc1 2208161525 DHCJRWILYOBQIT-QGZVFWFLSA-N 439.394 4.880 50 10 IJGE ClCc1ccc(Br)cc1OCCOCCOCCOCc1ccccc1 2227770220 DOZYDNLZOAPLAR-UHFFFAOYSA-N 443.765 4.817 50 10 IJGE Cc1ccc(C(=O)N2[C@H]3CCC[C@@H](Br)[C@H]2CC3)cc1I 2232844590 YFRNBUZQMAJGLT-GZBFAFLISA-N 448.142 4.520 50 10 IJGE CC(C)(C)OC(=O)N1C[C@](C)(CNC(=O)c2ccc(CBr)cc2)CC1(C)C 2236681365 UXHCCNGUXQKAEY-NRFANRHFSA-N 439.394 4.737 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@H](Br)c1nn(C)cc1Br 2264361312 RWSYOZMOVFRRTN-NSHDSACASA-N 428.939 4.982 50 10 IJGE CC[C@@H](C)N(CCCl)Cc1ccc(I)c(Br)c1 2306232220 RLVCUKSRUJAJFQ-SNVBAGLBSA-N 430.555 4.893 50 10 IJGE BrC[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(Br)c1Br 2309693974 JNSYZZFYZKXGAO-LOWVWBTDSA-N 438.001 4.959 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@H](Cc2ccccc2F)C(=O)N1c1ccc(C(C)C)cc1 2314593440 MXSMVMPYFGKAKB-JOCHJYFZSA-N 449.551 4.678 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)c(I)c2)CC[C@@H]1CBr 2315554087 AXEIHBZFBOURSO-CMPLNLGQSA-N 442.566 4.798 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C)CN(C[C@](C)(CBr)C(C)(C)C)CC1(F)F 2352107323 MXWBFVBKHHPCNS-ZWKOTPCHSA-N 441.401 4.916 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Br)[C@]12COC[C@H]1C2(F)F 2358058993 RPAAAVVQTOAOLF-JLLWLGSASA-N 432.486 4.829 50 10 IJGE CC(C)(C)[C@](C)(CBr)CN1CCC[C@@]2(CN(Cc3ccccc3)CCO2)C1 2380175693 LZXADVYEONFSLJ-DHIUTWEWSA-N 437.466 4.801 50 10 IJGE CCOc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCc3ccc(C(=O)O)cc3)cc2)cc1 2305371 QPTOIDHPXJTIMP-RCCKNPSSSA-N 442.471 4.908 50 10 IJGE O=C(COc1ccccc1-c1ccccc1)NNC(=O)c1ccc(-c2ccc(F)cc2)o1 17202081 IAJNFWRWMUARTP-UHFFFAOYSA-N 430.435 4.593 50 10 IJGE COc1ccc(C(=O)NN=C2CCN[C@H]3CCCC[C@H]23)cc1COc1ccccc1Cl 33796091 MDTKETGJOMDZSA-ICSRJNTNSA-N 441.959 4.566 50 10 IJGE C/C(O)=N/S(=O)(=O)c1ccc(-c2ccc(/C=C(\C#N)c3nc4ccccc4[nH]3)o2)cc1 33935936 AOZHAOOJPIGVCR-FOWTUZBSSA-N 432.461 4.552 50 10 IJGE COc1ccc(Cl)cc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccco1)CCC2 40814396 PEIUNLABMSQKFP-AFUMVMLFSA-N 441.871 4.566 50 10 IJGE CCOC(=O)c1c(NC(=O)N/N=C/c2c(O)ccc3ccccc23)sc2c1CCCC2 40846036 FLEMPPAHKYBUNO-ZMOGYAJESA-N 437.521 4.818 50 10 IJGE O=C(N/N=C/c1ccc(N2CCCCCC2)o1)c1cc2cc(Br)ccc2o1 59304784 IEEQJJDLZRBUCS-LPYMAVHISA-N 430.302 4.933 50 10 IJGE COc1ccc(/C=N\NC(=O)Cc2cc(Cl)ccc2SC)cc1Br 169922619 AXHVJPSVORHAPT-JMIUGGIZSA-N 427.751 4.526 50 10 IJGE N#C/C(=C/N(Cc1ccccc1)c1ccccc1)C(=O)N1CCN(c2ccc(F)cc2)CC1 217237374 BAGNICOXEHSHAK-LNVKXUELSA-N 440.522 4.589 50 10 IJGE CCC(CCl)(CCl)NS(=O)(=O)c1c(Cl)cc(Br)cc1Cl 232948092 HZWVEHXEOSFBOZ-UHFFFAOYSA-N 444.005 4.661 50 10 IJGE CC(=O)[C@H](Br)[C@@H](C)c1ccc(I)cc1Br 300916718 VMTGDOVUPIPFMX-UPONEAKYSA-N 445.920 4.510 50 10 IJGE ClCc1ccc(N2CC[C@H](N3CCN(Cc4ccccc4)CC3)C2)c(Br)c1 312628953 IJCXQTLOVDKKLJ-FQEVSTJZSA-N 448.836 4.584 50 10 IJGE CC[C@H](Br)[C@@H](CC)NC(=O)c1cc(Br)ccc1Br 313094312 VTXSXJMQDQFIMU-CMPLNLGQSA-N 441.989 4.894 50 10 IJGE COc1cc(Br)c([C@@H]2CCC[C@H](CI)O2)cc1OC 382199635 FSXCUUUQBRHBPC-SKDRFNHKSA-N 441.103 4.512 50 10 IJGE COc1ccc([C@@H](Br)c2ccc(F)cc2I)s1 383674032 OXIBDLHMSBJAGC-LBPRGKRZSA-N 427.076 4.985 50 10 IJGE CCN(C[C@@H](C)Br)C(=O)c1cc(Br)c(Br)s1 691306116 JARGQJDKUZYOCZ-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE C[C@H](CCl)[C@@H]1CCCCN1C(=O)c1ccc(I)c(Cl)c1 696714638 POUUULKOJJGAHW-YGRLFVJLSA-N 426.125 4.814 50 10 IJGE O=S(=O)(CCC(CBr)(CBr)C1CCCC1)C1CCCC1 699980991 CWZBIYCEEWYZOQ-UHFFFAOYSA-N 430.246 4.700 50 10 IJGE C[C@H](NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1ccccc1Oc1ccccc1 725874790 IZQOOFBOVGVGHE-KRWDZBQOSA-N 428.492 4.676 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)Nc2ccc(N3CCCC3)cc2)c(-c2ccccc2)n1 914470380 FSNINUJWXPDDOZ-HEHNFIMWSA-N 436.519 4.610 50 10 IJGE Cc1cccc(Cn2cc(C=NNC(=O)CC[C@@H](O)c3ccccc3)c3ccccc32)c1 1084281776 BKDLQPJGXQKYQF-AREMUKBSSA-N 425.532 4.962 50 10 IJGE Cc1sc(-n2c(C)cc(C=NNC(=O)CC[C@@H](O)c3ccccc3)c2C)c(C#N)c1C 1084467337 WEVJZUOCIHAGHU-JOCHJYFZSA-N 434.565 4.608 50 10 IJGE O=C(Cc1ccccc1)NN=C1C(=O)N(C(c2ccccc2)c2ccccc2)c2ccccc21 1084578922 PPWSMGNCNDNTCJ-UHFFFAOYSA-N 445.522 4.886 50 10 IJGE Cc1nc(-c2ccc(F)cc2)ccc1C(=O)NNC(=O)CCCc1ccc(Cl)cc1 1865758126 KPUBYZQMDMUHKD-UHFFFAOYSA-N 425.891 4.633 50 10 IJGE CCCSc1ccccc1C(=O)NNC(=O)c1sc(Cc2ccccc2)nc1C 1865845044 FTHCSKZYGVXMPE-UHFFFAOYSA-N 425.579 4.619 50 10 IJGE CC[C@@H](NC(=O)Cc1nc(-c2ccc(C)cc2)oc1C)C(=O)Nc1ccc(SC#N)cc1 1866652309 MDYJGVPWMMCTSA-HXUWFJFHSA-N 448.548 4.608 50 10 IJGE FC(F)(CBr)c1cc(Br)ccc1I 1951533985 VODWZOWFUIEOHS-UHFFFAOYSA-N 425.836 4.540 50 10 IJGE COc1ccc([C@@H](CI)OCCCOCc2ccccc2)cc1 1983389675 IKNDHFUQGOVNER-LJQANCHMSA-N 426.294 4.795 50 10 IJGE Brc1cccc(Br)c1CN1CCCC[C@@H](Br)C1 2003418521 YMAZTDKTCNBPGV-SNVBAGLBSA-N 425.990 4.961 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1cscc1Br 2006103107 QZQCQGIHJNXGCX-VIFPVBQESA-N 430.149 4.624 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1cc(Br)cs1 2006103533 SKKJTRGBQSVBTP-SECBINFHSA-N 430.149 4.624 50 10 IJGE COc1cc(Br)c(OC[C@H]2C[C@@H](Br)C2)cc1Br 2020236288 URXOFMADIUBAQM-OCAPTIKFSA-N 428.946 4.773 50 10 IJGE COc1cc(-n2nc(CCl)c(Br)c2C(F)(F)F)nc(C(F)(F)F)c1 2078862984 RKALNKYNDSDAFN-UHFFFAOYSA-N 438.553 4.815 50 10 IJGE Br[C@H](Cc1ccccc1I)c1ccc2c(c1)CCO2 2087565105 ZESBUMKYLLITOD-CQSZACIVSA-N 429.095 4.905 50 10 IJGE ClCc1ccc(N2CCCN(Cc3ccccc3)CCOCC2)c(Br)c1 2088628011 JSJJVIYFWYARPR-UHFFFAOYSA-N 437.809 4.917 50 10 IJGE CN(Cc1cc(Cl)ccc1I)C1(CCl)CCSCC1 2114725281 QZJHFTSMPMADKM-UHFFFAOYSA-N 430.182 4.881 50 10 IJGE CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1CCBr 2123255611 YLVLLXAXNHAMQD-MRXNPFEDSA-N 440.403 4.622 50 10 IJGE CC(C)(C)OC(=O)N1CCc2c(cccc2NC(=O)[C@H](Br)C2CCCC2)C1 2167040275 POLXTQKQERTUGF-GOSISDBHSA-N 437.378 4.872 50 10 IJGE Cc1nc([C@H](Cl)c2cc3nc(O)[nH]c3cc2Br)c(Br)s1 2169495473 MAHPWLALKNAMMB-SECBINFHSA-N 437.544 4.887 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2N1C(=O)OC(C)(C)C 2196906339 CNCQUVONXAFDIT-YKFHYGQGSA-N 443.426 4.577 50 10 IJGE CN(CC[C@H]1CCCCN1CCCCCI)C(=O)OC(C)(C)C 2211186513 POIZFKPCKSAUNR-MRXNPFEDSA-N 438.394 4.703 50 10 IJGE O=S(=O)(c1ccc(F)c(Br)c1)N(Cc1ccccc1)[C@@H](CCl)C1CC1 2224005500 PWIBOTXRNFOBDI-SFHVURJKSA-N 446.769 4.797 50 10 IJGE CCOCc1cc(Br)c([C@@H](Cl)c2nn(C)cc2Br)s1 2224774477 PPSWUKPPLQUASR-JTQLQIEISA-N 428.577 4.871 50 10 IJGE COC(=O)[C@]1(CCl)C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 2230922118 SZNXTPCJMSKXCC-DYESRHJHSA-N 442.028 4.570 50 10 IJGE C[C@@H](COC(F)F)O[C@@H](CI)c1ccccc1Br 2253912357 AMDMUCJMAWFAHM-KWQFWETISA-N 435.046 4.570 50 10 IJGE CN(CC1(CBr)CC(F)C1)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 2265631913 ICRIZTLWKPGNKK-GNZRSQJKSA-N 429.374 4.697 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1Cl)C(=Cc1cccs1)NC(=O)c1ccccc1 2297565264 FLOGWQKFERMLIW-UHFFFAOYSA-N 444.343 4.976 50 10 IJGE O=C(CSCc1cccc(Br)c1)NN=Cc1cccc(C(F)(F)F)c1 2297708771 OIZYLODJKPJGBD-UHFFFAOYSA-N 431.277 4.851 50 10 IJGE FC1(F)CC[C@H]1CO[C@H](CI)c1ccccc1Br 2313738099 WYJWAKBSWKZMPU-JOYOIKCWSA-N 431.058 4.987 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)C23CCC3)cc1I 2315552781 ISJHFAUVGSSJPA-ZDUSSCGKSA-N 440.550 4.837 50 10 IJGE CN(CC1(CBr)CC(C)(C)C1)[C@H](CNC(=O)OC(C)(C)C)C(F)(F)F 2321758570 GKERQGFOXWJWIF-GFCCVEGCSA-N 431.337 4.575 50 10 IJGE COc1ccc(C)cc1-c1csc(C(C#N)=C(O)[C@H]2CC(=O)N(Cc3ccccc3)C2)n1 2331323716 ZNZFUXMQWLXLDT-SFHVURJKSA-N 445.544 4.969 50 10 IJGE C[C@H](CCBr)CCN1C[C@@H]2CC(F)(F)CC[C@@]2(NC(=O)OC(C)(C)C)C1 2344056675 DTQJMSBJTXYQFU-RVKKMQEKSA-N 439.385 4.812 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@](C)(CBr)C(C)(C)C)C[C@@H]1C(F)(F)F 2352091612 OJUDENYMBFBDCN-AHIWAGSCSA-N 445.364 4.821 50 10 IJGE F[C@@]12CCC[C@@]1(CCl)CN(Cc1ccc(Cl)c(I)c1)C2 2362380992 UTGJTPYZWFGZPZ-HUUCEWRRSA-N 428.116 4.878 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)NCCOC)ccc1OCc1ccc(Cl)c(Cl)c1 6600581 ZGGDALLPAFEJGA-YVLHZVERSA-N 449.334 4.641 50 10 IJGE CC[C@H](C)c1ccc(OCC(=O)NNC(=O)[C@H](C)Oc2ccc(-c3ccccc3)cc2)cc1 14038776 BVBRIJOLDLWGGG-PMACEKPBSA-N 446.547 4.861 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@@H](C)Oc4ccccc4F)ccc32)cc1 38649232 APOSYHRWVLVFDU-VOIUYBSRSA-N 444.462 4.725 50 10 IJGE Cc1ccc(Oc2ncnc(NNC(=O)C(c3ccccc3)c3ccccc3)c2N)cc1C 40795005 IBTKTDFALYYPKY-UHFFFAOYSA-N 439.519 4.743 50 10 IJGE Cc1ccc(Sc2ccc(/C=C(\C#N)C3=NN(c4ccccc4)[C@@H](N)[C@@H]3C#N)o2)cc1 59137920 UGDYPXUFXOKCTA-IOMAZRRQSA-N 425.517 4.947 50 10 IJGE C=CCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccc(Cl)cc3)c(OC)c2)C1=O 101230872 JTGUAPILYKDRSP-UDWIEESQSA-N 448.906 4.706 50 10 IJGE O=C(N/N=C\c1c(Cl)cccc1Cl)c1cccn(Cc2ccc(Cl)cc2)c1=O 169920403 YEFCCRAZMSWMGY-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE COc1ccc(/C=N\NC(=O)c2nc(-c3ccccc3)sc2C)cc1Br 169927097 YUXFCSSULGFODW-NHDPSOOVSA-N 430.327 4.654 50 10 IJGE C[C@H]1CC(O[C@@](C)(CI)CNC(=O)OC(C)(C)C)C[C@H](C)C1 231317170 YCUQZFYPUPFWLH-XNJGSVPQSA-N 425.351 4.546 50 10 IJGE CCOc1ccc(C(C[P+](c2ccccc2)(c2ccccc2)c2ccccc2)=NN)cc1 254443930 DHNBPCIEYSREGC-UHFFFAOYSA-N 439.519 4.742 50 10 IJGE CC(=NNC(=O)CCC(=O)N(c1ccccc1)c1ccccc1)c1cccc([N+](=O)[O-])c1 254845247 AGNVUWINIVZWHJ-UHFFFAOYSA-N 430.464 4.580 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@@H]1Cl)c1cc(Br)sc1Br 379725102 KRGDFAIUKUNJMY-CMPLNLGQSA-N 435.568 4.908 50 10 IJGE ClCc1nc2ccncc2n1-c1cc(I)ccc1Br 381818790 HKIWGSDJYBCDSI-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE CN(Cc1cc(Cl)ccc1I)C(C)(C)CCBr 688341424 VWGFAUUPFBFKLE-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE CC(C)N(C[C@@H](C)Br)C(=O)c1cc(Cl)ccc1I 691343147 IQPCEJXOLBHCGV-SECBINFHSA-N 444.538 4.579 50 10 IJGE Cc1ccc(C[C@H](NC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c2ccccn2)cc1 734685847 WOBHFDGUGOGYIH-QHCPKHFHSA-N 430.552 4.616 50 10 IJGE Cc1cccc([C@H](C)NC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)c1C 734691599 DNZUARICMAYYOM-SFHVURJKSA-N 435.499 4.727 50 10 IJGE CC(C)c1csc([C@@H](C#N)C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)n1 747197370 FNZPBODRAAKNTB-OLROSQPISA-N 440.532 4.827 50 10 IJGE CC(C)n1ccc(COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)n1 781866877 CBVPDDKWRUTSAH-PDGQHHTCSA-N 448.914 4.545 50 10 IJGE N#Cc1ccc(NNC(=O)CSCc2coc(-c3ccccc3)n2)c(C(F)(F)F)c1 799751740 XXDGRDSPLHAIEU-UHFFFAOYSA-N 432.427 4.609 50 10 IJGE Cc1cc(C=NNC(=O)c2cccc(Cl)c2)c(C)n1-c1ccc(C(=O)O)c(Cl)c1 1083986034 URJXTIQWGBYCAA-UHFFFAOYSA-N 430.291 4.863 50 10 IJGE O=C(NN=Cc1coc2ccc(Cl)cc2c1=O)c1cc2cc(Br)ccc2o1 1084208028 NWNVYSOIIZQPSK-UHFFFAOYSA-N 445.656 4.719 50 10 IJGE C#C[C@@H](NC(=O)NNc1ccc(Br)cc1C)c1ccc(Br)cc1 1478897319 XQWHJCYDICWFJQ-OAHLLOKOSA-N 437.135 4.521 50 10 IJGE CCOc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2)CCC3)cc1 1772744346 BVONELXQEQSWCJ-UHFFFAOYSA-N 431.492 4.709 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@@H]2C)oc2c1C(=NNC(=O)c1ccccc1)CCC2 1772745110 SISXCHIPNOWZOK-INIZCTEOSA-N 427.504 4.650 50 10 IJGE CCCc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1ccc(O)cc1)C(C#N)=C(N)O2 1865684009 LCAIOVLBAYKGBT-HXUWFJFHSA-N 438.890 4.600 50 10 IJGE CCCc1nn(-c2ccc(Cl)cc2)c2c1[C@@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865701802 FVJXJSRZPFRLNK-IBGZPJMESA-N 426.854 4.975 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)Cc1ccc(Cl)c(Cl)c1 1916334009 BFUKNEIJPXCHBZ-INIZCTEOSA-N 445.184 4.975 50 10 IJGE BrC[C@@]1(Cc2cccc(Br)c2Br)CCCOC1 1943883888 LMELVNZDKKDUPF-ZDUSSCGKSA-N 426.974 4.946 50 10 IJGE COc1ccc(Cn2nc(CBr)c(Br)c2C(F)(F)F)c(F)c1 2079231644 BCLZUMVVQRKMQO-UHFFFAOYSA-N 446.036 4.755 50 10 IJGE ClCc1nc2cncc(Br)c2n1C[C@H]1CCCCN1Cc1ccccc1 2095437906 QHUXHXVGEPXULV-MRXNPFEDSA-N 433.781 4.987 50 10 IJGE Cc1coc(C)c1[C@@H](Br)c1cc(I)cc2c1OCC2 2096741665 TYRLCMKSLWKYJB-AWEZNQCLSA-N 433.083 4.920 50 10 IJGE BrC[C@]12CCC[C@@H]1N(Cc1ccc(I)cc1)CCC2 2108953155 SMHBMOMNRINQNQ-JKSUJKDBSA-N 434.159 4.821 50 10 IJGE ClCc1ccc(N2CC[C@H]3OCCN(Cc4ccccc4)[C@H]3C2)c(Br)c1 2129057283 UTAIQQYQKWMFPW-LEWJYISDSA-N 435.793 4.668 50 10 IJGE Cn1nc(COc2c(CBr)ccc(F)c2F)c(Br)c1Cl 2152996727 AIASKZBRZRCZGF-UHFFFAOYSA-N 430.474 4.588 50 10 IJGE O=C(c1ccccc1OCc1ccccc1)N1C[C@@]2(F)CCC[C@@]2(CBr)C1 2176638592 BUMZYLLFDSGLJQ-YADHBBJMSA-N 432.333 4.995 50 10 IJGE CC(C)(C)OC(=O)NCCN(C(=O)c1ccc(CBr)cc1)C1CCCCC1 2186620062 KIZZUNSEFHAKIB-UHFFFAOYSA-N 439.394 4.881 50 10 IJGE O=S1(=O)C[C@H]2C([C@H](Cl)c3c(Br)cc(Cl)c(Cl)c3Cl)[C@@H]2C1 2232511383 JSQHBMGVQHJOFY-NWWTUURKSA-N 438.985 4.980 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1cc(Br)c(F)cc1Cl 2285958175 OYUWFZSYZGCDAP-QMMMGPOBSA-N 447.595 4.878 50 10 IJGE CC(C)C[C@H](CCl)CNC(=O)Cc1cc(Br)cc(Br)c1 2295311297 IZFZBCNALUWLRM-GFCCVEGCSA-N 425.592 4.771 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(C)C[C@H]2CC[C@H]1C[C@]21CCC[C@H](CI)O1 2307493730 XVMSBJAXCXCSOF-OHIZHGFFSA-N 449.373 4.833 50 10 IJGE CC1=C(C#N)C(=O)N(C2CCCC2)C(=O)C1=Cc1ccc(OCc2ccc(F)cc2)cc1 2314617073 QFHVANHHEJNQEB-UHFFFAOYSA-N 430.479 4.940 50 10 IJGE C=CCC(CBr)(CBr)Cc1cc(OC)ncc1Br 2315339376 UDCUSQROVLAFJG-UHFFFAOYSA-N 441.989 4.748 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)CNC(=O)c1csc(I)c1 2318085259 NISGYALPSZJYHV-LLVKDONJSA-N 444.176 4.528 50 10 IJGE Clc1ccc(CN2C[C@H]3CC(Br)C[C@@H]3C2)c(I)c1 2318537214 DQRJZZMTNDHLSL-GHMZBOCLSA-N 440.550 4.550 50 10 IJGE C[C@H]1CCN(Cc2ccc(Cl)cc2I)C[C@@H]1CBr 2318539436 MBFLMGVTGZIJSZ-JQWIXIFHSA-N 442.566 4.798 50 10 IJGE CCN(Cc1ccccc1)c1ccc(C=NNC(=O)CSc2nc3ccccc3[nH]2)cc1 2323081282 INRVBWIAHHUJFM-UHFFFAOYSA-N 443.576 4.832 50 10 IJGE COc1ccnc(N(C)[C@H]2C[C@@H]3C[C@H](OCc4ccccc4)C[C@H]23)c1CBr 2359230452 SCIZSCMHJYXPHP-JPLJXNOCSA-N 431.374 4.805 50 10 IJGE COc1ccc(/C(C#N)=C\c2ccc(OC(=O)c3ccc4c(c3)OCO4)c(OC)c2)cc1 31902266 QBPJBHRGBCCHBY-ODLFYWEKSA-N 429.428 4.716 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(Cl)cc2)CCC3)n1 40811710 USPDULZPPOJJTM-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE Cc1ncc(Cn2c([C@@H](C)Cl)nc3cc(I)c(F)cc32)s1 97408890 UEAMCQDDJHJUIL-SSDOTTSWSA-N 435.693 4.893 50 10 IJGE CCCCOCCO[C@H](CI)c1ccccc1Br 162123098 FRTTXVQCEOJLII-CQSZACIVSA-N 427.120 4.759 50 10 IJGE ClCc1csc2cc(I)c(I)cc12 307118452 WUKRBIAHDGNKMS-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1ccc([C@@H]2CCc3ccccc3N2S(N)(=O)=O)cc1 616669599 QRUPSXWLQSXZPL-QFIPXVFZSA-N 446.689 4.948 50 10 IJGE Cc1nc([C@@H]2CCCCN2C(=O)/C(C#N)=C\c2cc(C)n(-c3ccccc3C)c2C)no1 737613811 BAHGOAVBFRJIAD-CVGPFBNFSA-N 429.524 4.755 50 10 IJGE Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)o1 742964854 KANJDFKZJXZFAC-VGSWGCGISA-N 446.551 4.558 50 10 IJGE N#Cc1ccc(NNC(=O)Cc2ccc(Br)c(Cl)c2)c(C(F)(F)F)c1 799754655 RAJLPVVAAYQLJY-UHFFFAOYSA-N 432.627 4.679 50 10 IJGE Cc1cc([C@H]2CN(Cc3ccccc3)C[C@@H]2CI)ccc1[N+](=O)[O-] 1614640814 FYNWHKDXQZPYFG-ZWKOTPCHSA-N 436.293 4.554 50 10 IJGE O=C(CSc1cc(Cl)ccc1Cl)NNC(=O)Nc1cccc(C(F)(F)F)c1 1616048891 MSRGLJIGJXDCSO-UHFFFAOYSA-N 438.258 4.957 50 10 IJGE CCOc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3cccc4nc(O)[nH]c34)c2C)cc1 1625536339 FHUZWPVUJOPFCE-AQTBWJFISA-N 441.491 4.620 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C(=O)NNC(=O)CCc2ccc(C(C)(C)C)cc2)cc1 1858081845 KYYPWAUFTVQVDF-UHFFFAOYSA-N 439.556 4.725 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccccc2)cc1 1865694107 PQAYZKWRRVMPKW-GOSISDBHSA-N 440.425 4.567 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)N/N=C\c1ccccc1Br 1865760613 GVYXGUJDKBABQW-MYKKPKGFSA-N 430.252 4.862 50 10 IJGE CCC[C@@H](NC(=O)c1nc(CC(C)C)n2ccccc12)C(=O)Nc1ccc(SC#N)cc1 1866863948 GOWWNPOPFNDIET-LJQANCHMSA-N 449.580 4.643 50 10 IJGE CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1cccc(Oc2ccccc2)c1 1873795059 PUNVHDOGGVTKMY-HUXSYLCKSA-N 425.529 4.868 50 10 IJGE Brc1ccccc1[C@H](CI)O[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12 1917452886 ILZHNYBOVDSZAP-JROCKOOZSA-N 433.127 4.986 50 10 IJGE C[C@H]1CCN(Cc2c(Br)cccc2Br)[C@H]1CBr 1945332689 GXRVDABUGIKGCP-ZANVPECISA-N 425.990 4.817 50 10 IJGE CC(C)N1C[C@@H](Br)[C@H](c2c(Br)cccc2Br)C1 1950852595 ZVENDVCXTRCZRS-BXKDBHETSA-N 425.990 4.783 50 10 IJGE COC(CBr)(CBr)Cc1cc(Br)ccc1Cl 1979517012 DPWRBYUKKWDICA-UHFFFAOYSA-N 435.381 4.820 50 10 IJGE CC(C)[C@H](CCl)N(Cc1ccccc1)C(=O)c1nn(C)c(Cl)c1Br 2001989964 FUQPINPYWNQIEV-ZDUSSCGKSA-N 433.177 4.742 50 10 IJGE C[C@H](Br)C12CCC(CC1)N2c1ncc(Br)cc1Br 2035844655 NCWMNWGVANIPBM-LUHBLDKBSA-N 438.989 4.891 50 10 IJGE BrC[C@@H]1CC2(CC2)CN1Cc1ccc(Br)cc1Br 2037825672 RNRIMNUSARRZNG-LBPRGKRZSA-N 438.001 4.961 50 10 IJGE CN(CCN(C[C@H](CBr)CC1CC1)CC(F)(F)F)C(=O)OC(C)(C)C 2050052993 IMWZNLHINDTUEH-AWEZNQCLSA-N 431.337 4.529 50 10 IJGE CC1(C)CC[C@@H](CCl)N(c2ncc(I)cc2Br)C1 2069528752 MTWYPZNYKWTLAO-JTQLQIEISA-N 443.554 4.683 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1ccc(Br)c(Cl)c1 2090387126 HCFUTARJEBJKDC-JTQLQIEISA-N 429.605 4.739 50 10 IJGE CC(C)[C@H](Br)C(=O)N1C[C@@H](C)N(C(=O)OC(C)(C)C)Cc2ccccc21 2106773344 RQKJUKQHGWUIRX-PBHICJAKSA-N 425.367 4.578 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CCCCCCCCCBr)CCCO1 2106784833 LNBQCBMCCPPFMJ-GOSISDBHSA-N 435.447 4.728 50 10 IJGE O=C(c1csc(Br)c1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Cl)C2 2134140186 YCWUMMOYDFDWFY-LHGNLISDSA-N 431.552 4.596 50 10 IJGE Cc1cc(N2C[C@@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)ncc1CBr 2153341613 RYGWAILGKBVLQV-ZRZAMGCNSA-N 426.402 4.777 50 10 IJGE C[C@@H]1CCCN(CC2(CBr)CCOCC2)[C@H]1CCCNC(=O)OC(C)(C)C 2163063282 PJXLQMYMLRGGGS-MSOLQXFVSA-N 447.458 4.584 50 10 IJGE COCC1(COC)C[C@H](Cl)[C@H](c2c(Br)cccc2Br)C1 2190817579 QEGTUCLFWNXXHF-MFKMUULPSA-N 426.576 4.976 50 10 IJGE CC(C)(C)[C@@H]1CCCN1S(=O)(=O)c1cc(CBr)sc1Br 2191964673 WVIKZKZLIDIMFE-NSHDSACASA-N 445.242 4.605 50 10 IJGE O=C(c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@@H](Br)C1 2250729332 LDANZXVXFQRZNZ-SYDPRGILSA-N 432.884 4.846 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@H](CBr)C12CCC2 2264501615 NWURLYHXNCCURL-MRVPVSSYSA-N 427.589 4.944 50 10 IJGE CC1(C)OCCN(Cc2ccc(Cl)c(Br)c2F)[C@@H]1CBr 2282821413 ZOPRLOIWXVQLDL-LLVKDONJSA-N 429.555 4.616 50 10 IJGE COc1ccc(C=NNC(=O)[C@@H]2CC2(c2ccccc2)c2ccccc2)cc1Br 2297710498 MBGCNBPIZAUZQY-FQEVSTJZSA-N 449.348 4.914 50 10 IJGE CN[C@H](c1c(C)cc(Br)c(F)c1Br)[C@@H]1C[C@@H]1Br 2301487733 TZTXUORLCRDFMJ-LTMDPNIMSA-N 429.953 4.703 50 10 IJGE CC(C)c1cccc(CO[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2I)c1 2303761755 GXXWBWKMBGIANK-IRXDYDNUSA-N 445.341 4.750 50 10 IJGE O=C(CSCc1ccccc1)NN=C1C(=O)N(CC=Cc2ccccc2)c2ccccc21 2313649558 DGJLTZVDEHXVQX-UHFFFAOYSA-N 441.556 4.500 50 10 IJGE CC(C)[C@H]1C[C@@H](Cl)CN1Cc1ccc(I)c(Br)c1 2325206175 BWAINYNBTBIPNO-BXUZGUMPSA-N 442.566 4.891 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@H]3[C@@H](CCCN3C(=O)OC(C)(C)C)C2)C1 2345010809 OIRHJXZTXKBOBG-IRXDYDNUSA-N 429.443 4.909 50 10 IJGE CCC[C@@H]1CN(C(=O)c2ccc(Cl)cc2I)C[C@@H]1CCl 2365589782 ZHEAPMYDCQWAAM-MNOVXSKESA-N 426.125 4.672 50 10 IJGE Cc1cc(C(=O)N2CCC[C@H](Br)[C@H]2C(F)(F)F)c(Br)s1 2370247025 ISVHYPXGFDSRQT-IUCAKERBSA-N 435.103 4.749 50 10 IJGE Cc1[nH]c2ccccc2c1/C=N/NC(=O)COc1ccc2ccccc2c1Br 12575688 REHMENXOFOUPNK-WYMPLXKRSA-N 436.309 4.921 50 10 IJGE Cc1cc(Oc2ncnc(NNC(=O)c3ccc(Cl)cc3)c2[N+](=O)[O-])ccc1Cl 40657826 SVGUAHCFBPERFP-UHFFFAOYSA-N 434.239 4.549 50 10 IJGE Cc1ccc(Sc2ccc(/C=C(\C#N)C3=NN(c4ccccc4)[C@H](N)[C@H]3C#N)o2)cc1 59137922 UGDYPXUFXOKCTA-TVODWRMHSA-N 425.517 4.947 50 10 IJGE CCOC1=N/C(=C(C#N)\N=N\c2ccc(OC)cc2)NC(=N)[C@H]1/N=N/c1ccc(OC)cc1 104767194 OZMQFSNQCOMIOT-NNGDQTBSSA-N 446.471 4.648 50 10 IJGE C[C@@H]1CCN(C(=O)c2cc(Br)c(Br)s2)[C@@H]1CBr 227178004 SQTDOBWPLOZDSV-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE CC[C@](C)(CCBr)NC(=O)c1cc(Cl)ccc1I 228583228 OQHIPSFZCFQGKL-CYBMUJFWSA-N 444.538 4.628 50 10 IJGE ClCc1cc(I)c(I)c2sccc12 306563790 DHGRRMPXDGRIEO-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE O=C(OCc1ccccc1)N1C[C@@H](CI)[C@H](c2ccc(F)cc2)C1 382708941 WGXAVPCSASKOSJ-AEFFLSMTSA-N 439.268 4.613 50 10 IJGE Cc1cccc(C(=O)N[C@@H](CBr)CC(C)(C)C)c1I 393532407 XICWPNYEKQKUFJ-LLVKDONJSA-N 438.147 4.529 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccc([C@H]2CCN(S(N)(=O)=O)c3ccccc32)cc1 616674590 GPGWTCNVQJFBJZ-LJQANCHMSA-N 432.662 4.754 50 10 IJGE C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1[C@@H](Br)c1cc(I)cc2c1OCC2 716444321 OGAQKQRVTFCCSD-FTDPQWIQSA-N 433.127 4.954 50 10 IJGE COc1ccc2nc(NNC(=O)C3CCN(c4nc5ccccc5s4)CC3)c(C)cc2c1 778482301 VUNCMMDGNBQLIQ-UHFFFAOYSA-N 447.564 4.521 50 10 IJGE CCc1cccc(CC)c1NC(=O)/C(C#N)=C/c1cccc(I)c1 789127588 OCHGSGNHQANGTN-GZTJUZNOSA-N 430.289 4.962 50 10 IJGE CC(=O)c1cccc(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)c1 817991689 GACMBWMRGRSESL-XDHOZWIPSA-N 443.894 4.865 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)c2c[nH]c3cccc(C)c23)c([N+](=O)[O-])cc1OC(F)F 953132136 CJVIJXQIDSYNTJ-MLPAPPSSSA-N 427.363 4.784 50 10 IJGE O=C(Cc1csc(Cc2cccc(Cl)c2)n1)NNc1nc2ccccc2[nH]c1=S 1633443982 UUKXKDOIDRJQLH-UHFFFAOYSA-N 441.969 4.679 50 10 IJGE CCCc1nn(C)c2c1[C@H](c1ccccc1OCc1ccc(Cl)cc1)C(C#N)=C(N)O2 1865700695 BHFQCGYDDWGQAP-OAQYLSRUSA-N 434.927 4.823 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc3ccccc23)cc1OC 1865707147 PBVYTVZKSBNBAW-XMMPIXPASA-N 438.487 4.569 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)c(C)n2)cc1C 1865756198 LLLCDXLVBVYRDD-UHFFFAOYSA-N 427.426 4.767 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)CCCC(F)(F)F 1915290742 HDDYZCCAUSJFOS-OAHLLOKOSA-N 430.330 4.580 50 10 IJGE CN(CCN(Cc1ccccc1)S(=O)(=O)c1ccsc1CCl)Cc1ccccc1 1931969935 ZSFXSKSECQAOGM-UHFFFAOYSA-N 449.041 4.810 50 10 IJGE Cc1nn(-c2ccc(CCl)c(Br)c2)c(C)c1I 1945163038 ZBDNPKOFHGDIQF-UHFFFAOYSA-N 425.495 4.595 50 10 IJGE C[C@@H]1OCC[C@]1(CBr)Cc1c(Br)cccc1Br 1945331056 PPWCAOFRXFSCQQ-TVQRCGJNSA-N 426.974 4.944 50 10 IJGE O=S(=O)(c1ccc(CCl)cc1Br)N(Cc1ccccc1)CC(F)F 1946833261 BGEWMPUJLMIHCM-UHFFFAOYSA-N 438.721 4.644 50 10 IJGE CC[C@H](CBr)CN1C[C@H](CC)N(C(=O)OCc2ccccc2)C[C@H]1CC 1977883688 FXCXEGHOHPXBIE-RLLQIKCJSA-N 425.411 4.919 50 10 IJGE COc1ccc(Cl)cc1[C@H](Br)c1cc(I)sn1 2007643626 GZJWXIJBVXAAPJ-NSHDSACASA-N 444.519 4.894 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc([S@@](C)(=O)=NC(=O)CCCCBr)c1 2044529718 AHBORTFZNIZXFM-RUZDIDTESA-N 433.368 4.582 50 10 IJGE COC[C@@H](C)CCO[C@H](CI)c1ccc(Br)cc1 2067236908 CLEZVPUHIJYECS-SMDDNHRTSA-N 427.120 4.614 50 10 IJGE C[C@@H](Cl)[C@@H](NC(=O)c1cc(Br)sc1Br)C(F)(F)F 2074732937 BDFJQRVPRFFHST-AWFVSMACSA-N 429.483 4.561 50 10 IJGE Brc1cc2c(cc1[C@H](Br)[C@H]1C[C@@H](Br)C1)OCCO2 2076182057 MTSYOYXQEHAIQW-BFHDXFOESA-N 440.957 4.830 50 10 IJGE Clc1cc(CN[C@H](CBr)C2CCCC2)ccc1I 2086658074 KEZFJDVSPRPCGW-CQSZACIVSA-N 442.566 4.988 50 10 IJGE CCC[C@@H](CBr)CN1CCC[C@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2129045859 WTFFIOPWRSBMAP-GJZGRUSLSA-N 429.403 4.747 50 10 IJGE ClCc1nc2cc(Br)cnc2n1CCc1ccsc1Br 2186669202 QSWAIHNUFQKWKU-UHFFFAOYSA-N 435.572 4.999 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@H](CNC(=O)OC(C)(C)C)CC1CCCCC1 2196914591 OWCWBHWREAIJEH-OKZBNKHCSA-N 445.442 4.730 50 10 IJGE Cc1c(C[C@H](Br)CN2C(=O)c3ccccc3C2=O)cccc1C(F)(F)F 2211288779 OIMFLPVDWBPYCF-ZDUSSCGKSA-N 426.232 4.616 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2Cc1cnn(Cc2ccccc2)c1 2224722803 UACDLPNAORLYNT-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE CC1(C)C[C@H](CBr)CN(Cc2sccc2I)C1 2301070461 CPDZVBDKASMHBM-SNVBAGLBSA-N 428.177 4.596 50 10 IJGE C[C@@H]1CC[C@H](CBr)N(Cc2ccc(Cl)cc2I)C1 2318512125 QAWYCTGPHUYIOR-ZWNOBZJWSA-N 442.566 4.940 50 10 IJGE N#CC(=Cc1cc2c(cc1[N+](=O)[O-])OCCO2)c1nc(-c2ccc(F)cc2F)cs1 2331437902 RKGKSCCHTRUMAN-UHFFFAOYSA-N 427.388 4.832 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCN(C[C@H]2C[C@H](Br)C2)[C@H](C(F)(F)F)C1 2337681805 BGHUALQPXGHHBK-TUVASFSCSA-N 443.348 4.718 50 10 IJGE CCc1cc([C@@H](Br)[C@]23CCC[C@H]2CS(=O)(=O)C3)sc1Br 2359284679 AKUNIHQWQUTJJK-SUHUHFCYSA-N 442.238 4.724 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CC2CCN(C(=O)CCCCBr)CC2)CC1 2361053767 TZHFKMFQEDLGED-UHFFFAOYSA-N 445.442 4.827 50 10 IJGE O=C(N/N=C/c1ccc(Br)cc1)c1ccc(NC(=O)C2CCCCC2)cc1 12487397 QUFKCFCURCFTDV-OEAKJJBVSA-N 428.330 4.732 50 10 IJGE CCc1ccc(O[C@@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(C)o2)cc1 38659358 XQDYYWKVDYSKGK-FYSMJZIKSA-N 444.487 4.742 50 10 IJGE COc1ccc(Cc2nc3cc(C(=O)N/N=C\c4c(C)[nH]c5ccccc45)ccc3[nH]2)cc1 169925584 MREKZRORJMUBRH-DICXZTSXSA-N 437.503 4.716 50 10 IJGE CCCCN(/C=C(/C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)CCC 216496555 HQQBNVQADIQSLD-RWEWTDSWSA-N 444.623 4.840 50 10 IJGE CCOC(=O)c1ccc(N/C=C(/C#N)C(=O)NC(c2ccccc2)c2ccccc2)cc1 216972763 VOLVFXAHHLXJDH-PYCFMQQDSA-N 425.488 4.588 50 10 IJGE CCS(=O)(=O)CCCC(CBr)(CBr)C1CCCCCC1 696863989 DEVQZTLYKZLGPB-UHFFFAOYSA-N 432.262 4.948 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1C(=O)c1cc(Br)sc1Br 705491831 TXBDHPQIMDVUAA-RNFRBKRXSA-N 446.002 4.661 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@H](CCBr)C1 705520024 ZNWFVYRWETZYNF-ZETCQYMHSA-N 446.002 4.520 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@]1(C)CN(C(=O)c1ccc(CBr)cc1)C2 705910333 VABRPSVNCSREAI-ZRZAMGCNSA-N 427.386 4.566 50 10 IJGE CN(C[C@@H]1CCCN(Cc2ccccc2)C1)c1nc2sccn2c1CBr 720017503 WQOYXWYCVSRREV-KRWDZBQOSA-N 433.419 4.639 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCc2cccc(Br)c2)c1C 768746940 IJOKLXYIZFVHIS-GDXCHIGESA-N 431.330 4.725 50 10 IJGE C[C@@H](OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)c1cc(F)ccc1F 920156134 GTCRUGPOOJXJAH-YAJBTMAUSA-N 432.430 4.953 50 10 IJGE Cc1ccc(C)c(NC(=O)CCC(=O)NN=Cc2cccc(OCc3ccccc3)c2)c1 1083858963 QIKZNQPJGIMJHW-UHFFFAOYSA-N 429.520 4.751 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(C)c1C=NNC(=O)CSCc1ccccc1 1083983387 DCHLMAZPIUMLCX-UHFFFAOYSA-N 426.973 4.585 50 10 IJGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 1087669077 WKIISFWOIIPCOE-SJORKVTESA-N 445.466 4.702 50 10 IJGE CC(C)(Cc1ccc(Br)cc1)C(=O)NNc1nc2ccccc2[nH]c1=S 1167430591 JZMDDRYABPLXQB-UHFFFAOYSA-N 431.359 4.767 50 10 IJGE CCOc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3cccc4nc(O)oc34)c2C)cc1 1298881207 TZJKYZBADBNLML-AQTBWJFISA-N 442.475 4.885 50 10 IJGE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)c1cc2c(s1)CCCCC2 1440374115 CDSZDEKXEGIBRM-QBFSEMIESA-N 438.471 4.780 50 10 IJGE COc1ccc(/C(C#N)=C/c2cccc(OC(=O)c3ccc4c(c3)OCO4)c2)cc1OC 1615066662 JLIINDITTVFQKM-VXLYETTFSA-N 429.428 4.716 50 10 IJGE C=CC[C@@H]1CCCC[C@@H]1NC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl 1636883801 VXPTXFICJXMMBB-PBHICJAKSA-N 428.360 4.618 50 10 IJGE C#CCOc1ccc(NC(=O)NNc2cc(C(F)(F)F)ccc2Br)cc1 1667082958 OHQBEPSSEBSGFF-UHFFFAOYSA-N 428.208 4.629 50 10 IJGE C[C@H](Br)C(=O)c1ccc(I)c(SC(F)(F)F)c1 1848425830 FRTFZPFTOQGPMK-YFKPBYRVSA-N 439.034 4.869 50 10 IJGE CCc1nn(-c2ccccn2)c2c1[C@H](c1ccc(OCc3ccccc3)cc1)C(C#N)=C(N)O2 1865690615 WYZDXKIVNAXOFO-XMMPIXPASA-N 449.514 4.627 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)[C@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C(F)(F)F 1892594544 YMPJTBHIFJGUIS-UPJWGTAASA-N 430.895 4.697 50 10 IJGE Brc1ccc(Br)c([C@H]2CC[C@H](CI)O2)c1 1927790710 WSGSECUVBBXXIF-LDYMZIIASA-N 445.920 4.867 50 10 IJGE Cc1nn(-c2cc(Br)ccc2CCl)c(C)c1I 1945161923 JZLPONMOUFJHBP-UHFFFAOYSA-N 425.495 4.595 50 10 IJGE C[C@@H]1[C@@H](CBr)CCN1Cc1c(Br)cccc1Br 1945333746 UQJFVAZRDIISJG-NXEZZACHSA-N 425.990 4.817 50 10 IJGE Clc1cc(CN(CCBr)C2CCC2)ccc1I 2026560830 NCBGJOQKOQDYLK-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE CC(C)[C@@H](Br)CN(C)Cc1ccc(I)c(Cl)c1 2026567859 WBKNDIKWPUDPCR-NSHDSACASA-N 430.555 4.796 50 10 IJGE BrC[C@]1(Cc2cccc(Br)c2Br)C[C@]12CCOC2 2039026141 WWJDGJILUFSALN-KBPBESRZSA-N 438.985 4.946 50 10 IJGE CC(C)[C@@H](Br)c1cn(-c2cc(Br)ccc2Br)nn1 2057429564 QDBSZZDSYHZUBA-GFCCVEGCSA-N 437.961 4.884 50 10 IJGE CC(C)C(F)(F)[C@@H](Br)c1cc(I)cc2c1OCC2 2065536902 WCIPNNRLCBTYRS-LBPRGKRZSA-N 431.058 4.953 50 10 IJGE C[C@@H](Cl)C[C@H]1CCCCN1c1ncc(I)cc1Br 2069526374 VFRNGUHKWCDXFN-MWLCHTKSSA-N 443.554 4.825 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1ccc(Br)cc1Cl 2081235315 DPVQUBDOYLXXES-QPUJVOFHSA-N 444.538 4.682 50 10 IJGE CCC(CC)(CBr)CN1C[C@]23CCC[C@]2(C1)CN(C(=O)OC(C)(C)C)C3 2106782510 QWZHBIBEJIKUFR-SFTDATJTSA-N 429.443 4.911 50 10 IJGE Cc1cccc(C(=O)N[C@@H](C)CCCCCI)c1Br 2117894913 NVTDNWZKYUETDG-LBPRGKRZSA-N 438.147 4.871 50 10 IJGE O=C(c1ccc(I)c(Cl)c1)N1CCC[C@H](CCCl)CC1 2149744989 XYRKYNUKGKKKRL-LLVKDONJSA-N 426.125 4.816 50 10 IJGE ClCCc1nc2cncc(Br)c2n1Cc1sccc1Br 2151791530 VDCNUHBUQSLBFI-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CN(C(=O)c1cccc(Br)c1Cl)[C@H](CCBr)C(F)(F)F 2178516559 XPUCNWJSEASXPY-SECBINFHSA-N 437.481 4.890 50 10 IJGE CCC1(C)CCN(S(=O)(=O)c2cc(CBr)sc2Br)CC1 2179791824 WXRPIQCXFRGICB-UHFFFAOYSA-N 445.242 4.606 50 10 IJGE C[C@@H]1[C@@H](C)N(Cc2ccccc2)[C@H](C)CN1c1ccc(CBr)c([N+](=O)[O-])c1 2188578572 YFEUVJUFYAAGKE-BRWVUGGUSA-N 432.362 4.977 50 10 IJGE O=[N+]([O-])c1cc(Br)c(Br)cc1NCC1CC(Br)C1 2218662142 QITJUVAEXBIVJG-UHFFFAOYSA-N 442.933 4.705 50 10 IJGE Br[C@H]1CCC2(CCN(C[C@H]3CC3(Br)Br)CC2)C1 2250562859 MFYUNMRXWMDYHR-MNOVXSKESA-N 430.022 4.522 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2[C@@H]1CCN(Cc2ccccc2)C1 2270561349 JXMFEZKOUBBQJP-OAHLLOKOSA-N 434.765 4.993 50 10 IJGE N#CC(=Cc1ccc(OCc2ccc(Cl)cc2Cl)cc1)C(=O)NC[C@@H]1CCCO1 2294156143 SOJSGRGZALDMLE-FQEVSTJZSA-N 431.319 4.775 50 10 IJGE CCC[C@@H](Cl)CCNCc1ccc(I)c(Br)c1 2306221562 JNLIXVMHCCRSEX-LLVKDONJSA-N 430.555 4.941 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)Nc2ccccc2OC)cc(Br)c1OCC 2313675623 GQBALXIVFLOXJH-UHFFFAOYSA-N 445.313 4.801 50 10 IJGE N#CC(=Cc1ccc(F)cc1)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 2324494358 XTIMLBIXGLINJC-UHFFFAOYSA-N 425.507 4.666 50 10 IJGE CC(C)(C)[C@@](C)(CBr)Cn1cc(Br)cc(Br)c1=O 2327112372 JSMQNOIRTYNWFV-ZDUSSCGKSA-N 444.005 4.821 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN(Cc2cc(I)ccc2Cl)C1 2327387875 CHTGAUXOAJKMFJ-PWSUYJOCSA-N 442.566 4.940 50 10 IJGE CN(c1c(CBr)c(C(F)(F)F)nn1C)[C@@H]1CC[C@H]1OCc1ccccc1 2339772984 CRVQBWWJRUOHIC-HUUCEWRRSA-N 432.284 4.518 50 10 IJGE CC1(C)CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)[C@H](CC(F)F)C2)C1 2345009938 IHKZZKAXCGLNEM-CQSZACIVSA-N 439.385 4.764 50 10 IJGE O=C(c1ccc(Cl)cc1I)N1CCCC[C@H]1CCCCl 2365592825 QCPDNGKNJFCOEE-LBPRGKRZSA-N 426.125 4.958 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@H]1C[C@@H]2CCC[C@H](C1)C2(F)F 2369430751 IGWVSHRYELABCM-AKHDSKFASA-N 444.360 4.935 50 10 IJGE CC[C@H](C)c1ccc(OCC(=O)NNC(=O)[C@@H](C)Oc2ccc(-c3ccccc3)cc2)cc1 14038771 BVBRIJOLDLWGGG-VQTJNVASSA-N 446.547 4.861 50 10 IJGE CCCCOc1ccc(Nc2ncnc(NNC(=O)c3cccc4ccccc34)c2N)cc1 40754856 HNHVYKBUSHRULE-UHFFFAOYSA-N 442.523 4.891 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)c3c2[C@@H](c2ccc(F)cc2)C(C#N)=C(N)O3)cc1 143643148 RCVFMHJNRULPOD-QFIPXVFZSA-N 438.462 4.905 50 10 IJGE Cc1cccc(N2CCN(/C=C(/C#N)C(=O)Nc3ccc(Cl)cc3Cl)CC2)c1C 217177897 ZCVVYVQITKIUHY-VKAVYKQESA-N 429.351 4.778 50 10 IJGE COc1ccc(C=NNC(=O)c2cc(-c3cccc(C)c3)nc3ccccc23)cc1OC 252599449 DJIFYAGCOVVRSO-UHFFFAOYSA-N 425.488 4.991 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2ccc(Br)c(F)c2)[C@@H](CBr)C1 382702509 PSRWPHABJLKSKN-NWDGAFQWSA-N 437.147 4.934 50 10 IJGE C[C@]1(CBr)CCCN(c2ncc(Br)cc2Br)C1 688778979 VRVVDSNVWSWJAQ-GFCCVEGCSA-N 426.978 4.608 50 10 IJGE C[C@H](Br)[C@H]1CCCN(Cc2cc(Cl)ccc2I)C1 689037945 PMSMULUVYXYBFY-QWRGUYRKSA-N 442.566 4.940 50 10 IJGE CC[C@@H](C)c1ccc([C@@H](NC(=O)NNC(=O)c2ccc(OC)cc2OC)C(C)C)cc1 730021033 GMOCITROQKTEGF-ZHRRBRCNSA-N 427.545 4.559 50 10 IJGE O=C(CCOc1ccccc1)NNC(=O)Nc1ccc(S(F)(F)(F)(F)F)cc1 752991191 RJWZIVKWOSMWOX-UHFFFAOYSA-N 425.379 4.966 50 10 IJGE Cc1onc(-c2ccc(Cl)c(Cl)c2)c1C(=O)NNC(=O)c1cn(C)c2ccccc12 797798477 ZTYRGDWBJNNINW-UHFFFAOYSA-N 443.290 4.523 50 10 IJGE CCOC(=O)O[C@]1(C(=O)OCCl)CC[C@@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4(C)C3=CC[C@]21C 1082546916 FVOOBFFVLCZGIJ-VNPGJNKMSA-N 448.943 4.866 50 10 IJGE CN(C)C(=O)/C(C#N)=C/c1cc(Cl)c(OCc2ccc(F)cc2)c(Br)c1 1084157588 HNLGEFQSBSCDCW-VGOFMYFVSA-N 437.696 4.816 50 10 IJGE CCc1ccc(OCC(=O)NN=Cc2ccc(OC)c3ccccc23)c(Br)c1 1084333632 GNLFURPKDWDADJ-UHFFFAOYSA-N 441.325 4.702 50 10 IJGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 1087669063 WKIISFWOIIPCOE-DLBZAZTESA-N 445.466 4.702 50 10 IJGE CC(=O)CCc1ccc(O[C@H](C)C(=O)N2CCC[C@H](O[Si](C)(C)C(C)(C)C)C2)cc1 1275314396 KRKBVWLBHPIFDW-KNQAVFIVSA-N 433.665 4.988 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2c(F)cccc2Cl)[C@@H]1c1ccccc1 1865680717 UAAZCQYVFFVVQD-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)CCCOc3ccc(C)cc3)c(C)n2)cc1 1865758450 AUMWNHCSEBKPLP-UHFFFAOYSA-N 431.536 4.548 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)[C@@H](CBr)C(C)C)cc1[N+](=O)[O-] 1915273513 MEMGBYAMVMWWAO-SFHVURJKSA-N 435.318 4.665 50 10 IJGE Cc1cc(C)c(S(=O)(=O)N(Cc2ccccc2)[C@@H](CBr)C(C)C)s1 1915290638 GHRCLLZCTYEKEP-KRWDZBQOSA-N 430.433 4.975 50 10 IJGE O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N(Cc1ccccc1)C1(CBr)CCC1 1915748937 AUJZNROOPGVBMO-UHFFFAOYSA-N 439.256 4.833 50 10 IJGE CCCN1C[C@H](c2c(Br)cccc2Br)[C@@H](Br)C1 1950850554 LDYPZSGVGMLQPX-CABZTGNLSA-N 425.990 4.784 50 10 IJGE BrC[C@H]1CC12CCN(c1ncc(Br)cc1Br)CC2 2031626669 RVHSRJIQYARAMM-SECBINFHSA-N 438.989 4.608 50 10 IJGE CSCC[C@H](Cl)CCNC(=O)c1csc(Br)c1Br 2032958448 DMFURDGHFILCQH-SSDOTTSWSA-N 435.634 4.754 50 10 IJGE CC[C@]1(CBr)COCCN1Cc1cc(Cl)c(C)c(Br)c1 2169029479 QPYMMYWGCJONSX-HNNXBMFYSA-N 425.592 4.787 50 10 IJGE CCc1nc(C(=O)N(CCBr)Cc2ccsc2)c(Br)s1 2171095177 KSFYMYZXBRCFQQ-UHFFFAOYSA-N 438.210 4.567 50 10 IJGE BrCc1ccc(CN2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)cc1 2182853732 FCXSKXLRNZSDIW-YCAMKHIRSA-N 425.414 4.924 50 10 IJGE CCCC(CBr)(CCC)CN(CCNC(=O)OC(C)(C)C)C1CCOCC1 2186614844 AJAHHVVDYMEOKN-UHFFFAOYSA-N 449.474 4.974 50 10 IJGE COCCO[C@H]1[C@@H](Oc2c(Cl)cc(Br)cc2Cl)C[C@H]1Br 2203012664 UPQKTOISOLOMQE-JFUSQASVSA-N 448.966 4.702 50 10 IJGE Cc1sc(Br)c(C)c1[C@H](Br)[C@@]12CCC[C@H]1CS(=O)(=O)C2 2234237633 SSDLHLGEZCAMJV-VHRBIJSZSA-N 442.238 4.778 50 10 IJGE C[C@@]1(CCl)CCCN1Cc1ccc(I)c(Br)c1 2306218259 YAZBBWPYNDONSE-ZDUSSCGKSA-N 428.539 4.647 50 10 IJGE Brc1ccc(Br)c(CN2CC[C@@H](Br)[C@H]3CC[C@H]32)c1 2310809848 HCWAMOSDOWKNGD-MRVWCRGKSA-N 438.001 4.959 50 10 IJGE CCCCOc1ccc(C=NNC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)cc1OCC 2328821171 XMIBITIGRGQJMV-UWJYYQICSA-N 449.592 4.654 50 10 IJGE CCC(CBr)(CBr)NC(=O)c1ccc(Cl)c(Cl)c1C 2339148260 BNNLCEIABGFVFW-UHFFFAOYSA-N 431.983 4.970 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@](C)(F)[C@@](C)(Br)C2)c1 2365819764 SDUOLLNLNJQELG-KBPBESRZSA-N 429.555 4.945 50 10 IJGE O=C(NC1CCCCC1)[C@@H](c1ccc(F)cc1)N(Cc1ccc(F)cc1)C(=O)CCl 3037421 GLWKZEBGFYSGGA-JOCHJYFZSA-N 434.914 4.722 50 10 IJGE CCCC(=O)[C@H](Br)Cc1cc(OC)c(Br)cc1Br 232910212 KVTHQJKOZSSNFJ-SNVBAGLBSA-N 442.973 4.895 50 10 IJGE CC[C@H](CCBr)NC(=O)c1cc(Br)cc(Br)c1 234007484 LDXGIPGDVGKGQL-LLVKDONJSA-N 427.962 4.505 50 10 IJGE C[C@H]1C[C@H](n2c(CCCl)nc3cc(Br)cnc32)CN1Cc1ccccc1 398003329 PBBFPDMTNQJBLM-YOEHRIQHSA-N 433.781 4.811 50 10 IJGE CC(C)N(C[C@@H](C)Cl)C(=O)c1cc(I)ccc1Br 691349057 GEKMKFONJYNACG-SECBINFHSA-N 444.538 4.532 50 10 IJGE ClCc1cc(Br)cc(Br)c1OCCOC[C@@H]1CCCO1 710310123 TYRZMZJMYKQKJK-LBPRGKRZSA-N 428.548 4.525 50 10 IJGE ClCCc1nc2cc(I)ccc2n1Cc1cnc(Cl)s1 718897082 RFVJUMVAYOQHBS-UHFFFAOYSA-N 438.121 4.580 50 10 IJGE Cc1ccccc1NNC(=O)c1cccc(NC(=O)Cc2ccc(Br)cc2)c1 739391529 MZVLHZKADZHIHU-UHFFFAOYSA-N 438.325 4.696 50 10 IJGE O=C(NNc1ccc(OCC(F)(F)F)cc1)c1cnc(-c2ccc(F)c(F)c2)s1 780659509 VPZLXEQTAGQUGF-UHFFFAOYSA-N 429.370 4.786 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2CC3(CCC3)[C@@H]2C2CC2)c(-c2ccc(Cl)cc2)n1 793428389 AXANJSAKWVZLPW-FOYGFLCZSA-N 445.954 4.815 50 10 IJGE COc1cc(Cl)c(C=NNC(=O)CCCOc2ccc(Cl)cc2Cl)cc1OC 1084056323 HYQYMJQAKWCOQK-UHFFFAOYSA-N 445.730 4.973 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2[N+](=O)[O-])ccc1OCc1ccccc1Cl 1084242611 ZJBGTQKBDNMYGN-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE Cc1ccc(-n2nc(C)c(C=NNC(=O)CSCc3ccccc3Cl)c2C)cc1 1084269567 ZJUGXDPPPPDEDO-UHFFFAOYSA-N 426.973 4.834 50 10 IJGE Cc1nn(-c2ccccc2Cl)c2c1[C@H](c1cccc(Br)c1)C(C#N)=C(N)O2 1865684026 LLDYWYYERAHWJR-GOSISDBHSA-N 441.716 4.815 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@H]2c1ccc(OCC)c(OCC)c1 1865689166 LLABWSSOLAAOLC-JOCHJYFZSA-N 444.535 4.976 50 10 IJGE CCCc1nn(CC)c2c1[C@H](c1ccc(OCc3ccc(C)cc3)cc1)C(C#N)=C(N)O2 1865694137 USKZFADKQQZSMC-HSZRJFAPSA-N 428.536 4.961 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CN(C(=O)OC(C)(C)C)[C@H]1C(C)(C)C 1881339343 KHJRFKRVDQLGRZ-HZSPNIEDSA-N 435.403 4.556 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1C(=O)c1csc(Br)c1Br 1945183715 LYTHREHKWBPOGR-RQJHMYQMSA-N 446.002 4.661 50 10 IJGE O=C(N[C@@H]1CCC[C@@H]1CBr)c1csc(Br)c1Br 1945189134 JVGNCHJBFAVNFX-HTRCEHHLSA-N 446.002 4.567 50 10 IJGE Brc1ccc(CN2CCCC[C@@H](Br)C2)c(Br)c1 2003417194 LHALYWNHIUUONU-GFCCVEGCSA-N 425.990 4.961 50 10 IJGE Clc1cc(C[C@@]2(CBr)CCCOC2)ccc1I 2026569067 GNGPMRBCNFRFBL-CYBMUJFWSA-N 429.523 4.679 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2C[C@H]1CC[C@H]2Br 2033087195 ULZJZHAXQVASIH-CKYFFXLPSA-N 438.001 4.959 50 10 IJGE Clc1ccc(I)c(CN2CC[C@H](Br)[C@@H]3CC[C@@H]32)c1 2069997357 SUBUTDZJHCNAMM-OBJOEFQTSA-N 440.550 4.692 50 10 IJGE CCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2110714097 AGQXGFCPZKMARN-SJORKVTESA-N 431.415 4.578 50 10 IJGE CN(C(=O)OC(C)(C)C)C1CCC(N(C)C(=O)c2ccc(CBr)cc2)CC1 2162917301 YAAROMZPNDUVQF-UHFFFAOYSA-N 439.394 4.832 50 10 IJGE CC1(C)OCCO[C@H]1COc1c(Br)cc(Cl)cc1CBr 2186979912 WPKZVDIRDIQVHT-LBPRGKRZSA-N 428.548 4.570 50 10 IJGE CN(C[C@H]1CCCCN1Cc1ccccc1)c1ccc(CBr)c([N+](=O)[O-])c1 2188571487 GDRDGAWWBIRDJL-HXUWFJFHSA-N 432.362 4.981 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)O)N(CCCCCCCCCBr)C1 2188789622 YBMCFNJALMOGBS-IAGOWNOFSA-N 449.430 4.554 50 10 IJGE Cn1nc([C@H](Br)c2ccc([C@H]3CCOC3)s2)c(Br)c1Cl 2240422639 XAHOGNIXSJDURH-OIBJUYFYSA-N 440.588 4.886 50 10 IJGE CN(C[C@H]1CC1(Br)Br)[C@@H](CBr)c1ccccc1 2253362058 BZMJWRLGCQDSPJ-NEPJUHHUSA-N 425.990 4.560 50 10 IJGE CN(CC[C@@H](NC(=O)[C@H](Br)C1CCCC1)C(C)(C)C)C(=O)OC(C)(C)C 2278545746 JXDFYJDCFMZTKE-HZPDHXFCSA-N 433.431 4.728 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)C(C)(C)CCBr 2300239739 CFQDGNRCJZTUPP-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE CCN(C)C[C@@H](Cl)CCc1ccc(I)c(Br)c1 2306218286 YPPVZROOUWUDMD-NSHDSACASA-N 430.555 4.545 50 10 IJGE COc1c(Br)cc([C@@H](Br)[C@@H]2C[C@H]2Br)c(OC)c1C 2313498336 ZNTCMGDIAZZPQD-ZOFUNIGCSA-N 442.973 4.994 50 10 IJGE FC1(F)CC[C@@H]1CO[C@@H](CI)c1ccc(Br)cc1 2313734618 YKYCLKCTVCZGEU-PWSUYJOCSA-N 431.058 4.987 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc(Cl)c1OC 2323608963 XRGFAJBLVPXZII-UHFFFAOYSA-N 446.960 4.888 50 10 IJGE C[C@H](NC(=O)C(C#N)=CN1CCN(c2cccc(Cl)c2)CC1)c1ccc2c(c1)CCCC2 2325118603 SGGHRRGAKKWKQJ-IBGZPJMESA-N 448.998 4.626 50 10 IJGE CN(C[C@@]1(CBr)CC1(F)F)C1CCC(N(C)C(=O)OC(C)(C)C)CC1 2326916292 ZZMKSVXBZPECDA-KVULBXGLSA-N 425.358 4.517 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H](CBr)C2(CC2)C1 2327393315 UDKCOVPXSKOSKH-NSHDSACASA-N 440.550 4.552 50 10 IJGE CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)C(C#N)=Cc3ccc(F)cc3)c2C(N)=O)C1 2329644227 NZEDSFRNXFTUDT-OAHLLOKOSA-N 425.529 4.683 50 10 IJGE CN(Cc1cccc(I)c1)CC1(CBr)CC(C)(C)C1 2345006012 HMDHYTBDJCCTBM-UHFFFAOYSA-N 436.175 4.924 50 10 IJGE Brc1cccc([C@H](CI)OC[C@@H]2O[C@H]3CC[C@H]2C3)c1 2352707573 LTXWNIGEHGMRFQ-MXAVVETBSA-N 437.115 4.509 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)CN1c1c(CBr)c(C(F)F)nn1C 2365332641 JYFAUFRTDQJENX-CABCVRRESA-N 441.364 4.599 50 10 IJGE CCOc1cc(C(=O)N/N=C/c2ccc(Cl)cc2Cl)cc(OCC)c1OCC 10038388 PTXSGKLUWWJEIN-FSJBWODESA-N 425.312 4.953 50 10 IJGE CC(C)(C)c1ccc(C(=O)NC(=S)NNC(=O)c2ccc(-c3ccccc3)cc2)cc1 12573688 HXBWYOWLEDFTQC-UHFFFAOYSA-N 431.561 4.600 50 10 IJGE CCCOc1ccc(/C(CC)=N\NC(=O)[C@]2(C)CC2(Br)Br)cc1 13136677 JZJCPZOBTUPRMA-IEOAWGNMSA-N 446.183 4.602 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C/c2ccccc2OCC)c(OCC)c1 40950340 QNARZRCPTVOJFR-HUYXPJJLSA-N 435.476 4.573 50 10 IJGE Nc1nc2ccc(C(=O)N/N=C\c3ccc(OCc4ccccc4)c(Cl)c3)cc2s1 169916822 SHSGMINLGPOKGY-ROTLSHHCSA-N 436.924 4.875 50 10 IJGE CCCCCOc1ccc(/C=C/C(=O)Oc2cccc(/C=C(/C#N)C(=O)OC)c2)cc1OC 206679695 TZSJAYFVCLENOD-COYSUQGBSA-N 449.503 4.963 50 10 IJGE O=C(NCC1(CCBr)CC1)c1cc(Br)cc(Br)c1 232456105 AYFWRIFNRXRYGD-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE Cc1nn(-c2ccccc2)c(Cl)c1C=NNC(=O)COc1cc(Cl)ccc1Cl 252619581 LQMFGIKGMLLUAK-UHFFFAOYSA-N 437.714 4.670 50 10 IJGE COc1ccc(C(=O)NN=C2CCN[C@@H]3CCCC[C@H]23)cc1COc1ccccc1Cl 254527541 MDTKETGJOMDZSA-AZUAARDMSA-N 441.959 4.566 50 10 IJGE CC(C)[C@@](C)(CBr)NC(=O)c1cc(Br)c(Br)s1 398553128 JGVBUWARKPKFMA-LLVKDONJSA-N 448.018 4.813 50 10 IJGE CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNc1cccc2cnccc12 749291870 MSPMAIRVVMKYFJ-HXUWFJFHSA-N 445.350 4.829 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@H]1CCCN(Cc2nc(O)c3cnn(-c4ccccc4)c3n2)C1 1654678577 JQYVRQIECIAZNK-SFHVURJKSA-N 439.636 4.507 50 10 IJGE Cc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1cccc(Cl)c1)C(C#N)=C(N)O2 1865683738 ODHSBMWCCKLCPJ-IBGZPJMESA-N 429.282 4.904 50 10 IJGE CCOC(=O)CN(C(=O)/C(C#N)=C/c1ccc(Br)cc1)c1ccc(Cl)cc1 1866367731 JABURVZVHRXMGI-RVDMUPIBSA-N 447.716 4.606 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(O[C@@H]2COC3(CCCCC3)C2)C1 1879030685 VWCHYOOXPZJLPY-OXJNMPFZSA-N 432.399 4.659 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1ccc(Cl)cc1Br 1882088113 OOFWUXJMRRXNLG-NSHDSACASA-N 427.564 4.933 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)C(=O)c1ccccc1I 1915090583 MRIHGHPBLRTXQR-HNNXBMFYSA-N 427.713 4.951 50 10 IJGE O=C(N[C@@H](CCCl)C(F)(F)F)c1csc(Br)c1Br 1918540882 MWBROXKLLQMPRT-YFKPBYRVSA-N 429.483 4.563 50 10 IJGE O=C(NCC[C@@H](Br)C1CC1)c1csc(Br)c1Br 1945189014 GUYHTJLYGAASBE-MRVPVSSYSA-N 446.002 4.567 50 10 IJGE FC(F)(CBr)c1cc(I)ccc1Br 1951559252 ZFNWHUDBBCLVGE-UHFFFAOYSA-N 425.836 4.540 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC[C@@H]1C[C@@H]1C1CCCC1 1993088823 IUJONRVOFKJHCA-DAYGRLMNSA-N 437.362 4.548 50 10 IJGE Cn1cc(Br)c(CC(CBr)(CBr)C2CCCC2)n1 2027122057 KTICYFOPJVJOGS-UHFFFAOYSA-N 443.021 4.692 50 10 IJGE CC[C@H](Br)[C@@H](CC)NC(=O)c1c(Br)cccc1Br 2033085666 FVVWBIIESYCJPH-GZMMTYOYSA-N 441.989 4.894 50 10 IJGE FC(F)(F)c1cc(I)c(CCl)c(I)c1 2060238312 GLZJPCYJJRCDJA-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE ClC[C@@H](Nc1ncc(I)cc1Br)c1ccccc1 2069526420 VSHFBRKRXSFSBI-GFCCVEGCSA-N 437.506 4.841 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1C(=O)c1cccc(Br)c1Br 2073314584 HNEVIFWOSMKFFX-LDYMZIIASA-N 439.973 4.600 50 10 IJGE Fc1cc(F)cc(Cn2nc(CBr)c(Br)c2C(F)(F)F)c1 2079234531 YYYIBGSRGZWBSH-UHFFFAOYSA-N 434.000 4.886 50 10 IJGE O=[N+]([O-])c1c(CBr)nn(Cc2cccc(C(F)(F)F)c2)c1C(F)(F)F 2079250679 IZHIMMQDYKITLO-UHFFFAOYSA-N 432.118 4.772 50 10 IJGE ClCc1cnc(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)c(Br)c1 2092523124 FDAZPPSTLJIVTQ-OALUTQOASA-N 434.809 4.931 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2[C@]12C[C@H]1CN(Cc1ccccc1)C2 2099677871 CWAHLRKKAPJYJA-XOBRGWDASA-N 434.740 4.908 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@@H]2CCC[C@H](C1)C2Cl 2111476945 SCKMNGVBGXEXRV-OQJHAAMPSA-N 427.589 4.753 50 10 IJGE COc1cc(Cl)c([C@H](Cl)c2cc(I)sn2)cc1OC 2120033603 UGXKSMWPYHXQLI-LBPRGKRZSA-N 430.094 4.747 50 10 IJGE Fc1ccc(C(CBr)(CBr)CCS[C@H]2CCOC2)cc1 2149123177 MNJFLOODJPJYTK-AWEZNQCLSA-N 426.189 4.766 50 10 IJGE C[C@@H]1CCCC[C@]1(CNC(=O)OC(C)(C)C)NC(=O)c1ccc(CBr)cc1 2162496110 XPSYWZFWGKUDRN-QVKFZJNVSA-N 439.394 4.785 50 10 IJGE O=C(N[C@@H](CBr)c1ccsc1)c1c(F)cc(Br)cc1F 2175664851 BMVNEQLTQVKDFH-NSHDSACASA-N 425.092 4.655 50 10 IJGE O=C(c1ccc(Br)c(Cl)c1)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Br)C2 2190677966 JRAVLIIZDFPSHO-JAAHAHCPSA-N 425.523 4.581 50 10 IJGE Br[C@@H]1CN(C[C@H]2CC2(Br)Br)CC12CCCCC2 2213081636 DCXPXDISSHIQFU-GHMZBOCLSA-N 430.022 4.522 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C1CC([C@H]2CCN(C(=O)OC(C)(C)C)C2)C1 2241364340 HJQHTFNQOUHWOX-SLTXQBBLSA-N 447.414 4.558 50 10 IJGE C[C@@H](Br)CN(CC(C)(C)C)C(=O)c1ccc(I)cc1 2272439654 RXXYLODVCPTWNZ-LLVKDONJSA-N 438.147 4.563 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Br)c1nn(C)cc1Cl 2277882793 FXNCNCPXHNBPDT-JTQLQIEISA-N 428.939 4.982 50 10 IJGE Cc1ccc(NC(=O)C(C#N)=Cc2c(Oc3ccccc3)nc3c(C)cccn3c2=O)cc1 2296718580 ZVTRMZAGUQEXPY-UHFFFAOYSA-N 436.471 4.649 50 10 IJGE CC1CCC([C@H](CBr)NC[C@@H]2CC2(Br)Br)CC1 2306825762 LJFINHKRGJGBME-QQFIATSDSA-N 432.038 4.672 50 10 IJGE Cc1ccc(-c2ccc(C=C(C#N)C(=O)Nc3sc4c(c3C(N)=O)CCCC4)o2)cc1 2314571157 BZGNCWGNPMVZNK-UHFFFAOYSA-N 431.517 4.840 50 10 IJGE COc1ccc(C=NNC(=O)c2c(C)ccc3ccccc23)c(Br)c1OC 2323675390 JAOJYKJPNBGZES-UHFFFAOYSA-N 427.298 4.692 50 10 IJGE Cc1cc(Br)ccc1NC=C(C#N)C(=O)Nc1ccc(Br)cc1 2324090771 JQAUDMKINNXZBU-UHFFFAOYSA-N 435.119 4.978 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Br)c2)C[C@@]1(C)CCl 2325214486 OSESQWUCQMPIII-QMTHXVAHSA-N 442.566 4.751 50 10 IJGE CCCCCOc1ccc(/C=N/NC(=O)CSc2nc3ccccc3o2)cc1OC 32519985 DXYDAQZCXVFAKX-OEAKJJBVSA-N 427.526 4.648 50 10 IJGE CCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cccc(F)c1 38678332 SCKXPYVHJHCTFB-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE Cc1ccccc1NC(=O)/C(C#N)=C/c1c(Oc2ccccc2)nc2c(C)cccn2c1=O 39992804 RKWZINWZRRUTKF-XDJHFCHBSA-N 436.471 4.649 50 10 IJGE CCCOc1ccc(/C=C(\C#N)C(=O)Nc2cc(OC)c(C(=O)OCC)cc2Cl)cc1 41013347 DINLMSLFANTQEK-LFIBNONCSA-N 442.899 4.860 50 10 IJGE Cc1ccc(Cn2cc(/C=N\NC(=O)CC[C@H](O)c3ccccc3)c3ccccc32)cc1 58891241 LEQVSTIIVZYWLR-VUMGZPTDSA-N 425.532 4.962 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc(C)cc2)cc([N+](=O)[O-])c1OCc1cccc(C)c1 169885824 IOYRCJNEVDTOSF-QFEZKATASA-N 433.464 4.563 50 10 IJGE CCCOc1ccc(/C=C/C(=O)Oc2cccc(/C=C(/C#N)C(=O)OCC)c2)cc1OC 206683942 NMJSMTKFMQGULB-MGFARZDGSA-N 435.476 4.573 50 10 IJGE CCC[C@@H](Br)CNC(=O)c1cc(Br)sc1Br 233265773 SMWRYEWIBVJJML-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3cccc(F)c3)n2-c2ccccc2)cc1 263626202 SYJYXFWAPQWGFA-UHFFFAOYSA-N 445.523 4.624 50 10 IJGE CC1(C)CN(C(=O)c2cc(Br)sc2Br)C[C@@H]1Br 387894020 QFNYGOUKLOJWAX-ZETCQYMHSA-N 446.002 4.519 50 10 IJGE CC(C)[C@H](CBr)CNC(=O)c1ccc(Br)cc1Br 394183946 KUFSQVHMWYBVGT-SECBINFHSA-N 441.989 4.609 50 10 IJGE C[C@H](CCBr)CCNC(=O)c1cc(Br)ccc1Br 397727610 CZXHLSRFJGHNJH-SECBINFHSA-N 441.989 4.753 50 10 IJGE C[C@H](CCBr)CCNC(=O)c1scc(Br)c1Br 705441021 HPNDWCUVQHKAOM-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE COc1ccc(-c2nc(C(=O)Oc3ccc([N+](=O)[O-])c4ncccc34)cs2)cc1OC 770129979 CUNCLTAOHPMNFA-UHFFFAOYSA-N 437.433 4.503 50 10 IJGE Cc1cc(C=NNC(=O)CC(=O)NC2CCCCC2)c(C)n1-c1cc(Cl)cc(Cl)c1 1084381175 IIODNBKKZZZGKI-UHFFFAOYSA-N 449.382 4.690 50 10 IJGE O=C(Nc1ccccc1)Nc1ccc(C(=O)NNc2nc3ccccc3[nH]c2=S)cc1 1148222502 DWGLURAXDIILAL-UHFFFAOYSA-N 430.493 4.693 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865709854 IPXTYPYDDGETJP-JOCHJYFZSA-N 443.507 4.627 50 10 IJGE N#C/C(=C\c1ccc(Br)cc1)C(=O)Nc1cccc(-c2cccc(C(=O)O)c2)n1 1866129512 XJHRHWFYYAHHHK-GZTJUZNOSA-N 448.276 4.755 50 10 IJGE CC[C@H](NC(=O)[C@H](Cc1ccncc1)c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1866708601 WFHMPOQPMBULSE-PKTZIBPZSA-N 444.560 4.515 50 10 IJGE CC[C@H](NC(=O)c1csc(Br)c1Br)[C@@H](C)Br 1937736919 BOCYIXMWEDQGAF-VDTYLAMSSA-N 433.991 4.565 50 10 IJGE ClCc1c(Cl)ncn1-c1ccc(I)c(Br)c1 1982522804 XIVMLCOVMOBXQE-UHFFFAOYSA-N 431.886 4.632 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CCCC[C@@H]1F)C(=O)OC(C)(C)C 1991632821 DCUGRMFOFCSVKP-VBQJREDUSA-N 443.341 4.734 50 10 IJGE CC1(C)OCCO[C@@H]1[C@@H](Br)c1sc(Br)cc1Br 2013734247 NGVZPHXZLKYIMJ-WCBMZHEXSA-N 449.002 4.903 50 10 IJGE O=C(CBr)c1c(OC(F)(F)F)ccc(C(F)(F)F)c1Br 2054797536 YZGQTFHQYGJTSV-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE O=C(CBr)c1c(Br)cc(OC(F)(F)F)cc1Br 2054917847 YHAFTFCGVDGSMB-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE C[C@H]1COc2ccc([C@@H](Br)c3cc(I)sn3)cc21 2056489773 GRBNTOMTNNDPBC-WPPNPWJKSA-N 436.112 4.728 50 10 IJGE C[C@H]([C@@H](Br)c1cc(I)cc2c1OCC2)C(F)(F)F 2059188618 HWUZDFSETBZYCD-LHLIQPBNSA-N 435.021 4.861 50 10 IJGE O=C(OCc1ccccc1)N1CCC2(CC1)CCN2Cc1ccc(CBr)cc1 2062780783 JTALLDNQJQTJBE-UHFFFAOYSA-N 443.385 4.959 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc(CCNC(=O)[C@@H](Br)C2CCCC2)c1 2110714450 DAWVEMDEJFWRAU-KRWDZBQOSA-N 425.367 4.646 50 10 IJGE CO[C@]1(C(F)(F)F)C[C@H](C(=O)N(Cc2ccccc2)[C@@H](CBr)C(C)C)C1 2125556954 XTYAOFRFOYKOHT-XYJFISCASA-N 436.312 4.792 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1[C@H]2CC[C@@H]1C[C@@H](CCl)C2 2128152183 PNNBCMRTKKKXLA-PSVAKVPMSA-N 427.589 4.895 50 10 IJGE COCC1CC(O[C@](C)(CI)c2ccccc2Br)C1 2142497049 PTCLMWBBXADHSL-KOHJWAIASA-N 439.131 4.541 50 10 IJGE O=C(c1ccc(Br)c(Cl)c1)N1CC[C@@H](CBr)C(F)(F)C1 2146375705 QRHXXQUWUBJPPQ-VIFPVBQESA-N 431.502 4.595 50 10 IJGE Cc1cc(C(=O)NCC2(F)CCC(CBr)CC2)sc1Br 2178581324 PCLKADAFQMKTJI-UHFFFAOYSA-N 427.177 4.842 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@@H](CBr)C2CC2)C[C@H]1c1ccccc1 2185528323 HBLILFWUYYNPPS-AQNXPRMDSA-N 437.422 4.648 50 10 IJGE O=C(c1cc(Br)ccc1Cl)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Br)C2 2190678784 NNYURTWKDWDNHZ-JAAHAHCPSA-N 425.523 4.581 50 10 IJGE FC1(F)C[C@@]1(Br)Cn1c(CCCl)nc2c(Br)cccc21 2202503539 GVMPLNYIDCGGAZ-GFCCVEGCSA-N 428.502 4.753 50 10 IJGE Cl[C@H]1COC[C@H]1c1sc(Br)c(Br)c1Br 2209977222 QAHSQHZNAAOIHI-DMTCNVIQSA-N 425.367 4.757 50 10 IJGE CN(C(=O)Cc1ccc(Br)cc1Cl)[C@H](CCBr)C(F)F 2237437947 BMTASJUIUJYVLP-LLVKDONJSA-N 433.518 4.522 50 10 IJGE CN(C(=O)Cc1ccc(Br)cc1Cl)[C@H](CBr)C(C)(C)C 2237444057 PUKXIYUUBSKTDY-CYBMUJFWSA-N 425.592 4.913 50 10 IJGE COc1ccc([C@H](Br)c2cscc2F)cc1I 2248895578 QDNCFRNXOWPMDL-LBPRGKRZSA-N 427.076 4.985 50 10 IJGE O=C(N[C@H]1CC[C@H](CBr)CC1)c1cc(F)c(Br)cc1Cl 2282984779 USSZNSQKXYNOEI-KYZUINATSA-N 427.539 4.925 50 10 IJGE C[C@@H]1CN(C(=O)c2ccc(Cl)c(I)c2)CC[C@@H]1CCCl 2283654755 FDEPOMWAMZTRET-MNOVXSKESA-N 426.125 4.672 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@]1(C)CBr 2285844974 UBHNSIGDSPXTST-CLAHSXSESA-N 427.539 4.735 50 10 IJGE CC(C)(C)[C@H]1[C@@H](Br)CCN1Cc1sccc1I 2301073416 IKPNHSVNQZETGH-JOYOIKCWSA-N 428.177 4.737 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](OC[C@@H]2C[C@H]3CCC[C@H]2CC3)C1 2301132083 UXWADPLOJUNPPO-QUSNUVHPSA-N 449.373 4.642 50 10 IJGE CC1(C)CN(Cc2cc(I)ccc2Cl)C[C@H]1Br 2307329025 VBFDWGGJIMFXFF-GFCCVEGCSA-N 428.539 4.550 50 10 IJGE CCCOc1ccc(C=C(C#N)C(=O)Nc2sc(C(C)=O)c(C)c2C(=O)OCC)cc1 2314736692 SIRMULHNGBGEGU-UHFFFAOYSA-N 440.521 4.770 50 10 IJGE Br[C@@H]1CC[C@@H]2CCCN(Cc3sccc3I)[C@H]2C1 2316761323 CWGINHWQIKSRJZ-LOWVWBTDSA-N 440.188 4.881 50 10 IJGE CCN(C[C@@](C)(CBr)OCc1ccc(COC)s1)C(=O)OC(C)(C)C 2319542802 VOKUGQAWRIUPMQ-GOSISDBHSA-N 436.412 4.822 50 10 IJGE N#CC(=CNc1ncc(Br)cn1)C(=O)NC1CCCCCCCCCCC1 2325489272 FOMFTWLBHSFCOR-UHFFFAOYSA-N 434.382 4.848 50 10 IJGE Cc1cccc(CO[C@@H](CI)c2ccc(Br)cc2)n1 2341708753 DYIHNTFKSYYLGB-HNNXBMFYSA-N 432.099 4.845 50 10 IJGE C[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](CCBr)COCc1ccccc1 2343704075 FJNPDRSSGYCHFV-QAPCUYQASA-N 440.765 4.594 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1C1CCN(C[C@@]2(CBr)CC2(F)F)CC1 2351888541 XCSXELJUPVZSHA-YJBOKZPZSA-N 437.369 4.518 50 10 IJGE COc1ccc(CC(=O)Oc2ccc(/C=C(/C#N)c3ccccc3)cc2OC)cc1OC 31901910 DZUXUPZVMQUPMZ-BKUYFWCQSA-N 429.472 4.925 50 10 IJGE CCOc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccc1)CCC2 40803995 BIBPIBAXYIOWAE-ZXVVBBHZSA-N 431.492 4.709 50 10 IJGE C=CCOc1ccc(/C=C2/C(=O)N(Cc3ccccc3Cl)C(=O)C(C#N)=C2C)cc1OC 101305691 VKGOLCJLDKKETO-XDHOZWIPSA-N 448.906 4.706 50 10 IJGE CCN(Cc1ccccc1)c1ccc(/C=N\NC(=O)c2ccc3nc(S)[nH]c3c2)cc1 169917378 DGFAJMACLZMRFZ-MYYYXRDXSA-N 429.549 4.642 50 10 IJGE COc1cc(/C=N/NC(=O)c2cc3ccccc3n2C)ccc1OCc1ccc(C)cc1 169925972 IQGYDYDJBUECEE-JVWAILMASA-N 427.504 4.838 50 10 IJGE CCOc1cc(/C=N\NC(=O)Nc2cccc(Cl)c2)cc(Br)c1OC 169943173 VZRQQWDSGBDKMN-JMIUGGIZSA-N 426.698 4.665 50 10 IJGE CCCO[C@H]1[C@@H](Oc2c(Br)cccc2Br)C[C@H]1Br 233240526 TWKVFHOHWXHILT-NTZNESFSSA-N 442.973 4.921 50 10 IJGE CC1(C)[C@@H](Br)CCN1C(=O)c1cc(Br)ccc1Br 311225407 QRGHQYYESRWPTF-NSHDSACASA-N 439.973 4.600 50 10 IJGE CC[C@@H](NC(=O)c1ccc(Br)cc1Br)[C@@H](C)Br 386698401 MGKOSQSAZZLPOH-RDDDGLTNSA-N 427.962 4.503 50 10 IJGE C[C@H](Br)CC(C)(C)CNS(=O)(=O)c1ccc(Br)cc1Cl 393583543 MOAFBCOKXLBNFL-VIFPVBQESA-N 447.620 4.581 50 10 IJGE COc1ccc(F)c(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)c1 755603375 PXCHUJQPWWKBFM-LFIBNONCSA-N 449.873 4.811 50 10 IJGE O=C(CCCc1nnc(-c2ccc(Cl)cc2Cl)o1)NNc1cccc(F)c1F 787133487 FHDYCMBUWWYSJF-UHFFFAOYSA-N 427.238 4.788 50 10 IJGE O=C(NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)Nc1nc(C(F)(F)F)cs1 796588941 YNMVHBHYUTUQJA-UHFFFAOYSA-N 448.352 4.786 50 10 IJGE O=C(NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)[C@H]1C[C@@H]1c1cc(F)ccc1F 804206084 BWMUNKPPGMZQCG-ZBFHGGJFSA-N 434.368 4.687 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)c1 1176937681 RSJHSSWVZNGRMQ-UHFFFAOYSA-N 430.577 4.830 50 10 IJGE C#C[C@H](NC(=O)NNc1nc(Cl)c(Cl)cc1Cl)c1ccc(Br)cc1 1230498523 FJUXIDHQAMYZRV-LBPRGKRZSA-N 448.535 4.805 50 10 IJGE C=CCNC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(C)c2)c1C 1352385093 WFGMPIODNBWICF-JWGURIENSA-N 438.531 4.864 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)C1(c2ccc(Br)cc2)CCC1 1453775311 YKDMXADGAYEZFA-UHFFFAOYSA-N 429.343 4.620 50 10 IJGE C[C@@H](SCc1nc(O)c2ccccc2n1)C(=O)NN(Cc1ccccc1)c1ccccc1 1525359700 QBYMIBXSWVFWJJ-GOSISDBHSA-N 444.560 4.695 50 10 IJGE C/C(=C/C1CCC(C)CC1)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1 1544388624 PGRPTQCHEHHLOT-MPZHGACVSA-N 445.607 4.534 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cc(Cl)cc(Br)c1F 1633443256 DKLLIGOUMVGARG-UHFFFAOYSA-N 427.686 4.604 50 10 IJGE C#C[C@@H](NC(=O)NNc1cc(C(F)(F)F)ccc1Br)c1ccc(F)cc1 1686917791 VTATVAAJIIXNDC-CQSZACIVSA-N 430.199 4.608 50 10 IJGE CCCc1nn(-c2ccc(Cl)cc2)c2c1[C@@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865683136 GRIPFBKFCWEBPG-NRFANRHFSA-N 433.943 4.762 50 10 IJGE C[C@@H](c1ccncc1Br)[C@@H](Br)c1nn(C)cc1Br 1924058242 VJCJQSZQIIOGAG-WRWORJQWSA-N 437.961 4.580 50 10 IJGE CC[C@H](C[C@H](C)Br)NC(=O)c1csc(Br)c1Br 1945183660 KUHZQTGOBLLJSX-NKWVEPMBSA-N 448.018 4.955 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(c2ccccc2)CCN(C[C@@H](CBr)C2CCC2)C1 1966413746 DEOZSRREHWLFGF-XMSQKQJNSA-N 437.422 4.924 50 10 IJGE O=C(OCc1ccccc1)N1CCC2(CC1)CCN2C[C@H](CBr)C1CCC1 1999502576 UDPPSHVLLOBOHT-FQEVSTJZSA-N 435.406 4.675 50 10 IJGE CC1(C)C[C@H](CCl)CN(c2ncc(I)cc2Br)C1 2069530109 VLNOQHLTKVTACB-SECBINFHSA-N 443.554 4.540 50 10 IJGE Cc1cccc(O)c1Cn1nc(CBr)c(Br)c1C(F)(F)F 2079231939 JIASDLLRUUERHS-UHFFFAOYSA-N 428.046 4.622 50 10 IJGE Clc1cc(CN2[C@H]3CC[C@H]2[C@H](CBr)C3)ccc1I 2086660543 FUPATEVZXUMENC-MJVIPROJSA-N 440.550 4.692 50 10 IJGE CO[C@](C)(COCc1ccccc1)Cn1c(CCl)nc2cncc(Br)c21 2095437264 MKINGAQEMJNCBM-IBGZPJMESA-N 438.753 4.555 50 10 IJGE CC(C)[C@H](Br)C(=O)Nc1ccc(CCCCNC(=O)OC(C)(C)C)cc1 2106201710 XWTSHANABZZXLV-KRWDZBQOSA-N 427.383 4.892 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@@H]1CCCN(C[C@@H](Br)C(F)(F)F)C1 2106789423 YKAXEOQZXXIDGF-RBSFLKMASA-N 443.348 4.814 50 10 IJGE CC[C@@]1(CNC(=O)[C@H](Br)C2CCCC2)CCCCN1C(=O)OC(C)(C)C 2110723814 OWLDNGHYFKWHAS-UZLBHIALSA-N 431.415 4.626 50 10 IJGE C[C@@H]1[C@@H](C(F)(F)F)N(CC2(CBr)CCCC2)CCN1C(=O)OC(C)(C)C 2115980181 OUGWGLYDARNRRE-KGLIPLIRSA-N 443.348 4.814 50 10 IJGE O=S(=O)(c1ccc(OCCBr)cc1)N(Cc1ccccc1)C1CCCC1 2123270086 LREIRNTXRHDKMT-UHFFFAOYSA-N 438.387 4.594 50 10 IJGE Clc1cccc(N2CC[C@H]3OCCN(Cc4ccccc4)[C@H]3C2)c1CBr 2129053539 NNDWVVPQESMCDL-LEWJYISDSA-N 435.793 4.715 50 10 IJGE CCC(CC)[C@@H](Br)CNC(=O)c1ccc(I)c(C)c1 2142107556 QXMMXLKPTMJOEO-ZDUSSCGKSA-N 438.147 4.529 50 10 IJGE CCN(Cc1cccc(NC(=O)N2CCC(Br)CC2)c1)C(=O)OC(C)(C)C 2162485256 BNYRFLFIKCKMFQ-UHFFFAOYSA-N 440.382 4.835 50 10 IJGE CC(C)(C)[C@H](CBr)CN1CCCC[C@@H]1[C@H]1CCCN(C(=O)C(F)(F)F)C1 2163064845 WNQYLVAQFUCITB-ARFHVFGLSA-N 441.376 4.699 50 10 IJGE ClCCc1nc2cc(I)ccc2n1[C@H]1C[C@H](Br)C1 2263446640 PKYBUNHBECTBOJ-CZMCAQCFSA-N 439.522 4.521 50 10 IJGE CN(Cc1ccc(I)cc1)c1ccc(CBr)cc1C#N 2280336441 QYCBNKBTEYTNJL-UHFFFAOYSA-N 441.110 4.694 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@H]1COC2(CCC2)C1 2284739710 KRLQHWLUFDMYCR-RISCZKNCSA-N 449.126 4.621 50 10 IJGE COCc1ccccc1[C@@H](Br)c1ccc(OC)c(I)c1 2285004575 UEGPBLLEMRUFRI-INIZCTEOSA-N 447.110 4.931 50 10 IJGE CS(=O)(=O)c1cscc1[C@H](Br)c1ccc(F)c(Br)c1F 2288500772 KZFRUBXBRHSZRT-SNVBAGLBSA-N 446.132 4.677 50 10 IJGE CCC[C@@H]1CN(Cc2sccc2I)C[C@@H]1CBr 2301079532 VHEHPNYKURAWLC-MNOVXSKESA-N 428.177 4.596 50 10 IJGE Cc1nc(-c2ccc(F)cc2)ccc1C(=O)NN=Cc1ccc(F)c(Br)c1 2321246487 SPQHKWAFTYDQBR-UHFFFAOYSA-N 430.252 4.862 50 10 IJGE COc1cc(C=NNC(=O)Nc2ccccc2)cc([N+](=O)[O-])c1OCc1ccc(C)cc1 2323063544 CQUZYSZRGMFSMC-UHFFFAOYSA-N 434.452 4.646 50 10 IJGE CCOc1cc(C=NNC(=O)Cc2ccc(N)cc2)ccc1OCc1cccc(Cl)c1 2323318114 YJCNXAKCCPASKV-UHFFFAOYSA-N 437.927 4.593 50 10 IJGE Cl[C@H]1CC[C@H]2CC[C@H]1N2Cc1ccc(I)c(Br)c1 2325212540 OSVLGGOCRZHXBO-VHRBIJSZSA-N 440.550 4.788 50 10 IJGE C[C@@H]1[C@H](Cl)CCN(Cc2ccc(I)c(Br)c2)[C@@H]1C 2325214242 NUAWTQREJWNBJQ-OPQQBVKSSA-N 442.566 4.891 50 10 IJGE ClC[C@@H]1CCCN(Cc2ccc(I)c(Br)c2)CC1 2325224093 TWFCZVDNWKQBJZ-LLVKDONJSA-N 442.566 4.895 50 10 IJGE COc1ccc(C=C(C#N)C(=O)NCc2ccc(-c3ccccc3OC)cc2)cc1OC 2329700997 LIYDJGOQXCMQRJ-UHFFFAOYSA-N 428.488 4.603 50 10 IJGE COc1cc(CBr)cc(N(C)[C@H]2C[C@@H]3C[C@H](OCc4ccccc4)C[C@H]23)n1 2364761520 IGTIUADAMJVDFB-MUGJNUQGSA-N 431.374 4.805 50 10 IJGE FC(F)(F)c1ccc(CBr)c(N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)n1 2369843360 UWPQPEWZBNQTGW-CALCHBBNSA-N 440.307 4.564 50 10 IJGE CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc(COc2ccc(F)cc2)c(C)cc1C 2727806 UQVZWMVFFLVKKP-HSZRJFAPSA-N 436.483 4.666 50 10 IJGE CCCCCCOc1ccccc1C(=O)NNC(=O)COc1cc(C)c(Cl)c(C)c1 14032632 BHPUKFVYDAJINN-UHFFFAOYSA-N 432.948 4.756 50 10 IJGE Cc1c(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)c2ccccc2n1Cc1ccccc1Cl 59396270 JBSXUPSATMPARC-ACSPXDACSA-N 433.939 4.854 50 10 IJGE COc1cc(/C=N\NC(=O)Nc2ccccc2C)cc([N+](=O)[O-])c1OCc1ccc(C)cc1 169940080 HXZKKOWDBLQXPX-QFEZKATASA-N 448.479 4.955 50 10 IJGE O=C(NN=Cc1c(Cl)cccc1Cl)/C(=C\c1cccs1)NC(=O)c1ccccc1 252624791 PVEOPHGPQHCEQK-SAMODZKWSA-N 444.343 4.976 50 10 IJGE CCCCCCOc1ccc(C=NNC(=O)COc2ccccc2OCC)cc1OC 256017187 CKEHYTHHKZZAHM-UHFFFAOYSA-N 428.529 4.582 50 10 IJGE Fc1cccc([C@H](Br)c2cc(I)cc3c2OCC3)c1 388491342 ZMJFPFTURGNRSP-AWEZNQCLSA-N 433.058 4.850 50 10 IJGE Clc1ccc(I)c(CN2CCC(CCBr)CC2)c1 405238696 AGUKVXOHJCBAKB-UHFFFAOYSA-N 442.566 4.942 50 10 IJGE Cc1c(Cl)cccc1NNC(=O)CSCc1nc(O)c2c3c(sc2n1)CCCC3 748528479 JWCRFMIOQZQZQD-UHFFFAOYSA-N 449.001 4.614 50 10 IJGE Cn1c(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc2cc(C(F)(F)F)ccc21 799748757 YFWODLVFSBQWMK-UHFFFAOYSA-N 426.320 4.844 50 10 IJGE COc1ccc(C=NNC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)c(OC)c1 1084639971 CAXVHLPUKNWJIT-UHFFFAOYSA-N 432.520 4.559 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCCCc2nc3ccccc3s2)c(C)n1C[C@@H]1CCCO1 1087661254 TYVLARLRIBOMGC-UKQGIEBLSA-N 448.592 4.550 50 10 IJGE C#C[C@@H](NC(=O)NNc1cc(Cl)ccc1Br)c1ccc(Cl)cc1F 1565002877 OXGFIKSMEGUUET-CQSZACIVSA-N 431.092 4.896 50 10 IJGE Cn1cccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2Cc1ccc(Cl)cc1 1865698695 AODGEBMPEFYVBK-OAQYLSRUSA-N 441.922 4.808 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2F)[C@H]1c1ccccc1O 1865708385 VTVBXJIZOQIOMR-QFIPXVFZSA-N 438.462 4.661 50 10 IJGE CCCc1nc(Nc2ccc(SC#N)cc2)cc(N2CCO[C@@H](c3cccnc3)C2)n1 1868389197 RMWDYPUHXUYWHJ-HXUWFJFHSA-N 432.553 4.719 50 10 IJGE C[C@H](C[C@@H]1CCCN1C(=O)OC(C)(C)C)[C@H](CBr)NC(=O)OC(C)(C)C 1880762727 YFBXGXYOJVXWDT-ILXRZTDVSA-N 435.403 4.700 50 10 IJGE C[C@H](CCl)N(Cc1ccccc1)C(=O)c1ccc(F)cc1I 1914222710 CJGNKCULUPALIM-GFCCVEGCSA-N 431.676 4.700 50 10 IJGE CN(Cc1c(Br)cccc1Br)C1(CBr)CCC1 1914979213 WWSPOXQGLQXQBA-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE CCC[C@@](C)(CBr)NC(=O)c1scc(Br)c1Br 1942781886 RKTMYXKBAXUSSN-NSHDSACASA-N 448.018 4.957 50 10 IJGE CC(C)N(C)C[C@H](Br)Cc1c(Br)cccc1Br 1949896596 LQFYXVJLLKJYOX-SNVBAGLBSA-N 428.006 4.858 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@@H]2C[C@H]3CC[C@H]2C3)CC1 1997929679 MQBZJHLDDCTMJW-JYJNAYRXSA-N 449.373 4.644 50 10 IJGE O=C(N[C@H](CBr)C1CCC1)c1cccc(Br)c1Br 2031476815 GNKZEZCWCLBGIL-LLVKDONJSA-N 439.973 4.505 50 10 IJGE Brc1cccc(Br)c1CN1CC[C@@H](Br)C2(CC2)C1 2033086396 LMNPVNPKVNYELW-CYBMUJFWSA-N 438.001 4.961 50 10 IJGE CC(C)(C)[C@@H](CBr)NC(=O)c1c(Br)cccc1Br 2033086773 PPILQEKBNPIJDL-SNVBAGLBSA-N 441.989 4.751 50 10 IJGE Brc1ccc(Br)c(CN2CC[C@@H](Br)C3(CC3)C2)c1 2054718299 MTANXULQMUAZSH-CYBMUJFWSA-N 438.001 4.961 50 10 IJGE C[C@@H]([C@H](Br)c1cc(I)cc2c1OCC2)C(F)(F)F 2059188624 HWUZDFSETBZYCD-WKEGUHRASA-N 435.021 4.861 50 10 IJGE Cc1c(Br)ccc([C@H](Br)[C@H]2OCCO[C@H]2C)c1Br 2083320547 KNOQFPRKQAASQE-HJIKLVIJSA-N 442.973 4.760 50 10 IJGE Cc1cc(Br)c(C)c([C@H](Cl)C2(S(C)(=O)=O)CC2)c1Br 2136371155 RMECSXUQOXYBSL-LBPRGKRZSA-N 430.589 4.686 50 10 IJGE CN(CCc1ccc(NC(=O)[C@@H](Br)C2CCCC2)cc1)C(=O)OC(C)(C)C 2167032542 NATGTAVMIUJBFN-SFHVURJKSA-N 439.394 4.988 50 10 IJGE ClCc1nc2cc(Br)cnc2n1C[C@@]12CC[C@H]1CN(Cc1ccccc1)C2 2201230067 MALWEPHMZGJDNM-KKSFZXQISA-N 445.792 4.845 50 10 IJGE Cc1ccc(C(=O)N2C[C@H](Br)CC23CCCC3)cc1I 2241039989 NXAQIBPGPPRVEI-CYBMUJFWSA-N 448.142 4.522 50 10 IJGE O=C(Nc1ccc(OC[C@H]2C[C@@H](Br)C2)cc1C(=O)O)OCc1ccccc1 2248250365 WEZQBQWBXCJMCM-GASCZTMLSA-N 434.286 4.686 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@@H](C(F)(F)CBr)C1 2264509617 LSGFUVLARJAIQO-ZCFIWIBFSA-N 437.531 4.656 50 10 IJGE CC1(C)[C@@H](Br)CC[C@@H]1NC(=O)c1cc(F)c(Br)cc1Cl 2282971890 ITDQYJFLQBBMBC-RYUDHWBXSA-N 427.539 4.924 50 10 IJGE C=CCNC(=O)C(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc(OCCC)cc1C 2296705935 AMBWFPFKTUGYAJ-UHFFFAOYSA-N 426.520 4.846 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)[C@H]1CCC[C@@H]1Cl 2306224830 UBHNVWHQVCTXRK-AAEUAGOBSA-N 428.539 4.645 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1OCc1cccc(F)c1 2313738854 UBAMVQHKIOUQMA-UHFFFAOYSA-N 447.422 4.867 50 10 IJGE Clc1ccc(CN2CC[C@H]3C[C@]2(CBr)C3)cc1I 2315551330 PLLJFGDDMVCBKJ-VDISTLRHSA-N 440.550 4.694 50 10 IJGE C=CC[C@@H](Br)[C@@H]1CCN1Cc1ccc(Cl)cc1I 2318537956 GTOWVZCLNCFOQS-OCCSQVGLSA-N 440.550 4.859 50 10 IJGE CC(C)[C@@H]1C[C@H](Cl)CN1Cc1ccc(I)c(Br)c1 2325206176 BWAINYNBTBIPNO-FZMZJTMJSA-N 442.566 4.891 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCN(C[C@H]2C[C@@H](Br)C2)[C@H](C(F)(F)F)C1 2337544380 BGHUALQPXGHHBK-XQLPTFJDSA-N 443.348 4.718 50 10 IJGE COc1c(F)c(F)cc(C(=O)N(Cc2ccccc2)[C@H](CBr)C2CC2)c1F 2361224837 HTCTUULLJKYOKM-MRXNPFEDSA-N 442.275 4.928 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1I)[C@H](CCCl)C(F)(F)F 2365589906 ALASPDZRVPITSI-SNVBAGLBSA-N 440.030 4.576 50 10 IJGE CN(C[C@H](Cl)C1CCCC1)C(=O)c1ccc(Cl)cc1I 2365601599 ZONOMZYZHGJWAW-ZDUSSCGKSA-N 426.125 4.814 50 10 IJGE COc1ccc(C=NNC(=O)c2ccccc2)cc1COc1c(F)c(F)cc(F)c1F 20573213 YPKPYBLACXLLOQ-UHFFFAOYSA-N 432.373 4.595 50 10 IJGE CSc1ccc(/C=C(\C#N)c2nc(CCN3C(=O)c4ccccc4C3=O)cs2)cc1 34720198 ZDAKAUMIGQBHTR-FOWTUZBSSA-N 431.542 4.768 50 10 IJGE CCc1ccc(Nc2ncnc(NNC(=O)C(c3ccccc3)c3ccccc3)c2N)cc1 40688536 SCKNXMPZGHRSBO-UHFFFAOYSA-N 438.535 4.640 50 10 IJGE Cc1ccc(CNC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccc(Cl)c2)CCC3)cc1 40813266 YVTWKRHMRZJJRC-VFCFBJKWSA-N 449.938 4.950 50 10 IJGE N#CCOc1c(Cl)cc(/C=N/NC(=O)c2cc3ccccc3o2)cc1Br 59304190 BNERFOHQJIAMFF-LSHDLFTRSA-N 432.661 4.515 50 10 IJGE COC(=O)c1ccc(C=NNC(=O)c2ccc(COc3cc(Cl)ccc3Cl)o2)cc1 252620893 MOPCYQQUOSLBQD-UHFFFAOYSA-N 447.274 4.716 50 10 IJGE COc1cc(C=NNC(=O)CSC2c3ccccc3-c3ccccc32)cc(OC)c1OC 254825309 WGTPQLZLTRSQMT-UHFFFAOYSA-N 448.544 4.666 50 10 IJGE O=[N+]([O-])c1ccc(N2CC[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c(CBr)c1 717413390 RNIZXXOJQBRKQT-AZUAARDMSA-N 430.346 4.733 50 10 IJGE CCCN(C(=O)c1ccccc1NC(=O)NNc1ccc(C#N)cc1C(F)(F)F)C(C)C 799407213 SXVMZTQLSVMRGN-UHFFFAOYSA-N 447.461 4.986 50 10 IJGE Cc1cc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc(C)c1OCc1cccnc1 799748484 VSXZYQJPYJLWBH-UHFFFAOYSA-N 440.425 4.925 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCCc2ccc(O)nc2)c(C)n1-c1cccc2ccccc12 1157169455 OQJNYAJIIFBWDN-HZHRSRAPSA-N 436.515 4.614 50 10 IJGE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2 1463643028 OUJQXRQUGHRMQV-YGYTWAPGSA-N 438.471 4.636 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)c1nc2ccccc2s1)c1ccc(C(F)(F)F)cc1 1633470470 CPKDERQWTRCGLD-OAHLLOKOSA-N 448.470 4.967 50 10 IJGE COc1cc(C=NNC(=O)c2ccncc2)ccc1OCc1c(Cl)cccc1Cl 1772753433 GHEAZOHBOCKKOW-UHFFFAOYSA-N 430.291 4.740 50 10 IJGE CC(=O)[C@H](Br)c1ccc(I)cc1SC(F)(F)F 1848425919 RZWJHMYKVFEGQQ-VIFPVBQESA-N 439.034 4.928 50 10 IJGE CSCc1ccc(C(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3)nc2C)cc1 1865755819 RGRYNQSABMSUAN-UHFFFAOYSA-N 425.941 4.648 50 10 IJGE N#C/C(=C\c1cccc(Br)c1)C(=O)NC1CCC(C2CCC(N)CC2)CC1 1866130816 OFQSJRVOEXKLJJ-LDADJPATSA-N 430.390 4.549 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCN(C[C@H](Br)C(F)(F)F)C2)C1 1879197713 CPXODZHUQFKXJI-KKUMJFAQSA-N 443.348 4.671 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]21 1882066843 OQOLOYILZZDBHR-KLHDSHLOSA-N 447.414 4.558 50 10 IJGE Cc1cc(F)cc(C)c1S(=O)(=O)N(Cc1ccccc1)C(C)(C)CBr 1915771189 KROLTKRZWDFVHX-UHFFFAOYSA-N 428.367 4.807 50 10 IJGE C[C@@H](c1ccncc1Br)[C@@H](Br)c1cnn(C)c1Br 1924047845 QJXPZELZOBGFQU-WRWORJQWSA-N 437.961 4.580 50 10 IJGE Cc1nn(C)c(Br)c1[C@H](Br)c1ccc(Br)s1 1986902004 WUBOHBLLHOJALQ-SECBINFHSA-N 428.975 4.799 50 10 IJGE CC1(C)CN(Cc2cc(Br)ccc2Br)[C@@H]1CBr 2006498779 GEGHUQUSFQGRNW-GFCCVEGCSA-N 425.990 4.817 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1Cc1cccc(Br)c1Br 2018118175 YGUPTMGOIDUOBR-SKDRFNHKSA-N 425.990 4.959 50 10 IJGE O=C(N[C@H]1CCC[C@H](Br)C1)c1cccc(Br)c1Br 2031478817 TZEWZOUQKSEKQR-IUCAKERBSA-N 439.973 4.648 50 10 IJGE FC(F)C1CC(O[C@H](CI)c2cccc(Br)c2)C1 2035657179 VLHDPOFHLYEHPY-QEWOUOOISA-N 431.058 4.986 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1ccc(Cl)c(Br)c1 2081236408 OWRNGCMWIIVPBD-UFBFGSQYSA-N 444.538 4.682 50 10 IJGE Fc1ccc([C@H](Br)c2ncn3ccsc23)c(I)c1 2083983201 XKOWMPTXXHIWTM-JTQLQIEISA-N 437.075 4.624 50 10 IJGE Cc1ccc(NC(=O)OC(C)(C)C)cc1NS(=O)(=O)CCC(CCl)CCl 2106296298 QKJCAMATVZHXMO-UHFFFAOYSA-N 425.378 4.568 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@@H]1CN(CC1(CBr)CCCCC1)C2 2106786678 VSUAVBMQAKZYHA-UTKZUKDTSA-N 429.443 4.959 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@H]1CC12CCC(F)(F)CC2 2107097565 ZFLAIGBIKVKAMU-DLBZAZTESA-N 430.333 4.641 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CC[C@@H](CCl)C(F)(F)C1 2150504102 SMGBXPRFVUMIIF-QMMMGPOBSA-N 431.502 4.548 50 10 IJGE Fc1cncc(N2C[C@@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)c1CBr 2153340619 GYHSWWAGELRZAF-SZPZYZBQSA-N 430.365 4.608 50 10 IJGE CC1(C)CC[C@@H](CNC(=O)c2ccc(CBr)cc2)N(C(=O)OC(C)(C)C)C1 2162485103 AQUSVRDMEWYCSJ-KRWDZBQOSA-N 439.394 4.737 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@@]2(CCl)CCC[C@]2(F)C1 2176640914 QETYARBTZILVIF-STQMWFEESA-N 445.579 4.846 50 10 IJGE CC1(C)C[C@@](C)(CCl)CN1C(=O)c1cc(Cl)ccc1I 2199537638 DILHBUBVWCGKPF-HNNXBMFYSA-N 426.125 4.814 50 10 IJGE F[C@H]1C[C@@H](Br)CN(Cc2cccc(Br)c2Br)C1 2213900123 KBZABLSBPGAPDF-ZJUUUORDSA-N 429.953 4.519 50 10 IJGE O=C(N[C@@H]1CC[C@@H]2C[C@@]21CBr)c1cc(F)c(Br)cc1Cl 2282990571 SYXAJEBDIATXIG-QVCNTJRGSA-N 425.523 4.535 50 10 IJGE CCn1c(SCC(=O)NN=CC(C)=Cc2ccccc2)nnc1-c1ccc(Cl)cc1 2293746728 PHKMNTLTDYHFQE-UHFFFAOYSA-N 439.972 4.916 50 10 IJGE CC(C)(CCCCl)CNC(=O)Cc1cc(Br)cc(Br)c1 2295316528 ZJULFSFCPYKCDN-UHFFFAOYSA-N 425.592 4.916 50 10 IJGE CCC(CBr)(CBr)Cc1cc(OC)ncc1Br 2300093475 IBNUFIDVQLFVFQ-UHFFFAOYSA-N 429.978 4.581 50 10 IJGE Cl[C@H]1CC[C@H](CNCc2ccc(I)c(Br)c2)C1 2306231970 OPGRWUSKIQCFSP-ONGXEEELSA-N 428.539 4.551 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)c2cccc3ccccc23)c(OC)c1 2314789697 VVJNORIQSRGGRV-UHFFFAOYSA-N 428.488 4.891 50 10 IJGE C[C@@H]1C[C@H](CBr)CN(Cc2ccc(Cl)c(I)c2)C1 2315550807 IRCPKPMOCHAPCA-ZYHUDNBSSA-N 442.566 4.798 50 10 IJGE Clc1ccc(CN2C[C@H]3[C@@H](Br)CC[C@H]3C2)cc1I 2315552001 YHFUGLYPNLPBCG-TUAOUCFPSA-N 440.550 4.550 50 10 IJGE COc1ccc(-c2ccc(C(=O)NN=C(C)c3ccc(Br)cc3)c(C)n2)cc1 2321266934 YIHLGTBVORLFLW-UHFFFAOYSA-N 438.325 4.982 50 10 IJGE COc1ccc(CCNC(=O)C(C#N)=CNc2ccc(Nc3ccccc3)cc2)cc1OC 2324718582 XFZMWKKXTMIUFF-UHFFFAOYSA-N 442.519 4.626 50 10 IJGE COc1c(CBr)cccc1OCc1ccc(I)cc1 2341637883 QDZFPAOSYKSWQC-UHFFFAOYSA-N 433.083 4.774 50 10 IJGE Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2ccc(OCCc3ccccc3)cc2)c1 14041605 XGMQUUZPXIQASH-UHFFFAOYSA-N 446.547 4.580 50 10 IJGE C/C(=N\NC(=O)c1ccco1)c1ccc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2C)cc1 20352675 VDJSMGBTPQTZGX-WBILBPDKSA-N 439.899 4.801 50 10 IJGE CCOC(=O)/C(C#N)=C/C=C(\c1ccc(Cl)cc1)N1CCN(c2ccc(F)cc2)CC1 33598033 WVHIJAMYZBXHNF-QMFGBYSBSA-N 439.918 4.655 50 10 IJGE O=C(CBr)c1c(Br)cc(Br)cc1Br 34271284 FOMRPOBCRRBPGM-UHFFFAOYSA-N 435.735 4.552 50 10 IJGE Cc1cccc(C)c1NC(=O)CSc1ccc(/C=N/NC(=O)c2ccc(F)cc2)o1 59507188 ZNRZLUPOLPOEFB-WYMPLXKRSA-N 425.485 4.530 50 10 IJGE COc1ccc([C@@H](C(=O)NC2CCCCCC2)N(Cc2ccccc2)C(=O)CCl)cc1 97915000 SWGYLHKTBMYBQC-DEOSSOPVSA-N 442.987 4.843 50 10 IJGE COc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2F)cc1 205644979 HTTQVIVUOUHWBQ-SXUJQFLNSA-N 442.446 4.671 50 10 IJGE Clc1cccc(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@H]32)c1CBr 404142235 GFTPJERPSINQBK-RTWAWAEBSA-N 435.793 4.715 50 10 IJGE Clc1ccc(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@@H]32)c(CBr)c1 404213550 XTOVHVZCLUCXSY-SFTDATJTSA-N 435.793 4.715 50 10 IJGE CCCCN(CCBr)C(=O)c1scc(Br)c1Br 705397874 DZYDDHOIQSKZJU-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE CN(C(=O)c1cc(Br)c(Br)s1)[C@@H]1CCC[C@@H]1Br 709100573 AXRKAWNXHCYVIQ-POYBYMJQSA-N 446.002 4.661 50 10 IJGE O=C(N[C@H](CBr)C1CCC1)c1cc(Br)cc(Br)c1 717613528 PEGMJBLOCZTQKW-GFCCVEGCSA-N 439.973 4.505 50 10 IJGE O=C(COc1ccc2ccccc2c1Br)NNc1ccc(F)c(F)c1F 727759875 FJXVBEXUTHPIJH-UHFFFAOYSA-N 425.204 4.542 50 10 IJGE O=C(NCc1cccc(COc2ccccc2)c1)NNC(=O)c1c(Cl)cccc1Cl 727841924 DIKNTSXHVRPJFE-UHFFFAOYSA-N 444.318 4.717 50 10 IJGE CCC(=O)c1ccc(OC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)c(F)c1 766547940 AXOXCOWOHOKZGL-CPNJWEJPSA-N 442.450 4.708 50 10 IJGE Cc1ccc(/C=C\C(=O)NS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)cn1 774342166 FMHPUNPGUMRZIV-WTKPLQERSA-N 428.404 4.566 50 10 IJGE Cc1ccc2nc(-c3ccc(NC(=O)C(=O)NNc4cccc(F)c4F)cc3)sc2c1 785019727 JXKPOLVUICPUFF-UHFFFAOYSA-N 438.459 4.632 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccccc2C(=O)c2ccc(F)cc2)c(C(F)(F)F)c1 799751104 LGIZEFHCVIMZSR-UHFFFAOYSA-N 427.357 4.704 50 10 IJGE CCOc1ccc(NNC(=O)c2cc(Oc3cccc(Br)c3)ccn2)cc1 817882258 GGEMQHRJVQOBPF-UHFFFAOYSA-N 428.286 4.792 50 10 IJGE CC(=O)Nc1cccc(C(=O)NN=Cc2ccc(OCc3c(C)cccc3Cl)o2)c1 1084085583 SVXIXUQWXHHTRA-UHFFFAOYSA-N 425.872 4.543 50 10 IJGE C=CCSc1ccccc1C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl 1135381705 PSRWAAWALFUJAW-UHFFFAOYSA-N 439.364 4.892 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NNc2nc3ccccc3[nH]c2=S)c(C)n1CCC(C)C 1301148136 MHCAYSPXQDAXAK-PDGQHHTCSA-N 434.569 4.807 50 10 IJGE C=CCC[C@H](C(=O)NNC(=O)COc1ccccc1Cc1ccccc1)c1ccccc1 1306168795 QCJICTBWKJPPPM-DEOSSOPVSA-N 428.532 4.554 50 10 IJGE C/C(=C\C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl)c1ccc(F)cc1 1353130339 IXWLBLDMCHDVKW-ACCUITESSA-N 425.287 4.542 50 10 IJGE CC(=O)c1ccc(OC(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)cc1Cl 1439530757 AIWOWMIVVUHXAC-ACEGTKJHSA-N 426.900 4.653 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1)c1ccccc1OC(F)F 1538898027 IGKVTUPJIYCMLQ-PEZBUJJGSA-N 432.467 4.577 50 10 IJGE Cc1cc(Br)c(Cl)c2sc(NNC(=O)C(Cl)(Cl)Cl)nc12 1615891724 FRWMOGPEMWHWMP-UHFFFAOYSA-N 437.961 4.834 50 10 IJGE C#CCOc1ccc(F)cc1NC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2 1675013935 FDTGJAHRLOQGBL-HNNXBMFYSA-N 443.544 4.517 50 10 IJGE Cc1c(C(=O)N2CCCC[C@@H]2C)oc2c1C(=NNC(=O)c1ccc3ccccc3n1)CCC2 1772751533 SZJVKIPQKABCPH-INIZCTEOSA-N 444.535 4.621 50 10 IJGE O=C(CCBr)c1cccc(I)c1SC(F)(F)F 1848425832 FZUYFAVQADRFMA-UHFFFAOYSA-N 439.034 4.871 50 10 IJGE CC(C)Oc1cccc(/C=C/C(=O)N2CCC(C(=O)Nc3ccc(SC#N)cc3)CC2)c1 1860599767 HQULVISKWKNTPL-IZZDOVSWSA-N 449.576 4.937 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1cccc(Cl)c1 1865691192 LXJPWOSYLOAIDH-JOCHJYFZSA-N 446.938 4.930 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](NC(=O)[C@H]2C[C@H]2c2ccc(F)cc2)c2ccccc2)cc1 1866938410 DIWGOVQLKUPEAH-RJGXRXQPSA-N 445.519 4.999 50 10 IJGE Brc1cccc([C@H](CI)O[C@@H]2COC3(CCC3)C2)c1 1889722796 QATHZMCDRNBSSU-KBPBESRZSA-N 437.115 4.653 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Br)cc2Br)C[C@H]1Br 1943851825 TWJYGIRAXKRUMB-NOZJJQNGSA-N 425.990 4.817 50 10 IJGE Brc1cccc(Br)c1C[C@H]1CCOCC[C@H]1Br 2001024585 TUDTUGKQUXOYNZ-MWLCHTKSSA-N 426.974 4.944 50 10 IJGE C[C@H]1CC[C@H](Br)CN1Cc1ccc(I)c(Cl)c1 2026563698 MLDSDCHBBGGVBX-ONGXEEELSA-N 428.539 4.692 50 10 IJGE COCCOC[C@@H](Br)CCc1ccc(Br)cc1Br 2038173306 IPTGVXUUWUKITN-LBPRGKRZSA-N 444.989 4.571 50 10 IJGE CCOc1cc(C=C(C#N)S(=O)(=O)c2ccc(C)cc2)cc(Br)c1OC 2040447530 UPNKZFLKRFVNMH-UHFFFAOYSA-N 436.327 4.503 50 10 IJGE C[C@@H](Br)CCc1cn(-c2cc(Br)cc(Br)c2)nn1 2068977219 MAJGZYDKGJTJEW-MRVPVSSYSA-N 437.961 4.508 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@@H]2CCC[C@H](Cl)[C@H]2C1 2094583763 LOMRWTKBUAVRTD-NRPADANISA-N 427.589 4.753 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@H]2[C@@H](Br)CCC[C@H]2C1 2115923581 HUKFNEWHVZUKHS-YIZRAAEISA-N 427.589 4.800 50 10 IJGE Brc1ccccc1[C@@H](CI)OC[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]32 2134544363 ZOZPKGYYFDPBLG-CFWQCGOVSA-N 433.127 4.844 50 10 IJGE CC(C)[C@H](Br)c1cn(Cc2ccc(Cl)c(Br)c2F)nn1 2177556999 CINRNHYTSMUVRC-NSHDSACASA-N 425.527 4.973 50 10 IJGE CCOc1cccc(CBr)c1OC[C@@H]1CC1(Br)Br 2218001754 YAKJKUDDSOIZKR-JTQLQIEISA-N 442.973 4.865 50 10 IJGE COc1ccc(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c(CBr)c1 2235970542 QVTRNWZLIMPONP-PZJWPPBQSA-N 429.402 4.939 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CCS[C@H](CCBr)C1 2253553095 UBPNAOJNEZOHDP-SSDOTTSWSA-N 433.618 4.507 50 10 IJGE CC(C)OC(=O)c1ccsc1NC(=O)C(C#N)=Cc1c(F)c(F)c(F)c(F)c1F 2297616703 BZZWUYHRYNZDAG-UHFFFAOYSA-N 430.354 4.554 50 10 IJGE CC(C)(CBr)[C@@H]1CCCN1Cc1sccc1I 2301067852 FUYBPRSDWGONOZ-LBPRGKRZSA-N 428.177 4.738 50 10 IJGE Br[C@@H]1CCN(Cc2sccc2I)C2(CCC2)C1 2301070558 DMRZBNNSKSJQEI-SNVBAGLBSA-N 426.161 4.635 50 10 IJGE CC(C)[C@@H](CBr)N(C)Cc1cc(I)ccc1Cl 2307327715 DQPWSGNKILSWDI-CYBMUJFWSA-N 430.555 4.796 50 10 IJGE BrC[C@]12CCC[C@H]1N(Cc1sccc1I)CCC2 2316760191 RLPWFLIOAORCMD-ZIAGYGMSSA-N 440.188 4.882 50 10 IJGE COc1ccc(CCN(C)C[C@H](Cl)COCc2ccccc2)c(Br)c1 2317220674 OQXLQLSXSIMUMM-SFHVURJKSA-N 426.782 4.756 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)cc2I)C[C@]1(C)CBr 2318529752 UQOAPXOCYHPJES-YGRLFVJLSA-N 442.566 4.798 50 10 IJGE Clc1ccc(CN2C[C@@H](Br)CC3(CC3)C2)c(I)c1 2318540341 PPPXXSSAXXLRSB-NSHDSACASA-N 440.550 4.694 50 10 IJGE COC[C@@H]1C[C@H](Br)[C@H](Cc2cc(I)ccc2Cl)C1 2327404990 AAXUFZHFKDVLRG-KWBADKCTSA-N 443.550 4.923 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@H]([C@H]3CCCN3C(=O)OC(C)(C)C)C2)C1 2345009655 GEHYMNCPDVBZIJ-DLBZAZTESA-N 429.443 4.909 50 10 IJGE CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cc1 27520209 SWCOVFIQJOLZJO-WPWMEQJKSA-N 432.499 4.688 50 10 IJGE CCCn1c(-c2ccc(C(=O)NNC(=O)c3ccccc3Cl)s2)nc2ccccc21 35554239 JPEXKVJEJCIFPV-UHFFFAOYSA-N 438.940 4.903 50 10 IJGE Cc1cc(C)cc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)c1 38652936 BAPGGXOLBVVOSF-RUZDIDTESA-N 444.462 4.645 50 10 IJGE ClCc1nc2cc(Br)cnc2n1-c1ccccc1I 98039899 MBELATMVALZVHG-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE COc1ccc(OC)c([C@H](Br)c2ccccc2I)c1 109842773 RVKLVBVBLXNJHR-OAHLLOKOSA-N 433.083 4.793 50 10 IJGE O=C(NC1CCC(Br)CC1)c1cc(C(F)(F)F)ccc1Br 139714744 NDEJYUYRHGNXHW-UHFFFAOYSA-N 429.074 4.904 50 10 IJGE COc1cc(C=NNC(=O)COc2ccc3ccccc3c2)ccc1OCc1ccccc1 254614470 IADMWLGKOFLOCV-UHFFFAOYSA-N 440.499 4.957 50 10 IJGE ClCCc1nc2cccc(Br)c2n1C1[C@H]2CN(Cc3ccccc3)C[C@H]12 700134850 DSYPTXQRCHJRTE-HOTGVXAUSA-N 430.777 4.883 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2CC[C@@H](c3cccc(F)c3)C2)c(-c2ccccc2)n1 729444729 BDVKSNBVSFCWGU-XOWGOQOESA-N 439.494 4.526 50 10 IJGE COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NNc2cccc(F)c2F)cc1 743720693 KZKBRZFITZPJNH-UHFFFAOYSA-N 434.446 4.642 50 10 IJGE Cc1cc2ccc(Cl)cc2nc1NNC(=O)CCc1nc(O)c2c(C)c(C)sc2n1 779042038 CGLVQQZNVDXQIR-UHFFFAOYSA-N 441.944 4.600 50 10 IJGE N#C/C(=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)NCc1ccc([N+](=O)[O-])cc1 787149659 UAVRDNFZJAJDOC-ACAGNQJTSA-N 443.303 4.856 50 10 IJGE C#CCOc1c(Cl)cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)cc1Br 1084160214 BFYANAFLKMJGJW-OQLLNIDSSA-N 429.701 4.969 50 10 IJGE N#C/C(=C\c1ccc(OCc2ccc(Br)cc2)cc1)C(=O)NC1CCCC1 1084268937 YUMJZXSZYWEFLI-QGOAFFKASA-N 425.326 4.994 50 10 IJGE Cc1cc(-c2nc(C)c(C(=O)NNc3nc(-c4ccccn4)nc(C)c3C)s2)ccc1F 1558934730 KNRFREYYAKOAIS-UHFFFAOYSA-N 448.527 4.792 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1cc(C)ccc1O)C(C#N)=C(N)O2 1865686887 DKZHWWSUNLYKGE-HXUWFJFHSA-N 438.890 4.519 50 10 IJGE CCCc1nn(Cc2ccc(F)cc2)c2c1[C@@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689836 XKZLLKQSEKAGKB-FQEVSTJZSA-N 438.890 4.600 50 10 IJGE CCCc1nn(-c2ccccc2Cl)c2c1[C@@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865712764 HIAYZDVXWPGOPE-IBGZPJMESA-N 435.871 4.605 50 10 IJGE CCCc1nc(Nc2ccc(SC#N)cc2)cc(N2CCC(c3nc(C)n(C)n3)CC2)n1 1868389578 YAJWFNLHZGHRMZ-UHFFFAOYSA-N 448.600 4.567 50 10 IJGE C=C[C@@H](Br)CCc1ccc(I)c(Br)c1 1893241255 GWWDIRSAAUTTME-SECBINFHSA-N 429.921 4.936 50 10 IJGE CC(C)[C@@H](c1nc(CCl)cs1)n1ccnc1CCCN1C(=O)c2ccccc2C1=O 1912990900 INRDKXFSLJVMCB-IBGZPJMESA-N 442.972 4.553 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1Cc1cccc(Br)c1Br 1943881057 NEJLYMLDUOIXGY-MWLCHTKSSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)N(CC(F)F)[C@@H]1CCCN(C[C@H](CBr)C2CCC2)C1 1966430716 PHXYRYRIJCZVOE-JKSUJKDBSA-N 439.385 4.764 50 10 IJGE Cc1ccc(Br)c(CC(CBr)(CBr)C2CC2)n1 2003268293 UENOVGHJXFSEGB-UHFFFAOYSA-N 425.990 4.881 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1Cc1c(Br)cccc1Br 2018117033 JXWPCVHTGKYFDE-RNCFNFMXSA-N 425.990 4.959 50 10 IJGE O=C(NC[C@H](Cl)CC(F)(F)F)c1scc(Br)c1Br 2055500324 XDWWXZOJSYCNGI-SCSAIBSYSA-N 429.483 4.563 50 10 IJGE O=[N+]([O-])c1c(CBr)nn(-c2cc(C(F)(F)F)ccc2F)c1C(F)(F)F 2079144962 HBUIHXRKPRLHCT-UHFFFAOYSA-N 436.081 4.852 50 10 IJGE Fc1ccc(CBr)c(N2CCN(Cc3ccccc3)CC(F)(F)C2)c1F 2093154708 FVWQKICRKBVPOR-UHFFFAOYSA-N 431.271 4.817 50 10 IJGE CC(C)N(C[C@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2110714123 ANVSGBFTPKKSBO-SJORKVTESA-N 431.415 4.577 50 10 IJGE C[C@@H](NC(=O)c1ccc(CBr)cc1)c1csc(NC(=O)OC(C)(C)C)n1 2114351391 LZOBBXSYCWKIBS-LLVKDONJSA-N 440.363 4.876 50 10 IJGE C[C@@]12CC[C@@](CCl)(C1)N(C(=O)c1cc(Br)sc1Br)C2 2134798318 RDKRJFITYXAKOT-OLZOCXBDSA-N 427.589 4.897 50 10 IJGE O=S1(=O)CCC[C@@H]([C@H](Br)c2csc3c(Br)cccc23)C1 2146094563 HVBPVBAJIHMVSY-RNCFNFMXSA-N 438.206 4.925 50 10 IJGE O=C(NC[C@]1(C2CC2)CCN(CC2(CBr)CCCCCC2)C1)C(F)(F)F 2163064591 VDPNSDJKRSWQHG-GOSISDBHSA-N 439.360 4.503 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C(=O)[C@H](Br)C2CCCC2)c2ccccc2C1 2167032572 JYKVNLJHHVKDJQ-GOSISDBHSA-N 437.378 4.724 50 10 IJGE O=C([C@@H](Br)C1CCCC1)N1CCCCN(Cc2ccccc2)CC(F)(F)C1 2167034140 VMXKFIJWXNCKPI-IBGZPJMESA-N 443.376 4.700 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)CC[C@@H](CCNC(=O)OC(C)(C)C)C(C)(C)C 2196914476 NPPJXHUIIGBMFZ-YESZJQIVSA-N 447.458 4.976 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1C[C@]1(Br)CC1(F)F 2202501902 AWFAGTAJKBGKLC-UPONEAKYSA-N 429.490 4.666 50 10 IJGE COc1cc(F)c(Cl)cc1[C@@H](Br)c1c(Br)c(C)nn1C 2207377551 IZOLOQWWWWHJGE-GFCCVEGCSA-N 426.511 4.776 50 10 IJGE COCc1cc(Br)c([C@H](Br)c2c(Cl)c(C)nn2C)s1 2232171105 ZIMHGVQRDZXHQL-SECBINFHSA-N 428.577 4.837 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CC[C@H]3C[C@H]2CO3)cc1I 2269556044 LAECCBRCWYEDSK-ASHKBJFXSA-N 437.115 4.551 50 10 IJGE O=C1NCCc2ccc([C@@H](Br)c3scc(Br)c3Cl)cc21 2279286849 GMHOQNHKJLVGGS-LLVKDONJSA-N 435.568 4.934 50 10 IJGE COc1ccc([C@@H](Br)Cc2ccccc2I)c(OC)c1 2287081979 IEBRTYZQZNJFOS-AWEZNQCLSA-N 447.110 4.987 50 10 IJGE C[C@@H]1C[C@H](CCl)CN1Cc1ccc(I)c(Br)c1 2306227289 MHQAIGJWKLZEKC-MWLCHTKSSA-N 428.539 4.503 50 10 IJGE CC1=C(C#N)C(=O)N(CC(C)C)C(=O)C1=Cc1cn(-c2ccccc2)nc1-c1ccccc1 2314611593 XTJOASDYFKEYHC-UHFFFAOYSA-N 436.515 4.788 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)CC23CC3)c(I)c1 2318524783 RXLIXXIBERNVKZ-NSHDSACASA-N 440.550 4.837 50 10 IJGE O=C(Cc1cccc(Cl)c1F)N[C@H](CCBr)COCc1ccccc1 2320358437 NXJUHTLLXGCPRW-MRXNPFEDSA-N 428.729 4.508 50 10 IJGE CC(C)(C)OC(=O)NCCN(C[C@]1(CBr)CC1(F)F)C1CCCCC1 2326918840 FRSDPVYHRFDKFX-QGZVFWFLSA-N 425.358 4.566 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Br)c1ccc2c(c1)CCC2 2338722920 RPVNPBBJBUKNLX-LLVKDONJSA-N 448.984 4.918 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Cl)[C@H]1CCCS(=O)(=O)C1 2365226431 UTFWCBFFXUTRRX-UFBFGSQYSA-N 448.579 4.764 50 10 IJGE C[C@H]1CN(C(=O)c2ccc(Cl)cc2I)CC[C@H]1CCCl 2365582994 XUPKLPHLAGLYFG-WDEREUQCSA-N 426.125 4.672 50 10 IJGE BrCC1(Cc2ncc(I)cn2)CC2(CC3(CCC3)C2)C1 2381619337 KOYLEIMZMDJUJO-UHFFFAOYSA-N 447.158 4.749 50 10 IJGE Cc1ccc(-n2c(SCC(=O)N/N=C/C=C\c3ccco3)nnc2-c2ccccc2)cc1 19826155 SRUPAXPXBQFDKB-MPVXGRFSSA-N 443.532 4.743 50 10 IJGE Cc1ccc(Oc2nc3ccccn3c(=O)c2/C=C(/C#N)c2nc3ccccc3n2C)cc1 35549685 WCUIHHJDPUWSEM-SDXDJHTJSA-N 433.471 4.746 50 10 IJGE N#C/C(=C/c1cn(-c2ccccc2)nc1-c1ccc2c(c1)OCO2)C(=O)NC1CCCCC1 210034128 DITDNXYFCYRIDT-UYRXBGFRSA-N 440.503 4.624 50 10 IJGE COc1ccc(C(C)=NNC(=O)CSc2nc3ccccc3n2Cc2ccccc2)cc1 254488064 OKIBWIIEOGKIRG-UHFFFAOYSA-N 444.560 4.726 50 10 IJGE C[C@H]1C[C@H](Br)CCN1C(=O)c1cc(Br)ccc1Br 705613039 SQWQMVJELUZQJN-WCBMZHEXSA-N 439.973 4.600 50 10 IJGE C[C@@H](NC(=O)NNc1cccc(F)c1F)c1cccc(NC(=O)Cc2ccccc2F)c1 745503371 HRTWVLIBQKBMKP-CQSZACIVSA-N 442.441 4.672 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCCCCC[C@H]1C(=O)NNc1nc2ccccc2[nH]c1=S 1148222609 FBFLHXISDJXOJX-HUUCEWRRSA-N 445.589 4.599 50 10 IJGE Cc1cc(-c2nc(C)c(C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)s2)ccc1F 1306606592 GUMSJAJNGMZLKP-UHFFFAOYSA-N 448.527 4.792 50 10 IJGE C=CC[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc3ccccc23)c1C)C(=O)OCC 1632655800 DNWZYZJEGVBWKG-FOOJEKODSA-N 441.531 4.778 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H](c1ccccc1)[C@H](CBr)NC(=O)OC(C)(C)C 1883674849 IJMBJRKFNPVOHZ-HOTGVXAUSA-N 443.382 4.583 50 10 IJGE Brc1cnccc1C[C@@H](Br)c1sncc1Br 1924010782 BVQDAUIPODUSCU-SSDOTTSWSA-N 426.959 4.742 50 10 IJGE CCC[C@@](C)(CBr)NC(=O)c1cc(Br)c(Br)s1 1942785537 NMPKYSPQFKDEME-NSHDSACASA-N 448.018 4.957 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]3(CC[C@@](C)(CI)O3)C[C@@H]21 2001952405 RDNNIRCHJFVSKB-PDWMJMLSSA-N 449.373 4.929 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1C(=O)c1cc(Br)sc1Br 2018122707 ADOIUOIDROCOHE-SVRRBLITSA-N 446.002 4.661 50 10 IJGE COc1cc(Br)c(OC[C@H]2C[C@H](Br)C2)cc1Br 2020236290 URXOFMADIUBAQM-ZKCHVHJHSA-N 428.946 4.773 50 10 IJGE CCC(CC)(CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2066603908 YIOMCELWPZIAOM-CYBMUJFWSA-N 431.337 4.671 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCCN(c2ncc(CCl)cc2Br)C1 2096468086 RBBAPBGWFQYARU-UHFFFAOYSA-N 444.751 4.931 50 10 IJGE CC(C)[C@H](Br)C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C2(CCCCC2)C1 2106203418 HLYXNYPMODREHZ-CVEARBPZSA-N 431.415 4.625 50 10 IJGE Cc1cc(C(=O)N(C)C2(CBr)CCSCC2)c(Br)s1 2114721493 UNUYZMNREBYROW-UHFFFAOYSA-N 427.227 4.552 50 10 IJGE CC(C)(C)OC(=O)N1CCC([S@](C)(=O)=NCc2ccc(CBr)cc2)CC1 2126471436 KTKZKXUQTLYLAR-SANMLTNESA-N 445.423 4.579 50 10 IJGE Cc1cc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)ncc1CBr 2130159997 QISHBHOHIFTTIO-KRWDZBQOSA-N 428.296 4.538 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Br)c1c(Cl)cnn1C 2138248057 XPMGEQSDWKOANB-JTQLQIEISA-N 428.939 4.982 50 10 IJGE Cc1cc(S(=O)(=O)N(C)[C@H]2CCCCC[C@@H]2Br)sc1Br 2172543414 KPQBFXAIXBBNNG-QWRGUYRKSA-N 445.242 4.536 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H](C(=O)O)N(CCCCCCCCCBr)C1 2188789623 YBMCFNJALMOGBS-IRXDYDNUSA-N 449.430 4.554 50 10 IJGE CCN(CCCCCI)C1CCC(NC(=O)OC(C)(C)C)CC1 2211186319 OVMPNUQHMSVLBK-UHFFFAOYSA-N 438.394 4.750 50 10 IJGE N#CC(=Cc1cn(CC(=O)N2CCOCC2)c2ccccc12)c1cccc(C(F)(F)F)c1 2297552140 LJHOXFXESOTIKZ-UHFFFAOYSA-N 439.437 4.583 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1Cc1ccc(Cl)cc1I 2302326282 NZARHRSWXFQQMW-RNCFNFMXSA-N 428.539 4.692 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)[C@H]2C[C@@H]3C[C@@H]3CO2)c1 2313495502 HPPYRCWSNICRBG-GZZJDILISA-N 438.985 4.943 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)COc2ccccc2C(C)C)c(OCC)c1 2314736136 WUCHUYCAZVFCIU-UHFFFAOYSA-N 437.492 4.663 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccccc2Cl)cc(Br)c1OCC 2323078695 QYQARGRGPXJAMI-UHFFFAOYSA-N 425.710 4.664 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C[C@@]2(CBr)CC2(F)F)C2(CCCCC2)C1 2351884994 COGFIJNJCURWRC-PBHICJAKSA-N 437.369 4.709 50 10 IJGE ClCc1c(Cl)ncnc1OCc1cc(I)ccc1Cl 2352250607 XOCYOUFPOIORTM-UHFFFAOYSA-N 429.472 4.706 50 10 IJGE CC(C)[C@H](Cl)C(C)(C)CNC(=O)c1ccc(Cl)c(I)c1 2366004648 FKQDEXUUGLPKPB-ZDUSSCGKSA-N 428.141 4.964 50 10 IJGE COc1ccc(Cl)cc1C(=O)NN=C(C)c1cccc(NC(=O)c2ccc(F)cc2)c1 676331 CQUHTDDXNNBALN-UHFFFAOYSA-N 439.874 4.894 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](CC)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C)c(C)c1 10153697 RRKFUUNEEZNTSM-DKZVUGQWSA-N 426.557 4.589 50 10 IJGE CCCCOc1cccc(C(=O)NNC(=O)c2ccc(NC(=O)c3cccc(C)c3)cc2)c1 14041637 LHQHZCWGDVKHPB-UHFFFAOYSA-N 445.519 4.501 50 10 IJGE CCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(F)cc1 38653169 QLCGZPKRRDDOCH-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE CCCc1cc(C(=O)OC)c(NC(=O)/C(C#N)=C\c2ccc(Cl)c([N+](=O)[O-])c2)s1 98063414 PBOXTJIZQGCPBT-GHXNOFRVSA-N 433.873 4.594 50 10 IJGE CCCCOc1ccc(/C=C2\C(=O)N(CCc3ccccc3)C(=O)C(C#N)=C2C)cc1OC 214349938 ODORMOWMDGLRTB-JWGURIENSA-N 444.531 4.709 50 10 IJGE Cc1ccc(C=NNC(=O)CSc2nnc(-c3ccc(C)cc3)n2-c2ccccc2)cc1 254522774 NWSVKHZDIODEDM-UHFFFAOYSA-N 441.560 4.794 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OCCOC2CCCCCC2)c(-c2ccccc2)n1 740944485 FESTYUIGYWUVTJ-HEHNFIMWSA-N 432.524 4.653 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2c(-c3cccc(Cl)c3)noc2C)c1C 795113916 WVBJXTYQVQMYCO-UHFFFAOYSA-N 434.887 4.529 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2cc(N3CCCC3=O)ccc2Cl)c(C(F)(F)F)c1 799383948 FCIYLVHMWUITCJ-UHFFFAOYSA-N 437.809 4.506 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)c1ccc(Br)cc1Cl)c1ccccc1 1224522576 NOXZHRQVULTMFS-KRWDZBQOSA-N 436.737 4.754 50 10 IJGE CCOc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)Nc3cccc4nc(O)oc34)c2C)cc1 1298881209 TZJKYZBADBNLML-QGOAFFKASA-N 442.475 4.885 50 10 IJGE CCC(CC)(C(=O)NNc1nc2ccccc2[nH]c1=S)c1ccc(OC)c(OC)c1 1301148554 RQRAIYSEFDQJGG-UHFFFAOYSA-N 426.542 4.511 50 10 IJGE C#CC[C@]1(C(=O)NNc2ccccc2Oc2ccccc2)CCCN1C(=O)OC(C)(C)C 1628599118 VGBIRDLKBYFTIS-RUZDIDTESA-N 435.524 4.715 50 10 IJGE C=CCOc1ccc(CC(=O)NNC(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1 1633826471 PUCXSTFGXYLOBA-UHFFFAOYSA-N 428.703 4.607 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2ccc(OCCCC)c(OCCCC)c2)c1 1644012026 UMQAHEYUSRGSFP-UHFFFAOYSA-N 439.581 4.657 50 10 IJGE C=CCCC[C@H](NC(=O)NNC(=O)Nc1cc(Cl)c(OC)cc1OC)c1ccccc1 1684894163 NHBDFRSJTSKUGK-KRWDZBQOSA-N 446.935 4.791 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccc(Cl)cc2)[C@H]1c1ccncc1 1865700410 SIWFRGXRWZJHFX-NRFANRHFSA-N 439.906 4.865 50 10 IJGE N#C/C(=C(/O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1nc(-c2ccccc2)cs1 1872747578 JTANQTSNPCELNR-FXBPSFAMSA-N 434.477 4.505 50 10 IJGE C[C@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(Br)c1 1914350042 FRYHPKPPUJZDHH-GFCCVEGCSA-N 437.186 4.921 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1ccccc1C(F)(F)F 1914640098 WFPUVYCBJZTYQW-CYBMUJFWSA-N 436.293 4.680 50 10 IJGE IC[C@@H]1CC[C@@]2(CN(Cc3ccccc3)C3(CCCCC3)C2)O1 1939537575 SXYNHPANIMVVSI-AZUAARDMSA-N 425.354 4.948 50 10 IJGE CSCC[C@H](Cl)CCNC(=O)c1cc(Br)c(Br)s1 2029921790 IKOZJBDWBQMRNJ-SSDOTTSWSA-N 435.634 4.754 50 10 IJGE CN(CCN(CC(F)(F)F)CC1(CBr)CCCC1)C(=O)OC(C)(C)C 2044698496 CCIMCIKESBZSQU-UHFFFAOYSA-N 431.337 4.673 50 10 IJGE CC(C)[C@H](CBr)CN1CCC[C@@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2044704200 AQYWVTYSCXMNNG-CZUORRHYSA-N 431.337 4.575 50 10 IJGE CC1(C)C[C@@H](O[C@H](CI)c2ccccc2Br)CO1 2052239229 FMGDJCILVOVKEZ-ZWNOBZJWSA-N 425.104 4.509 50 10 IJGE O=S(=O)(c1ccc(CBr)cc1F)N(Cc1ccccc1)C1CCCC1 2059265633 YKRRUMLYIARALM-UHFFFAOYSA-N 426.351 4.854 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Cl)c2)CC[C@H]1CBr 2086661468 MRAFYMYFESKFHE-JQWIXIFHSA-N 442.566 4.798 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC2(CCC2)C[C@@H]1CCl 2095169250 WZJLVQFNZKDQDR-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](C(F)(F)F)CCN1CC1(CBr)CCC1 2107584181 MQPOQPMSTKBFCT-KGLIPLIRSA-N 443.348 4.719 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@@H]1CCCCN1C(=O)[C@H](Br)C1CCCC1 2143047240 JGJOSLOOHKRNMK-JKSUJKDBSA-N 431.415 4.625 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1CCCl)c1ccc(I)c(Cl)c1 2146741768 ZGTOTBDCYAJNTD-QMTHXVAHSA-N 426.125 4.862 50 10 IJGE ClC[C@H](CC1CCOCC1)NCc1ccc(Br)cc1Br 2195480023 VGLHSOVDMNQILF-AWEZNQCLSA-N 425.592 4.725 50 10 IJGE COC[C@](C)(CC(CBr)(CBr)c1ccccc1Cl)OC 2198253310 PSRJOEQELCYGTJ-AWEZNQCLSA-N 428.592 4.809 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)C(=O)Cc1ccc(Br)cc1Cl 2221699503 IWPWJNOWNGMHIY-KRWDZBQOSA-N 445.184 4.928 50 10 IJGE CC1(C)CCN(Cc2ccccc2)CCN1c1nc2sccn2c1CBr 2231338962 RGXDRPNOYBDTIG-UHFFFAOYSA-N 433.419 4.782 50 10 IJGE CCN(CCCCI)[C@@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2243591494 VCKSCCAJKSIXFQ-JKSUJKDBSA-N 438.394 4.607 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H]2CC[C@H]1[C@@H](CBr)C2 2285847171 XHTZBSHMCJZART-UJVNDKKSSA-N 425.523 4.630 50 10 IJGE COc1cc(Br)c(C=C(C#N)C(=O)Nc2cc(Cl)ccc2C)cc1OC 2313738403 AOQJJCOCWUOOOJ-UHFFFAOYSA-N 435.705 4.974 50 10 IJGE COc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)C=Cc4ccc(C)cc4)ccc32)c1 2314634248 NERVJLNDTKMNAS-AREMUKBSSA-N 438.483 4.841 50 10 IJGE N#CC(C(=O)Cn1cnc2scc(-c3ccccc3)c2c1=O)=C1Nc2ccccc2S1 2320729526 BJENRNHTGZQZSA-UHFFFAOYSA-N 442.525 4.647 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2328527844 MLRAEQSTVMHVHY-UONOGXRCSA-N 431.337 4.527 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Br)c2n1[C@]12C[C@H]1CN(Cc1ccccc1)C2 2329012163 KZRSSKLEQKXOPV-AFBRZQFHSA-N 431.765 4.725 50 10 IJGE Cc1ccc(C)c(-c2csc(C(C#N)=C(O)[C@@H](C)N3C(=O)c4ccccc4C3=O)n2)c1 2331319349 JZEDQAPRYZJTIF-OAHLLOKOSA-N 429.501 4.904 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H](NC(=O)OC(C)(C)C)[C@H](C(F)(F)F)C2)C1 2345005431 YJTQBFBHYZKAST-CHWSQXEVSA-N 443.348 4.575 50 10 IJGE CC(C)(C)[C@](C)(CBr)CN1CCCN(Cc2ccccc2)CCOCC1 2352089290 QPHUHXTWZWZGDR-JOCHJYFZSA-N 425.455 4.658 50 10 IJGE Cc1sc(Br)cc1C(=O)N1CC[C@H](Br)C[C@H]1C(F)(F)F 2361459038 QEVPMJPTPYATMC-CBAPKCEASA-N 435.103 4.749 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccc(Cl)cc2I)C[C@H]1CCl 2366680341 QSAWGPNYUATGKF-MWLCHTKSSA-N 438.058 4.794 50 10 IJGE Cc1sc(Br)cc1C(=O)N1CCC[C@@H](Br)[C@H]1C(F)(F)F 2370247772 ODXXWHKXJVPORJ-SCZZXKLOSA-N 435.103 4.749 50 10 IJGE CCOc1c(Br)cc2ccccc2c1/C=N/NC(=O)CNc1cccc(C)c1 3193605 OLCUOIOWKVBYPM-DHRITJCHSA-N 440.341 4.872 50 10 IJGE Cc1cc(Br)cc(C)c1NS(=O)(=O)c1ccc(CBr)cc1 115917275 FJRWXLKWZDYMFP-UHFFFAOYSA-N 433.165 4.762 50 10 IJGE ClC[C@@H](I)[C@H](CCl)OCc1cccc(Br)c1 158544201 BMTYQFZDSKDABT-MNOVXSKESA-N 437.930 4.616 50 10 IJGE CC(C)(C)OC(=O)NCCN1CCNC[C@@H]1c1cccc(CO[Si](C)(C)C(C)(C)C)c1 616636006 ILPJKVTZZADHJZ-OAQYLSRUSA-N 449.712 4.679 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NC(=O)c1cc(Br)c(Br)s1 716854515 ILNDOUWHAJGNQJ-RQJHMYQMSA-N 448.018 4.955 50 10 IJGE COc1ccc(C(C)=NNC(=O)CSCc2cccc(Cl)c2)cc1Br 725392076 SHUCOPQSLXFNJJ-UHFFFAOYSA-N 441.778 4.885 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2CCC(c3ccccc3)CC2)c(-c2ccccc2)n1 914467609 CJORWDLKXXAICW-HKOYGPOVSA-N 435.531 4.777 50 10 IJGE CCc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699636 YVLQNVSWRSVFQB-JOCHJYFZSA-N 443.938 4.857 50 10 IJGE COc1ccccc1C1(CNC(=O)/C(C#N)=C/c2ccc(Br)cc2)CCCC1 1866129040 ZJEVQJKMROAXTB-NBVRZTHBSA-N 439.353 4.993 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OCC[C@H]1CC[C@H]1C1CC1 1902509137 RCBJNEOWWNZXMI-VKJFTORMSA-N 437.362 4.548 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)C(=O)c1cccc(I)c1 1915090284 JMEBLCGFCQWSRU-MRXNPFEDSA-N 427.713 4.951 50 10 IJGE Cc1nn(C)c(CN(Cc2ccccc2)[C@@H](CBr)C2CC2)c1Br 1915212862 YYXYBYXDGJSALT-INIZCTEOSA-N 441.211 4.667 50 10 IJGE C[C@](CBr)(NC(=O)c1scc(Br)c1Br)C1CC1 1942785746 PVLYXEDXLDKWRF-LLVKDONJSA-N 446.002 4.567 50 10 IJGE O=C(NC[C@H]1CC[C@H](Br)C1)c1csc(Br)c1Br 1945188808 BRROOXSULZYQFH-BQBZGAKWSA-N 446.002 4.567 50 10 IJGE C[C@@H](C[C@@H](C)Br)NC(=O)c1c(Br)cccc1Br 1945333868 WBMSZFDCBKGTOV-SFYZADRCSA-N 427.962 4.503 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Cl)c2)CC[C@H]1Br 2026560696 MCIZPPMRURVCIH-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE FC1CC(C[C@H](Br)c2cc(I)cc3c2OCC3)C1 2033346751 QIISBMOFAMIVJG-RHYVWVDMSA-N 425.079 4.800 50 10 IJGE Clc1ccc(I)c(CN2CC[C@H](Br)[C@H]3CC[C@H]32)c1 2069997356 SUBUTDZJHCNAMM-MBNYWOFBSA-N 440.550 4.692 50 10 IJGE CCN(CCCCCl)C(=O)c1ccc(Br)cc1I 2086148698 FFAKHVRTTUYFSF-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1N(C)C[C@H](CBr)c1ccccc1 2106780611 AHWUYWIMJAOCIK-NZSAHSFTSA-N 425.411 4.742 50 10 IJGE Fc1c(CN2CC[C@H](OCCCBr)C2)ccc(Cl)c1Br 2207038447 NMHWSBBQFCVOSJ-NSHDSACASA-N 429.555 4.618 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CCCCCCCBr)C[C@H]1C(F)(F)F 2277448911 NJWUKGDKVQTNLB-HUUCEWRRSA-N 445.364 4.967 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N(C[C@@H](C)Br)C(C)(C)C)c1Br 2288078567 MYNRRLJPWPANKY-MRVPVSSYSA-N 447.258 4.700 50 10 IJGE CCCOc1c(Br)cc(C=C(C#N)C(=O)NCc2ccccc2)cc1OCC 2313518851 WRTHLTRYMXUIIQ-UHFFFAOYSA-N 443.341 4.860 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)C[C@H]1CCC[C@H]1Br 2315551294 PDAWWMSQVKAPDG-VXGBXAGGSA-N 442.566 4.940 50 10 IJGE CCOc1cc(C=NNC(=O)Cc2ccc(Cl)cc2)cc(Br)c1OCC 2323347709 FCRUAPUINDOMPJ-UHFFFAOYSA-N 439.737 4.593 50 10 IJGE ClC[C@@H]1CCC[C@H]1CNCc1ccc(I)c(Br)c1 2325211809 LWDDGTDZDGXXTE-RYUDHWBXSA-N 442.566 4.798 50 10 IJGE C[C@@H]1C[C@H](CBr)CN(Cc2cc(I)ccc2Cl)C1 2327397885 WTYYDNAJIVPWGR-GHMZBOCLSA-N 442.566 4.798 50 10 IJGE Fc1cc(Cl)c(Br)c(Cl)c1[C@H](Br)[C@@H]1CO[C@@H]2COC[C@H]21 2360416738 BKIQVVPAIGSDQH-WQRVWIMNSA-N 448.941 4.992 50 10 IJGE O=C(NC[C@@H]1CCCC[C@@H]1CCl)c1ccc(Cl)cc1I 2365588571 LDNZQPLLUYVGRD-MNOVXSKESA-N 426.125 4.720 50 10 IJGE O=C(COc1ccc(OCc2ccccc2)cc1)N/N=C/c1ccccc1Br 20522814 BQXOWEDNKBDHFH-ZVHZXABRSA-N 439.309 4.557 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1NC(=O)/C(C#N)=C\c1ccc(OC(=O)c2ccccc2)cc1 33930022 IWWUVWGDSRKPQO-RGEXLXHISA-N 427.416 4.668 50 10 IJGE COc1ccc(Br)cc1/C=C(/C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 33930073 FIOWNLRERYZHHL-WDZFZDKYSA-N 436.649 4.565 50 10 IJGE CCCOc1cccc(/C=N\NC(=O)c2cccn(Cc3ccc(C(C)(C)C)cc3)c2=O)c1 169921135 CQNIJSWVGUQCMG-VEILYXNESA-N 445.563 4.747 50 10 IJGE CCOc1ccc(/C=C\C(=O)Oc2ccc(/C=C(\C#N)C(=O)NCc3ccco3)cc2)cc1 206687522 PCPCVOXRJADKQN-FNEDYENRSA-N 442.471 4.520 50 10 IJGE Cc1ccccc1OCCCC(=O)Oc1ccc(/C=C(/C#N)C(=O)NCc2ccco2)cc1 206739594 XSYMDSWMCDUVQQ-PGMHBOJBSA-N 444.487 4.576 50 10 IJGE Cc1ccccc1C(=O)Oc1ccc(C=NNC(=O)COc2cccc3ccccc23)cc1 254304635 XQQQWPHJNNFBRI-UHFFFAOYSA-N 438.483 4.897 50 10 IJGE O=C(NCCC1(CBr)CC1)c1cc(Br)cc(Br)c1 395939536 JBQOKICWLSGPCG-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccc([C@@H]2COCCN2S(=O)(=O)c2ccccc2)cc1 616642037 CCDPYALMJIQDNB-QFIPXVFZSA-N 447.673 4.971 50 10 IJGE CC(=O)[C@@H](C)CCCCC(=O)NS(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1 783123944 KXJZEGLQJWTXAP-NSHDSACASA-N 437.452 4.934 50 10 IJGE Cc1ccc(C(=O)Nc2ccc(C(=O)NN=Cc3cccc(Br)c3)cc2)cc1 1084055688 QMNDUVOYVQSELB-UHFFFAOYSA-N 436.309 4.774 50 10 IJGE O=C(CC[C@@H](O)c1ccccc1)NN=Cc1ccc(-c2cccc(Br)c2)o1 1084216047 UVCHVUGFLVLCOL-LJQANCHMSA-N 427.298 4.673 50 10 IJGE Cc1nn(-c2ccccc2)c(Cl)c1C=NNC(=O)CCCNc1ccc(Cl)cc1 1084280086 NOOLQERSCUAPLE-UHFFFAOYSA-N 430.339 4.830 50 10 IJGE O=C(CSc1cccc(Cl)c1Cl)NNC(=O)Nc1cccc(C(F)(F)F)c1 1088720793 FTTJZCVGGDNTDL-UHFFFAOYSA-N 438.258 4.957 50 10 IJGE CC(=O)c1cccc(OCc2cc(C(=O)NN(c3ccccc3)c3ccccc3)no2)c1 1124816721 MGZDLDJRKIRBQE-UHFFFAOYSA-N 427.460 4.939 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)cc2)cc1 1463643077 PFVBLYZYBWPCCD-OAHLLOKOSA-N 448.544 4.943 50 10 IJGE BrC[C@H](CN1CCC(OCc2ccc(Br)cc2)CC1)C1CC1 1772509600 AZZUJJDDHVAQLY-MRXNPFEDSA-N 431.212 4.851 50 10 IJGE CCCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccncc1)C(C#N)=C(N)O2 1865700259 OAKWJHUVAZFCSC-LJQANCHMSA-N 440.334 4.804 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C/c3cc4c(cc3[N+](=O)[O-])OCCO4)n2)cc1F 1872792422 YENBPRPKUFXCPF-MKMNVTDBSA-N 439.424 4.701 50 10 IJGE Fc1cc(Br)c2nc(CCl)n(Cc3ccn(Cc4ccccc4)n3)c2c1 1912673844 GIYMBSCRAYAERV-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE CN(C(=O)c1ccc(Br)cc1Br)C1(CBr)CCC1 1915002844 LZMUZXQBQYHQPC-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE COc1c(C(=O)N(Cc2ccccc2)[C@H](CBr)C(C)C)cccc1[N+](=O)[O-] 1915275100 YFJTXVWFSCFLEQ-GOSISDBHSA-N 435.318 4.665 50 10 IJGE O=C(c1ncccc1Br)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915311146 DTUTUDVDCLGVPQ-INIZCTEOSA-N 438.163 4.660 50 10 IJGE Brc1ccccc1[C@H](CI)O[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12 1917452887 ILZHNYBOVDSZAP-QJCXCHQMSA-N 433.127 4.986 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@@]2(CCC[C@H]2Cl)C1 1918918065 XCZAYEXQMLASNA-RNCFNFMXSA-N 427.589 4.897 50 10 IJGE CC[C@@H](C)N(CCBr)C(=O)c1csc(Br)c1Br 1945189303 NMBXBAIDEFUGML-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@]23CCC[C@@H](CI)O3)C1 1950281062 NNSWIOITOQUADZ-IPELMVKDSA-N 449.373 4.931 50 10 IJGE Fc1ccc([C@@H](CI)OCCOCCOCc2ccccc2)cc1 2007813839 CTWDRMHBRXMDOY-LJQANCHMSA-N 444.284 4.552 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)c1cc(Br)ccc1CBr 2020225223 PGQSDRJMIYQWIM-WVSHTKLVSA-N 425.990 4.954 50 10 IJGE CCN(C[C@@](C)(CI)OCc1ccc(C)cc1)C(=O)OC(C)(C)C 2024642383 PTNUBUGYWHRYOR-LJQANCHMSA-N 447.357 4.962 50 10 IJGE C[C@H](CCBr)CCNCc1ccc(I)c(Cl)c1 2026562483 BGRSUCRBYVZVGX-SNVBAGLBSA-N 430.555 4.845 50 10 IJGE BrC[C@@H]1[C@H]2CCN(Cc3cccc(Br)c3Br)C[C@H]21 2032219306 HRFXNGCYKFOUCA-IJLUTSLNSA-N 438.001 4.674 50 10 IJGE CCCOCCCO[C@](C)(CI)c1ccccc1Br 2092639473 VGTJHTNKORYFPZ-OAHLLOKOSA-N 441.147 4.933 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2[C@H]3CC[C@@H]([C@H]2C1)N(CC1(CBr)CCCC1)C3 2106786384 FFPIZLKUICXEFC-XSLAGTTESA-N 427.427 4.519 50 10 IJGE O=C(c1csc(Br)c1Br)N1[C@H](CCl)C[C@H]2CCC[C@@H]21 2108399813 QYQGDXYXVCNLTI-WEDXCCLWSA-N 427.589 4.895 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](CN(C[C@H](CBr)CC2CC2)C2CC2)C1 2112869922 XZADFSMDOJGTTK-ROUUACIJSA-N 429.443 4.909 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2N1C(=O)OC(C)(C)C 2196913230 CNCQUVONXAFDIT-AVEIZBFRSA-N 443.426 4.577 50 10 IJGE C[C@@H]1CCC[C@]12[C@H](Br)C[C@H]2OCCOCCOCCOCc1ccccc1 2236089243 PXBKKPHQDABBLJ-ZHHKINOHSA-N 441.406 4.595 50 10 IJGE Fc1ccccc1[C@@H](CI)O[C@@H]1CCN(Cc2ccccc2)C1 2244803771 YZAUEYXAHVYYSZ-VQIMIIECSA-N 425.285 4.593 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2cc(-c3ccccc3)n[nH]2)sc2c1CCCC2 2294818821 URUZDABCHSGDDN-UHFFFAOYSA-N 446.532 4.739 50 10 IJGE CC(C)(C)[C@@H](CBr)NCc1cc(I)ccc1Cl 2307328817 RNFNVAXDAIFMLZ-GFCCVEGCSA-N 430.555 4.844 50 10 IJGE FC1(CBr)CCN(Cc2ccc(Cl)cc2I)CC1 2318508598 APGAIUXDKZYKGO-UHFFFAOYSA-N 446.529 4.644 50 10 IJGE O=C(NN=Cc1cc(Br)c(O)c(Br)c1)Nc1ccc(Cl)cc1 2323840387 WSHJUGSLHCAQEM-UHFFFAOYSA-N 447.514 4.726 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)C(C#N)=CN(Cc1ccccc1)Cc1ccccc1 2324429996 MZBPIINQBSFATC-UHFFFAOYSA-N 439.515 4.912 50 10 IJGE Cl[C@@H]1CCC2(CC2)N(Cc2ccc(I)c(Br)c2)C1 2325211494 JHXPQHYDIOUIOO-LLVKDONJSA-N 440.550 4.790 50 10 IJGE CC(C)(C)c1cc(Br)ccc1OCCOCCI 2326711647 SQPWGEXPAQWILQ-UHFFFAOYSA-N 427.120 4.577 50 10 IJGE CCCCOc1ccc(C=C(C#N)c2nc(O)c3ccc(C(=O)OC)cc3n2)cc1OCC 2331045324 AXNAHTYFUMJPKJ-UHFFFAOYSA-N 447.491 4.764 50 10 IJGE C[C@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1ccnc(Cl)c1CBr)C2 2344739233 BXQMKDXBTMVDPN-NHCUHLMSSA-N 434.809 4.978 50 10 IJGE Cc1scc(C(=O)N2CC[C@@](CBr)(C(F)(F)F)C2)c1Br 2369602668 DVSVAKMVPFYLHF-NSHDSACASA-N 435.103 4.609 50 10 IJGE CC[C@@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)COc1cc(C)c(Cl)c(C)c1 10682254 PESIEJVUYRUEBC-FOIQADDNSA-N 446.975 4.854 50 10 IJGE CCN(CC)c1ccc(/C=C2/C(=O)N(Cc3ccccc3Cl)C(=O)C(C#N)=C2C)cc1 38608799 GDEQCTQJHJXDKZ-KGENOOAVSA-N 433.939 4.979 50 10 IJGE C=CCOc1ccccc1/C=N/NC(=O)COc1ccc2ccccc2c1Br 100437278 MYFSWIODLYTRGN-ZVHZXABRSA-N 439.309 4.696 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C\Nc1ccc(Br)cc1)C12CC3CC(CC(C3)C1)C2 217025167 QQWDLEVBDRKKOI-IAYYKLOSSA-N 428.374 4.990 50 10 IJGE COC(C)(C)CCO[C@@H](CI)c1ccccc1Br 234674574 BUNYWTQMVANJSC-ZDUSSCGKSA-N 427.120 4.757 50 10 IJGE Brc1cc(Br)cc([C@@H]2CC[C@H](CI)O2)c1 307601033 UFHIKHJTQVNFOD-MNOVXSKESA-N 445.920 4.867 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@@H]1CCC[C@]12CC[C@H](CI)O2 686242769 SZQKDQKGSHMYJB-OLMMMNRUSA-N 449.373 4.929 50 10 IJGE O=S(=O)(CCC(CBr)(CBr)C1CCCCC1)C(F)(F)F 697078654 NDSDAHNDBSBHLL-UHFFFAOYSA-N 444.151 4.668 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@@H]2C[C@@H]2c2ccc(Cl)cc2Cl)c1C 736694125 OWLAAPYBKGEDKJ-IAGOWNOFSA-N 428.323 4.709 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc(Oc3ccc(F)c(F)c3)cc2)c1C 736696965 PTIXLLZHPXGGGK-UHFFFAOYSA-N 447.445 4.983 50 10 IJGE O=C(NNc1ncccc1Cl)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 784815337 UVJVDDZWXQVPTC-UHFFFAOYSA-N 435.698 4.791 50 10 IJGE C[C@@H](NC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)c1cc2ccccc2o1 785978029 RKRMHBCFFLEGLG-MRXNPFEDSA-N 447.466 4.856 50 10 IJGE CCC(CC)(C(=O)NNc1ccc(C#N)cc1C(F)(F)F)c1ccc(OC)c(OC)c1 799751048 NOVJTFHVOCTJJE-UHFFFAOYSA-N 435.446 4.795 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1)c1ccccc1 1650685821 CDPILOPATXASQO-ICFOKQHNSA-N 442.544 4.720 50 10 IJGE C#CCCCC(=O)NNC(=O)c1oc2ccccc2c1CSc1ccccc1Cl 1652536076 GSLOFMMFPWOQAE-UHFFFAOYSA-N 426.925 4.943 50 10 IJGE CCCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@@H]2c1ccccc1OC(C)C 1865704679 BQLRBLWLTTWEIF-QFIPXVFZSA-N 444.535 4.974 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCN(C(=O)OC(C)(C)C)C2(CCC2)C1 1882567125 PBGAZOHXZWGXSQ-HUUCEWRRSA-N 447.414 4.844 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@H]2C[C@]23CCOC3)s1 1900920733 XQAKBTOFJIOLSL-CGYDSVCVSA-N 433.536 4.869 50 10 IJGE C[C@@H](c1ccncc1Br)[C@H](Br)c1c(Br)cnn1C 1924055623 HIXWUESUDRHNKC-CPCISQLKSA-N 437.961 4.580 50 10 IJGE O=C(N[C@H](CBr)CC1CC1)c1scc(Br)c1Br 1942799928 UTDNRELDWWKRTL-ZETCQYMHSA-N 446.002 4.567 50 10 IJGE C[C@H]1CN(Cc2cccc(Br)c2Br)C[C@@H]1CBr 1943881545 BSSQDLLZXONMSV-ONGXEEELSA-N 425.990 4.674 50 10 IJGE Brc1ccc(CN2C[C@@H](Br)[C@@H](C3CC3)C2)c(Br)c1 2031403281 PEVLKZWCQZKAIM-TZMCWYRMSA-N 438.001 4.817 50 10 IJGE CC(C)N1C[C@H](Br)[C@H](Cc2cccc(Br)c2Br)C1 2039262942 RXTVJTRSWVBFKR-YPMHNXCESA-N 440.017 4.858 50 10 IJGE CCN(CCCCBr)C(=O)c1cc(Br)cc(Br)c1 2041183089 AZPSAYLTWGPPQP-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE CC(C)[C@H](CBr)CN1CCC[C@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2044704199 AQYWVTYSCXMNNG-CJNGLKHVSA-N 431.337 4.575 50 10 IJGE CC1(CBr)CC(NC(=O)c2cc(Br)cc(Br)c2)C1 2055633081 IUIWHSREPGPVGO-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE FC(F)Oc1ccc(I)c(OC(F)(F)F)c1CBr 2060215743 JHAQGYSBEJSXOQ-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE O=C(CBr)c1ccc(I)c(C(F)(F)F)c1C(F)F 2060394327 GOTCUFRLVJFIFU-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)C[C@@H]1CCCCN1C(=O)OC(C)(C)C 2106786970 WRUSNVMEMAZHHS-MOPGFXCFSA-N 425.411 4.887 50 10 IJGE CC1CCC(CNC(=O)[C@@H](Br)C2CCCC2)(NC(=O)OC(C)(C)C)CC1 2136820205 WFTRBAJMBPVXMX-FXUPRZHBSA-N 431.415 4.530 50 10 IJGE CC[C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CN1C[C@@H](CBr)c1ccccc1 2163065293 ZBJJAZGNGVDERD-UAFMIMERSA-N 437.422 4.742 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CCCN2C(=O)c2ccc(CBr)cc2)C1 2182064860 NFUQXZRTXRTQMZ-NRFANRHFSA-N 437.378 4.587 50 10 IJGE O=C(c1cccc(Br)c1Cl)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Br)C2 2190679408 QFGRPSVJZHPYPZ-LXOIKGMDSA-N 425.523 4.581 50 10 IJGE CC(C)N(CCCCCI)C[C@H]1CCCN1C(=O)OC(C)(C)C 2211185542 KDNNZFLMZBBRLC-MRXNPFEDSA-N 438.394 4.702 50 10 IJGE CO[C@@H]1CC[C@H]1COc1c(Br)cc(CBr)cc1Br 2220576035 KXAWEHIOTIPEPM-JOYOIKCWSA-N 442.973 4.910 50 10 IJGE FC(F)(F)c1nc(-c2ccc(I)cc2)ncc1CBr 2228788119 MNOSJVSVGZJOMS-UHFFFAOYSA-N 443.004 4.662 50 10 IJGE CCc1nc(-c2ccc(I)cc2)nc(CC)c1CCBr 2237092176 FVIOTKGMDMXZFV-UHFFFAOYSA-N 445.142 4.810 50 10 IJGE O=C(Cc1ccc(Br)cc1Cl)N[C@H](CBr)c1ccsc1 2237439120 FZYVDGBZWVZAAQ-CYBMUJFWSA-N 437.584 4.959 50 10 IJGE C[C@@H]1CC[C@@H](COC2(CI)CCN(C(=O)OC(C)(C)C)CC2)C1 2243469183 GFEQLIXGOZDYDO-HUUCEWRRSA-N 437.362 4.644 50 10 IJGE C[C@H]1CO[C@@](CBr)(Cc2ccc(Cl)cc2I)C1 2302315068 FLORSBXKPHIRFN-NOZJJQNGSA-N 429.523 4.677 50 10 IJGE Cc1ccc(NC(=O)COc2ccc(C=C(C#N)c3nc(O)c4ccccc4n3)cc2)cc1 2314433490 NVVPYRNJEZZKRW-UHFFFAOYSA-N 436.471 4.726 50 10 IJGE CC1=C(C#N)C(=O)N([C@H](C)c2ccccc2)C(=O)C1=CNc1cccc(C(F)(F)F)c1 2314585761 RSJZYMHXPQKARE-OAHLLOKOSA-N 425.410 4.971 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)COc2ccc(C(C)(C)C)cc2)cc1 2314785106 IBOGHITVAPWRIF-UHFFFAOYSA-N 434.536 4.792 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CBr)OCc1cc(F)ccc1C(F)F 2316335323 LGOOPNAOYBJKQV-QGZVFWFLSA-N 426.273 4.958 50 10 IJGE CN(CC[C@@H]1CCCCN1C[C@@]1(CBr)CC1(F)F)C(=O)OC(C)(C)C 2326919541 OHORWPHVPMRCIV-YOEHRIQHSA-N 425.358 4.518 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@H]2C[C@]1(CBr)C2 2327396288 AGZYIPFKXAHANP-WJONMLJTSA-N 440.550 4.694 50 10 IJGE CC(C)N(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@@]1(CBr)CC1(F)F 2351886837 FGBGYQJSTZBWNR-YJBOKZPZSA-N 439.385 4.764 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)CC[C@H]1C(F)(F)F 2353834169 LGSVWTWSBOEHTA-GJZGRUSLSA-N 445.364 4.917 50 10 IJGE CC[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C)c(C)c1 10153412 BVNMDCCBNMCPOC-CJFMBICVSA-N 446.547 4.743 50 10 IJGE O=C(CCC(=O)Nc1ccc(Cl)cc1Cl)N/N=C/c1c(O)ccc2ccccc12 12580922 FADHMRPPZYMJHD-WYMPLXKRSA-N 430.291 4.721 50 10 IJGE O=C(CCCNc1ccc(Cl)cc1)N/N=C/c1ccc(OCc2ccc(F)cc2)o1 20291537 FYOQNMHOTLHGQT-VULFUBBASA-N 429.879 4.994 50 10 IJGE N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccc2c(c1)OCO2)C(=O)NC1CCCCC1 39850235 DITDNXYFCYRIDT-CPNJWEJPSA-N 440.503 4.624 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Cl)c3ccc(Br)c(F)c3)cc2[nH]1 109883654 CLXSTWOHMSFTQP-ZDUSSCGKSA-N 434.490 4.849 50 10 IJGE CC(C)Oc1c(Br)cc(/C=N/NC(=O)c2ccccc2)cc1Br 169881327 MPXWNNAIWQEWQR-KEBDBYFISA-N 440.135 4.763 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\N(Cc1ccccc1)c1ccccc1 217156408 BZYDYVSGOIJIOO-VZCXRCSSSA-N 425.488 4.916 50 10 IJGE CC(C)C[C@H](Br)CNC(=O)c1cc(Br)c(Br)s1 226263038 GPNNAKPUHDQXDB-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE COc1ccc(C=NNC(=O)c2cccc(Br)c2)cc1COc1ccccc1 252622638 NZOGXIZQULVYFY-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2cccc(NC(=O)c3ccc(C)cc3)c2)cc1 254704126 ACLCEYPJUVYZLW-UHFFFAOYSA-N 428.536 4.857 50 10 IJGE ClCc1c(I)ccc2c(I)csc12 307487154 CTWRWGUZOJPARE-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE FC(F)Oc1cc(CBr)cc(Br)c1I 575682418 POEJPCMWMDHJCM-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE FC(F)(F)c1cc(I)cc(Br)c1CBr 575694569 ILTSGIUMQVIFMQ-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE CC(C)C[C@H](C)O[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 725343880 UALACBCWDZQSGU-YOEHRIQHSA-N 425.351 4.642 50 10 IJGE Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)NNC(=O)c3cn(C)c4ccccc34)s2)cc1 730829987 MGDUDOZIENPMEQ-MRXNPFEDSA-N 447.564 4.624 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc3c(c2)nc(C)n3-c2ccccc2)c1C 736695130 UNPRNTODASNZTR-UHFFFAOYSA-N 449.518 4.560 50 10 IJGE COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)NNC(=O)CCOc2ccccc2)cc1 743572313 AZPKFJBRNYNJGE-LJQANCHMSA-N 447.535 4.565 50 10 IJGE CCc1ccccc1NC(=O)NN=Cc1ccc(OCc2cccc(C(=O)O)c2)c(OC)c1 1084321698 VOCNVVBCSHEFDI-UHFFFAOYSA-N 447.491 4.690 50 10 IJGE O=C(COc1ccc(Cl)cc1Br)NN=Cc1cccc(C(F)(F)F)c1 1084613911 XVQDCUXNRBLLHK-UHFFFAOYSA-N 435.627 4.650 50 10 IJGE C=C1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 1301269480 PGWCTHVPAXLEJU-LAQTVEMMSA-N 431.927 4.734 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C)[C@H]1CCCO1 1435967822 WSWAIRCFZDPXID-KOJWAJMBSA-N 442.346 4.605 50 10 IJGE CCCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@@H]2c1c(F)cccc1Cl 1865685135 GBZYHLOUAGXTPI-GOSISDBHSA-N 438.890 4.979 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@H](c1ccccc1OC)C(C#N)=C(N)O2 1865710361 WJVJRUZMZYRPHU-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE CCc1ccc(OCCCC(=O)Oc2ccc([N+](=O)[O-])cc2F)c(Br)c1 1865772186 UDTJIUAAVNJMPX-UHFFFAOYSA-N 426.238 4.823 50 10 IJGE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1ccc(-c2ccccc2Cl)o1 1873793847 ZTYPEPJCAATXAC-YDHBSESOSA-N 433.936 4.990 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)C(=O)c1cc(O)cc(Br)c1 1914231290 AJLMSDODMKKRBL-LBPRGKRZSA-N 427.136 4.581 50 10 IJGE CC(C)C[C@H](CNC(=O)OC(C)(C)C)[C@@H]1CCC[C@@H](CI)O1 1931100229 YHHBILQQZOQXLO-ILXRZTDVSA-N 425.351 4.546 50 10 IJGE CC1(C)OC[C@@H](Cc2cccc(Br)c2Br)[C@H]1Br 1943886692 XIONLLPAZLXSHR-BXKDBHETSA-N 426.974 4.943 50 10 IJGE C[C@H]1CCN(Cc2cc(Br)ccc2Br)[C@@H]1CBr 2006503726 RIPDXVPBYZYYKJ-TVQRCGJNSA-N 425.990 4.817 50 10 IJGE CCC[C@@H](CCBr)NCc1ccc(I)c(Cl)c1 2026567008 OLILYJAAFYDQNM-NSHDSACASA-N 430.555 4.988 50 10 IJGE CC(C)[C@@H](Br)CCNC(=O)c1c(Br)cccc1Br 2033091232 OKAVWRWFPFKVTL-VIFPVBQESA-N 441.989 4.751 50 10 IJGE CC(C)(C)OC(=O)N1CC[S@](=O)(=NC[C@@H](CBr)C(C)(C)C)C(C)(C)C1 2069025071 HPHCXFANCNGRBN-DLUDVSRJSA-N 439.460 4.541 50 10 IJGE COc1ccc(-n2nc(CCl)c(I)c2C(F)(F)F)c(C)c1 2079211077 ITMVGUXMHDSPDD-UHFFFAOYSA-N 430.595 4.552 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1ccc(Cl)c(Br)c1 2081236404 OWRNGCMWIIVPBD-PRHODGIISA-N 444.538 4.682 50 10 IJGE CC1(C)CCC[C@@]1(CCl)NC(=O)c1cc(Cl)ccc1I 2150543769 VAYKBECEFCKGQL-HNNXBMFYSA-N 426.125 4.862 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2Cc1sncc1Br 2184944880 WEYZMWMQWDUVGE-UHFFFAOYSA-N 436.560 4.508 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)C12CC(CO1)C2 2213489413 LPDSLINXKIDJPH-WQGPLGNCSA-N 428.921 4.966 50 10 IJGE O=S1(=O)C[C@H]2[C@@H](C1)[C@@H]2[C@H](Cl)c1c(Br)cc(Cl)c(Cl)c1Cl 2232511180 JSQHBMGVQHJOFY-AYFZAPKBSA-N 438.985 4.980 50 10 IJGE Cc1cncc(CO[C@@H](CI)c2cccc(Br)c2)c1 2279035226 XOVWGTSTDDDSLO-HNNXBMFYSA-N 432.099 4.845 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCC[C@H](CCBr)C1 2285957402 GZFQPPOSSDJJGG-SECBINFHSA-N 427.539 4.879 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2[C@]12C[C@@H]1CN(Cc1ccccc1)C2 2286081312 QYRUXNXBNDPJFU-VFNWGFHPSA-N 446.776 4.777 50 10 IJGE COC(=O)c1ccccc1NC=C(C#N)c1nc(-c2cc3ccccc3oc2=O)cs1 2295937227 ABDMTWKIQPIEBH-UHFFFAOYSA-N 429.457 4.680 50 10 IJGE COc1cc(C=C(C#N)c2nc(-c3cc4ccccc4oc3=O)cs2)ccc1OC(C)=O 2296763991 ULKVYICOEAOICS-UHFFFAOYSA-N 444.468 4.915 50 10 IJGE CCOC(=O)C(C#N)=CC=C(c1ccc(Cl)cc1)N1CCN(c2ccc(F)cc2)CC1 2297534808 WVHIJAMYZBXHNF-UHFFFAOYSA-N 439.918 4.655 50 10 IJGE C[P@@]1(=O)C[C@H](Cc2ccc(Cl)c(I)c2)[C@@H](Br)C1 2300238424 KSGOKAWHNQIJSU-FJHFEUQMSA-N 447.478 4.873 50 10 IJGE C[C@H]1CC[C@H](CBr)CN1Cc1ccc(Cl)cc1I 2318529934 WVZQVBYWBBFMPZ-WDEREUQCSA-N 442.566 4.940 50 10 IJGE Clc1ccc(CN2C[C@@H]3CC(Br)C[C@H]3C2)c(I)c1 2318537215 DQRJZZMTNDHLSL-QWRGUYRKSA-N 440.550 4.550 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(Cc2ccc(I)c(Cl)c2)[C@@H]1C 2321326630 RLRGQJCSMFRDCP-UMNHJUIQSA-N 442.566 4.938 50 10 IJGE Cc1[nH]c2ccccc2c1C=NNC(=O)c1ccc(Nc2nc(O)c3ccccc3n2)cc1 2323766246 QHWJBWKELMPNTG-UHFFFAOYSA-N 436.475 4.633 50 10 IJGE CCOc1cc(C=C(C#N)c2nc(C(C)C)cs2)ccc1OCC(=O)N(CC)CC 2331451184 YMGOXTUAQXYZNG-UHFFFAOYSA-N 427.570 4.977 50 10 IJGE C[C@@H](CC(=O)N(C)C[C@@H]1C[C@@H]1Br)c1ccc(NC(=O)OC(C)(C)C)cc1 2332465373 OYYBWYZIWMKNAN-QRTARXTBSA-N 425.367 4.769 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2C[C@H]1CN(CC1(CBr)CCCCCC1)C2 2333675299 ZSZQENBRCAIMLN-OKZBNKHCSA-N 429.443 4.957 50 10 IJGE COc1ccc(CCCCO[C@@](C)(CBr)CNC(=O)OC(C)(C)C)cc1 2344026679 CBFLNEWDOGFEIA-FQEVSTJZSA-N 430.383 4.713 50 10 IJGE C=CC[C@H](Br)[C@@H]1CCN1C(=O)c1cc(Br)c(F)cc1Cl 2360965872 ZKSXJBFQSVAWKX-ZANVPECISA-N 425.523 4.796 50 10 IJGE COc1ccc(N2Cc3ccc(C(=O)N/N=C/c4c(O)ccc5ccccc45)cc3C2)cc1 58871925 QNYJDGRUYUOHFF-RWPZCVJISA-N 437.499 4.838 50 10 IJGE CC1(C)CN(c2ccc(C(F)(F)F)cc2Br)C[C@@H](CBr)O1 164132041 HYTQPHXKXKUVEC-SNVBAGLBSA-N 431.090 4.847 50 10 IJGE CCO[C@@H]1[C@@H](Cl)C[C@@H]1Oc1c(I)cc(Cl)c2cccnc12 229349469 SWSYEWXVAGUEPK-VHRBIJSZSA-N 438.092 4.656 50 10 IJGE CC(C)N(CCCCl)C(=O)c1cc(Br)ccc1I 232631861 XGZJQPVFAFODIF-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE CCn1c(SCC(=O)NN=Cc2ccccc2C)nnc1-c1ccc(C(C)(C)C)cc1 254819613 RDTFGJFZSAYZLS-UHFFFAOYSA-N 435.597 4.813 50 10 IJGE O=C(NC[C@]12CCC[C@H]1CN(Cc1ccccc1)C2)c1ccc(CBr)cc1 312894530 XHUYYRGMCWQIDS-GMAHTHKFSA-N 427.386 4.614 50 10 IJGE COc1ccc([C@@H](Br)c2cc(I)cc3c2OCC3)cc1 379950721 DSWWUTQNWPVKLK-OAHLLOKOSA-N 445.094 4.719 50 10 IJGE C/C(NCCSSCCN/C(C)=C1/C(=O)C[C@@H]2[C@@H]1C2(C)C)=C1/C(=O)C[C@H]2[C@@H]1C2(C)C 503976550 SZFRXFHQDNKSIE-ZAKVSISKSA-N 448.698 4.585 50 10 IJGE FC(F)Oc1cc(I)c(C(F)(F)F)c(CBr)c1 575722971 IXHJJZDWNNYPMP-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE C=CC[C@]1(C(=O)OC)C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 688653172 DWWQFLFXOGTKEW-AUSIDOKSSA-N 433.621 4.907 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCC(F)(F)[C@@H](CCl)C1 705440205 VXKCNYODKMGSIK-LURJTMIESA-N 437.531 4.609 50 10 IJGE Cc1nn(C)c(COc2c(F)cc(Br)cc2CCl)c1Br 715716664 HWBFYDIHQMKXHO-UHFFFAOYSA-N 426.511 4.710 50 10 IJGE CC(=NNC(=O)CN1CCCCC1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1)N2 725395814 FOFUENVTYJRKRP-KHVXQDHOSA-N 428.580 4.839 50 10 IJGE COc1cc(C(=O)NNc2cc(C)ccn2)ccc1OCc1ccc(Br)s1 755846989 GYSIWCRYEDZKID-UHFFFAOYSA-N 448.342 4.559 50 10 IJGE CCc1c(C)nn(-c2cccc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c2)c1C 799749804 NBZLMMIJCGCNAI-UHFFFAOYSA-N 427.430 4.699 50 10 IJGE Cc1nc2ccccc2n1CC(=O)NN=Cc1ccccc1OCc1ccccc1Cl 1084032981 ZZVGPWFAHKSWKT-UHFFFAOYSA-N 432.911 4.727 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(-n3c(C)ccc3-c3ccccc3)cc2)ccc1O 1084092929 HVBSESGQPNAGOY-UHFFFAOYSA-N 425.488 4.931 50 10 IJGE Cc1ccc(-n2nc(C)c(C=NNC(=O)COc3ccc(C(C)(C)C)cc3)c2C)cc1C 1084159432 CPJQZJHRTARKLY-UHFFFAOYSA-N 432.568 4.933 50 10 IJGE C=CCC1(C(=O)NNC(=O)c2cc(-c3ccc(Cl)cc3)nc3ccccc23)CCOCC1 1136132010 WFONWHRHFILTLO-UHFFFAOYSA-N 449.938 4.689 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2c(C)cc(Cl)c3ccccc23)cc1 1466103416 FQBVZWBGYNRBAP-HNNXBMFYSA-N 439.899 4.624 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccccc2-c2ccc(C)s2)cc1 1679852644 WOBRCJUEHYMMDD-MRXNPFEDSA-N 437.521 4.546 50 10 IJGE CC[C@H](C)NC(=O)c1oc2c(c1C)C(=NNC(=O)Cc1coc3c(C)c(C)ccc13)CCC2 1772751786 MVXWTYDXUPHUSK-HNNXBMFYSA-N 449.551 4.879 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(Cl)cc2)cc1 1865694595 XNKVFADIBZIVIX-QFIPXVFZSA-N 434.927 4.900 50 10 IJGE CC[C@]1(C)[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C 1887218563 YRADNODIOLYJEW-PJIJBLCYSA-N 435.403 4.700 50 10 IJGE O[C@H](c1c(Br)sc(Br)c1Br)[C@H]1C[C@H]1Cl 1893453265 LVNZMIRTJIAHCU-VPGXFDHMSA-N 425.367 4.696 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC[C@@H]1C[C@H]1c1ccccc1 1910883741 RCVXRKPLHAOUMR-BXWFABGCSA-N 445.341 4.525 50 10 IJGE C[C@](CBr)(NC(=O)c1csc(Br)c1Br)C1CC1 1945189089 IUBAUUXDWNGNGL-LLVKDONJSA-N 446.002 4.567 50 10 IJGE C[C@@H]1C[C@H](CBr)CN1C(=O)c1cc(Br)sc1Br 1950506983 FGUAAPKYJRJPSM-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1ncc(Br)cc1F 1979830152 AMPKJCICELPPQG-UHFFFAOYSA-N 444.142 4.799 50 10 IJGE CCN(C[C@](C)(CI)O[C@H]1CCC2CC1C2)C(=O)OC(C)(C)C 1992237250 GECLQWOQRQVTTH-GULCKSEBSA-N 437.362 4.642 50 10 IJGE O=S(=O)(c1ccc(Cl)c(CBr)c1)N(Cc1ccccc1)CC(F)F 2009622642 SUWIPXFRQONJBQ-UHFFFAOYSA-N 438.721 4.691 50 10 IJGE CCC[C@@H](Br)CCNC(=O)c1cc(Br)ccc1Br 2029921162 DKMPHQFLNGMWCI-SECBINFHSA-N 441.989 4.895 50 10 IJGE CC(C)N1C[C@@H](Br)[C@H](Cc2cc(Cl)ccc2I)C1 2039249206 ASEBIKGXJUMKGQ-DGCLKSJQSA-N 442.566 4.591 50 10 IJGE CCC[C@@H](Cl)c1cn(-c2ccc(Br)c(I)c2)nn1 2057420820 JOTMLFMMAPIUDG-SNVBAGLBSA-N 440.510 4.714 50 10 IJGE O=S(=O)(C1CCC(CBr)CC1)N(CCC(F)(F)F)Cc1ccccc1 2059289060 NKFQODQWNBRTRV-UHFFFAOYSA-N 442.341 4.725 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2CCN(CC3(CBr)CCCCC3)C[C@H]2C1 2106788795 SPBRRGQCDSSCBC-ROUUACIJSA-N 429.443 4.911 50 10 IJGE Clc1ccc(CBr)c(N2CC[C@H]3COC[C@@H](C2)N3Cc2ccccc2)c1 2139652647 QIODWGAWSLCWBE-VQTJNVASSA-N 435.793 4.715 50 10 IJGE O=[N+]([O-])c1cc(CBr)ccc1N1CCN(Cc2ccccc2)C2(CCC2)C1 2153349890 QEQQWHCFOKNBJF-UHFFFAOYSA-N 430.346 4.735 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)NC[C@H](CBr)CC(C)(C)C 2156328533 GFLAUCONRPAABV-JTQLQIEISA-N 447.258 4.545 50 10 IJGE C[C@@]1(CCl)CC(F)(F)CN1C(=O)c1ccc(Br)cc1Br 2159053809 FQVYYBLCYFTZDX-LBPRGKRZSA-N 431.502 4.690 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N(C)C1(CBr)CCCCC1 2170290376 GAIIVADCSAVTEM-UHFFFAOYSA-N 445.242 4.537 50 10 IJGE BrC[C@@H]1CCc2nc([C@@H]3C[C@@H]4CC[C@H](C3)N4Cc3ccccc3)ncc2C1 2187368133 KSKFHLXIAGUNPY-RMVXJAJNSA-N 426.402 4.887 50 10 IJGE COc1ccc(N2C[C@]3(C)CN(Cc4ccccc4)C[C@]3(C)C2)c(CBr)c1 2235961560 ZCQXCTTWCGSIJL-ZRZAMGCNSA-N 429.402 4.939 50 10 IJGE CC(C)(C)OC(=O)NCCN(Cc1ccccc1)CC1(CBr)CC(F)C1 2241370342 MUALNJOKPWFOLG-UHFFFAOYSA-N 429.374 4.527 50 10 IJGE CN(Cc1cccc(I)c1)c1cccc(F)c1CBr 2265533082 QNXUONMIUKGEQM-UHFFFAOYSA-N 434.090 4.962 50 10 IJGE COc1ccc([C@H](Cl)c2nn(C)c(Cl)c2Cl)cc1I 2269539706 DWFPOWZZHRHVEN-VIFPVBQESA-N 431.488 4.668 50 10 IJGE Fc1cccc(I)c1[C@H](Br)c1ccc2c(c1)OCCO2 2282783599 IYUXAQOOJHWFON-OAHLLOKOSA-N 449.057 4.686 50 10 IJGE CC(F)(F)C[C@H](CBr)NC(=O)c1cc(F)c(Br)cc1Cl 2282980078 JFVOAFHXRYYWKE-ZCFIWIBFSA-N 437.481 4.780 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2OCCOC2(C)C)c(Br)c1Cl 2283546471 DZUQRHHPYCAAHO-AAEUAGOBSA-N 428.548 4.741 50 10 IJGE C[C@H]1CCCN(C(=O)c2cc(Br)c(F)cc2Cl)[C@@H]1CBr 2285960159 TVSXBISDVVIQLD-ISVAXAHUSA-N 427.539 4.877 50 10 IJGE N#CC(=Cc1ccc(-c2cccc(C(=O)O)c2)o1)C(=O)Nc1ccc(Br)cc1 2297504546 HAWMDOFJCWBFGQ-UHFFFAOYSA-N 437.249 4.953 50 10 IJGE CC[C@@H](C)[C@@H](CCl)NCc1ccc(I)c(Br)c1 2306218805 DWXQMDFGLDFMTL-NOZJJQNGSA-N 430.555 4.797 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)[C@H]2C2CC2)cc1I 2315547949 AYOBKWUKOLRENI-SMDDNHRTSA-N 440.550 4.692 50 10 IJGE C[C@H](CBr)CC1CN(Cc2ccc(Cl)c(I)c2)C1 2315550998 KUKDRSGLSMIJSZ-JTQLQIEISA-N 442.566 4.798 50 10 IJGE CC1(C)C[C@H](CBr)N(Cc2ccc(Cl)cc2I)C1 2318558128 RJJAXKXQHIJYLC-GFCCVEGCSA-N 442.566 4.940 50 10 IJGE O=C(NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21)c1ccc(Cl)s1 2326843826 SBOQEXHPCUIBHB-UHFFFAOYSA-N 430.316 4.736 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](CC)C(=O)NNC(=O)c1ccc(C)c(Br)c1 10683610 SNRSZNVBEPSPRM-IFXJQAMLSA-N 447.373 4.890 50 10 IJGE CC(C)c1ccccc1OCC(=O)NNC(=O)c1ccc(C(C)(C)C)c(Br)c1 13980013 YGEYOSAGSQUFKX-UHFFFAOYSA-N 447.373 4.710 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4C)ccc32)c1 38684833 ZHFIPKKNDOVPOW-XMMPIXPASA-N 426.472 4.831 50 10 IJGE CS(=O)(=O)c1ccc([C@H](Cl)c2cc(Br)ccc2Br)cc1 40269145 XFCJOSCNFWXNIY-AWEZNQCLSA-N 438.568 4.943 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)Nc2ccccc2[N+](=O)[O-])ccc1OCc1ccccc1 105792189 BCQOZRGVYBOWJE-CPNJWEJPSA-N 429.432 4.728 50 10 IJGE COc1cc(/C=N/NC(=O)Nc2ccccc2)cc([N+](=O)[O-])c1OCc1ccccc1C 169885136 MVCBXIRJGBGQBY-ZVHZXABRSA-N 434.452 4.646 50 10 IJGE CCCn1c(CBr)nnc1-c1cc(Br)cc(Br)c1 233394554 RKZSKINRTLIVAV-UHFFFAOYSA-N 437.961 4.775 50 10 IJGE CC[C@@H](CCBr)NC(=O)c1cc(Br)sc1Br 233873865 LRBJYVFFIOGDET-LURJTMIESA-N 433.991 4.567 50 10 IJGE C[C@@H](Cl)C[C@@H]1CCCCN1C(=O)c1ccc(I)c(Cl)c1 380181181 AFHRDGXYSCRRNC-PWSUYJOCSA-N 426.125 4.957 50 10 IJGE O=C(NNC(=O)[C@@H](Oc1ccc(F)cc1Cl)c1ccccc1)c1cccc2cccnc12 730541245 SSFCHJILNQGQAP-QFIPXVFZSA-N 449.869 4.609 50 10 IJGE O=C(NNC(=O)[C@H]1C[C@@H]1c1cccc2ccccc12)c1ccc(Br)cc1Cl 730752513 HEFPYYJCOAEWHO-MSOLQXFVSA-N 443.728 4.820 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)O[C@H]([C@H]2CCOC2)C(F)(F)F)c(C)n1-c1ccc(F)cc1 778021177 DKANOAVUZYSBQW-FMJPRLEPSA-N 436.405 4.651 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OCCSc2ccccc2)c(-c2ccccc2)n1 781846069 GBEUPWVMBSKBAQ-SILNSSARSA-N 428.517 4.706 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)Nc2ccccc2Cc2ccccc2)cc1 822629346 FQVLLBMHSZBYDF-IBZADVPGSA-N 440.499 4.763 50 10 IJGE O=C(NN=Cc1c(O)ccc2ccccc12)c1ccn(Cc2ccc(Cl)cc2Cl)n1 1084363182 FHVDODPGNQJBAJ-UHFFFAOYSA-N 439.302 4.861 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2ccc3oc(O)nc3c2)c(C)n1-c1cccc(Cl)c1 1133240331 JLFQWYFAGYTHPH-VCHYOVAHSA-N 446.894 4.818 50 10 IJGE CC[C@H](C(=O)NNc1nc(-c2cccnc2)nc(C)c1C)c1ccc(Br)cc1 1457667926 DASFLEAICASAJD-SFHVURJKSA-N 440.345 4.555 50 10 IJGE C/C(=C\c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1 1529781969 AUFBQXVOOBILTF-JQIJEIRASA-N 438.886 4.923 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CCC)nn3CC(C)C)cc1OCC 1865691712 ZHKDXAGFPWPCQA-JOCHJYFZSA-N 438.572 4.897 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)c3c2[C@H](c2cccs2)C(C#N)=C(N)O3)cc1 1865697754 AXIAPNRSYIZOJV-FQEVSTJZSA-N 426.501 4.828 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(Cl)c(Cl)c2)cc1 1865714449 KNXLIHWHGMDZPP-LJQANCHMSA-N 427.291 4.714 50 10 IJGE O=S(=O)(c1c(Cl)cccc1Br)N(CCCCl)Cc1ccccc1 1914613939 SPVWJEDXODMFLF-UHFFFAOYSA-N 437.186 4.922 50 10 IJGE N#C[C@H]1CN(c2ccc(CBr)c(C(F)(F)F)c2)CCN1Cc1ccccc1 1914891520 MYPZHXBCFNLRAY-SFHVURJKSA-N 438.291 4.815 50 10 IJGE C[C@H](CCCl)N(Cc1ccccc1)C(=O)c1ccc(I)cc1 1915079278 AFHSIWKVBZPHMA-CQSZACIVSA-N 427.713 4.951 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1nccc(C)c1Br 1927120364 BLLBIUDFGLUYAP-OAHLLOKOSA-N 440.179 4.968 50 10 IJGE CC[C@@H](Cl)CN(CC)C(=O)c1cc(Br)ccc1I 2044540513 CXYYHTDYDXZISD-SNVBAGLBSA-N 444.538 4.533 50 10 IJGE CC(C)CN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C[C@@H](Br)C(F)(F)F 2044705002 IAPPOALKHQBAFS-ZIAGYGMSSA-N 431.337 4.670 50 10 IJGE Brc1cccc(Br)c1CN1C[C@@H]2CC(Br)C[C@H]2C1 2065397933 VBLNJWCEANEPHM-UWVGGRQHSA-N 438.001 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)C(C)(C)C)[C@H](C(F)(F)F)C1 2066604286 SRWQPOXWISECEI-STQMWFEESA-N 431.337 4.527 50 10 IJGE Clc1cc(CN2C[C@H]3C[C@@H](Br)C[C@H]2C3)ccc1I 2086652551 QEERLAQZESCVNM-QJPTWQEYSA-N 440.550 4.692 50 10 IJGE FC(F)[C@@H]1CCc2c3c(cc(I)c2[C@H](Br)C1)CCO3 2094490333 ZPBWNDLVZJOQDD-PSASIEDQSA-N 443.069 4.880 50 10 IJGE CN(CCOCCN(C)C(=O)OC(C)(C)C)CC1(CBr)CCCCCC1 2106785725 CMKSBORJMHFYGI-UHFFFAOYSA-N 435.447 4.537 50 10 IJGE COCC(C)(C)N(Cc1ccccc1)S(=O)(=O)c1cccc(CBr)c1C 2123198333 BWYFSXCJJRBVKR-UHFFFAOYSA-N 440.403 4.506 50 10 IJGE CSCC[C@H](Cl)CCNc1ncc(C(F)(F)F)cc1I 2146553123 ANNJUDSYWVYDRQ-SECBINFHSA-N 438.684 4.868 50 10 IJGE CS(=O)(=O)c1csc([C@H](Br)Cc2ccc(Br)cc2F)c1 2149497624 AWADBWHMHNUVBD-LLVKDONJSA-N 442.169 4.732 50 10 IJGE CO[C@H]1CN(CC2(CBr)CCCCCC2)[C@](C)(CNC(=O)OC(C)(C)C)C1 2163061333 GFMFJRNWCRRKAJ-XLIONFOSSA-N 447.458 4.726 50 10 IJGE BrCc1c(N2CC[C@]3(CCCN(Cc4ccccc4)C3)C2)nc2sccn12 2163319424 VDMBESCXJOCKPY-NRFANRHFSA-N 445.430 4.783 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1CN(C(=O)[C@@H](Br)C1CCCC1)C1CC1 2167033869 POAQZVOOEJCTNH-MSOLQXFVSA-N 443.426 4.721 50 10 IJGE C[C@@H]1CC[C@H](CBr)N(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282987914 KQVZLCZGCGKEHN-RKDXNWHRSA-N 427.539 4.877 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1CCCl)c1ccc(Cl)c(I)c1 2283653811 KFIHRQHVXBSGPM-HZMBPMFUSA-N 426.125 4.862 50 10 IJGE CCOC(=O)COc1c(Cl)cc(C=C(C#N)c2nc3ccc(C)cc3[nH]2)cc1OCC 2294229400 QKAOPIWPQHVBCU-UHFFFAOYSA-N 439.899 4.930 50 10 IJGE C[C@H]1CCN(Cc2cc(I)ccc2Cl)C[C@H]1Br 2307329349 ZROVBZXEQGGDDB-JOYOIKCWSA-N 428.539 4.550 50 10 IJGE C=CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)cc1 38652780 DZMFSMKOVYBETQ-DEOSSOPVSA-N 442.446 4.828 50 10 IJGE CCOc1ccc(OCC(=O)N/N=C/c2ccc(OCc3ccccc3C)c(OC)c2)cc1 40911575 ZKPRCLYIFGTRRZ-JVWAILMASA-N 448.519 4.510 50 10 IJGE CCCOc1ccc(/C=C(/C#N)C(=O)Nc2sc(C(C)=O)c(C)c2C(=O)OCC)cc1 108861708 SIRMULHNGBGEGU-ATVHPVEESA-N 440.521 4.770 50 10 IJGE CC[C@@H](NC(=O)/C(C#N)=C\Nc1ccc([N+](=O)[O-])cc1OC)c1ccc2c(c1)CCCC2 217189704 MVGOOALIUBAUDE-OHUBLEDJSA-N 434.496 4.569 50 10 IJGE COCCCOCCC(CBr)(CBr)c1ccc(Cl)cc1 232239957 QZENHKNAWAEGCO-UHFFFAOYSA-N 428.592 4.811 50 10 IJGE CC[C@@H](Cl)c1noc(-c2cc(I)ccc2Br)n1 233884753 JPOHTEWVKIEJMW-SECBINFHSA-N 427.467 4.794 50 10 IJGE O=C(Cc1cccc2ccccc12)NN=Cc1ccc(OC(=O)c2cccc(F)c2)cc1 254707077 MKNCCLCDTIPWNA-UHFFFAOYSA-N 426.447 4.891 50 10 IJGE C[C@@H]1CC[C@H](O[C@@](C)(CI)CNC(=O)OC(C)(C)C)C[C@H]1C 299978899 JYYHURNHODTVMS-WVZRYYJFSA-N 425.351 4.546 50 10 IJGE C[C@@H](Br)CC(C)(C)CNS(=O)(=O)c1c(Cl)cccc1Br 393588412 ZUYNAUPHIQJDBW-SECBINFHSA-N 447.620 4.581 50 10 IJGE CC[C@@H](Br)[C@H](C)NC(=O)c1ccc(Br)cc1Br 395360277 JAQPTQAIIXQXGP-OIBJUYFYSA-N 427.962 4.503 50 10 IJGE ClCCc1nc2cc(Br)ccc2n1C1[C@@H]2CN(Cc3ccccc3)C[C@@H]12 398475423 YSPDUNMBHMWYGK-IAGOWNOFSA-N 430.777 4.883 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1C[C@@H]2CN(Cc3ccccc3)CC[C@H]2C1 404298891 PETWHVLGBKYHSN-HOTGVXAUSA-N 436.375 4.510 50 10 IJGE CC1(C)OC[C@@H](Cc2cc(Cl)ccc2I)[C@H]1Br 405540280 RMYOJPTYBICSLN-BXKDBHETSA-N 429.523 4.676 50 10 IJGE O=C(N[C@H](CCl)CC(F)(F)F)c1scc(Br)c1Br 717729319 NYBGHQGPDHHFDO-BYPYZUCNSA-N 429.483 4.563 50 10 IJGE BrCc1ncoc1-c1ccc(I)c(Br)c1 721591664 DNWVKZXYFOFRTL-UHFFFAOYSA-N 442.876 4.604 50 10 IJGE Cc1nnc(SCc2c(C(=O)NNc3cccc(F)c3F)oc3ccccc23)s1 743725513 HNRVLUKUSGRZLH-UHFFFAOYSA-N 432.477 4.920 50 10 IJGE Cc1cncc(/C=C\C(=O)NS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)c1 783460518 CVYPRWLWVFLXFZ-UQCOIBPSSA-N 428.404 4.566 50 10 IJGE Cc1c(O)nc2ccccc2c1C(=O)NNc1cc(C(F)(F)F)ccc1Br 1142347133 HEVQYKROHLXDDT-UHFFFAOYSA-N 440.219 4.787 50 10 IJGE COc1ccc2c(c1)c(C(=O)NNc1ccc(C#N)cc1C(F)(F)F)c(C)n2C1CC1 1339893528 LHCGNCZRMTUBTE-UHFFFAOYSA-N 428.414 4.941 50 10 IJGE C=CCOc1ccc(Br)cc1NC(=O)NNc1ccc(C(F)(F)F)cn1 1672209613 HDJAFJAOEFGYOK-UHFFFAOYSA-N 431.212 4.576 50 10 IJGE Cc1cc(OCC(=O)NN=Cc2c[nH]c3ccccc23)c(Br)c(C)c1Cl 1772756521 KQPCNYQSNLQHAB-UHFFFAOYSA-N 434.721 4.730 50 10 IJGE COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)c1 1860391449 HLULKNVNQIAKKN-UHFFFAOYSA-N 432.501 4.660 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@@H]1c1cccc(O)c1 1865681841 YHBQFWWSLOWYLP-MRXNPFEDSA-N 446.816 4.527 50 10 IJGE Cc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2ccccc2C(=O)O)cc1 1865704178 PKDUTUOVPSZPAO-JOCHJYFZSA-N 448.482 4.764 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2ccccc2)sc(C(=O)OCC(C)C)c1C 1865911543 QOAGYJOGNHNXBQ-GZTJUZNOSA-N 440.521 4.592 50 10 IJGE O=C(Oc1ccc2c(=O)c(-c3ccc(Br)cc3)coc2c1)C(Cl)Cl 1871385016 ADVWUTIQQQTWGW-UHFFFAOYSA-N 428.065 4.932 50 10 IJGE CC(=O)c1ccc(-c2ccc(/C=N/NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)o2)cc1 1873793210 CMUOHZXBEZKHRP-LEEXQRRLSA-N 441.528 4.539 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCC[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21 1882066945 OQOLOYILZZDBHR-XUWVNRHRSA-N 447.414 4.558 50 10 IJGE COc1cc(CBr)cc(Br)c1OC[C@H]1C[C@@H]1Br 2020240858 LAUWDUVYEWCGBA-BDAKNGLRSA-N 428.946 4.515 50 10 IJGE CC[C@H](C)[C@H](CBr)NC(=O)c1csc(Br)c1Br 2023036645 BSIRZXMEFMVRKD-XPUUQOCRSA-N 448.018 4.813 50 10 IJGE Oc1nc2cc([C@H](Br)C3CC(Br)C3)c(Br)cc2[nH]1 2076167965 SWRYNLQBSYOWIN-TUXAIXRJSA-N 438.945 4.641 50 10 IJGE C[C@@H]1CCCN(C[C@@H](CBr)c2ccccc2)[C@H]1CNC(=O)OC(C)(C)C 2106782687 SFSSKXMIHYYXBV-QRQLOZEOSA-N 425.411 4.790 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2Cc1ncc(Br)s1 2184942475 YHXGGLOOOPAXCP-UHFFFAOYSA-N 436.560 4.508 50 10 IJGE Cc1c(Br)csc1C(=O)NCCCCCCI 2213765946 KIOQTBISDOWJJT-UHFFFAOYSA-N 430.149 4.544 50 10 IJGE C[C@H]1[C@@H](C(F)(F)F)N(CCCCCCBr)CCN1C(=O)OC(C)(C)C 2223289495 IQQYXMIJIUWUIV-KBPBESRZSA-N 431.337 4.814 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)c(Br)cc2n1CCOCCF 2234057905 OJHNTKWHJNLOFM-MRVPVSSYSA-N 428.527 4.847 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H]3CC[C@@H](CN3CCCCCCCBr)[C@H]2C1 2277441001 YQJOFXHAKIPRII-MANSERQUSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)NC1(C(F)(F)F)CC2(C1)C[C@]2(CBr)C(F)(F)F 2302017054 ZPVPMOTWTJHFIV-MOENNCHZSA-N 426.195 4.940 50 10 IJGE C[C@@H]1[C@H](Cl)CCCN1Cc1ccc(I)c(Br)c1 2306220395 XBBSVNJGFVLTRG-BXKDBHETSA-N 428.539 4.645 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)CC(C)(C)CCl 2306226048 XTUMXMMUQFNYDO-UHFFFAOYSA-N 430.555 4.751 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)CSc2ccc(C)cc2)c(OC)c1 2314789601 MPABDJUMLYXQEA-UHFFFAOYSA-N 438.549 4.525 50 10 IJGE Cc1sc(NC(=O)C(C#N)=Cc2ccccc2)nc1-c1ccc2c(c1)C(C)(C)C(=O)N2 2320934074 IRHIUMLUTMALIC-UHFFFAOYSA-N 428.517 4.894 50 10 IJGE CCCOc1ccc(C(=O)NN=Cc2cccc(OCc3ccccc3)c2)cc1[N+](=O)[O-] 2325902482 QGKPNXRYJAECAE-UHFFFAOYSA-N 433.464 4.727 50 10 IJGE C[C@@]1(CCBr)CCN(Cc2cc(I)ccc2Cl)C1 2327407894 WRDXYQOOPWRANS-CQSZACIVSA-N 442.566 4.942 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2ccc(F)cc2)c(C)n1-c1ccc(N2CCOCC2)cc1 59087081 YUIWLKQOEQEWNX-LTGZKZEYSA-N 444.510 4.616 50 10 IJGE CCCCOc1ccc(/C=C2\C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)cc1OC 214381262 PIYWTEJLQHURIB-HMAPJEAMSA-N 444.531 4.975 50 10 IJGE ClCc1cc(I)c2ccsc2c1I 307073793 AIDXXFBOTAKVBK-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CCc1cc(NNC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)nc(-c2ccccn2)n1 738530841 QLABNMZKPXJOFZ-UHFFFAOYSA-N 447.445 4.928 50 10 IJGE Cc1ccc(F)c(NNC(=O)C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)c1 784880857 FZQSHNZNQIBTSO-LBPRGKRZSA-N 442.343 4.502 50 10 IJGE CCCc1c(OCCCBr)ccc(C(C)=O)c1OCCCC(=O)OCC 888086535 BJZCFUASEFSJSW-UHFFFAOYSA-N 429.351 4.728 50 10 IJGE in-vitro CCOc1cc(Br)c(/C=C(/C#N)C(=O)Nc2ccc(OC)cc2)cc1OCC 1083999736 RKGXIZIJFMSZJO-GDNBJRDFSA-N 445.313 4.801 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNC(=O)[C@@H](C)Oc1cccc(Cl)c1 1270896407 CZCLWFMADLAXPT-LMMOQWNQSA-N 427.715 4.665 50 10 IJGE C=C(CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1c1ccccc1Cl 1473418103 AKWOKGZAHMPIAV-QGZVFWFLSA-N 429.786 4.885 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865699868 FESKVRBAKOLSED-NRFANRHFSA-N 447.901 4.986 50 10 IJGE CC[C@@H](NC(=O)[C@H](C)c1ccc(Br)cc1)C(=O)Nc1ccc(SC#N)cc1 1866945148 YRMTYICVWODDDY-FZKQIMNGSA-N 446.370 4.659 50 10 IJGE CC(C)(C)[C@](C)(CBr)CN1CCC(NC(=O)OCc2ccccc2)CC1 1904845321 QBGILOIQHSUNSS-OAQYLSRUSA-N 425.411 4.825 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)C(=O)c1cc(Cl)ccc1Br 1916354688 KTVCVTILMDMVFZ-HNNXBMFYSA-N 431.157 4.999 50 10 IJGE CN(C[C@@H](Br)C1CCCC1)c1ncc(Br)cc1Br 2048739348 JFFXKYBPWQYSMZ-GFCCVEGCSA-N 441.005 4.997 50 10 IJGE CCC(CC)(CBr)CN=[S@](C)(=O)CC1CC(NC(=O)OC(C)(C)C)C1 2052164958 MOBKDKRPNCQRON-JXCLUFJWSA-N 439.460 4.589 50 10 IJGE CCn1cc(Br)c([C@H](Br)Cc2ncccc2Br)n1 2060851959 STMPTAWOIUTHTR-SECBINFHSA-N 437.961 4.502 50 10 IJGE CC[C@H](C)[C@H](CBr)NC(=O)c1cc(Br)cc(Br)c1 2081239769 WPGRPYGTDKFAAM-UFBFGSQYSA-N 441.989 4.751 50 10 IJGE CN(Cc1cccc(NC(=O)OC(C)(C)C)c1)C(=O)[C@H](Br)C1CCCC1 2110715890 RKHOCCFPMDGHNM-QGZVFWFLSA-N 425.367 4.946 50 10 IJGE C[C@H](CCCCCBr)NC(=O)c1cc(I)ccc1F 2117884873 YTWDSBSGNWWQDJ-SNVBAGLBSA-N 442.110 4.504 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(CC2(CBr)CCOCC2)c2ccccc21 2163057895 GFPJAKPHQUTQDO-QGZVFWFLSA-N 439.394 4.654 50 10 IJGE CN(C(=O)c1ccc(I)c(Cl)c1)C1(CCl)CCCCC1 2170169526 SXIUMXSBKVOTAP-UHFFFAOYSA-N 426.125 4.958 50 10 IJGE O=C(NCC[C@H]1CCCC[C@@H]1Cl)c1ccc(I)c(Cl)c1 2179638861 RXWZFIXQIKXIQG-PWSUYJOCSA-N 426.125 4.862 50 10 IJGE Cc1cc([C@H](Br)c2ccc3nc(O)[nH]c3c2)ccc1I 2207101978 IJDVDISFFSKPAL-AWEZNQCLSA-N 443.082 4.666 50 10 IJGE CCCN(C[C@H](C)Br)C(=O)c1cc(Br)sc1Br 2250567346 BYRKUZPCKFUQAM-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE O=S1(=O)CCC[C@@H]([C@@H](Br)c2cc3sc(Br)cc3s2)C1 2278111615 LKXPAKKZIMLABC-JMCQJSRRSA-N 444.235 4.986 50 10 IJGE COc1cc(C=C(C#N)c2ccc(C(=O)O)cc2)c([N+](=O)[O-])cc1OCc1ccccc1 2297379021 HKVFIWAASGJYPF-UHFFFAOYSA-N 430.416 4.945 50 10 IJGE Clc1ccc(CN2CCC[C@@H](Br)CC2)cc1I 2300238020 FYDURRXCRJUUOT-LLVKDONJSA-N 428.539 4.694 50 10 IJGE Cl[C@H]1CCCC[C@@H]1NCc1ccc(I)c(Br)c1 2306232485 VLBUJJBDQGXRJA-AAEUAGOBSA-N 428.539 4.693 50 10 IJGE C[C@@H](Cl)CCCN(C)C(=O)c1cc(I)ccc1Br 2314469686 CCOPJQUENVGINV-SECBINFHSA-N 444.538 4.533 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccccc2)C(=O)C1=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 2314610873 NOUHCCFVXQDCGP-UHFFFAOYSA-N 439.427 4.647 50 10 IJGE N=c1[nH]c2ccc(C(=O)NN=Cc3ccc(OCc4ccccc4)c(Cl)c3)cc2s1 2323601749 SHSGMINLGPOKGY-UHFFFAOYSA-N 436.924 4.705 50 10 IJGE CCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2326919753 QKPUMSRVAKVENA-RHSMWYFYSA-N 425.358 4.518 50 10 IJGE Cc1ccc(-c2csc(C(C#N)=C(O)c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)n2)cc1 2331313572 WCWSGYWYFMPRPP-UHFFFAOYSA-N 448.504 4.813 50 10 IJGE COc1c(Br)cc(C)c([C@H](Cl)[C@H]2OCCO[C@H]2C)c1Br 2365176956 VFGIHRPNCXTFSB-HJIKLVIJSA-N 428.548 4.612 50 10 IJGE CCCCCCOc1ccccc1C(=O)NNC(=O)c1ccc(NC(=O)CC(C)C)cc1 14032697 IOPNFUWRYZKDEH-UHFFFAOYSA-N 439.556 4.705 50 10 IJGE O=C(C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 33355031 UPLANWWIHHWIAE-UHFFFAOYSA-O 441.447 4.527 50 10 IJGE Cc1ccc(Br)c(-c2csc3nc(CCBr)[nH]c(=O)c23)c1 36306290 WRWFFJLQNKTRHK-UHFFFAOYSA-N 428.149 4.660 50 10 IJGE COc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(Cl)cc2)c1 38651289 PFXJMWUOEDRAKQ-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE CC(C)CCOc1ccc(/C=N/NC(=O)CSc2nnc(-c3ccccc3)s2)cc1 40947800 NUVVNQTZLJVTEX-OEAKJJBVSA-N 440.594 4.872 50 10 IJGE CCOCCC(CBr)(CBr)c1ccccc1Br 118878910 NFNYYDQEPZGZMP-UHFFFAOYSA-N 428.990 4.903 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCCC[C@H]1CBr 122800735 SMWLMWHBSUJFOS-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE CCOC(=O)/C(C#N)=C\c1cccc(OC(=O)/C=C\c2ccc(OCC)c(OCC)c2)c1 206692787 ANRYBALTKYHNEK-QHAKJVSCSA-N 435.476 4.573 50 10 IJGE O=C(CBr)c1cc(Br)c(Br)c(Br)c1 686086145 WLSBICLNEJLQJY-UHFFFAOYSA-N 435.735 4.552 50 10 IJGE Cn1c(Cl)cnc1CC(CBr)(CBr)c1ccc(Cl)cc1 700228886 RWGQDTANBBPFCX-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE BrCc1ccc(N2CC3(CN(Cc4ccccc4)C3)C2)cc1Br 706134717 NQTPBQMIDLYZMN-UHFFFAOYSA-N 436.191 4.666 50 10 IJGE Cc1c(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cnn1-c1ccccc1 772728094 GTLNQTNORBBCBP-RCCKNPSSSA-N 447.502 4.504 50 10 IJGE CC(C)Cn1nc(-c2ccccc2)cc1NC(=O)C(=O)NNc1cc(Cl)ccc1Cl 783369670 PQFGFQUQVXCTKH-UHFFFAOYSA-N 446.338 4.595 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12)c1ccc(F)cc1 1353183698 UEWSHCGLEABXTP-BMRADRMJSA-N 425.463 4.905 50 10 IJGE C#CC1(F)CN(C(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Cl)c(C(F)(F)F)c3)c2C)C1 1643708621 HEFRQDJSATWRRV-LZYBPNLTSA-N 449.835 4.857 50 10 IJGE COc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1cccc(C)c1)CCC2 1772744735 HOCYBYOYQUOVDK-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE CC(=O)N1CCc2cc(/C(C)=N\NC(=O)c3ccc(-c4ccc(C)c(C)c4)nc3C)ccc21 1865763198 ZVPJGHSWGDVKQK-MIXAMLLLSA-N 440.547 4.737 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)CN1c1ccc([N+](=O)[O-])c(CBr)c1 1921467336 AIVAPWNLNAPCKJ-SJORKVTESA-N 432.362 4.837 50 10 IJGE CCc1ccc(-n2cnc(Cl)c2CBr)cc1I 2012893019 XHUYQIQYYOUKHW-UHFFFAOYSA-N 425.495 4.588 50 10 IJGE O=C(N[C@@H](CBr)CC1CC1)c1c(Br)cccc1Br 2033091826 WAUGJVADQDUMFA-SECBINFHSA-N 439.973 4.505 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CCC[C@@H]1CCBr 2033093691 KJARWXFQAQNECE-SECBINFHSA-N 439.973 4.601 50 10 IJGE BrC[C@@H]1[C@H]2CC[C@@H](C2)N1Cc1cccc(Br)c1Br 2058369507 BWBSJFBMEZZJTR-XHVZSJERSA-N 438.001 4.959 50 10 IJGE Cc1oc(CBr)cc1S(=O)(=O)N(CCC(F)(F)F)Cc1ccccc1 2059285331 YFRSBIOBCGASFS-UHFFFAOYSA-N 440.281 4.626 50 10 IJGE CC1(C)OCCO[C@H]1[C@H](Br)c1ccc(Br)cc1Br 2083338153 MBMADQFAWJWPLW-NEPJUHHUSA-N 442.973 4.842 50 10 IJGE CCN1CCC[C@H]([C@H](Br)c2ccccc2OCc2ccccc2)S1(=O)=O 2089514392 KQJWGZRUZBDRNK-WOJBJXKFSA-N 438.387 4.516 50 10 IJGE CSCC[C@@H](Cl)CCNC(=O)c1ccc(Br)cc1Br 2090381754 IBTXYVZKWAZGDD-JTQLQIEISA-N 429.605 4.692 50 10 IJGE CC[C@]1(CNC(=O)[C@@H](Br)C2CCCC2)CCCCN1C(=O)OC(C)(C)C 2110723808 OWLDNGHYFKWHAS-OXJNMPFZSA-N 431.415 4.626 50 10 IJGE COc1ccc([C@H](Br)c2cc(Br)n(C)n2)c(Cl)c1Cl 2138627851 MSKALRGCOAYPSV-JTQLQIEISA-N 428.939 4.982 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N[C@@H](CBr)CC(C)(C)C)c1Br 2143909568 ASBQMVWSWKIHAQ-SNVBAGLBSA-N 447.258 4.605 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](CNC(=O)c2ccc(CBr)cc2)CC1 2162591779 NYSQUVZYIFQSPO-QAQDUYKDSA-N 439.394 4.642 50 10 IJGE Cc1sc(C(=O)N2CC(F)(F)C[C@@]2(C)CBr)c(Br)c1C 2237610779 DJKLGANYCGQZJG-LBPRGKRZSA-N 431.140 4.762 50 10 IJGE N#CC(=Cc1ccc(OCc2ccccc2)c(Br)c1)C(=O)NC1CCCC1 2293519266 QKWAYHAPPZNACM-UHFFFAOYSA-N 425.326 4.994 50 10 IJGE CC(C)Cc1ccc(-c2csc(C(C#N)=CNc3ccc(S(N)(=O)=O)cc3)n2)cc1 2296790037 KMYJJMRPVUCZOH-UHFFFAOYSA-N 438.578 4.633 50 10 IJGE O=C(Cc1ccc(Cl)c(F)c1)N[C@H](CCBr)COCc1ccccc1 2320353924 DVAZJZNYTNYWEI-MRXNPFEDSA-N 428.729 4.508 50 10 IJGE Clc1ccc(I)cc1CN1[C@H]2CC[C@H]1[C@H](CBr)C2 2327389779 NUCABRUPJXPCES-WFBYXXMGSA-N 440.550 4.692 50 10 IJGE C[C@H]1CN(Cc2cc(I)ccc2Cl)CC[C@@H]1CBr 2327402343 WBTNIRUTAPOIAH-WDEREUQCSA-N 442.566 4.798 50 10 IJGE COC(=O)c1ccc(C=CC(O)=C(C#N)c2nc(-c3ccc4c(c3)OCO4)cs2)cc1 2331334933 VYYNIHWLKVRSLP-UHFFFAOYSA-N 432.457 4.831 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3[C@@H](NC(=O)OC(C)(C)C)CCC[C@H]3C2)C1 2345010083 JKJJDWNBDTYSGS-BBWFWOEESA-N 429.443 4.813 50 10 IJGE Cc1nc(Br)c([C@@H](Cl)c2c(Br)cc(F)c(F)c2F)n1C 2362440837 FKVGPKVMEIIIGS-QMMMGPOBSA-N 432.465 4.999 50 10 IJGE FC(F)(F)[C@H]1C[C@@]1(CCl)CNCc1cc(I)ccc1Cl 2380513314 SMKNUMYLSRWPLO-NWDGAFQWSA-N 438.058 4.842 50 10 IJGE Clc1c(Br)cccc1CN(CCCBr)C1CCOCC1 2381149808 RJMHSYKWVZEKMJ-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE FC(F)(F)Cc1cccc(CO[C@H](CCl)[C@H](I)CCl)c1 2381379397 BXQBXPRRXKAWHN-VXGBXAGGSA-N 441.058 4.958 50 10 IJGE CCOC(=O)c1sc(NC(=O)CCSc2ccc(OC)cc2)c(SC#N)c1C 10032346 JTFRCAIHKDIMDK-UHFFFAOYSA-N 436.580 4.936 50 10 IJGE O=C(NNc1ncnc(Nc2cccc3ccccc23)c1[N+](=O)[O-])c1ccc(Cl)cc1 40627183 RNZQCRPXUNUGPQ-UHFFFAOYSA-N 434.843 4.692 50 10 IJGE Cc1ccc(Cl)cc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccn1)CCC2 40814278 CAFOMRFZTKBOBA-JVWAILMASA-N 436.899 4.668 50 10 IJGE CCOc1ccc(Br)cc1/C=N/NC(=O)COc1ccc(C(C)(C)C)cc1 40911907 AMQUKSLRWUHKSN-YDZHTSKRSA-N 433.346 4.674 50 10 IJGE CCOc1ccc(Br)cc1/C=N/NC(=O)COc1ccc(C(C)C)c(C)c1 40911921 BOYBOMNUUFEKIA-FSJBWODESA-N 433.346 4.809 50 10 IJGE CCOc1c(/C=N/NC(=O)COc2ccc(Br)cc2C(C)C)cccc1OC 40951058 NUHHBEAKNQCXHN-FSJBWODESA-N 449.345 4.509 50 10 IJGE CO[C@H](C)CC(CBr)(CBr)c1cccc(Br)c1 228630586 AXDWHIAYADRXNF-SNVBAGLBSA-N 428.990 4.902 50 10 IJGE CCCC[C@H](CC)CO[C@@](C)(CI)CNC(=O)OC(C)(C)C 231313501 QCLPPRFTYRYEEO-YOEHRIQHSA-N 427.367 4.938 50 10 IJGE Cc1nn(Cc2ccc(C(=O)NN=Cc3c(Cl)cccc3Cl)o2)c(C)c1Cl 252625576 QMXHKUPRICPCTI-UHFFFAOYSA-N 425.703 4.865 50 10 IJGE CC(=NNC(=O)c1ccc(Br)o1)c1ccc(NC(=O)c2ccccc2C)cc1 254595159 ZONOVVMYXVNVBO-UHFFFAOYSA-N 440.297 4.757 50 10 IJGE Oc1c(Br)cccc1[C@@H]1CN(Cc2ccccc2)C[C@@H]1CBr 382694360 WWEJURUDFAPOPH-GOEBONIOSA-N 425.164 4.765 50 10 IJGE C[C@@H](CCCBr)CNC(=O)c1ccc(Br)cc1Br 384288806 CZXPLLGNAJMFBM-VIFPVBQESA-N 441.989 4.753 50 10 IJGE COC(=O)c1ccc(NC(=O)c2cccc(NC(=O)Nc3ccc(SC#N)cc3)c2)cc1 586732742 PWVJKPLBXUKRIL-UHFFFAOYSA-N 446.488 4.943 50 10 IJGE C[C@@H](CCCCCl)NC(=O)c1ccc(I)c(Br)c1 721616486 URNFDCQDOXCXCO-VIFPVBQESA-N 444.538 4.581 50 10 IJGE CC(C)C[C@@H]1CCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)C1 744639743 GIRDZDNTYQMUBG-ACRNLXFHSA-N 435.959 4.919 50 10 IJGE CN(C)C(=O)/C(C#N)=C/c1cc(Cl)c(OCc2cccc(F)c2)c(Br)c1 1084318624 GTNJKOLNDAANRF-MKMNVTDBSA-N 437.696 4.816 50 10 IJGE COc1ccc(NC(=O)OC(C)(C)C)c(NC(=O)[C@@H](Br)C2CCCC2)c1 1183404478 FPDJATTYCIGHCQ-INIZCTEOSA-N 427.339 4.934 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)NCc2cnc(-c3ccccc3)s2)c1C 1339805124 VEIKORYMZHDIJV-RYFGYPJOSA-N 434.565 4.659 50 10 IJGE C/C(=C\c1cccc(Cl)c1)C(=O)NNC(=O)c1ccc(Br)cc1Cl 1359901174 ZBCVCBGUQRFOHB-JXMROGBWSA-N 428.113 4.620 50 10 IJGE CC(=O)c1ccc(OC(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)cc1Cl 1439530763 AIWOWMIVVUHXAC-JYWRCUDFSA-N 426.900 4.653 50 10 IJGE C=CC[C@]1(C(=O)NNc2ccc(Br)c(C)c2)CCCN1C(=O)OC(C)(C)C 1446486542 KCXGVRBJSVAGSW-HXUWFJFHSA-N 438.366 4.546 50 10 IJGE COc1ccc(C=NNC(=O)COc2ccc(-c3ccccc3)cc2Br)cc1 1772754459 IATYDYWQIGWGJS-UHFFFAOYSA-N 439.309 4.654 50 10 IJGE COc1cccc(/C=C/C(=O)Nc2cccc(C(=O)Nc3ccc(SC#N)cc3)n2)c1 1860563656 DFQUZRUMBQPWIY-MDWZMJQESA-N 430.489 4.568 50 10 IJGE CCCc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1ccc(O)cc1)C(C#N)=C(N)O2 1865684008 LCAIOVLBAYKGBT-FQEVSTJZSA-N 438.890 4.600 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccc(Cl)cc1 1865691252 NTRVQWRNOIPNOD-JOCHJYFZSA-N 432.911 4.676 50 10 IJGE Cc1ccc(COc2ccc([C@H]3C(C#N)=C(N)Oc4c3c(C)nn4-c3ccccn3)cc2)cc1 1865692331 DYPHMZURLRMVGA-VWLOTQADSA-N 449.514 4.681 50 10 IJGE COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccc(Cl)c(Cl)c1 1865710099 OEGAMXLKXVLOGF-HXUWFJFHSA-N 441.318 4.773 50 10 IJGE Cc1ccc(SCCCC(=O)NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1 1865755637 JGEGXIOAHWIEQN-CQSZACIVSA-N 441.380 4.789 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](O[C@H]2CCC3(CCCC3)C2)C1 1902886352 SFMJKHLZLGRUMF-SOUVJXGZSA-N 435.346 4.539 50 10 IJGE BrCCN(Cc1c(Br)cccc1Br)C1CCC1 1945333640 SUYLSTWGHVPUCK-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE Cc1c(CBr)cc(Cl)cc1S(=O)(=O)N(Cc1ccccc1)C1CC1 2009657783 FOHZJWIGUOPIBS-UHFFFAOYSA-N 428.779 4.897 50 10 IJGE O=C(Nc1c(Br)cc(Cl)cc1Br)C1CC(Br)C1 2020151872 KNLOUMSYZSGMHB-UHFFFAOYSA-N 446.364 4.977 50 10 IJGE O=C(NCC[C@H](Br)C1CC1)c1cccc(Br)c1Br 2031482606 UYCFGXSCZFVTFE-JTQLQIEISA-N 439.973 4.505 50 10 IJGE CCN(C[C@H](Br)C(F)(F)F)[C@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2044700637 RREBRLDFUGNXET-IHRRRGAJSA-N 431.337 4.718 50 10 IJGE COc1cccc(C)c1-n1nc(CBr)c(Br)c1C(F)(F)F 2079240000 QADOSEAORKLVDN-UHFFFAOYSA-N 428.046 4.866 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Cn1c(CCl)nc2cncc(Br)c21 2095438905 BRUVVZIVWNFKPC-GDBMZVCRSA-N 433.781 4.701 50 10 IJGE C[C@@H]1CC[C@@H](CNC(=O)C(F)(F)F)N(CCCCCCCCCBr)C1 2106786345 UOHIGLFCZVJLFG-CVEARBPZSA-N 429.365 4.891 50 10 IJGE CCC[C@H](CBr)CN1CC[C@H](C(F)(F)F)C[C@H]1CNC(=O)OC(C)(C)C 2107588406 XNSHMICMHMUASF-ILXRZTDVSA-N 445.364 4.965 50 10 IJGE COc1nsc(OC)c1CC(CBr)(CBr)C1CCCC1 2146821871 HUIXFNIBRULKSM-UHFFFAOYSA-N 427.202 4.669 50 10 IJGE CC1(C)CCCN(C(=O)c2cc(Cl)ccc2I)[C@@H]1CCl 2185813058 UADBOAPOYGXPQU-CYBMUJFWSA-N 426.125 4.814 50 10 IJGE C[C@H](Br)CCCc1cn(-c2cc(F)c(Br)c(Cl)c2)nn1 2189285790 ZOCSJCPYHASHAC-QMMMGPOBSA-N 425.527 4.928 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@]12CCC[C@@H](CN(C[C@H](CBr)CC3CC3)C1)C2 2226553576 LCHGOPKACOOMCW-LVCYWYKZSA-N 429.443 4.909 50 10 IJGE Cc1c(Br)csc1C(=O)NCC1(F)CCC(CBr)CC1 2234505933 HPKAZABEOIETBL-UHFFFAOYSA-N 427.177 4.842 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2OCCOC2(C)C)c(Br)c1Cl 2283546472 DZUQRHHPYCAAHO-DGCLKSJQSA-N 428.548 4.741 50 10 IJGE COc1ccc(Br)cc1C=C(C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 2293264741 WCQUMQZMNKJYBI-UHFFFAOYSA-N 436.649 4.565 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc(N(CC)CC)cc2)sc(C)c1C 2296818138 OXZFQVFRENOOFO-UHFFFAOYSA-N 425.554 4.934 50 10 IJGE C[C@H](Br)CCCN(C)C(=O)c1ccc(Cl)c(I)c1 2314467412 OMZQQSMAVMLFSE-VIFPVBQESA-N 444.538 4.580 50 10 IJGE COc1c(Br)cc(C)c([C@H](Br)[C@H]2C[C@@H]2OC)c1Br 2317429499 RXHBLHAUFMJJNK-OVYXKVPISA-N 442.973 5.000 50 10 IJGE COc1c(Br)cc(C)c([C@@H](O)C2CC(Br)C2)c1Br 2317433889 USCQJUSIQDQCSQ-TYAJBCFHSA-N 442.973 4.736 50 10 IJGE CC[C@@H](C[C@H](C)Br)NC(=O)c1ccc(Cl)cc1I 2317767725 AJQMSJCMGSYUJJ-WPRPVWTQSA-N 444.538 4.627 50 10 IJGE COc1cc(C=NNC(=O)Cc2ccc(O)cc2)ccc1OCc1ccc(C(C)(C)C)cc1 2323341209 FMWMKOZEENNKSB-UHFFFAOYSA-N 446.547 4.970 50 10 IJGE ClC[C@H](CNCc1ccc(I)c(Br)c1)C1CCC1 2325226490 PDQPBODHJXNMLT-GFCCVEGCSA-N 442.566 4.798 50 10 IJGE CC1(C)CC(CBr)(CN2[C@H]3CCC[C@H]3C[C@@H]2CNC(=O)OC(C)(C)C)C1 2345008232 MGDVSLBNKIRCOG-BBWFWOEESA-N 429.443 4.955 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@]34CCC[C@@]3(C2)CN(C(=O)OC(C)(C)C)C4)C1 2371150498 XTDVWFHOEDIFJB-FGZHOGPDSA-N 441.454 4.911 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc(S(N)(=O)=O)cc2)o1)c1nc(-c2ccccc2)cs1 33568265 VZNNXOMXALTDNW-ATVHPVEESA-N 433.514 4.782 50 10 IJGE Cc1cccc(NC(=O)/C(C#N)=C\c2c(Oc3cccc(C)c3)nc3ccccn3c2=O)c1 39858618 XUPXOKOTZLFVKZ-CYVLTUHYSA-N 436.471 4.649 50 10 IJGE COc1ccccc1/C=C(\C#N)C(=O)N(c1cc(C)ccc1C)S(=O)(=O)c1ccccc1 40977773 XSMDZWZAURJLLZ-LTGZKZEYSA-N 446.528 4.641 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@H]1Br)c1ccc(Br)c(Cl)c1 123771000 KEMNOWGWOCPAHI-HIFRSBDPSA-N 429.539 4.893 50 10 IJGE CC(C)Oc1ccc(/C=N\NC(=O)c2cccn(Cc3ccc(C(C)(C)C)cc3)c2=O)cc1 169921143 ALLNHMSFKRGZJM-QRQIAZFYSA-N 445.563 4.745 50 10 IJGE CC(C)COCCO[C@H](CI)c1ccc(Br)cc1 232698554 AFLSMTSBPABGNB-CQSZACIVSA-N 427.120 4.614 50 10 IJGE CC[C@@H](Br)CCNC(=O)c1cc(Br)cc(Br)c1 233853285 FQSRWHOWNSPVRD-SECBINFHSA-N 427.962 4.505 50 10 IJGE COC(=O)c1cccc(-n2c(C)cc(C=NNC(=O)c3cc4ccccc4o3)c2C)c1C 254438957 IXJISXVWDNEGPE-UHFFFAOYSA-N 429.476 4.699 50 10 IJGE COC1(C[C@H](Br)c2cc(I)cc3c2OCC3)CCC1 302507187 MLUQVQIFTFCZCS-ZDUSSCGKSA-N 437.115 4.621 50 10 IJGE CC1(C)CN(c2ncc(Br)cc2Br)CC[C@H]1Br 304491509 CXRJALSKGYIUAS-SNVBAGLBSA-N 426.978 4.606 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccccc1[C@@H]1CCc2ccccc2N1S(N)(=O)=O 616668003 CBGWUHLITLLYRT-NRFANRHFSA-N 432.662 4.906 50 10 IJGE COc1ccc(O[C@H]2C[C@H](Br)C23CCCC3)cc1I 712929990 KIIQPAGQZBFCJG-KBPBESRZSA-N 437.115 4.775 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)N2CCn3c(C(C)C)nnc3[C@@H]2C)c1C 784695465 FFGMWGGHHUCLHG-ALFKQNEGSA-N 442.567 4.628 50 10 IJGE COc1cc(C=NNC(C)=O)cc(Br)c1OCc1ccc(Cl)cc1Cl 1084433418 FJTAWQYVSWWOQC-UHFFFAOYSA-N 446.128 4.814 50 10 IJGE C=CCC[C@@H](NC(=O)NNc1ccc(F)c(C(=O)OC)c1)c1ccc(C(F)(F)F)cc1 1312343272 QQGRFNNBPSASHX-GOSISDBHSA-N 439.409 4.965 50 10 IJGE C#CCSCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1444390859 ZMHVPZBHYMSVPN-GZTJUZNOSA-N 432.376 4.791 50 10 IJGE C/C(=C/c1ccc(Cl)cc1)C(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1 1648376295 QPKJTWAGCGBZFK-VKAVYKQESA-N 445.906 4.508 50 10 IJGE Cc1c(C(=O)NCCc2ccccc2)oc2c1C(=NNC(=O)c1cccc(Cl)c1)CCC2 1772745716 FOBAZAJJYOUTGN-UHFFFAOYSA-N 449.938 4.684 50 10 IJGE N#CSc1ccc(NC(=O)Oc2ccc(CNC(=O)c3ccc4c(c3)OCO4)cc2)cc1 1858899835 SCYCEHSABFYEJI-UHFFFAOYSA-N 447.472 4.529 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CCl)[C@@H]1CCCN(C(=O)OC(C)(C)C)CCC1(F)F 1893342225 NKGMJHFLZZQWEZ-KBPBESRZSA-N 426.932 4.791 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1ccc2c(c1)CCC2 1915295449 KLKPEMASFJQABN-OAQYLSRUSA-N 436.415 4.786 50 10 IJGE O=S(=O)(N[C@@H](CBr)CC1CCCCC1)c1sccc1Br 1926736080 KVDLVPYBLXPYIN-LLVKDONJSA-N 445.242 4.523 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1C(=O)c1csc(Br)c1Br 1945186182 CQSHCLRPWQYFCK-RQJHMYQMSA-N 446.002 4.661 50 10 IJGE Cc1cc(F)c([C@H](Br)c2cc(I)sn2)cc1F 2007642676 APUKFILTYYOTRL-NSHDSACASA-N 430.055 4.819 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3C[C@H]2CC[C@H]3Br)c1 2028278911 ZQEALWNGTXCUIL-OASPWFOLSA-N 440.550 4.692 50 10 IJGE CC(C)CN(CCBr)C(=O)c1cccc(Br)c1Br 2036707419 BLCHQHQWAFJGJY-UHFFFAOYSA-N 441.989 4.705 50 10 IJGE CCC[C@@H](CBr)CNC(=O)c1cc(Br)cc(Br)c1 2057120844 VFGDFDBTZJKZBR-VIFPVBQESA-N 441.989 4.753 50 10 IJGE C[C@H](Cc1ccc(Br)cc1)NCCSSCCNC(=O)OC(C)(C)C 2061263903 IGPGYANDCKCIBL-CQSZACIVSA-N 449.480 4.876 50 10 IJGE CC(C)[C@@H](CBr)CN1CCCC[C@H]1C(F)(F)CNC(=O)OC(C)(C)C 2065453371 RBCTZYXTTQPWKJ-GJZGRUSLSA-N 427.374 4.668 50 10 IJGE CN(CCCCCCCCCBr)[C@]1(CNC(=O)OC(C)(C)C)CCOC1 2106784510 JESJUKDWJJUJNT-FQEVSTJZSA-N 435.447 4.728 50 10 IJGE Cc1cc(Br)c(C)c([C@@H](Cl)[C@@H]2CCS(=O)(=O)C2)c1Br 2136372512 UNBMQSWQUJFOII-RNCFNFMXSA-N 430.589 4.543 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2162911567 KZGNTMYEVKRDGU-JWTNVVGKSA-N 437.378 4.584 50 10 IJGE CC(C)(C)OC(=O)NCCC[C@@H]1CCCCN1C(=O)c1ccc(CBr)cc1 2163058680 MOHCMCFNFWMPGF-SFHVURJKSA-N 439.394 4.881 50 10 IJGE Cc1cc(Br)c(C)c([C@H](Cl)C2CCS(=O)(=O)CC2)c1Br 2201069858 MBUFJVPFIZRRFQ-CQSZACIVSA-N 444.616 4.933 50 10 IJGE CC[C@@H]1OCC[C@@H]1[C@H](Br)c1ccc(OC)c(I)c1 2257368516 HYCZZOSFQFKUEG-VHRBIJSZSA-N 425.104 4.551 50 10 IJGE CC1(C)C[C@H](CBr)CN1C(=O)c1cc(Br)c(F)cc1Cl 2285846081 JPJXEBPEZRBIFG-MRVPVSSYSA-N 427.539 4.877 50 10 IJGE CC1(C)OC[C@@H](Cc2ccc(Cl)c(I)c2)[C@H]1Br 2300239090 UDQRTZLWPLMQSE-BXKDBHETSA-N 429.523 4.676 50 10 IJGE N#CC(=Cc1ccc(OCC(=O)O)c(Cl)c1)C(=O)Nc1ccc(Cl)cc1Cl 2313543563 MOUPTNMMEFEVNG-UHFFFAOYSA-N 425.655 4.656 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)COc2ccc(C(C)C)c(C)c2)c(OC)c1 2314737349 AACUBEHBZGNYGD-UHFFFAOYSA-N 437.492 4.582 50 10 IJGE C[C@@H]1CCCN(Cc2ccc(Cl)c(I)c2)[C@@H]1CBr 2315553676 VTJJWNVPRASOKG-QMTHXVAHSA-N 442.566 4.940 50 10 IJGE COc1ccc([C@@H](C)NC(=O)C(C#N)=CN(Cc2ccccc2)c2ccccc2)cc1OC 2325045339 ADDDTXPBRXKUEU-HXUWFJFHSA-N 441.531 4.995 50 10 IJGE Clc1ccc(I)cc1CN1[C@H]2CC[C@H](C2)[C@H]1CBr 2327405672 DYOHSFPZHUHOQH-LJWDBELGSA-N 440.550 4.692 50 10 IJGE CCCCCOc1ccc(C=C(C#N)c2nc(O)c3ccc(C(=O)OC)cc3n2)cc1OC 2331045436 QLDIVCWACWYWKM-UHFFFAOYSA-N 447.491 4.764 50 10 IJGE Cc1ccc(C)c(-c2csc(C(C#N)=C(O)[C@H](C)N3C(=O)c4ccccc4C3=O)n2)c1 2331319348 JZEDQAPRYZJTIF-HNNXBMFYSA-N 429.501 4.904 50 10 IJGE COc1ccc(CCO[C@H]2CCCC[C@H]2I)c(Br)c1 2339257667 LUNGRQBYXCNSQA-CABCVRRESA-N 439.131 4.763 50 10 IJGE Clc1cc(Br)c(CN2C[C@@H]3CC[C@H](CBr)O[C@@H]3C2)s1 2345961953 PYACHAFBZYIQAT-IQJOONFLSA-N 429.605 4.538 50 10 IJGE C[C@@H](CCl)[C@@H]1CCCCN1C(=O)c1ccc(Cl)cc1I 2365594114 XPUWRFVHCZAVOW-HZMBPMFUSA-N 426.125 4.814 50 10 IJGE CC(C)Oc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1Br 14658754 WWSFHHXANSDXEY-UHFFFAOYSA-N 446.128 4.618 50 10 IJGE CCCn1c(-c2ccc(C(=O)NNC(=O)c3cccc(Cl)c3)s2)nc2ccccc21 35554256 UJNMLJGZXZHSNK-UHFFFAOYSA-N 438.940 4.903 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(OC)c4)ccc32)cc1 38676815 PSGCFBJQMYWDLF-XMMPIXPASA-N 426.472 4.695 50 10 IJGE CC(C)(C)C(=O)N/C(S)=C(/C#N)[P+](c1ccccc1)(c1ccccc1)c1ccccc1 109653629 QRZITCBEASOXKL-WCWDXBQESA-O 445.548 4.765 50 10 IJGE C[C@H]1CCc2[nH]c3ccc(C(=O)N/N=C\c4ccc(O)c(Br)c4)cc3c2C1 169891300 MULCBXDFOJQCOS-QNEYSMKTSA-N 426.314 4.525 50 10 IJGE C[C@H](CBr)CCCNC(=O)c1cc(Br)c(Br)s1 228273467 QHLKZGJUTBVBDC-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE CCCCN(CCBr)C(=O)c1cc(Br)cc(Br)c1 232950978 CKMWYYFIJWMCJA-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)c1C 736693909 LNKHIGNJQBTKJV-UHFFFAOYSA-N 446.898 4.753 50 10 IJGE Cc1ccccc1NNC(=O)c1cnn(-c2ncc(Cl)cc2Cl)c1C(F)(F)F 739391615 VFIYVPPAWMPUIN-UHFFFAOYSA-N 430.217 4.658 50 10 IJGE C=C/C=C/CC(=O)NNc1c(Br)cc(Br)cc1Br 1565986170 TXQQLAWXDFBEOW-ONEGZZNKSA-N 438.945 4.550 50 10 IJGE COc1ccc(/C(C#N)=C/c2ccc(OC(=O)COc3ccccc3OC)c(OC)c2)cc1 1615066135 RRKNINFOCWOJED-XSFVSMFZSA-N 445.471 4.761 50 10 IJGE C=C[C@H](CC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1 1624557216 IRWQIQQJFSIOGV-HXUWFJFHSA-N 436.515 4.660 50 10 IJGE CC(=O)c1ccc(Br)c(NC(=O)NNc2c(C)cccc2Br)c1 1627110149 SXLSJABKBWJYKI-UHFFFAOYSA-N 441.123 4.871 50 10 IJGE COc1ccc(-c2nn(CC(C)C)c3c2[C@@H](c2c[nH]c4ccccc24)C(C#N)=C(N)O3)cc1 1865699852 DVOXGVGJYNEGLV-JOCHJYFZSA-N 439.519 4.914 50 10 IJGE Cc1nn(-c2ccccc2Cl)c2c1[C@@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 1865714585 MWEZZKVJETXUEJ-SFHVURJKSA-N 441.716 4.815 50 10 IJGE CCCC[C@@H](NC(=O)c1n[nH]c(C)c1-c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1867277763 WNTQKGHFXMSPRG-HXUWFJFHSA-N 447.564 4.886 50 10 IJGE N#C/C(=C(/O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1nc(-c2ccc(F)c(F)c2)cs1 1872751665 RPQPDXPZJFDXFS-LGMDPLHJSA-N 430.348 4.855 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C2CCN(CC3(CBr)CCCC3)CC2)C1 1879198939 RUYJGPBDMSQCLH-SFHVURJKSA-N 429.443 4.911 50 10 IJGE O=S(=O)(c1cccc2cccnc12)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915186468 LPSIUIQXCGVHND-LJQANCHMSA-N 445.382 4.599 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]([C@]2(C)CCC[C@H](CI)O2)CC1 1993734190 BAOHDOCTKBLTHA-FSZRXZPDSA-N 437.362 4.833 50 10 IJGE C[C@H]1C[C@H](Br)CCN1Cc1ccc(I)c(Cl)c1 2026564472 UCTMFOFJFVPYPY-GXSJLCMTSA-N 428.539 4.692 50 10 IJGE CC1(C)CO[C@@H]1COc1c(Br)cc(Br)cc1CBr 2043109105 PEDGBOQETIRLRV-LLVKDONJSA-N 442.973 4.910 50 10 IJGE CN(c1ncc(Br)cc1Br)C1CCC(CBr)CC1 2051462493 XZXSJFNRSQIVKU-UHFFFAOYSA-N 441.005 4.997 50 10 IJGE COCCOc1ccc([C@H](Br)[C@@H]2C[C@@H]2Br)cc1Br 2076168625 ALBVFINHVCAWDX-NRUUGDAUSA-N 442.973 4.694 50 10 IJGE FC(F)(F)c1c(Br)c(CBr)nn1-c1cncc(C2CC2)c1 2078913413 LYOXTPSPPBVQNI-UHFFFAOYSA-N 425.046 4.821 50 10 IJGE CC1(C)C[C@@H](CBr)N(Cc2ccc(I)c(Cl)c2)C1 2086657788 IEKNKPCRTRJKDA-NSHDSACASA-N 442.566 4.940 50 10 IJGE CCC(CC)[C@H](Br)CNC(=O)c1ccc(I)c(C)c1 2142107554 QXMMXLKPTMJOEO-CYBMUJFWSA-N 438.147 4.529 50 10 IJGE Cc1c(CCl)cc(Cl)cc1S(=O)(=O)N(CCCN(C)C)Cc1ccccc1 2152204110 YUDTXEQBJVGYHH-UHFFFAOYSA-N 429.413 4.530 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@H](CBr)c2cscn2)cc1Br 2175661607 BJIOLZAAVGHTAT-LLVKDONJSA-N 438.572 4.733 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1ccc(F)cc1C(F)(F)F 2181748561 VTCZJEBKMKSPRT-UHFFFAOYSA-N 428.517 4.840 50 10 IJGE C[C@@H]1C[C@H](CCNC(=O)OC(C)(C)C)CCN1CCCCCI 2211188185 YQPKSAZTWFKYRF-HZPDHXFCSA-N 438.394 4.607 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1 2226349388 HRPADLLNTPQMKT-IYBDPMFKSA-N 436.375 4.795 50 10 IJGE C=CC[C@@]1(CBr)CCCN1C(=O)c1cccc(C)c1I 2287755464 PIJAPSZPVZGDFF-INIZCTEOSA-N 448.142 4.545 50 10 IJGE C[C@@H]1CC[C@@H](Cl)CN1Cc1ccc(I)c(Br)c1 2306219629 OJKUGCQFTDYUJF-MWLCHTKSSA-N 428.539 4.645 50 10 IJGE CCOC(=O)c1ccc(-n2c(C)cc(C=C(C#N)C(=O)NCc3cccs3)c2C)cc1 2313540831 WVVKLZAYCGMJQM-UHFFFAOYSA-N 433.533 4.556 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)C=Cc1cccc(F)c1 2321144016 ZSFNGFDBWSKWOQ-UHFFFAOYSA-N 444.293 4.977 50 10 IJGE CC1(C)C[C@H](CBr)N(Cc2cc(I)ccc2Cl)C1 2327390841 IQKXSPSXLDAGDE-GFCCVEGCSA-N 442.566 4.940 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)COc1ccc(-c2ccccc2)cc1 9873694 UYAXXNKBKQAICV-VQTJNVASSA-N 446.547 4.861 50 10 IJGE CCCCCCOc1ccc(/C=N\NC(=O)CSc2nc3ccccc3[nH]2)cc1OC 50954857 NOODEPTYIQGVCI-IWIPYMOSSA-N 440.569 4.773 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2ccc([N+](=O)[O-])cc2)sc2c1CC[C@H](C)C2 102957800 ZRMGYWLPGWARAM-WZMONFQBSA-N 439.493 4.503 50 10 IJGE CC(C)(C)c1ccc(/C=N\NC(=O)c2ccc(Nc3nc4ccccc4c(=O)[nH]3)cc2)cc1 169927930 BMDMXHKYEZJSCD-YUMHPJSZSA-N 439.519 4.728 50 10 IJGE CCOc1cc(/C=C2\C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1 214275150 QPDTYRDNUBLMAY-XKZIYDEJSA-N 444.531 4.913 50 10 IJGE COc1ccc([C@@H](C)N/C=C(/C#N)C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)cc1OC 217200741 JKBSTEFYNKKDKT-HZPUXAHQSA-N 433.552 4.518 50 10 IJGE CCCOc1ccc([C@@H](Br)[C@@H]2CCCCS2(=O)=O)cc1Br 229005195 XZYPMQNCKIMGJB-LSDHHAIUSA-N 440.197 4.641 50 10 IJGE CCCCCCCCO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1I 231314192 OPFVRCSZBZUERI-LSDHHAIUSA-N 425.351 4.786 50 10 IJGE COc1cc(-c2nc3ccc(C(=O)NN)cc3[nH]2)ccc1OCc1ccc(C(C)(C)C)cc1 256046676 HLTTUSUTIHXHFA-UHFFFAOYSA-N 444.535 4.719 50 10 IJGE ClCc1csc2cc(I)cc(I)c12 307423170 CMNPAJSADQXLOS-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2C1[C@@H]2CN(Cc3ccccc3)C[C@@H]12 398464815 UGFPTUNVATUVEX-ZIAGYGMSSA-N 434.740 4.980 50 10 IJGE N#CSc1ccc(NC(=O)c2cccc(NC(=O)NCc3ccc4c(c3)OCO4)c2)cc1 586626961 JHGMUBUZONFUNT-UHFFFAOYSA-N 446.488 4.562 50 10 IJGE C[C@H](NC(=O)NNC(=O)COc1ccccc1F)c1ccccc1-c1ccc(Cl)cc1 740024796 AFYCBZKUIIBBHJ-HNNXBMFYSA-N 441.890 4.617 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OCc2ncc(C3CC3)o2)c(-c2ccc(Cl)cc2)n1 781869589 RUWNFAZAUSYLDK-LICLKQGHSA-N 447.882 4.633 50 10 IJGE Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)C(=O)NNc1ccc(F)c(F)c1F 784806178 AXJFEEMTZZRHQT-UHFFFAOYSA-N 433.817 4.815 50 10 IJGE Cc1cccc(C(=O)NN=Cc2c(C)nn(-c3ccccc3)c2Oc2cccc(F)c2)n1 794564988 PSIVQWKLIJREMF-UHFFFAOYSA-N 429.455 4.579 50 10 IJGE CCN(CC)Cc1ccc(C(=O)NN=CC(c2ccc(F)cc2)c2ccc(F)cc2)o1 799877514 CTPGWCVELSEGRF-UHFFFAOYSA-N 425.479 4.947 50 10 IJGE CC(=NNC(=O)c1ccc(OCc2ccc(Br)cc2)cc1)c1ccccc1O 1084171301 KYDMLRUQIJPNJN-UHFFFAOYSA-N 439.309 4.888 50 10 IJGE O=C(/C=C/c1cccc2cccnc12)NNC(=O)c1cc(-c2ccco2)nc2ccccc12 1087068944 RTGSYQOEGSEGJG-OUKQBFOZSA-N 434.455 4.517 50 10 IJGE C#C[C@@H](NC(=O)NNc1nc(Cl)c(Cl)cc1Cl)c1ccc(Br)cc1 1230498522 FJUXIDHQAMYZRV-GFCCVEGCSA-N 448.535 4.805 50 10 IJGE C=C(C)C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCC(Cl)Cl 1556511563 CLPNQTAOSREYHG-HXUWFJFHSA-N 447.362 4.780 50 10 IJGE C#CCN(C(=O)[C@@H](Br)C(C)(C)C)[C@@H]1CCOc2ccc(Br)cc21 1617600635 MTHSSTVXQKJLCK-GDBMZVCRSA-N 443.179 4.544 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(Cl)cc2)CCC3)n1 1772744137 USPDULZPPOJJTM-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE COc1cc(C=NNC(=O)COc2ccc(Cl)cc2)ccc1OCc1ccccc1C 1772754495 WUBRFIVYSQJNIX-UHFFFAOYSA-N 438.911 4.765 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1ccccc1OC)C(C#N)=C(N)O2 1865710390 XBAHOJKKWWXHMB-NRFANRHFSA-N 434.927 4.764 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C[C@@]1(C)CCCCN1C(=O)OC(C)(C)C 1890137059 YPTRTPCCFTYWJA-AUUYWEPGSA-N 435.403 4.844 50 10 IJGE CCN(C[C@](C)(CI)OCCC[C@@H]1C[C@H]1C)C(=O)OC(C)(C)C 1896108097 IEMBDBSLSVJOAP-RKVPGOIHSA-N 439.378 4.890 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)Cc1ccc2ccccc2c1 1916348454 OBZJYCQODJNNRY-QFIPXVFZSA-N 426.354 4.821 50 10 IJGE Clc1cccc(C(CBr)(CBr)CC[C@@H]2COCCO2)c1 1916656938 GMFKFHKQQZYPBH-CQSZACIVSA-N 426.576 4.563 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC1(CCC[C@H](CI)O1)C2 1917625025 JQHVTASBXDRMRC-CQSZACIVSA-N 435.346 4.540 50 10 IJGE Clc1ccc(I)c(CN[C@H](CCBr)C2CC2)c1 1942806443 VYAGMQTUWNYSLE-CYBMUJFWSA-N 428.539 4.598 50 10 IJGE C[C@H](Br)[C@H]1CCN(Cc2ccc(Br)cc2Br)C1 1943846800 MEEJJFJDEYRKLP-UWVGGRQHSA-N 425.990 4.817 50 10 IJGE CC(C)(C)CC1CC(O[C@@](C)(CI)CNC(=O)OC(C)(C)C)C1 1987833913 NZCURWIMUFFVST-JRSKDTKFSA-N 439.378 4.936 50 10 IJGE CN(Cc1cc(Br)ccc1Br)[C@@H]1CCC[C@H]1Br 2006498096 AXIHQQBLYUZXNW-CHWSQXEVSA-N 425.990 4.959 50 10 IJGE CC1(C)OC[C@H](Cc2cc(Br)ccc2Br)[C@@H]1Br 2006501608 USVRRMMUGULALU-CABZTGNLSA-N 426.974 4.943 50 10 IJGE Fc1cccc(F)c1C[C@@H](Br)c1cc(I)sn1 2007645767 WXZRTAJBJQIPIU-SSDOTTSWSA-N 430.055 4.705 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1Cc1c(Br)cccc1Br 2018117035 JXWPCVHTGKYFDE-ZANVPECISA-N 425.990 4.959 50 10 IJGE CC[C@H](Br)[C@H](CC)NC(=O)c1c(Br)cccc1Br 2033085668 FVVWBIIESYCJPH-KWQFWETISA-N 441.989 4.894 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cc(F)c(F)cc1Cl 2049598832 ZKOLEZOFCMWNFB-CYBMUJFWSA-N 432.692 4.671 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@@H]1CCCCN1CC1(CBr)CCC1 2065452060 GJNIWIGIJALWDO-AWEZNQCLSA-N 425.358 4.566 50 10 IJGE CC1(C)CC(CCl)(CNc2ncc(I)cc2Br)C1 2069535221 FZCWJTJHRGDETR-UHFFFAOYSA-N 443.554 4.906 50 10 IJGE CC1(C)C[C@H](Br)CN(Cc2ccc(I)c(Cl)c2)C1 2086657209 CBCIIPDJGKFQHG-NSHDSACASA-N 442.566 4.940 50 10 IJGE CN(CCCCCCCCCBr)[C@@]1(CNC(=O)OC(C)(C)C)CCOC1 2106784511 JESJUKDWJJUJNT-HXUWFJFHSA-N 435.447 4.728 50 10 IJGE CC1(C)CN(C[C@H](CBr)c2ccccc2)CCN(C(=O)OC(C)(C)C)C1 2106788876 UFFJUVGRHJLUMA-SFHVURJKSA-N 425.411 4.744 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CC[C@]2(CCCN(Cc3ccccc3)C2)C1 2163319126 GNYKSBHDBSPDLV-QHCPKHFHSA-N 427.386 4.710 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@]12C[C@@H]1CN(Cc1ccccc1)C2 2184922619 NLVMHJQDERQYNJ-IERDGZPVSA-N 445.792 4.515 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CCCN1CCCCCI 2211187120 ZNSWHWIUQDTXLN-INIZCTEOSA-N 438.394 4.559 50 10 IJGE Cl[C@H](c1cc(Br)co1)c1cc(I)cc2c1OCC2 2258102525 BAJDSQYXIYVAHI-LBPRGKRZSA-N 439.474 4.910 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1CCCl)c1ccc(Cl)c(I)c1 2283653812 KFIHRQHVXBSGPM-IINYFYTJSA-N 426.125 4.862 50 10 IJGE CCN(CC)c1cc(OC)c(C=C(C#N)C(=O)NCc2cccs2)cc1Br 2294956850 PYOMMMDFPDHVKX-UHFFFAOYSA-N 448.386 4.589 50 10 IJGE C[C@H](Br)[C@@H]1CCN(Cc2ccc(Cl)c(I)c2)C1 2300240691 PCHAVQDRFXYJAS-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE Cl[C@@H]1CCC[C@@H]1CNCc1ccc(I)c(Br)c1 2306221351 GZNHOCBHXFDTAY-ZYHUDNBSSA-N 428.539 4.551 50 10 IJGE Cc1ccc(Sc2ccc(C=C(C#N)C3=NN(c4ccccc4)[C@H](N)[C@@H]3C#N)o2)cc1 2313560455 UGDYPXUFXOKCTA-QPPBQGQZSA-N 425.517 4.947 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccccc2)C(=O)C1=Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 2314610981 OTRJAPGSMYKMDZ-UHFFFAOYSA-N 439.427 4.647 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)COc2ccc(Cl)c(C)c2)c(OCC)c1 2314735884 IEDUURLPNNJKRU-UHFFFAOYSA-N 443.883 4.502 50 10 IJGE C[C@H](Br)[C@@H]1CCCN(Cc2ccc(Cl)c(I)c2)C1 2315551476 RIYNGMFCEPXCMP-CMPLNLGQSA-N 442.566 4.940 50 10 IJGE COc1cc(F)c(CN(C)C[C@@H](Br)COCc2ccccc2)c(Cl)c1 2317102855 DHAJKRXDEFFAAO-OAHLLOKOSA-N 430.745 4.900 50 10 IJGE O=C(Cc1c(F)cccc1Cl)N[C@@H](CCBr)COCc1ccccc1 2320358065 JEWBGIRRVGNJBI-HNNXBMFYSA-N 428.729 4.508 50 10 IJGE C[C@@H]1[C@H](Br)CCN(Cc2cc(I)ccc2Cl)[C@@H]1C 2327409349 NFPYAWOBPGXGAV-OPQQBVKSSA-N 442.566 4.938 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CCCC[C@H]2C[C@@H]1CNC(=O)[C@@H](Br)C1CCCC1 2358977200 RHCOGNIATMOWMG-MHORFTMASA-N 443.426 4.625 50 10 IJGE CCCOc1ccc(/C(CC)=N\NC(=O)[C@@]2(C)CC2(Br)Br)cc1 13136676 JZJCPZOBTUPRMA-ZHTGWBIJSA-N 446.183 4.602 50 10 IJGE C[C@@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccccc1F 38652082 MOUPILQEYJUYHS-FATZIPQQSA-N 448.425 4.556 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc([N+](=O)[O-])c4)ccc32)cc1 38677671 GWJWCEJUILXFBI-QHCPKHFHSA-N 441.443 4.595 50 10 IJGE CCCOc1ccccc1/C=C\C(=O)Oc1ccc(/C=C(/C#N)C(=O)NC(C)C)cc1OC 207004315 OOTALMXIZHJSCQ-BGVZQIFQSA-N 448.519 4.534 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccc(Br)cc1)[C@@H](Br)C2=O 256019414 ZUHKNCNLMMRTQD-VUCTXSBTSA-N 429.152 4.547 50 10 IJGE C[C@H]1CN(Cc2ccccc2)CCN1S(=O)(=O)c1ccc(Cl)c(CCl)c1Cl 382648265 QYOOPBGHJZXISY-AWEZNQCLSA-N 447.815 4.627 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@H](c2cc(F)ccc2Br)C1 382686480 FOELUJGETCSYIP-ZWNOBZJWSA-N 437.147 4.934 50 10 IJGE Cc1cc(Br)c(S(=O)(=O)N[C@H](C)CCCCCl)cc1Br 398502096 ZBOMVBUIIGGLRU-SNVBAGLBSA-N 447.620 4.596 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@H]2CCN(Cc3ccccc3)C[C@@H]21 404188638 CUWWHMDTTUAIOO-VXKWHMMOSA-N 437.466 4.943 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@H]2CCN(Cc3ccccc3)C[C@H]21 404188641 CUWWHMDTTUAIOO-YADHBBJMSA-N 437.466 4.943 50 10 IJGE C[C@H]1CN(c2ccc([N+](=O)[O-])cc2CBr)[C@H](C)[C@H](C)N1Cc1ccccc1 404258187 BYONFXINWGIMBX-YESZJQIVSA-N 432.362 4.977 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1C[C@H]2CCN(Cc3ccccc3)C[C@@H]2C1 404298893 PETWHVLGBKYHSN-HZPDHXFCSA-N 436.375 4.510 50 10 IJGE N#CSc1ccc(NC(=O)c2cccc(NC(=O)NCCCCN3CCCC3)c2)cc1 586628769 CNHYRAQTQMBDDW-UHFFFAOYSA-N 437.569 4.510 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1C(=O)c1cc(Br)ccc1Br 705613037 SQWQMVJELUZQJN-SCZZXKLOSA-N 439.973 4.600 50 10 IJGE CN(C[C@H]1CCCCN1Cc1ccccc1)c1nc2ccccn2c1CBr 720015872 DUVDIGNOXDUZOD-LJQANCHMSA-N 427.390 4.720 50 10 IJGE CCOc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CBr)cc1OCC 725392527 UWZFLZDXUFJQKO-CVEARBPZSA-N 428.367 4.829 50 10 IJGE COc1cc(/C=C\C(=O)Cl)cc(I)c1OCc1cccc(F)c1 1081475956 WPWYFTLQTYWHCJ-WAYWQWQTSA-N 446.643 4.797 50 10 IJGE COc1ccc(CC(=O)NN=Cc2ccc(OCc3ccc(Cl)cc3)c(OC)c2)cc1 1083901987 AXBFMLFYRSIWQM-UHFFFAOYSA-N 438.911 4.629 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2ccc(OCc3ccc(C)cc3)cc2)cc1 1084310056 RIOLBBZLEDMEDM-SANMLTNESA-N 446.547 4.937 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccc3nc(O)oc3c2)c(C)n1-c1ccc(F)cc1 1131894298 HCZUHXKEANVCBJ-BKQORJHRSA-N 444.466 4.864 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12)c1ccc(F)cc1 1353183700 UEWSHCGLEABXTP-ICFOKQHNSA-N 425.463 4.905 50 10 IJGE Cc1ccc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)cc1[N+](=O)[O-] 1614689528 BHAVFUQYDCQFEI-MSOLQXFVSA-N 433.302 4.650 50 10 IJGE Cc1c(C(=O)N2CCCC[C@@H]2C)oc2c1C(=NNC(=O)c1ccc(Cl)cc1)CCC2 1772743443 AQWIGQBAFNMJMW-AWEZNQCLSA-N 427.932 4.726 50 10 IJGE CCc1ccc(NC(=O)COc2cccnc2NC(=O)Nc2ccc(SC#N)cc2)cc1 1858823786 OMYCYKOXWPOUFH-UHFFFAOYSA-N 447.520 4.879 50 10 IJGE CCCc1nn(C)c2c1[C@H](c1ccc(OCc3ccc(Cl)cc3)cc1)C(C#N)=C(N)O2 1865694799 BZMWWZVDKIYHLX-OAQYLSRUSA-N 434.927 4.823 50 10 IJGE COc1cc(/C(O)=C(\C#N)c2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc(OC)c1OC 1873940686 CODQQENJYDFWMW-CYVLTUHYSA-N 439.449 4.694 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1cc(Br)ccc1Cl 1882086133 ZCRPLFPQSWBWMT-NSHDSACASA-N 427.564 4.933 50 10 IJGE Brc1cc(OCc2ccccc2)ccc1[C@@H](Br)[C@H]1COCCO1 1899860542 ONRFXHPGDMHXDX-QZTJIDSGSA-N 442.147 4.880 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2cnccc12 1915300441 OAQKLYPTFRAAKU-FQEVSTJZSA-N 447.398 4.845 50 10 IJGE C[C@H](c1ccncc1Br)[C@@H](Br)c1ccsc1S(C)(=O)=O 1924062670 HHVDUEPVPOVCBW-PRHODGIISA-N 439.194 4.549 50 10 IJGE BrC[C@@H](CC1CC1)NCc1c(Br)cccc1Br 1945331774 VKRIBWIMXUZHON-SNVBAGLBSA-N 425.990 4.865 50 10 IJGE CCN(C[C@@](C)(CI)OC1CC2(CCC2)C1)C(=O)OC(C)(C)C 1985548863 BEZBQIZARZBXGZ-QGZVFWFLSA-N 437.362 4.786 50 10 IJGE CC[C@H](Br)CCCNC(=O)c1cccc(Br)c1Br 2031479177 VSYVRECKAMELDI-VIFPVBQESA-N 441.989 4.895 50 10 IJGE C[C@]1(CBr)CCCN1C(=O)c1c(Br)cccc1Br 2033085059 VAWLYZWESOGTGE-CYBMUJFWSA-N 439.973 4.601 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc([S@](C)(=O)=NC[C@@H](Br)C(F)(F)F)cc1 2044703119 QYOCEGNFFPPMOW-YDBLSZJJSA-N 445.301 4.816 50 10 IJGE C[C@H](CCBr)CCN1CCC[C@@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2044704357 BYPPGCDBOPCJDF-CZUORRHYSA-N 431.337 4.719 50 10 IJGE C[C@@H](Cl)c1nc2cc(I)ccc2n1CC1(Br)CC1 2049229502 CUNNVKLOYSRJTD-MRVPVSSYSA-N 439.522 4.868 50 10 IJGE COCCOc1ccc([C@H](Br)[C@H]2C[C@H]2Br)cc1Br 2076168620 ALBVFINHVCAWDX-CWSCBRNRSA-N 442.973 4.694 50 10 IJGE COc1ccc(-c2csc([C@H](C#N)C(=O)C(C#N)=Cc3ccccc3)n2)c(OC)c1OC 2084349519 WZKNNJMIESMSSA-GOSISDBHSA-N 445.500 4.619 50 10 IJGE CCc1nn(-c2ccc(C)cc2CBr)c(CC)c1I 2093917708 RYAGFABNTDWWHS-UHFFFAOYSA-N 433.131 4.805 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCCCCN(C[C@@H](CBr)c2ccccc2)C1 2106784151 GOGAWZWGYQICLX-MOPGFXCFSA-N 425.411 4.934 50 10 IJGE CC(C)(C)C[C@H](CBr)CNC(=O)c1ncc(Br)cc1Cl 2177054731 OYFVLNJJAVWCEH-SECBINFHSA-N 426.580 4.675 50 10 IJGE Clc1ccc(C[C@]23CO[C@](CI)(C2)C3)c(Br)c1 2216260981 BXHPWJAPIJNEPP-BETUJISGSA-N 427.507 4.629 50 10 IJGE CC(C)[C@@H](CCl)N(Cc1ccccc1)C(=O)c1cc(Br)c(O)cc1O 2256018411 MUXNCOIKZVGQNG-MRXNPFEDSA-N 426.738 4.766 50 10 IJGE CCCC1(O[C@@H](CI)c2cccc(Br)c2)COC1 2260092200 OSRLSAYNGHNMLU-ZDUSSCGKSA-N 425.104 4.511 50 10 IJGE COc1ccc([C@H](Br)C(C)(C)[C@@H]2CCCO2)cc1I 2269555010 ZEQOZRJXQRRLRE-KBPBESRZSA-N 439.131 4.941 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1cc(Br)c(F)cc1Cl 2285958173 OYUWFZSYZGCDAP-MRVPVSSYSA-N 447.595 4.878 50 10 IJGE FC1(F)CC[C@@H]1CO[C@H](CI)c1ccc(Br)cc1 2313734620 YKYCLKCTVCZGEU-ZYHUDNBSSA-N 431.058 4.987 50 10 IJGE Cc1cccc(NC(=O)COc2ccc(C=C(C#N)c3nc(O)c4ccccc4n3)cc2)c1 2314434018 ZXYSROAXKVHFIO-UHFFFAOYSA-N 436.471 4.726 50 10 IJGE CNC(=O)C(C#N)=C1S[C@H](Cc2ccc(C(C)C)cc2)C(=O)N1c1ccc(C)c(C)c1 2314593854 UWXZJTWEJZXHRD-JOCHJYFZSA-N 433.577 4.599 50 10 IJGE CCOc1ccc(N2C(=O)[C@H](CC)SC2=C(C#N)C(=O)N[C@@H](C)c2ccccc2)cc1 2314594061 YICHTOFEFGIBLM-KKSFZXQISA-N 435.549 4.556 50 10 IJGE O=C(C=Cc1cccc(F)c1)NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21 2326843830 URJFKQIBDGGVRS-UHFFFAOYSA-N 433.870 4.560 50 10 IJGE Cc1cccc(CO[C@H](CI)c2ccccc2Br)n1 2341907735 JBIFQFLEYHFZCO-OAHLLOKOSA-N 432.099 4.845 50 10 IJGE Cc1nsc(Br)c1-n1c(CCl)nc2c(C)c(Br)cnc21 2380352104 RNVWMNQGISMVCJ-UHFFFAOYSA-N 436.560 4.758 50 10 IJGE CCCCCCOc1ccc(Br)cc1C(=O)NNC(=O)c1cccs1 14648277 WXKIQXFBEHXRSR-UHFFFAOYSA-N 425.348 4.545 50 10 IJGE Cc1ccc(NC(=O)COc2cccc(C=NNC(=O)c3ccc(Cl)cc3)c2)cc1C 15018765 KMXKHIPTJQNSJQ-UHFFFAOYSA-N 435.911 4.738 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccc([N+](=O)[O-])cc3)ccc2[C@@H]1c1ccccc1Cl 38651004 YGMLTEXEANCFOX-NRFANRHFSA-N 447.834 4.686 50 10 IJGE COc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3ccc(C)cc3C)c(C)c21 40813130 NWGSUIRMCGBECL-VFCFBJKWSA-N 445.519 4.936 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)NCc2ccco2)ccc1OC(=O)c1ccc(C)c(C)c1 40926513 REZIWKRBWULCHP-FYJGNVAPSA-N 444.487 4.738 50 10 IJGE COC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)Nc3nc4ccccc4s3)o2)cc1 102443559 YYGRYTFUQVCEFI-VBKFSLOCSA-N 429.457 4.889 50 10 IJGE CC(C)(C)OCCO[C@H](CI)c1cccc(Br)c1 162577287 JIBMRWRKPZUKQJ-CYBMUJFWSA-N 427.120 4.757 50 10 IJGE C[C@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2Br)CC[C@H]1Br 167754551 MNMZEMUHLNUMDD-GZMMTYOYSA-N 429.074 4.713 50 10 IJGE O=C(N[C@@H]1CCC[C@H]1CBr)c1cc(Br)c(Br)s1 231556862 BYOAUSRPWDLGPC-POYBYMJQSA-N 446.002 4.567 50 10 IJGE CO[C@@H](CO[C@@H](CI)c1ccc(Br)cc1)C(C)C 311065261 KYGBQYIMHJPQCY-KBPBESRZSA-N 427.120 4.613 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC2CCCCCC2)C1 685992981 ZCWJADVYMUEQKE-SFHVURJKSA-N 437.362 4.931 50 10 IJGE O=C(NNc1cccc(F)c1F)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1 743722012 PMCDZDGSLQCEHO-UHFFFAOYSA-N 439.506 4.554 50 10 IJGE CC(C)(C)n1nc(-c2ccccc2)cc1NC(=O)C(=O)NNc1cc(Cl)cc(Cl)c1 792440725 DENZELDBWBBQDM-UHFFFAOYSA-N 446.338 4.694 50 10 IJGE Cc1ccc(OCc2nc(CC(=O)NNc3ccc(C#N)cc3C(F)(F)F)cs2)cc1 799751599 QIFPRZOMMCWGHT-UHFFFAOYSA-N 446.454 4.607 50 10 IJGE CC(=O)c1nc(NC(=O)NNc2cc(C(F)(F)F)ccc2Br)sc1C 1624969365 AIDYZUCLNHGPFU-UHFFFAOYSA-N 437.241 4.584 50 10 IJGE Cc1c(C(=O)NC2CCCCC2)oc2c1C(=NNC(=O)c1ccccc1Cl)CCC2 1772743781 IKMXKBNGOBGRFA-UHFFFAOYSA-N 427.932 4.774 50 10 IJGE Cc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@H](c1cccc(F)c1)C(C#N)=C(N)O2 1865707923 JMMYFCYVHVIJAO-LJQANCHMSA-N 429.282 4.904 50 10 IJGE COc1cc(/C=C(\C#N)c2ccccc2[N+](=O)[O-])ccc1OCC(=O)Nc1ccc(C)cc1 1872729389 HLIKXFOZVSDTII-CPNJWEJPSA-N 443.459 4.994 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC[C@@H]2C[C@H]2C2CCC2)C1 1910846962 VWEQBDSRTYGLNK-TXPKVOOTSA-N 449.373 4.644 50 10 IJGE CC(C)(C)OC(=O)N1CC2(CCC3(CC2)CC[C@](C)(CI)O3)C1 1923328285 ZETBAWORKKPHIJ-MRXNPFEDSA-N 435.346 4.540 50 10 IJGE CCn1cc(Br)c([C@H](Br)c2sccc2Br)n1 1985209359 JIYQQFQVSMXSPH-QMMMGPOBSA-N 428.975 4.974 50 10 IJGE CCCN1C[C@@H](Br)[C@@H](Cc2cccc(Br)c2Br)C1 2039263862 ZJLKQCDWTYFAJR-WCQYABFASA-N 440.017 4.859 50 10 IJGE CCCN(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@@H](Br)C(F)(F)F 2044704572 DQYBIEPCVASWSE-ZIAGYGMSSA-N 431.337 4.671 50 10 IJGE CCOC(=O)Nc1sccc1C=C(C#N)S(=O)(=O)c1ccc(OC(F)(F)F)cc1 2053542062 SVOMNTNYQOHZQG-UHFFFAOYSA-N 446.428 4.553 50 10 IJGE CCN(CC)c1ccc(C=C(C#N)C(=O)Nc2ccccc2I)cc1 2053612842 QSDSEAMAEPWQTK-UHFFFAOYSA-N 445.304 4.683 50 10 IJGE CN(C[C@H](Br)C(F)(F)F)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 2076788292 RHSHCDXMDJSETD-KBPBESRZSA-N 425.289 4.510 50 10 IJGE O=[N+]([O-])c1c(CBr)nn(-c2c(F)cccc2C(F)(F)F)c1C(F)(F)F 2079144433 AABFSOMESDONQM-UHFFFAOYSA-N 436.081 4.852 50 10 IJGE CN(C[C@]1(Br)CC1(F)F)c1ccc(CBr)cc1Br 2082521152 BYGZFXLYPOHSPS-LLVKDONJSA-N 447.943 4.953 50 10 IJGE FC1(F)[C@@H]2COC[C@@]21[C@@H](Br)c1ccc(Br)cc1Br 2083331239 XDUYFOWUOBZVPV-VWYCJHECSA-N 446.911 4.929 50 10 IJGE Cc1cc([C@H](Br)c2ncn3ccsc23)ccc1I 2086024796 WZSCOFFOTFXJAB-NSHDSACASA-N 433.112 4.793 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C 2106786235 SYUHZSHASIKCQD-CEXWTWQISA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)C(C)(C)C)C[C@H]1CC(F)(F)F 2119512313 FQUFTGVCMNRECR-ZIAGYGMSSA-N 445.364 4.917 50 10 IJGE COC1(C(F)(F)F)CC(C(=O)N(Cc2ccccc2)[C@@H](CBr)C2CC2)C1 2125552813 BFZDENBCTCHFBJ-PQUAAJSLSA-N 434.296 4.546 50 10 IJGE Clc1ccc(N2CC[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c(CBr)c1 2129059166 YJQLHRCYMCVORV-NHCUHLMSSA-N 435.793 4.715 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@H](Br)C1CCS(=O)(=O)CC1 2137657120 RSSOIERHCYBZEF-CYBMUJFWSA-N 430.589 4.672 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@@]2(CCN(C(=O)OC(C)(C)C)C2)C1 2163058346 JWGRYNRYQCRDHQ-NRFANRHFSA-N 447.458 4.680 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2N1C(=O)OC(C)(C)C 2196913236 CNCQUVONXAFDIT-SFFUCWETSA-N 443.426 4.577 50 10 IJGE CN(C[C@@H](Br)C1CCCCC1)C[C@@H]1CC1(Br)Br 2213093871 HQMKAHHDCRYMHN-NWDGAFQWSA-N 432.038 4.768 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@@H]2CCC[C@H](C1)C2Br 2264508086 YGRLDWCWLCBTCY-JWHQNHQBSA-N 427.589 4.800 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC2C[C@H]3CC[C@H](C2)C3)CC1 2299546449 AQCXOLHURUDJPK-GJZGRUSLSA-N 449.373 4.786 50 10 IJGE C[C@H](Br)[C@H]1CCCN1Cc1cc(I)ccc1Cl 2307320781 WIMCSEBZMSAEAV-TVQRCGJNSA-N 428.539 4.692 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@H](CCBr)C1 2307322365 NGBCYBAKXRJNGX-JTQLQIEISA-N 428.539 4.552 50 10 IJGE CCOc1cc(C=NNC(=O)Cc2ccc(O)cc2)ccc1OCc1cc(C)ccc1C 2318414705 GDXZYOYKUJXHDE-UHFFFAOYSA-N 432.520 4.680 50 10 IJGE ClC[C@@H]1CCN(Cc2ccc(I)c(Br)c2)C12CC2 2325208995 KKJPXPHUOFKZIW-NSHDSACASA-N 440.550 4.647 50 10 IJGE CC1(CCl)CCN(Cc2ccc(I)c(Br)c2)CC1 2325212030 BTFBOWDLSSQYAP-UHFFFAOYSA-N 442.566 4.895 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3CC[C@H]2[C@@H](Br)C3)c1 2325604706 GCIJJCBVXIXSQO-WFBYXXMGSA-N 440.550 4.692 50 10 IJGE CCCN(C[C@]1(CBr)CC1(F)F)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2326918530 AEICGJDQWJKPAB-WMLDXEAASA-N 425.358 4.518 50 10 IJGE CC(C)(C)OC(=O)NCCCC[S@@](C)(=O)=NC[C@@](C)(CBr)C(C)(C)C 2327074982 CXMQEZNRPJUTBE-IQGLISFBSA-N 441.476 4.836 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc(C)cc2)sc(C(=O)OC(C)C)c1C 2329632790 XIRKORSTYRTIJU-UHFFFAOYSA-N 440.521 4.653 50 10 IJGE FC(F)(CCl)C(F)(F)CNCc1cc(Br)ccc1Br 2336542784 BIHUARVAQASVEF-UHFFFAOYSA-N 427.461 4.811 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCCN1C[C@@]1(CBr)CC1(F)F 2351886719 CZQFAQABKVBZLE-DAYGRLMNSA-N 437.369 4.661 50 10 IJGE N#C/C(=C/c1c(N2CCCCCC2)nc2ccccn2c1=O)c1nc2ccccc2s1 33916916 FZSWAOBSLFBBMX-ICFOKQHNSA-N 427.533 4.749 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Br)c3cc(Cl)ccc3F)cc2[nH]1 109884266 YOACKFPBLISOIB-CYBMUJFWSA-N 434.490 4.896 50 10 IJGE BrCC[C@H]1CCCCN1c1ncc(Br)cc1Br 129134764 LZFQJNNQTQGFLX-SNVBAGLBSA-N 426.978 4.751 50 10 IJGE CC(C)(CCBr)CNC(=O)c1cc(Br)c(Br)s1 227907705 FNVYHPZCTOQWND-UHFFFAOYSA-N 448.018 4.814 50 10 IJGE Brc1cc([C@@H]2CCC[C@H](CI)O2)oc1Br 306180384 JLXIVQSLWAROJR-SVRRBLITSA-N 449.908 4.850 50 10 IJGE C[C@@H]([C@H](Br)c1cc(I)cc2c1OCC2)C(C)(F)F 385681709 CSQPCJXJIDQDLK-CPCISQLKSA-N 431.058 4.953 50 10 IJGE C[C@H](Br)C[C@@H](C)CNC(=O)c1cc(Br)sc1Br 397721928 KLDKMGLDHXFPLJ-RQJHMYQMSA-N 448.018 4.813 50 10 IJGE ClCc1nc2cc(Br)cnc2n1C1[C@H]2C[C@H]1CN(Cc1ccccc1)C2 399632228 XKKXNGUTXMEVNB-GJZGRUSLSA-N 431.765 4.626 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@@H](C)c3nc(C)cs3)c3ccccc3n2)cc1 727942280 BHISBNNQELZTSI-INIZCTEOSA-N 445.548 4.680 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2CC[C@H](c3cccc(F)c3)C2)c(-c2ccccc2)n1 729444721 BDVKSNBVSFCWGU-ODLJZMMESA-N 439.494 4.526 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCc2cc(Cl)ccc2OCC#N)c1C 735333368 YROHSDKIMGSFRR-MWJIIQFGSA-N 441.915 4.519 50 10 IJGE Cc1ccccc1NC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 798313382 YAPVOFINDOWZLK-UHFFFAOYSA-N 445.454 4.681 50 10 IJGE C[C@H]1CCCCN1CCOc1ccccc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799750539 HTRAZFQSHFUPLF-INIZCTEOSA-N 446.473 4.587 50 10 IJGE CN(C)C(=O)/C(C#N)=C/c1cc(Cl)c(OCc2ccccc2C#N)c(Br)c1 1084441588 LGMUFAOPUYPBER-FRKPEAEDSA-N 444.716 4.548 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNc1cc(Br)ccc1F 1646194077 PVQBLCZSMCLDFP-UHFFFAOYSA-N 433.199 4.929 50 10 IJGE CCCc1nn(CC(C)C)c2c1[C@@H](c1cc(Br)ccc1F)C(C#N)=C(N)O2 1865702214 PMYKOWNTMGQPNK-KRWDZBQOSA-N 433.325 4.611 50 10 IJGE CN(C[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)OC(C)(C)C 1880766273 GHKSRDNVBMCJQR-ZIAGYGMSSA-N 437.419 4.804 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2[C@@H]3CCOC[C@H]32)s1 1900919365 MNEKBUOHAYFTHB-SXILTZBTSA-N 433.536 4.725 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Cl)CCc1ccc(Cl)c(Br)c1 1905406420 SLMREMKDSWUGEL-GFCCVEGCSA-N 427.125 4.939 50 10 IJGE CN(Cc1nn(C)cc1Br)c1ccc(F)c(Cl)c1CBr 1912463527 GBZGOSMLYPYWKQ-UHFFFAOYSA-N 425.527 4.506 50 10 IJGE Cc1ncc(Br)c(N(Cc2ccccc2)[C@@H](CBr)C2CC2)n1 1915193293 LVCUPURGCHZHDN-INIZCTEOSA-N 425.168 4.728 50 10 IJGE CC(C)[C@@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1 1915275912 ITSYXDZEGNTFGK-GOSISDBHSA-N 430.795 4.903 50 10 IJGE Cc1nc(N(Cc2ccccc2)[C@@H](CBr)C(C)C)ncc1Br 1915328957 LRAOKPPAVWRTTE-INIZCTEOSA-N 427.184 4.974 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1nccc(C)c1Br 1927120363 BLLBIUDFGLUYAP-HNNXBMFYSA-N 440.179 4.968 50 10 IJGE CC(C)[C@@H](Br)CCNC(=O)c1csc(Br)c1Br 1945189156 KDAWIXFQSASYJY-QMMMGPOBSA-N 448.018 4.813 50 10 IJGE CC[C@@H](C[C@H](C)Br)NC(=O)c1cccc(Br)c1Br 2031478973 UUQPBYDPJBXGJL-IUCAKERBSA-N 441.989 4.894 50 10 IJGE CCC[C@@H](CBr)CN1CCC[C@H](N(CC(F)F)C(=O)OC(C)(C)C)C1 2044699109 HYUNENMNPYNHKQ-GJZGRUSLSA-N 427.374 4.764 50 10 IJGE CCC[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](CC(F)(F)F)C1 2055949142 RYWDPEYSSGBSRT-ZIAGYGMSSA-N 431.337 4.671 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Cl)c1cnn(C)c1Br 2138243781 WIWMFNAPWODCTH-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE CN(C(=O)c1ccc(Br)cc1Cl)[C@@H](CCBr)C(F)(F)F 2178515391 LMHOLYBNFMPRDV-JTQLQIEISA-N 437.481 4.890 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1cccc(C(F)(F)F)c1F 2181749732 XXVNZEBKTIFEBN-UHFFFAOYSA-N 428.517 4.840 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2Cc1csnc1Br 2184941027 NRGSWUAZDPPNKV-UHFFFAOYSA-N 436.560 4.508 50 10 IJGE C[C@@]1(CC(CBr)(CBr)c2cccc(F)c2)CSCCO1 2201227334 LZAMOXXVTVCKNM-CQSZACIVSA-N 426.189 4.766 50 10 IJGE BrCc1cc(Br)c(OCC[C@H]2CCO2)c(Br)c1 2253130842 VRKWSADIMDKIBD-SECBINFHSA-N 428.946 4.664 50 10 IJGE CCCN[C@@H](c1ccc(OC)c(I)c1)C1CC(Br)C1 2269589282 XNFLLBRMQBLSIG-QOZQQMKHSA-N 438.147 4.514 50 10 IJGE C[C@H](Br)[C@H](NC(=O)c1cc(Br)c(F)cc1Cl)C(F)(F)F 2285836053 WLYWSHRXRGSKTF-IGJIYHIXSA-N 441.444 4.686 50 10 IJGE CC[C@H](C[C@@H](C)Br)NCc1ccc(Cl)cc1I 2302326440 PHYVGFMWJINROM-BXKDBHETSA-N 430.555 4.986 50 10 IJGE C[C@H]1[C@H](CBr)CCN1Cc1cc(I)ccc1Cl 2307327539 BTQMMOLYAIEKEE-UWVGGRQHSA-N 428.539 4.550 50 10 IJGE CCOc1ccc(C=C2C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)cc1OCC 2314616814 KGXSXTDLGMMZPW-UHFFFAOYSA-N 430.504 4.585 50 10 IJGE CCOc1cc(C=C2C(=O)N(Cc3ccccc3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 2314618821 UWVUOTVAEFBLAR-UHFFFAOYSA-N 444.531 4.913 50 10 IJGE O=S(=O)(CCCN(Cc1ccccc1)[C@@H](CBr)C1CC1)c1ccccc1 2343341509 LBHBQQHEDAISBZ-NRFANRHFSA-N 436.415 4.526 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C)CN(CC2(CBr)CCCCC2)CC1(F)F 2351582341 QITREANWCIHFTL-KRWDZBQOSA-N 439.385 4.814 50 10 IJGE O=C(CCC(=O)Nc1ccccc1Cl)N/N=C/c1ccccc1OCc1ccccc1 12579840 MCHHLHQWTKORPI-WGOQTCKBSA-N 435.911 4.788 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc(OC)c1OC 28355517 CYBAZHLGUVKZDZ-WUXMJOGZSA-N 440.805 4.930 50 10 IJGE Cc1ccccc1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cccc(Cl)c1 38651156 GLFQXQFOEGTLRG-DEOSSOPVSA-N 446.890 4.851 50 10 IJGE CC(C)c1ccc(Oc2ncnc(NNC(=O)c3ccccc3Cl)c2[N+](=O)[O-])cc1 40611042 XWMSWYHOLFZYKI-UHFFFAOYSA-N 427.848 4.711 50 10 IJGE CCOc1cc(/C=C2\C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 214319467 GQAFHVWNXNWRII-JAIQZWGSSA-N 434.492 4.506 50 10 IJGE C[C@H](Br)[C@H]1CCN(C(=O)c2cc(Br)sc2Br)C1 719965770 CBXNUAWTXBTBSE-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE CC(=O)N(c1ccc(C)cc1)c1nc(C=NNC(=O)CCCc2cccs2)cs1 732529189 COIOOUUSVSSGOE-UHFFFAOYSA-N 426.567 4.671 50 10 IJGE O=C(CNc1cccc(N2CCCC2=O)c1)NN=Cc1c2ccccc2cc2ccccc12 1084019510 HTDZWXSKNQPTGO-UHFFFAOYSA-N 436.515 4.682 50 10 IJGE O=C(NN=Cc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc(OCc2ccccc2)cc1 1084202872 CMVJYRPYBYJGFL-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE CCCCC(CC)=NNC(=O)COc1c(C)cc(Br)cc1Br 1084216781 CUNLTUJBVQAXRX-UHFFFAOYSA-N 434.172 4.971 50 10 IJGE C=C[C@@H](CC(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(C)c1C)c1ccccc1 1136795159 IERXISMDQQJFSE-FQEVSTJZSA-N 438.531 4.806 50 10 IJGE C=CC1(CC(=O)NNc2ccc(Cl)c(C(F)(F)F)c2)CN(C(=O)OC(C)(C)C)C1 1583799086 NZIZZTJZKVAHEH-UHFFFAOYSA-N 433.858 4.615 50 10 IJGE Cc1ccc2c(c1)C(=NNC(=O)COc1ccc(Cl)cc1Cl)C(=O)N2CCC(C)C 1772720934 XLHONZJHRNTYOX-UHFFFAOYSA-N 448.350 4.594 50 10 IJGE Cc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2Cc1ccccc1F 1865713154 SAHBXQFUCYJHRO-KRWDZBQOSA-N 428.389 4.616 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)Cc3ccc(NC(C)=O)cc3)n2)c(OC)c1 1872755176 BNOGCHVEQGUEAO-VZCXRCSSSA-N 435.505 4.821 50 10 IJGE C[C@H]([C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1)[C@@H](CBr)NC(=O)OC(C)(C)C 1884025676 GLUDYOZOFOXJDC-KLHDSHLOSA-N 449.430 4.994 50 10 IJGE Cc1ccc(Br)c(C(=O)N(Cc2ccccc2)C[C@@H](C)Br)n1 1961084534 YWXLZEVHNYOEDP-GFCCVEGCSA-N 426.152 4.578 50 10 IJGE Cc1cc(Br)ccc1CNCCSSCCNC(=O)OC(C)(C)C 2010827058 LMIAZMKERSSEDQ-UHFFFAOYSA-N 435.453 4.753 50 10 IJGE Br[C@@H](Cc1ccc2c(c1)CCO2)c1csc(I)c1 2049594798 CVLVNLOMKCAQEQ-LBPRGKRZSA-N 435.124 4.966 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)c1cc(Cl)cc(NC(=O)OC(C)(C)C)c1 2076212728 FUGYVSZFVIPQPB-BJHJDKERSA-N 431.758 4.933 50 10 IJGE ClCc1nc2cc(I)ccc2n1C[C@H]1C[C@@H](Br)C1 2076266480 WDPRFYLUBOWVSF-DTORHVGOSA-N 439.522 4.553 50 10 IJGE CN(C[C@H]1CCCCN1C[C@@H](CBr)c1ccccc1)C(=O)OC(C)(C)C 2106782101 NWRZSTADIMWZRY-RTBURBONSA-N 425.411 4.887 50 10 IJGE COc1cc(F)c(Br)cc1[C@@H](Cl)c1nn(C)c(Br)c1C 2168215720 MWQWFRZDNXMILW-LLVKDONJSA-N 426.511 4.729 50 10 IJGE COCc1cc(Br)c([C@H](Br)[C@@H]2C[C@H](OC)[C@H](OC)C2)s1 2174904395 VMULKBAXOGEDML-GHORINQJSA-N 428.186 4.533 50 10 IJGE Cc1sc([C@H](Br)[C@]23CCC[C@H]2CS(=O)(=O)C3)c(C)c1Br 2201882903 QTONSBQCEUFFMI-BPNCWPANSA-N 442.238 4.778 50 10 IJGE CCn1cc([C@H](Br)c2cc(Cl)c(F)cc2OC)nc1Br 2207359588 IRPUNVHPLGYSPJ-GFCCVEGCSA-N 426.511 4.951 50 10 IJGE CCOCc1cc(Br)c([C@H](Br)[C@@H]2OCCOC2(C)C)s1 2233019562 PGDYGBOHWJYZBA-AAEUAGOBSA-N 428.186 4.677 50 10 IJGE Cc1ccc([C@@H](CBr)OCCOCCOCCOCc2ccccc2)cc1 2236087965 AXKBOMJZKNTCSQ-JOCHJYFZSA-N 437.374 4.698 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2CCC[C@H](C1)[C@@]21CCC[C@H](CI)O1 2249353377 DJXQVCSPTYMESE-TVEAVKIZSA-N 449.373 4.833 50 10 IJGE CC(C)CN(C[C@H](C)Cl)c1ncc(I)cc1Br 2250503798 MAHKTNFORBCIGJ-VIFPVBQESA-N 431.543 4.538 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1C(=O)c1csc(Br)c1Br 2251003578 PSLRLSGXKIZOCA-JGVFFNPUSA-N 446.002 4.661 50 10 IJGE CC1(CBr)CCN(C(=O)c2cc(F)c(Br)cc2Cl)CC1 2282979170 WKGMEFHMWPVCLX-UHFFFAOYSA-N 427.539 4.879 50 10 IJGE CC(C)[C@@H]1[C@H](Br)CCN1C(=O)c1cc(Br)c(F)cc1Cl 2285846817 SIAPUQAAFVJCRD-NOZJJQNGSA-N 427.539 4.876 50 10 IJGE CC1(C)CC[C@@H](CBr)N(Cc2sccc2I)C1 2301074883 WXBSRNTXOUWIEG-JTQLQIEISA-N 428.177 4.738 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C2CCC3(CC2)CC[C@@H](CI)O3)C1 2307683652 NJULSESTESUHLM-BHEGOAEISA-N 449.373 4.786 50 10 IJGE N#CC(=Cc1ccc(OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1)c1ccccc1F 2320507021 WZZQXOBAOQUPLG-UHFFFAOYSA-N 433.351 4.925 50 10 IJGE ClCc1ccc(Br)c(Cl)c1N1CC(n2cc(Br)cn2)C1 2361655114 UHLRFAKUWZIGJF-UHFFFAOYSA-N 439.966 4.862 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@@H](Cl)[C@H]1COC2(CCC2)CO1 2364176996 ZYGAGDOPVOCRCH-CHWSQXEVSA-N 428.523 4.969 50 10 IJGE CN(CC[C@H](Br)c1cccs1)Cc1nn(C)c(Cl)c1Br 2365979348 ATWVAZBNMSRRTJ-VIFPVBQESA-N 441.620 4.856 50 10 IJGE FC(F)(F)[C@H]1C[C@@]1(CCl)CNCc1ccc(Cl)cc1I 2366715527 QVORCVSMOYJSNL-NWDGAFQWSA-N 438.058 4.842 50 10 IJGE N#CC1=C2N=C(N)c3ccccc3N2C2=C(C(=O)CCC2)[C@H]1c1cccc(Br)c1 2500590 SMSGKNKAABPRAN-FQEVSTJZSA-N 445.320 4.514 50 10 IJGE Cc1ccc(C(=O)Oc2ccc(Br)cc2/C=N\NC(=O)c2ccccc2)cc1 33781847 UVNXLSFDZJKFQS-OYKKKHCWSA-N 437.293 4.741 50 10 IJGE O=C(NCC1(CCBr)CC1)c1ccc(Br)c(C(F)(F)F)c1 97907998 WEPOBFLEAASZFY-UHFFFAOYSA-N 429.074 4.763 50 10 IJGE C[C@@H]1CN(C(=O)c2ccc(Br)c(C(F)(F)F)c2)CC[C@H]1Br 167753560 YXDZJCVAIVJALK-LDYMZIIASA-N 429.074 4.713 50 10 IJGE CC[C@@H]1CCCCN1/C=C(/C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 216497829 AWXWFHVZAFSZBD-XIYFGJGBSA-N 442.607 4.592 50 10 IJGE CC(=NNC(=O)/C(=C/C(C)=C/c1ccccc1)NC(=O)c1ccccc1)c1ccccc1O 252610354 IAVPMFYZZSHZEZ-SXNDIXHQSA-N 439.515 4.650 50 10 IJGE CC(=NNC(=O)c1cc(-c2cccc([N+](=O)[O-])c2)n[nH]1)c1ccc(-c2ccccc2)cc1 254398948 RLAZHYJGPCGRHA-UHFFFAOYSA-N 425.448 4.806 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CCC[C@H]1CCBr 306078318 HEVMLFSXAMGNOO-JTQLQIEISA-N 439.973 4.601 50 10 IJGE Cc1cc([C@H](Br)c2cnn(C)c2Br)sc1Br 382220999 ZMMRIHVKLJIWPZ-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE CC1CCC(O[C@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)CC1 685992973 OBTBSYXVSLBDLP-JMLCCBQJSA-N 437.362 4.786 50 10 IJGE CC(C)(CBr)CCNC(=O)c1scc(Br)c1Br 705440394 ZWNZRWXHFOADMR-UHFFFAOYSA-N 448.018 4.814 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2CC[C@]3(CCC[C@@H](CI)O3)[C@H]1C2 721763090 SNUUCJRAYQEFJU-BASYENTBSA-N 435.346 4.539 50 10 IJGE Cc1cc(-c2ccccc2)ccc1NC(=O)C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799840544 MKHULJVQOCKKOK-UHFFFAOYSA-N 438.409 4.634 50 10 IJGE CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NNc1nc(-c2cccnc2)nc(C)c1C 806888969 VWANQKTXUAKJFZ-KRWDZBQOSA-N 443.473 4.886 50 10 IJGE Cc1cc(C=NNC(=O)C(=O)Nc2ccccc2F)c(C)n1-c1cc(Cl)cc(Cl)c1 1083911096 STSGMYYPOUGHEV-UHFFFAOYSA-N 447.297 4.629 50 10 IJGE C=CCCC[C@H](C(=O)NNc1cc(C(=O)OC)ccc1Br)c1ccccc1 1468499741 BCFHNTVIIARQQU-KRWDZBQOSA-N 431.330 4.819 50 10 IJGE BrC[C@@H](CN1CCc2nc[nH]c2[C@@H]1c1ccc(Br)cc1)C1CC1 1660254933 LYKWDHALISAPTQ-KSSFIOAISA-N 439.195 4.541 50 10 IJGE COc1ccc(/C(C)=N/NC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)c(OC)c1 1865763699 YYWQGEOIDAXVLP-MZJWZYIUSA-N 425.435 4.506 50 10 IJGE COc1ccc(Cl)cc1N1C[C@@H](/C(O)=C(\C#N)c2nc(C(C)(C)C)cs2)CC1=O 1872748937 TVCVEALVPCFDEN-DSVMPHHWSA-N 431.945 4.948 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@@]23CC[C@@H](CI)O3)C1 1939507018 RURZTYCNAZCZCT-BMGDILEWSA-N 435.346 4.540 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1Cc1cccc(Br)c1Br 1943881056 NEJLYMLDUOIXGY-KOLCDFICSA-N 425.990 4.959 50 10 IJGE CN(CC(C)(C)CBr)C(=O)c1cc(Br)c(Br)s1 1945727779 CIQDKLZXFZYOOF-UHFFFAOYSA-N 448.018 4.766 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CCC[C@@H](CI)O2)C12CCC2 1991821662 SROLOEFCGUGCDQ-KBXCAEBGSA-N 435.346 4.683 50 10 IJGE ClC[C@H]1CCC[C@H](Nc2ncc(I)cc2Br)C1 2015756766 KNBBZGZARIHSLV-WPRPVWTQSA-N 429.527 4.658 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1cc(Br)sc1Br 2023037251 IUGWOKGGXDRCRD-HTRCEHHLSA-N 448.018 4.813 50 10 IJGE Cc1cc([C@@H](Br)c2ccsc2S(C)(=O)=O)sc1Br 2033133949 AJOFCXZJESEUJQ-VIFPVBQESA-N 430.208 4.768 50 10 IJGE CCC[C@H](CBr)CN=[S@@](C)(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C 2044706541 VCXXDWVGGNPTLD-XGZNKIABSA-N 441.476 4.835 50 10 IJGE BrC[C@H]1CCN(c2ncc(Br)cc2Br)C12CCC2 2070107290 TYCSXNVQOFITEJ-SECBINFHSA-N 438.989 4.751 50 10 IJGE F[C@@]1(CBr)CCCN(Cc2ccc(I)c(Cl)c2)C1 2086660646 GMNXSSYZWITEAE-CYBMUJFWSA-N 446.529 4.644 50 10 IJGE CC(C)(C)OC(=O)N1CCCc2ccc(NC(=O)CCCCBr)cc2C1 2106303607 WLCRULZLCBZPMS-UHFFFAOYSA-N 425.367 4.874 50 10 IJGE O=S(=O)(Nc1cccc(CCCBr)c1)c1cscc1Br 2143914128 NLGZDROIIMDCMS-UHFFFAOYSA-N 439.194 4.639 50 10 IJGE O=C(NC[C@]12CC[C@@H]1CCCN2CC1(CBr)CCCCCC1)C(F)(F)F 2163059776 WHRVKECWQYAVCE-MAUKXSAKSA-N 439.360 4.645 50 10 IJGE CC(C)(C)[C@@H]1[C@H](Cl)CCN1C(=O)c1cc(Cl)ccc1I 2185112378 AZRUBZUHTQBBIE-YPMHNXCESA-N 426.125 4.813 50 10 IJGE Cc1cc(Br)c([C@@H](Br)C2(S(C)(=O)=O)CC2)c(C)c1Cl 2224316187 BCLAUGDTJMSDJS-GFCCVEGCSA-N 430.589 4.733 50 10 IJGE N#CC(=CNc1ccc(C(N)=O)cc1)c1nc(-c2cccc(Br)c2)cs1 2296790018 JPNNJRLQQNOBTB-UHFFFAOYSA-N 425.311 4.648 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)c(I)c2)C[C@@H]1Br 2300238228 IIXLXNVEDIYESZ-LBPRGKRZSA-N 428.539 4.550 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](O)[C@H]1C[C@H](Br)C1 2301506905 CFGPTMKCKVGBTD-NQYJQULFSA-N 430.937 4.866 50 10 IJGE C=CC[C@H](Br)[C@@H]1CCN1Cc1ccc(I)c(Cl)c1 2314255348 SXHICLSCQXDKQW-FZMZJTMJSA-N 440.550 4.859 50 10 IJGE CC[C@H](C)N(CCBr)C(=O)c1ccc(Cl)cc1I 2317765639 HAJYWYRQMQZFFP-VIFPVBQESA-N 444.538 4.580 50 10 IJGE COc1cc(C=C(C#N)c2ccccc2OC)ccc1OC(=O)c1ccc2c(c1)OCO2 2320506613 NEYFKKZYIXSPKM-UHFFFAOYSA-N 429.428 4.716 50 10 IJGE CCOc1ccc(C=CC(=O)NNC(=O)c2ccc(-c3ccc(C)c(C)c3)nc2C)cc1 2321103738 UFGKIHCLDBUCPG-UHFFFAOYSA-N 429.520 4.547 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC=C(C#N)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 2325205763 PLWDYXJSNAZNEN-CQSZACIVSA-N 428.876 4.652 50 10 IJGE CC1(C)[C@@H](CBr)CCN1Cc1cc(I)ccc1Cl 2327393256 TUDNHPYGTIOIFH-LLVKDONJSA-N 442.566 4.940 50 10 IJGE Cn1c(C(C#N)=Cc2cc(Br)c(O)c(Br)c2O)nc2ccccc21 2331019670 KNWDZATYMWXAIU-UHFFFAOYSA-N 449.102 4.574 50 10 IJGE CN(C)c1ccc(C(O)=C(C#N)c2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1[N+](=O)[O-] 2331236631 OJGVBIXIAUUQGS-UHFFFAOYSA-N 437.437 4.642 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)CNC(=O)c3ccccc3)n2)cc1Cl 2331399554 WYFGDUICPVGWLE-UHFFFAOYSA-N 425.897 4.695 50 10 IJGE Cc1c(Cl)cccc1Nc1ncnc(NNC(=O)c2ccccc2Cl)c1[N+](=O)[O-] 40588514 GTTTXFFLTZDBRE-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE FC(F)(F)[C@H](Br)COc1ccc(Br)cc1Br 96835006 LGPFIONHYYNJQI-MRVPVSSYSA-N 426.852 4.916 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C3\C(=O)N(C4CCCC4)C(=O)C(C#N)=C3C)o2)cc1 214360474 WEGDJQUPXWHXAY-STZFKDTASA-N 444.487 4.658 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1cccc([C@@H]2CN(S(=O)(=O)c3ccccc3)CCN2)c1 616604609 XLJKMFADMJXINW-QFIPXVFZSA-N 446.689 4.544 50 10 IJGE CN(C(=O)c1cc(I)ccc1Br)C(C)(C)CCCl 688376038 DJYDIUNCFZHENQ-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE O=C(CSc1nnc(-c2ccco2)n1C1CCCCC1)NNc1ccccc1Cl 748303911 WSRGKIDWOKAPHX-UHFFFAOYSA-N 431.949 4.932 50 10 IJGE CCc1cc(SC#N)cc(CC)c1NC(=O)CCCCN1C(=O)c2ccccc2C1=O 754530747 XHKCWMIZJJKIHS-UHFFFAOYSA-N 435.549 4.790 50 10 IJGE CO[C@H](C(=O)NN=Cc1cc(C)n(-c2ccc(Br)cc2)c1C)c1ccccc1 1084191787 QHWJTQHBFMQQBK-NRFANRHFSA-N 440.341 4.694 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)Nc2ccccc2OC)cc(Br)c1OCC 1084605063 GQBALXIVFLOXJH-GDNBJRDFSA-N 445.313 4.801 50 10 IJGE C#CCOc1ccc(CNC(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(Cl)c3)c2C)cc1 1436299793 BWYGBSLFARPTJF-HMAPJEAMSA-N 443.934 4.983 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C)c1ccc(C(F)(F)F)cc1 1624323820 OBRHYJRSDJLDFL-FYWRMAATSA-N 441.453 4.977 50 10 IJGE O=C(CCC(=O)c1ccccc1)NNC(=O)c1ccc(-c2ccc3ccccc3c2)s1 1860391569 OPKLDVPSVVUPBK-UHFFFAOYSA-N 428.513 4.992 50 10 IJGE N#C/C(=C\c1ccc(OC(=O)c2ccc(F)cc2)cc1)c1cc2c(cc1[N+](=O)[O-])OCCO2 1872728482 FCJHLLZFLAVXIM-GZTJUZNOSA-N 446.390 4.788 50 10 IJGE COc1ccc(C/C(O)=C(\C#N)c2nc(-c3ccc(OC)c(OC)c3OC)cs2)cc1 1872759775 ZIHWQXUKOFEVHZ-ZPHPHTNESA-N 438.505 4.880 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@@H](C(F)(F)CCl)C1 1892743796 JPOQPZQBWCVIPH-ZCFIWIBFSA-N 437.531 4.609 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)Cc1c(Br)cnn1CC 1915097885 ZWMZJBQKOKRXGR-OAHLLOKOSA-N 429.200 4.841 50 10 IJGE Cc1cc(Br)sc1[C@H](Br)c1cc(Br)n(C)n1 1939458947 QUDFKSOPNHRWOW-SECBINFHSA-N 428.975 4.799 50 10 IJGE CC[C@H](Br)[C@H](C)NC(=O)c1c(Br)cccc1Br 1945331487 SMUHMMRUGWMVCX-YUMQZZPRSA-N 427.962 4.503 50 10 IJGE CCN(C)C[C@H](Br)CCc1cccc(Br)c1Br 1949931810 VCMJXDPRDDDDFL-LLVKDONJSA-N 428.006 4.859 50 10 IJGE C[C@H](Cl)c1nnc(-c2ccc(Br)cc2I)s1 1995284439 DEFOXDVMRARRES-YFKPBYRVSA-N 429.508 4.872 50 10 IJGE C[C@H](Br)[C@H]1CCCN1Cc1c(Br)cccc1Br 2018114920 JXWPCVHTGKYFDE-TVQRCGJNSA-N 425.990 4.959 50 10 IJGE Brc1cnc(N2C[C@H](Br)C3(CCCC3)C2)c(Br)c1 2054049796 ICHXXORJWBIQHC-NSHDSACASA-N 438.989 4.751 50 10 IJGE CCOc1ccc(S(=O)(=O)N(Cc2ccccc2)C(C)C)cc1CBr 2059290019 WOUVVOBUONYKIW-UHFFFAOYSA-N 426.376 4.580 50 10 IJGE Cc1cccc(Cn2nc(CCl)c(I)c2C(F)(F)F)c1C 2079210967 FVRLNLOCUCPENR-UHFFFAOYSA-N 428.623 4.910 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Br)c2ccc(F)c(Br)c2)c1 2093074476 MFKIQYXKKLMPNL-LBPRGKRZSA-N 428.142 4.538 50 10 IJGE CCCN(C(=O)CCCCBr)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2106772113 CUTKPFCWSPOERW-SJPCQFCGSA-N 431.415 4.721 50 10 IJGE Cc1nc(N2C[C@@]34CCC[C@]3(CN(Cc3ccccc3)C4)C2)sc1CBr 2108213378 LIRGRYKNRSRQRM-SFTDATJTSA-N 432.431 4.839 50 10 IJGE Br[C@@H](Cc1ccc2c(c1)CCO2)c1ccccc1I 2112338286 KGWZQLIKBADUEX-AWEZNQCLSA-N 429.095 4.905 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCCC2)C[C@@H](CBr)CC2CC2)C1 2112868282 IHNHLSQHNWRLNO-GOSISDBHSA-N 429.443 4.909 50 10 IJGE O=[N+]([O-])c1ccc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c(CBr)c1 2163332624 CUGGEBARKBCHBE-OAQYLSRUSA-N 430.346 4.592 50 10 IJGE CC[C@@H](Br)C(=O)N[C@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1 2179674255 JRZZSAOXGCEXHH-QZTJIDSGSA-N 435.362 4.695 50 10 IJGE C[C@H]1CN(C(=O)OC(C)(C)C)c2ccccc2N1CCCCI 2243588752 GKFOXYDESQWGDJ-AWEZNQCLSA-N 430.330 4.852 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2Cc1ccn(Cc2ccccc2)n1 2286082666 AIQLVBVAZNWZIS-UHFFFAOYSA-N 445.748 4.839 50 10 IJGE CCC(CC)[C@@H](Cl)CNC(=O)Cc1cc(Br)cc(Br)c1 2295307328 IJKYHJKZTXWTAO-AWEZNQCLSA-N 425.592 4.914 50 10 IJGE COc1cccc(C=C(C#N)C(=O)Nc2ccc3c(c2)OCCO3)c1OCc1ccccc1 2295672687 RFXAKMHSBLINAO-UHFFFAOYSA-N 442.471 4.591 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2C[C@H]3O[C@H]2[C@H]2C[C@@H]23)s1 2300953535 KNSVWDFOLQYMSV-FUWZEQHRSA-N 445.547 4.866 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C2CCC3(CC2)CC[C@H](CI)O3)C1 2307683653 NJULSESTESUHLM-BWRBCVJASA-N 449.373 4.786 50 10 IJGE CC1=C(C#N)C(=O)N([C@@H](C)c2ccccc2)C(=O)C1=CNc1cccc(Br)c1 2314585690 MYSKRYPPLPCIJB-HNNXBMFYSA-N 436.309 4.715 50 10 IJGE CCCNC(=O)C(C#N)=Cc1ccc(OC(=O)CCc2ccc(C(C)C)cc2)c(OC)c1 2314790232 PNUMLJZPZBQGKS-UHFFFAOYSA-N 434.536 4.790 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc(C(F)(F)F)s1 2320359053 WZHURAOSFRJUMD-CYBMUJFWSA-N 436.293 4.867 50 10 IJGE Cc1sc(NC(=O)C(C#N)=Cc2ccccc2)nc1-c1ccc2c(c1)CCCC(=O)N2 2320934151 ZJKROZGQBNICCX-UHFFFAOYSA-N 428.517 4.939 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@H]([C@@H]3CCCN3C(=O)OC(C)(C)C)C2)C1 2345009658 GEHYMNCPDVBZIJ-SJORKVTESA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CCN(C[C@@H](CBr)c3ccccc3)C[C@H]21 2361359786 DOZGHCKPDULXKU-VAMGGRTRSA-N 437.422 4.887 50 10 IJGE Cc1cc(Br)c(C(=O)N2CCC[C@@H](Br)[C@H]2C(F)(F)F)s1 2370262503 WOFXBGKCYMFIKD-XCBNKYQSSA-N 435.103 4.749 50 10 IJGE CN(CC1CC(Br)C1)[C@]1(C(=O)O)CCC(C)(C)C[C@@H]1OCc1ccccc1 2374314325 QPUWQBALYRUTLC-UEWYOLLUSA-N 438.406 4.711 50 10 IJGE CC[C@@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)COc1ccc(Cl)cc1Cl 9871844 RXOJYLYEPKGGKC-ZIAGYGMSSA-N 439.339 4.501 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)COc1cc(C)ccc1C(C)C 9873228 OPVLTUSEAJRSTO-RBUKOAKNSA-N 426.557 4.626 50 10 IJGE COc1ccc(/C=N/NC(=O)COc2ccc(Br)cc2Cl)c2ccccc12 13977868 UDKYAYAPZGOXFG-FOKLQQMPSA-N 447.716 4.793 50 10 IJGE COc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cccc(Cl)c1 38651125 WQZLEIUTFUAFLK-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE Cc1ccc(Cl)cc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1cccnc1)CCC2 40814127 IIEAZSNHIILSQI-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE COc1ccccc1NC(=O)N/N=C/c1cc(C)n(-c2ccc(C(=O)O)c(Cl)c2)c1C 59247965 DFUDWCCXJHAGQL-WYMPLXKRSA-N 440.887 4.610 50 10 IJGE COc1ccc(NC(=O)/C(C#N)=C\c2ccc(OCCOc3cccc(OC)c3)cc2)cc1 101378893 MSQJHOBKCVVTHS-SILNSSARSA-N 444.487 4.707 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc3nc(S)[nH]c3c2)ccc1OCc1ccc(C)cc1 169917405 NQAARIIGBRSWTA-MXAYSNPKSA-N 446.532 4.512 50 10 IJGE C[C@H]1C[C@H](O[C@H](CI)c2ccc(Br)cc2)C[C@@H](C)O1 253115290 FNYCRCULNQUCNT-BAESOJJISA-N 439.131 4.898 50 10 IJGE COc1ccc2ccccc2c1C=NNC(=O)CSc1cc(C)nc2c(OC)cccc12 254622283 HMNSARWYTYXIQC-UHFFFAOYSA-N 445.544 4.956 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1cccc([C@@H]2CCc3ccccc3N2S(N)(=O)=O)c1 616593327 CFBVJXANXAREQN-NRFANRHFSA-N 432.662 4.906 50 10 IJGE C[C@@H](CCCBr)CNC(=O)c1scc(Br)c1Br 705428197 RZCOZKRAZMHBCV-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)c1C 736694087 YCRQTWXDHPYEAA-UHFFFAOYSA-N 447.445 4.983 50 10 IJGE O=C(NNc1cccc(F)c1F)N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1 745500181 BOJQQONRYGMZEP-IBGZPJMESA-N 425.414 4.521 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc3cc(Br)ccc3c2)c1C 746293324 HBFQKMQUBBHYKX-UHFFFAOYSA-N 448.324 4.828 50 10 IJGE CC(=O)N(c1ccc(Cl)cc1)c1nc(C=NNC(=O)c2ccc(C)c(F)c2)cs1 774505781 QBOJLPXBOFCBMN-UHFFFAOYSA-N 430.892 4.693 50 10 IJGE COc1cc(C=NNC(=O)CC[C@H](O)c2ccccc2)ccc1OCc1ccc(C)cc1 1083892632 UEZYKXUSOLAUGK-QHCPKHFHSA-N 432.520 4.547 50 10 IJGE Cc1ccccc1C(=O)Nc1ccc(C(=O)NN=Cc2ccc(Br)s2)cc1 1084038078 DROOVGKSRZVQMS-UHFFFAOYSA-N 442.338 4.835 50 10 IJGE C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)NNc1nc2ccccc2[nH]c1=S 1470319856 RBNJLCFVOPXOOX-JTQLQIEISA-N 435.322 4.516 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)c1 1558199356 FGAHVCKSMSBIOJ-UHFFFAOYSA-N 438.512 4.621 50 10 IJGE CC(=O)N(C)c1ccc(NC(=O)NNc2cc(C(F)(F)F)ccc2Br)cc1 1674020854 DOYQEQXLPMKHFZ-UHFFFAOYSA-N 445.239 4.599 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CC)nn2-c1cccc(Cl)c1 1865690945 FPDGAUNNBGMPMB-OAQYLSRUSA-N 432.911 4.871 50 10 IJGE CCCc1nn(-c2ccccc2)c2c1[C@H](c1ccc(OC(C)C)c(OC)c1)C(C#N)=C(N)O2 1865695751 HCRKSHDFQUNMBH-HSZRJFAPSA-N 444.535 4.839 50 10 IJGE CC(C)Cn1nc(C(F)(F)F)c2c1OC(N)=C(C#N)[C@H]2c1ccc(C(F)(F)F)cc1 1865710718 GBUWZXDPKZWOOO-CYBMUJFWSA-N 430.352 4.795 50 10 IJGE COc1ccc(-c2ccc(C(=O)N/N=C\c3ccccc3C(F)(F)F)c(C)n2)cc1OC 1865760616 HCOXHKSCEANXII-WKIKZPBSSA-N 443.425 4.857 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)cc(Cl)c1 1914636930 INMXCBHRNMEQSK-LBPRGKRZSA-N 437.186 4.968 50 10 IJGE CC1(C)CC[C@]2(CC[C@H](CI)O2)[C@@H](CNC(=O)OC(C)(C)C)C1 1927121580 JTHSQUZVHBNOLG-HBUWYVDXSA-N 437.362 4.690 50 10 IJGE CCCN(CCBr)C(=O)c1csc(Br)c1Br 1937738599 UJYFVKAYUVZILA-UHFFFAOYSA-N 433.991 4.520 50 10 IJGE Fc1ccc([C@@H](Cl)c2cc(I)sn2)cc1Br 1983291083 PXARSNDIBVHCDJ-SNVBAGLBSA-N 432.483 4.978 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@]2(CCC[C@@H](CI)O2)CC12CCC2 1986112749 SSZRSNPAETYZOM-KSSFIOAISA-N 435.346 4.683 50 10 IJGE C[C@H]1CO[C@](CBr)(Cc2cc(Br)ccc2Br)C1 2006498782 GFBKZXXXQDRETQ-RNCFNFMXSA-N 426.974 4.944 50 10 IJGE O=C(OCc1ccccc1)N1CC2(CC=CCN2CC2(CBr)CCCC2)C1 2026495744 WVCNCPUXMZZSMW-UHFFFAOYSA-N 433.390 4.595 50 10 IJGE FC1(F)[C@@H]2COC[C@]21[C@H](Br)c1cc(Br)ccc1Br 2043521221 PNPOBFVPGYGCTJ-GMTAPVOTSA-N 446.911 4.929 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc([S@](C)(=O)=NC[C@@H](Br)C(F)(F)F)c1 2044693276 JIWZJEYDTODTCG-YDBLSZJJSA-N 445.301 4.816 50 10 IJGE C[C@@H]1[C@H](n2c(CCCl)nc3cncc(Br)c32)CCN1Cc1ccccc1 2095446707 ZMLYCNKIFIDWBX-RDTXWAMCSA-N 433.781 4.811 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1CN(CC1CC1)C[C@H](CBr)C1CCC1 2106785550 PKKZTIGBQNSNCK-RBUKOAKNSA-N 429.443 4.909 50 10 IJGE CN(C(=O)[C@@H](Br)C1CCCC1)C1(CNC(=O)OC(C)(C)C)CCCCC1 2110716902 BSGPRNWEAYAIHO-INIZCTEOSA-N 431.415 4.626 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C(F)(F)F)CCCN1C[C@H](CBr)CC1CC1 2112864898 WHAYTJLPWRUSIJ-YOEHRIQHSA-N 443.348 4.719 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@H](Cl)c2cc(Br)sc2Br)C1 2137227280 LSWFRBGWIZVEQK-KOLSJAJHSA-N 448.629 4.768 50 10 IJGE O=C(N[C@H]1C[C@H]2CC[C@H]1[C@@H](Cl)C2)c1scc(Br)c1Br 2139715170 RCZAEJHVZBVASX-YIKMNZTOSA-N 427.589 4.799 50 10 IJGE O=S1(=O)CC[C@@H](CC(CBr)(CBr)C2CCCCCC2)C1 2148780550 YPMPEKWPODWUEP-ZDUSSCGKSA-N 430.246 4.558 50 10 IJGE CO[C@H]1CCN(CC2(CBr)CCCCCC2)[C@@H](CNC(=O)OC(C)(C)C)C1 2163063234 PCPWZBFFJIKLLS-MSOLQXFVSA-N 447.458 4.726 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CCC(F)(F)C1)C(=O)OC(C)(C)C 2212200752 PPKNAUSOQDFYDV-DOMZBBRYSA-N 447.304 4.642 50 10 IJGE CS(=O)(=O)[C@H]1C[C@H]([C@@H](Br)c2cc3sc(Br)cc3s2)C1 2278096230 IYFLPERGBBOVCS-NQYJQULFSA-N 444.235 4.985 50 10 IJGE Cc1ccc(OCCOc2ccccc2C=C(C#N)C(=O)NCc2ccccc2)cc1C 2293233217 PKTLZLWWFZUFFU-UHFFFAOYSA-N 426.516 4.985 50 10 IJGE O=C(C=Cc1ccc(Br)cc1)Oc1ccccc1C=NNC(=O)c1ccccc1 2296654294 MFMSTVVYTGVORI-UHFFFAOYSA-N 449.304 4.832 50 10 IJGE Clc1ccc(C[C@]2(CBr)CCCCO2)cc1I 2300240889 RTIOLEURITWXTQ-ZDUSSCGKSA-N 429.523 4.821 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1CC(F)F 2328525231 HGQLULMRAWFRLU-CABCVRRESA-N 427.374 4.620 50 10 IJGE CCCCO[C@H]1[C@@H](OCc2cccc(I)c2)C[C@H]1Br 2341609190 NQLNBUXGPHWKHQ-QLFBSQMISA-N 439.131 4.529 50 10 IJGE O=S1(=O)CC[C@@H](C(CBr)(CBr)CC2CCCCCC2)C1 2364426296 GNSWJGLDWOOYRC-CQSZACIVSA-N 430.246 4.558 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2O)CCC3)cc1C 40826383 KYJYLLFVBBUAED-ZXVVBBHZSA-N 431.492 4.633 50 10 IJGE Cc1cccc(C)c1NC(=O)CSc1ccc(/C=N/NC(=O)c2cccc(F)c2)o1 59507184 PCBHVHIYMBSPEP-WYMPLXKRSA-N 425.485 4.530 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccco2)C(=O)/C1=C/c1ccc(OCc2ccc(F)cc2)cc1 101336863 VDXFUUZSCOVZHX-YDZHTSKRSA-N 442.446 4.790 50 10 IJGE CCCCCOc1c(OC)cc(/C=N\NC(=O)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] 169901866 HNDKBBITCSGKJB-UCQKPKSFSA-N 433.892 4.519 50 10 IJGE C=CCN1C(=O)C(C#N)=C(C)/C(=C/c2cn(-c3ccccc3)nc2-c2ccc(C)cc2)C1=O 214351915 XIUCXMNGCFGQTP-HAHDFKILSA-N 434.499 4.626 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC(=O)/C(C#N)=C\N(Cc1ccccc1)Cc1ccccc1 217230622 UZYRRHLEMWKAJV-UZYVYHOESA-N 442.475 4.652 50 10 IJGE CC[C@@](C)(CCCl)NS(=O)(=O)c1cc(Br)c(C)cc1Br 228588330 POFGXILOTBTYOP-ZDUSSCGKSA-N 447.620 4.596 50 10 IJGE CC1CCC(CCl)(NC(=O)c2ccc(I)c(Cl)c2)CC1 232348712 NJVPMTKIOSBDNV-UHFFFAOYSA-N 426.125 4.862 50 10 IJGE C[C@@H](Cl)c1nc2ccc(Br)cc2n1C[C@H]1CN(Cc2ccccc2)CCO1 312616709 HFEDOQMFEIFQOU-CRAIPNDOSA-N 448.792 5.000 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1C[C@@H]1CCCN(Cc2ccccc2)C1 380258485 PDCXKGVEOCXRIW-QGZVFWFLSA-N 447.808 4.887 50 10 IJGE CC[C@H](C)N(CCBr)C(=O)c1cc(Br)c(Br)s1 393849973 VOYCNHTUZZMTSC-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE CN(C[C@H]1CCCN(Cc2ccccc2)C1)c1nc2ccccn2c1CBr 720016540 KJNBQKHLJRHICK-LJQANCHMSA-N 427.390 4.578 50 10 IJGE CC(C)c1nc(C#N)c(NNC(=O)[C@@H](Oc2ccc(F)c(Cl)c2)c2ccccc2)o1 730532439 GPIAZZGDBOHRBU-SFHVURJKSA-N 428.851 4.726 50 10 IJGE CC(=NNC(=O)c1ccc(CN(C)C)o1)c1ccc(-c2ccccc2Br)s1 914693996 WGXPTQBHZGMIPX-UHFFFAOYSA-N 446.370 4.986 50 10 IJGE C=CCc1cc(CNC(=O)NNc2ccc(Br)cc2CC)cc(OC)c1OC 1676274372 ABGWYSKEDZPVNU-UHFFFAOYSA-N 448.361 4.584 50 10 IJGE O=C(COc1ccc(-c2ccccc2)cc1Br)NN=Cc1ccc(F)cc1 1772754340 WRNRIKCJTSUHMN-UHFFFAOYSA-N 427.273 4.784 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C(=O)NNC(=O)c2cccc(-c3ccccc3)c2)cc1 1858081859 LWVMVJLHIUWJNK-UHFFFAOYSA-N 431.492 4.775 50 10 IJGE COc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2ccc(Cl)cc2Cl)cc1 1865686513 WTIMPULYSULRRC-LJQANCHMSA-N 427.291 4.714 50 10 IJGE CC/C(=C\C(=O)N[C@@](C)(CC)C(=O)Nc1ccc(SC#N)cc1)c1ccc(OC)cc1 1866687603 HDKHPTZIUVXNTF-BRGVFWSASA-N 437.565 4.985 50 10 IJGE CCC[C@H](NC(=O)CCC(=O)c1ccc(C)cc1C)C(=O)Nc1ccc(SC#N)cc1 1867091419 MWTWHLKVFDGJNV-NRFANRHFSA-N 437.565 4.763 50 10 IJGE CCC[C@@H]1C[C@H]1COC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1897634795 DQEUQNPNHABYPM-CABCVRRESA-N 437.362 4.644 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Cl)CCc1cc(Cl)ccc1Br 1905343690 PXXKBOUTYDOHNV-ZDUSSCGKSA-N 427.125 4.939 50 10 IJGE Cc1c(Br)sc([C@@H](Br)[C@H]2[C@H]3COC[C@H]32)c1Br 1982233721 YSULNWHTEVGMOS-XQXXSGGOSA-N 430.987 4.910 50 10 IJGE C=CCC[C@H](CBr)NC(=O)c1csc(Br)c1Br 2019482387 FPYABDHLOVDBNP-SSDOTTSWSA-N 446.002 4.733 50 10 IJGE C[C@]1(CBr)CCN(Cc2ccc(I)c(Cl)c2)C1 2026567336 QYLIYRIEEWFYEQ-CYBMUJFWSA-N 428.539 4.552 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CCCC[C@H]1CBr 2033094881 RHVRFHPFEUAUPO-VIFPVBQESA-N 439.973 4.601 50 10 IJGE CC1CC(CBr)(N(C)Cc2cc(Cl)ccc2I)C1 2046094683 APAACRACDDECES-UHFFFAOYSA-N 442.566 4.940 50 10 IJGE Cl[C@H]1C[C@H]2CC[C@H]1[C@H](Nc1ncc(I)cc1Br)C2 2084033128 AXHPTANUXYYODA-NXNXALQLSA-N 441.538 4.657 50 10 IJGE CC1(C)C[C@H](CBr)CN1Cc1ccc(I)c(Cl)c1 2086653948 BSULOWMQXOVHCT-LLVKDONJSA-N 442.566 4.940 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@H]2C[C@@H](Cl)CC[C@H]2C1 2093941793 CGMSJIGVAJJYCE-YIZRAAEISA-N 427.589 4.753 50 10 IJGE C[C@H]1[C@@H](NC(=O)C(F)(F)F)[C@H](C)CCN1CCCCCCCCCBr 2106781290 GRBYZIQDTRJVBD-PMPSAXMXSA-N 429.365 4.889 50 10 IJGE C[C@](CI)(OC[C@@H]1CCCOC1)c1ccccc1Br 2116006774 RUVYYJQPFWXISZ-IUODEOHRSA-N 439.131 4.543 50 10 IJGE CN(C(=O)c1cc(Br)cc(Br)c1)[C@H](CCCl)C(F)(F)F 2178516452 WLDKTXVIAIIGLC-SNVBAGLBSA-N 437.481 4.843 50 10 IJGE Cc1nc([C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)nc(O)c1CCCBr 2187360629 QNTRBGBSQIAJJR-REPLKXPHSA-N 430.390 4.729 50 10 IJGE O=C(NC[C@]12CCC[C@H]1CCN2Cc1ccccc1)c1ccc(CBr)cc1 2197370473 QSKHWXXYIBNLBJ-JTHBVZDNSA-N 427.386 4.756 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@@H]2CCCS2(=O)=O)c(C)c1Cl 2224302915 QCSMZVPAIGUARN-CMPLNLGQSA-N 430.589 4.733 50 10 IJGE O=C(c1ccc2c(c1)OC(F)(F)O2)N(Cc1ccccc1)[C@@H](CBr)C1CC1 2240246729 BHBDYUQLFXKKQM-INIZCTEOSA-N 438.268 4.824 50 10 IJGE CC[C@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@H]1CBr 2282969695 GATBDUGRHWXHTG-DTWKUNHWSA-N 427.539 4.735 50 10 IJGE O=C(CNc1cccc2ccccc12)NN=Cc1ccc(OC(=O)C=Cc2ccco2)cc1 2297297546 NCONQZSJSJJAMU-UHFFFAOYSA-N 439.471 4.614 50 10 IJGE CN(CCCCCBr)Cc1ccc(Cl)cc1I 2302326570 QOIXLTCEHJDONW-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE ClCC[C@@H]1CCCN1Cc1ccc(I)c(Br)c1 2306231094 GAYPPZIBNPVIQH-NSHDSACASA-N 428.539 4.647 50 10 IJGE CC1(C)C[C@H](Br)CN1Cc1cc(I)ccc1Cl 2307322958 VCAMWPSILRVILC-JTQLQIEISA-N 428.539 4.692 50 10 IJGE Cc1ccc2c(O)nc(C(C#N)=Cc3ccccc3OCC(=O)Nc3ccccc3)nc2c1 2314487133 CNCGZUJFBJVIPL-UHFFFAOYSA-N 436.471 4.726 50 10 IJGE O=C(Cc1ccc(Cl)c(F)c1)N[C@@H](CCBr)COCc1ccccc1 2320353923 DVAZJZNYTNYWEI-INIZCTEOSA-N 428.729 4.508 50 10 IJGE C[C@H]1[C@H](C)N(Cc2cc(Cl)ccc2I)CC[C@H]1Br 2321330050 LQCJYLDNCWFYIE-OUJBWJOFSA-N 442.566 4.938 50 10 IJGE COc1ccc(OC)c(C=NNC(=O)c2ccc3nc(-c4ccccc4Cl)[nH]c3c2)c1 2323743883 FYVJJSDXVWGBJW-UHFFFAOYSA-N 434.883 4.664 50 10 IJGE C[C@H]1CCCN(Cc2cc(I)ccc2Cl)[C@H]1CBr 2327398854 JKQXYBWFZBMSDH-HZMBPMFUSA-N 442.566 4.940 50 10 IJGE N#CC(=C(O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1nc(-c2ccc(F)cc2F)cs1 2331292952 AGBYQBJUIBPVBD-UHFFFAOYSA-N 430.348 4.855 50 10 IJGE Nc1c(NCCC2=CCCCC2)ncnc1NNC(=O)C(c1ccccc1)c1ccccc1 40756080 XOGAFVURZOVKJC-UHFFFAOYSA-N 442.567 4.636 50 10 IJGE CC(C)OC(=O)[C@@]12CC[C@@](C(Br)Br)([C@@H]1Br)C2(C)C 100935431 DOZFCBGAMFKXMY-AQUOVQTQSA-N 447.005 4.624 50 10 IJGE CC(C)(C(F)F)[C@@H](Br)c1cc(I)cc2c1OCC2 698465016 BZWJPEHHBAFOFK-NSHDSACASA-N 431.058 4.953 50 10 IJGE CC(C)N(C[C@@H](C)Cl)C(=O)c1ccc(I)c(Br)c1 721625550 YZCNEBWUDWMOLD-SECBINFHSA-N 444.538 4.532 50 10 IJGE O=C(N[C@H](CCCl)C1CCCC1)c1cc(Cl)ccc1I 725045129 VHBBBMKDZJOBCX-CQSZACIVSA-N 426.125 4.862 50 10 IJGE CC(C)[C@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1ccc(C(F)(F)F)cc1 747950317 QUTDZBGSEOITSJ-SFHVURJKSA-N 430.430 4.595 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2cc3c(cc2F)NC(=O)CC3)c(C)n1-c1ccc(F)cc1 778218195 DLEJIXNOSRNDMI-VCHYOVAHSA-N 446.457 4.803 50 10 IJGE COc1ccc(NNC(=O)C(=O)Nc2cccc(Oc3cccc(C(F)(F)F)c3)c2)cc1 783036417 YDEJBELOQHDHOX-UHFFFAOYSA-N 445.397 4.588 50 10 IJGE CCc1onc(-c2ccccc2Cl)c1C(=O)NNc1nc(-c2cccnc2)nc(C)c1C 795111718 BPZOCUQZEJXGDB-UHFFFAOYSA-N 448.914 4.783 50 10 IJGE COc1cc(Cl)ccc1COC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 795318817 ANZQMQGFMPRXIS-XDHOZWIPSA-N 446.894 4.776 50 10 IJGE CCCc1sc(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)cc1Br 1160827926 QKTZSIAZXMGHGQ-UHFFFAOYSA-N 446.374 4.689 50 10 IJGE CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NNc1ccc(Cl)cc1Br 1168053797 BIGGPXWWRKPOKH-GOSISDBHSA-N 434.721 4.510 50 10 IJGE C[C@@H](CNC(=O)NNC(=O)c1ccc(Br)cc1)c1c(Cl)cccc1Cl 1318311319 RJAXABJJRUGRDY-JTQLQIEISA-N 445.144 4.504 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2cccc(F)c2)[C@@H]1c1ccc(O)cc1 1865683434 DODWRLRQCNZDSS-JOCHJYFZSA-N 438.462 4.661 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1ccccc1F)C(C#N)=C(N)O2 1865683515 LMZYWPCJVBSXKE-LJQANCHMSA-N 426.854 4.644 50 10 IJGE CCN(CC)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(C)cc2)cc1 1865702338 TTXUNIWHYCWLGP-DEOSSOPVSA-N 427.552 4.613 50 10 IJGE C[C@@H](Cl)C(=O)N(c1ccc(N2CCCC2)cc1)C1CCN(Cc2ccccc2)CC1 1865854636 CCQLZCIWWGVAKK-HXUWFJFHSA-N 426.004 4.912 50 10 IJGE CCCC[C@H](NC(=O)Cc1cc(-c2ccccc2)on1)C(=O)Nc1ccc(SC#N)cc1 1866914444 WZZMPCXDXLSJIG-NRFANRHFSA-N 448.548 4.771 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCN(Cc2ccccc2)CC12CCC2 1882089160 XQBQRENXRXFAPO-RBUKOAKNSA-N 437.422 4.967 50 10 IJGE Cc1ccc(C(=O)N(C)CC2CC(Br)C2)c(NC(=O)OC(C)(C)C)c1C 1887829693 MJJIBQBAJWYAPE-UHFFFAOYSA-N 425.367 4.896 50 10 IJGE CN(CC1(CBr)CC1)C(=O)c1scc(Br)c1Br 1915522613 QFOUTEFERLTZNI-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE CCc1ccc(S(=O)(=O)N(Cc2ccccc2)C2(CBr)CCC2)s1 1915773532 HPPZZXAYKMSWGB-UHFFFAOYSA-N 428.417 4.819 50 10 IJGE C[C@@H](Br)CN(C(=O)c1csc(Br)c1Br)C1CC1 1945187115 RMCKHMXCUQXUBT-ZCFIWIBFSA-N 446.002 4.661 50 10 IJGE BrC[C@H](NCc1c(Br)cccc1Br)C1CCC1 1945331345 XGVYHYHXIVALDL-ZDUSSCGKSA-N 425.990 4.865 50 10 IJGE CC(C)(C)[C@H](CBr)CN1CCC[C@H](CNC(=O)OCc2ccccc2)C1 1977953687 VKKUOACSVRRYIP-RTBURBONSA-N 425.411 4.682 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@H](CI)O2)CC12CCCC2 1990423898 KRHWFUDGLHLXCB-RDTXWAMCSA-N 435.346 4.683 50 10 IJGE CCN(C[C@](C)(CI)O[C@H]1CCCC1(F)F)C(=O)OC(C)(C)C 1991616949 QFSCVHVGCIUVSM-WFASDCNBSA-N 447.304 4.642 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1Br)c1c(Br)cccc1Br 2033081483 FXGSIJFOQDKLHJ-KCJUWKMLSA-N 439.973 4.648 50 10 IJGE CC1(C)C[C@H](O[C@H](CI)c2ccc(Br)cc2)CO1 2052241280 ODCQAWFETLPJHG-QWHCGFSZSA-N 425.104 4.509 50 10 IJGE CCCN1CC[C@@H]([C@@H](Br)c2ccc(OCc3ccccc3)cc2)S1(=O)=O 2089516362 WQSZKZDIZAVCEQ-PMACEKPBSA-N 438.387 4.516 50 10 IJGE C[C@@H](CCBr)CCN1CCOc2ccc(CNC(=O)OC(C)(C)C)cc21 2106786993 XADPQKOHKJAFEO-HNNXBMFYSA-N 427.383 4.721 50 10 IJGE CC1(C)C[C@H](NC(=O)OC(C)(C)C)CN(C[C@H](CBr)c2ccccc2)C1 2106787360 IKVJCLLUXOXBEO-ROUUACIJSA-N 425.411 4.790 50 10 IJGE Cc1cc(Br)c([C@H](Br)c2ccc3c(c2)CCS3(=O)=O)s1 2170066521 HXRFZPWTVXEAMP-CYBMUJFWSA-N 436.190 4.633 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@@H]([C@@H](C)Br)C(F)(F)F)cc1Br 2195309667 JMSYGUNZJSCNQA-LDWIPMOCSA-N 437.481 4.855 50 10 IJGE Clc1ccc(CN2CCC(OCCCBr)CC2)cc1Br 2207526918 GTQDSZJFROHUFV-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE CC(C)(C)CN(CCBr)C(=O)Cc1ccc(Br)cc1Cl 2237444703 XAVVANBEHZWWKK-UHFFFAOYSA-N 425.592 4.915 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)C23COCC(C2)C3)c1 2263515577 PZMBYTFYPQUJSN-IWXRYERYSA-N 438.985 4.944 50 10 IJGE O=C(NC[C@]12CCC[C@@]1(CBr)C2)c1scc(Br)c1Cl 2264504059 LVLWKVBTIWLKDM-QWHCGFSZSA-N 427.589 4.849 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Br)[C@@H]1OCCOC1(C)C 2295368539 WQWIERXLGGVOSH-AAEUAGOBSA-N 428.548 4.741 50 10 IJGE C[C@H]1CN(Cc2sccc2I)CC[C@H]1CCBr 2301072460 YCFSCHLCGMDEKD-WDEREUQCSA-N 428.177 4.596 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)CN(C)C[C@@H]1CC1(Br)Br 2301978955 RZWDLAASJWQQIP-WDEREUQCSA-N 434.054 4.870 50 10 IJGE ClCCCN(Cc1ccc(I)c(Br)c1)C1CC1 2306224194 NYFRGCXIHCYRQX-UHFFFAOYSA-N 428.539 4.647 50 10 IJGE O=S1(=O)C[C@@H]2[C@H]([C@H](Cl)c3ccc(OCc4ccccc4)cc3Br)[C@@H]2C1 2314442395 BGFRUXVTGLZILK-UKBAYJJMSA-N 441.774 4.599 50 10 IJGE CCCOc1ccccc1C=NNC(=O)c1cccn(Cc2ccc(C(C)(C)C)cc2)c1=O 2323662351 TYKARSCGTGRLCJ-UHFFFAOYSA-N 445.563 4.747 50 10 IJGE COc1ccc([C@H](C)NC(=O)C(C#N)=CN[C@@H](C)c2ccc3c(c2)CCCC3)cc1OC 2325044963 OPCXVARRIOFILS-ROUUACIJSA-N 433.552 4.518 50 10 IJGE Cc1cc(I)ccc1NC(=O)C(C#N)=CN(CC(C)C)CC(C)C 2325408149 ISOMKNYOKMONRN-UHFFFAOYSA-N 439.341 4.560 50 10 IJGE CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1 2328833171 VNVSITPZMMFLQN-IBGZPJMESA-N 447.620 4.987 50 10 IJGE COCc1cc(Br)c([C@@H](Br)C2C[C@@H](OC)[C@H](OC)C2)s1 2355489082 VMULKBAXOGEDML-UPJWGTAASA-N 428.186 4.533 50 10 IJGE F[C@]12CCC[C@@]1(CCl)CN(Cc1ccc(Cl)cc1I)C2 2366701484 JBBQPHNKBZWUGT-CABCVRRESA-N 428.116 4.878 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CN(C[C@@](C)(CBr)C(C)(C)C)CCO2)C1 2380167077 DFDPTOPLZRJNEW-RTWAWAEBSA-N 447.458 4.536 50 10 IJGE N#C/C(=C/c1cn(Cc2c(F)cccc2Cl)c2ccccc12)C(=O)NC[C@H]1CCCO1 59087115 SDEGVJNTPRAFIH-MUMAZLPKSA-N 437.902 4.684 50 10 IJGE C[C@H]1CCC[C@@](CBr)(NC(=O)c2c(F)cc(Br)cc2F)C1 125131432 IMJHXYOAOTXOST-BJOHPYRUSA-N 425.111 4.801 50 10 IJGE CCOc1c(Cl)cc(/C=N/NC(=O)c2nn(-c3ccccc3)c3c2CCC3)cc1Cl 169927684 SPBABYIVSJFULR-DHRITJCHSA-N 443.334 4.830 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2ccc3c(c2)C[C@H](C)O3)sc2c1CCCC2 214202399 KYTBYPICQQIZEE-IQGJIOQQSA-N 436.533 4.673 50 10 IJGE CC(C)(CBr)CCCNS(=O)(=O)c1ccc(Br)cc1Cl 393371194 FRKJJOXOGXOONY-UHFFFAOYSA-N 447.620 4.582 50 10 IJGE BrCc1cc(Br)c(OCC[C@H]2CCOC2)c(Br)c1 400546727 MLOHOUWRGKNFQV-SECBINFHSA-N 442.973 4.912 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1Cc1cc(Cl)ccc1I 705503777 YENMUOVVAMKURH-ONGXEEELSA-N 428.539 4.692 50 10 IJGE Clc1cc(Br)c(OCC2=CSC3=NCCN23)c(CBr)c1 708074260 APUZEDQOEABKKP-UHFFFAOYSA-N 438.572 4.636 50 10 IJGE CC[C@H](C[C@H](C)Br)NC(=O)c1cc(Br)sc1Br 716854915 KSRUUOYQWVVOLG-NKWVEPMBSA-N 448.018 4.955 50 10 IJGE CC[C@H](NC(=O)NNC(=O)c1ccc(C(C)(C)C)cc1)c1nc(C(F)(F)F)cs1 745935860 SOSRNXXCYPZZQD-ZDUSSCGKSA-N 428.480 4.555 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCCCCC[C@@H]1C(=O)NNc1nc2ccccc2[nH]c1=S 1148222610 FBFLHXISDJXOJX-LSDHHAIUSA-N 445.589 4.599 50 10 IJGE CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NNc1ccc(Cl)c(Br)c1 1156736055 GQIFIVGBUKQHLD-GOSISDBHSA-N 434.721 4.510 50 10 IJGE C[C@@H](NC(=S)NNC(=O)c1ccc(Br)cc1)c1ccc(Cl)cc1Cl 1325620990 BZNFWOWVMDNVEQ-SECBINFHSA-N 447.185 4.626 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCc3cnc(O)c4ccccc34)c2C)cc1 1455900832 BOOUIDVFMGSDAG-BKUYFWCQSA-N 436.515 4.880 50 10 IJGE Cc1cc(O)nc2cc(C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C(C)(C)C)C4)ccc12 1540342022 OYUOAZIUPPILNM-MRXNPFEDSA-N 437.565 4.536 50 10 IJGE Cc1ccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4ccc(F)cc4F)c(C)c32)cc1 1772744394 CTXQNKXGFRJVBQ-UHFFFAOYSA-N 437.446 4.897 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccn2)[C@@H]1c1ccc(Cl)cc1 1865683149 HAKXCTCIXBTGLQ-HXUWFJFHSA-N 425.879 4.806 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@@H]1c1ccccc1F 1865683317 IPVBJBQJWZUFHM-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE Cn1cc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccccc2)c2ccccc21 1865699245 OFXZXPHHVVPNQC-LJQANCHMSA-N 449.436 4.660 50 10 IJGE Cc1ccccc1COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3CC(C)C)cc1 1865703236 QYEZOAVZTXDRBX-DEOSSOPVSA-N 428.536 4.953 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)Cc1ccc(F)cc1 1865759309 SZWZYTYFVQYMRX-UHFFFAOYSA-N 432.282 4.507 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@]2(CCC[C@H]2Cl)C1 1918907790 HNZHUDAXOAPHIM-ZWNOBZJWSA-N 427.589 4.897 50 10 IJGE CCC(=O)[C@H](Br)Cc1ccc(Cl)c(I)c1Cl 1937733268 BZDQXGRDBSXKGD-SSDOTTSWSA-N 435.914 4.883 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc([S@](C)(=O)=NC[C@H](Br)C(F)(F)F)cc1 2044703117 QYOCEGNFFPPMOW-VDBVYFBLSA-N 445.301 4.816 50 10 IJGE Cn1nc(C[C@@H](CBr)c2ccccc2Br)cc1Br 2049248838 KBYFUOWXZPABNX-VIFPVBQESA-N 436.973 4.666 50 10 IJGE CCc1nn(C)c([C@H](Br)c2ccc(Br)cc2)c1Br 2072302515 LHXIJWLCZBCBFU-LLVKDONJSA-N 436.973 4.992 50 10 IJGE CCc1nn(-c2cc(C)ccc2CBr)c(CC)c1I 2093909756 PUZYTSDRSIHEPH-UHFFFAOYSA-N 433.131 4.805 50 10 IJGE C[C@]1(C2CC2)CN(c2nc3sccn3c2CBr)CCN1Cc1ccccc1 2151088772 HGPPTIZICZSGQM-OAQYLSRUSA-N 445.430 4.782 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)NC[C@@H](CBr)CC(C)(C)C 2156328534 GFLAUCONRPAABV-SNVBAGLBSA-N 447.258 4.545 50 10 IJGE O=C(c1cc(Br)cs1)N1CCC(CBr)(CC(F)F)CC1 2188333957 DZYAPIGFXKQLDG-UHFFFAOYSA-N 431.140 4.783 50 10 IJGE ClCc1c(Cl)ncn1-c1ccc(Br)cc1I 2212574118 JCVFLJGGPAGWSB-UHFFFAOYSA-N 431.886 4.632 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@@H](Br)[C@@H]1[C@H]2COC[C@H]21 2213488783 ICCPIPVVMUGZFA-RQJHRRTKSA-N 428.921 4.679 50 10 IJGE CO[C@@H]1CC[C@@H]1COc1c(Br)cc(Br)cc1CBr 2220575494 JEQCABLWRGOZMU-PRHODGIISA-N 442.973 4.910 50 10 IJGE CC(C)(C)OC(=O)N(CC(F)F)[C@H]1CCCN(CCCCCCBr)C1 2223294295 YGQMYWNMEZQUFY-HNNXBMFYSA-N 427.374 4.908 50 10 IJGE O=C(Nc1ccc(I)cc1)O[C@@H]1CCCC[C@H]1CBr 2227209275 MJYKZENZZQLPJX-GXFFZTMASA-N 438.103 4.793 50 10 IJGE Cc1cc(Br)c(C(=O)N2C[C@@]3(CBr)CCC[C@]3(F)C2)s1 2237633429 LMNZLKSJLJIJJF-KBPBESRZSA-N 425.161 4.548 50 10 IJGE C[C@@H](N(Cc1ccccc1)S(=O)(=O)c1cncc(CBr)c1)C(C)(C)C 2256188479 JRYWRYFYAILDMH-OAHLLOKOSA-N 425.392 4.602 50 10 IJGE COc1ccc([C@H](Br)C[C@H]2CC[C@@H]2OC)cc1I 2257365216 PQCYGYOTVLFXAG-WZRBSPASSA-N 425.104 4.551 50 10 IJGE COc1ccc([C@H](Br)CC2(OC)CCC2)cc1I 2257366366 AYGWUQPHVTYBHW-LLVKDONJSA-N 425.104 4.695 50 10 IJGE COc1c(Br)cc([C@H](Br)[C@@H]2C[C@@H]2Br)c(OC)c1C 2263577958 ZNTCMGDIAZZPQD-POZPLHJXSA-N 442.973 4.994 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@@H](Br)C2(CCC2)C1 2282987712 HOCUTDJVRNFKGE-GFCCVEGCSA-N 425.523 4.631 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H](CNC(=O)c2ccc(CBr)cc2)CC1 2295179823 KCXATMRAZQKHQI-QGZVFWFLSA-N 439.394 4.739 50 10 IJGE CC(C)C[C@@H](CCl)CNC(=O)Cc1cc(Br)cc(Br)c1 2295311298 IZFZBCNALUWLRM-LBPRGKRZSA-N 425.592 4.771 50 10 IJGE C=CCc1cc(C=C(C#N)C(=O)NCCc2c[nH]c3ccccc23)cc(OCC)c1OC 2313555890 CRDSYQWLUKJKOA-UHFFFAOYSA-N 429.520 4.570 50 10 IJGE C[C@@H]1C[C@H](Br)[C@@H](C)N(Cc2ccc(Cl)cc2I)C1 2318545802 MMFBEARLSUFTAA-BREBYQMCSA-N 442.566 4.938 50 10 IJGE N#CC(=CNCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Sc1ccccc1 2325338872 DOVQYLJNJSQFIH-UHFFFAOYSA-N 429.501 4.672 50 10 IJGE COc1ccc(C)cc1N(C(=O)CCl)[C@@H](C(=O)NC1CCCCC1)c1cccs1 3034948 AXBYSQVFKPTWSO-OAQYLSRUSA-N 434.989 4.827 50 10 IJGE CC[C@H](Oc1ccccc1[C@@H](C)CC)C(=O)NNC(=O)COc1cc(C)c(Cl)c(C)c1 10682249 PESIEJVUYRUEBC-YWZLYKJASA-N 446.975 4.854 50 10 IJGE CCCCCN1C(=O)/C(=N/NC(=O)[C@@H](C)Oc2ccc(Cl)cc2C)c2cc(C)ccc21 33959320 CGAUEPWWTWYLIW-JMBSQFONSA-N 441.959 4.781 50 10 IJGE Cc1cc(C)cc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)COc2ccccc2)CCC3)c1 40815994 CHJRVJIDDTUYDV-SZXQPVLSSA-N 446.503 4.660 50 10 IJGE COc1cc(/C=N/NC(=O)c2ccc(C(C)(C)C)cc2)ccc1OC(=O)c1ccccc1 48573332 WASNMOXGEXBMQV-WPWMEQJKSA-N 430.504 4.976 50 10 IJGE CCN(C[C@](C)(CI)OCCC1CCC1)C(=O)OC(C)(C)C 229550123 DIZKHOFXJYYKNL-KRWDZBQOSA-N 425.351 4.644 50 10 IJGE O=C(NN=Cc1cn(Cc2c(F)cccc2Cl)nc1-c1ccccc1)c1ccc(O)cc1 254819858 ZKXIXVIKBNHKFP-UHFFFAOYSA-N 448.885 4.860 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1ccc(Oc2ccc(Cl)cn2)cc1 756788819 CUZAPVONDCEFHC-UHFFFAOYSA-N 433.855 4.542 50 10 IJGE O=C(CCc1ncc(-c2ccc(F)cc2F)o1)Oc1ccc([N+](=O)[O-])c2ncccc12 770127860 ROBOKYSBKQKEFU-UHFFFAOYSA-N 425.347 4.614 50 10 IJGE CN(Cc1ccccc1)Cc1cccc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1 799749511 RTOAOWKBLRQBKH-UHFFFAOYSA-N 438.453 4.966 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2cc3sc(Nc4ccccc4)nc3s2)c1 1176933268 LHYLSIPDWUMFFG-UHFFFAOYSA-N 449.586 4.714 50 10 IJGE C/C(=C/c1ccccc1Cl)C(=O)NNC(=O)COc1ccccc1Cc1ccccc1 1654118795 VBFNIFDMIRFNHT-SDXDJHTJSA-N 434.923 4.561 50 10 IJGE CC(=O)c1cc(NC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)ccc1C 1673137355 DVIWJBJBXJPDLD-MRXNPFEDSA-N 427.570 4.877 50 10 IJGE CCCCCN1C(=O)C(=NNC(=O)COc2ccc(Cl)cc2Cl)c2cc(C)ccc21 1772720967 YBBNMPZWSKXTFD-UHFFFAOYSA-N 448.350 4.738 50 10 IJGE Cc1c(C(=O)N2c3ccc(F)cc3CC[C@H]2C)oc2c1C(=NNC(=O)c1ccco1)CCC2 1772748091 YCTJNCHJPDTTJT-CQSZACIVSA-N 449.482 4.772 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3-c2ccc(C)cc2)cc1OCC 1865688913 DZECTMCREPULOQ-QHCPKHFHSA-N 444.535 4.759 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1C[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@]2(C)C1 1882084951 PMEYSZZCTATQBV-RDNQGFKOSA-N 447.414 4.558 50 10 IJGE O=C(c1cc(Br)sn1)N(Cc1ccccc1)C1(CBr)CCC1 1909915839 YZIQWSLHBSEYKM-UHFFFAOYSA-N 444.192 4.866 50 10 IJGE CC(C)[C@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1cscc1Br 1915281671 SEBSPGIRPCRVMK-HNNXBMFYSA-N 436.824 4.965 50 10 IJGE CN(C[C@]1(C(C)(C)C)CCC[C@H](CI)O1)C(=O)OC(C)(C)C 1929975171 PCISIVFRMKTFOE-DYVFJYSZSA-N 425.351 4.642 50 10 IJGE C[C@H]1CN(Cc2c(Br)cccc2Br)CC[C@@H]1Br 1945333219 MYHHRYYXLMLRDI-ONGXEEELSA-N 425.990 4.817 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1ncc(Br)cc1F 1979831742 SKOZDJLRAGPCPT-GFCCVEGCSA-N 444.142 4.799 50 10 IJGE C[C@H]1CN(Cc2ccc(CBr)cc2)C[C@@H](C)N1C(=O)OCc1ccccc1 2011641013 MWVJBFKXXQHUFR-HDICACEKSA-N 431.374 4.813 50 10 IJGE COC[C@@H](C)COc1c(Br)cc(CBr)cc1Br 2022005932 NZCPNFWZYRBQOP-MRVPVSSYSA-N 430.962 4.768 50 10 IJGE BrC[C@@]1(Cc2cccc(Br)c2Br)C[C@]12CCOC2 2039026143 WWJDGJILUFSALN-UONOGXRCSA-N 438.985 4.946 50 10 IJGE Cc1cc([C@H](Br)c2cc(S(C)(=O)=O)cs2)c(Br)s1 2039500559 KFIXRAOEQCRAPQ-JTQLQIEISA-N 430.208 4.768 50 10 IJGE CC[C@@H](Br)CN(CC)C(=O)c1cccc(Br)c1Br 2044542762 CDDBFXXUSGZYTK-SECBINFHSA-N 441.989 4.847 50 10 IJGE COC[C@H]1C[C@@H]1COc1c(Br)cc(CBr)cc1Br 2069753628 OSDMVPNAEHSFOH-NXEZZACHSA-N 442.973 4.768 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1cc(Br)cc(Br)c1 2081243317 WPGRPYGTDKFAAM-PRHODGIISA-N 441.989 4.751 50 10 IJGE FC(F)(F)c1ccc(NC[C@H]2C[C@H](Br)C2)c(I)c1 2083656158 NEZJZEDACMVKPG-XWEPSHTISA-N 434.037 4.895 50 10 IJGE C[C@H](CCCCCl)NC(=O)c1ccc(Br)cc1I 2086150521 BYEHBTHYJQYBNU-SECBINFHSA-N 444.538 4.581 50 10 IJGE Clc1cc(CN2C[C@H]3CC[C@]3(CBr)C2)ccc1I 2086654955 KFABHNAOWXCJNW-RISCZKNCSA-N 440.550 4.552 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1CCN(Cc2ccccc2)CC(F)(F)C1 2093155205 JHCGNSUTOCYIIM-UHFFFAOYSA-N 446.317 4.509 50 10 IJGE CC(C)[C@H](Br)C(=O)N[C@@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21 2106200742 RTVVIEFLZWBVPZ-SJORKVTESA-N 425.367 4.947 50 10 IJGE CC(C)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCN(CC1(CBr)CCC1)CC2 2106787390 IQGPXWYBYBATJA-KRWDZBQOSA-N 429.443 4.909 50 10 IJGE O=C([C@H](Br)C1CCCC1)N1CCC[C@@]2(CCCN(Cc3ccccc3)C2)C1 2167030755 AWWSIQXCRLJFKY-FYYLOGMGSA-N 433.434 4.845 50 10 IJGE O=C(c1ccccc1OCc1ccccc1)N1CCC(COCCBr)CC1 2167393766 WXLJGKISPZZIHK-UHFFFAOYSA-N 432.358 4.529 50 10 IJGE CC(C)(C)OC(=O)NC1(c2cccc(NC(=O)N3CCC(Br)CC3)c2)CC1 2169060850 XOUMCAHXAOLLDU-UHFFFAOYSA-N 438.366 4.592 50 10 IJGE C[C@@H]1CCCN(CCCCCI)[C@@H]1CCNC(=O)OC(C)(C)C 2211184285 LEBKUBFIPXGCKI-HZPDHXFCSA-N 438.394 4.607 50 10 IJGE CC(C)[S@@](=O)(=NCCCCCCBr)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2223291897 WLXIAESUZHRNGT-CPJLOUKISA-N 439.460 4.828 50 10 IJGE C=CC[C@]1(CBr)CCN(c2ncc(Br)cc2Br)C1 2259498512 DHVSYRJSCLMOII-CYBMUJFWSA-N 438.989 4.774 50 10 IJGE CC12COC(CO[C@@H](CI)c3ccccc3Br)(C1)C2 2266244066 YWKLQXMXVCZOMZ-NFOMZHRRSA-N 437.115 4.511 50 10 IJGE COc1ccc(Oc2nc3c(C)cccn3c(=O)c2C=C(C#N)c2nc3ccccc3[nH]2)cc1 2296719316 AWOOPFFMOZQUSA-UHFFFAOYSA-N 449.470 4.744 50 10 IJGE CC[C@H](Cl)[C@@H](CC)NCc1ccc(I)c(Br)c1 2306219594 NYJDIJRTHPPBSJ-WCQYABFASA-N 430.555 4.939 50 10 IJGE Clc1cc(Br)c(CN2C[C@@H](Br)C3(CCOCC3)C2)s1 2345951492 FVDHCTLKWRXQPL-LLVKDONJSA-N 429.605 4.540 50 10 IJGE Br[C@@H]1c2ccccc2CCC[C@@H]1Cc1ncc(I)cn1 2381287583 LDQGYDJOQZEXAL-WBMJQRKESA-N 443.126 4.712 50 10 IJGE Cc1ccc(CCN(C(=O)CCl)[C@H](C(=O)NC2CCCCC2)c2ccc(F)cc2)cc1 3037431 JPSLWRKUUWDOHU-DEOSSOPVSA-N 444.978 4.934 50 10 IJGE CCCOc1ccccc1C(=O)NNC(=O)C(C)(C)CCCOc1cc(C)ccc1C 66201474 LOUFDOGRNBBPGA-UHFFFAOYSA-N 426.557 4.739 50 10 IJGE O=C(Nc1ccccc1S[C@@H](Cl)C(F)(F)F)c1ccc(Cn2ccccc2=O)o1 97111258 KGUMYGQGJBBFHZ-GOSISDBHSA-N 442.846 4.961 50 10 IJGE N#C/C(=C/Nc1ccc(F)c([N+](=O)[O-])c1)c1nc(-c2cc3ccccc3oc2=O)cs1 102937781 YDRXAQWPHKNSCK-RAXLEYEMSA-N 434.408 4.940 50 10 IJGE CC(C)[C@H](CCBr)NC(=O)c1ccc(Br)cc1Br 231123593 AXDUZNNFPHSPSE-LBPRGKRZSA-N 441.989 4.751 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCC[C@@H](CBr)C1 232483018 DOLMAZHSDZQZJK-ZETCQYMHSA-N 446.002 4.520 50 10 IJGE CCC[C@@H](C)COC1(CI)CCN(C(=O)OC(C)(C)C)CC1 233271230 ZOQRDJBRUXROGP-CQSZACIVSA-N 425.351 4.644 50 10 IJGE CCOc1ccc(C=NNC(=O)c2cc(-c3ccc(C)o3)nc3ccccc23)cc1OC 252617403 KSBSNIKHRUERQG-UHFFFAOYSA-N 429.476 4.974 50 10 IJGE CCOC(=O)c1c(-c2ccccc2)oc2ccc(OCC(=O)NN=Cc3cccs3)cc12 254589758 RLAQVHBYWZGMQK-UHFFFAOYSA-N 448.500 4.867 50 10 IJGE CCCO[C@@H]1[C@H](Br)C[C@H]1Oc1ccc(Br)cc1Br 300467225 BNMCYLXNMXOXPO-RAIGVLPGSA-N 442.973 4.921 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@H]1C=C(I)C(=O)[C@H]1OCc1ccccc1 309923084 WOQWQMNYYGLQIV-RDJZCZTQSA-N 444.385 4.864 50 10 IJGE N#CSc1ccc(NC(=O)Nc2cccc(C(=O)Nc3cccc(C(=O)O)c3)c2)cc1 586732609 JNOPVCMOBGKJLI-UHFFFAOYSA-N 432.461 4.854 50 10 IJGE CC(C)[C@H](CCBr)NC(=O)c1scc(Br)c1Br 705396961 AKUKWLLGRHWJDV-QMMMGPOBSA-N 448.018 4.813 50 10 IJGE O=C(NNc1ccc(OCC(F)(F)F)cc1)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 748694043 HWVGFBBHDRFYRC-LSDHHAIUSA-N 434.336 4.773 50 10 IJGE Cc1ccccc1CC(=O)NNC(=O)N[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 764351663 AXKBIBCGPRMICR-HNNXBMFYSA-N 442.972 4.714 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccccc2C(=O)c2ccc(F)c(F)c2)c(C(F)(F)F)c1 799753228 TUJSIDYICYSMBL-UHFFFAOYSA-N 445.347 4.843 50 10 IJGE CC[C@H](Oc1ccc2ccccc2c1Br)C(=O)NN=Cc1ccccc1OC 1084341908 OFHKZAGLJBOVJD-SFHVURJKSA-N 441.325 4.919 50 10 IJGE C=CC[C@H](C(=O)NNC(=O)c1ccc(COc2ccc(OCC)cc2)cc1)c1ccccc1 1349593805 VFEYLBDGUQUTFR-VWLOTQADSA-N 444.531 4.785 50 10 IJGE Cc1cc(O)nc2cc(C(=O)NNc3cc(C(F)(F)F)ccc3Br)ccc12 1451566928 DJLWZUKBMYYBDR-UHFFFAOYSA-N 440.219 4.787 50 10 IJGE C=CCOc1ccc(/C=C\C(=O)NNc2cc(Cl)ccc2Br)cc1OC 1644409894 YAUJVKYRYBKHAZ-UITAMQMPSA-N 437.721 4.832 50 10 IJGE C#C[C@H]1CC[C@H](NC(=O)NNC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)CC1 1675720351 MRZOYXNVLZGVCI-UKIBZPOASA-N 441.984 4.768 50 10 IJGE Cc1ccc(Cn2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2cccc(Br)c2)cc1 1865683667 HRFCBASGPBHJEP-HXUWFJFHSA-N 435.325 4.529 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccc(OC)cc1)nn2CCC 1865702793 FLEUTWGWWSDSTL-QFIPXVFZSA-N 444.535 4.976 50 10 IJGE CCCc1nn(-c2ccc(OC)cc2)c2c1[C@@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865705069 LEUWHXJMSHDHCP-QHCPKHFHSA-N 444.535 4.839 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccc(Br)cc1 1902794679 NWWKZGMEHAVTAD-KRWDZBQOSA-N 441.163 4.549 50 10 IJGE C[C@H](CCBr)N(C)C(=O)c1cc(Br)sc1Br 1917084929 QXRMFPVCXWLNNP-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE O=C(N[C@@H]1[C@H]2C[C@H]1N(CC1(CBr)CCCCCC1)C2)OCc1ccccc1 1999504120 OYPITYUTVCBPAT-XUVXKRRUSA-N 435.406 4.721 50 10 IJGE CC[C@@H](Br)c1nnc(-c2cc(I)ccc2F)s1 2003651499 GAKRPTNYRRKXAE-MRVPVSSYSA-N 427.080 4.795 50 10 IJGE CC(C)[C@@H](Br)c1cn(-c2cc(Br)cc(Br)c2)nn1 2057421442 NPCXLJXCORKSGZ-GFCCVEGCSA-N 437.961 4.884 50 10 IJGE C[C@H]1CCc2nn(Cc3c(F)cccc3I)c(CBr)c21 2080648084 NNCKFHOMBDHGLA-VIFPVBQESA-N 449.105 4.620 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2-c1cnn(Cc2ccccc2)c1 2096786947 PGQFKCSXUCTCES-UHFFFAOYSA-N 430.737 4.518 50 10 IJGE CC(C)(C)OC(=O)N1CCCN(CC2(CBr)CCCCC2)CC(F)(F)C1 2106787725 KAOJTNYGEQYDCK-UHFFFAOYSA-N 439.385 4.910 50 10 IJGE CC(F)(F)C[C@H](CCl)Nc1ncc(C(F)(F)F)cc1I 2169538564 UREYDXREESJMSJ-SSDOTTSWSA-N 428.570 4.770 50 10 IJGE CC[C@H](Br)[C@@H]1CCCCN1S(=O)(=O)c1cc(Br)sc1C 2170612544 JCENSLXXHZOEBQ-QWRGUYRKSA-N 445.242 4.536 50 10 IJGE CN(Cc1cc(Cl)n(C)n1)c1cc(Br)cc(F)c1CBr 2170692624 SRGQPANMXNHROF-UHFFFAOYSA-N 425.527 4.506 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)CC[C@H](NC(=O)OC(C)(C)C)c1ccccc1 2196913157 CCAJYZDLZACCLV-JQHSSLGASA-N 439.394 4.665 50 10 IJGE CC[C@H](Br)CN(CC)C(=O)c1ccc(Cl)c(I)c1 2256384746 GWJNPKWPCJSOBV-JTQLQIEISA-N 444.538 4.580 50 10 IJGE CCCN(C[C@H](C)Br)C(=O)c1c(Br)cccc1Br 2259744037 ABDCBQSOLWWDAD-VIFPVBQESA-N 441.989 4.847 50 10 IJGE O=C(Nc1ccc(CBr)cc1)c1c(F)cccc1I 2267677087 MAFRHSKYOCUXEH-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE CC(C)(C)C1(O[C@H](CI)c2ccc(Br)cc2)COC1 2272932808 YIMBHMVZYVWNPX-CYBMUJFWSA-N 439.131 4.757 50 10 IJGE CC(C)(C)CCN(CCBr)C(=O)c1cccc(I)c1 2274143825 YIHQPUKLSGFHDC-UHFFFAOYSA-N 438.147 4.565 50 10 IJGE CC1(C)OC[C@@H](Cc2ccc(I)c(Br)c2)[C@@H]1Cl 2306216494 GUCCHFWBQQXDIB-SKDRFNHKSA-N 429.523 4.629 50 10 IJGE Clc1ccc(I)cc1CN[C@@H](CBr)CC1CC1 2307328086 JGNYQNITPUKCNP-GFCCVEGCSA-N 428.539 4.598 50 10 IJGE Cc1nc(Br)c(C[C@H](Br)c2cccc(Br)c2)n1C 2315519557 JYHXTLNPNSRTJI-NSHDSACASA-N 436.973 4.932 50 10 IJGE Cn1c(C(C#N)=Cc2cc(Br)cc(Br)c2O)nc2ccccc21 2331019763 WNCYDWOGPDNZMA-UHFFFAOYSA-N 433.103 4.868 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(O[C@H]2CCOc3ccccc32)C1 2340300323 XFENJBIVMNUGFK-PXNSSMCTSA-N 426.351 4.691 50 10 IJGE Clc1nccc(N2CC[C@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c1CBr 2344698325 JLUJHRQIQYJZAP-QZTJIDSGSA-N 434.809 4.978 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CCCN(C[C@]3(CBr)CC3(F)F)C2)C1 2351892675 SDXRIMPISIRZGT-ZWKOTPCHSA-N 437.369 4.520 50 10 IJGE CC[C@@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1 9874422 MCTGXALYZVQMRM-QRVBRYPASA-N 434.536 4.736 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc([N+](=O)[O-])cc2)CCC3)cc1 40812235 OJEBBTQILKAGOG-LGUFXXKBSA-N 446.463 4.527 50 10 IJGE Brc1ccccc1[C@H](CI)OC[C@@H]1CCCCO1 161968175 NVTFFMVTKMWZFF-FZMZJTMJSA-N 425.104 4.511 50 10 IJGE Cc1ccc(N2C(=O)c3ccc(C(=O)Nc4nc(CCl)cs4)cc3C2=O)c(C)c1 170535189 OLCCSZCDMROHMM-UHFFFAOYSA-N 425.897 4.552 50 10 IJGE CC[C@@](C)(CO[C@@H](CI)c1cccc(Br)c1)OC 319034466 BVJASZNWMHDSLR-KBPBESRZSA-N 427.120 4.757 50 10 IJGE CC[C@H](Cl)CCCNC(=O)c1cc(Br)ccc1I 398486163 ZPKGCXFQZDZVJJ-JTQLQIEISA-N 444.538 4.581 50 10 IJGE FC(F)Oc1cc(I)cc(CBr)c1C(F)(F)F 575723812 YECRDSNCBWADLH-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE C[C@H]1C[C@H](Br)CCN1C(=O)c1ccc(Br)cc1Br 705610501 CXOXSLKCRLLTMU-WCBMZHEXSA-N 439.973 4.600 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)c1C 736697032 RBBXVQBAAJHDEH-AWEZNQCLSA-N 426.524 4.518 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)cc2CC(=O)NNc2cccc(F)c2F)cc1 743724891 WEALFRGTCZZRPL-UHFFFAOYSA-N 434.446 4.512 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NCCCc2ccc(Cl)cc2)c(-c2ccccc2)n1 749624927 GOLCULIORDKHSZ-PGMHBOJBSA-N 443.938 4.773 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3cc(C(F)F)ccc3Cl)n[nH]2)cc1C 757734787 MPPLVLXVFXKKSH-UHFFFAOYSA-N 433.846 4.751 50 10 IJGE CCOc1ccc(NC(=O)CCC(=O)NN=Cc2cccc(OCc3ccccc3)c2)cc1 1084168396 JYWBWZZUWIZHJA-UHFFFAOYSA-N 445.519 4.533 50 10 IJGE COc1ccccc1C(=O)NN=C1C(=O)N(Cc2cccc3ccccc23)c2ccccc21 1084209219 VPZANEZBJQWQQF-UHFFFAOYSA-N 435.483 4.529 50 10 IJGE CC(=O)CCc1ccc2oc(C(=O)NNc3cc(F)ccc3Br)c(C)c2c1 1299430550 UCKGWAQXOAVXGL-UHFFFAOYSA-N 433.277 4.921 50 10 IJGE C[C@@H](Br)C(=O)c1cc(I)cc(SC(F)(F)F)c1 1848425877 LVELSUPFBWRAQL-RXMQYKEDSA-N 439.034 4.869 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@@H]2c1cccc(Br)c1 1865684277 PFKIYWNNGSHDFS-SFHVURJKSA-N 435.325 4.941 50 10 IJGE CCc1nn(Cc2ccc(C)cc2)c2c1[C@@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865704761 DBROXOLZYDDGNK-QHCPKHFHSA-N 428.536 4.808 50 10 IJGE C[C@@H](/C(O)=C(\C#N)c1nc(-c2ccc(Cl)cc2)cs1)N1C(=O)c2ccccc2C1=O 1872748466 YNSALCSKHXKXSQ-LCIOQVQZSA-N 435.892 4.941 50 10 IJGE C[C@H]1CN(c2ncc(Br)cc2Br)CC[C@H]1CCBr 2052374860 OEGDCDSSRGGVJW-VHSXEESVSA-N 441.005 4.854 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCN[C@H]1CCc2cc(Br)ccc21 2061263918 INZQQAALZKCZND-INIZCTEOSA-N 447.464 4.932 50 10 IJGE CC1(C)CCN(c2ncc(I)cc2Br)C[C@H]1CCl 2069531983 PIEFYPNQLVOPQJ-SECBINFHSA-N 443.554 4.540 50 10 IJGE Brc1cc2c(cc1[C@H](Br)[C@H]1C[C@H]1Br)OCCCO2 2076174836 XQSFLEITDXWPIM-WIMUKIRHSA-N 440.957 4.830 50 10 IJGE CC(=O)[C@H](Br)[C@H](C)c1ccc(C(F)(F)F)cc1I 2083649906 NHYBMOGTFIJWLF-KSBSHMNSSA-N 435.021 4.766 50 10 IJGE CCC(CC)(CBr)CN1C[C@@H](C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)C1 2106783776 COBWLEDGNFHTNF-ZIAGYGMSSA-N 445.364 4.823 50 10 IJGE COc1ccc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)CC(C)(C)C 2123272551 ZZAPLWZLXAOVFO-UHFFFAOYSA-N 440.403 4.827 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CCl)c1F)N(Cc1ccccc1)C[C@H]1CCCO1 2152215440 SPGVJDGJVCQART-QGZVFWFLSA-N 432.344 4.588 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@H]1Br)c1cc(Br)c(Cl)s1 2172565362 UEJDKWYMQGUCLA-SKDRFNHKSA-N 435.568 4.955 50 10 IJGE COc1ccc([C@@H](Br)c2ccsc2OC)cc1I 2257355123 HFGSUNAWNGMFAS-GFCCVEGCSA-N 439.112 4.854 50 10 IJGE CCCn1c(C)cc(C=C(C#N)C(=O)N[C@@H](CCSC)c2nc3ccccc3[nH]2)c1C 2297442874 FQEPYLXCAVSTEL-QFIPXVFZSA-N 435.597 4.909 50 10 IJGE Clc1ccc(CN2CCC[C@H](CBr)C2)c(I)c1 2302307271 NFDSHMVNQFGIQW-SNVBAGLBSA-N 428.539 4.552 50 10 IJGE C[C@@H]1C[C@@H](Br)CN(Cc2cc(I)ccc2Cl)C1 2307327524 BMSZJBVUOPFBMT-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE CCCN[C@@H](Cc1cc(Br)cc(Br)c1)[C@@H]1C[C@@H]1Br 2313495717 OYVMJDPUYKAONC-RDBSUJKOSA-N 440.017 4.906 50 10 IJGE Cn1cc(I)c(C[C@H]2CCC(C)(C)CC[C@H]2Br)n1 2319208497 VYPWXDJOYNXMHQ-GHMZBOCLSA-N 425.152 4.547 50 10 IJGE CCCCOc1ccc(C=NNC(=O)c2nn(-c3ccccc3)c3c2CCC3)cc1OCC 2323759371 REBNGOAGOWAVBH-UHFFFAOYSA-N 446.551 4.703 50 10 IJGE COc1ccc(NC(=O)C(C#N)=CNc2ccc(Cl)cc2C(F)(F)F)cc1OC 2324067945 XMFKZHJKMYTFNS-UHFFFAOYSA-N 425.794 4.834 50 10 IJGE CC[C@@H](NC(=O)C(C#N)=CNc1ccc([N+](=O)[O-])cc1OC)c1ccc2c(c1)CCCC2 2325081433 MVGOOALIUBAUDE-OAQYLSRUSA-N 434.496 4.569 50 10 IJGE FC1(F)C[C@@]1(CBr)CN1CCC2(CCN(Cc3ccccc3)CC2)CC1 2351889749 XRARESISGQIBFW-HXUWFJFHSA-N 427.377 4.785 50 10 IJGE CC[C@H](C)c1ccc(OCC(=O)NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1 13983231 VYNLHQLVGIYZJI-UONOGXRCSA-N 439.339 4.501 50 10 IJGE CCOc1ccc(Br)c(/C=N/NC(=O)[C@@H](C)Oc2cccc3ccccc23)c1 20176114 LTIDLBUASASKLT-LZCVXGSNSA-N 441.325 4.919 50 10 IJGE N#C/C(=C/c1cccn1-c1ccc([N+](=O)[O-])cc1)C(=O)Nc1sc2c(c1C#N)CCCC2 35518678 YBYIXHFILWBHOR-QINSGFPZSA-N 443.488 4.743 50 10 IJGE N#C/C(=C\Nc1ccc(C(N)=O)cc1)c1nc(-c2cc3cc(Cl)ccc3oc2=O)cs1 102934601 VHKSIAHVVAPFHR-GXDHUFHOSA-N 448.891 4.645 50 10 IJGE CC[C@H](Br)CCNC(=O)c1cc(Br)ccc1Br 161242948 ASWRPWPNVQTCPJ-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE COc1ccc([C@@H](C)NC(=O)/C(C#N)=C\N(Cc2ccccc2)Cc2ccccc2)cc1 217179275 DDJPUBYDBNGBSQ-VUSVCRIZSA-N 425.532 4.982 50 10 IJGE CS/C(N=CN(C)C)=C(\C#N)[P+](c1ccccc1)(c1ccccc1)c1ccccc1 254293308 UFDWTORMQBJKGO-BDPOBCKZSA-N 430.537 4.626 50 10 IJGE ClCc1nc2cc(Br)ccc2n1C[C@H]1CN(Cc2ccccc2)CCCO1 390597206 IXYHXWJJHBDTLP-GOSISDBHSA-N 448.792 4.829 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@@H]1CCC[C@@]12CC[C@H](CI)O2 686242772 SZQKDQKGSHMYJB-YYAJDYIMSA-N 449.373 4.929 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)c1cc(O)nc2ccc(Br)cc12 737484455 OKYAHXSBEJSRQP-UHFFFAOYSA-N 429.226 4.559 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)CCCn2ccc3cc(Cl)ccc32)c1C 760566790 HZHAGXDGBMXEQL-UHFFFAOYSA-N 434.931 4.687 50 10 IJGE CC(C)(C)OC(=O)COc1ccc(C=NNC(=O)CCSc2ccc(Cl)cc2)cc1 1084220367 VRJNSPTUHYPPJW-UHFFFAOYSA-N 448.972 4.693 50 10 IJGE COc1ccc(Cl)cc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccco1)CCC2 1772747376 PEIUNLABMSQKFP-UHFFFAOYSA-N 441.871 4.566 50 10 IJGE CCOc1ccc(OCC(=O)NN=Cc2ccc(OCc3ccccc3Cl)cc2)cc1 1772754844 YBTLJKXMULNUTD-UHFFFAOYSA-N 438.911 4.847 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccc(Cl)c(Cl)c2)[C@@H]1c1ccc[nH]1 1865710061 NLRVXCJCJCLJDE-ZDUSSCGKSA-N 440.212 4.744 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] 1915765770 PBBLAERHXXLPFA-UHFFFAOYSA-N 427.245 4.689 50 10 IJGE Clc1ccc(I)c(CN2CCC23CC(CBr)C3)c1 2042666376 GTZAYYHDZWWYSP-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE N#CC(=Cc1cc(Br)c(O)c(Br)c1)c1nc(O)c2ccccc2n1 2053528658 WSQUMABTRPTOSM-UHFFFAOYSA-N 447.086 4.630 50 10 IJGE CC1(C)CCCN(c2ncc(Br)cc2Br)[C@@H]1CBr 2065934381 WRPYICXOPVPEQX-LLVKDONJSA-N 441.005 4.997 50 10 IJGE CCC(CC)Cn1nc(CBr)c(I)c1C(F)(F)F 2079261339 MUAVJVPBTMANQJ-UHFFFAOYSA-N 439.057 4.838 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1[C@H]2CCC[C@H]1CN(Cc1ccccc1)C2 2125905648 BWOJZFVCWFVWBJ-HOTGVXAUSA-N 436.375 4.795 50 10 IJGE Oc1nc2ccc([C@@H](Br)Cc3ccccc3I)cc2o1 2143869113 WCPWWPMLFIIXLK-NSHDSACASA-N 444.066 4.817 50 10 IJGE Cc1sc(Br)cc1C(=O)NC[C@]1(F)CC[C@H](CBr)CC1 2178580586 DSGOTMBVJFDVAW-YPFXGUDJSA-N 427.177 4.842 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]21 2185533279 MONSMHKFLOIMBN-ZWKOTPCHSA-N 447.458 4.678 50 10 IJGE CCOCc1nnc(CC(CBr)(CBr)C2CCCC2)s1 2187478939 PTMLIDNYJOYZCO-UHFFFAOYSA-N 426.218 4.584 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H](C)N(c2ccc(CBr)c([N+](=O)[O-])c2)C1 2188576903 KEMYSLQNMPUKEY-IRXDYDNUSA-N 432.362 4.837 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@@H]1C[C@H](C(C)(C)C)CN(C(=O)OC(C)(C)C)C1 2196908357 XFGRECCYHAZLPH-WCXIOVBPSA-N 445.442 4.538 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@H]2C[C@@H]([C@H](F)CBr)C2)cc1Cl 2199059217 QSLSPHPFRSHONL-VYUIOLGVSA-N 427.539 4.652 50 10 IJGE O=[N+]([O-])c1cc(CBr)ccc1N1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1 2234719371 NFABKHJSAHTZJC-KDURUIRLSA-N 430.346 4.733 50 10 IJGE CC(C)(C)[C@H](CBr)CNC(=O)Cc1ccc(Br)cc1Cl 2237445422 FIZNIZMABOJFDL-LLVKDONJSA-N 425.592 4.818 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)Cc1cscc1S(C)(=O)=O 2250805204 XUJZCXKXQIUYHS-KRWDZBQOSA-N 430.433 4.573 50 10 IJGE N#CC(=Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)C(=O)NC1CCCCC1 2293665739 XONJUCCLOABVHC-UHFFFAOYSA-N 444.285 4.973 50 10 IJGE BrC[C@@H]1Cc2ccccc2CN1Cc1ccc(I)cc1 2296471192 FXMOIZFBAMBWCI-KRWDZBQOSA-N 442.138 4.613 50 10 IJGE CC[C@H](C[C@@H](C)Br)NC(=O)c1ccc(Cl)cc1I 2317767722 AJQMSJCMGSYUJJ-PSASIEDQSA-N 444.538 4.627 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)c(Cl)c1OC 2323168916 NCTGXHKWMCTNND-CYBMUJFWSA-N 425.916 4.727 50 10 IJGE CC1(C)C[C@H](CCl)N(Cc2ccc(I)c(Br)c2)C1 2325226389 NZYXAOYYHDCAEU-LLVKDONJSA-N 442.566 4.893 50 10 IJGE N#CC(=Cc1cccc(Cl)c1)C(=O)NC[C@H](c1c(F)cccc1Cl)N1CCCC1 2329684269 WEWCLZRDIALLEK-HXUWFJFHSA-N 432.326 4.993 50 10 IJGE CC1(C)COC[C@H]1CO[C@H](CI)c1ccccc1Br 2339010114 IXCJLQNWQNTTLB-SMDDNHRTSA-N 439.131 4.614 50 10 IJGE COc1ccc(/C=N\NC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc1Br 169917792 RTNUHRBJHQWQNU-FBHDLOMBSA-N 447.358 4.598 50 10 IJGE C[Si]1(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(CCCCl)O[Si](C)(C)O1 205974595 GPUKZSLCDNQBFV-UHFFFAOYSA-N 433.274 4.591 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C\Nc1ccc(Br)cc1)C12CC3CC(CC(C3)C1)C2 217025212 QQWDLEVBDRKKOI-ZTNMFLNZSA-N 428.374 4.990 50 10 IJGE C[C@@H](Br)C[C@@H](C)NC(=O)c1ccc(Br)cc1Br 235183252 CESYWNXRLJFPML-HTQZYQBOSA-N 427.962 4.503 50 10 IJGE O=C(NN=Cc1ccc2ccccc2c1)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 254466953 JAKZIMBUBOTKAV-UHFFFAOYSA-N 438.443 4.764 50 10 IJGE Cc1cc(C=NNC(=O)c2cccc(C(F)(F)F)c2)c(C)n1-c1ccc2c(c1)OCO2 254752132 ILRAETCZZDLBGQ-UHFFFAOYSA-N 429.398 4.606 50 10 IJGE Clc1ccc(C(CBr)(CBr)CO[C@@H]2CCCOC2)cc1 313029749 YSLHNUKTLISSET-CQSZACIVSA-N 426.576 4.563 50 10 IJGE CC[C@@H]1CN(C(=O)c2cc(Br)c(Br)s2)C[C@@H]1Br 399999730 MHANCYXZBKSAKX-SVRRBLITSA-N 446.002 4.519 50 10 IJGE BrCC1(CN2CC[C@@]3(CN(Cc4ccccc4)CCO3)C2)CCCCCC1 717536484 MDOWDLLUESZXHJ-HSZRJFAPSA-N 435.450 4.699 50 10 IJGE CCOc1cc(C=NNC(=O)CC[C@@H](O)c2ccccc2)ccc1OCc1ccc(C)cc1 725399308 XQBKWZXHBTXYRW-XMMPIXPASA-N 446.547 4.937 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)OCc2cc(Cl)ccc2OCC#N)c(C)n1CC(C)C 735338643 VIAFZGCGHZQGFB-GRSHGNNSSA-N 425.916 4.967 50 10 IJGE C[C@H]1CC(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)C[C@H](C)C1 739653728 DMBPIKDKWOKRRL-FUEBIDMXSA-N 435.959 4.965 50 10 IJGE O=C(Nc1ccccc1S[C@@H](Cl)C(F)(F)F)C(=O)N[C@H]1CCCC(F)(F)C1 768757096 PQJACTULUKPCHM-LKFCYVNXSA-N 430.826 4.539 50 10 IJGE Cc1ccc(-c2ccccc2)n1-c1ccc(C(=O)NN=Cc2ccc3c(c2)OCCO3)cc1 1083918733 LASPXZOFOFBAHK-UHFFFAOYSA-N 437.499 4.988 50 10 IJGE C=C[C@H](CO)NC(=O)Nc1cc(Br)ccc1CO[Si](C)(C)C(C)(C)C 1310784322 GQGLDVRDBLPXEI-OAHLLOKOSA-N 429.431 4.639 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3ccc(-n4ccc(O)n4)cc3)c2C)c1 1454280720 MCVYTBPBDSVIES-QNGOZBTKSA-N 437.503 4.840 50 10 IJGE CC(=O)N(c1cccc(Cl)c1)c1nc(CNC[C@]2(C)C[C@@H]2Br)cs1 1474640811 NTQHVQRZBTUKAF-RDJZCZTQSA-N 428.783 4.744 50 10 IJGE C=CCc1cc(C(=O)NNC(=O)Nc2ccc(-c3ccccc3)cc2)cc(OC)c1OC 1617603341 YQEVPJCHHYPBQB-UHFFFAOYSA-N 431.492 4.566 50 10 IJGE C#C[C@@H]1CCCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1 1643854230 JYUHHIVAJVCTGH-BDBXIWDTSA-N 425.454 4.892 50 10 IJGE COc1ccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4cccc(C)c4)c(C)c32)cc1 1772745495 CJFTVKKAXXTAOL-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE O=C(CSc1nc(-c2ccccc2)cs1)NN=Cc1ccc(Cl)c([N+](=O)[O-])c1 1772755165 RCXYBKBMVFWZCN-UHFFFAOYSA-N 432.914 4.614 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2)c1 1865694413 UVRIYOVLLSTARP-GOSISDBHSA-N 440.425 4.898 50 10 IJGE Cc1nn(-c2ccccc2)c2c1[C@H](c1ccc(OC(=O)c3ccccc3)cc1)C(C#N)=C(N)O2 1865704765 DFOHMAHJZVTSIB-XMMPIXPASA-N 448.482 4.618 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1cnsc1Br 1887458481 QLVXIEHZXBLMPH-NSHDSACASA-N 432.181 4.722 50 10 IJGE COc1cc(C(=O)N(Cc2ccccc2)C2(CBr)CCC2)cc(OC)c1C 1915749042 CTADJAITCMYDAE-UHFFFAOYSA-N 432.358 4.972 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1Cc1cccc(Br)c1Br 1943884212 PBJBCEDPBMNCOB-GXSJLCMTSA-N 425.990 4.959 50 10 IJGE CCN1CCC[C@H]([C@H](Br)c2cscc2OCc2ccccc2)S1(=O)=O 2038676929 LDNUXGNNBZRFCL-QZTJIDSGSA-N 444.416 4.577 50 10 IJGE Brc1ccc(CN2C[C@@H]3C[C@H](C[C@@H]3Br)C2)c(Br)c1 2045152913 CGZAUWKTVXKSEC-CDMKHQONSA-N 438.001 4.817 50 10 IJGE C[C@H]1C[C@@H](C(F)(F)F)N(CC(C)(C)CBr)CCN1C(=O)OC(C)(C)C 2058049375 MLULFDXEINGJCC-STQMWFEESA-N 431.337 4.670 50 10 IJGE CC1(C)CCN(c2ncc(I)cc2Br)C[C@@H]1CCl 2069531984 PIEFYPNQLVOPQJ-VIFPVBQESA-N 443.554 4.540 50 10 IJGE CC(C)(C)[C@H]1[C@H](Cl)CCN1c1ncc(I)cc1Br 2069532814 XIJZSLUCILQLIF-GHMZBOCLSA-N 443.554 4.681 50 10 IJGE CN(C[C@@H](Br)C(F)(F)F)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 2076788294 RHSHCDXMDJSETD-UONOGXRCSA-N 425.289 4.510 50 10 IJGE CCC(CC)(CBr)CN1CC[C@@H](C(F)(F)F)[C@@H](NC(=O)OC(C)(C)C)C1 2106783147 XHOVOEURZPTKQU-KGLIPLIRSA-N 445.364 4.965 50 10 IJGE CC(C)(C)[C@H]1C[C@@H](CCl)CN(C(=O)c2csc(I)c2)C1 2165006145 FYUFVDYBWOBAAH-JQWIXIFHSA-N 425.763 4.716 50 10 IJGE C[C@@H]1CN(C(=O)c2ccc(I)c(Cl)c2)CC[C@H]1CCCl 2172476001 RDEMDQAKIRNLKM-GHMZBOCLSA-N 426.125 4.672 50 10 IJGE CO[C@H]1C[C@H](Oc2c(Br)cc(Br)cc2CCl)C[C@H]1OC 2187175888 BPIZFQJYYOXSFQ-UOJUARBOSA-N 428.548 4.522 50 10 IJGE Cc1nc([C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)nc(O)c1CCCBr 2187360628 QNTRBGBSQIAJJR-LDLYASANSA-N 430.390 4.729 50 10 IJGE O=C(NC[C@]1(CBr)C[C@@H]1C(F)(F)F)c1ccccc1OCc1ccccc1 2192585221 ZJBONZFOVPSMRZ-PKOBYXMFSA-N 442.275 4.959 50 10 IJGE Fc1cc2nc(CCl)n(C[C@@]3(Br)CC3(F)F)c2cc1Br 2202503884 IFZDXPZBLLBPJV-NSHDSACASA-N 432.465 4.849 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C1CCCN(C(=O)OC(C)(C)C)CCC1 2241586114 QNIMUXGGDCMKNV-OAHLLOKOSA-N 435.403 4.702 50 10 IJGE C[C@]1(CBr)C=CCCN1Cc1cc(Cl)ccc1I 2253521620 XTKITRIUAIHHMO-CQSZACIVSA-N 440.550 4.860 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)C1CC(CBr)C1 2300237503 ZUKFATIWDGJAHD-UHFFFAOYSA-N 428.539 4.550 50 10 IJGE C[C@H](Br)CCCN(C)C(=O)c1ccc(Br)cc1Br 2314467868 YUAOVIKANKKVOI-VIFPVBQESA-N 441.989 4.847 50 10 IJGE CCC[C@@H]1CC[C@@H](Br)[C@@H](Cc2nn(C)cc2I)C1 2319222458 CYBZFPJBJVJPRU-IJLUTSLNSA-N 425.152 4.547 50 10 IJGE C[C@H]1[C@H](C)N(Cc2ccc(Cl)c(I)c2)CC[C@H]1Br 2321336559 XIGDWMOTOXKORG-JBLDHEPKSA-N 442.566 4.938 50 10 IJGE CCOc1cc(C=NNC(=O)Cc2cc(OC)ccc2Cl)cc(Cl)c1OC(C)C 2323676336 LCVNIFYNYYBSAC-UHFFFAOYSA-N 439.339 4.881 50 10 IJGE COc1c(Br)cc(C)c([C@H](Cl)[C@H]2OCCO[C@@H]2C)c1Br 2365176957 VFGIHRPNCXTFSB-JCOFBHIZSA-N 428.548 4.612 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1COC2(CCN(C[C@](C)(CBr)C(C)(C)C)CC2)C1 2380177580 WBKXDYPQJLDBTE-UZLBHIALSA-N 447.458 4.582 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C/c2ccc(OCC)cc2)c(OCC)c1 2886902 YZEODDNOEXRLCO-MSPZYCAZSA-N 435.476 4.573 50 10 IJGE Cc1c(C(=O)Oc2ccc3ccccc3c2)oc2c1/C(=N/NC(=O)c1ccncc1)CCC2 40813961 NQFPTODNCNVZQI-SGWCAAJKSA-N 439.471 4.826 50 10 IJGE C=CCNC(=O)/C(C#N)=C1\S[C@@H](Cc2ccc(C)c(C)c2)C(=O)N1c1ccc(CC)cc1 101241473 HQPFPKPDKGOTIJ-YDYXIROLSA-N 445.588 4.594 50 10 IJGE CC(=O)c1ccc(-c2ccc(/C=C3/C(=O)N(CCCOC(C)C)C(=O)C(C#N)=C3C)o2)cc1 101336278 SPLDBXBCZUDIMG-HYARGMPZSA-N 446.503 4.557 50 10 IJGE CC[C@H](NC(=O)/C(C#N)=C\N[C@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 217189431 CCDOGXUQFZICQM-ZDTIEKHLSA-N 447.579 4.908 50 10 IJGE CC(C)[C@H](CCBr)NC(=O)c1cc(Br)ccc1Br 231125027 ALQHYRDUBBKFAL-LBPRGKRZSA-N 441.989 4.751 50 10 IJGE COc1ccc2[nH]cc(C=NNC(=O)c3sc4nc(C)cc(C)c4c3-n3cccc3)c2c1 254633784 QGHFWIAVFIYPGU-UHFFFAOYSA-N 443.532 4.958 50 10 IJGE Fc1ccsc1[C@@H](Br)c1cc(I)cc2c1OCC2 310759827 MGWQASDLTBQTEL-NSHDSACASA-N 439.087 4.911 50 10 IJGE Cc1cc(S(=O)(=O)Nc2cccc(CCBr)c2)sc1Br 313162570 OLFQWOYQYNNKBJ-UHFFFAOYSA-N 439.194 4.557 50 10 IJGE CC(C)OCC(CBr)(CBr)c1ccc(Br)cc1 383434145 FBUNAFXEWZGINF-UHFFFAOYSA-N 428.990 4.902 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OCc2ncc(-c3ccccc3)o2)c(-c2ccccc2)n1 761403306 RBGUNCGDLHBIDX-STZFKDTASA-N 449.470 4.769 50 10 IJGE O=C(NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl)c1c[nH]c2cccc(F)c12 762193946 DQMMVNILOYTHJM-UHFFFAOYSA-N 430.814 4.611 50 10 IJGE Cc1cc(NC(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)n(-c2ccccc2C)n1 788051388 KLNDHXZXNRWSQY-DZSAKIAFSA-N 443.551 4.632 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCc2ccc(-c3csc(C)n3)cc2)c1C 790483180 CHJJMPPCSRGFEI-OYPWENPISA-N 448.592 4.968 50 10 IJGE N#Cc1ccc(NNC(=O)[C@H]2C[C@H]2c2ccccc2OC(F)(F)F)c(C(F)(F)F)c1 799750641 JSHIIQUXWMBHMK-STQMWFEESA-N 429.320 4.722 50 10 IJGE COc1cc(OC)cc(C(=O)Oc2ccc(/C=C(/C#N)C(=O)c3ccccc3)cc2OC)c1 915841358 GXDZGVLGIHYQSI-JAIQZWGSSA-N 443.455 4.721 50 10 IJGE COc1ccc(C(=O)NN=Cc2c(Br)c(C)n(-c3ccccc3C)c2C)cc1 1084095385 HVBCUEIVLRTQKO-UHFFFAOYSA-N 440.341 4.938 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)NCc2cc3ccccc3nc2O)c1C 1540171439 RPWLOKCAYCZSBF-HYARGMPZSA-N 436.515 4.880 50 10 IJGE Cc1ccc(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)cc1 1865707935 JUVPDQLZMXVFDW-QGZVFWFLSA-N 428.389 4.616 50 10 IJGE CCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccc(OC)cc1)C(C#N)=C(N)O2 1865712620 CVTQLIZFJLUMKG-IBGZPJMESA-N 441.318 4.968 50 10 IJGE Cc1ccc(SCCCC(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)nc2C)cc1 1865758071 HXPZAYHYDBEKHE-UHFFFAOYSA-N 437.540 4.838 50 10 IJGE COc1cc(/C=C(\C#N)c2nc3ccccc3[nH]2)ccc1OC(=O)c1cccc([N+](=O)[O-])c1 1872726884 SXGTVPVMOLCMAZ-GZTJUZNOSA-N 440.415 4.763 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N/N=C/c2ccc(-c3ccccc3Cl)o2)C1 1873499366 RJYUHGJXYJBSRA-GMJSKMFWSA-N 431.920 4.697 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(O[C@H]2COC3(CCCCC3)C2)C1 1879030687 VWCHYOOXPZJLPY-UZLBHIALSA-N 432.399 4.659 50 10 IJGE C[C@H]1CN(Cc2c(Br)cccc2Br)CC[C@H]1Br 1945333216 MYHHRYYXLMLRDI-GXSJLCMTSA-N 425.990 4.817 50 10 IJGE Brc1cccc(C[C@@H]2CCOCC[C@@H]2Br)c1Br 2001020155 AHVXOTBCMPQZEA-ONGXEEELSA-N 426.974 4.944 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3C[C@H](Br)C[C@H]3C2)c1 2065402932 MBGFNMKKEMSYOC-IAZYJMLFSA-N 440.550 4.550 50 10 IJGE CCC[C@H](Cl)CCNC(=O)c1ccc(Br)cc1I 2086145571 OFXHOPHHJCYMJU-JTQLQIEISA-N 444.538 4.581 50 10 IJGE CCCN1C[C@H](Cc2ccc(I)c(Cl)c2)[C@@H](Br)C1 2086651233 GMGJPDFAVFFBFF-RYUDHWBXSA-N 442.566 4.592 50 10 IJGE ClCCc1nc2cccc(Br)c2n1[C@]12C[C@@H]1CN(Cc1ccccc1)C2 2099679990 WKGBABOMPMAGDN-IERDGZPVSA-N 430.777 4.811 50 10 IJGE Cc1cc(S(=O)(=O)NC[C@@H](CBr)CC(C)(C)C)sc1Br 2156331784 VOTWGCIRYIDEOC-SNVBAGLBSA-N 447.258 4.545 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@H]2NC(=O)[C@@H](Br)C2CCCC2)C1 2167033044 PJZVICLIPAEIAZ-LLGFUMIMSA-N 443.426 4.626 50 10 IJGE CC1(C)CO[C@H](CBr)CN1Cc1ccc(Cl)c(Br)c1F 2167525079 SUYKOXFWGLYLDK-SNVBAGLBSA-N 429.555 4.616 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2Cc1ccn(Cc2ccccc2)n1 2184935994 QVNVXUBOXJMODV-UHFFFAOYSA-N 444.764 4.577 50 10 IJGE CC(C)(C)[C@H]1C[C@@H](S(=O)(=O)N(Cc2ccccc2)[C@@H](CBr)C2CC2)C1 2223706876 GBIYCVVYSOXATC-OTWHNJEPSA-N 428.436 4.817 50 10 IJGE FC(F)(F)CC1(CCl)CCN(C[C@H]2CC2(Br)Br)CC1 2224800443 HQHHBBIOHOUACD-SECBINFHSA-N 427.530 4.766 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1CCOCCF 2234057906 OJHNTKWHJNLOFM-QMMMGPOBSA-N 428.527 4.847 50 10 IJGE COc1cc(OC)c([C@H](Br)C2(Br)CC2)cc1Br 2252882514 GWSWASQTPFKFEK-NSHDSACASA-N 428.946 4.830 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CC2(CBr)CC(F)C2)Cc2ccccc21 2265632026 JUFFWKSTLXSBNI-RYZJOYRSSA-N 427.358 4.581 50 10 IJGE CCC[C@@H](CCBr)NCc1ccc(Cl)cc1I 2302317192 FBWPTOSJFDXTSM-LBPRGKRZSA-N 430.555 4.988 50 10 IJGE Clc1ccc(CNCCCCCCBr)c(I)c1 2302324971 CAWHDXXSVZVZMA-UHFFFAOYSA-N 430.555 4.990 50 10 IJGE CC(C)[C@H]1C[C@@H](Br)CN1Cc1ccc(Cl)c(I)c1 2321369927 WMSGEMOHJRVVRG-BXUZGUMPSA-N 442.566 4.938 50 10 IJGE N#CC(=CN1CCN(C(c2ccccc2)c2ccccc2)CC1)C(=O)Nc1ccc(F)cc1 2325198331 JPLAYYNJNWTRSA-UHFFFAOYSA-N 440.522 4.579 50 10 IJGE CC(C)N1C[C@@H](Br)[C@@H](Cc2cc(I)ccc2Cl)C1 2327395900 WZXMVDVWQRKYCQ-WCQYABFASA-N 442.566 4.591 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@]2(CBr)CC[C@H]1C2 2327396663 GFQXBWBQERIMOT-JSGCOSHPSA-N 440.550 4.694 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NN=Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1 2328828082 KSDWYAHVVFYOHU-IBGZPJMESA-N 445.604 4.837 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1C1CCN(C[C@]2(CBr)CC2(F)F)CC1 2351888539 XCSXELJUPVZSHA-MAUKXSAKSA-N 437.369 4.518 50 10 IJGE Cn1nc(Br)c(Br)c1C(=O)Nc1ccc(Cl)cc1CCl 2364011477 ABSUSJIJRVTMCA-UHFFFAOYSA-N 441.938 4.590 50 10 IJGE CCOc1ccc(/C=N/NC(=O)COc2ccc(C(C)(C)C)cc2Br)cc1 12403441 SMQXKHPPQACVGS-YDZHTSKRSA-N 433.346 4.674 50 10 IJGE CCOc1ccc(/C=N/NC(=O)CSc2nc(-c3ccccc3)cs2)cc1OCC 40924457 AZBQEKGPPDPGAS-YDZHTSKRSA-N 441.578 4.850 50 10 IJGE BrCC(CBr)(COCC1CC1)c1ccc(Br)cc1 232468962 QBNHPUCQJREJAF-UHFFFAOYSA-N 441.001 4.903 50 10 IJGE CCCO[C@H]1[C@@H](Oc2cc(Br)c(OC)cc2Br)C[C@H]1Cl 233241387 JZYBJJGWXSOCJC-DDTOSNHZSA-N 428.548 4.774 50 10 IJGE O=C(NN=Cc1cccc(I)c1)c1cc2c(ccc3ccccc32)o1 252599894 DMIODNQREFDGEM-UHFFFAOYSA-N 440.240 4.955 50 10 IJGE CC1(C)CC[C@@H](CCl)N(C(=O)c2cc(Cl)ccc2I)C1 701593850 FATDEFPRTGHYPV-NSHDSACASA-N 426.125 4.814 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@@]2(CN(Cc3ccccc3)CCO2)C1 717534855 HPLZPEWAJOIBDB-HSZRJFAPSA-N 437.466 4.945 50 10 IJGE COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NN=C(C)CCC2CCCC2)c1 740759829 ASSXIRAVQPXLAD-UHFFFAOYSA-N 443.569 4.572 50 10 IJGE N#Cc1ccc(NNC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)cc1C(F)(F)F 746891790 KCEHJZVERZINEG-ZIAGYGMSSA-N 429.320 4.722 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2CCc3c(Cl)cccc32)c(-c2ccccc2)n1 757202664 HLBBWWDKVWNTSW-JXAWBTAJSA-N 427.895 4.613 50 10 IJGE COc1ccc(CNS(=O)(=O)c2cccc(S(F)(F)(F)(F)F)c2)cc1C#N 778010325 VKIWZYQWTAFONL-UHFFFAOYSA-N 428.404 4.703 50 10 IJGE C[C@@]12CC[C@H]3c4ccc(O)c(Br)c4CC[C@@H]3[C@H]1C[C@H](Br)C2=O 1085211396 WALNGSHUZXVAOU-CJMBTWRPSA-N 428.164 4.953 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)[C@H](Oc2cccc(C(C)C)c2)c2ccccc2)c1 1154050521 PRJDJCORTPPOCB-XMMPIXPASA-N 443.572 4.929 50 10 IJGE O=S(=O)(c1cccc(Cl)c1)N(Cc1ccccc1)C1(CBr)CCC1 1915749715 BAVAFDWZCOIPHN-UHFFFAOYSA-N 428.779 4.849 50 10 IJGE CN(C[C@]1(C(C)(C)C)CCC[C@@H](CI)O1)C(=O)OC(C)(C)C 1929975172 PCISIVFRMKTFOE-GUYCJALGSA-N 425.351 4.642 50 10 IJGE CC(C)CC(CBr)(CBr)Cc1cnn(C)c1Br 2005316053 YZEQRLBHGKSTQJ-UHFFFAOYSA-N 431.010 4.547 50 10 IJGE CCC(CC)(CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1 2044693243 JANOJUPWXQIPGZ-CHWSQXEVSA-N 431.337 4.575 50 10 IJGE Cc1nc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)sc1CBr 2066627228 KJHIPIGZNXXKNO-HNNXBMFYSA-N 434.325 4.600 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCCN(c2cc(CCl)c(Br)cn2)C1 2096465019 JBVDGSGEXRNNIW-UHFFFAOYSA-N 444.751 4.931 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(C[C@H](CBr)c2ccccc2)C1 2106783968 DZAIFUQVHXZPOU-WDSOQIARSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CC2(CBr)CCC2)CC[C@H]1C(F)(F)F 2106785312 OOXVHGMDJKWGTF-UONOGXRCSA-N 443.348 4.577 50 10 IJGE CCC(CC)(CBr)CN1C[C@H]2CC[C@H]1[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]21 2106788016 MFZNLYYGKOTNNM-BDXSIMOUSA-N 429.443 4.765 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CNC(=O)CCCCBr)CCCC[C@H]12 2108946797 LQNYYUGGZCKHCV-JXFKEZNVSA-N 431.415 4.628 50 10 IJGE COC[C@@H](C)CCO[C@@](C)(CI)c1ccccc1Br 2130878673 FEYWDMFKEBUOMO-WFASDCNBSA-N 441.147 4.789 50 10 IJGE CCC(CC)(CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)CCC12CCOCC2 2193498791 XRIKTVUUTYWZDT-KRWDZBQOSA-N 447.458 4.726 50 10 IJGE CC1(C)C[C@](C)(CCl)CN1C(=O)c1cc(Cl)ccc1I 2199537639 DILHBUBVWCGKPF-OAHLLOKOSA-N 426.125 4.814 50 10 IJGE ClCc1nc2cc(Cl)c(Br)cc2n1Cc1conc1Br 2239108803 PMWBQFPRELMJIK-UHFFFAOYSA-N 439.922 4.990 50 10 IJGE CCO[C@@H]1C[C@H]1[C@@H](Br)Cc1cc(Br)cc(Br)c1 2252837343 OAVMJGQZSWJZCA-RWMBFGLXSA-N 426.974 4.943 50 10 IJGE COCc1ccc([C@@H](Br)c2ccc(OC)c(I)c2)cc1 2285001832 IEISOAASHOERRO-MRXNPFEDSA-N 447.110 4.931 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@@H](C)C1Br 2285959035 OHYSGQDYIWOYOK-HTQZYQBOSA-N 427.539 4.733 50 10 IJGE C[C@H](Br)C12CCC(CC1)N2Cc1sccc1I 2301076881 QUQLBALEUOWQBG-JBLZRFIASA-N 426.161 4.633 50 10 IJGE COc1cc(C=NNC(=O)c2cc3ccccc3n2C)ccc1OCc1ccccc1F 2323739175 PRCQHEWMIUIQLE-UHFFFAOYSA-N 431.467 4.669 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)n2)cc1C 2331259264 IKPZUTDCSJIBND-LJQANCHMSA-N 445.544 4.969 50 10 IJGE Cc1cc(C(=O)N2CC[C@@H](Br)C[C@@H]2C(F)(F)F)c(Br)s1 2361459961 BIGRQGIWPJKSIQ-VXNVDRBHSA-N 435.103 4.749 50 10 IJGE Cc1scc(C(=O)N2CC[C@@H](Br)C[C@@H]2C(F)(F)F)c1Br 2369596639 QXBHMZWIXMCVJQ-VXNVDRBHSA-N 435.103 4.749 50 10 IJGE CC(C)(C)OC(=O)NCc1cccc2c1N(C[C@]1(CBr)CC1(F)F)CCC2 2379986746 WPMXJLGBNNXPJY-LJQANCHMSA-N 445.348 4.884 50 10 IJGE CCN(C(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(O)cc1)CCC2)c1cccc(C)c1 40812101 XZOCMJLMTUELEG-SZXQPVLSSA-N 445.519 4.739 50 10 IJGE COC(=O)/C(C#N)=C\c1cccc(OC(=O)/C=C/c2ccc(OCc3ccccc3)cc2)c1 98028247 WTRFPSQAKJUFCF-WULFHVAMSA-N 439.467 4.964 50 10 IJGE CC(C)n1ncnc1CC(CBr)(CBr)c1ccc(Cl)cc1 118876984 JDYMEONSFGMOLQ-UHFFFAOYSA-N 435.591 4.783 50 10 IJGE C[C@H]1CCc2[nH]c3ccc(C(=O)N/N=C\c4cc(Cl)c(O)c(Cl)c4O)cc3c2C1 169891419 CMQYGSXFDYTBLE-VOBWUGTDSA-N 432.307 4.775 50 10 IJGE O=C(N/N=C\c1ccccc1Cl)c1cccn(Cc2ccc(Cl)c(Cl)c2)c1=O 169920486 HYSQVSSHKVQYNH-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)COc2ccc(C(C)C)c(C)c2)cc1 207141950 VJLBJHHQGRYIRR-QNGOZBTKSA-N 434.536 4.926 50 10 IJGE C[C@H]1CCC[C@@](CCl)(NC(=O)c2ccc(I)c(Cl)c2)C1 232348700 JHBBEBXCRWFTAP-ZUZCIYMTSA-N 426.125 4.862 50 10 IJGE O=C(NN=Cc1ccccc1Cl)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1 254290024 HXBNQAKPQNXRRA-UHFFFAOYSA-N 448.331 4.558 50 10 IJGE CC[C@@H](Br)C(=O)Nc1c(Br)cc(Cl)cc1Br 300843143 KDGKELZRYGOYEN-ZCFIWIBFSA-N 434.353 4.977 50 10 IJGE CC(C)[C@](C)(CBr)NC(=O)c1cc(Br)ccc1Br 398568241 OTNYQDJKJZPLMJ-ZDUSSCGKSA-N 441.989 4.751 50 10 IJGE C[C@H]1CN(Cc2cc(Cl)ccc2I)C[C@@]1(C)CBr 694632291 LCOZJIGOVRVBRW-IINYFYTJSA-N 442.566 4.798 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc(Oc3ccc(F)cc3)cc2)c1C 736694120 OUMONVPXMZVEKY-UHFFFAOYSA-N 429.455 4.844 50 10 IJGE CCC(CC)(C(=O)NNc1ccc(S(C)(=O)=O)cc1)c1ccc(Cl)c(Cl)c1 748147000 JTWYDFJOGQIKCP-UHFFFAOYSA-N 429.369 4.598 50 10 IJGE COc1ccc(NNC(=O)Nc2ccc(Oc3nncc4ccccc34)c(Cl)c2)nc1 782057749 FJXATWDUJUXDKL-UHFFFAOYSA-N 436.859 4.628 50 10 IJGE CC(C)c1ccc(S(=O)(=O)c2ccc(NNC(=O)c3nc(Cl)cs3)cc2)cc1 790511941 DYKDHCLGLVNPKD-UHFFFAOYSA-N 435.958 4.510 50 10 IJGE CCOc1cc(C=NNC(=O)CNc2ccccc2)ccc1OCc1ccccc1Cl 1084115621 OKBTXDXFBVHOBP-UHFFFAOYSA-N 437.927 4.880 50 10 IJGE Cc1cc(N2CCCC2)ccc1C=NNC(=O)CN(Cc1ccccc1)Cc1ccccc1 1084405123 WGFXBMYSPNTCGB-UHFFFAOYSA-N 440.591 4.748 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNc2c(Cl)cccc2Br)c(O)n1 1306869525 AVYWYEGRXJRJFO-UHFFFAOYSA-N 448.704 4.636 50 10 IJGE C=C(C)c1cccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)c1 1311298046 HUYXRZQGJATYRN-UHFFFAOYSA-N 431.492 4.530 50 10 IJGE C#CCOc1ccccc1CNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2)c1C 1444159171 LRPOMIIEMJUELU-HYARGMPZSA-N 443.934 4.983 50 10 IJGE CC(=O)N(C)c1ccc(CNC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(C)cc3)c2C)cc1 1532492139 JGWLQYLCQMVQPD-BUVRLJJBSA-N 440.547 4.609 50 10 IJGE CCOc1ccc(-c2nc(CC(=O)NNc3nc4ccccc4[nH]c3=S)cs2)cc1 1633439378 GYCCATQQVGBCDA-UHFFFAOYSA-N 437.550 4.500 50 10 IJGE C=CCN(CC=C)C(=O)c1ccc(NC(=O)NNc2nc3ccc(Cl)cc3s2)cc1 1658659228 REBMGGANCKMIIU-UHFFFAOYSA-N 441.944 4.913 50 10 IJGE N#CSc1ccc(NC(=O)C2CCN(C(=O)c3ccc(Br)cc3)CC2)cc1 1860588220 NFCCLHQUJHXFML-UHFFFAOYSA-N 444.354 4.513 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2Cl)[C@H]1c1ccccn1 1865699709 AOFHFKRCXURTPU-HXUWFJFHSA-N 425.879 4.806 50 10 IJGE N#C/C(=C\c1cccc(Cl)c1)C(=O)NC[C@H](c1c(F)cccc1Cl)N1CCCC1 1866130008 WEWCLZRDIALLEK-MBNYPGIVSA-N 432.326 4.993 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1cccc(Br)c1 1866130919 SOBRCPCLRFWVGX-FOWTUZBSSA-N 427.298 4.952 50 10 IJGE N#C/C(=C\c1cccc(Br)c1)C(=O)Nc1nc2ccc([N+](=O)[O-])cc2s1 1866131714 KIAAYUJOQRYOGW-IZZDOVSWSA-N 429.255 4.513 50 10 IJGE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1ccccc1OCc1ccccc1 1873794319 DFADIXRJMSYCCT-VSQKZVHOSA-N 439.556 4.655 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)Cc1cnn(Cc2ccccc2)c1 1915739252 WSCXXNHCMGEDDL-UHFFFAOYSA-N 440.385 4.676 50 10 IJGE C[C@H]1[C@H](Br)CCCN1Cc1cccc(Br)c1Br 1943880962 MFTQJWBARYDQTP-GXSJLCMTSA-N 425.990 4.959 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1nc(C)ccc1Br 1980431011 VPAHQEURRKCAMH-HNNXBMFYSA-N 440.179 4.968 50 10 IJGE CS(=O)(=O)C1([C@@H](Cl)c2c(Br)sc(Br)c2Cl)CC1 2002553208 XVVVKFIQTCHROF-LURJTMIESA-N 443.009 4.784 50 10 IJGE CN(Cc1cc(Br)ccc1Br)[C@H]1CCC[C@H]1Br 2006498097 AXIHQQBLYUZXNW-OLZOCXBDSA-N 425.990 4.959 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1C(=O)c1csc(Br)c1Br 2018120081 WCMQEPFWOCKSAM-SVRRBLITSA-N 446.002 4.661 50 10 IJGE C[C@]1(CBr)C[C@H](NC(=O)c2cc(Br)cc(Br)c2)C1 2059454455 IUIWHSREPGPVGO-AULYBMBSSA-N 439.973 4.505 50 10 IJGE FC(F)c1c(I)cc(CCl)cc1I 2060235664 KEDBRRPOXAUKFZ-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE CN(c1ncc(I)cc1Br)[C@H]1CCCCC[C@H]1Cl 2069528694 LEHVMOYCQVMZBJ-NEPJUHHUSA-N 443.554 4.825 50 10 IJGE CN(c1ncc(I)cc1Br)C1(CCl)CC(C)(C)C1 2069538518 YXVAJHVGXNLTRR-UHFFFAOYSA-N 443.554 4.683 50 10 IJGE O=C(c1csc(Br)c1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Cl)C2 2134140185 YCWUMMOYDFDWFY-BNJNZJEJSA-N 431.552 4.596 50 10 IJGE Cn1ncc(Br)c1CC(CCl)(CCl)c1ccc(Br)cc1 2143634467 NQGWEOBFHNOHBZ-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE CCC(CC)[C@@H](Br)CNS(=O)(=O)c1c(C)sc(C)c1Br 2143912529 GIAXOAVOGJSREV-NSHDSACASA-N 447.258 4.605 50 10 IJGE COc1cc(F)c(Br)cc1[C@@H](Cl)c1c(Br)nn(C)c1C 2188146122 UXUDGCJLIMVHTN-GFCCVEGCSA-N 426.511 4.729 50 10 IJGE CC(C)(C)OC(=O)NCCCC[S@@](C)(=O)=NCCCCCCCBr 2252613283 RLJICSFQHCTCFN-XMMPIXPASA-N 427.449 4.735 50 10 IJGE CN(C(=O)c1cc(F)c(Br)cc1Cl)[C@@H](CBr)CC1CC1 2282972753 TYMYMSJBDMRVIL-SECBINFHSA-N 427.539 4.877 50 10 IJGE COc1ccc(NC(=O)C(C#N)=Cc2c(C)nn(-c3ccc(F)cc3)c2Cl)cc1OC 2297382113 DATUERXJNUTOBB-UHFFFAOYSA-N 440.862 4.536 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1NC(=O)C(C#N)=Cc1ccc(-c2ccc([N+](=O)[O-])cc2C)o1 2297551317 ADBKLJBWMSFYEU-UHFFFAOYSA-N 432.392 4.926 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)s1 2300953537 KNSVWDFOLQYMSV-NREIWNPNSA-N 445.547 4.866 50 10 IJGE CC[C@@H](Cl)CCCNCc1ccc(I)c(Br)c1 2306219144 IYLHEESSFKUCKR-LLVKDONJSA-N 430.555 4.941 50 10 IJGE CN(C)C(=O)C(C#N)=Cc1cc(Cl)c(OCc2cccc(F)c2)c(Br)c1 2313567124 GTNJKOLNDAANRF-UHFFFAOYSA-N 437.696 4.816 50 10 IJGE C=CCN1C(=O)C(=Cc2ccc(OCc3ccc(Cl)cc3)c(OC)c2)C(C)=C(C#N)C1=O 2314616784 JTGUAPILYKDRSP-UHFFFAOYSA-N 448.906 4.706 50 10 IJGE CCCCCOc1c(OC)cc(C=NNC(=O)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] 2318414805 HNDKBBITCSGKJB-UHFFFAOYSA-N 433.892 4.519 50 10 IJGE COc1cccc(-c2ccc(C(=O)NN=C(C)c3ccc(Br)cc3)c(C)n2)c1 2321275791 HKKLWHOKMFMPHN-UHFFFAOYSA-N 438.325 4.982 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1[C@H]2CCC[C@H]2C[C@@H]1CCl 2329613139 UJDMSSALWMHSMP-XKSSXDPKSA-N 427.589 4.895 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CCN(C[C@@]2(CBr)CC2(F)F)c2ccccc21 2379984539 MYFLZOMZNDVESQ-KUHUBIRLSA-N 445.348 4.925 50 10 IJGE Cc1cc(=O)oc2cc(N/C=C(/C#N)c3nc(-c4ccc5c(c4)OCO5)cs3)ccc12 1803198 RPNVJAVUBZRVPW-GDNBJRDFSA-N 429.457 4.930 50 10 IJGE CCN(C(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(F)cc1)CCC2)c1ccccc1 40811955 OYVWRQDVOPHWRS-NHFJDJAPSA-N 433.483 4.864 50 10 IJGE Cc1c(C(=O)NCCC(C)C)oc2c1/C(=N/NC(=O)c1cccc3ccccc13)CCC2 40813633 NKQBXKFDFWKBHU-SGWCAAJKSA-N 431.536 4.988 50 10 IJGE O=C(CCCSc1nc2ccc([N+](=O)[O-])cc2s1)N/N=C/c1ccc(Cl)cc1 58989426 HZXYGMVKADDWDO-RGVLZGJSSA-N 434.930 4.881 50 10 IJGE COc1cc(/C=N/NC(=O)c2cc3ccccc3o2)ccc1OCc1cccc([N+](=O)[O-])c1 59304045 BOMMHXQOEXZLGJ-AFUMVMLFSA-N 445.431 4.693 50 10 IJGE CCOc1cc(/C=C(/C#N)c2nc3cc(C)ccc3[nH]2)ccc1OCC(=O)N(CC)CC 169942255 MTVAQGXIYUATME-UYRXBGFRSA-N 432.524 4.581 50 10 IJGE ClCc1cc2sccc2c(I)c1I 306606944 HRPXTDATYASMQQ-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE C[C@H]1CC[C@H](Br)CN1C(=O)c1cc(Br)ccc1Br 399441784 WJLFPDPZQYAKDE-WPRPVWTQSA-N 439.973 4.600 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@H]2C[C@H](Cl)CC[C@H]2C1 705436558 AIOITVOGIBOPTC-DJLDLDEBSA-N 427.589 4.753 50 10 IJGE CC[C@@H]1CN(C(=O)c2scc(Br)c2Br)C[C@H]1Br 705442203 MUFVQPFLVHHJKJ-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE O=C(NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)[C@@H]1C[C@H]1c1cccc2ccccc12 734259818 CIBRPJHNJCKVJG-ZWKOTPCHSA-N 449.436 4.957 50 10 IJGE O=C(NCc1ccn(C2CCCC2)n1)C(=O)Nc1cccc(S(F)(F)(F)(F)F)c1 762669514 OQUTTZFVITZMFU-UHFFFAOYSA-N 438.422 4.911 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)c1[nH]ccc1-c1c(Cl)cccc1Cl 799592961 SWGDXACETPNKEH-UHFFFAOYSA-N 425.275 4.612 50 10 IJGE COc1cc(C=NNC(=O)c2cccc(Cl)c2)ccc1Oc1ccccc1[N+](=O)[O-] 1084412945 WVVHPZSAVGMRKO-UHFFFAOYSA-N 425.828 4.813 50 10 IJGE COc1ccc(COc2ccc(C=NNC(=O)CCCNc3ccc(Cl)cc3)o2)cc1 1084434054 DPXUGLHLJFXTEA-UHFFFAOYSA-N 441.915 4.863 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)O[C@@H]3N=C(/C(C#N)=C/c4ccc(Cl)cc4)S[C@@H]32)cc1 1088740827 VTBXPKSDIVVDMG-HDZYQILWSA-N 448.935 4.603 50 10 IJGE C=CCCOCCCCC(=O)NNC(=O)c1cc(-c2ccc(C)cc2)nc2ccccc12 1347919695 LDTUDYGMUHDPGN-UHFFFAOYSA-N 431.536 4.734 50 10 IJGE CC[C@@H](C(=O)NNc1nc(-c2cccnc2)nc(C)c1C)c1ccc(Br)cc1 1457667922 DASFLEAICASAJD-GOSISDBHSA-N 440.345 4.555 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2cccc(F)c2)cc1 1865693041 RAFZXIUOSNDUHH-HSZRJFAPSA-N 432.499 4.776 50 10 IJGE O=C(c1cc(I)sn1)N(Cc1ccccc1)C1(CCl)CCC1 1909915907 ZVNZAYFMBKPNQB-UHFFFAOYSA-N 446.741 4.552 50 10 IJGE IC[C@H]1CCC[C@@]2(CN(Cc3ccccc3)C3(CCCC3)C2)O1 1939534595 CYHWHSYVHRKIOY-UYAOXDASSA-N 425.354 4.948 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1Cc1ccc(Br)cc1Br 1943859445 PCQCZWKMNRZHNC-SKDRFNHKSA-N 425.990 4.959 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1cscc1OCc1ccccc1 1993390811 LDAYWWKDAYIDLM-XJKSGUPXSA-N 443.350 4.907 50 10 IJGE ClC[C@H]1CC[C@H](Nc2ncc(I)cc2Br)CC1 2015763243 WFKBAIARLUFBLD-CZMCAQCFSA-N 429.527 4.658 50 10 IJGE O=C(NC1(CCCBr)CC1)c1cc(Br)cc(Br)c1 2029622035 PUWDKRVSJHKHMB-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE CC1(C)C[C@@H](CBr)N(Cc2cc(Cl)ccc2I)C1 2033714031 AESAXWUTRXCHPP-LBPRGKRZSA-N 442.566 4.940 50 10 IJGE CC[C@H](CCCBr)NC(=O)c1cccc(Br)c1Br 2036512181 ZMTGMZSNMZNIKD-SECBINFHSA-N 441.989 4.895 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CCSC[C@@H]1CCBr 2052454661 UWHLIWFZATUNPJ-ZETCQYMHSA-N 433.618 4.507 50 10 IJGE COc1cc(C)ccc1-n1nc(CBr)c(Br)c1C(F)(F)F 2079238769 IAAMRSSSHQZMLI-UHFFFAOYSA-N 428.046 4.866 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CCN(C[C@H](Br)C(F)(F)F)c2ccccc21 2106782856 USZCNWMVQDUCHK-DOMZBBRYSA-N 437.300 4.831 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@H](Cl)c2sc(Br)cc2Br)C1 2137239062 PHEZFEIXNJBHNQ-BPTDKIDVSA-N 448.629 4.768 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2ccc(CBr)cc2)CC12CCC2 2162496407 ZHLCRNVOIWKUMX-KRWDZBQOSA-N 437.378 4.634 50 10 IJGE CCCN(C1CCCC1)S(=O)(=O)c1cc(CBr)sc1Br 2179785379 LETVNCDGRGWXMF-UHFFFAOYSA-N 445.242 4.749 50 10 IJGE COC[C@]1([C@H](Br)c2cc(Br)c(OC)cc2Cl)CCCO1 2202367850 YYVCXYMDEHNYJK-KGLIPLIRSA-N 428.548 4.743 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1c(Br)cccc1C#N 2248966757 OEMZVCIGVWVZNI-UHFFFAOYSA-N 432.409 4.639 50 10 IJGE CC(C)([C@@H](Br)c1cc2sc(Br)cc2s1)S(C)(=O)=O 2263562731 FGFLOHBZIRPOJP-JTQLQIEISA-N 432.224 4.985 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc(OC(F)F)cc2)sc2c1CCCC2 2297382252 HIQZOLZBGCPQHF-UHFFFAOYSA-N 446.475 4.951 50 10 IJGE ClCc1csc(OCc2ccc(I)c(Br)c2)n1 2306304227 CJIZADJNROPJIQ-UHFFFAOYSA-N 444.519 4.828 50 10 IJGE COCCCN1C(=O)C(=Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)C(C)=C(C#N)C1=O 2314618625 QOQBCNJXEXJFMH-UHFFFAOYSA-N 445.302 4.882 50 10 IJGE O=C(Cc1ccc(Cl)cc1)NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21 2326838974 CMURMBOYEHWMJH-UHFFFAOYSA-N 438.314 4.603 50 10 IJGE CCOC(=O)c1cnn(-c2ccc(C)cc2)c1NC(=O)C(C#N)=Cc1ccc(Cl)cc1 2329654462 MPXSGISNBOABFV-UHFFFAOYSA-N 434.883 4.557 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@H](CNC(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1 2353830104 JQWDGJWTPGHUBP-ILXRZTDVSA-N 445.364 4.679 50 10 IJGE CC[C@H](C)c1ccc(OCC(=O)NNC(=O)c2cccc(OCCc3ccccc3)c2)cc1 10331726 COHISVZDHURRDE-FQEVSTJZSA-N 446.547 4.662 50 10 IJGE CCc1ccc(OCC(=O)N/N=C/c2c(Cl)cccc2Cl)c(Br)c1 13977547 MBZOLCWTYDTFFN-ZVBGSRNCSA-N 430.129 4.847 50 10 IJGE C=CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(F)cc4)ccc32)c1 38684519 LEALWICSJPLADK-XMMPIXPASA-N 442.446 4.828 50 10 IJGE COc1ccccc1NC(=O)/C(C#N)=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21 59146079 LNZHCRJROPQXQN-NKFKGCMQSA-N 443.890 4.811 50 10 IJGE O=C(CCC(=O)Nc1ccc(Cl)cc1Cl)NN=Cc1ccc(Br)s1 252459966 AMHFVBGLEZYQQH-UHFFFAOYSA-N 449.157 4.686 50 10 IJGE O=C(NN=Cc1cc(Br)c(O)cc1O)c1cc2c(ccc3ccccc32)o1 252628435 SQHFOZQUQMEZTE-UHFFFAOYSA-N 425.238 4.524 50 10 IJGE CCCOc1ccc(Br)cc1C=NNC(=O)c1ccc(Br)cc1 254749161 OAURNZRTDPRDOH-UHFFFAOYSA-N 440.135 4.764 50 10 IJGE ClCc1c(I)c(I)cc2sccc12 307185276 HRTSVZYSXLDOBZ-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE O=C(c1ccc(I)c(Cl)c1)N1CCC(CCCCl)CC1 401005297 BILGYSLXMXITSO-UHFFFAOYSA-N 426.125 4.816 50 10 IJGE C[C@H]1CN(c2ccc([N+](=O)[O-])c(CBr)c2)[C@H](C)[C@H](C)N1Cc1ccccc1 404289078 UCIWFFUQEFYXSY-YESZJQIVSA-N 432.362 4.977 50 10 IJGE C[C@@H]1[C@H]2CC[C@@H](C[C@]13CCC[C@H](CI)O3)N2C(=O)OC(C)(C)C 686237938 UODORMZWPHZNQH-KQVLKZGSSA-N 435.346 4.537 50 10 IJGE C[C@@H](CBr)CCCNC(=O)c1scc(Br)c1Br 705402109 TUNDATGYRSOMGG-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE CN(C[C@H]1CCCCN1Cc1ccccc1)c1ccc(CBr)cc1[N+](=O)[O-] 720017109 QHCNUXNUPBTLPU-LJQANCHMSA-N 432.362 4.981 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@H]2CC[C@@H](Cl)[C@H]1C2 721564267 XNXPMPYYCXHVCX-SZEHBUNVSA-N 427.589 4.895 50 10 IJGE Cc1ccc(SCC(F)(F)F)c(NC(=O)NNC(=O)c2cccc3cccnc23)c1 756663479 JCSKCVSNQXMMDT-UHFFFAOYSA-N 434.443 4.664 50 10 IJGE O=C(NCCOc1ccc(F)cc1F)C(=O)Nc1cccc(S(F)(F)(F)(F)F)c1 762655396 MHOCIDXBCBPMPH-UHFFFAOYSA-N 446.344 4.756 50 10 IJGE O=C(NNc1cccc(F)c1F)C(=O)Nc1ccc(Sc2ccc(Cl)cc2)cc1 785012599 FKAYECWIBUGIMK-UHFFFAOYSA-N 433.867 4.851 50 10 IJGE O=C(NN=C/C=C/c1ccccc1)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1 886005294 WGKLJUJAFSGPNM-UQYZDNHMSA-N 439.924 4.570 50 10 IJGE C/C(=C\c1ccc(Br)o1)C(=O)NNC(=O)Nc1ccc(Cl)cc1Cl 1467439884 RDJBLBFREZPKHP-SOFGYWHQSA-N 433.089 4.605 50 10 IJGE C/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1 1521231151 WDIMGDMSUBUGDX-JQIJEIRASA-N 438.886 4.923 50 10 IJGE C=CCn1ncc2ccc(NC(=O)/C(C#N)=C/c3cn(CCC#N)nc3-c3ccccc3)cc21 1636357775 IKHNIGXLRJVXER-KGENOOAVSA-N 447.502 4.545 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1F 1915090669 NRPDLZUYOUJRDK-GFCCVEGCSA-N 427.245 4.689 50 10 IJGE CC[C@H](Br)[C@@H](CC)NC(=O)c1csc(Br)c1Br 1945184142 WCJBDRHTERCXPO-JGVFFNPUSA-N 448.018 4.955 50 10 IJGE CC1(C)CN(C(=O)c2csc(Br)c2Br)[C@H]1CBr 1945187477 XEXRMQAJTQPDIZ-ZETCQYMHSA-N 446.002 4.519 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H]2C[C@H]1[C@H]2NC(=O)OCc1ccccc1 1999499711 BRCAFDKGKXCDPK-AABGKKOBSA-N 437.422 4.967 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1scc(Br)c1Br 2023027246 ACYKXZXZZUBRBT-POYBYMJQSA-N 448.018 4.813 50 10 IJGE CC1(C)OC[C@@H](Cc2ccc(I)c(Cl)c2)[C@@H]1Br 2026566283 IXGQWNQKICROBA-SKDRFNHKSA-N 429.523 4.676 50 10 IJGE C[C@@]12CN(Cc3cccc(Br)c3Br)C[C@@]1(CBr)C2 2046798887 QYSDSXVKGWBYQH-KGLIPLIRSA-N 438.001 4.819 50 10 IJGE Cn1ncc(C[C@@H](CBr)c2cccc(Br)c2)c1Br 2053030187 MZLXCKBBCKVXSX-JTQLQIEISA-N 436.973 4.666 50 10 IJGE Cc1cnc(-n2nc(CBr)c(Br)c2C(F)(F)F)c(C)c1C 2078913543 FGNIOTYAIGTVCO-UHFFFAOYSA-N 427.062 4.869 50 10 IJGE C[C@H]1OC2(C)CC1([C@H](Br)c1cc(I)cc3c1OCC3)C2 2156697110 BIZGIMMDWALZIY-ZIYKAWHXSA-N 449.126 4.620 50 10 IJGE CN(CCC1CCN(CCCCCI)CC1)C(=O)OC(C)(C)C 2211184950 GRWOPZOOCPHJKX-UHFFFAOYSA-N 438.394 4.561 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CN(CC1(CBr)CC(F)C1)CC2 2265632993 RXCSICZTOASWAC-UHFFFAOYSA-N 427.358 4.905 50 10 IJGE Fc1cc(Br)cc(F)c1COc1ncc(Br)c(CCl)n1 2287132798 HPIWDIBWOOZHJG-UHFFFAOYSA-N 428.458 4.598 50 10 IJGE BrCCC[C@H]1CCCCN1Cc1sccc1I 2301075049 YOJNJXJMPADLFA-LLVKDONJSA-N 428.177 4.882 50 10 IJGE Fc1ccc(CBr)c(OCc2sccc2I)c1 2301075055 YPPMNTIIPAEQFB-UHFFFAOYSA-N 427.076 4.966 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@H](CC2CC2)C2CC2)C1 2303848993 FURHZPMZBIWNQO-APWZRJJASA-N 449.373 4.786 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1OCc1ccccc1 2313676699 UVPDBDJXALIJHK-UHFFFAOYSA-N 429.432 4.728 50 10 IJGE COc1ccc(CCOCCCCCI)c(Br)c1 2317161413 LWKQOBJXBRUZLV-UHFFFAOYSA-N 427.120 4.622 50 10 IJGE CC[C@@H](NC=C(C#N)C(=O)N[C@@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 2325044900 DVGWFEJTONCTNB-MHECFPHRSA-N 447.579 4.908 50 10 IJGE CC(C)(C)OC(=O)NCCN(CC(F)(F)F)C[C@](C)(CBr)C(C)(C)C 2327079345 ZETNDELITITAOC-INIZCTEOSA-N 433.353 4.823 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)Cc2ccccc2)CCC3)c(C)c1 40815675 RCRAZRGLFHMJGQ-SGWCAAJKSA-N 429.520 4.856 50 10 IJGE O=C(N/N=C\c1ccc(Oc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1)c1ccncc1 59462959 WMRGYTZNLKXPJI-ROTLSHHCSA-N 430.342 4.565 50 10 IJGE CC(C)COc1ccccc1/C=N/NC(=O)c1ccc2[nH]c(-c3ccccc3O)nc2c1 169926448 UUSUFQLEVBHSLC-VULFUBBASA-N 428.492 4.734 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\Nc1cc(Cl)ccc1OC 217240147 XYVHFQYELNYHAL-PFONDFGASA-N 427.888 4.764 50 10 IJGE N#C/C(=C/Nc1ccc(Nc2ccccc2)cc1)C(=O)N1CCN(Cc2ccccc2)CC1 217257368 LVSODIFPLHXRGV-ATJXCDBQSA-N 437.547 4.594 50 10 IJGE CC(C)(C)S(=O)(=O)CC[C@@H](CBr)Cc1cccc(Br)c1 232658908 FVNNKUOIJHQBGN-CYBMUJFWSA-N 426.214 4.606 50 10 IJGE Cc1cc([C@@H](Br)c2cn(C)c(Br)n2)sc1Br 698419719 QBNMAFICSKHZKZ-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE O=C(NN=C1C(=O)N(Cc2ccccc2F)c2ccccc21)c1ccc(Cl)cc1Cl 1084629007 WBYFFKLJBZROEI-UHFFFAOYSA-N 442.277 4.813 50 10 IJGE C#CCC1(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Br)cc3)c2C)CCC1 1611039543 LUVMBXWVJQQHMI-RGEXLXHISA-N 436.353 4.826 50 10 IJGE Cc1cccc([C@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)c1[N+](=O)[O-] 1614629148 GMTXNCUQXMYLNV-WMZOPIPTSA-N 433.302 4.650 50 10 IJGE C=CCOc1cccc(NC(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)c1 1666342346 CJTFNNVHMXVPPR-UHFFFAOYSA-N 429.402 4.876 50 10 IJGE CCOc1c(C=NNC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)cccc1OC 1772754578 YZLXBGWDABGAKK-UHFFFAOYSA-N 446.547 4.949 50 10 IJGE CC(C)c1cc(Br)ccc1OCC(=O)NN=Cc1c(F)cccc1Cl 1772756080 YQEOMSGXKAJTGX-UHFFFAOYSA-N 427.701 4.894 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccccc1Cl 1865691152 KQKVKMDXCBGCTI-JOCHJYFZSA-N 432.911 4.676 50 10 IJGE COc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(C)cc2)ccc1OC(C)C 1865696930 ULLWVMGOGUFCSF-XMMPIXPASA-N 444.535 4.562 50 10 IJGE O[C@H](c1c(Cl)cc(Br)c(F)c1Br)[C@H]1C[C@H]1Br 1900375750 GGWIZLHMYKUPFF-JISPFJSISA-N 437.328 4.821 50 10 IJGE Cc1c(Br)sc([C@H](Cl)[C@@H]2CCCS(=O)(=O)C2)c1Br 1922912353 MJDBMHWMFALOLV-VXNVDRBHSA-N 436.618 4.686 50 10 IJGE Brc1cnccc1C[C@@H](Br)c1csnc1Br 1925225586 JDNAJZSSDVJEPP-MRVPVSSYSA-N 426.959 4.742 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@]2(CC[C@@H](CI)O2)CC12CCCC2 1990423897 KRHWFUDGLHLXCB-KSSFIOAISA-N 435.346 4.683 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc([C@]2(C)CCC[C@H](CI)O2)cc1 2014210799 PGRZBGWDNSVOGY-APWZRJJASA-N 445.341 4.931 50 10 IJGE C[C@H]1CO[C@@H](COc2c(Br)cc(CBr)cc2Br)C1 2047588541 ACSRKOCLZWYTLA-PSASIEDQSA-N 442.973 4.910 50 10 IJGE FC(F)(F)c1cc(I)c(I)cc1CCl 2060236648 WEJQGQJQTIFFAF-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2CN(CC3(CBr)CCCCC3)C(C)(C)[C@@H]2C1 2106788560 QORJNTCSGYLHNS-IAGOWNOFSA-N 429.443 4.909 50 10 IJGE CCCN(CC(C)(C)CNC(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2110717982 NAQPTIZFBHAXHH-INIZCTEOSA-N 433.431 4.730 50 10 IJGE Cc1c(Br)ccc([C@H](Cl)C2CCS(=O)(=O)CC2)c1Br 2138870549 JPCBZVKCMZCYFG-CYBMUJFWSA-N 430.589 4.625 50 10 IJGE O=C(NC[C@@]12CCC[C@]1(CCl)C2)c1scc(Br)c1Br 2142937693 SHSSBUPYVMCQPO-OLZOCXBDSA-N 427.589 4.802 50 10 IJGE Cc1cc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)ncc1CBr 2151925572 OERCAADCBXLLRF-ZDFPQIBNSA-N 426.402 4.632 50 10 IJGE Fc1cc2nc(CCCl)n([C@@]34C[C@@H]3CN(Cc3ccccc3)C4)c2cc1Br 2155866938 YUHHGSAIWRLQHD-QVKFZJNVSA-N 448.767 4.950 50 10 IJGE CC(C)(C)OC(=O)N[C@@]1(c2ccccc2)CCN(C[C@H](CBr)CC2CC2)C1 2169167146 UQJZLNFMWKDYJN-AVRDEDQJSA-N 437.422 4.924 50 10 IJGE C[C@@H](CCCCCBr)NS(=O)(=O)c1ccc(Cl)c(Br)c1 2174530667 SVFRTJJWKBCMKR-JTQLQIEISA-N 447.620 4.725 50 10 IJGE CO[C@H]1CC(Oc2c(Br)cc(Cl)cc2CBr)C[C@@H]1OC 2187175456 YPUQKYLHRYLREB-STQMWFEESA-N 428.548 4.569 50 10 IJGE C[C@@H](C(=O)N(C)C[C@H]1C[C@@H](Br)C1)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 2196913804 HLBLTTPJGGXVQV-XYVMCAHJSA-N 439.394 4.520 50 10 IJGE BrC[C@@H]1CCC2(CCC2)CN1C[C@@H]1CC1(Br)Br 2213086923 BSLDYQSBERSSQA-QWRGUYRKSA-N 430.022 4.522 50 10 IJGE C[C@]1(CBr)C=CCCN1C(=O)c1cc(F)c(Br)cc1Cl 2282987729 HYTFSLVVJDLJNR-CQSZACIVSA-N 425.523 4.797 50 10 IJGE COc1ccc(C=CC(=O)Oc2ccc(C=NNC(=O)c3ccc(Cl)cc3)cc2)cc1 2294323096 WFSPJUXPLFUPQO-UHFFFAOYSA-N 434.879 4.731 50 10 IJGE CCCCCOc1ccc(C=C(C#N)C(=O)Nc2ccc(C(=O)OCC)cc2)cc1OC 2296819021 LLEFENWYPQYMMJ-UHFFFAOYSA-N 436.508 4.987 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@@H](CC2CC2)C2CC2)CC1 2303862238 XGSZWKDPEIBYBY-INIZCTEOSA-N 449.373 4.786 50 10 IJGE C[C@H](CCBr)CCNCc1cc(I)ccc1Cl 2307325758 DYOITXCLHFPOEJ-SNVBAGLBSA-N 430.555 4.845 50 10 IJGE BrC[C@@H]1C[C@@H]2CC[C@H]1N2Cc1cc(Br)ccc1Br 2309796171 MZYRRXFRWMTFOW-DUFXMDAXSA-N 438.001 4.959 50 10 IJGE Cc1cccc(N2CCN(C=C(C#N)C(=O)Nc3cc(Cl)ccc3Cl)CC2)c1C 2318454593 BSVKENSUJLRKMO-UHFFFAOYSA-N 429.351 4.778 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)C3(CC3)C2)c(I)c1 2318558100 RDMWXMAXAGWHSH-ZDUSSCGKSA-N 440.550 4.694 50 10 IJGE N#CC(=CNCCc1cccc(Br)c1)C(=O)Nc1cccc(C(F)(F)F)c1 2324412892 DNKMAFVPLKKLAY-UHFFFAOYSA-N 438.247 4.646 50 10 IJGE CCOC(=O)c1ccc(NC=C(C#N)C(=O)NC(c2ccccc2)c2ccccc2)cc1 2324825549 VOLVFXAHHLXJDH-UHFFFAOYSA-N 425.488 4.588 50 10 IJGE C[C@@H]1[C@@H](Cl)CCN(Cc2ccc(I)c(Br)c2)[C@H]1C 2325214241 NUAWTQREJWNBJQ-KWBADKCTSA-N 442.566 4.891 50 10 IJGE CCn1nc(Br)nc1C[C@H](Br)c1ccc(Br)cc1 2328435440 KGVQYQRCFZCEBI-JTQLQIEISA-N 437.961 4.502 50 10 IJGE CC(C)C[C@H](CBr)CN=[S@@]1(=O)CCN(C(=O)OC(C)(C)C)CC1(C)C 2328518710 JDDRLQOEWILHEM-SGANQWHYSA-N 439.460 4.541 50 10 IJGE Clc1cc(Br)c(CN(CCCBr)C2CCOCC2)s1 2352956935 CKKMUJHREILUNC-UHFFFAOYSA-N 431.621 4.930 50 10 IJGE C=CC[C@@H](Br)[C@@H]1CCN1C(=O)c1cc(F)c(Br)cc1Cl 2360963489 JIKLQQGEVNVTLE-RNCFNFMXSA-N 425.523 4.796 50 10 IJGE Cc1cccc2c1N(C(=O)N1CCC(Br)CC1)CCN2C(=O)OC(C)(C)C 2381023258 KLRJXGYXNISBTO-UHFFFAOYSA-N 438.366 4.536 50 10 IJGE Cc1ccccc1C(=O)Nc1ccc(C(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)cc1 12578680 VZJYHBBVFLDCEL-ZMOGYAJESA-N 436.855 4.573 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=O)c2ccccc2OCCOc2ccccc2)cc1 14040596 ZEDLUXWRNCPTFN-UHFFFAOYSA-N 432.520 4.517 50 10 IJGE Cc1ccc(Cl)cc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccco1)CCC2 40814429 VCKCHIQDCGXXIP-MFKUBSTISA-N 425.872 4.866 50 10 IJGE O=C(CSCC(=O)Nc1ccccc1)N/N=C/c1ccc2cc3ccccc3cc2c1 59147268 KAZUPBNCEFLUEE-CVKSISIWSA-N 427.529 4.815 50 10 IJGE CC(C)[C@@H](CI)NC(=O)c1ccc2cc(Br)ccc2c1 232708355 ZECWTNRMVCUUPS-OAHLLOKOSA-N 446.126 4.792 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1cc(Br)sc1Br 234280925 PJNNAJKXRMTLBE-UHFFFAOYSA-N 446.002 4.519 50 10 IJGE CCOc1ccccc1OCC(=O)NN=Cc1c(C)n(Cc2ccccc2)c2ccccc12 252626765 RFIHAOMPDZJOBC-UHFFFAOYSA-N 441.531 4.926 50 10 IJGE CCC(=NNC(=O)CSc1nc2ccccc2n1Cc1ccccc1)c1ccc(O)cc1 254303807 QEUJTMYUARFVGZ-UHFFFAOYSA-N 444.560 4.813 50 10 IJGE CCOC(=O)c1c(NC(=O)NN=Cc2c(O)ccc3ccccc23)sc2c1CCCC2 256017323 FLEMPPAHKYBUNO-UHFFFAOYSA-N 437.521 4.818 50 10 IJGE CC[C@@H](Br)[C@@H](CC)NC(=O)c1ccc(I)c(Cl)c1 313081017 ILBPJNOFDALHJM-BXKDBHETSA-N 444.538 4.627 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1C(=O)c1cc(Br)cc(Br)c1 399422265 NXMHRTWTIIXULN-WCBMZHEXSA-N 439.973 4.600 50 10 IJGE O=C(N[C@H]1CCC[C@H](Br)C1)c1cc(Br)sc1Br 694585367 CPTAXKDTGFKHPI-BQBZGAKWSA-N 446.002 4.709 50 10 IJGE Cc1c(CNC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)oc2ccccc12 734445504 KQALDSFWBDNZJF-ZHZULCJRSA-N 435.487 4.742 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2CCC(C3CCCC3)CC2)c(-c2ccccc2)n1 742790705 GJRXJOGXUKMCNU-QJOMJCCJSA-N 427.552 4.800 50 10 IJGE CC(C)c1csc([C@H](C#N)C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)n1 747197359 FNZPBODRAAKNTB-BUDOKORBSA-N 440.532 4.827 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccc(Sc3ccccc3Cl)nn2)c(C(F)(F)F)c1 799747294 WYHPHKPXXIJNEG-UHFFFAOYSA-N 449.845 4.929 50 10 IJGE CC(=NNC(=O)COc1c(C)cc(Br)cc1Br)c1cccs1 1084036668 OELZIZCZVIYOMK-UHFFFAOYSA-N 446.164 4.501 50 10 IJGE BrC[C@H](CN1CC2(CCOCC2)c2ccc(Br)cc21)C1CC1 1175129074 PVRBQBWGJHUFME-CQSZACIVSA-N 429.196 4.738 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c(-c2ccccc2)n1 1341867408 DGPMMSYCYKGXCY-RNHBDSLOSA-N 442.482 4.795 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N[C@@H](COC(=N)O)Cc2ccccc2)c(C)n1C1CCCCC1 1469026292 UKWYHRHXWLORBB-UAPYWLNTSA-N 448.567 4.754 50 10 IJGE CCc1nn(-c2ccc(Br)cc2)c2c1[C@@H](c1cccc(F)c1)C(C#N)=C(N)O2 1865711441 YPRYNLBJNAWVFE-SFHVURJKSA-N 439.288 4.554 50 10 IJGE CN(C[C@@H](CBr)CC1CC1)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 1890234027 MRRNOJYCAPOIPR-IEBWSBKVSA-N 425.411 4.995 50 10 IJGE BrC[C@@H]1CCCN(Cc2cc(Br)ccc2Br)C1 2006503791 SADXVDPPZUZNTG-JTQLQIEISA-N 425.990 4.819 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1C(=O)c1cccc(Br)c1Br 2031477830 OEEBEQUDMXUNEM-DTWKUNHWSA-N 439.973 4.600 50 10 IJGE CC(C)(C)OC(=O)N1CC([S@@](C)(=O)=NCCCCCCCCCBr)C1 2044697985 YEFIEXWHCBPDQM-RUZDIDTESA-N 439.460 4.829 50 10 IJGE Fc1ccc(C(F)(F)F)nc1-n1nc(CCl)c(Br)c1C(F)(F)F 2078864768 CIBIDPMBUBBSGJ-UHFFFAOYSA-N 426.517 4.945 50 10 IJGE CCC(CC)(CBr)CN1CCc2sc(CNC(=O)OC(C)(C)C)nc2C1 2106782497 QVAAYJAQLHZZLY-UHFFFAOYSA-N 446.455 4.727 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CN(CC3(CBr)CCCCCC3)C[C@]2(C)C1 2106784211 HBMXKOHILFDLHP-YLJYHZDGSA-N 429.443 4.911 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CNC(=O)CCCCBr)CCCC[C@@H]12 2108946800 LQNYYUGGZCKHCV-UZLBHIALSA-N 431.415 4.628 50 10 IJGE CS(=O)(=O)C1([C@H](Br)c2scc(C(F)(F)F)c2Br)CC1 2111593228 LPQYFCYFARPANS-MRVPVSSYSA-N 442.116 4.543 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CC2(CBr)CCCCCC2)CC(F)(F)C1 2127775125 GFTIWSZCBPXUGE-OAHLLOKOSA-N 439.385 4.956 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1cc(C)cc(Br)c1F 2146559842 HHQHMNJEGASCHQ-JTQLQIEISA-N 427.177 4.533 50 10 IJGE C[C@H](c1cnn(Cc2ccccc2)c1)n1c(CCCl)nc2cncc(Br)c21 2151779984 YTKXAJYIMJVXFZ-CQSZACIVSA-N 444.764 4.829 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@H](CBr)c2ccccc2)CCC1(F)F 2163057413 BFYKMUHCLXSXAV-DLBZAZTESA-N 447.364 4.790 50 10 IJGE CC1(C)CC[C@H](NC(=O)[C@H](Br)C2CCCC2)[C@@H](CNC(=O)OC(C)(C)C)C1 2167032404 MQALBXVXYOQHIY-IXDOHACOSA-N 445.442 4.776 50 10 IJGE Cc1cc(C(=O)N2C[C@@]3(F)CCC[C@@]3(CBr)C2)c(Br)s1 2176637822 WZSQXIYDJSUIFY-KGLIPLIRSA-N 425.161 4.548 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@H]1CCCN(C[C@H](CBr)CC2CC2)C1 2185502000 PQWSPNNPTALAJW-HOTGVXAUSA-N 441.414 4.747 50 10 IJGE COc1cc(NC(=O)[C@H](Br)C2CCCC2)ccc1CNC(=O)OC(C)(C)C 2192960694 GHIOYOMIRUVLQJ-QGZVFWFLSA-N 441.366 4.612 50 10 IJGE CC[C@@H]1CC[C@@H](N(C)S(=O)(=O)c2cc(CBr)sc2Br)C1 2206136237 IBRFWABVGUHISD-NXEZZACHSA-N 445.242 4.605 50 10 IJGE CN(C[C@H]1CC1(Br)Br)C1(CBr)CC2(CCC2)C1 2213092444 VLEJTPIAPPAFNY-SNVBAGLBSA-N 430.022 4.522 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1Cc2ccc(NC(=O)[C@H](Br)C3CCCC3)cc2C1 2234141481 XMRWRKLSZIQUJO-QZTJIDSGSA-N 437.378 4.571 50 10 IJGE Cc1sc(C(=O)N2CC[C@@H](C(F)(F)CBr)C2)c(Br)c1C 2237633619 NZRYZVBQSKXVSH-SECBINFHSA-N 431.140 4.620 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OCC[C@H]1CCCC12CC2 2243323042 UCCZZDADUKEHBT-RHSMWYFYSA-N 437.362 4.692 50 10 IJGE COC1(CO[C@](C)(CI)c2ccccc2Br)CCC1 2266246605 CSLHBCYNIKVLHH-CQSZACIVSA-N 439.131 4.685 50 10 IJGE C[C@H]1C[C@H](Br)CN(Cc2cc(I)ccc2Cl)C1 2307327525 BMSZJBVUOPFBMT-ONGXEEELSA-N 428.539 4.550 50 10 IJGE N#CC(=Cc1ccccc1OCc1cccc(F)c1)C(=O)N1CCN(c2ccccc2)CC1 2313566934 DTUMYQMBOBGZMV-UHFFFAOYSA-N 441.506 4.660 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2cc(OCC)c(OC)cc2Br)cc1 2313670492 ATMZQSUFDHYYJQ-UHFFFAOYSA-N 445.313 4.801 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc3nc(-c4ccccc4)[nH]c3c2)cc(Cl)c1O 2323744800 GGQOFYUPFVLFLF-UHFFFAOYSA-N 434.883 4.752 50 10 IJGE ClC[C@@H]1CCCC[C@H]1NCc1ccc(I)c(Br)c1 2325211682 AJHIEDFRANAHFA-SMDDNHRTSA-N 442.566 4.941 50 10 IJGE C[C@H]1C[C@H](Br)CCN(Cc2cc(I)ccc2Cl)C1 2327387873 CHTGAUXOAJKMFJ-CMPLNLGQSA-N 442.566 4.940 50 10 IJGE Cc1cc(Br)c(C(=O)NCCSCCCBr)cc1Cl 2335645254 LDDHYLCGDFGREU-UHFFFAOYSA-N 429.605 4.659 50 10 IJGE CC(C)c1[nH]c(-c2cc(Br)c(Cl)s2)nc(=O)c1CBr 2353851891 JCKSHUVZSXPSJH-UHFFFAOYSA-N 426.561 4.933 50 10 IJGE CCCCCOc1ccc(C(=O)NNC(=O)COc2ccc(-c3ccccc3)cc2)cc1 14029513 UIPNNMNMCPBVAW-UHFFFAOYSA-N 432.520 4.763 50 10 IJGE CC[C@@H](C)c1ccc(OCC(=O)NNC(=O)c2ccc(OCCc3ccccc3)cc2)cc1 14041618 IKZLFWIOKFYDRO-HXUWFJFHSA-N 446.547 4.662 50 10 IJGE CCCCc1ccc(NC(=S)NNC(=O)c2cccc(OCc3cscn3)c2)cc1 16228470 UVVPYFKRXYNNBV-UHFFFAOYSA-N 440.594 4.696 50 10 IJGE O=C(N/N=C/C=C\c1ccccc1[N+](=O)[O-])c1cc(-c2ccc3c4c(cccc24)CC3)n[nH]1 27527958 WIKZTVAFWGRJKR-FWAVXLSMSA-N 437.459 4.666 50 10 IJGE C[C@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(F)cc1 38652800 UUCIQEJGHDOMEW-PSLXWICFSA-N 448.425 4.556 50 10 IJGE O=C1CCc2cc([C@H](Br)c3ccccc3I)ccc2N1 40283281 DBLIDOYMCRVAKE-INIZCTEOSA-N 442.094 4.660 50 10 IJGE C=CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4C)ccc32)c1 40529781 IOBOWRKHKVUOQB-RUZDIDTESA-N 438.483 4.997 50 10 IJGE C=CCc1cc(/C=N\NC(=O)CC[C@H](O)c2ccccc2)ccc1OCc1ccccc1 58891707 QFDYVSCEWOULOS-GRWOLDDTSA-N 428.532 4.958 50 10 IJGE CCCCN(CCCc1ccccc1)c1ccc(C2=C(C#N)C(=C(C#N)C#N)NC2=O)cc1 100081892 GDCPQIKPENJLKR-UHFFFAOYSA-N 435.531 4.634 50 10 IJGE CCC(=O)Nc1cccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(OC)cc3)c2C)c1 115626661 XQBYRXVCYVYTTA-XSFVSMFZSA-N 442.519 4.997 50 10 IJGE CCC[C@@H](Br)CNC(=O)c1cc(Br)c(Br)s1 218438418 BEQAIUUJWGBSFD-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OCc1cccc(Cl)c1 231317549 NKTPYHCHOLHLMV-MRXNPFEDSA-N 439.721 4.575 50 10 IJGE CC(C)(C)c1ccc(C=NNC(=O)/C(=C/c2cccs2)NC(=O)c2ccccc2)cc1 252630098 UUJWJJHVGXGDOP-DEEHQUFZSA-N 431.561 4.967 50 10 IJGE O=C(OCc1ccccc1)N1C[C@H](CI)[C@H](c2ccccc2F)C1 382697085 SOXDARICFPJRGU-DOTOQJQBSA-N 439.268 4.613 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)cnc2n1Cc1cnn(Cc2ccccc2)c1 390386374 DINGKDHKYPHFRU-CYBMUJFWSA-N 430.737 4.787 50 10 IJGE C[C@H]1CCN(C(=O)c2scc(Br)c2Br)C[C@H]1Br 707788376 AAZLJULOQJWXAV-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE Cc1nc(O)cc(-c2ccc(NC(=O)NNc3nc4cc(Cl)ccc4cc3C)cc2)n1 778653426 DRICIEKVCIICKN-UHFFFAOYSA-N 434.887 4.816 50 10 IJGE COc1cc(OC)cc(C(=O)Oc2ccc(/C=C(\C#N)C(=O)c3ccccc3)cc2OC)c1 915841359 GXDZGVLGIHYQSI-RGVLZGJSSA-N 443.455 4.721 50 10 IJGE C=CCCCC(=O)NNc1c(Br)cc(Br)cc1Br 1126492051 WLEMDVHUCUFKHN-UHFFFAOYSA-N 440.961 4.774 50 10 IJGE O=C(CCCC(=O)c1ccc(Br)cc1)NNc1nc2ccccc2[nH]c1=S 1167430845 URZCXWJTQZGHEC-UHFFFAOYSA-N 445.342 4.551 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNC(=S)Nc2ccc(C)c(C)c2)cc1 1587158928 CPSAMMZRJZONMO-UHFFFAOYSA-N 432.549 4.881 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)NCc2ccc(-c3ccccc3OC)cc2)cc1OC 1866130272 LIYDJGOQXCMQRJ-KGENOOAVSA-N 428.488 4.603 50 10 IJGE CC(C)c1nc(Nc2ccc(SC#N)cc2)cc(N2CCO[C@H](c3cccnc3)C2)n1 1868231317 CFZNMTXNFRVNFU-FQEVSTJZSA-N 432.553 4.890 50 10 IJGE COc1cc(C(=O)N(Cc2ccccc2)[C@H](CBr)C2CC2)cc(OC)c1C 1915262726 CNQGMOUKBYADMF-LJQANCHMSA-N 432.358 4.828 50 10 IJGE C[C@H](c1ccncc1Br)[C@H](Br)c1cc(Br)n(C)n1 1924063909 XJZUGBVQCMPBBF-KRTXAFLBSA-N 437.961 4.580 50 10 IJGE Cc1ccnc(C(=O)N(Cc2ccccc2)[C@@H](C)CBr)c1Br 1927120530 CSONQRXJSJWXLS-ZDUSSCGKSA-N 426.152 4.578 50 10 IJGE O=S(=O)(c1cc(CCl)oc1Br)N(Cc1ccccc1)CC(F)(F)F 1946815377 QOSWUMGGJUTWGE-UHFFFAOYSA-N 446.672 4.534 50 10 IJGE C[C@@H]1[C@@H](CBr)CCN1Cc1ccc(I)c(Cl)c1 2026567579 SZKBRVITLNSZFL-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE C[C@@]12CN(Cc3c(Br)cccc3Br)C[C@@]1(CBr)C2 2046802408 NJHQISQWCOHTQZ-KGLIPLIRSA-N 438.001 4.819 50 10 IJGE C[C@H](Br)[C@H]1CCCN1C(=O)c1cc(Br)ccc1Br 2073318281 AIHGTFHEDNNWML-QPUJVOFHSA-N 439.973 4.600 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(C[C@H](CBr)c2ccccc2)CC1(C)C 2106788169 NMXSHDHQLUOMHL-ROUUACIJSA-N 425.411 4.648 50 10 IJGE COc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)C2CC2)cc1CBr 2123272531 ZTPUSQAQVLWBME-HNNXBMFYSA-N 438.387 4.580 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)C(C)(C)CN1C[C@@H](CBr)c1ccccc1 2133658249 XADKHKYSHNCOBI-SJLPKXTDSA-N 425.411 4.885 50 10 IJGE ClCCc1nc2cccnc2n1Cc1scc(Br)c1Br 2150584357 YNXSWDDTADBLQZ-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE O=C(N[C@H]1CCN(Cc2ccccc2)CC12CCC2)c1ccc(CBr)cc1 2154926983 RICDKVWLNXRLNX-NRFANRHFSA-N 427.386 4.756 50 10 IJGE O=C(NC[C@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(CBr)cc1 2159218218 UTFSODJGKDOSLI-MMVMTREESA-N 427.386 4.755 50 10 IJGE FC1(F)C[C@]1(Br)Cn1c(CCCl)nc2cccc(Br)c21 2202505607 MVIAFQIROHYLHF-LBPRGKRZSA-N 428.502 4.753 50 10 IJGE COc1cccc(N2CCCN(Cc3ccccc3)CC(F)(F)C2)c1CBr 2203197060 UAJRTNDAVPFNPE-UHFFFAOYSA-N 439.344 4.938 50 10 IJGE ClCCCOC1CCN(Cc2cc(Cl)ccc2I)CC1 2207522722 SDUAPYOHFCBQER-UHFFFAOYSA-N 428.141 4.555 50 10 IJGE CCC(CC)(CBr)CNC(=O)Cc1ccc(Br)cc1Cl 2237437384 VXGYZDLNZDWJPH-UHFFFAOYSA-N 425.592 4.963 50 10 IJGE COC[C@@H]1C[C@H]1[C@@H](Br)Cc1cc(Br)cc(Br)c1 2252830723 HTRDTUZITSPVHC-BIMULSAOSA-N 426.974 4.800 50 10 IJGE CC(C)(C)OC(=O)NCc1cccc(Cl)c1NC(=O)N1CCC(Br)CC1 2269409500 TURHMFSAMMAWRU-UHFFFAOYSA-N 446.773 4.756 50 10 IJGE Cc1cncc(CO[C@H](CI)c2ccccc2Br)c1 2279019868 PLJBNKHGYHZHGC-OAHLLOKOSA-N 432.099 4.845 50 10 IJGE CC[C@@H](C)c1ccc(OCC(=O)NN=Cc2cccc(OC(=O)C=Cc3ccco3)c2)cc1 2294365357 CQICXCDVBKVFRO-LJQANCHMSA-N 446.503 4.941 50 10 IJGE ClCCC1(CNCc2ccc(I)c(Br)c2)CC1 2306217388 PFSWYOSGMQIAIP-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE CC[C@H](C[C@@H](C)Cl)NCc1ccc(I)c(Br)c1 2306222399 UBIHKQGFNAWQKY-MWLCHTKSSA-N 430.555 4.939 50 10 IJGE BrC[C@@H]1CCC2(CCC2)CN1Cc1sccc1I 2316754505 JDAGDJUCSXJRBR-NSHDSACASA-N 440.188 4.882 50 10 IJGE COC(=O)c1c(-c2c(Cl)cccc2Cl)noc1NC(=O)C(C#N)=Cc1ccccc1 2322524869 QOAPGLRQEGSWMW-UHFFFAOYSA-N 442.258 4.981 50 10 IJGE Cc1cc(I)ccc1NC=C(C#N)C(=O)Nc1ccccc1Cl 2324352218 UVSQBENWCXAZJF-UHFFFAOYSA-N 437.668 4.711 50 10 IJGE CCc1cccc(CC)c1NC(=O)C(C#N)=CNCCc1ccc(Br)cc1 2325129641 WASLXTDWCDWVSB-UHFFFAOYSA-N 426.358 4.752 50 10 IJGE C[C@H](CCl)CS(=O)(=O)Nc1ccc(NC(=O)OC(C)(C)C)c(C(F)(F)F)c1 2367185044 WDHPCNCQQXHRDM-SNVBAGLBSA-N 430.876 4.669 50 10 IJGE CC[C@@H]1CCCCN1CC(=O)/C(C#N)=C1\NC(c2ccc(Br)cc2)=CS1 25325963 ZBWVVYZDMFSRIM-HNOLQLOCSA-N 432.387 4.653 50 10 IJGE Cc1c(C(=O)Nc2ccc(F)cc2F)oc2c1/C(=N/NC(=O)Cc1ccccc1)CCC2 40815886 HACVJGTXPAPGHU-TURZUDJPSA-N 437.446 4.518 50 10 IJGE CCCc1ccc(OCC(=O)N/N=C/c2c(F)cccc2Cl)c(Br)c1 40960010 PKKISERBEHFXMD-LSHDLFTRSA-N 427.701 4.723 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1cc([N+](=O)[O-])ccc1Br)[C@H]2Br 261366746 JGXPZIMLYGPVRX-MAZHCROVSA-N 446.139 4.886 50 10 IJGE CC(C)(C)[C@@H](Br)CNC(=O)c1cc(Br)ccc1Br 324423362 NXIMSWCYRWJELV-NSHDSACASA-N 441.989 4.751 50 10 IJGE C[C@H](CCCCBr)NC(=O)c1ccc(I)c(Cl)c1 398531394 RELLIXSHOGXEOJ-SECBINFHSA-N 444.538 4.628 50 10 IJGE FC(F)(F)c1cc(Br)cnc1N1CCS[C@H](CCBr)C1 720089594 YZHIZGCZJPWDHO-SECBINFHSA-N 434.119 4.570 50 10 IJGE CCOc1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CBr)cc1OCC 725392530 UWZFLZDXUFJQKO-JKSUJKDBSA-N 428.367 4.829 50 10 IJGE O=C(NNc1cnc2ccccc2n1)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 774776165 TUBSAAFNCAZYAW-UHFFFAOYSA-N 440.438 4.606 50 10 IJGE CSc1ccccc1[C@H](C)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 799741133 FYLBNGQDIUPSBP-BAOGPQIGSA-N 441.560 4.970 50 10 IJGE CC(C)c1ccc([C@@H](NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2cccs2)cc1 916207505 FLRDNZQPCYSRCR-HXUWFJFHSA-N 438.509 4.513 50 10 IJGE O=C(NNc1ccc(Br)cc1F)c1ccc(-c2cccc(Cl)c2)nc1O 1137675575 NKYROUJRIOPDSO-UHFFFAOYSA-N 436.668 4.766 50 10 IJGE C=CCNC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(F)cc2)c1C 1523430746 SROONFZZTTZIEZ-HKWRFOASSA-N 442.494 4.695 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNC(=O)CCSc1ccc(F)cc1 1648380076 FSGKWLSSFHDXTE-VAWYXSNFSA-N 427.328 4.866 50 10 IJGE C=CC[C@H]1CCCC[C@H]1NC(=O)NNC(=O)Nc1ccc(Br)cc1Cl 1682683258 KOOXSOXCDGOBHT-SMDDNHRTSA-N 429.746 4.573 50 10 IJGE COC(=O)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccc2)cc1 1865709049 MEQMJLGVNWSMRW-QFIPXVFZSA-N 448.482 4.544 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](NC(=O)c2snc3ccccc23)c2ccccc2)cc1 1867269370 YDMSWYFASUEVFL-HXUWFJFHSA-N 444.541 4.979 50 10 IJGE CN(C[C@@H]1C[C@H]1Br)C(=O)C(C)(C)c1ccc(NC(=O)OC(C)(C)C)cc1 1887829642 LTKYKVWZSXCGDI-XJKSGUPXSA-N 425.367 4.553 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cc(Cl)cc(Cl)c1O 1916383896 RFSICFUNHVRETC-ZDUSSCGKSA-N 447.156 4.751 50 10 IJGE C[C@H]1CCN(Cc2cccc(Br)c2Br)C[C@H]1Br 1943880795 KEAPXVAIJIJPGF-JOYOIKCWSA-N 425.990 4.817 50 10 IJGE CCC(CC)(CBr)CN1CCC[C@H](CNC(=O)OCc2ccccc2)C1 1977948109 CELCQVGKPLBAFA-LJQANCHMSA-N 425.411 4.826 50 10 IJGE Cc1c([C@@H](Br)c2sccc2Br)c(Br)nn1C 1987721580 USTJGTSFWNDDKI-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE CC(C)(C)OC(=O)N1C[C@](C)([C@@H]2CC[C@](C)(CI)O2)CC1(C)C 1992813774 LOOJEZCILXULAX-MORSLUCNSA-N 437.362 4.785 50 10 IJGE CCC[C@@H](CBr)CNC(=O)c1cc(Br)c(Br)s1 2008108391 GWTXLKNNLQVKPC-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE CN(C(=O)c1cc(Br)sc1Br)C1(CCBr)CC1 2015866369 XGQMLWHWYOMIFA-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE Cc1cc([C@@H](Br)c2cc(S(C)(=O)=O)cs2)sc1Br 2032179952 XPLXPDAFFOGILL-JTQLQIEISA-N 430.208 4.768 50 10 IJGE FC1(F)CC(CO[C@@H](CI)c2ccc(Br)cc2)C1 2035120186 KMAHVKJDSWVMNG-LBPRGKRZSA-N 431.058 4.987 50 10 IJGE C[C@H]1CO[C@@H](COc2c(Br)cc(Br)cc2CBr)C1 2047588865 CIXMZUQDKOFRLN-LDYMZIIASA-N 442.973 4.910 50 10 IJGE N#CC(=Cc1cc2c(cc1[N+](=O)[O-])OCO2)c1nc(-c2cc3ccccc3oc2=O)cs1 2053497213 AEABDZOHTKHFDL-UHFFFAOYSA-N 445.412 4.618 50 10 IJGE CC(C)[C@H]1[C@@H](Br)CCN1Cc1cc(Cl)ccc1I 2062184840 WQCBHMWTGUSQBC-JSGCOSHPSA-N 442.566 4.938 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C 2106786238 SYUHZSHASIKCQD-QYZOEREBSA-N 425.411 4.790 50 10 IJGE CCC[C@]1(CNC(=O)N2CCC(Br)CC2)CCCCN1C(=O)OC(C)(C)C 2162495353 SSNNFYHGUYGPJR-HXUWFJFHSA-N 446.430 4.515 50 10 IJGE O=C(c1ccccc1OCc1ccccc1)N1C[C@@H](C(F)(F)F)[C@@H](CBr)C1 2163359236 QUNANSMHRCZCDN-DOTOQJQBSA-N 442.275 4.911 50 10 IJGE FC(F)(F)[C@]1(CBr)CCN(Cc2ncc(Br)cc2Cl)C1 2183581304 IHPIRWLTNAALSN-NSHDSACASA-N 436.497 4.647 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@@H]1CN(Cc2ccccc2)C[C@H]1C 2184936330 VSNDSURDPLDEBR-RDTXWAMCSA-N 447.808 4.977 50 10 IJGE O=S(=O)(Nc1ccc(Cl)cc1CBr)[C@H]1C[C@H](OCc2ccccc2)C1 2223321715 NPONDZQAMZUBTE-QAQDUYKDSA-N 444.778 4.724 50 10 IJGE Cc1ccc(I)c(C(=O)N2C3CCC2([C@@H](C)Br)CC3)c1 2240921934 CPRMADFYYPWFKA-OPGSHWCFSA-N 448.142 4.520 50 10 IJGE CC[C@H]1[C@H](Br)CCN1C(=O)c1scc(Br)c1Br 2251004840 SNWIMIXQLXDEOA-SVRRBLITSA-N 446.002 4.661 50 10 IJGE CCc1nc(C(=O)N(CCBr)CCC(C)(C)C)c(Br)s1 2289885813 NGQLOSHSQBHOLB-UHFFFAOYSA-N 426.218 4.741 50 10 IJGE Clc1ccc(I)cc1CN1CCC[C@@H](Br)CC1 2307329286 ZAUVDONTWKNPTM-LLVKDONJSA-N 428.539 4.694 50 10 IJGE ClCc1cc(Br)cnc1OCc1cccc(I)c1 2319095018 LPMKIGHHRSQYIH-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE COc1ccc(C=NNC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)c(Br)c1OC 2323144429 IXSAZAOBQXWQJE-BGCCBAISSA-N 449.389 4.913 50 10 IJGE N#CC(=CNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)NCCc1ccccc1 2324685710 DQZRVFJVXRTWKQ-UHFFFAOYSA-N 427.348 4.902 50 10 IJGE CC[C@@H]1CN(Cc2ccc(I)c(Br)c2)C[C@@H]1CCl 2325234050 UANAXHJMJKSJIA-NEPJUHHUSA-N 442.566 4.751 50 10 IJGE Clc1cc2c(cc1[C@@H](Br)c1cnsc1Br)OCCO2 2337303227 FJTGCTVLXQDHSC-LLVKDONJSA-N 425.529 4.815 50 10 IJGE C[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@H](CCBr)COCc1ccccc1 2343705191 FJNPDRSSGYCHFV-CRAIPNDOSA-N 440.765 4.594 50 10 IJGE C[C@@H]1CCC[C@](CCl)(NC(=O)c2ccc(Cl)cc2I)C1 2365587071 SRQPXCXPIAIGBG-BMIGLBTASA-N 426.125 4.862 50 10 IJGE CCC[C@H]1CN(C(=O)c2ccc(Cl)cc2I)C[C@@H]1CCl 2365589783 ZHEAPMYDCQWAAM-QWRGUYRKSA-N 426.125 4.672 50 10 IJGE O=C(CCC(=O)Nc1ccccc1Cl)N/N=C/c1cccc(OCc2ccccc2)c1 12579833 WQOIAFIDYHJJLE-WGOQTCKBSA-N 435.911 4.788 50 10 IJGE Br[C@H](c1cnn(-c2ccccc2)c1)c1ccccc1I 109864499 REWYYYQZOUVYNM-MRXNPFEDSA-N 439.094 4.961 50 10 IJGE COc1ccc([N+](=O)[O-])cc1N/C=C(/C#N)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 217250502 ZHYYWWQEYYOQEU-KTKRTIGZSA-N 440.765 4.734 50 10 IJGE Clc1ccc(C(CBr)(CBr)COC2CCOCC2)cc1 380175911 ZTMSCTSFTIOOJS-UHFFFAOYSA-N 426.576 4.563 50 10 IJGE C[C@H]1CC[C@H](Br)CN1C(=O)c1ccc(Br)cc1Br 399433209 SJOGBINNPLDCJK-WPRPVWTQSA-N 439.973 4.600 50 10 IJGE CC[C@@H](C[C@@H](C)Cl)NS(=O)(=O)c1cc(Br)c(C)cc1Br 716891063 JLRAMPAOUMRKGZ-ZJUUUORDSA-N 447.620 4.594 50 10 IJGE C[C@@H](OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)c1ccccc1[N+](=O)[O-] 764596254 HRHMWOWKXAVBDQ-SQFNAUOLSA-N 441.447 4.583 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NCc2ccc([N+](=O)[O-])cc2)c(-c2ccccc2)cc1OC 787149007 LOKAKGKGJIHRPJ-UDWIEESQSA-N 443.459 4.502 50 10 IJGE O=C(NN=Cc1cccc(Cl)c1Cl)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 1084234651 MGKJGAMKECWOLA-UHFFFAOYSA-N 438.620 4.754 50 10 IJGE C=CCc1cc(C(=O)NNc2ccc(Cl)cc2Br)cc(OC)c1OC 1301455988 ALCAUUUQFQXYQW-UHFFFAOYSA-N 425.710 4.605 50 10 IJGE C#CCN(CC1CC1)C(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Br)cc2)c1C 1435585503 VQKVYKPVALJHGW-MOSHPQCFSA-N 436.353 4.635 50 10 IJGE C#CCC1(C(=O)NNC(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)CCCCC1 1457532522 XOYWRQXPHIEWSX-UHFFFAOYSA-N 446.576 4.590 50 10 IJGE C[C@H](SCc1nc(O)c2ccccc2n1)C(=O)NN(Cc1ccccc1)c1ccccc1 1525359708 QBYMIBXSWVFWJJ-SFHVURJKSA-N 444.560 4.695 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2cc(C)ccc2C)c1 1865690737 ZWDGPBDKPJHKKG-QHCPKHFHSA-N 428.536 4.728 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CCC)nn3Cc2ccccc2)cc1 1865693979 NPRTXUVVCBZRPQ-QHCPKHFHSA-N 428.536 4.891 50 10 IJGE CCCc1nn(C)c2c1[C@@H](c1ccc(OCc3ccc(Cl)cc3)cc1)C(C#N)=C(N)O2 1865694798 BZMWWZVDKIYHLX-NRFANRHFSA-N 434.927 4.823 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3Cl)c3c2[C@H](c2ccc[nH]2)C(C#N)=C(N)O3)cc1 1865709752 GDCZOICZLTWSKZ-FQEVSTJZSA-N 443.894 4.748 50 10 IJGE CCOc1ccc(/C=C/C(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3)nc2C)cc1 1865755601 HTUDTOJPDVZPLQ-GIDUJCDVSA-N 435.911 4.584 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1 1914639971 VUIHTPJPMFWJSW-GFCCVEGCSA-N 437.186 4.968 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)Cc1c(Br)c(C)nn1C 1915116597 WNRQYQWGNJKGBZ-HNNXBMFYSA-N 429.200 4.667 50 10 IJGE FC(F)C[C@H](CBr)NCc1c(Br)cccc1Br 1945329740 OUMOIGJEQRQQOJ-SSDOTTSWSA-N 435.932 4.720 50 10 IJGE Cc1cc([C@H](Br)c2cc(I)sn2)c(C)cc1F 2007646892 DBMYNEFSPMHLBD-LBPRGKRZSA-N 426.092 4.988 50 10 IJGE C[C@H](Cl)CC(C)(C)CNc1ncc(I)cc1Br 2015758448 HXRVFWPPZNLZKO-QMMMGPOBSA-N 431.543 4.904 50 10 IJGE CCC[C@@H](Br)CCNC(=O)c1c(Br)cccc1Br 2033091828 WBSBCTHAXLNHSF-SECBINFHSA-N 441.989 4.895 50 10 IJGE N#CC(=Cc1ccccc1OC(F)(F)F)S(=O)(=O)c1ccc(Br)cc1 2040489227 JRUKGSKJGZGNRX-UHFFFAOYSA-N 432.217 4.686 50 10 IJGE COCCCCN(Cc1ccccc1)S(=O)(=O)c1cc(C)c(CBr)s1 2059287020 SEKTYMVRSWRKNL-UHFFFAOYSA-N 446.432 4.569 50 10 IJGE Clc1cc(CN2CCC[C@H](CBr)CC2)ccc1I 2086657786 IEFOCWXEGRCROI-NSHDSACASA-N 442.566 4.942 50 10 IJGE COC[C@H]1C[C@@H](Cc2ccc(I)c(Cl)c2)[C@H](Br)C1 2086664018 GXEKCRDDYSUYBJ-QJPTWQEYSA-N 443.550 4.923 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CN(C[C@@H](Br)C(F)(F)F)c2ccccc21 2106781404 HKMHPGYPCAOCNZ-IUODEOHRSA-N 437.300 4.831 50 10 IJGE Clc1cccc(N2CC[C@H]3COC[C@@H](C2)N3Cc2ccccc2)c1CBr 2139652231 NKJWWPRMMRNLFV-ZWKOTPCHSA-N 435.793 4.715 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1cc(C)cc(Br)c1F 2146559844 HHQHMNJEGASCHQ-SNVBAGLBSA-N 427.177 4.533 50 10 IJGE C[C@@H]1[C@@H](NC(=O)OC(C)(C)C)CC(C)(C)CN1C(=O)c1ccc(CBr)cc1 2162872358 MEACROVBBPIAHD-PBHICJAKSA-N 439.394 4.735 50 10 IJGE CC(C)(C)C[C@@H](CBr)CNC(=O)c1ncc(Br)cc1Cl 2177054732 OYFVLNJJAVWCEH-VIFPVBQESA-N 426.580 4.675 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2Cc1cnn(Cc2ccccc2)c1 2202317636 CICCZWJISIXKSD-UHFFFAOYSA-N 445.748 4.839 50 10 IJGE Cc1sc([C@H](Br)c2cc(S(C)(=O)=O)cs2)cc1Br 2218971126 WXESUUFKKQOACP-LLVKDONJSA-N 430.208 4.768 50 10 IJGE Fc1cc(Br)cc2c1nc(CCCl)n2C[C@@H]1CCN1Cc1ccccc1 2224707520 FBRHSVWCNIPQCA-INIZCTEOSA-N 436.756 4.994 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CCCCCCBr)C[C@H]1c1ccccc1 2231090862 XKCBFDKJKXAQFH-RBUKOAKNSA-N 425.411 4.934 50 10 IJGE Cc1ccc(CBr)cc1NC(=O)c1sccc1I 2264066500 MAHAKIVYUGBYAR-UHFFFAOYSA-N 436.112 4.808 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCCCN1CC1(CBr)CC(F)C1 2265638164 JPLGGEVSXMLWJC-ASPXRTSYSA-N 433.406 4.754 50 10 IJGE CCc1cc([C@H](Br)[C@@]23CCC[C@H]2CS(=O)(=O)C3)sc1Br 2282915397 AKUNIHQWQUTJJK-VHRBIJSZSA-N 442.238 4.724 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2CCCN(C[C@H](CBr)c3ccccc3)[C@@H]2C1 2290276768 UMZVTPBGBULGMD-SLFFLAALSA-N 437.422 4.887 50 10 IJGE CC(=O)Nc1ccc(NC=C(C#N)c2nc(-c3cc4ccccc4oc3=O)cs2)cc1 2296751942 YSOPTHGVPUUTJL-UHFFFAOYSA-N 428.473 4.851 50 10 IJGE CN(C)c1ccc(C=C(C#N)c2nc(CSc3nnnn3-c3ccccc3)cs2)cc1 2297498080 JYXUZUFTVNMHGD-UHFFFAOYSA-N 445.577 4.541 50 10 IJGE O=S1(=O)C[C@H]2C([C@H](Cl)c3ccc(OCc4ccccc4)cc3Br)[C@@H]2C1 2314486504 BGFRUXVTGLZILK-GPMSIDNRSA-N 441.774 4.599 50 10 IJGE CN(Cc1ccc(Cl)cc1I)C[C@@H]1CCC[C@@H]1Br 2318529637 SJEXDYKCEBTZEZ-GWCFXTLKSA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NN=Cc2ccc(-c3ccccc3Cl)o2)C1 2321721602 RJYUHGJXYJBSRA-HNNXBMFYSA-N 431.920 4.697 50 10 IJGE Cc1cc(Br)c(S(=O)(=O)N(C)CCC[C@@H](C)Cl)cc1Br 2361186359 ONDREWRTCCVMHJ-SNVBAGLBSA-N 447.620 4.548 50 10 IJGE CC[C@H](Cl)[C@H]1CCCCN1C(=O)c1ccc(Cl)cc1I 2365582023 LYYDJDGABNQDTR-GXTWGEPZSA-N 426.125 4.957 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(C)cc4)ccc32)c1 38684829 ONYFDRCCUCUKOW-XMMPIXPASA-N 426.472 4.831 50 10 IJGE Cc1ccc(Oc2nc3ccccn3c(=O)c2/C=C(/C#N)C(=O)Nc2cccc(C)c2)cc1 39858545 HDFQNBSJDVEZAO-CYVLTUHYSA-N 436.471 4.649 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2ccc(-c3cccc(C(C)=O)c3)o2)cc1 58894778 BTOPIPAYZRQWRR-DGMIEQENSA-N 434.492 4.512 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2cccc(Cl)c2)cc(Br)c1OC(C)=O 59117089 VDLQLBJVTXXETA-MLPAPPSSSA-N 449.688 4.582 50 10 IJGE C[C@@H](CBr)COc1c(Br)cc([N+](=O)[O-])cc1Br 96869853 GQHAGABTCIBECE-LURJTMIESA-N 431.906 4.530 50 10 IJGE CC1(C)C[C@H](Cl)C[C@@H](NC(=O)c2cc(Cl)ccc2I)C1 693879466 UBCKBUDEUYODDJ-GHMZBOCLSA-N 426.125 4.861 50 10 IJGE BrCC1(CN2CC[C@]3(CN(Cc4ccccc4)CCO3)C2)CCCCCC1 717536506 MDOWDLLUESZXHJ-QHCPKHFHSA-N 435.450 4.699 50 10 IJGE COc1cc(F)cc(NNC(=O)C(C)(C)[C@@H](O)c2ccc(OCc3ccccc3)cc2)c1 778932743 BGOURRYVTBULOA-QHCPKHFHSA-N 438.499 4.616 50 10 IJGE COc1ccc([C@H](NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)C(F)(F)F)cc1 799414055 HLMUFHSWYKQPBT-HNNXBMFYSA-N 432.324 4.515 50 10 IJGE COc1ccc(-n2c(C)cc(C=NNC(=O)c3ccccc3Br)c2C)cc1 916247752 XYNDMGUDEBLVPU-UHFFFAOYSA-N 426.314 4.629 50 10 IJGE CCOc1ccc(Br)c(C=NNC(=O)[C@@H](C)Oc2cccc3ccccc23)c1 1084178766 LTIDLBUASASKLT-OAHLLOKOSA-N 441.325 4.919 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)C1(Cc2ccc(OC(F)(F)F)cc2)CC1 1453768148 IVUAPLXXUYRKJB-UHFFFAOYSA-N 434.443 4.657 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)[C@]2(Cc3ccc(Cl)cc3)C[C@H]3CC[C@H]2C3)c1 1455417845 TZSPNFMCHPCRQR-AXHZCLLHSA-N 437.996 4.688 50 10 IJGE C#C[C@H](NC(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1)c1ccccc1 1478895270 CNVBEUZQEABMTQ-QFIPXVFZSA-N 449.963 4.951 50 10 IJGE C=CCNC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccccc3C)c2C)cc1 1527701045 RGYVFJREUVCGMO-XQNSMLJCSA-N 438.531 4.864 50 10 IJGE Cc1c(C(=O)Oc2cccc3ccccc23)oc2c1C(=NNC(=O)c1ccncc1)CCC2 1772745681 HNKZYPHALUBTSE-UHFFFAOYSA-N 439.471 4.826 50 10 IJGE COc1ccc([N+](=O)[O-])c(C(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)c1 1860391774 ULACQYDQOLPXCX-UHFFFAOYSA-N 447.472 4.560 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865705882 IGOVPDUXWCOMOC-FQEVSTJZSA-N 449.898 4.664 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CC[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)C1 1880761527 OCWBRWIUAWRKOW-KKUMJFAQSA-N 435.403 4.606 50 10 IJGE CCOc1c(C(=O)N(Cc2ccccc2)C[C@H](Br)CC)cccc1[N+](=O)[O-] 1915098193 DAMABOWJXKXCME-MRXNPFEDSA-N 435.318 4.809 50 10 IJGE CC(C)[C@H](CCl)N(Cc1ccccc1)S(=O)(=O)[C@H]1C[C@H](OCc2ccccc2)C1 1958927924 GQJXZEABLDLRNJ-VABKMULXSA-N 436.017 4.830 50 10 IJGE CC[C@@H]1CN(C(=O)OCc2ccccc2)[C@H](CC)CN1CC(C)(C)CBr 1977884926 NQMVWTLJMOHTBU-RTBURBONSA-N 425.411 4.919 50 10 IJGE Cl[C@@H]1CCC[C@H]1CCNc1ncc(I)cc1Br 2015765227 NIIQVLDUDADGAB-GZMMTYOYSA-N 429.527 4.658 50 10 IJGE CN(Cc1cc(Br)ccc1Br)C[C@H]1C[C@@H](Br)C1 2020202032 WKNVMXHDCAPPPR-WVSHTKLVSA-N 425.990 4.817 50 10 IJGE O=C(NC[C@H]1CCCN(C[C@@H](CBr)c2ccccc2)C1)OCc1ccccc1 2044697858 XFPDDTJUCCLNHH-IFMALSPDSA-N 445.401 4.804 50 10 IJGE O=C(CCl)c1c(OC(F)(F)F)cc(I)cc1C(F)(F)F 2055120343 HXPUSIOUENHCOL-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE Cc1cc(S(=O)(=O)N(Cc2ccccc2)CC(F)(F)F)ccc1CBr 2059266226 DOABIDKJDDVIMJ-UHFFFAOYSA-N 436.293 4.643 50 10 IJGE Cc1cnc(-n2nc(CCl)c(I)c2C(F)(F)F)c(C)c1C 2078882443 YPVWLBRNWQXILK-UHFFFAOYSA-N 429.611 4.555 50 10 IJGE Clc1cc(CN2C[C@H]3C[C@H]2CC[C@@H]3Br)ccc1I 2086660209 CDJYCTHWMLCFIN-UTUOFQBUSA-N 440.550 4.692 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCCCN(C[C@H](CBr)c2ccccc2)C1 2106786253 TUWJMCDYRWHBFK-HKUYNNGSSA-N 425.411 4.792 50 10 IJGE CCC[C@H](Cl)CCNS(=O)(=O)c1cc(Br)c(C)cc1Br 2146561980 NRSLHSPWLIAYCV-JTQLQIEISA-N 447.620 4.596 50 10 IJGE Cc1c(CCl)cc(Cl)cc1S(=O)(=O)N(C)[C@H]1CC[C@@H]1OCc1ccccc1 2156443647 RQEIRTGGODTGPO-OALUTQOASA-N 428.381 4.756 50 10 IJGE Cc1c(Cl)cc(C(=O)NC[C@]2(F)C[C@H](CBr)C2)cc1Br 2168554552 RSJHDNYIHZYWPH-KMHCFJFGSA-N 427.539 4.654 50 10 IJGE BrC[C@@H]1CN(Cc2ccc(I)cc2)Cc2ccccc21 2176214930 BVLWELUEYJRBMQ-OAHLLOKOSA-N 442.138 4.786 50 10 IJGE Cc1c(Cl)cc(C(=O)N(C)[C@@H](CCBr)C(F)F)cc1Br 2178516194 TWNNIWILOQVVEE-NSHDSACASA-N 433.518 4.902 50 10 IJGE O=C(c1c(Br)cccc1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Cl)C2 2190688639 XUCAGVSYORYBCE-HKDSHFDBSA-N 425.523 4.534 50 10 IJGE Cc1cc([C@@H](Br)c2ccc3c(c2)OCCO3)ccc1I 2207102929 LZYBWMJPHKLELH-MRXNPFEDSA-N 445.094 4.855 50 10 IJGE Fc1ccccc1[C@H](CBr)OCCOCCOCCOCc1ccccc1 2236090417 YGMKDDJDMQBCTN-NRFANRHFSA-N 441.337 4.528 50 10 IJGE O=C(c1ccc(Cl)c(I)c1)N(CCCl)Cc1ccccc1 2241522986 OWOXQPYZLXUNPG-UHFFFAOYSA-N 434.104 4.826 50 10 IJGE CCN(C[C@](C)(CI)OC[C@@H]1CC[C@H](C)C1)C(=O)OC(C)(C)C 2243467584 OQUXXRPDKHEUMC-DAYGRLMNSA-N 439.378 4.890 50 10 IJGE CCC1(COc2c(Br)cc(CBr)cc2Br)COC1 2259037190 KYXRZZLTHQTIPC-UHFFFAOYSA-N 442.973 4.912 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC2(CC[C@@H]1CBr)CC2 2264505718 BDBSATBEGILMJQ-MRVPVSSYSA-N 427.589 4.944 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@H](Br)[C@H]1OCCO[C@H]1C 2295264777 JYCRNQWSJQJXQU-HJIKLVIJSA-N 428.548 4.659 50 10 IJGE COc1ccc(NC(=O)C(C#N)=Cc2ccc(OCc3ccc(F)cc3)c(OC)c2)cc1 2296374001 RFCRHNUOJQCMEU-UHFFFAOYSA-N 432.451 4.968 50 10 IJGE N#CC(=Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(=O)Nc1ccc([N+](=O)[O-])cc1 2297551351 CYGCSFSDQRXVPR-UHFFFAOYSA-N 438.783 4.962 50 10 IJGE CC[C@@H](Br)CN(CC)Cc1ccc(Cl)c(I)c1 2300243439 WAIDSKMGCAVXRP-LLVKDONJSA-N 430.555 4.940 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3CC[C@@H](Br)[C@H]3C2)c1 2309796510 ZMRNBMFDAFSOSV-LJWDBELGSA-N 438.001 4.817 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)NCc2ccco2)ccc1OC(=O)c1ccc(C)c(C)c1 2314753263 REZIWKRBWULCHP-UHFFFAOYSA-N 444.487 4.738 50 10 IJGE Clc1ccc(COc2cnccc2CBr)c(I)c1 2317810369 GETDDRACRWHCCV-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE CC(C)[C@H](CBr)N(C)C(=O)c1cc(Br)ccc1Br 2318854865 XIBZHMDYFXOMSL-LBPRGKRZSA-N 441.989 4.703 50 10 IJGE COC[C@]1(C)C[C@@]1(CCl)Cc1ccc(I)c(Br)c1 2325224246 VOPWILIXJUTKQY-UONOGXRCSA-N 443.550 4.878 50 10 IJGE CC(C)c1ccccc1NC(=O)CO/C(=C(\C#N)c1nnc2n1CCCCC2)C(F)(F)F 3317555 PYEJUJIKWMWGCI-CAPFRKAQSA-N 447.461 4.580 50 10 IJGE C=CCNC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1cccc(OCCCC)c1 35446759 MEAARBTXTPFBCA-LTGZKZEYSA-N 426.520 4.927 50 10 IJGE Cc1cc(-n2c(C)cc(/C=C(/C#N)C(=O)NCc3ccco3)c2C)ccc1Br 38198656 CFFZVCSBIHTHKS-WQRHYEAKSA-N 438.325 4.981 50 10 IJGE Cc1ccccc1C(=O)NNc1ncnc(Nc2cc(Cl)cc(Cl)c2)c1[N+](=O)[O-] 40588057 CGCXLUAUYHKZJP-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE CCOc1cc(/C=N/NC(=O)c2cc3cc(Br)ccc3o2)cc(Cl)c1O 59304756 QTDIDOGJXXWZHH-ZVBGSRNCSA-N 437.677 4.717 50 10 IJGE O=C(N/N=C/c1ccc(F)cc1)c1cc(Br)ccc1OCc1ccccc1 96095881 LSIUBXVLMYDZNY-ZMOGYAJESA-N 427.273 4.931 50 10 IJGE Cc1cc(S(=O)(=O)Nc2ccc(CCBr)cc2)sc1Br 136857894 DYXFKFCSJLWFQM-UHFFFAOYSA-N 439.194 4.557 50 10 IJGE COc1ccc(CC(=O)N/N=C\c2ccc(OCc3cc(C)ccc3C)c(OC)c2)cc1 169901204 WMHSHKVUNWMXJG-YUMHPJSZSA-N 432.520 4.592 50 10 IJGE COc1ccc2ccccc2c1/C=N/NC(=O)c1ccc2[nH]c(-c3ccccc3O)nc2c1 169926460 TWHBQDUPEXBUIK-JFLMPSFJSA-N 436.471 4.861 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)COc2cc(C)ccc2C(C)C)c(OC)c1 206236280 RJZKWORQONOANL-UNOMPAQXSA-N 437.492 4.582 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)NCc2ccco2)ccc1OC(=O)c1ccc(C)c(C)c1 206677496 REZIWKRBWULCHP-BKUYFWCQSA-N 444.487 4.738 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C\NCc1cccc(Br)c1)C12CC3CC(CC(C3)C1)C2 217058962 XESQDPCCCJMCET-JNDLRXIJSA-N 442.401 4.667 50 10 IJGE CC(=NNC(=O)c1ccc(Br)o1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 252624548 PQIJHFKINYTHLJ-UHFFFAOYSA-N 444.260 4.588 50 10 IJGE COc1ccc(OC)c(-c2cc(C(=O)NN=C/C=C/c3ccco3)c3ccccc3n2)c1 252637599 XUFBRLUALGMQGN-FONYWYSESA-N 427.460 4.941 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)[C@@H](C)Oc2ccc(C)cc2Br)cc1 256017463 NHVXRPOURPKSMG-MRXNPFEDSA-N 432.362 4.521 50 10 IJGE Cc1cc(Cl)c([C@H](Br)c2cnn(C)c2I)cc1C 379219107 RVBMCUDQKZNQAK-LBPRGKRZSA-N 439.522 4.779 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)c1cn(Cc2ccccc2)nc1-c1cccs1 728718286 FLTZVFZTRMNIBJ-UHFFFAOYSA-N 428.439 4.834 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N2CCCc3ccnc(O)c32)c(C)n1-c1cccc(Cl)c1 1130974209 XKNNFYYXLAJLOD-UNOMPAQXSA-N 432.911 4.735 50 10 IJGE BrC[C@@H](CN1CCN(c2cccc(OCc3ccccc3)c2)CC1)C1CC1 1175769752 SWSVXTPERBVWSL-NRFANRHFSA-N 429.402 4.809 50 10 IJGE BrC[C@@H](CN1CC[C@H](Cc2cccc(I)c2)C1)C1CC1 1645784591 YJAMVMGXCXKOEU-ZBFHGGJFSA-N 448.186 4.577 50 10 IJGE Cc1nn(Cc2ccccc2F)c2c1[C@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 1865685794 NHSHQFBWBYAXJP-GOSISDBHSA-N 429.282 4.904 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1ccc(OC)cc1)C(C#N)=C(N)O2 1865714388 JAMQJMLKCLGZQM-NRFANRHFSA-N 434.927 4.764 50 10 IJGE C[C@H](C1CCN(C(=O)OC(C)(C)C)CC1)[C@H](CBr)NC(=O)OC(C)(C)C 1880759864 BMKVRRULBSRLQW-HIFRSBDPSA-N 435.403 4.558 50 10 IJGE COc1cc(CBr)cc(Br)c1OC[C@@H]1C[C@@H]1Br 1910162139 LAUWDUVYEWCGBA-IUCAKERBSA-N 428.946 4.515 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@@]21CCC[C@H](CI)O1 1987456548 TZAZXPOUEBRHGV-KDOFPFPSSA-N 435.346 4.540 50 10 IJGE O=C(Nc1c(Br)cc(Cl)cc1Br)[C@H]1C[C@H]1Br 1991402808 ABXSVQVHHDREPG-NTSWFWBYSA-N 432.337 4.587 50 10 IJGE CC(C)[C@](C)(CBr)NC(=O)c1cccc(Br)c1Br 2031476661 DRNROVDBTSVXCL-ZDUSSCGKSA-N 441.989 4.751 50 10 IJGE CC(C)N1C[C@@H](Br)[C@@H](Cc2cccc(Br)c2Br)C1 2039262941 RXTVJTRSWVBFKR-WCQYABFASA-N 440.017 4.858 50 10 IJGE CC(C)[C@@H](CBr)CN1CCC[C@H](N(CC(F)F)C(=O)OC(C)(C)C)C1 2044698300 AUPHPBKNTNBKBF-GJZGRUSLSA-N 427.374 4.620 50 10 IJGE CC[C@H](Br)[C@H]1CCCCN1C(=O)c1sccc1I 2051079127 PEQWLVNKSZKRSZ-GXSJLCMTSA-N 442.160 4.521 50 10 IJGE CCC(CC)(CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1 2066631537 BGDHIUZRHBZHJU-ZDUSSCGKSA-N 431.337 4.671 50 10 IJGE O=C(N[C@H]1C[C@H]2CC[C@H]1N(CCCCCCCCCBr)C2)C(F)(F)F 2106787292 YOTAUONZFMSXDT-OWCLPIDISA-N 427.349 4.643 50 10 IJGE COc1ccc(NC(=O)[C@@H](Br)C2CCCC2)cc1NC(=O)OC(C)(C)C 2110720253 BVTVPQQQQSTEOO-INIZCTEOSA-N 427.339 4.934 50 10 IJGE O=C(NC[C@H]1C[C@@H](Cl)C12CCC2)c1scc(Br)c1Br 2115601367 GICVNAWBCNZDFV-VXNVDRBHSA-N 427.589 4.801 50 10 IJGE C[C@@]12CC[C@@](CCl)(C1)N(C(=O)c1scc(Br)c1Br)C2 2134817394 QXEIUQBQFJVKNM-OLZOCXBDSA-N 427.589 4.897 50 10 IJGE CCN(C(=O)c1ccc(CBr)cc1)[C@H]1CCC[C@H]1CNC(=O)OC(C)(C)C 2162915150 JJYRACZAFCYKBP-ROUUACIJSA-N 439.394 4.737 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc2c(c1)CCN(C(=O)[C@H](Br)C1CCCC1)C2 2167034074 QKADNXQZTKKDQP-GOSISDBHSA-N 437.378 4.872 50 10 IJGE CCC[C@@]1(CNC(=O)[C@@H](Br)C2CCCC2)CCCN(C(=O)OC(C)(C)C)C1 2167048147 OTDPGGYTNJKRNW-UWJYYQICSA-N 445.442 4.874 50 10 IJGE CN(Cc1nn(C)c(Cl)c1Br)C[C@H](Br)C1CCCCC1 2167656453 QIWNRHFGRTXLNI-NSHDSACASA-N 427.612 4.612 50 10 IJGE CN(Cc1ccccc1)[C@@H]1CCCCN(c2ccc(CBr)c([N+](=O)[O-])c2)C1 2188572004 LXVPJAHTAKHKHO-HXUWFJFHSA-N 432.362 4.981 50 10 IJGE COc1cc(F)c([C@@H](Cl)c2nn(C)c(Br)c2C)cc1Br 2202901840 IETKDRMBJQYSNO-LLVKDONJSA-N 426.511 4.729 50 10 IJGE Cc1cc(C(=O)N2[C@H]3CCC[C@H]2CC(Br)C3)ccc1I 2207106162 ZVCSBUUXDFGGES-KBPBESRZSA-N 448.142 4.520 50 10 IJGE CCC[C@@H](Cl)c1cn(-c2ccc(Br)cc2I)nn1 2223528096 BJTXURSXBIYVLF-SECBINFHSA-N 440.510 4.714 50 10 IJGE COc1cc(OC)c([C@H](Br)[C@@H]2C[C@H]2Br)cc1Br 2252870740 POXXVJRTSXOOMH-SLOVDRIHSA-N 428.946 4.686 50 10 IJGE CC1CC(CBr)(CN2CCC[C@@]3(CCCN(C(=O)OC(C)(C)C)C3)C2)C1 2265312157 PQKNISAOHFVSPT-TWMPVWRBSA-N 429.443 4.911 50 10 IJGE C[C@@H]1C[C@H]1N(CCBr)Cc1ccc(Cl)c(I)c1 2300242104 GTRIWODMGLMVDC-NOZJJQNGSA-N 428.539 4.550 50 10 IJGE FC1(F)[C@H]2CC(CBr)(Cc3sccc3I)C[C@@H]21 2301052801 KMVVHOAFJXQNEE-YUMQZZPRSA-N 433.099 4.952 50 10 IJGE ClC[C@@H]1CC[C@@H](NCc2ccc(I)c(Br)c2)C1 2306223859 KEYMPUOBCSFENO-MWLCHTKSSA-N 428.539 4.551 50 10 IJGE C[C@@H](Br)[C@@H]1CCN(Cc2cc(I)ccc2Cl)C1 2307315738 KKYICNWGSLRSQZ-NXEZZACHSA-N 428.539 4.550 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Br)Cc1cccc(F)c1 2316834681 SIXQOVYCEJOCKM-VIFPVBQESA-N 440.936 4.763 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC=C(C#N)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 2318463102 WSHCIOHKEOOAAO-UHFFFAOYSA-N 440.765 4.734 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCC[C@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2353830370 CLFOCWYLXVGZPG-YOEHRIQHSA-N 445.364 4.965 50 10 IJGE Cc1nc(Br)c([C@H](Cl)c2c(Br)cc(F)c(F)c2F)n1C 2362440836 FKVGPKVMEIIIGS-MRVPVSSYSA-N 432.465 4.999 50 10 IJGE COc1c(Br)cc(C)c([C@@H](Cl)[C@@]2(C)COCCO2)c1Br 2365232762 RALKKOWLZWSVSN-ZIAGYGMSSA-N 428.548 4.614 50 10 IJGE COc1cccc([C@@H](C(=O)NC2CCCCC2)N(Cc2ccc(C)cc2)C(=O)CCl)c1 3039798 WULWGXQPMITLCL-DEOSSOPVSA-N 442.987 4.761 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2F)ccc1OC(=O)c1ccc(C)cc1 33500150 XRRBTUJCNKVROO-UYRXBGFRSA-N 430.435 4.908 50 10 IJGE Clc1cc(I)c(OCCCBr)c2ncccc12 36330770 WXDXIXVXPDWCCE-UHFFFAOYSA-N 426.479 4.657 50 10 IJGE CCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccccc3Cl)c(OC)c2)C1=O 38603348 HNUORLRKNNOHBH-WOJGMQOQSA-N 436.895 4.540 50 10 IJGE O=S(=O)(NC[C@@H]1CCC[C@H]1CCl)c1c(Cl)cc(Br)cc1Cl 91375708 CHHSZQZZUULLBC-IUCAKERBSA-N 435.598 4.689 50 10 IJGE O=C(N/N=C/c1c(O)ccc2ccccc12)c1ccc(NC(=O)c2ccc(F)cc2)cc1 97729896 ZGWPAXQJLAWOGF-JFLMPSFJSA-N 427.435 4.701 50 10 IJGE CCCCCCCOc1ccc(C(=O)NNC(=O)c2ccc(NC(=O)CCC)cc2)cc1 100153671 KVEYVIMZFYNYNH-UHFFFAOYSA-N 439.556 4.849 50 10 IJGE C[C@@H](Br)C[C@@H](C)NC(=O)c1cc(Br)c(Br)s1 165526863 CDUMVHADGWRLIT-PHDIDXHHSA-N 433.991 4.565 50 10 IJGE CCCOc1ccccc1/C=C\C(=O)Oc1ccc(/C=C(\C#N)C(=O)OCC)cc1OC 207002644 DUMYQQCULOEPIX-KVWUQHRGSA-N 435.476 4.573 50 10 IJGE C[C@@H](N/C=C(/C#N)C(=O)Nc1ccc(Br)cc1)C12CC3CC(CC(C3)C1)C2 216778308 VZOQWTUJJRQFLM-IAYYKLOSSA-N 428.374 4.990 50 10 IJGE CC[C@](C)(CCBr)NC(=O)c1cc(Br)sc1Br 228574176 DPSALAGRCURQQK-LLVKDONJSA-N 448.018 4.957 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccncc2)ccc1OC(=O)c1cccc2ccccc12 263631904 CKJNTLWTJJZEFF-UHFFFAOYSA-N 439.471 4.617 50 10 IJGE CC(C)(C)C[C@H](Br)CNS(=O)(=O)c1c(Cl)cccc1Br 312379324 QZRMGJGVKXUXFI-VIFPVBQESA-N 447.620 4.581 50 10 IJGE O=S(=O)(c1cc(F)c(Cl)c(CCl)c1)N1CCC(OCc2ccccc2)CC1 383942245 YHARTXUFLUBZOE-UHFFFAOYSA-N 432.344 4.588 50 10 IJGE O=C(NC1(CCBr)CCSCC1)c1cc(Cl)cc(Br)c1 719664286 DFBMOJLUAKTKCW-UHFFFAOYSA-N 441.616 4.883 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 741285293 YXMARVWHBPOSFY-RYUDHWBXSA-N 449.307 4.759 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F 776012211 FQWSKPVPFKAPHO-CYBMUJFWSA-N 429.267 4.635 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OC[C@H]2Cc3ccccc32)c(-c2ccc(Cl)cc2)n1 803218650 WCIKDLWQMIGDAM-UBXANZILSA-N 442.906 4.907 50 10 IJGE CC#CCCCC(=O)NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1 1348283074 PDFZKYRMWAXFPX-UHFFFAOYSA-N 426.516 4.887 50 10 IJGE BrC[C@@H](CN1Cc2cc(Br)ccc2OC2(CCC2)C1)C1CC1 1460801422 LXDDUFAXQXPJRF-HNNXBMFYSA-N 429.196 4.987 50 10 IJGE CC(=O)c1ccc2c(c1)CN(C(=O)/C(C#N)=C/c1cc(C)n(-c3ccccc3F)c1C)C2 1525219757 FVZVSNDBBLPPSV-WSDLNYQXSA-N 427.479 4.885 50 10 IJGE C=CCOc1ccc(CNC(=O)NNc2cc(C(F)(F)F)ccc2Br)cc1 1681032923 ZHGBVIVZVAAXJE-UHFFFAOYSA-N 444.251 4.859 50 10 IJGE Cc1c(C(=O)NCc2ccco2)oc2c1C(=NNC(=O)c1cccc3ccccc13)CCC2 1772749087 WMJZXUIYCZMEKA-UHFFFAOYSA-N 441.487 4.735 50 10 IJGE CCc1cc(Br)cc2c1O[C@]1(C=C2)CCN(C(=O)/C(C#N)=C/c2ccccc2)C1 1859497767 LLVFKZRFMYOAKW-GWZGDKMZSA-N 449.348 4.995 50 10 IJGE CCCc1nn(Cc2cccc(F)c2)c2c1[C@H](c1cccc(OCC)c1)C(C#N)=C(N)O2 1865689462 AAULDSATMTUSJD-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)S(=O)(=O)c1ccc(Cl)c(F)c1Cl 1916332845 LMAPNCQCXMAAPF-ZDUSSCGKSA-N 440.751 4.577 50 10 IJGE C[C@H]1C[C@@H](Br)CN(Cc2ccc(Br)cc2Br)C1 1943860181 VRTNKJHDAPZPIC-JOYOIKCWSA-N 425.990 4.817 50 10 IJGE FC(F)C[C@@H](CBr)NCc1cccc(Br)c1Br 1943904773 ANBZSGOHKSKNJI-QMMMGPOBSA-N 435.932 4.720 50 10 IJGE Cc1nn(C)c(Br)c1CN(Cc1ccccc1)[C@@H](CBr)C(C)C 1986916027 XMUJVRDCDSWFBG-KRWDZBQOSA-N 443.227 4.913 50 10 IJGE Cc1nn(C)c([C@@H](Br)c2sccc2Br)c1Br 1989610628 WCRXVUDFBUDPCK-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE Cc1c(Br)sc([C@@H](Br)[C@]2(C)COCCO2)c1Br 2021898312 XSGNABHENBQRAE-KOLCDFICSA-N 449.002 4.823 50 10 IJGE CCN(CCCCCl)C(=O)c1ccc(I)c(Br)c1 2041185049 IILNWUDQNUZHMU-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE Brc1cnc(N2CC3(CCC(Br)CC3)C2)c(Br)c1 2060770032 UGRNDGPLQHWRRN-UHFFFAOYSA-N 438.989 4.751 50 10 IJGE Fc1ccc(F)c(-n2nc(CBr)c(Br)c2C(F)(F)F)c1F 2079231999 KQSHCKVSCDLYFG-UHFFFAOYSA-N 437.963 4.966 50 10 IJGE CCC[C@H]1CN(c2ncc(I)cc2Br)C[C@@H]1CCl 2084893741 NICSRKFNTFWTDE-UWVGGRQHSA-N 443.554 4.540 50 10 IJGE COc1ccc(S(=O)(=O)N(Cc2ccccc2)CC2CCC2)cc1CBr 2123270172 MDGFSXIQORSGIP-UHFFFAOYSA-N 438.387 4.581 50 10 IJGE CCN(CC1(CBr)CCOCC1)[C@@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2163058836 OCLWODKORBLTTP-QZTJIDSGSA-N 447.458 4.584 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCCC[C@@H]1CN(C[C@@H](CBr)c1ccccc1)C2 2169634117 OOQLNCGOWPUPJG-KNKQGSTJSA-N 437.422 4.934 50 10 IJGE Cc1c([C@H](Cl)c2c(Br)cc(F)c(F)c2F)c(Br)nn1C 2188150740 QUPXCAHJOWANET-VIFPVBQESA-N 432.465 4.999 50 10 IJGE O=C(c1ccc(Cl)c(Br)c1)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Br)C2 2190678180 KHKOEFZGAYHZRM-SKZLGDCLSA-N 425.523 4.581 50 10 IJGE CCC(CC)N(CCBr)C(=O)c1cc(C)ccc1I 2232158759 YZZKHKATNFFMQC-UHFFFAOYSA-N 438.147 4.625 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1Cc1cnsn1 2234067807 NQNGLPCSVVWXQU-LURJTMIESA-N 436.560 4.761 50 10 IJGE CN(C[C@@H](F)[C@H]1CCOC1)c1c(CBr)ccc(Br)c1Cl 2238357290 IDGANBVHLAUUGT-CMPLNLGQSA-N 429.555 4.808 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCCCBr)[C@H](CC(F)F)C1 2263161709 CZVIWAKMLTVSQH-OAHLLOKOSA-N 427.374 4.908 50 10 IJGE O=C(c1cccc(Cl)c1Br)N1CC[C@@H](Br)C(F)(F)CC1 2283142668 MVPWAJFZKWPGHC-SNVBAGLBSA-N 431.502 4.737 50 10 IJGE ClCC[C@@H](NCc1ccc(I)c(Br)c1)C1CC1 2306222648 WZZQJQAWGPRJPR-CYBMUJFWSA-N 428.539 4.551 50 10 IJGE COc1c(Br)cc([C@@H](Br)[C@@H]2C[C@@H]2Br)c(OC)c1C 2313498991 ZNTCMGDIAZZPQD-HDBBIHSSSA-N 442.973 4.994 50 10 IJGE C=CCOc1ccc(C=C2C(=O)N([C@H](C)c3ccccc3)C(=O)C(C#N)=C2C)cc1OC 2314617886 CMTAYPOMKLLXSE-GOSISDBHSA-N 428.488 4.613 50 10 IJGE CN[C@@H](c1c(C)cc(Br)c(OC)c1Br)[C@@H]1C[C@@H]1Br 2317397955 GPLJDFMKDYREMF-RGNHYFCHSA-N 441.989 4.573 50 10 IJGE COc1ccc(C(C#N)=Cc2ccc(OC(=O)c3ccc([N+](=O)[O-])cc3)c(OC)c2)cc1 2320506509 LEYDYJYHBWDXRM-UHFFFAOYSA-N 430.416 4.895 50 10 IJGE Cc1c(Cl)cc(C(=O)NCCSCCCBr)cc1Br 2335632646 CTXFWZKGURKUAV-UHFFFAOYSA-N 429.605 4.659 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)CC[C@@H]1C(F)(F)F 2353834171 LGSVWTWSBOEHTA-HUUCEWRRSA-N 445.364 4.917 50 10 IJGE COCc1ccc(CC(CBr)(CBr)C2CCOCC2)s1 2368239934 ZUJURTSHIAIQSH-UHFFFAOYSA-N 426.214 4.640 50 10 IJGE CC(C)C[C@H](CBr)CN1CCC([C@H]2CCCN(C(=O)C(F)(F)F)C2)CC1 2382184984 SDOMWQFSUPQGHF-WBVHZDCISA-N 441.376 4.557 50 10 IJGE Cc1ccccc1/C=N/NC(=O)c1cccc(NC(=O)c2cccc(Br)c2)c1 27520066 CEEALEVYUSXDKT-ZVHZXABRSA-N 436.309 4.774 50 10 IJGE CCOc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C)c2C)cc1I 33705886 DSXMZPTVEJLMEO-YBEGLDIGSA-N 446.288 4.852 50 10 IJGE N#C/C(=C/Nc1ccc(O)c(C(=O)O)c1)c1nc(-c2cccc(Br)c2)cs1 33747254 WZPUDZNGWDNNIF-XFXZXTDPSA-N 442.294 4.953 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(OC)cc2)CCC3)cc1 40813908 HSKUUXINLQSMSE-SZXQPVLSSA-N 446.503 4.849 50 10 IJGE C[C@@H](Br)CCCNC(=O)c1cc(Br)sc1Br 227715592 QMCFEEXXPQCEDF-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE COc1ccc(C=NNC(=O)CSc2nc3ccccc3n2Cc2ccc(C)cc2)cc1 254845671 YEOWFCPZLXTTHL-UHFFFAOYSA-N 444.560 4.644 50 10 IJGE NNC(=O)c1ccc2nc(-c3ccc(OCc4ccc(Cl)c(Cl)c4)cc3)[nH]c2c1 256048965 XKNVFYZBYLHCBG-UHFFFAOYSA-N 427.291 4.719 50 10 IJGE O=C(NCCCCCCI)c1cccc(OCc2ccccc2)c1 310247614 JTRUFHQWOVXFNM-UHFFFAOYSA-N 437.321 4.991 50 10 IJGE Cn1ncc([C@@H](Br)c2ccc(F)c(Br)c2)c1Br 383258487 SJYPIESTPOUQOC-JTQLQIEISA-N 426.909 4.569 50 10 IJGE CCOc1c(Br)cc(/C=C(/C#N)C(=O)Nc2ccccc2CC)cc1OC 1084217790 BZKAFOIBTVOPHC-YBEGLDIGSA-N 429.314 4.964 50 10 IJGE COc1ccccc1C=NNC(=O)c1ccc(CN2CCC(Cc3ccccc3)CC2)cc1 1084222024 CCEGTNAKMYCJKN-UHFFFAOYSA-N 441.575 4.914 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2cccc(Cl)c2SC(C)C)cc1 1667414570 VAWMVBBIVUAPCE-AWEZNQCLSA-N 449.960 4.663 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccccc2)cc1OCC 1865688243 NUKZSPHLCOTUQD-XMMPIXPASA-N 444.535 4.646 50 10 IJGE CCCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3CC(C)C)cc1OC 1865695682 GIYKPAVGFASJLW-QFIPXVFZSA-N 438.572 4.897 50 10 IJGE CCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@H]2c1cc(Br)ccc1F 1865702177 OUYOPTNKFQRFKW-QGZVFWFLSA-N 439.288 4.690 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@@H]2c1cc(Cl)c(O)c(OC)c1 1865707465 XLVWFETVFSJJPM-SFHVURJKSA-N 436.899 4.546 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](NC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)c2ccccc2)cc1 1866938409 DIWGOVQLKUPEAH-DNVJHFABSA-N 445.519 4.999 50 10 IJGE CC1(NC(=O)OC(C)(C)C)CCC([C@@H](CBr)NC(=O)OC(C)(C)C)CC1 1880761237 LYNDDJGQEWGZPF-SHYRYGCCSA-N 435.403 4.748 50 10 IJGE CC(C)(CI)CN1CCCC[C@H]1CCCNC(=O)OC(C)(C)C 1904652948 GXDRDOFVLXXHQK-HNNXBMFYSA-N 438.394 4.607 50 10 IJGE CC1(C)C[C@@H](Br)CN1C(=O)c1csc(Br)c1Br 1949203711 FUXKYKJIHGBZME-ZCFIWIBFSA-N 446.002 4.661 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]23CCC[C@@]2(CN(C[C@@H](CBr)C2CCC2)C3)C1 1966579046 JZMYTGIOWXOZES-DUXKGJEZSA-N 427.427 4.521 50 10 IJGE CCOC(=O)[C@@]1(CC2CC(Br)C2)CCCN(C(=O)OCc2ccccc2)C1 2020238064 VZXIIILGNTZBSF-WIXQSORDSA-N 438.362 4.532 50 10 IJGE O=C(CCl)c1cc(C(F)(F)F)c(I)cc1OC(F)(F)F 2055120105 BROLHNQVNOFTDP-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE CC(C)[C@@H](Br)c1cn(-c2cc(Cl)ccc2I)nn1 2057420667 FLJPCMALKRHNOZ-GFCCVEGCSA-N 440.510 4.617 50 10 IJGE Cc1cc(Br)c(C)c([C@@H](Br)[C@H]2COCCO2)c1Br 2081072679 XAGCOUZLOHJPBK-MFKMUULPSA-N 442.973 4.680 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CCN(C[C@@H](CBr)c3ccccc3)CC[C@H]2C1 2163065185 YDZFEIDKXWPIOK-HSALFYBXSA-N 437.422 4.744 50 10 IJGE CC[C@H](Br)[C@H]1CCCCN1S(=O)(=O)c1cc(Br)sc1C 2170612545 JCENSLXXHZOEBQ-WDEREUQCSA-N 445.242 4.536 50 10 IJGE CN(Cc1c(Cl)ncn1C)c1cc(Br)cc(F)c1CBr 2170694125 RZWHVFJBRMUKNK-UHFFFAOYSA-N 425.527 4.506 50 10 IJGE O=C(c1ccc2cc(Br)ccc2c1)N1CCC(I)CC1 2198573668 VYDNCXNPAWVJNA-UHFFFAOYSA-N 444.110 4.642 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@](C)(CNC(=O)c2ccc(CBr)cc2)CC1(C)C 2236681366 UXHCCNGUXQKAEY-OAQYLSRUSA-N 439.394 4.737 50 10 IJGE COc1cc(OC)c([C@@H](Cl)c2cc(I)sn2)cc1Cl 2264476965 UPKUVZVYHWLQEK-GFCCVEGCSA-N 430.094 4.747 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2COC3(CCC3)C2)cc1I 2269555808 YYYNGMQSNHUNCB-FZMZJTMJSA-N 437.115 4.695 50 10 IJGE COC[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)N(CC2(CBr)CCCCCC2)C1 2289496962 YHXZSHOTYUQZJT-ROUUACIJSA-N 447.458 4.584 50 10 IJGE CC(C)[C@H](CBr)N(C)Cc1ccc(Cl)cc1I 2302497919 KFQBJIIRVOVULT-ZDUSSCGKSA-N 430.555 4.796 50 10 IJGE CC[C@@H](C)N1C(=O)C(=Cc2ccc(OCc3ccc(F)cc3)c(OC)c2)C(C)=C(C#N)C1=O 2314611131 RCJISSJMJNRJIA-MRXNPFEDSA-N 448.494 4.804 50 10 IJGE Cc1ncc(CCl)c(Oc2cc(Br)cc(I)c2)n1 2316720367 NZTYNSQMEOQQIZ-UHFFFAOYSA-N 439.478 4.683 50 10 IJGE Clc1ccc(I)cc1CN1CCC[C@@H](CBr)CC1 2327397890 WVDCQDJCMXHVGN-LLVKDONJSA-N 442.566 4.942 50 10 IJGE Clc1ccc(I)cc1CN1[C@H]2CC[C@H](Br)[C@H]1CC2 2327409272 MIKLMNOQFILHJP-SGMGOOAPSA-N 440.550 4.835 50 10 IJGE CCOc1ccc(OCC)c(-c2csc(C(C#N)=C(O)CNC(=O)c3ccccc3)n2)c1 2331376650 CNBODSGUZOYORY-UHFFFAOYSA-N 449.532 4.830 50 10 IJGE CCC[C@@H](CBr)CN1C[C@@H]2CC(F)(F)CC[C@]2(NC(=O)OC(C)(C)C)C1 2344114407 CZZAEILPEZCQDD-MPGHIAIKSA-N 439.385 4.812 50 10 IJGE O=C(N/N=C/c1ccc(-c2ccc(Br)cc2)o1)c1cncc(Br)c1 3127343 WPZAVNLNTLTKLM-UFFVCSGVSA-N 449.102 4.631 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1Cl)c1ccc(OCCOc2ccccc2)cc1 14039469 KFQWQLWGJCJGQV-UHFFFAOYSA-N 445.302 4.526 50 10 IJGE Cc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)/C(C#N)=C\c2cccs2)cc1 35351746 XJHQKXLDDXGSFR-LGMDPLHJSA-N 437.546 4.711 50 10 IJGE COc1ccc(CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(Cl)c2)cc1 38651264 FMMCFOSIYTWDMD-DEOSSOPVSA-N 446.890 4.715 50 10 IJGE CCOc1ccc(NC(=S)NNC(=O)c2ccc(-c3cccc(C(F)(F)F)c3)o2)cc1 39892610 VPUOIXMAAQQZTK-UHFFFAOYSA-N 449.454 4.996 50 10 IJGE CCN(C(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccoc1C)CCC2)c1cccc(C)c1 40823560 NMENTZLZSHJOSH-LHLOQNFPSA-N 433.508 4.935 50 10 IJGE CCc1cccc(C)c1NC(=O)/C(C#N)=C\Nc1ccc(I)cc1 217220445 SOLSKFITCXFKOR-QINSGFPZSA-N 431.277 4.620 50 10 IJGE O=C(N[C@H]1CCC[C@H]1CBr)c1cc(Br)sc1Br 231543467 BXPOXWDCXFDWLN-XPUUQOCRSA-N 446.002 4.567 50 10 IJGE Cc1cccc(C(=O)NC[C@@H](Br)CC(C)(C)C)c1I 235787313 FJJKYCZSSQSXGM-NSHDSACASA-N 438.147 4.529 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2ccc(F)cc2Cl)[C@@H](CI)C1 382698205 MHYCZJPFNBNGNO-GWCFXTLKSA-N 439.696 4.865 50 10 IJGE Cn1ncc([C@H](Br)c2ccc(C(C)(C)C)s2)c1I 386273702 XTYDZFUSDRJDIK-NSHDSACASA-N 439.160 4.868 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1Cc1cc(Cl)ccc1I 405325034 BRFQLVLZZUYEJM-BXKDBHETSA-N 428.539 4.692 50 10 IJGE CC(=O)N(C)c1ccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 743713542 IBVUZFFKDDPAEB-ZHZULCJRSA-N 430.483 4.762 50 10 IJGE N#Cc1ccccc1COc1ccccc1C=NNC(=O)c1ccccc1Br 1084460537 RWFNQAOSYMOYOH-UHFFFAOYSA-N 434.293 4.664 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNc3cccc(Br)n3)cc2)cc1 1141815929 DPAQSYLXZXQGHI-UHFFFAOYSA-N 426.270 4.596 50 10 IJGE COc1ccccc1-c1ccc(C(=O)N2CC[C@H](O[Si](C)(C)C(C)(C)C)C2)c(O)n1 1149156490 PKVDXJIXCKACMX-INIZCTEOSA-N 428.605 4.699 50 10 IJGE COc1ccccc1-c1cccc(NC(=O)NNC(=O)c2ccc(Br)cc2)c1 1320118682 PBNPPSYGFGCECN-UHFFFAOYSA-N 440.297 4.591 50 10 IJGE CC(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(C)cc3)nc3ccccc23)cs1 1347920029 NBZMQXWODMKEIT-UHFFFAOYSA-N 429.501 4.549 50 10 IJGE CC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2sc3cc(F)ccc3c2Cl)c1C(C)C 1558911568 FCJCJLKQJBBECH-UHFFFAOYSA-N 435.908 4.731 50 10 IJGE C=CCCCNC(=O)NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1 1682054407 GDQNUJJTZYHTSA-UHFFFAOYSA-N 429.520 4.843 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CCC)nn3Cc2ccccc2)cc1 1865693977 NPRTXUVVCBZRPQ-HSZRJFAPSA-N 428.536 4.891 50 10 IJGE Cc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865702311 SEGFUPDDJODLOD-LJQANCHMSA-N 430.817 4.529 50 10 IJGE O[C@H](c1c(Cl)cc(Br)c(F)c1Br)[C@@H]1C[C@H]1Br 1900375751 GGWIZLHMYKUPFF-SGTYWVLOSA-N 437.328 4.821 50 10 IJGE CN(C[C@](C)(CBr)C(C)(C)C)[C@H]1CCN(C(=O)OCc2ccccc2)C1 1904845251 PRUUTOISPRHSSB-RXVVDRJESA-N 425.411 4.777 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2Cc1csnc1Br 1925105383 DMRCXYWUDHNCSE-UHFFFAOYSA-N 436.560 4.508 50 10 IJGE C[C@@H](Br)CCN(C)C(=O)c1csc(Br)c1Br 1937737284 GIAKGGIVSVNDGH-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE C[C@@H]1C[C@H](CBr)CN1Cc1cc(Cl)ccc1I 1950510330 LZAJMRSQEQYRJQ-NXEZZACHSA-N 428.539 4.550 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Cl)c2)CC[C@@H]1Br 2026560697 MCIZPPMRURVCIH-ONGXEEELSA-N 428.539 4.550 50 10 IJGE Clc1cc(CN[C@H](CBr)CC2CC2)ccc1I 2026565191 ZLEHSRGZKJLUJC-NSHDSACASA-N 428.539 4.598 50 10 IJGE C[C@@]1(CCBr)CCN1Cc1ccc(I)c(Cl)c1 2026568050 XUNSUYCYIGQCKS-CYBMUJFWSA-N 428.539 4.694 50 10 IJGE O=C(NCC[C@@H](Br)C1CC1)c1ccc(Br)cc1Br 2029910948 FBWUPDFVGSBMPI-LLVKDONJSA-N 439.973 4.505 50 10 IJGE CC(C)(C)OC(=O)NCCCN(C[C@@H](Br)C(F)(F)F)c1ccccc1 2044702913 PFYNIQJGLNBHCW-CQSZACIVSA-N 425.289 4.734 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1cc(Br)ccc1Cl 2081235483 GPIVCYKPMACNHC-UFBFGSQYSA-N 444.538 4.682 50 10 IJGE CC1(C)OCCO[C@H]1[C@@H](Br)c1ccc(Br)cc1Br 2083338155 MBMADQFAWJWPLW-RYUDHWBXSA-N 442.973 4.842 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCN(C[C@@H](CBr)c2ccccc2)C1 2163059729 WBOHJCZUIAFWPK-XUVXKRRUSA-N 437.422 4.887 50 10 IJGE ClCCOCC1CCN(Cc2cccc(Br)c2Br)CC1 2167400139 NARVJNHBJXUOQJ-UHFFFAOYSA-N 425.592 4.679 50 10 IJGE CN(Cc1c(F)ccc(Br)c1F)C1(CBr)CCSCC1 2171184002 QFSXCVDFTSGEPX-UHFFFAOYSA-N 429.168 4.820 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@@H](Br)[C@]12C[C@H](CO1)C2 2213489411 LPDSLINXKIDJPH-KKIHLJRUSA-N 428.921 4.966 50 10 IJGE Clc1cc(Br)cc(CC23COC(CI)(C2)C3)c1 2216252784 MWNFRAZCLLAYTN-UHFFFAOYSA-N 427.507 4.629 50 10 IJGE CC1(C)CN(c2ncc(I)cc2Br)C[C@H]1CCCl 2222561349 QZUJRXWKNDXODT-SECBINFHSA-N 443.554 4.540 50 10 IJGE ClCCc1nc2cc(Br)c(Br)cc2n1C[C@@H]1C[C@@H]1Cl 2225702272 PNYZSWHLAIIMAC-XVKPBYJWSA-N 426.967 4.970 50 10 IJGE Fc1ccc([C@H](CI)OC2CCN(Cc3ccccc3)CC2)cc1 2250385942 IXTHTISXKDTNAW-FQEVSTJZSA-N 439.312 4.983 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C[C@@]23CC3(F)F)cc1I 2257367863 DFHWYBKWTMUSII-KPXOXKRLSA-N 429.042 4.781 50 10 IJGE Cn1cc(Br)c(COc2c(Cl)cc(CBr)cc2Cl)n1 2278817967 LZXHMTSFTMRZSO-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE N#CC(=Cc1c(Oc2ccccc2)nc2ccccn2c1=O)C(=O)Nc1ccccc1Cl 2296849762 OMHOFSYKSCWRPA-UHFFFAOYSA-N 442.862 4.686 50 10 IJGE CC1(C)OC[C@H](Cc2ccc(I)c(Br)c2)[C@H]1Cl 2306216493 GUCCHFWBQQXDIB-JOYOIKCWSA-N 429.523 4.629 50 10 IJGE Brc1cc2c(cc1[C@@H](Br)[C@@H]1C[C@H]1Br)OCCCO2 2311267345 XQSFLEITDXWPIM-JPVBRFOXSA-N 440.957 4.830 50 10 IJGE CCCN[C@@H](Cc1cc(Br)cc(Br)c1)[C@@H]1C[C@H]1Br 2313495716 OYVMJDPUYKAONC-MCIONIFRSA-N 440.017 4.906 50 10 IJGE N#CC(=Cc1ccccc1OCc1ccc(Br)cc1)C(=O)NC1CCCC1 2313670817 YFGQAFJTOGJQFD-UHFFFAOYSA-N 425.326 4.994 50 10 IJGE CC(C)[C@H](Br)C(=O)N(C)Cc1c(Br)cccc1Br 2318202884 MCJKGRRYPQSJIA-LBPRGKRZSA-N 441.989 4.590 50 10 IJGE CC(C)[C@H](CBr)N(C)C(=O)c1cccc(Br)c1Br 2318855566 SQTSCLPDGIIGCP-NSHDSACASA-N 441.989 4.703 50 10 IJGE CC(C)Sc1nc2ccc(C(=O)NN=Cc3cc(Cl)c(O)c(Cl)c3O)cc2[nH]1 2323608573 CAFZHMCTKOEVSZ-UHFFFAOYSA-N 439.324 4.545 50 10 IJGE N#CC(=CNCCc1ccccc1Br)C(=O)Nc1cc(Cl)ccc1Cl 2324392508 MFBHZVMEONKZAY-UHFFFAOYSA-N 439.140 4.934 50 10 IJGE N#CC(=CNC1CCCCCC1)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 2324608260 FCGLZDGFUPMXBL-UHFFFAOYSA-N 442.607 4.640 50 10 IJGE Cl[C@@H]1CCN(Cc2ccc(I)c(Br)c2)[C@@H]2CC[C@@H]12 2325210329 XBDHHWMVJJIKLD-ZKYQVNSYSA-N 440.550 4.645 50 10 IJGE ClC[C@@H]1CC2(CC2)CN1Cc1ccc(I)c(Br)c1 2325219181 WHWWVSUTELQJTR-NSHDSACASA-N 440.550 4.647 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 2343416441 QCAQKYUXQBNMKO-ZACQAIPSSA-N 436.312 4.842 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)OC(C)(C)C)C1 2353833744 HUCGWONAUVYJQS-SPOLIRPYSA-N 429.443 4.621 50 10 IJGE BrCc1c(N2CCc3scc(Br)c3C2)nc2sccn12 2361587908 GEKAJDSVMKXOCK-UHFFFAOYSA-N 433.194 4.677 50 10 IJGE COc1cc(CBr)cc(N(C)[C@@H]2C[C@@H]3C[C@H](OCc4ccccc4)C[C@H]32)n1 2364794816 IGTIUADAMJVDFB-VNTMZGSJSA-N 431.374 4.805 50 10 IJGE CC[C@@H](C)c1ccc(OCC(=O)NNC(=O)c2cccc(OCCc3ccccc3)c2)cc1 10331715 COHISVZDHURRDE-HXUWFJFHSA-N 446.547 4.662 50 10 IJGE CCc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(OC)cc2)CCC3)cc1 40813815 FTRWMXWTKZYJQL-SGWCAAJKSA-N 445.519 4.882 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C/c2cn(-c3ccccc3)nc2-c2ccc(F)cc2)C1=O 214216499 QTEQNRSJOVUAAG-HMAPJEAMSA-N 440.478 4.681 50 10 IJGE BrCc1cc(Br)c(OCC2CCOCC2)c(Br)c1 232484539 BIKUOTZBMFZQOF-UHFFFAOYSA-N 442.973 4.912 50 10 IJGE O=C(NCCCCI)c1ccc2cc(Br)ccc2c1 232554175 DIWKYYQGUNECBD-UHFFFAOYSA-N 432.099 4.547 50 10 IJGE O=S(=O)(Nc1ccccc1CBr)c1ccc(Cl)c(Br)c1 236057628 VCHSPOVHMFNULU-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE CC(C)(C)c1ccc(C(=O)Oc2ccc(C=NNC(=O)c3ccc(C#N)cc3)cc2)cc1 254340547 ANIREFNRNQMYIL-UHFFFAOYSA-N 425.488 4.839 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1-c1ccc(C=NNC(=O)Cc2cccc(C(F)(F)F)c2)o1 254505218 YDYSWSZJJSSOED-UHFFFAOYSA-N 431.370 4.875 50 10 IJGE Cc1nc(-c2ccc(CNC(=O)NNC(=O)c3c(Cl)cccc3Cl)s2)cs1 727850177 AHNUHYBDGUXWOR-UHFFFAOYSA-N 441.365 4.631 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCCOc2ccc(Cl)cc2Cl)c1C 736691186 KTQHATQWJZIHGL-UHFFFAOYSA-N 446.338 4.765 50 10 IJGE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NNc1cc(Cl)cc(Cl)c1 791726021 CWPZWAAHBDGAQM-UHFFFAOYSA-N 432.336 4.918 50 10 IJGE C=CCOc1c(Br)cc(C=NNC(=O)c2ccc(OCC)cc2)cc1OCC 1083963603 DJXUPJXVLVLAEJ-UHFFFAOYSA-N 447.329 4.575 50 10 IJGE COc1ccc(CSCC(=O)NN=C(C)c2cccc(NC(=O)c3ccccc3)c2)cc1 1084170613 FFLUJBMYEJJJGQ-UHFFFAOYSA-N 447.560 4.721 50 10 IJGE COc1c(C(=O)NN=C2C(=O)N(Cc3ccccc3)c3ccccc32)ccc2ccccc12 1084537454 BDRHGPZGTCJQIM-UHFFFAOYSA-N 435.483 4.529 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc(NS(=O)(=O)c2ccc(CBr)cc2)c1 1260508793 ZBBZBPORJZUYJB-UHFFFAOYSA-N 441.347 4.729 50 10 IJGE C=CCC[C@H](NC(=O)NNc1ccc(C(=O)OC)cc1F)c1ccc(C(F)(F)F)cc1 1564407257 ZTZQBASJOOOJFI-KRWDZBQOSA-N 439.409 4.965 50 10 IJGE C#CC[C@H](CCOC)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1587382702 LPKFYELHIPEWAN-UBXANZILSA-N 443.469 4.565 50 10 IJGE Cc1cccc(Cl)c1NNC(=O)CCc1nc(O)c2c3c(sc2n1)C[C@@H](C)CC3 1636833652 YVVGBNRQPNLERP-NSHDSACASA-N 430.961 4.559 50 10 IJGE CCCc1nn(-c2ccc(Br)cc2)c2c1[C@@H](c1ccccc1)C(C#N)=C(N)O2 1865680212 BWYDFEBMWKENRC-IBGZPJMESA-N 435.325 4.805 50 10 IJGE CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1cccc(Oc2ccccc2)c1 1873794976 LRCCZUFYIXCWAX-WEKPXBEKSA-N 443.569 4.575 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CC[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]1C2 1882087059 HCJLIVFGFRFNAQ-VGWMRTNUSA-N 447.414 4.700 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Br)Cc1cccs1 1900972203 VQGCELFPHGTXSI-SSDOTTSWSA-N 428.975 4.685 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)[C@H](CBr)C(C)C)cc1[N+](=O)[O-] 1915273512 MEMGBYAMVMWWAO-GOSISDBHSA-N 435.318 4.665 50 10 IJGE Cc1c(Br)sc([C@H](Cl)[C@H]2CCCCS2(=O)=O)c1Br 1922942221 QXYAAPUSYHAEKF-VXNVDRBHSA-N 436.618 4.829 50 10 IJGE CC1(C)C[C@H](Br)CN1C(=O)c1scc(Br)c1Br 1949214257 HKKPRCVWDFPZQM-LURJTMIESA-N 446.002 4.661 50 10 IJGE CC1(C)C[C@@H](Br)CN1Cc1cc(Br)ccc1Br 2006503263 MEZVKNTZFVHZIT-LLVKDONJSA-N 425.990 4.959 50 10 IJGE CC[C@@](C)(CCBr)NC(=O)c1cccc(Br)c1Br 2031487848 ZLWIMKYQIDGQBH-ZDUSSCGKSA-N 441.989 4.895 50 10 IJGE FC1(F)C[C@@H](CBr)N(Cc2cccc(Br)c2Br)C1 2041128346 XBLYAGOVESBHGC-VIFPVBQESA-N 447.943 4.816 50 10 IJGE C[C@@H](c1ccncc1Br)[C@H](Br)c1cn(C)nc1Br 2052974892 CHKBIXLBGAAGPY-CPCISQLKSA-N 437.961 4.580 50 10 IJGE O=C(c1csc(I)c1)N1CCCC[C@@H]1CCCBr 2085688503 PXSNZEAHERXCJA-LLVKDONJSA-N 442.160 4.523 50 10 IJGE CCC[C@H](CBr)CN1CC[C@@H](C(F)(F)F)C[C@@H]1CNC(=O)OC(C)(C)C 2107588413 XNSHMICMHMUASF-RBSFLKMASA-N 445.364 4.965 50 10 IJGE Br[C@@H]1CC[C@H]2CCCN(Cc3ccc(I)cc3)[C@@H]2C1 2110680848 XACHFHSISIPHHY-IIAWOOMASA-N 434.159 4.819 50 10 IJGE CCC[C@@]1(NC(=O)[C@H](Br)C2CCCC2)CCCN(C(=O)OC(C)(C)C)C1 2110714159 ARDDTTZZTQUUPW-OXQOHEQNSA-N 431.415 4.626 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@H](CBr)C2CCC2)C[C@H]1c1ccccc1 2163060173 ZYRDPYQGERNHID-SLFFLAALSA-N 437.422 4.790 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CN(CCCCCCCCCBr)C[C@H]1CCO2 2175184363 VEVBXYLABDKOOQ-WIYYLYMNSA-N 447.458 4.728 50 10 IJGE O=[N+]([O-])c1cc(N2[C@H]3CCC[C@H]2CN(Cc2ccccc2)C3)ccc1CBr 2188572031 MDBMSIUBBXVBGG-PMACEKPBSA-N 430.346 4.733 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2C1[C@@H]2CN(Cc3ccccc3)C[C@@H]12 2202298194 MWGLMZOYFVIDRA-HUUCEWRRSA-N 446.776 4.849 50 10 IJGE FC(F)(F)c1ccccc1CO[C@H](CCl)[C@H](I)CCl 2227755175 SRGJJIQGKAQDMO-GHMZBOCLSA-N 427.031 4.872 50 10 IJGE Cn1nc([C@@H](Cl)c2ccc3c(c2Br)CCO3)c(Br)c1Cl 2238061298 VOVVEYABWHILAZ-NSHDSACASA-N 440.950 4.862 50 10 IJGE O=[N+]([O-])c1cc(Br)cc(Cl)c1OCCCCI 2248219153 ZTFUABIRRDVHEQ-UHFFFAOYSA-N 434.455 4.605 50 10 IJGE COc1ccc([C@H](Br)C(F)(F)C(F)(F)F)cc1I 2257368563 ILSOYVRPWNROIV-QMMMGPOBSA-N 444.963 4.933 50 10 IJGE COc1ccc([C@@H](Br)C23CCOC(C)(C2)C3)cc1I 2269533807 IGNCGVZASYYRML-WLYUNCDWSA-N 437.115 4.695 50 10 IJGE COc1ccc([C@H](Cl)c2cnsc2Br)cc1I 2300281996 HMCTYDFPBYPIQF-JTQLQIEISA-N 444.519 4.847 50 10 IJGE BrC[C@@H](NCc1sccc1I)C1CCCCC1 2301073200 GJDXESSWNRIGHC-GFCCVEGCSA-N 428.177 4.786 50 10 IJGE CCOc1ccc(C=C(C#N)C(=O)Nc2ccc(I)cc2C)cc1 2314734464 ANHCCCURKKJOLF-UHFFFAOYSA-N 432.261 4.544 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)C=Cc2ccc(OCC)c(OC)c2)cc1 2314777495 HOLAPKBRACNSKU-UHFFFAOYSA-N 448.519 4.536 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(OC[C@H]2C[C@@H](C(F)(F)F)C2)CC1 2327819489 PTOQIZWKCSDTJG-BETUJISGSA-N 430.305 4.756 50 10 IJGE CN(c1c(CBr)c(C(F)(F)F)nn1C)[C@@H]1CC[C@@H]1OCc1ccccc1 2339772982 CRVQBWWJRUOHIC-CABCVRRESA-N 432.284 4.518 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@]2(CBr)CC2(F)F)C2(CCCCC2)C1 2351888635 JQMBAIDIZVEMAL-KRWDZBQOSA-N 437.369 4.662 50 10 IJGE CC[C@@H](Br)C(=O)N1CCC(CCC2CCN(C(=O)OC(C)(C)C)CC2)CC1 2361052513 IKWKWRGTYCVCBF-GOSISDBHSA-N 445.442 4.826 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccc(OC(F)(F)F)cc1 2369432788 HGFUFAQZESMFMI-INIZCTEOSA-N 446.263 4.685 50 10 IJGE COc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3cc(C)cc(C)c3)c(C)c21 40813136 RGQJQSDCSSROGJ-VFCFBJKWSA-N 445.519 4.936 50 10 IJGE Cc1c(C(=O)Nc2ccccc2C(F)(F)F)oc2c1/C(=N/NC(=O)c1ccco1)CCC2 40814423 GDGDDUSWSOPCDW-JFLMPSFJSA-N 445.397 4.923 50 10 IJGE Cc1nc(Cn2c([C@@H](C)Cl)nc3cc(I)c(F)cc32)cs1 97408898 SMTPTGXEANYWAQ-SSDOTTSWSA-N 435.693 4.893 50 10 IJGE CC[C@H](C)N(CCCl)S(=O)(=O)c1cc(Br)c(C)cc1Br 312727647 INTIXYKLNIGOAK-JTQLQIEISA-N 447.620 4.548 50 10 IJGE CC(C)[C@H](CBr)CNC(=O)c1cc(Br)sc1Br 394172517 YSGVAKWFDAHRJP-SSDOTTSWSA-N 448.018 4.670 50 10 IJGE C[C@]12CN(Cc3ccccc3)C[C@@H]1CN(c1cc(CBr)sc1[N+](=O)[O-])C2 702106840 GNUFGDXTCGKOHD-DNVCBOLYSA-N 436.375 4.510 50 10 IJGE CC(C)(C)S(=O)(=O)CCC[C@H](CBr)c1cccc(Br)c1 718760749 HQNKOGCKXNEMJA-CYBMUJFWSA-N 426.214 4.921 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)c(-c2ccccc2)n1 817222878 BCCFBGRWNAXOII-SPQMOQBQSA-N 439.494 4.572 50 10 IJGE Cc1cccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4cccc([N+](=O)[O-])c4)c(C)c32)c1 1772744817 KBHHSKUYUNBFHA-UHFFFAOYSA-N 446.463 4.527 50 10 IJGE COCCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(Oc3ccc(N)cc3)cc2)cc1 1866214231 YMXPNMGZQOYCDU-KNTRCKAVSA-N 429.476 4.632 50 10 IJGE CCCC[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)C(=O)Nc1ccc(SC#N)cc1 1866939727 MEIOOYFUESTKIG-HKBOAZHASA-N 425.529 4.816 50 10 IJGE CC[C@](C)(NC(=O)C[C@H](C)c1cccc(OC)c1)C(=O)Nc1ccc(SC#N)cc1 1867109975 GBHMBBYQPGVEJN-HJPURHCSSA-N 425.554 4.686 50 10 IJGE N#C/C(=C\c1cc(Br)c(O)c(Br)c1O)c1ccccc1[N+](=O)[O-] 1872729547 QUOYBOMTVRYUGX-WEVVVXLNSA-N 440.047 4.595 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cc(Cl)cc(F)c1F 1916365510 YCXFYTSEXCWOLD-CYBMUJFWSA-N 432.692 4.671 50 10 IJGE C[C@H]1C[C@H]1N(CCBr)Cc1cc(Cl)ccc1I 2002044342 ZXFVOQWYJZZNOO-TVQRCGJNSA-N 428.539 4.550 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc([C@@]2(C)CC[C@@](C)(CI)O2)cc1 2014211374 TYCCTQMMBYDKQH-RBUKOAKNSA-N 445.341 4.931 50 10 IJGE Clc1ccc(I)c(CN2[C@H]3CC[C@@H](C3)[C@H]2CBr)c1 2058367128 XNHHFPULAGYWGZ-DUFXMDAXSA-N 440.550 4.692 50 10 IJGE FC(F)c1cc(I)cc(I)c1CCl 2060238836 SHSQBLBICCKLKC-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CCN(C[C@@H](CBr)c3ccccc3)C2)C1 2163061715 HSTNLNNSLWXTQV-KNQAVFIVSA-N 437.422 4.888 50 10 IJGE Cc1sc(Br)c(C(=O)N2CCC([C@H](F)CBr)CC2)c1C 2163245206 JABLHFBXQGCZES-LLVKDONJSA-N 427.177 4.713 50 10 IJGE CCCCN([C@H](C)CC)S(=O)(=O)c1cc(CBr)sc1Br 2179791569 SPOYAJIZZLVLPQ-SNVBAGLBSA-N 447.258 4.995 50 10 IJGE Cc1nn(C)c(Br)c1[C@H](Cl)c1c(Br)cc(F)c(F)c1F 2185753316 HMAAUNKEVFNVPK-VIFPVBQESA-N 432.465 4.999 50 10 IJGE COC[C@@H]1CC[C@H]([C@@H](Br)c2ccc(OC)c(I)c2)C1 2269541306 DHRKCFQFJPTZHR-JRPNMDOOSA-N 439.131 4.799 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CC[C@H]3C[C@H]2CO3)cc1I 2269556046 LAECCBRCWYEDSK-OHTBPHCPSA-N 437.115 4.551 50 10 IJGE CC(C)CN(C[C@H](C)Cl)C(=O)Cc1cc(Br)cc(Br)c1 2295315483 MFCWTDILXAFEPK-NSHDSACASA-N 425.592 4.866 50 10 IJGE COC(=O)c1ccccc1NC(=O)C(C#N)=Cc1ccc(OCc2ccc(C)cc2)cc1 2295459759 VNISJBYBBCRBMN-UHFFFAOYSA-N 426.472 4.906 50 10 IJGE CCC[C@H](O[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1I)c1ccccc1 2302032136 RMLCNYSQNGNADX-IKGGRYGDSA-N 445.341 4.967 50 10 IJGE BrC[C@@H]1[C@H]2CN(Cc3cccc(Br)c3Br)CC[C@@H]12 2311904443 HRFXNGCYKFOUCA-SRVKXCTJSA-N 438.001 4.674 50 10 IJGE C=CCOc1ccc(C=C2C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)cc1OCC 2314617232 UHFCCXNSNBMNLB-UHFFFAOYSA-N 442.515 4.751 50 10 IJGE C[C@H]1C[C@@H](CBr)CCN1Cc1ccc(Cl)c(I)c1 2315554273 CWFVZRIUSQSDMZ-QWRGUYRKSA-N 442.566 4.940 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2[C@H](Br)CC[C@H]2C1 2327404271 UAALJRBJBCTIKW-ZWKOPEQDSA-N 440.550 4.550 50 10 IJGE CCN(c1ccccc1)S(=O)(=O)c1ccccc1NC(=O)C(C#N)=Cc1ccc(F)cc1 2329638933 BLVKSHNXWWEPRF-UHFFFAOYSA-N 449.507 4.587 50 10 IJGE CC1(C)COC[C@@H]1CO[C@@H](CI)c1ccc(Br)cc1 2339010395 KUVFVPAQSBPECK-OCCSQVGLSA-N 439.131 4.614 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccc(Cl)cc3)ccc2[C@H]1c1ccc([N+](=O)[O-])cc1 38654400 QNIPZHIGYCEERJ-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE C=CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4C)ccc32)cc1 38657995 VTTYTTGYJQBDEV-RUZDIDTESA-N 438.483 4.997 50 10 IJGE CCOc1c(Br)cc(/C=N/NC(=O)COc2ccc(C(C)C)cc2)cc1OC 40911800 KRTNZOOJRRLYJY-FSJBWODESA-N 449.345 4.509 50 10 IJGE CCc1ccc([C@H](C)NC(=O)/C(C#N)=C\Nc2ccc(I)cc2)cc1 217198063 VNXIFEJLRSSVIM-ZSRMJVKVSA-N 445.304 4.550 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCC[C@H](CBr)C1 232471436 DOLMAZHSDZQZJK-SSDOTTSWSA-N 446.002 4.520 50 10 IJGE O=C(NN=Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1)c1cccc(C(F)(F)F)c1 254634041 SOQCWBZSZGKYJT-UHFFFAOYSA-N 443.381 4.957 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CI)[C@H](c2ccc(F)cc2Cl)C1 382698211 MHYCZJPFNBNGNO-ZWNOBZJWSA-N 439.696 4.865 50 10 IJGE CC[C@@H](Br)[C@H](C)NC(=O)c1cc(Br)ccc1Br 386799694 PWDOOPOTVDQXPK-OIBJUYFYSA-N 427.962 4.503 50 10 IJGE O=C(NCC1(CCBr)CC1)c1scc(Br)c1Br 705398622 GIHIAHGNWYHHGK-UHFFFAOYSA-N 446.002 4.568 50 10 IJGE C[C@H]1[C@H](Br)CCCN1C(=O)c1scc(Br)c1Br 705425011 JGBGGUPCYIGPFV-NKWVEPMBSA-N 446.002 4.661 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@@H](c2cnn(C)c2)C(F)(F)F)c(C)n1C1CCCCC1 775145912 GMBNXBXDDDJDRC-YZILGEIOSA-N 433.478 4.670 50 10 IJGE O=C(Nc1ccccc1S[C@H](Cl)C(F)(F)F)N1CCN(c2ccc(F)cn2)CC1 775293073 BAUGHMZSLRZHJY-INIZCTEOSA-N 448.873 4.794 50 10 IJGE O=C(NNc1ccc([N+](=O)[O-])cc1)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 788788613 UKNRKTUDGXQOQL-UHFFFAOYSA-N 435.227 4.633 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)c(C(F)(F)F)c1 799404432 UMVYHQNAXBDZJN-UHFFFAOYSA-N 428.374 4.653 50 10 IJGE CC(=O)N(C)c1cccc(NC(=O)NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 814655451 XQENBHPMHBWDPB-UHFFFAOYSA-N 434.340 4.856 50 10 IJGE O=C(COc1ccccc1)NN=Cc1ccccc1OCc1ccc(Br)cc1 1084358292 QAXVKMSCXFLKKC-UHFFFAOYSA-N 439.309 4.557 50 10 IJGE C=C[C@@H]1OCC[C@H]1CNC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1129928569 YQUPXKQPUWFFCT-BHUPXUDBSA-N 443.469 4.727 50 10 IJGE C=CCCC[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(=O)OC 1455839143 YFSLOKHHQOZZAF-DJAVKIJBSA-N 439.943 4.669 50 10 IJGE C=CCOc1ccc(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)cc1OC 1628466834 CLTCDPPDTRTWBI-KRWDZBQOSA-N 442.581 4.547 50 10 IJGE C=CC[C@@H]1CCCC[C@H]1NC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1 1687035980 FKQCOUBMFGWYHD-XMSQKQJNSA-N 441.959 4.998 50 10 IJGE CCCCOc1ccc(C=NNC(=O)COc2c(C)cc(Br)cc2C)cc1 1772753287 NCLHYTRUHFTREE-UHFFFAOYSA-N 433.346 4.774 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccc(Cl)cc2)c1 1865690424 QUNQRAKGDDWZDP-NRFANRHFSA-N 434.927 4.764 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)CNC(=O)c3ccc(Cl)cc3)n2)cc1F 1872752461 DADDGJWOQSWGEQ-SDXDJHTJSA-N 443.887 4.834 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)[C@@H]3CC(=O)N(C(C)(C)C)C3)n2)cc1Cl 1872757362 BTYOXXZYCAJBMD-ZDKYXOAUSA-N 431.945 4.912 50 10 IJGE C[C@@H](CCCl)N(Cc1ccccc1)C(=O)c1ccc(I)c(O)c1 1915092492 JZBCYPFGEXAWGP-ZDUSSCGKSA-N 443.712 4.657 50 10 IJGE O=S(=O)(N[C@H](CBr)CC1CCCCC1)c1ccc(Br)s1 1926739251 YBMCBZGCJALWIK-NSHDSACASA-N 445.242 4.523 50 10 IJGE Cl[C@H]1CCC[C@H]1CCNc1ncc(I)cc1Br 2015765232 NIIQVLDUDADGAB-KWQFWETISA-N 429.527 4.658 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)CCc1ccc(OC(F)(F)F)cc1 2025440432 JEZXUOLZFOSKEQ-ZDUSSCGKSA-N 442.231 4.578 50 10 IJGE CC(C)[C@H](CBr)CN=[S@](C)(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C 2044705869 ORFXXRWFXGZAEK-KDCSIKNMSA-N 441.476 4.691 50 10 IJGE CC(C)(CBr)CN1CC[C@H](C(F)(F)F)C[C@@H]1CNC(=O)OC(C)(C)C 2045432411 UOPHITFVYIRDRB-QWHCGFSZSA-N 431.337 4.575 50 10 IJGE C[C@@H]1C[C@H](O[C@@H](CI)c2ccc(Br)cc2)CCO1 2084724852 KKDBWCBDVCGCMY-HONMWMINSA-N 425.104 4.509 50 10 IJGE CC[C@H](CCCCl)NC(=O)c1ccc(Br)cc1I 2086145020 HWYZCHIHPUTRAA-SNVBAGLBSA-N 444.538 4.581 50 10 IJGE CN(CC1CCN(C(=O)OC(C)(C)C)CC1)C[C@@H](CBr)c1ccccc1 2106789510 YYHCGYODMNBENB-LJQANCHMSA-N 425.411 4.744 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@H](Cl)C2(CCCC2)C1 2117757361 YUQFIXFWGUCVNA-JTQLQIEISA-N 427.589 4.897 50 10 IJGE ClCc1ccc(Br)cc1N1CC[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 2129053721 NTMFDZZHTMJVOM-SFTDATJTSA-N 435.793 4.668 50 10 IJGE COc1cc(CNC(=O)OC(C)(C)C)ccc1NC(=O)[C@@H](Br)C1CCCC1 2167031790 JZLCHPYNTQDYQP-KRWDZBQOSA-N 441.366 4.612 50 10 IJGE CC(C)(C)OC(=O)NCC(C)(C)C1CCN(C(=O)[C@H](Br)C2CCCC2)CC1 2167033787 OZWBISCVGNXMHD-QGZVFWFLSA-N 445.442 4.730 50 10 IJGE Cc1c(Cl)cc(CN2CCC(OCCBr)CC2)cc1Br 2167397255 YPLQMEWCXREQCF-UHFFFAOYSA-N 425.592 4.787 50 10 IJGE O=S(=O)(c1cc(Cl)sc1Cl)N(CCBr)Cc1ccsc1 2171097261 PHLNDRABXHKGBK-UHFFFAOYSA-N 435.217 4.702 50 10 IJGE C[C@@H]1CCCC[C@H]1N(C)S(=O)(=O)c1cc(CBr)sc1Br 2179790827 JHIGUEVGQIIRMF-MWLCHTKSSA-N 445.242 4.605 50 10 IJGE BrCc1c(N2CCc3sc(Br)cc3C2)nc2sccn12 2206352642 CYSHGUNUIWWSLW-UHFFFAOYSA-N 433.194 4.677 50 10 IJGE C=CC[C@@]1(CBr)CCCN1c1ncc(Br)cc1Br 2259501823 WDCHSSRRIPOSRZ-ZDUSSCGKSA-N 438.989 4.917 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@H](Br)c1c(Br)cnn1C 2264367177 RNXFJWJPZCIXKS-NSHDSACASA-N 428.939 4.982 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@@H](CBr)C2(CCC2)C1 2264508446 BMBAVSZEHOLTTJ-MRVPVSSYSA-N 427.589 4.801 50 10 IJGE CC1CC(CBr)(CN2C[C@@H](NC(=O)OC(C)(C)C)[C@H](c3ccccc3)C2)C1 2280056938 MNCFSFKXDNDFDK-GYCHQTGJSA-N 437.422 4.790 50 10 IJGE COc1ccc([C@H](Br)c2ccc3c(c2)CCO3)cc1I 2284996704 BXBYIYGXKUOHSS-MRXNPFEDSA-N 445.094 4.719 50 10 IJGE CCOc1ccc(C=C(C#N)C(=O)Nc2cccc(C)c2C)cc1I 2293188463 DSXMZPTVEJLMEO-UHFFFAOYSA-N 446.288 4.852 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCCc2ccccc2)cc(Br)c1OC(C)C 2293497255 BCITXKCVLBHILG-UHFFFAOYSA-N 443.341 4.511 50 10 IJGE COC(=O)Cn1cc(C=C(C#N)C(=O)Nc2cccc(Cl)c2Cl)c2ccccc21 2294156154 UUGHNDHFQFFXNP-UHFFFAOYSA-N 428.275 4.667 50 10 IJGE C[C@H](Br)COCc1cn(-c2c(Cl)cc(Br)cc2Cl)nn1 2295834288 ZVAPUVCMRGTIDI-ZETCQYMHSA-N 443.954 4.637 50 10 IJGE ClC[C@H]1CCCCN1Cc1ccc(I)c(Br)c1 2306218318 YZKPENLRCLQKNQ-LLVKDONJSA-N 428.539 4.647 50 10 IJGE C[C@@H](NCc1ccc(I)c(Br)c1)C(C)(C)CCl 2306222723 XYCDVNPTQGGLDR-SECBINFHSA-N 430.555 4.797 50 10 IJGE CC1(C)C[C@H](Br)CN(Cc2ccc(Cl)c(I)c2)C1 2315554578 GRCZSHYWGQWDLE-NSHDSACASA-N 442.566 4.940 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4Cl)[nH]c3c2)c(OC)c1 2323743903 HGSYPAWWOAWXLN-UHFFFAOYSA-N 434.883 4.664 50 10 IJGE ClC[C@H](Cc1ccc(I)c(Br)c1)C1CCOCC1 2325218016 KGGQUIBRHSPAOO-LBPRGKRZSA-N 443.550 4.878 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]3CC2)C1 2345011738 VOTVADXNGKHWKZ-IAGOWNOFSA-N 429.443 4.767 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@](C)(CBr)C(C)(C)C)C[C@@H]1C(F)(F)F 2352071513 HSNINTRTXGWNRS-CXAGYDPISA-N 445.364 4.917 50 10 IJGE COc1ccc(Br)cc1/C=N/NC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 13953756 PGMZQKWOXBFBIT-LUKZVCJISA-N 446.128 4.682 50 10 IJGE O=C(N/N=C\c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)c1ccncc1 33927546 HSUJUYCNAJNICS-UUYOSTAYSA-N 435.490 4.515 50 10 IJGE Fc1cc(Br)ccc1-n1c(CCCl)nc2cc(Br)cnc21 98040012 VLRKTFRZQITGCK-UHFFFAOYSA-N 433.506 4.866 50 10 IJGE O=C1OC(=O)c2ccc(Sc3ccc4c5c(cccc35)C(=O)OC4=O)c3cccc1c23 104011669 OGUFHGUJFLRVKA-UHFFFAOYSA-N 426.405 4.765 50 10 IJGE C[C@@]1(Cn2c(CCCl)nc3cc(I)c(F)cc32)CCCS1 122559354 WYADROWQPHEVBI-HNNXBMFYSA-N 438.737 4.847 50 10 IJGE N#C/C(=C/Nc1cc(Br)ccn1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 217250836 PQXQJCDDLPBLHY-HJWRWDBZSA-N 445.626 4.974 50 10 IJGE O=C(NC[C@@H]1CCC[C@H]1Br)c1ccc(Br)cc1Br 232453655 DTCNKDCCAWKDNG-GZMMTYOYSA-N 439.973 4.505 50 10 IJGE CCC[C@H](Br)CNC(=O)c1ccc(Br)cc1Br 233326300 FDWRCTWBJBMFGO-VIFPVBQESA-N 427.962 4.505 50 10 IJGE N#C/C(=C1\CCN(C(=O)OCc2ccccc2)C1)c1cccc(I)c1 381953899 DLPOEMMHHZJCHX-ZPHPHTNESA-N 444.272 4.611 50 10 IJGE C[C@H](Br)C[C@H](C)CNC(=O)c1cc(Br)sc1Br 397721920 KLDKMGLDHXFPLJ-BQBZGAKWSA-N 448.018 4.813 50 10 IJGE FC(F)Oc1cc(CBr)c(I)cc1C(F)(F)F 575722802 GGCVVWRNDBGHEF-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE Cl[C@@H](c1cc(I)cc2c1OCC2)c1occc1Br 696514272 QCHFSCMOFZUEHU-NSHDSACASA-N 439.474 4.910 50 10 IJGE Cc1ccc([N+](=O)[O-])cc1[C@H]1CN(Cc2ccccc2)C[C@@H]1CI 725379750 JNVWRXKGYWAYJR-LPHOPBHVSA-N 436.293 4.554 50 10 IJGE C[C@@H]1CN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)CCC1(F)F 753016456 GHDYJHBCMHAYKR-QJISPJEISA-N 443.885 4.528 50 10 IJGE O=C(NN(Cc1ccccc1)c1ccccc1)c1ccc2nc(O)n(CC(F)(F)F)c2c1 1540548983 YFDXKYZUTXWHNO-UHFFFAOYSA-N 440.425 4.656 50 10 IJGE Cc1c(C(=O)N2CCCc3ccccc32)oc2c1C(=NNC(=O)c1ccccc1)CCC2 1772744927 OIWQAXLJCJLERB-UHFFFAOYSA-N 427.504 4.651 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(OC)cc2)CCC3)cc1 1772745684 HSKUUXINLQSMSE-UHFFFAOYSA-N 446.503 4.849 50 10 IJGE CC(C)CC(=O)NN=C1C(=O)N(Cc2ccccc2Cl)c2ccc(Br)cc21 1772752431 LQCVHUDHAQLNHF-UHFFFAOYSA-N 448.748 4.516 50 10 IJGE COc1ccc(C=NNC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)cc1Br 1772756000 JINRNUTXHYYBMW-AWEZNQCLSA-N 433.346 4.673 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3-c2ccccc2)cc1OCC 1865690801 BISBNUHOAYKBQM-QHCPKHFHSA-N 444.535 4.840 50 10 IJGE CCOc1ccc(/C=N\NC(=O)c2ccc(-c3cccc(OC)c3)nc2C)cc1OCC 1865760568 DTZVNECRKPLQJO-QQXSKIMKSA-N 433.508 4.627 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)N/N=C\c1c(Cl)nc2scc(C)n12 1865760757 NEPQWGDFTCDOLQ-GYRAYZOKSA-N 445.882 4.770 50 10 IJGE COc1cc(Cl)c(C)cc1-c1csc(/C(C#N)=C(\O)[C@H]2CC(=O)N(C(C)C)C2)n1 1872756973 KSFQYNPKFNJPIU-NSPLTWOJSA-N 431.945 4.830 50 10 IJGE C[C@]1([C@H](Br)c2cc(I)cc3c2OCC3)CCCCO1 1908094171 JGOQHDFURWZVCX-HUUCEWRRSA-N 437.115 4.621 50 10 IJGE CC(C)CCN(CCBr)S(=O)(=O)c1ccc(Br)cc1Cl 1924443870 YOHGVQFMYTYYRV-UHFFFAOYSA-N 447.620 4.534 50 10 IJGE COC(CBr)(CBr)Cc1cc(Cl)cc(Br)c1 1979518394 USMAMBHMWKYPDW-UHFFFAOYSA-N 435.381 4.820 50 10 IJGE Cc1cc([C@H](Br)c2cn(C)nc2Br)sc1Br 1981648538 PHCOKSYATODBGQ-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)CCc1ccccc1C(F)(F)F 1994836604 BRMDUDJLHMGNBI-CYBMUJFWSA-N 426.232 4.698 50 10 IJGE CC[C@H](Br)CN(CC)Cc1ccc(I)c(Cl)c1 2026563109 HKBZOIUZGXLWKX-NSHDSACASA-N 430.555 4.940 50 10 IJGE CCc1nsc(COc2c(Br)cc(CCl)cc2Br)n1 2102672583 OEKUDYKDYSRCKI-UHFFFAOYSA-N 426.561 4.943 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1cn(C)nc1C(F)(F)F 2122210554 XGAVSXKODULFRF-HNNXBMFYSA-N 432.284 4.501 50 10 IJGE ClCc1ccc(N2CC[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c(Br)c1 2129057288 UTAIQQYQKWMFPW-NHCUHLMSSA-N 435.793 4.668 50 10 IJGE CCCCN([C@@H](C)CC)S(=O)(=O)c1cc(CBr)sc1Br 2179791568 SPOYAJIZZLVLPQ-JTQLQIEISA-N 447.258 4.995 50 10 IJGE O=C(Nc1cc(Cl)cc(Br)c1OC(F)F)C1CC(Br)C1 2196891616 ULSJADVUJAWYMQ-UHFFFAOYSA-N 433.474 4.816 50 10 IJGE COC[C@]1([C@@H](Br)c2cc(Br)c(OC)cc2Cl)CCCO1 2202367847 YYVCXYMDEHNYJK-KBPBESRZSA-N 428.548 4.743 50 10 IJGE Cc1ccc([C@@H](Br)c2ncn3ccsc23)cc1I 2217865146 TZHUZYGLVZGQRB-LLVKDONJSA-N 433.112 4.793 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CCCCCCBr)C[C@@H]1c1ccccc1 2231090853 XKCBFDKJKXAQFH-MOPGFXCFSA-N 425.411 4.934 50 10 IJGE Cc1sc(Br)c(C)c1[C@H](Br)[C@@]12CCC[C@@H]1CS(=O)(=O)C2 2234237631 SSDLHLGEZCAMJV-SCDSUCTJSA-N 442.238 4.778 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1Cc1ccc(I)c(Cl)c1 2251038778 IEJKFUSIVRQJDQ-ZWNOBZJWSA-N 428.539 4.692 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1C(=O)c1ccc(Br)cc1Br 2260376553 AMLHQKQNQCYLPW-CMPLNLGQSA-N 439.973 4.600 50 10 IJGE O=C(N[C@@H](CBr)Cc1ccccc1)c1scc(Br)c1Cl 2279174581 AGOWMMLEXHQRKD-SNVBAGLBSA-N 437.584 4.900 50 10 IJGE CC[C@H](Cl)[C@H]1CCCCN1C(=O)c1ccc(Cl)c(I)c1 2283654857 FNGQYKCGRPRRAR-SMDDNHRTSA-N 426.125 4.957 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccccc2C)ccc1OCc1ccc(C(=O)O)cc1 2294168670 ZIFKNPHLASTXSB-UHFFFAOYSA-N 442.471 4.827 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)C[C@H]1C[C@@H](Br)C1 2300270358 VFJAVLUXYQCOKO-PHIMTYICSA-N 428.539 4.550 50 10 IJGE CCCOc1ccc(C=CC(=O)Oc2cccc(C=C(C#N)C(=O)OCC)c2)cc1OC 2314754227 NMJSMTKFMQGULB-UHFFFAOYSA-N 435.476 4.573 50 10 IJGE COc1cc(CC(CBr)(CBr)C(C)C)c(Br)cn1 2315345808 WFHWODLUDQIOGM-UHFFFAOYSA-N 444.005 4.827 50 10 IJGE C[C@H]1[C@@H](Br)C[C@@H](C)CN1Cc1ccc(Cl)c(I)c1 2315548223 DWXYRILLOWORSW-SCVCMEIPSA-N 442.566 4.938 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Br)c1ccc(F)cc1F 2316717565 KEIFEEBERSASCI-QMMMGPOBSA-N 444.899 4.708 50 10 IJGE CC(C)[C@H]1C[C@H](Br)CN1Cc1ccc(Cl)cc1I 2321366866 ZNFBRLWPYLYYLL-SMDDNHRTSA-N 442.566 4.938 50 10 IJGE Cl[C@@H]1C[C@@H]2CN(Cc3ccc(I)c(Br)c3)C[C@@H]2C1 2325207986 FESQRYYGNRTOJZ-ZSBIGDGJSA-N 440.550 4.503 50 10 IJGE CC(C)(C)OC(=O)N[C@@]1(C)CN(C[C@@](C)(CBr)C(C)(C)C)CC1(F)F 2327110038 PNVJVWVRDQRUJW-SJORKVTESA-N 427.374 4.668 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Cl)[C@H]1CCCS1(=O)=O 2339654368 SDIVHOIGKRCLAP-KCJUWKMLSA-N 434.552 4.516 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@H]1CCC[C@@H](C(F)(F)F)C1 2343416438 QCAQKYUXQBNMKO-BBWFWOEESA-N 436.312 4.842 50 10 IJGE CC(C)(C)[C@@](C)(CBr)COCCOCCOCCOCc1ccccc1 2352092638 NTOKQGNEXACJGV-NRFANRHFSA-N 431.411 4.700 50 10 IJGE CN(Cc1c(Br)cnn1C)c1cc(Cl)c(F)cc1CBr 2362383015 LPHCCMBBMUEEAB-UHFFFAOYSA-N 425.527 4.506 50 10 IJGE C[C@H](O[C@H](CCl)[C@@H](I)CCl)c1cccc(OC2CC2)c1 2368478133 APPUQEVKIUDZTM-NZVBXONLSA-N 429.125 4.955 50 10 IJGE FC(F)(F)[C@H]1C[C@]1(CCl)CNCc1cc(I)ccc1Cl 2380513315 SMKNUMYLSRWPLO-RYUDHWBXSA-N 438.058 4.842 50 10 IJGE COc1ccc([C@H](C(=O)NC2CCCCC2)N(Cc2ccc(C)cc2)C(=O)CCl)cc1 3035318 IIQUGPPRHISEPM-XMMPIXPASA-N 442.987 4.761 50 10 IJGE CCC(C)(C)c1ccc(OCC(=O)NNC(=O)COc2ccccc2-c2ccccc2)cc1 14784103 DUUVXUJHXCUSNA-UHFFFAOYSA-N 446.547 4.646 50 10 IJGE CN(C)c1ccc(/C=C(/C#N)c2nc(-c3cc4cc([N+](=O)[O-])ccc4oc3=O)cs2)cc1 33398849 ZDLBBKNKFAQXAJ-SXGWCWSVSA-N 444.472 4.955 50 10 IJGE CCCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(C)o2)cc1 38659235 OTESBFXCSHGSED-QHCPKHFHSA-N 430.460 4.814 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc1COc1ccc(C(C)(C)C)cc1 58976444 VIXRYCONVCDEJH-VEWQMQJVSA-N 448.563 4.774 50 10 IJGE CC1=C(C#N)C(=O)N([C@@H](C)c2ccccc2)C(=O)/C1=C/Nc1cccc(Br)c1 101235017 MYSKRYPPLPCIJB-NPRIEWAGSA-N 436.309 4.715 50 10 IJGE C[C@H]1CN(C(=O)c2cc(Br)sc2Br)CC[C@@H]1Br 235649244 VEAPBBUHMXVCCN-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE CCCCCCCCCC(=O)NCC(=O)NN=Cc1ccccc1OCc1ccccc1 254702592 URCOSZXWPCJLSV-UHFFFAOYSA-N 437.584 4.973 50 10 IJGE C[C@H]1C[C@@H](O[C@](C)(CI)CNC(=O)OC(C)(C)C)CC[C@H]1C 299978901 JYYHURNHODTVMS-XJIUQZFPSA-N 425.351 4.546 50 10 IJGE Fc1ccc(I)cc1[C@@H]1CN(Cc2ccccc2)C[C@H]1CCl 382733970 VZMGPBSLTNNRCJ-RHSMWYFYSA-N 429.704 4.885 50 10 IJGE Cn1cc([C@@H](Br)c2ccc(F)c(Br)c2)nc1Br 698415216 CQQXVYLWPJSXNZ-JTQLQIEISA-N 426.909 4.569 50 10 IJGE CN(C[C@@H]1CCCCN1Cc1ccccc1)c1nc2sccn2c1CBr 720015672 CISNBLVSWJBRJW-KRWDZBQOSA-N 433.419 4.782 50 10 IJGE O=C(NNC(=O)[C@@H](Sc1ccc(F)c(F)c1)c1ccccc1)c1cccc2cccnc12 729972205 VVMHXBMHGGGFDC-QFIPXVFZSA-N 449.482 4.808 50 10 IJGE Cc1cc(C)c2c(CC(=O)NN=C3CCCc4oc(C(=O)NC(C)(C)C)c(C)c43)coc2c1 1772751968 QEVPBOKDFMWFCU-UHFFFAOYSA-N 449.551 4.879 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@@H]1c1ccccc1 1865680681 RYUZHCSFDNASGK-MRXNPFEDSA-N 430.817 4.822 50 10 IJGE Cc1ccc(-n2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2cc(Cl)ccc2O)cc1 1865689181 LZQJLLUVJUOXLG-MRXNPFEDSA-N 446.816 4.777 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccc(OC)cc2)cc1 1865709521 XETQDANYYQTSRL-SFHVURJKSA-N 440.425 4.680 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)[C@@H](C)Oc1ccc(Cl)cc1 1865755482 AOBQIINEGVGYRO-CQSZACIVSA-N 444.318 4.592 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1880757526 YPWMAWCHGXYQFG-ZNMIVQPWSA-N 435.403 4.606 50 10 IJGE CN(Cc1ccc(Br)cc1)C[C@@H](Br)COCc1ccccc1 1916354069 HRJZBGJWEQHSPF-GOSISDBHSA-N 427.180 4.861 50 10 IJGE C[C@H]1C[C@@H](Br)[C@H](C)CN1c1ncc(Br)cc1Br 1944576312 PTSZRRRDHGQCMU-KHQFGBGNSA-N 426.978 4.605 50 10 IJGE FC(F)C[C@@H](CBr)NCc1cc(Br)ccc1Br 2006498251 BVOUYUPHSSDNKG-VIFPVBQESA-N 435.932 4.720 50 10 IJGE CC1(C)OCCO[C@H]1[C@@H](Br)c1cc(Br)sc1Br 2013744700 OGEKLESEQJBWTC-IUCAKERBSA-N 449.002 4.903 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@](C)(CI)O2)C[C@@H]1C1CCC1 2018371737 OMMWTXWVQMOFSK-ATZDWAIDSA-N 449.373 4.929 50 10 IJGE C[C@@H]1C[C@H](Br)CN(Cc2ccc(I)c(Cl)c2)C1 2026563454 KFGBRIYDHGQKGZ-KOLCDFICSA-N 428.539 4.550 50 10 IJGE C[C@@](CBr)(NC(=O)c1c(Br)cccc1Br)C1CC1 2033091465 REOOCKBGMOPFCL-ZDUSSCGKSA-N 439.973 4.505 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(CC2(CBr)CCCCC2)CC1(F)F 2044700613 RJEVGXUMZVGYEX-CQSZACIVSA-N 425.358 4.566 50 10 IJGE O=C(CBr)c1ccc(Br)c(Br)c1OC(F)(F)F 2054919017 LHWNQTMSJVDYIK-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE O=C(CBr)c1cc(I)c(C(F)(F)F)c(C(F)F)c1 2060393554 INHXSFXCESHRLZ-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE ClC[C@H]1CC[C@H](CNc2ncc(I)cc2Br)CC1 2069533311 GJFYNYNKGJNTGZ-MGCOHNPYSA-N 443.554 4.906 50 10 IJGE BrC[C@H]1CCN(Cc2cccc(Br)c2Br)C12CC2 2070104407 FSXQOXZSWJBCSH-LLVKDONJSA-N 438.001 4.961 50 10 IJGE FC(F)(F)c1c(I)c(CCl)nn1-c1cccnc1C1CC1 2078888412 ARVWHBCZZAOQSM-UHFFFAOYSA-N 427.595 4.507 50 10 IJGE CC[C@@H]1CCOC[C@H]1O[C@@H](CI)c1ccc(Br)cc1 2096206483 IHWRSSDSJJDEMW-BYCMXARLSA-N 439.131 4.757 50 10 IJGE BrCc1c(N2CCC[C@@H]2[C@@H]2CCN(Cc3ccccc3)C2)nc2sccn12 2145252385 DYTLJTRPUMJFAF-QZTJIDSGSA-N 445.430 4.782 50 10 IJGE COc1cccc(N2C[C@@]3(C)CN(Cc4ccccc4)C[C@]3(C)C2)c1CBr 2203190646 SAZJKHWFFMSSCM-DHIUTWEWSA-N 429.402 4.939 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(C[C@@H](CBr)c3ccccc3)C[C@H]2C1 2206174414 DBGXSTWZSRQNFE-UAFMIMERSA-N 437.422 4.790 50 10 IJGE CC1(CO[C@@H](CCl)[C@H](I)CCl)CC2(CC(F)(F)C2)C1 2230633482 KHAGJNDVGJLWKD-ZJUUUORDSA-N 427.100 4.868 50 10 IJGE O=C(c1ccc(Cl)c(I)c1)N(CCCl)Cc1cccs1 2283656020 LCQUQRZNGYFVCN-UHFFFAOYSA-N 440.133 4.887 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCC[C@H](CBr)CC1 2285845378 ZJHQWGVGYRZODE-VIFPVBQESA-N 427.539 4.879 50 10 IJGE C[C@@H]1C[C@H](Br)CCN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285846215 LJQSVJVLFYZMHM-RKDXNWHRSA-N 427.539 4.877 50 10 IJGE C[C@H](Cl)[C@H]1CCN(Cc2ccc(I)c(Br)c2)C1 2306221851 MQZYPVMYADIOQN-ONGXEEELSA-N 428.539 4.503 50 10 IJGE CC1=C(C#N)C(=O)N([C@H](C)c2ccccc2)C(=O)C1=CNc1ccccc1Br 2314579166 LHTGBVIGJOFXOC-OAHLLOKOSA-N 436.309 4.715 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@H](Cc2ccccc2C)C(=O)N1c1ccc(C(C)C)cc1 2314593641 QJNGYYFLDQJLRJ-HSZRJFAPSA-N 445.588 4.847 50 10 IJGE FC(F)C(F)(F)CO[C@H](CI)c1cccc(Br)c1 2315994523 SHRPNKUICNQEKX-SECBINFHSA-N 441.000 4.842 50 10 IJGE COc1ccc(CC(=O)Oc2ccc(C=C(C#N)c3ccccc3OC)cc2OC)cc1 2320506039 AELHSJBEKJIAKD-UHFFFAOYSA-N 429.472 4.925 50 10 IJGE CCN(C[C@](C)(CBr)OCC1C[C@@H]2[C@@H](C1)C2(F)F)C(=O)OC(C)(C)C 2320756896 FSNRJDNRNMGJKP-CPUCHLNUSA-N 426.342 4.705 50 10 IJGE COc1cc(C)c(-c2csc(C(C#N)=C(O)CN3C(=O)c4ccccc4C3=O)n2)cc1C 2331402749 MVRPZRQYGWXGGQ-UHFFFAOYSA-N 445.500 4.524 50 10 IJGE COCc1cc(Br)c([C@H](Cl)c2c(Br)nc(C)n2C)s1 2337321533 LLVBPHFRORVBCS-SECBINFHSA-N 428.577 4.790 50 10 IJGE Clc1cc(Br)c(CN2CCC(OCCCBr)CC2)s1 2345958659 JGJFYUJQPLDGJF-UHFFFAOYSA-N 431.621 4.930 50 10 IJGE O=C(NC[C@@H]1CCCC[C@H](Cl)C1)c1ccc(Cl)cc1I 2365597258 FBQXHBVWTAMWOW-MNOVXSKESA-N 426.125 4.862 50 10 IJGE CN(CC1CC(Br)C1)[C@@](C)(C(=O)O)c1ccc(OCc2ccccc2)cc1 2378576143 QFWDSVSJZLUCQY-RKOYOZNISA-N 432.358 4.671 50 10 IJGE COc1cc(/C=C(\C#N)c2ccccc2)ccc1OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 40851059 ZYFBYUGFWMKSGA-GIJQJNRQSA-N 445.387 4.795 50 10 IJGE CN(Cc1cc(Br)cs1)S(=O)(=O)c1cc(CCl)ccc1Cl 91271748 XLRZGDJSOGECER-UHFFFAOYSA-N 429.188 4.724 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)NC2CC2)ccc1OC(=O)c1ccc(Cl)cc1Cl 96504375 OXKHDXAHRSZSFF-ZROIWOOFSA-N 445.302 4.797 50 10 IJGE N#Cc1ccc(Cl)c(-n2c(CCl)nc3cc(I)ccc32)c1 127987342 ZVFIWYUSAGOALS-UHFFFAOYSA-N 428.060 4.894 50 10 IJGE COC(=O)c1c(-c2c(Cl)cccc2Cl)noc1NC(=O)/C(C#N)=C/c1ccccc1 170535614 QOAPGLRQEGSWMW-JLHYYAGUSA-N 442.258 4.981 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C\c2ccccc2OCC)c(OCC)c1 206999323 QNARZRCPTVOJFR-IJSSBWKMSA-N 435.476 4.573 50 10 IJGE O=C(N[C@@H]1CCC[C@@H]1CBr)c1cc(Br)c(Br)s1 231556821 BYOAUSRPWDLGPC-HTRCEHHLSA-N 446.002 4.567 50 10 IJGE CC(C)([C@H](Br)c1scc(C(F)(F)F)c1Br)S(C)(=O)=O 306111359 UIWHHZODBDKLDR-MRVPVSSYSA-N 444.132 4.789 50 10 IJGE ClCc1sc2ccc(I)cc2c1I 307112085 PGGWOKMYWQKGNA-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE Clc1cccc(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@@H]32)c1CBr 404142223 GFTPJERPSINQBK-LEWJYISDSA-N 435.793 4.715 50 10 IJGE FC(F)(F)c1ccc(Br)c(CBr)c1I 575694581 IPXDOHLJZMSOIC-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE FC(F)Oc1ccc(C(F)(F)F)c(I)c1CBr 575723569 QRBDGHSHJQIQBL-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE CN(c1ncc(Br)cc1Br)[C@H](CBr)C(C)(C)C 689210450 WAYHSKRVMLBYOK-SNVBAGLBSA-N 428.994 4.852 50 10 IJGE CC(C)N(C[C@@H](C)Br)C(=O)c1ccc(I)c(Cl)c1 691343092 HYJLLFOUCVVGHV-SECBINFHSA-N 444.538 4.579 50 10 IJGE Cc1cc([C@@H](Br)c2nn(C)cc2Br)sc1Br 693102911 SBYNPAHWROFFEB-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE ClCCc1nc2cc(Br)ccc2n1Cc1sncc1Br 722790729 VCOWOOGIEGQLQW-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CCC[C@H](Cc1ccccc1)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 727810683 CIHBQYFHFNAEMW-UWFGVWCKSA-N 437.547 4.898 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccc(CCC(F)(F)F)cc3)n[nH]2)cc1C 757613462 RWAZUNUANQZYHX-UHFFFAOYSA-N 445.445 4.655 50 10 IJGE N#Cc1ccc(NNC(=O)NCc2cccnc2Oc2cccc(F)c2)c(C(F)(F)F)c1 799537273 GGLVFOATGYJOQK-UHFFFAOYSA-N 445.376 4.730 50 10 IJGE Cc1nn(-c2ccc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)cc2)c(C)c1Cl 799746472 MDOWRZKXBGWVDD-UHFFFAOYSA-N 433.821 4.790 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1cnsc1Br 1887458580 RHJQZTDTQUDEEC-GFCCVEGCSA-N 432.181 4.722 50 10 IJGE C[C@H]1C[C@@H](Br)CN(Cc2ccc(I)c(Cl)c2)C1 2026563453 KFGBRIYDHGQKGZ-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE C[C@@H](CCCCBr)NC(=O)c1cccc(Br)c1Br 2031478251 QLQOZAQPOPXUQP-VIFPVBQESA-N 441.989 4.895 50 10 IJGE Clc1sc(Br)c(Cl)c1[C@H](Br)[C@@H]1CO[C@@H]2COC[C@@H]21 2040325161 JSJHUUGFHXUNJW-UAKXSSHOSA-N 436.980 4.915 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@@H](CI)C(C)C)cc1Br 2048498851 YFWKONDUECDEGZ-LBPRGKRZSA-N 444.538 4.600 50 10 IJGE O=S(=O)(c1ccc(F)c(CBr)c1)N(Cc1ccccc1)C1CCCC1 2059266811 JFWHEESHSQQCNU-UHFFFAOYSA-N 426.351 4.854 50 10 IJGE C[C@@]1(CCBr)CCN(Cc2ccc(I)c(Cl)c2)C1 2086654278 FCJLTQSRXWHJBQ-CQSZACIVSA-N 442.566 4.942 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@@H](CCl)C(F)(F)C1 2090182992 XFFCAIZTSDCKPD-LURJTMIESA-N 437.531 4.609 50 10 IJGE O=C(Nc1ccc(CBr)cc1)c1cc(I)ccc1F 2113356346 UBZCQPYULCSHHQ-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE CN(C(=O)c1csc(Br)c1Br)[C@H](CCCl)C(F)(F)F 2121996697 SRGJGPSKJMBYEY-ZCFIWIBFSA-N 443.510 4.905 50 10 IJGE CCN(Cc1ccccc1NC(=O)N1CCC(Br)CC1)C(=O)OC(C)(C)C 2162487071 NWDWVVBYCHBPFB-UHFFFAOYSA-N 440.382 4.835 50 10 IJGE CC(C)(C)OC(=O)N(CCO)[C@H]1CCCN(CCCCCCCCCBr)C1 2163064747 VUBNBHDTVNRFCK-IBGZPJMESA-N 449.474 4.806 50 10 IJGE CCN(Cc1ccc(NC(=O)N2CCC(Br)CC2)cc1)C(=O)OC(C)(C)C 2169060908 YCFHNXHNEWAKES-UHFFFAOYSA-N 440.382 4.835 50 10 IJGE CC(C)(C)CN(C1CC1)S(=O)(=O)c1cc(CBr)sc1Br 2179774600 GGYQAGNGOUJJIG-UHFFFAOYSA-N 445.242 4.605 50 10 IJGE N#Cc1cc(CBr)ccc1N1CCN(Cc2ccccc2)C[C@@H]1C(F)(F)F 2186710996 HIOKIWIMENUADJ-LJQANCHMSA-N 438.291 4.706 50 10 IJGE C[C@@H]1[C@H](NC(=O)OC(C)(C)C)CC[C@H](C(=O)N(C)C[C@H]2C[C@H](Br)C2)C1(C)C 2196913596 DZNBBBUSGFIMGW-WRQOLXDDSA-N 445.442 4.584 50 10 IJGE CCn1cc(Br)c([C@H](Cl)c2cc(Br)c(OC)cc2F)n1 2202911214 BNTIOJSLRCDOSC-GFCCVEGCSA-N 426.511 4.904 50 10 IJGE CC(C)(C)[C@@H]1C[C@H](CBr)CN(C[C@@H]2CC2(Br)Br)C1 2218004268 BLQRCNMSLGRRNF-UTUOFQBUSA-N 446.065 4.872 50 10 IJGE BrCC1(COCCOCCOCCOCc2ccccc2)CCCCC1 2227782832 HBRXLRXGCSNXBR-UHFFFAOYSA-N 429.395 4.598 50 10 IJGE COc1ccc([C@H](Br)[C@H](C)[C@@H]2CCCO2)cc1I 2257373782 ONOGCELSGPSSIX-LJWDBELGSA-N 425.104 4.551 50 10 IJGE CC(C)(C)CCN(CCCl)c1ncc(I)cc1Br 2261142190 JAWDCQADTSXHFC-UHFFFAOYSA-N 445.570 4.930 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@]12CCC[C@@H](CN(CC3(CBr)CC(F)C3)C1)C2 2265640417 YUFQJEBLJNUXME-AZNSAFFESA-N 433.406 4.611 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)c1csc(NC(=O)[C@@H](Br)C2CCCC2)n1 2267697477 JQYVTGSASOVAKG-ZDUSSCGKSA-N 446.411 4.795 50 10 IJGE Cc1cc(Br)c([C@H](Cl)[C@H]2C[C@H](S(C)(=O)=O)C2)cc1Br 2269883281 IUDQTVPFJZJSHF-JRKPZEMJSA-N 430.589 4.623 50 10 IJGE C[C@H]1C[C@@H](Br)[C@H](C)CN1C(=O)c1cc(F)c(Br)cc1Cl 2282974207 GAHOGMQXCMUXQX-KHQFGBGNSA-N 427.539 4.876 50 10 IJGE O=C(NC1(CCBr)CCSCC1)c1cccc(Cl)c1Br 2283190553 AKBJPLMGOXLWJX-UHFFFAOYSA-N 441.616 4.883 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC2(CC2)C[C@@H]1CBr 2285847205 XWUUWEHYASAFDJ-MRVPVSSYSA-N 425.523 4.631 50 10 IJGE C[C@H]1CCN(Cc2ccc(Cl)c(I)c2)[C@H]1CBr 2300238635 NFLGGKCUEDNVQC-ZANVPECISA-N 428.539 4.550 50 10 IJGE CC(C)[C@H](Br)C(C)(C)CN(C)C[C@@H]1CC1(Br)Br 2301978954 RZWDLAASJWQQIP-QWRGUYRKSA-N 434.054 4.870 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@H]2CCCC[C@@H]3C[C@H]23)C1 2302878310 NZXLAHCKYVTIQQ-PASDCYSWSA-N 449.373 4.786 50 10 IJGE CC(C)[C@H](Cl)CCNCc1ccc(I)c(Br)c1 2306223178 BQXLEEFQPLFZBA-GFCCVEGCSA-N 430.555 4.797 50 10 IJGE CCC[C@@](C)(CCl)NCc1ccc(I)c(Br)c1 2306223699 IKEZUMUSZKQLOO-ZDUSSCGKSA-N 430.555 4.941 50 10 IJGE Br[C@@H]1C[C@H]2CCCC[C@H]2N(Cc2sccc2I)C1 2316765477 XMPVEOSHMSASMR-NQBHXWOUSA-N 440.188 4.881 50 10 IJGE CCOc1cc(OCC)c([N+](=O)[O-])cc1C=NNC(=O)C12CC3C[C@](C)(C1)C[C@@](C)(C3)C2 2323144587 VMBUNGBAPGRSHG-XARYMXHKSA-N 443.544 4.839 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(C)CN(CC2(CBr)CCCCCC2)CC1(F)F 2336779749 BPHPKDDAXSCIBW-QGZVFWFLSA-N 439.385 4.956 50 10 IJGE CC1(C)CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)[C@@H](CC(F)F)C2)C1 2345009936 IHKZZKAXCGLNEM-AWEZNQCLSA-N 439.385 4.764 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Cl)[C@@H]1CCCCS1(=O)=O 2365222689 GFFGZMHSINOGGS-CABZTGNLSA-N 448.579 4.906 50 10 IJGE COc1c(F)cc([C@H](Br)c2nn(C)c(Cl)c2Br)cc1F 2370460375 QEGRJKKXFGZMIS-QMMMGPOBSA-N 430.474 4.607 50 10 IJGE CC(C)(C)OC(=O)NCCCOC1CCN(C[C@@](C)(CBr)C(C)(C)C)CC1 2380198100 YCLOBZOYWCPFBV-OAQYLSRUSA-N 449.474 4.830 50 10 IJGE C[C@H](CCCBr)NC(=O)c1cc(Br)c(Br)s1 125998431 NRVFHBXLTSFELH-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE CCc1cc(C(=O)c2ccccc2Cl)c(NC(=O)CI)s1 196455960 HAFBMEZRTVCNJA-UHFFFAOYSA-N 433.698 4.568 50 10 IJGE CC(C)(C)c1ccc(C(=O)Oc2ccc(C=NNC(=O)c3cc(C(C)(C)C)n[nH]3)cc2)cc1 254590304 ZFDMUAYUKSBNKF-UHFFFAOYSA-N 446.551 4.988 50 10 IJGE CC(C)(CCCBr)CNS(=O)(=O)c1c(Cl)cccc1Br 312360753 OGXKCIDYMSNZON-UHFFFAOYSA-N 447.620 4.582 50 10 IJGE CC(C)(C)[C@@H](CBr)NC(=O)c1cc(Br)sc1Br 393947790 GTEJKIPVOJNNLT-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE CC[C@H](Br)[C@H](C)NC(=O)c1ccc(Br)cc1Br 395360282 JAQPTQAIIXQXGP-XVKPBYJWSA-N 427.962 4.503 50 10 IJGE O=C(NC1(CCBr)CCCCC1)c1csc(I)c1 687329148 XPVOROHSZHFQTA-UHFFFAOYSA-N 442.160 4.570 50 10 IJGE CC(C)(C)N(CCBr)C(=O)c1cc(Cl)ccc1I 707921230 DQZVXZRRBNQDNW-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)NNC(=O)c1ccc(Cl)cc1 729616170 IKTCTXRUUXMDNZ-GFCCVEGCSA-N 432.908 4.616 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)c1ccc(-c2ccc(OC(F)F)cc2)s1 730215978 MCTBNWYMBIHNCE-UHFFFAOYSA-N 439.443 4.640 50 10 IJGE CC(=O)N(C)c1cccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccccc3C)c2C)c1 744772418 HYEPWUYFDZRHSJ-HMAPJEAMSA-N 426.520 4.931 50 10 IJGE COCCSc1ccc([C@@H](C)NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1 799578152 QHSGHKIOAVBZHY-CYBMUJFWSA-N 438.475 4.703 50 10 IJGE C=CCc1cc(/C=C(\C#N)C(=O)Nc2cccc(Br)c2)cc(OCC)c1O 1084125162 RMJXLGXWWWELES-MHWRWJLKSA-N 427.298 4.828 50 10 IJGE Cc1nn(Cc2ccccc2)c(C)c1C=NNC(=O)CSCc1ccccc1Cl 1084294024 BNZBAGIUNNIESX-UHFFFAOYSA-N 426.973 4.585 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3CC(C)C)cc1 1865690741 ZZBZSFZJIMQQJD-QGZVFWFLSA-N 434.462 4.955 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@@H]1c1ccccc1O 1865707979 LACAUGQTMLTRTM-MRXNPFEDSA-N 446.816 4.527 50 10 IJGE C[C@H]1[C@H](C)[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C 1892778171 WTQUVVRYYPFNGN-XQLPTFJDSA-N 435.403 4.556 50 10 IJGE Brc1cc(Br)c([C@H](Br)[C@H]2[C@H]3COCC[C@H]32)s1 1895913514 AWTSJEITKRYHBD-MLTZYSBQSA-N 430.987 4.992 50 10 IJGE Clc1cc(Br)c(CC23COC(CI)(C2)C3)s1 1903682485 FXNYSFVUXKYFAW-UHFFFAOYSA-N 433.536 4.691 50 10 IJGE O=C(c1cc(Br)sn1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1909915445 UMHBJNUGHNCGJF-AWEZNQCLSA-N 444.192 4.722 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21 1917525364 JQQMZYNWIUUJHY-FMZODGAVSA-N 445.138 4.954 50 10 IJGE O=C(Nc1ccc(F)c(CBr)c1)c1ccccc1I 1924859169 TWMPVMQWSDZUKK-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE Fc1ccc2nc(CCl)n(Cc3csnc3Br)c2c1Br 1925105399 DSLPBUDFQHCYNX-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1Cc1cc(Br)ccc1Br 2006498633 FBCMLJYWUPTMPY-BXKDBHETSA-N 425.990 4.959 50 10 IJGE Cl[C@H]1CCC[C@@H]1CCNc1ncc(I)cc1Br 2015765230 NIIQVLDUDADGAB-KCJUWKMLSA-N 429.527 4.658 50 10 IJGE Cc1cc(F)ccc1Cn1nc(CCl)c(I)c1C(F)(F)F 2079211254 NCIASRZNRMGKNT-UHFFFAOYSA-N 432.586 4.741 50 10 IJGE FC(F)(F)c1cc(Br)nc(-n2nc(CBr)c3c2C[C@H]2C[C@H]32)c1 2080741193 RXSZLMGVBRMTOD-SVRRBLITSA-N 437.057 4.603 50 10 IJGE CC1(C)CN(Cc2ccccc2)CCN(c2nc3sccn3c2CBr)C1 2094067317 LWTKIWZICFUOEH-UHFFFAOYSA-N 433.419 4.639 50 10 IJGE CC(C)(C)OC(=O)NCc1nc2c(s1)CCN(C[C@H](CBr)C(C)(C)C)C2 2106782560 RFQVACJACLYUNS-ZDUSSCGKSA-N 446.455 4.583 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@@H]1CCN(C[C@H](CBr)c2ccccc2)C1 2139885930 WLVWRXYXAKDJJV-ZWKOTPCHSA-N 425.411 4.790 50 10 IJGE Cc1ccc(CBr)c(N2CCC[C@]3(CN(Cc4ccccc4)CCO3)C2)c1 2151738812 KGOIOZBAKLXHND-QHCPKHFHSA-N 429.402 4.761 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]2CCC[C@@H]2N1C[C@H](CBr)c1ccccc1 2164654454 AELCOYANOIHHPM-MUGJNUQGSA-N 437.422 4.933 50 10 IJGE CCCN(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)[C@H](Br)C1CCCC1 2167031238 HXILNHVAKYYMSB-FUHWJXTLSA-N 445.442 4.826 50 10 IJGE CN(C(=O)c1c(Cl)cccc1Br)[C@H](CCBr)C(F)(F)F 2178519743 CWJLWEUQYHNHIV-SECBINFHSA-N 437.481 4.890 50 10 IJGE COc1ccc(Oc2cccc(OC)c2CBr)cc1I 2203196507 MBSIVBAJBVPADJ-UHFFFAOYSA-N 449.082 4.996 50 10 IJGE Cc1c(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)ccnc1CBr 2205626212 QEHOYLKVTNHNSJ-URFJDIBFSA-N 426.402 4.632 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1Cc2ccccc2N(CCCCCI)C1 2214705330 QHVBTPPRJDDOTH-MRXNPFEDSA-N 444.357 4.548 50 10 IJGE CO[C@@H]1CC[C@@H]1COc1c(Br)cc(CBr)cc1Br 2220576033 KXAWEHIOTIPEPM-BXKDBHETSA-N 442.973 4.910 50 10 IJGE F[C@@]1(COc2c(Br)cc(Br)cc2CBr)CCOC1 2222397400 VBWDSMFEHUFEAV-LBPRGKRZSA-N 446.936 4.614 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2[C@]12C[C@H]1CN(Cc1ccccc1)C2 2224708270 HNVQFSXSHRBAHW-XOBRGWDASA-N 434.740 4.908 50 10 IJGE BrC[C@@H]1C[C@@H]2CCCC[C@@H]2N1Cc1ccc(I)cc1 2231964296 KNASCRFVGUYHQI-BPUTZDHNSA-N 434.159 4.819 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(CCCCCCCBr)CCC1(F)F 2263164833 MFYIATAWFUZDFY-OAHLLOKOSA-N 427.374 4.956 50 10 IJGE CC(C)[C@@H](CBr)N(C)Cc1ccc(Cl)cc1I 2302484827 KFQBJIIRVOVULT-CYBMUJFWSA-N 430.555 4.796 50 10 IJGE CCOc1ccc(C=C2C(=O)N(Cc3ccccc3Cl)C(=O)C(C#N)=C2C)cc1OC 2314620794 VGLWANXRMXWXRS-UHFFFAOYSA-N 436.895 4.540 50 10 IJGE C[C@H]1CCN(Cc2ccc(Cl)c(I)c2)C[C@@H]1CBr 2315551336 PNOVDJFVBBOGGV-JQWIXIFHSA-N 442.566 4.798 50 10 IJGE N#CC(=CNCCc1ccccc1Br)C(=O)Nc1ccc(Cl)c(Cl)c1 2318454997 KLDMJFORWLWISJ-UHFFFAOYSA-N 439.140 4.934 50 10 IJGE O=C(Cc1ccc(Br)cc1Cl)N[C@@H](CCCl)COCc1ccccc1 2320559162 UUQOURJNONKAFD-KRWDZBQOSA-N 445.184 4.976 50 10 IJGE Clc1cc(Br)c(CN2C[C@@H]3CC[C@@H](CBr)O[C@@H]3C2)s1 2345961952 PYACHAFBZYIQAT-ATZCPNFKSA-N 429.605 4.538 50 10 IJGE CC[C@@H](Nc1ccc(Br)cc1)C(=O)N/N=C/c1cccc(Br)c1 1947158 UDTCPSCMAGBDNV-MBTVCVBTSA-N 439.151 4.552 50 10 IJGE O=C(NC1CCCCC1)[C@H](c1ccc(F)cc1)N(Cc1ccc(F)cc1)C(=O)CCl 3037418 GLWKZEBGFYSGGA-QFIPXVFZSA-N 434.914 4.722 50 10 IJGE O=C(NNC(=O)c1cc(-c2ccco2)nc2ccccc12)c1cc(Cl)sc1Cl 17409184 OJGVGWTWDPIOMS-UHFFFAOYSA-N 432.288 4.938 50 10 IJGE COc1ccc(/C(C)=N/NC(=O)c2cc(-c3ccc(Cl)c(Cl)c3)n[nH]2)cc1OC 33340623 RDGUXXWIODDYDK-FOKLQQMPSA-N 433.295 4.555 50 10 IJGE C=CCNC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccc(OCCC)cc1C 33559917 AMBWFPFKTUGYAJ-SILNSSARSA-N 426.520 4.846 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(C(C)C)cc4)ccc32)o1 38659350 RNVAVAIZVHPZDE-RUZDIDTESA-N 444.487 4.914 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(F)cc4)ccc32)c1 38684852 WGAUNFQFOGGJJW-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2cc(C)ccc2C(C)C)cc1 40978037 ZPMVDCXLJZCGLE-RCCKNPSSSA-N 434.536 4.926 50 10 IJGE COc1ccc(CNC(=O)/C(C#N)=C/c2ccc(OCc3cccc(C)c3)c(OC)c2)cc1 59272183 MJYKERZBAAIMMX-OEAKJJBVSA-N 442.515 4.815 50 10 IJGE CC1=C(C#N)C(=O)N([C@H](C)c2ccccc2)C(=O)/C1=C/Nc1cccc(Br)c1 101235022 MYSKRYPPLPCIJB-OOWUWCJESA-N 436.309 4.715 50 10 IJGE COCCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(-c3cccc(Cl)c3Cl)o2)C1=O 101335699 CIYVXUNPNOBXBQ-LFIBNONCSA-N 445.302 4.882 50 10 IJGE CCCCN(CCBr)C(=O)c1cc(Br)ccc1Br 161194063 BWDAVIIXFJLDDZ-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE CCOc1cc(/C=N\NC(=O)CSc2nc3ccccc3[nH]2)cc(Cl)c1OC(C)C 169886277 BRTUURWDSCMNKS-KSEXSDGBSA-N 446.960 4.645 50 10 IJGE N#C/C(=C/NCCc1ccccc1Br)C(=O)Nc1ccc(Cl)c(Cl)c1 217006855 KLDMJFORWLWISJ-QBFSEMIESA-N 439.140 4.934 50 10 IJGE O=C(c1cc(Br)sc1Br)N(CCBr)C1CCC1 232486693 YBUPRTDSAHUVRM-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE Cn1ncc([C@@H](Br)c2ccc(Cl)c(Cl)c2)c1I 379216132 QCFDNCFBTHVJNS-JTQLQIEISA-N 445.913 4.816 50 10 IJGE C[C@H](CNC(=O)c1scc(Br)c1Br)C[C@@H](C)Br 705442271 NNDMZUUTLIBDNU-NKWVEPMBSA-N 448.018 4.813 50 10 IJGE C[C@@H]1CCN(C(=O)c2scc(Br)c2Br)[C@H]1CBr 705518944 SYWADLBOGKPHDY-SVRRBLITSA-N 446.002 4.519 50 10 IJGE CC(C)(C)N(CCBr)Cc1cc(Cl)ccc1I 708577125 FOJBHJYJDSDDSY-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE Cn1cc(C[C@H](CBr)c2cccc(Br)c2)c(Br)n1 714085737 QBLFEDGEZBOOAN-SNVBAGLBSA-N 436.973 4.666 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C[C@@H](C)c2ccc(C(F)(F)F)cc2)c1C 736694904 LVYOZYJZKLLSTA-CYBMUJFWSA-N 429.446 4.811 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2cc(O)nc3ccccc23)c(C)n1-c1ccccc1F 754317345 GUEBMUATTRGVNI-XDHOZWIPSA-N 440.478 4.710 50 10 IJGE Cc1ccccc1C(NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1ccccc1C 760659237 VOHYYVSQIOVXOS-UHFFFAOYSA-N 426.520 4.529 50 10 IJGE CC(C)(C)c1ccc(NNC(=O)C(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)cc1 784804267 GCSIXFGZTIGASM-UHFFFAOYSA-N 443.853 4.660 50 10 IJGE Cc1cccc(C)c1Oc1ccccc1NC(=O)C(=O)NNc1ccc(F)c(F)c1F 784810438 GRQJMQAOGPZTIS-UHFFFAOYSA-N 429.398 4.595 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3cnccc3C)n2C2CCCCC2)cc1 794525163 UILRKJPONMJHFP-UHFFFAOYSA-N 448.596 4.705 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2c(C)cc(Cl)c3ccccc23)cc1 1466103419 FQBVZWBGYNRBAP-OAHLLOKOSA-N 439.899 4.624 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1[C@H]1CN(C(=O)OCc2ccccc2)C[C@@H]1CBr 1614643597 UBYXTBMTUAKLBT-LPHOPBHVSA-N 433.302 4.650 50 10 IJGE C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F 1657694584 DKJFVEIIUVGADX-HNNXBMFYSA-N 436.883 4.715 50 10 IJGE Cc1ccc(C)c(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2ccccc2F)c1 1865684175 VKDPXESJXZXBIT-SFHVURJKSA-N 442.416 4.924 50 10 IJGE CCCc1nn(Cc2ccccc2)c2c1[C@H](c1cccc(Br)c1)C(C#N)=C(N)O2 1865684725 WRMDHBFWTPUNDK-HXUWFJFHSA-N 449.352 4.865 50 10 IJGE N#C/C(=C\c1ccc(OC(=O)c2ccccc2)cc1)c1cc2c(cc1[N+](=O)[O-])OCCO2 1872728590 KNVWUEVVQBYHQY-LDADJPATSA-N 428.400 4.649 50 10 IJGE Cc1ccc(C(=O)N(C)C[C@H]2C[C@@H](Br)C2)c(NC(=O)OC(C)(C)C)c1C 1887829691 MJJIBQBAJWYAPE-GASCZTMLSA-N 425.367 4.896 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@H]1CCC[C@H](C(F)(F)F)C1 1916346742 DOEZHSKLDYUHRI-ULQDDVLXSA-N 436.312 4.794 50 10 IJGE CCc1sc(Br)cc1[C@@H](Cl)c1cnn(C)c1I 1943035818 GBHYQYQJFLIPEI-SNVBAGLBSA-N 445.551 4.739 50 10 IJGE CC1(C)[C@@H](Br)CCN1Cc1ccc(Br)cc1Br 1943854170 YGBDXEKKYLJFHE-LBPRGKRZSA-N 425.990 4.959 50 10 IJGE CC1([C@@H](CBr)NCc2cccc(Br)c2Br)CC1 1945368343 JTFWSBVIUIUQGB-LLVKDONJSA-N 425.990 4.865 50 10 IJGE CCc1nc(C(=O)N(CCCBr)Cc2ccccc2)c(Br)s1 1961182336 OIBMBSFADJDGIM-UHFFFAOYSA-N 446.208 4.895 50 10 IJGE C[C@]1(CBr)CCN(Cc2cc(Br)ccc2Br)C1 2006507977 NLFJJESGMQNGMQ-CYBMUJFWSA-N 425.990 4.819 50 10 IJGE CC1(C)OCCO[C@@H]1[C@@H](Br)c1cc(Br)c(Br)s1 2013745500 VHCSCDQSYQAIHJ-DTWKUNHWSA-N 449.002 4.903 50 10 IJGE CC[C@@H](CCCCl)NC(=O)c1cc(Br)ccc1I 2036511025 QHEYMYNGNZUROF-JTQLQIEISA-N 444.538 4.581 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)c1ccc(NC(=O)OC(C)(C)C)c(Cl)c1 2076209424 RINBKNZBUCGLTI-AULYBMBSSA-N 431.758 4.933 50 10 IJGE CN(C[C@@H]1CCCCN1C[C@@H](CBr)c1ccccc1)C(=O)OC(C)(C)C 2106785237 NWRZSTADIMWZRY-MOPGFXCFSA-N 425.411 4.887 50 10 IJGE C[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)CN1C[C@@H](CBr)c1ccccc1 2106787123 YBLPQONEBSHBKR-ZIFCJYIRSA-N 425.411 4.790 50 10 IJGE CCCN(CC1(CBr)CCOCC1)C1CCC(NC(=O)OC(C)(C)C)CC1 2163059766 WGUTWYKREISNFA-UHFFFAOYSA-N 447.458 4.726 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CCCN2C[C@@H](CBr)c2ccccc2)C1 2163062148 JYNWFMNDOZVIPK-VAMGGRTRSA-N 437.422 4.887 50 10 IJGE CC(C)(CC(CBr)(CBr)c1cccc(Cl)c1)S(C)(=O)=O 2167893603 CTOPQLZGARMDDP-UHFFFAOYSA-N 446.632 4.581 50 10 IJGE C[C@H]1CCCCCCN1S(=O)(=O)c1cc(CBr)sc1Br 2179792880 LTAIGDUPQWQZBM-JTQLQIEISA-N 445.242 4.749 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2-c1csnc1Br 2202301621 SOZTXILBTVKSJF-UHFFFAOYSA-N 437.544 4.754 50 10 IJGE FCCOCCC(CBr)(CBr)c1ccc(Br)cc1 2224108325 ZYVAQNHBTUASHX-UHFFFAOYSA-N 446.980 4.853 50 10 IJGE O=C(c1ccc2c(c1)OC(F)(F)O2)N(Cc1ccccc1)[C@H](CBr)C1CC1 2240246730 BHBDYUQLFXKKQM-MRXNPFEDSA-N 438.268 4.824 50 10 IJGE C[C@H](Br)CCCN(C)C(=O)c1csc(Br)c1Br 2299512021 YCXKQBZZVITTNT-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE C[C@@H](Br)CCCN(C)Cc1ccc(I)c(Cl)c1 2299539073 BJKKRNVTKJRYQE-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)N(C)C)cc(Br)c1OCc1ccc(C)cc1 2313568197 PLGLOWRYNALIMF-UHFFFAOYSA-N 443.341 4.730 50 10 IJGE CCCOc1ccccc1C=CC(=O)Oc1ccc(C=C(C#N)C(=O)OCC)cc1OC 2314774387 DUMYQQCULOEPIX-UHFFFAOYSA-N 435.476 4.573 50 10 IJGE COc1cc(C=C(C#N)C(=O)NC(C)C)ccc1OC(=O)CCc1ccc(C(C)C)cc1 2314790186 HHWZYBUMQRKKRI-UHFFFAOYSA-N 434.536 4.788 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2)cc([N+](=O)[O-])c1OCc1cc(C)ccc1C 2322999058 WRLHGUWXAGHEHA-UHFFFAOYSA-N 433.464 4.563 50 10 IJGE CC1(C)[C@H](Cl)CC[C@H]1NCc1ccc(I)c(Br)c1 2325213930 WOLPVBTWWZRPCL-CHWSQXEVSA-N 442.566 4.939 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]([S@](C)(=O)=NC[C@@](C)(CBr)C(C)(C)C)C1 2327092540 LNGHSIQXRFOMAN-ZEZBYCSMSA-N 439.460 4.541 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CCN(C[C@]2(CBr)CC2(F)F)c2ccccc21 2379984534 MYFLZOMZNDVESQ-AUUYWEPGSA-N 445.348 4.925 50 10 IJGE Cc1ccc(Cl)c(Oc2cc(N3CCN(C(=O)C(C)(C)CCl)[C@H](C)C3)ncn2)c1 37356533 XYQQQALAGCBDKA-OAHLLOKOSA-N 437.371 4.533 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2F)cc1 38651982 UDNDRSAFAZULJD-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE Cc1ccc(Cl)cc1Nc1ncnc(NNC(=O)c2ccccc2Cl)c1[N+](=O)[O-] 40592845 WDJFVIWDPUCVFJ-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE COc1cc(/C=N\NC(=O)c2cccnc2)ccc1OCc1c(Cl)cccc1Cl 169888152 LZZYCNQOWHEDEL-GATIEOLUSA-N 430.291 4.740 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)COc2cccc(C(C)C)c2)c(OCC)c1 206291005 VYNKOEDULMSURR-NDENLUEZSA-N 437.492 4.663 50 10 IJGE CCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)CCc2ccc(C(C)(C)C)cc2)c(OC)c1 207164039 YUHCXKPEWDJMIP-PGMHBOJBSA-N 448.563 4.964 50 10 IJGE Oc1ccc(Br)cc1[C@H]1CN(Cc2ccccc2)C[C@H]1CBr 382704608 DZKMEUPRRZSXCK-PBHICJAKSA-N 425.164 4.765 50 10 IJGE CCN(C[C@](C)(CI)OC1CCCCC1)C(=O)OC(C)(C)C 685993138 BZKFOFCIGPDXGW-KRWDZBQOSA-N 425.351 4.786 50 10 IJGE CN(C(=O)c1cc(Br)sc1Br)[C@@H]1CCC[C@H]1Br 709101706 GDOIVCXYYAHHMH-HTQZYQBOSA-N 446.002 4.661 50 10 IJGE C[C@@H](Br)[C@H]1CCN(C(=O)c2scc(Br)c2Br)C1 719869151 HEGDBXJGZUNOJE-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE CC(C)[C@@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1cccc(C(F)(F)F)c1 726614066 QMVIRSSKLSGQBK-GOSISDBHSA-N 430.430 4.595 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)c1nc(-c2ccccc2)oc1-c1ccccc1 731342760 XXLYIAKADHAQLG-UHFFFAOYSA-N 434.455 4.632 50 10 IJGE Cc1cc(C(=O)Oc2ccc([N+](=O)[O-])c3ncccc23)ccc1NC(=O)c1cccs1 770138645 HMYLABAXAXAFEP-UHFFFAOYSA-N 433.445 4.984 50 10 IJGE Cc1ccc(NCC(=O)NN=Cc2ccc(-c3cc([N+](=O)[O-])ccc3Cl)o2)cc1C 1083989814 MWGLUVRRLKMBIT-UHFFFAOYSA-N 426.860 4.687 50 10 IJGE CCOc1ccc2ccccc2c1C=NNC(=O)Cn1c(C(F)(F)F)nc2ccccc21 1084092022 MQVJTSOAUBBGOR-UHFFFAOYSA-N 440.425 4.757 50 10 IJGE C=C(C)[C@@H](NC(=O)NNC(=O)c1ccc(OCCC(C)C)cc1)c1ccc(F)c(F)c1 1671852329 WCDDGMXNWBQEBX-OAQYLSRUSA-N 431.483 4.651 50 10 IJGE COc1cc(C=NNC(=O)COc2cc(C)cc(C)c2)ccc1OCc1ccc(C)cc1 1772754470 IEJSVLQJZBMKMA-UHFFFAOYSA-N 432.520 4.729 50 10 IJGE COc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2c(Cl)cccc2Cl)cc1 1865686315 TWMMPJWWYACYBI-SFHVURJKSA-N 427.291 4.714 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)C12CC(C1)[C@@H](C(F)(F)F)O2 1878394605 CFGZFDNHIVGGOK-LPMVOBIJSA-N 434.296 4.545 50 10 IJGE C[C@@H](CC[C@H](Br)CN1C(=O)c2ccccc2C1=O)COCc1ccccc1 1880124771 PWYQURSRFHFUTE-WMZOPIPTSA-N 430.342 4.679 50 10 IJGE O=S(=O)(c1cccc2cccnc12)N(Cc1ccccc1)C1(CBr)CCC1 1915756934 QGZKVQROOILSJN-UHFFFAOYSA-N 445.382 4.743 50 10 IJGE C[Si](C)(C)O[Si@](C)(O[Si@@](C)(O[Si](C)(C)C)c1ccccc1)c1ccccc1 1933213626 MRUHXDZUINGBFB-KAYWLYCHSA-N 434.833 4.664 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@@]23CC[C@H](CI)O3)C1 1939507021 RURZTYCNAZCZCT-ZTFGCOKTSA-N 435.346 4.540 50 10 IJGE Cc1c([C@H](Br)c2sccc2Br)c(Br)nn1C 1987721581 USTJGTSFWNDDKI-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE Clc1cc(CN[C@H](CCBr)C2CC2)ccc1I 2026564254 REYJGYZHDXINDT-CYBMUJFWSA-N 428.539 4.598 50 10 IJGE CC(C)C[C@@H](CBr)NC(=O)c1cccc(Br)c1Br 2031487453 UVNXBQUXPHCEPD-VIFPVBQESA-N 441.989 4.751 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CCCCCBr)CC[C@H]1C(F)(F)F 2044695173 AZTAPTWWOCFQBJ-ZIAGYGMSSA-N 431.337 4.577 50 10 IJGE CCC[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]1C(F)(F)F 2052479127 MWBKKEBTPIRXSC-MCIONIFRSA-N 431.337 4.670 50 10 IJGE CN(C(=O)c1ccc(Br)cc1Br)C1(CCBr)CC1 2069688813 WGVCFQWILHBOPQ-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE CC(C)[C@H](CBr)CN1CCC(c2n[nH]cc2NC(=O)OC(C)(C)C)CC1 2129060771 QTONIJPWJYGVGP-OAHLLOKOSA-N 429.403 4.603 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@H]2OCCN(C(=O)OC(C)(C)C)[C@H]2C1 2163061908 IQWNKIOYEDSDNN-ZWKOTPCHSA-N 447.458 4.678 50 10 IJGE Cc1c(Cl)cc(CN2CCOC[C@@H]2C[C@H](C)Br)cc1Br 2185304717 FCRYVWBLNDLEFR-GWCFXTLKSA-N 425.592 4.785 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CCC[C@]23CCC[C@@H](CI)O3)C1 2213354084 IOGQEPVWFYEKHH-OLMMMNRUSA-N 449.373 4.786 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1cc(Br)ccc1OC 2220400219 PUKBVMBVWCVYEL-INIZCTEOSA-N 446.794 4.666 50 10 IJGE Cc1sc(C(=O)N2CC[C@H](Br)C(F)(F)CC2)c(C)c1Br 2234464117 KXFKCISIOGIELY-VIFPVBQESA-N 431.140 4.762 50 10 IJGE CS(=O)(=O)C1CC([C@@H](Br)c2cc(C3CC3)c(Br)s2)C1 2269762380 RZFANTJQAJOMMD-SHVIVCPWSA-N 428.211 4.647 50 10 IJGE Cc1cc(Br)c([C@@H](Br)C2CC(S(C)(=O)=O)C2)c(C)c1Cl 2285390800 GNURVDMTTITMOA-ZPPKWKGLSA-N 444.616 4.979 50 10 IJGE C=CC[C@@]1(CBr)CCCCN1Cc1nn(C)c(Cl)c1Br 2287725080 JKYYZSIBJUYCNI-AWEZNQCLSA-N 425.596 4.532 50 10 IJGE Clc1ccc(I)cc1CN1CCCC[C@@H]1CBr 2307329646 CUQPDEPDYSGLAV-GFCCVEGCSA-N 428.539 4.694 50 10 IJGE BrC[C@H]1C[C@@H]2CN(Cc3cc(Br)ccc3Br)C[C@H]12 2309795979 HWGQNTSNTSSKBD-GIPNMCIBSA-N 438.001 4.674 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc(OC)cc2)sc2c1CC[C@H](CC)C2 2314571853 NFTPQYXLHDZGNG-HNNXBMFYSA-N 438.549 4.994 50 10 IJGE COc1c(Br)cc(C)c([C@@H](Br)[C@@H]2C[C@H]2OC)c1Br 2317411162 RXHBLHAUFMJJNK-ZOFUNIGCSA-N 442.973 5.000 50 10 IJGE CN(Cc1ccc(Cl)cc1I)C[C@H]1CCC[C@H]1Br 2318529640 SJEXDYKCEBTZEZ-ZWNOBZJWSA-N 442.566 4.940 50 10 IJGE BrCC1C[C@@H]2C[C@H](C1)CN(Cc1sccc1I)C2 2319712353 HVVLOVKNZDHOFC-YOGCLGLASA-N 440.188 4.596 50 10 IJGE Cl[C@H]1CCC[C@@H](CNCc2ccc(I)c(Br)c2)C1 2325224067 SVJWECGUWTZUKK-PWSUYJOCSA-N 442.566 4.941 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1C1CCN(C[C@]2(CBr)CC2(F)F)CC1 2351888538 XCSXELJUPVZSHA-CRAIPNDOSA-N 437.369 4.518 50 10 IJGE Cc1cc(C=NNC(=O)c2ccc([N+](=O)[O-])cc2)c(C)n1-c1cccc(C(F)(F)F)c1 8437665 HLVXEQWQSBHCLW-UHFFFAOYSA-N 430.386 4.785 50 10 IJGE CC(C)CCOc1ccc(Br)cc1C(=O)NNC(=O)c1ccccc1Cl 14650687 YBTOWJMDNMZBRP-UHFFFAOYSA-N 439.737 4.602 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccc(Cl)cc4)ccc32)cc1 38650410 CKVSXGUIFXUTKZ-DEOSSOPVSA-N 446.890 4.715 50 10 IJGE CC[C@@H](C)NC(=O)c1oc2c(c1C)/C(=N/NC(=O)Cc1coc3cc(C)cc(C)c13)CCC2 40826819 DYOUNARCJSUTLE-VLKBHEQSSA-N 449.551 4.879 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2cc(C)n(-c3cccc(C)c3)c2C)cc1 58893336 ZPUPTGNRTXSERP-GKZBKZLQSA-N 433.552 4.765 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)Nc2ccc(Cl)cc2)cc(Br)c1OC(C)=O 59116951 KLRHRRWCXYYVRL-NTUHNPAUSA-N 449.688 4.582 50 10 IJGE Cc1cccc(C(=O)N/N=C2\C(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)c1 59471805 AYWUUAXEJONWCT-QLYXXIJNSA-N 438.314 4.983 50 10 IJGE CC(C)Cc1ccc([C@H](C)C(=O)NNC(=O)c2ccc(NC(=O)C3CCCCC3)cc2)cc1 66199312 ZMYDNWPGEVBWHD-IBGZPJMESA-N 449.595 4.969 50 10 IJGE COc1ccc([C@@H](C(=O)NC2CCCCC2)N(C(=O)CCl)c2ccc(F)cc2)cc1 97914338 ALRIEJMXQBBEDJ-QFIPXVFZSA-N 432.923 4.596 50 10 IJGE CCOc1cc(/C=N/NC(=O)c2cc3ccccc3n2C)cc(Br)c1OCC 169926132 NJGFUHFOXCYYOE-YDZHTSKRSA-N 444.329 4.502 50 10 IJGE O=C(NN=Cc1ccc2ccccc2c1)c1cc(I)ccc1Cl 252603235 FOYHMXSOKZZVRO-UHFFFAOYSA-N 434.664 4.862 50 10 IJGE ClCc1nc2cc(Br)cnc2n1C[C@H]1CCCN(Cc2ccccc2)C1 382144350 GEQLKPCUJSOGGL-INIZCTEOSA-N 433.781 4.845 50 10 IJGE FC(F)Oc1cc(I)cc(CBr)c1Br 575682087 JFLJIMILHZOEHI-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE CC(C)N(CCBr)C(=O)c1scc(Br)c1Br 705509723 FLPNOYXNDNYZMR-UHFFFAOYSA-N 433.991 4.519 50 10 IJGE Cc1nc(CC(=O)NN=Cc2c(C)nn(-c3ccccc3)c2Oc2cccc(F)c2)cs1 766687235 KHEHIRGYMWZYSY-UHFFFAOYSA-N 449.511 4.570 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCn4c(C(C)C)nnc4[C@H]3C)c2C)c1 784685123 DWNBZJIQFLIXJY-YRXLECQKSA-N 442.567 4.628 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N[C@@H]2CCSc3ccccc32)c(-c2ccccc2)n1 914463480 GRQKJCWSCHTMJQ-JIKIWWBOSA-N 439.544 4.724 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)N(C)C)c(Br)cc1OCc1ccc(Cl)cc1 1084120457 IWJBCVFKNSYFJH-OVCLIPMQSA-N 449.732 4.685 50 10 IJGE O=C(CC[C@H](O)c1ccccc1)NN=Cc1ccc(-c2cccc(Br)c2)o1 1084216046 UVCHVUGFLVLCOL-IBGZPJMESA-N 427.298 4.673 50 10 IJGE O=C(NNC(=O)[C@H](Oc1ccc(F)c(Cl)c1)c1ccccc1)c1ccccc1Cl 1321617386 CILDSHHJAHBPEH-LJQANCHMSA-N 433.266 4.714 50 10 IJGE CC(=O)N(CCc1ccccc1)CC(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F 1352091939 WPEQRHQKEONYFA-IBGZPJMESA-N 444.906 4.936 50 10 IJGE C[C@@H](Br)C(=O)c1c(I)cccc1SC(F)(F)F 1848425903 PLFUOJGCBJJQAV-RXMQYKEDSA-N 439.034 4.869 50 10 IJGE Cc1ccsc1[C@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2Cc1ccc(F)cc1 1865698858 DYHULKCRQJDXSO-AWEZNQCLSA-N 434.418 4.677 50 10 IJGE C[C@@H]1CCN(C(=O)OC(C)(C)C)CC[C@@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1881376154 ODPQXSWOBMRZOS-QLFBSQMISA-N 435.403 4.558 50 10 IJGE Cc1nsc(Br)c1[C@@H](Br)c1cc2c(cc1Cl)NC(=O)C2 1912982547 ODDZRJILYQXRQW-LBPRGKRZSA-N 436.556 4.846 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)c1nccn2nc(C(F)(F)F)cc12 1915087384 UWPZTDBPEUMAGZ-CYBMUJFWSA-N 427.268 4.928 50 10 IJGE CCN(C[C@](C)(CI)OC1CC2(CCC2)C1)C(=O)OC(C)(C)C 1985548862 BEZBQIZARZBXGZ-KRWDZBQOSA-N 437.362 4.786 50 10 IJGE CC(C)[C@@H](Br)CN(C)C(=O)c1csc(Br)c1Br 2002410797 OBAYOVUEPCOHSO-QMMMGPOBSA-N 448.018 4.765 50 10 IJGE Cn1cc([C@@H](Br)c2ccc(F)c(Br)c2)c(Br)n1 2005274453 LOSGBBORYZWRBJ-JTQLQIEISA-N 426.909 4.569 50 10 IJGE BrC[C@H]1CCCCN1Cc1cc(Br)ccc1Br 2006504210 XHJIKSOZCCHMSY-GFCCVEGCSA-N 425.990 4.961 50 10 IJGE BrC[C@@H]1[C@@H]2CCN(Cc3cccc(Br)c3Br)C[C@@H]12 2032219307 HRFXNGCYKFOUCA-QJPTWQEYSA-N 438.001 4.674 50 10 IJGE O=C1N(c2c(Br)cc(Cl)cc2Br)CC1(CCl)CCl 2035958529 FHQACNOLFMMKIA-UHFFFAOYSA-N 436.358 4.676 50 10 IJGE CCN1CCC[C@H]([C@@H](Br)c2cscc2OCc2ccccc2)S1(=O)=O 2038676928 LDNUXGNNBZRFCL-MSOLQXFVSA-N 444.416 4.577 50 10 IJGE CCCN(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@@H](Br)C(F)(F)F 2044704571 DQYBIEPCVASWSE-UONOGXRCSA-N 431.337 4.671 50 10 IJGE C[C@@H]1CO[C@@H](COc2c(Br)cc(CBr)cc2Br)C1 2047588543 ACSRKOCLZWYTLA-WCBMZHEXSA-N 442.973 4.910 50 10 IJGE O=C1Cc2cc([C@@H](Br)C3CC(Br)C3)c(Br)cc2N1 2076167153 IULSZLBEDARHRU-ROKYYSGWSA-N 437.957 4.553 50 10 IJGE CCc1ccccc1Cn1nc(CCl)c(I)c1C(F)(F)F 2079211359 QBNMISZPYFBZMI-UHFFFAOYSA-N 428.623 4.856 50 10 IJGE Clc1cc(N2CCCN(Cc3ccccc3)CCOCC2)ccc1CBr 2088627512 DHVPRVFTONOWCY-UHFFFAOYSA-N 437.809 4.964 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@H](Cl)CC2(CCC2)C1 2094997939 UTBJOPGINNOMDW-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE CN(c1ncc(Br)c(CCl)n1)[C@@H]1C[C@@H]2C[C@@H](OCc3ccccc3)C[C@H]21 2134002228 WAOQWTYQAWOLND-WFXMFSGNSA-N 436.781 4.798 50 10 IJGE CC[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1N(C)C(=O)c1ccc(CBr)cc1 2163625852 VVDMIQSFOSACDZ-FUHWJXTLSA-N 439.394 4.689 50 10 IJGE Cc1cc(C(=O)N2C[C@]3(F)CCC[C@]3(CBr)C2)sc1Br 2176631314 YARSXAMYEPLOAB-UONOGXRCSA-N 425.161 4.548 50 10 IJGE CC(C)(C)OC(=O)N1CCCC(C)(C)[C@@H]1CNC(=O)c1ccc(CBr)cc1 2184323474 JBENFUCIMAUPSE-KRWDZBQOSA-N 439.394 4.737 50 10 IJGE CCN(C[C@](C)(CI)OC[C@@H]1CCC1(C)C)C(=O)OC(C)(C)C 2243126528 JYEFIORPJBXXAG-KSSFIOAISA-N 439.378 4.890 50 10 IJGE COc1ccc([C@H](Cl)c2sncc2Br)cc1I 2248889749 PGJGGXMOEJHSEL-JTQLQIEISA-N 444.519 4.847 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1C(=O)c1c(Br)cccc1Br 2260390370 YQKFLDSKPYIPAM-GZMMTYOYSA-N 439.973 4.600 50 10 IJGE O=C(c1scc(Br)c1Cl)N1[C@H](CBr)C[C@H]2CCC[C@H]21 2264505428 YSOIHRJSRJQHKC-KHQFGBGNSA-N 427.589 4.942 50 10 IJGE CCOC(=O)c1cccc(-c2ccc(C=C(C#N)c3c(C#N)c(=N)[nH]n3-c3ccccc3)o2)c1 2297377746 VMVATMIGMSJVBH-UHFFFAOYSA-N 449.470 4.657 50 10 IJGE CC(C)[C@H](CCl)CNCc1ccc(I)c(Br)c1 2306220091 TWQFZKLHVYROSL-LLVKDONJSA-N 430.555 4.654 50 10 IJGE Clc1ccc(I)cc1CN[C@H](CBr)CC1CC1 2307328087 JGNYQNITPUKCNP-LBPRGKRZSA-N 428.539 4.598 50 10 IJGE N#CC(=CN1CCN(c2cccc(Cl)c2)CC1)C(=O)Nc1ccc(Cl)c(Cl)c1 2324268934 GGENQTXJYVXKNU-UHFFFAOYSA-N 435.742 4.815 50 10 IJGE COc1cc(F)c(Br)cc1[C@H](Cl)c1c(Br)nc(C)n1C 2362484178 YHSHROJKDLGMJV-NSHDSACASA-N 426.511 4.729 50 10 IJGE COc1ccc(COc2ccc(/C=N/NC(=O)CCCNc3ccc(Cl)cc3)o2)cc1 20291477 DPXUGLHLJFXTEA-CVKSISIWSA-N 441.915 4.863 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)cc2/C=C(/C#N)C(=O)NCc2ccco2)c(C)c1 33557999 OAIOADBELAZXSG-RGEXLXHISA-N 438.487 4.673 50 10 IJGE CCc1ccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2[N+](=O)[O-])cc1 40587349 GTCWCKUNNFNCMN-UHFFFAOYSA-N 447.282 4.755 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)N(c2ccc(C)cc2)S(=O)(=O)c2ccc(C)cc2)cc1 40971377 FMVQHJBQLHELDJ-LTGZKZEYSA-N 446.528 4.641 50 10 IJGE O=C(N/N=C/c1ccccc1)c1ccc(-c2ccc(C(=O)N/N=C/c3ccccc3)cc2)cc1 59475099 SGUAHSVZGWIRNV-CZYCKNNWSA-N 446.510 4.881 50 10 IJGE ClC[C@H](OCc1ccc(Br)cc1)[C@@H](I)CCl 158539987 ARSJONRFLKEQKM-QWRGUYRKSA-N 437.930 4.616 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2ccc3nc(N)sc3c2)ccc1OCc1ccccc1 169916688 BQCVNEJCKHENBA-WGARJPEWSA-N 446.532 4.620 50 10 IJGE CCc1ccc(N(C(=O)/C(C#N)=C\c2ccccc2OC)S(=O)(=O)c2ccccc2)cc1 207132761 GFQCMPPULIHCBT-FXBPSFAMSA-N 446.528 4.587 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CBr)[C@H](c2ccc(O)c(Br)c2)C1 382703217 DJVFIPJSKKFZPK-RYUDHWBXSA-N 435.156 4.500 50 10 IJGE CC[C@H](O[C@@](C)(CI)CNC(=O)OC(C)(C)C)c1ccccc1 403282397 OTEQQTXAEBYROY-YJBOKZPZSA-N 433.330 4.873 50 10 IJGE CCOc1ccc(/C=C(\C#N)C(=O)N2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1 726536925 IWNMZEVJNAZBCB-XAJRUKRBSA-N 446.482 4.588 50 10 IJGE COc1cc(OC)cc(C(=O)Oc2ccc(/C=C(/C#N)C(=O)c3ccoc3C)cc2OC)c1 744858701 ARIPPXVEAYGNMK-NVMNQCDNSA-N 447.443 4.623 50 10 IJGE CN(C(=O)CSc1ccccc1C(=O)NNc1cccc(F)c1F)C1CCCCC1 748795882 FIAIXRUSJKFSPC-UHFFFAOYSA-N 433.524 4.605 50 10 IJGE CC(=O)N1CCc2c(NC(=O)/C(C#N)=C/c3cc(C)n(-c4ccc(C)cc4)c3C)cccc21 1524080451 YIRGPFKZKMBATE-PXLXIMEGSA-N 438.531 4.857 50 10 IJGE C=C(Cl)C[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccccc2C)c1C)C(=O)OCC 1535344764 HYWQKEYALNJOIT-MSTPFNHUSA-N 439.943 4.500 50 10 IJGE C=CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1cc(Cl)ccc1Br 1558283847 VZIOYTOHTYFCJS-CQSZACIVSA-N 446.773 4.795 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNc1cc(C#N)ccc1Br 1632433629 ZKBHIYVZSNJQMU-UHFFFAOYSA-N 440.219 4.661 50 10 IJGE Cc1c(C(=O)N(C)Cc2ccccc2)oc2c1C(=NNC(=O)c1ccccc1Cl)CCC2 1772743528 BBZQHWZEGXOZAI-UHFFFAOYSA-N 449.938 4.984 50 10 IJGE Cc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2cccc(F)c2)c1 1865711370 WMTKXPHSPTYDNA-KRWDZBQOSA-N 428.389 4.616 50 10 IJGE N#C/C(=C(/O)[C@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 1872747295 WJOXIXHZMPHCSZ-UBZKEQBWSA-N 446.488 4.560 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1cc(Br)sn1 1909914015 BBJFPNDXHBCCAJ-AWEZNQCLSA-N 446.208 4.968 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1Cl 1914639254 RWIZKFOLFHUSKV-LBPRGKRZSA-N 437.186 4.968 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1ncsc1Br 1915771573 OPJNPJAYCIAFNZ-UHFFFAOYSA-N 432.181 4.722 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]3(CC[C@H]21)CC[C@](C)(CI)O3 1935707893 ZDRVODWGSNOAMI-DTDBQYNISA-N 435.346 4.539 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OCC[C@@]23CCC[C@H]2C3)C1 2011683787 ARRNLCHUGQTMJK-KFKAGJAMSA-N 449.373 4.788 50 10 IJGE CC1(C)OCCO[C@H]1[C@H](Br)c1cc(Br)c(Br)s1 2013745499 VHCSCDQSYQAIHJ-BDAKNGLRSA-N 449.002 4.903 50 10 IJGE C[C@H](C[S@@](C)(=O)=NCC1(CBr)CCCCCC1)NC(=O)OC(C)(C)C 2044699433 KYXIOESLMPKTQO-SGANQWHYSA-N 439.460 4.733 50 10 IJGE CC[C@@H](Br)[C@@H]1CCCCN1C(=O)c1sccc1I 2051079128 PEQWLVNKSZKRSZ-KOLCDFICSA-N 442.160 4.521 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@H](C)CN(C)Cc1ccccc1 2096784722 LVZMIZTXOZUXRS-CQSZACIVSA-N 435.797 4.977 50 10 IJGE C[C@H]1CN(C(=O)OC(C)(C)C)C(C)(C)CN1C[C@H](CBr)c1ccccc1 2133658256 XADKHKYSHNCOBI-WMZOPIPTSA-N 425.411 4.885 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC2(CCC2)N(C(=O)c2ccc(CBr)cc2)C1 2193440263 RFZHCSWGVZRETL-QGZVFWFLSA-N 437.378 4.634 50 10 IJGE COc1cc(Cl)c([C@H](Br)[C@]23COC[C@H]2C3(F)F)cc1Br 2202364175 GSUBOJBUGZUWIJ-WOPDTQHZSA-N 432.486 4.829 50 10 IJGE Cc1cccc([C@@H](CBr)OCCOCCOCCOCc2ccccc2)c1 2236089115 PCQXYAUBKJMSLN-JOCHJYFZSA-N 437.374 4.698 50 10 IJGE C[C@@H]1CC[C@H](CO[C@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)C1 2243469987 PBBHPHLAYYWSPP-VKJFTORMSA-N 437.362 4.644 50 10 IJGE CCn1c(SCC(=O)NN=C(C)C=Cc2ccccc2)nnc1-c1ccc(Cl)cc1 2297109529 CFFMAYJJRRCNMH-UHFFFAOYSA-N 439.972 4.916 50 10 IJGE Br[C@@H]1CCC[C@H]2CC[C@H]1N2Cc1sccc1I 2301069602 YPYLZKAMQIECMQ-HOSYDEDBSA-N 426.161 4.633 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H]2C[C@H]3CBr)c(I)c1 2318541320 SQECZVSKQWJOEB-SUHUHFCYSA-N 440.550 4.692 50 10 IJGE COc1ccc(C(C#N)=Cc2ccc(OC(=O)c3ccc([N+](=O)[O-])cc3)cc2)cc1OC 2320506219 FAFBGXAFFIRUID-UHFFFAOYSA-N 430.416 4.895 50 10 IJGE CC(C)(C)c1cc(C=NNC(=O)Cc2ccc3[nH]c(=N)sc3c2)cc(C(C)(C)C)c1O 2323602260 ULNVWVBULCMXNJ-UHFFFAOYSA-N 438.597 4.702 50 10 IJGE O=C(NN=Cc1c(Cl)ccc(Cl)c1Cl)c1cc(-c2ccc(F)cc2)nc(O)n1 2323702269 HEVGEVCHAXIWTP-UHFFFAOYSA-N 439.661 4.712 50 10 IJGE C[C@H]1CCN(Cc2cc(I)ccc2Cl)C[C@H]1CBr 2327398418 DIVZJEZNVMTGFX-CMPLNLGQSA-N 442.566 4.798 50 10 IJGE N#CC(=C(O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2ccc(F)c(F)c2)cs1 2331351906 LLVFXWQXWDQFFD-MRXNPFEDSA-N 437.471 4.930 50 10 IJGE CC1(C)COC[C@H]1CO[C@H](CI)c1ccc(Br)cc1 2339010393 KUVFVPAQSBPECK-GXTWGEPZSA-N 439.131 4.614 50 10 IJGE Clc1cc(Br)c(CN2C[C@H](Br)C[C@@]3(CCCO3)C2)s1 2345957450 BNBFCSZMPALHOH-RNCFNFMXSA-N 429.605 4.682 50 10 IJGE Cc1ccc(CCN(C(=O)CCl)[C@@H](C(=O)NC2CCCCC2)c2ccc(F)cc2)cc1 3037433 JPSLWRKUUWDOHU-XMMPIXPASA-N 444.978 4.934 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccc(Cl)cc4)ccc32)cc1 38650409 CKVSXGUIFXUTKZ-XMMPIXPASA-N 446.890 4.715 50 10 IJGE Nc1c(NNC(=O)c2cccc(Cl)c2)ncnc1NC(c1ccccc1)c1ccccc1 40783666 YSJVRADGGABQPG-UHFFFAOYSA-N 444.926 4.671 50 10 IJGE CCN(C(=O)c1oc2c(c1C)/C(=N/NC(=O)Cc1ccccc1)CCC2)c1ccccc1 40815860 FUQLJNREJZTALZ-SZXQPVLSSA-N 429.520 4.654 50 10 IJGE CCCCOC(=O)c1ccccc1N/C=C(/C#N)C(=O)N1CCC(Cc2ccccc2)CC1 216876260 OWYCYVWCJFRNND-ATJXCDBQSA-N 445.563 4.944 50 10 IJGE Cc1cc(Br)c(S(=O)(=O)N[C@@H](C)CCCCCl)cc1Br 398502095 ZBOMVBUIIGGLRU-JTQLQIEISA-N 447.620 4.596 50 10 IJGE O=C1COc2ccc([C@@H](Cl)c3scc(Br)c3Br)cc2N1 705448782 WUWURXTUTMGJJR-GFCCVEGCSA-N 437.540 4.932 50 10 IJGE C[C@@]1(CBr)CCN(C(=O)c2scc(Br)c2Br)C1 705493651 VJTRMNGNQLJMHO-NSHDSACASA-N 446.002 4.520 50 10 IJGE CN(C[C@@H]1CCCN(Cc2ccccc2)C1)c1cc(CBr)sc1[N+](=O)[O-] 720017454 WAVQCURJDXMAKI-INIZCTEOSA-N 438.391 4.900 50 10 IJGE CC(=O)N(c1ccc(C)c(C)c1)c1nc(C=NNC(=O)CCCc2cccs2)cs1 732529149 AYOKEQRQMVBJJC-UHFFFAOYSA-N 440.594 4.979 50 10 IJGE O=C(NNc1ccc(OCC(F)(F)F)cc1)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 748694032 HWVGFBBHDRFYRC-GJZGRUSLSA-N 434.336 4.773 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(F)cc2-c2nc(C3CC3)no2)c(C(F)(F)F)c1 799404499 XHYBAZWIQWVUKZ-UHFFFAOYSA-N 446.364 4.792 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2nccc(C(F)F)n2)c(C)n1-c1ccc(Cl)cc1 809291507 AEMPEFZZMUHIRS-MHWRWJLKSA-N 441.869 4.699 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N2CCCc3ccnc(O)c32)c(C)n1-c1cccc(Cl)c1 1130974210 XKNNFYYXLAJLOD-XDHOZWIPSA-N 432.911 4.735 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(-c3ccccc3)cc2)cc1 1858081894 OHMZOOFPUHAWHX-UHFFFAOYSA-N 431.492 4.775 50 10 IJGE CCCc1nn(-c2ccc(Cl)cc2)c2c1[C@@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865712910 LJGCGGUYAFKEJX-IBGZPJMESA-N 435.871 4.605 50 10 IJGE Cc1nc(Nc2ccc(SC#N)cc2)cc(N2CC[C@@H](c3ccc4c(c3)OCO4)C2)n1 1868479799 BGYWGDMPTQWFNS-QGZVFWFLSA-N 431.521 4.824 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN1Cc1c(Br)cccc1Br 1950540223 YYQOBJIWVGDHDX-ZJUUUORDSA-N 425.990 4.817 50 10 IJGE CC(C)[C@H](Br)CN(C)C(=O)c1cc(Br)c(Br)s1 2002410106 GHUZQMKBBXCWNU-MRVPVSSYSA-N 448.018 4.765 50 10 IJGE Fc1ccc(-n2nc(CBr)c(Br)c2C(F)(F)F)c(F)c1F 2079233419 VJRXZRVFEKYVBI-UHFFFAOYSA-N 437.963 4.966 50 10 IJGE Clc1cc(CN2CC[C@@H](Br)CC23CC3)ccc1I 2086661152 KUGXTFFVHBRHOM-LLVKDONJSA-N 440.550 4.837 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CCCN(C[C@@H](CBr)C3CCC3)C2)C1 2106784708 KPPHQYQFAOHADQ-NQIIRXRSSA-N 429.443 4.911 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C(F)(F)F)CCCN1CC1(CBr)CCCC1 2106787191 HSIQWNUNCUNBED-KRWDZBQOSA-N 443.348 4.863 50 10 IJGE O=C(NC[C@@H]1C[C@H](Cl)C12CCC2)c1csc(Br)c1Br 2115610678 SWZAYIXUPGJXRB-CBAPKCEASA-N 427.589 4.801 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)CC[C@H](NC(=O)OC(C)(C)C)c1ccccc1 2196913159 CCAJYZDLZACCLV-SZMVWBNQSA-N 439.394 4.665 50 10 IJGE CN[C@H](c1cc(Br)c(Br)cc1F)[C@H]1C[C@@H](Br)C1 2213490343 QSDACTGOASFQRX-KJNMHVQDSA-N 429.953 4.785 50 10 IJGE Cc1ccc(C(=O)N2C[C@@H](Br)CC23CCCC3)cc1I 2241039990 NXAQIBPGPPRVEI-ZDUSSCGKSA-N 448.142 4.522 50 10 IJGE CCn1nc(C)c(CBr)c1N1[C@H]2CCC[C@H]1CN(Cc1ccccc1)CC2 2281295051 AZRYDVIOGNJCIW-PMACEKPBSA-N 431.422 4.740 50 10 IJGE CC(C)(CCl)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(I)c1 2283662819 KSERXCUJASZHBN-ZDUSSCGKSA-N 426.125 4.814 50 10 IJGE CCCCN1C(=O)C(=CNc2cc(Cl)ccc2Cl)C(=O)N(CCCCl)C1=O 2297454766 MMWZKSNQBSTLTG-UHFFFAOYSA-N 432.735 4.509 50 10 IJGE CCC[C@H](Cl)CCNCc1ccc(I)c(Br)c1 2306221563 JNLIXVMHCCRSEX-NSHDSACASA-N 430.555 4.941 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C2CCC3(CC2)CC[C@H](CI)O3)C1 2307683655 NJULSESTESUHLM-YJTLQXIOSA-N 449.373 4.786 50 10 IJGE CC(C)N1C[C@@H](Br)[C@H](Cc2ccc(Cl)c(I)c2)C1 2315549982 YEQNCKFFDKMCRI-VXGBXAGGSA-N 442.566 4.591 50 10 IJGE CC1(C)COC[C@@]1(CBr)Cc1ccc(Cl)c(I)c1 2315556004 XMMAJBNKCBEFBJ-AWEZNQCLSA-N 443.550 4.925 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1I)C(C)(C)CCBr 2317776340 VRRUMVUGMUNWSP-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE N#CC(=CNCc1ccccc1Br)C(=O)NC(c1ccccc1)c1ccccc1 2324837671 RUYWOPLQWKTCBM-UHFFFAOYSA-N 446.348 4.852 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)N/N=C/c3cccc([N+](=O)[O-])c3)cc2)cc1 12491706 NXPMPABPJUFIEP-WGOQTCKBSA-N 444.491 4.909 50 10 IJGE N#C/C(=C\c1ccc(-c2ccc(C(=O)O)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 35518486 YFUBOQHAZQTEPI-NTEUORMPSA-N 437.795 4.752 50 10 IJGE Brc1cccc([C@H](CI)OC[C@H]2CCCCO2)c1 161965899 IOYSQNLTBJJTES-KGLIPLIRSA-N 425.104 4.511 50 10 IJGE CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNc1cccc2cnccc12 749291869 MSPMAIRVVMKYFJ-FQEVSTJZSA-N 445.350 4.829 50 10 IJGE O=C(NNc1cccc(F)c1F)C(=O)Nc1ccc(Sc2ccccc2Cl)cc1 785014569 UCBVLTDVHLDABN-UHFFFAOYSA-N 433.867 4.851 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cccc3cccc(Br)c23)c1C 806888753 SLYILCMBMJJJCB-UHFFFAOYSA-N 448.324 4.828 50 10 IJGE Cc1cccc(NC(=O)C(=O)NN=Cc2ccc(OCc3ccccc3Cl)cc2)c1C 1083853532 HNLSLPIRSALYDO-UHFFFAOYSA-N 435.911 4.625 50 10 IJGE CC(=NNC(=O)c1ccc(Br)cc1)c1cccc(NC(=O)c2ccccc2)c1 1084319436 SFFUNSVSEOMOCO-UHFFFAOYSA-N 436.309 4.855 50 10 IJGE C=C[C@@](C)(CCOC)C(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 1587236022 JULDGZRXPQZHPA-QFIPXVFZSA-N 432.973 4.622 50 10 IJGE C=CCn1c(SCC(=O)NNc2ccc(SC)cc2)nnc1-c1ccc(Cl)cc1 1624457572 HJXJBIDTWIAURP-UHFFFAOYSA-N 446.001 4.742 50 10 IJGE C#C[C@@H](NC(=O)NNc1c(F)cc(F)cc1Br)c1ccc(Cl)cc1F 1683516632 FNJQWCNDHGJGHB-CQSZACIVSA-N 432.627 4.520 50 10 IJGE Cc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 1865682336 MHFPFFLRNMYRQL-GOSISDBHSA-N 429.282 4.904 50 10 IJGE CCOc1ccc(/C=C/C(=O)Nc2sc(/C(C)=C/C#N)c(C)c2C(=O)OC)cc1OC 1873426998 ALVHSQVRHHEMDD-BOTKGMRRSA-N 440.521 4.829 50 10 IJGE CCN(C[C@@](C)(CI)OC[C@@H]1CC12CCC2)C(=O)OC(C)(C)C 1902102930 VIWAXXIPARWFSE-WMLDXEAASA-N 437.362 4.644 50 10 IJGE Brc1cnc(N2[C@H]3CCC[C@H]2CC(Br)C3)c(Br)c1 1922796575 BHKMJPMCMFJJBB-QWRGUYRKSA-N 438.989 4.891 50 10 IJGE O=C(N[C@H](CCBr)C1CC1)c1cc(Br)c(Br)s1 1942802660 FGYGTJBASKCOPN-MRVPVSSYSA-N 446.002 4.567 50 10 IJGE CC[C@H](Br)CCNC(=O)c1cccc(Br)c1Br 1943886876 LDSCAOBIRGHMGT-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@]1(CC[C@](C)(CI)O1)C2 1949547700 KWEFGRWYZOHEJZ-IEBWSBKVSA-N 449.373 4.931 50 10 IJGE CCN(C[C@](C)(CI)OC[C@H]1C[C@H]1C(C)C)C(=O)OC(C)(C)C 1993100342 GJOZYVZXWZYBPC-VKJFTORMSA-N 439.378 4.746 50 10 IJGE CO[C@@H](C)CCOc1c(Br)cc(CBr)cc1Br 2001105593 MTXZATPIXQIDOI-QMMMGPOBSA-N 430.962 4.910 50 10 IJGE C[C@H](CCCBr)CNCc1ccc(I)c(Cl)c1 2026568081 XXKQEKHHGNTVIV-SNVBAGLBSA-N 430.555 4.845 50 10 IJGE O=C(N[C@@H]1CC[C@H](CBr)C1)c1cc(Br)cc(Br)c1 2029536101 PFHSBETYXBWJTK-QPUJVOFHSA-N 439.973 4.505 50 10 IJGE CC[C@@H](C)N(CCBr)C(=O)c1cccc(Br)c1Br 2031484922 FDGSMOAXOWJJGC-SECBINFHSA-N 441.989 4.847 50 10 IJGE O=S1(=O)CCCC[C@@H]1[C@H](Br)c1cc(C2CC2)c(Br)s1 2094674347 UTZUKEVJJKCPFX-VXGBXAGGSA-N 428.211 4.791 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)N(C[C@H](CBr)c2ccccc2)C1 2106785847 COCZWBYJOVARRS-SCTDSRPQSA-N 425.411 4.742 50 10 IJGE CC(C)N(C[C@H]1CCCCN1C(=O)OC(C)(C)C)CC1(CBr)CCOCC1 2163057792 FETRQJPJNFUDQA-GOSISDBHSA-N 447.458 4.678 50 10 IJGE CO[C@H]1C[C@@H](Oc2c(Br)cc(CCl)cc2Br)C[C@H]1OC 2187172489 QPWGXOSFVRZWTC-YSCVYTRNSA-N 428.548 4.522 50 10 IJGE C[C@H](Cl)c1nc2cc(I)ccc2n1C[C@@]1(Cl)CC1(F)F 2205572246 KRGDUHVTYOEVOI-MADCSZMMSA-N 431.051 4.957 50 10 IJGE Cc1ccc(I)c(C(=O)N2[C@H]3CCC[C@H](Br)[C@H]2CC3)c1 2240903115 IOJVHFNXPXCYEU-CORIIIEPSA-N 448.142 4.520 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CCCCI 2248243023 YTQFHOMSGZVGDP-UHFFFAOYSA-N 444.357 4.679 50 10 IJGE CCCc1nc(Br)c(Br)n1CC1(CBr)CC(F)C1 2254445738 UOOXNXUYCVVSTG-UHFFFAOYSA-N 446.984 4.874 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@@H](Br)[C@@H]1[C@H]2COC[C@H]21 2259998710 GXHKSPZWQIISJB-BCDWUSSUSA-N 446.911 4.818 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC2(CCC2)C[C@H]1CBr 2264512138 AIAKWRDXNNZKNA-QMMMGPOBSA-N 427.589 4.944 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2COC3(CCC3)C2)cc1I 2269555810 YYYNGMQSNHUNCB-SMDDNHRTSA-N 437.115 4.695 50 10 IJGE C[C@H](Br)[C@@H]1CCCN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282978934 SSKTWNSABAYLIR-DTWKUNHWSA-N 427.539 4.877 50 10 IJGE C[C@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@]1(C)CBr 2285844976 UBHNSIGDSPXTST-RTHLEPHNSA-N 427.539 4.735 50 10 IJGE CCC[C@H]1CN(Cc2sccc2I)C[C@@H]1CBr 2301079533 VHEHPNYKURAWLC-QWRGUYRKSA-N 428.177 4.596 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(N)cc2)ccc1OCc1ccc(Cl)c(Cl)c1 2318415590 RHVPZXFKHBUUPC-UHFFFAOYSA-N 444.318 4.927 50 10 IJGE Clc1ccc(CN2CC[C@H]3C[C@]2(CBr)C3)c(I)c1 2318545586 KFDBIVWSWFZYSF-WJONMLJTSA-N 440.550 4.694 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NN=Cc1ccc2c(c1)OCCO2 2321242335 IKJYKPOWCMERDB-UHFFFAOYSA-N 442.302 4.899 50 10 IJGE COc1ccc([C@@H](C)NC(=O)C(C#N)=CN[C@H](C)c2ccc3c(c2)CCCC3)cc1OC 2325044962 OPCXVARRIOFILS-QZTJIDSGSA-N 433.552 4.518 50 10 IJGE COc1ccc(CCCC(=O)N[C@@H](CCBr)COCc2ccccc2)cc1 2369977666 FRYATMKZUPMIOR-FQEVSTJZSA-N 434.374 4.505 50 10 IJGE CC[C@@H](C)c1ccccc1OCC(=O)NNC(=O)c1ccc(OCc2ccccc2)cc1 14027812 BINHDCRWGKWYAL-LJQANCHMSA-N 432.520 4.619 50 10 IJGE CCCOc1ccccc1C(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1C(C)(C)C 14661789 YEPSPLASQQKCQB-UHFFFAOYSA-N 440.584 4.910 50 10 IJGE CCCCOc1ccc(/C=C2/C(=O)N(CCc3ccc(OC)cc3)C(=O)C(C#N)=C2C)cc1 38608624 VXZGUQSNIGSVIH-JJIBRWJFSA-N 444.531 4.709 50 10 IJGE O=S(=O)(N[C@@H]1CCCCC[C@@H]1Cl)c1c(Cl)cc(Br)cc1Cl 136223021 DJERWOMGBVSEJW-JOYOIKCWSA-N 435.598 4.974 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C\c2ccccc2OCCC)cc1 207161204 RWLMGFLGYFMJJD-YAQOHLEHSA-N 432.520 4.917 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@H]2C[C@@H](Cl)CC[C@H]2C1 398701152 LTRMSERPTBWTTI-YIZRAAEISA-N 427.589 4.753 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2ccc(-c3ccc(Cl)cc3)o2)cc1 725379833 GVAREHIOBZUPLO-OAQYLSRUSA-N 426.900 4.963 50 10 IJGE CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1 741660865 OYHLGEGUTPHENE-UHFFFAOYSA-N 429.948 4.697 50 10 IJGE C[C@H](Sc1ccc(Cl)cc1)C(=O)NN=Cc1ccc(OCC(=O)OC(C)(C)C)cc1 1084318545 BLRDLVGKBPAQIK-HNNXBMFYSA-N 448.972 4.691 50 10 IJGE O=C(NNc1nc(-c2ccc(Cl)cc2)no1)c1ccc(-c2cccc(Cl)c2)nc1O 1627963923 YZRIAKHFBSLQHR-UHFFFAOYSA-N 442.262 4.568 50 10 IJGE C=CCOc1ccc(Br)cc1NC(=O)NNc1ccc(Cl)c(OC)c1 1672209546 FQZIQSDMEOBZHS-UHFFFAOYSA-N 426.698 4.825 50 10 IJGE Cc1occc1C(=O)NN=C1CCCc2oc(C(=O)Nc3nc4ccccc4s3)c(C)c21 1772748081 AAZXSHXVXWGBEW-UHFFFAOYSA-N 448.504 4.822 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1cccc(Cl)c1 1865704581 ZEFWEQACVJWJRN-QFIPXVFZSA-N 434.927 4.900 50 10 IJGE C=CCn1c(C)c(C)c(S(=O)(=O)c2ccccc2)c1NC(=O)/C(C#N)=C/c1ccccc1 1873685403 PYPUGHVFYOCALZ-LTGZKZEYSA-N 445.544 4.669 50 10 IJGE C[C@@H](CC[C@@H](Br)CN1C(=O)c2ccccc2C1=O)COCc1ccccc1 1880124769 PWYQURSRFHFUTE-FUHWJXTLSA-N 430.342 4.679 50 10 IJGE COC[C@]1([C@@H](Br)c2sc(Br)cc2Br)CCCO1 1922895040 QRMSPUHBDBNJJX-QWRGUYRKSA-N 449.002 4.905 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]2(CCC13CCC3)CC[C@@](C)(CI)O2 1983725575 UVVBNXKTSQRTJD-WMZOPIPTSA-N 435.346 4.683 50 10 IJGE CC(C)N(C[C@H](C)Br)C(=O)c1cccc(Br)c1Br 2031477376 LCRVARFPIDKZAM-VIFPVBQESA-N 441.989 4.846 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CCCC[C@@H](Br)C1 2050108588 QUDOUJBGQKRHJL-SNVBAGLBSA-N 439.973 4.601 50 10 IJGE O=C(CCl)c1cc(OC(F)(F)F)c(I)cc1C(F)(F)F 2055164337 VCMVNQSZVKFCQS-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE C[C@@H]1CCCN(Cc2ccc(I)c(Cl)c2)[C@H]1CBr 2086661492 MXFIZDDQIBCFEB-YGRLFVJLSA-N 442.566 4.940 50 10 IJGE COc1cc([C@@H]2C(C#N)=C(N)Oc3cc4c(cc32)[C@H](C)CC(C)(C)N4C)cc(OC)c1OC 2087934204 ZAHNTKBQPBRGBI-FATZIPQQSA-N 449.551 4.653 50 10 IJGE O=S(=O)(C[C@H](Br)c1ccccc1OCc1ccccc1)N1CCCCC1 2089397412 GMTZKCIFOREUIH-IBGZPJMESA-N 438.387 4.517 50 10 IJGE C[C@@H](N(Cc1ccccc1)S(=O)(=O)N1CCC[C@H](CCBr)C1)C(C)(C)C 2123368099 BDDQILOQNQLOKJ-IEBWSBKVSA-N 445.467 4.665 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1CN(C(=O)c1ccc(CBr)cc1)C1CC1 2162912587 XNCAZIMFJMTESI-GOSISDBHSA-N 437.378 4.586 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)Cc1cc(Cl)cc(Cl)c1 2224038617 PRZPFPGEYFULDN-MRXNPFEDSA-N 445.184 4.975 50 10 IJGE CCC[C@H]1CN(C(=O)OC(C)(C)C)CCN1C[C@@H](CBr)c1ccccc1 2231938881 CSUBDXGYCVEYCY-MOPGFXCFSA-N 425.411 4.887 50 10 IJGE CCCOC1([C@H](Br)c2ccc(OC)c(I)c2)CC1 2257369257 LXCDUCPDKQSUIJ-CYBMUJFWSA-N 425.104 4.695 50 10 IJGE CC1CC(CBr)(CN2CC[C@@H](NC(=O)OC(C)(C)C)C[C@@H]2C(F)(F)F)C1 2266273874 OZSLEBLENAWSRQ-YXXKGXSTSA-N 443.348 4.718 50 10 IJGE CN(Cc1ccccc1I)C[C@H](CBr)c1ccccc1 2280348522 AJGCQYYROUHOHZ-INIZCTEOSA-N 444.154 4.902 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1OCc1ccccc1 2297551337 BHSBRZIRBATWAG-UHFFFAOYSA-N 429.432 4.728 50 10 IJGE O=C(COc1c(Cl)cc(Cl)cc1[N+](=O)[O-])NN=Cc1c(Cl)cccc1Cl 2297710748 ODNHFYBGEDVHGB-UHFFFAOYSA-N 437.066 4.738 50 10 IJGE CCN(C)C[C@H](Br)CCc1ccc(Cl)c(I)c1 2300236065 GIPQKEWTLPOMLK-LLVKDONJSA-N 430.555 4.592 50 10 IJGE CC(C)[C@@H](Br)CN(C)Cc1ccc(Cl)cc1I 2302325862 KVUNFHHWXNVWRE-LBPRGKRZSA-N 430.555 4.796 50 10 IJGE C[C@H](Cl)CCCN(C)C(=O)c1cc(Br)ccc1I 2314575493 NVQXHGBLCNYVHY-VIFPVBQESA-N 444.538 4.533 50 10 IJGE CCc1ccc(N2C(=O)[C@H](Cc3ccc(C(C)C)cc3)SC2=C(C#N)C(=O)NC)cc1 2314592917 DOKQAWUAZFGGMU-QFIPXVFZSA-N 433.577 4.545 50 10 IJGE FC(F)C(F)(F)CO[C@H](CI)c1ccccc1Br 2315878043 OXJBADYHWPJWAF-SECBINFHSA-N 441.000 4.842 50 10 IJGE COc1cc(C=C(C#N)c2nc(O)c3ccccc3n2)cc(OC)c1OCc1ccccc1 2318417654 BABUBDZBAFIYEZ-UHFFFAOYSA-N 439.471 4.996 50 10 IJGE CCN(CC)Cc1ccc(C=NNC(=O)c2ccc(-c3ccccc3OC)nc2C)cc1 2321251703 HGNVIRKVQCBUTI-UHFFFAOYSA-N 430.552 4.671 50 10 IJGE O=C(NN=Cc1cccc(OCc2ccc(Cl)cc2)c1)c1ccc2nc(S)[nH]c2c1 2323603177 WLSMUIXHJGHNRY-UHFFFAOYSA-N 436.924 4.848 50 10 IJGE COc1ccc2ccccc2c1C=NNC(=O)c1ccc2nc(-c3ccccc3O)[nH]c2c1 2323739839 TWHBQDUPEXBUIK-UHFFFAOYSA-N 436.471 4.861 50 10 IJGE COC[C@@H]1C[C@H](Cl)[C@H](Cc2ccc(I)c(Br)c2)C1 2325204650 QOKMUTWKFDTFCA-LOWVWBTDSA-N 443.550 4.876 50 10 IJGE N#CC(=CNc1ccc(Br)cn1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 2325385115 WJNPGQKDBKKKLW-UHFFFAOYSA-N 445.626 4.974 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)Cc3ccccc3)ccc21 38681887 FMPOCIPQMCIEBC-SANMLTNESA-N 440.499 4.842 50 10 IJGE CCOc1cc(/C=N\NC(=O)CC[C@H](O)c2ccccc2)ccc1OCc1cccc(C)c1 58887893 GMDRFAQCMYQOHP-LKSMXUKOSA-N 446.547 4.937 50 10 IJGE CC(C)Cc1ccc([C@H](C)C(=O)NNC(=O)COc2ccc(-c3ccccc3)cc2)cc1 66199336 ABIRAJFVCWRKNX-FQEVSTJZSA-N 430.548 4.882 50 10 IJGE O=C1NCCc2ccc([C@@H](Br)c3ccc(Br)cc3Cl)cc21 70545575 IBEZHLQHBJHFLS-OAHLLOKOSA-N 429.539 4.873 50 10 IJGE CC(C)(C)c1cc(/C=N\NC(=O)CCc2nc3ccccc3nc2O)cc(C(C)(C)C)c1O 169887090 APALTNQBSNISMN-DICXZTSXSA-N 448.567 4.719 50 10 IJGE Cc1ccccc1N/C=C(/C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 216486498 JNCULSUAIPTSSS-DAFNUICNSA-N 436.559 4.748 50 10 IJGE N#C/C(=C/NCc1ccc(Br)cc1)C(=O)Nc1cc(Cl)ccc1Cl 217136323 SXZQHAUXGSBXNU-BENRWUELSA-N 425.113 4.892 50 10 IJGE CCCC(=O)[C@@H](Br)Cc1cc(OC)c(Br)cc1Br 232906653 KVTHQJKOZSSNFJ-JTQLQIEISA-N 442.973 4.895 50 10 IJGE CCCCOc1ccc(Br)cc1C=NNC(=O)COc1cc(C)ccc1C 254520722 NXDSWVWQVSALNE-UHFFFAOYSA-N 433.346 4.774 50 10 IJGE CN(C[C@H]1CCCCN1Cc1ccccc1)c1ccc([N+](=O)[O-])c(CBr)c1 720017647 YWQIPZHMVCACAK-HXUWFJFHSA-N 432.362 4.981 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)N2CCn3c(C(C)C)nnc3[C@H]2C)c1C 784695466 FFGMWGGHHUCLHG-IDCRMVTHSA-N 442.567 4.628 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 784812388 HDIHPZDYBSGWIS-UHFFFAOYSA-N 435.789 4.631 50 10 IJGE COc1ccc(C(=O)NN=Cc2cccc(OCc3ccccc3)c2)cc1Br 1084237770 DRHQJRUTITXZTO-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE O=C(COc1ccc(C2CCCCC2)cc1)NN=Cc1cc(Br)ccc1O 1084547374 DQZXHBQLBDBEID-UHFFFAOYSA-N 431.330 4.732 50 10 IJGE BrC[C@H](CN1CCN(c2cccc(OCc3ccccc3)c2)CC1)C1CC1 1175769753 SWSVXTPERBVWSL-OAQYLSRUSA-N 429.402 4.809 50 10 IJGE C=CC[C@@]1(C(=O)Oc2ccc([N+](=O)[O-])c3ccccc23)CCCN1C(=O)OC(C)(C)C 1518799742 FQBIBYJVOGVTJH-QHCPKHFHSA-N 426.469 4.999 50 10 IJGE CC(=O)CCc1ccc(O[C@H](C)C(=O)NNc2c(Cl)cccc2Br)cc1 1651127052 OUXVBPBZTWYOGZ-CYBMUJFWSA-N 439.737 4.535 50 10 IJGE COc1ccc(OC)c([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc3ccccc23)c1 1865692111 JDFPEQLVEUMRCL-XMMPIXPASA-N 438.487 4.569 50 10 IJGE CCCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)cc1OC 1865695088 JMTQPQRXBAKFND-DEOSSOPVSA-N 444.535 4.977 50 10 IJGE I[C@@H]1CCCCCC[C@H]1OCCOCCOCc1ccccc1 1895483153 HBHBYWJSBNWFRC-RTBURBONSA-N 432.342 4.763 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1ccc(F)cc1Br 1915069961 QEXOABULYDZPJM-CQSZACIVSA-N 434.758 4.797 50 10 IJGE COc1cc(C(=O)N(Cc2ccccc2)C[C@@H](C)Br)ccc1Br 1989501477 LRCRKTHEMCZMRQ-CYBMUJFWSA-N 441.163 4.884 50 10 IJGE C[C@H]1C[C@H]1N(CCBr)Cc1cc(Br)ccc1Br 2006509097 YJFCYAMPMFPJRU-TVQRCGJNSA-N 425.990 4.817 50 10 IJGE Brc1cccc(CN2C[C@H]3C[C@H]2CC[C@H]3Br)c1Br 2031478459 RLBNWNRMUZBGSK-IJLUTSLNSA-N 438.001 4.959 50 10 IJGE C[C@@H](CBr)CCCNC(=O)c1cccc(Br)c1Br 2031487431 UKLWKWVOBIBYBQ-SECBINFHSA-N 441.989 4.753 50 10 IJGE CC(C)[C@@H](CBr)CN1CCCC[C@@H]1C(F)(F)CNC(=O)OC(C)(C)C 2065453373 RBCTZYXTTQPWKJ-LSDHHAIUSA-N 427.374 4.668 50 10 IJGE C[C@H](Br)c1ccccc1NS(=O)(=O)c1cscc1Br 2087628916 HXJPHCAQXNRJTN-QMMMGPOBSA-N 425.167 4.767 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1cc(C(F)(F)F)n(C)n1 2102479679 NZLKZMOFWORWNL-OAHLLOKOSA-N 432.284 4.501 50 10 IJGE O=C(c1cc(Br)sc1Br)N1[C@H]2CC[C@@H]1C[C@@H](CCl)C2 2128152839 YSRUPUNVEUPQNM-PSVAKVPMSA-N 427.589 4.895 50 10 IJGE Clc1ccccc1C(CBr)(CBr)C[C@@H]1COCCCO1 2154013022 PEEWHJFRCJFVBN-GFCCVEGCSA-N 426.576 4.563 50 10 IJGE CCc1nc(C(=O)NC[C@@H](CBr)CC(C)(C)C)c(Br)s1 2169492383 PGXUOHQGEMRRPE-SECBINFHSA-N 426.218 4.645 50 10 IJGE C[C@H](C1CCCC1)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2179786284 YKLZRZGZGJBYFT-SECBINFHSA-N 445.242 4.605 50 10 IJGE FC1(F)[C@@H]2[C@@H](O[C@H](CI)c3ccccc3Br)CC[C@H]21 2230421602 RWLXKDHHXQQTCH-MGAJPHDKSA-N 443.069 4.986 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC2(CBr)CCC1CC2 2264482092 JVXCIFZFWDTGSY-UHFFFAOYSA-N 427.589 4.944 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCCN(CC2(CBr)CC(F)C2)C1 2265638373 LXIOIPKYZBOOPH-YJBCQJRQSA-N 433.406 4.611 50 10 IJGE COc1cc(F)c(CBr)c(N2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)c1 2283544968 LGYOLISWBQSQKR-QZTJIDSGSA-N 433.365 4.688 50 10 IJGE CC1(C)C[C@@](C)(CCl)CN1C(=O)c1ccc(Cl)c(I)c1 2283651447 HBUJVLMETPPPGP-HNNXBMFYSA-N 426.125 4.814 50 10 IJGE CC(=NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1ccc(C(C)C)cc1 2297635196 BKFDJVZJSSBULH-UHFFFAOYSA-N 441.578 4.826 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NCc1ccc(Cl)c(I)c1 2300237526 ADNPBEPOLBXTAS-NOZJJQNGSA-N 430.555 4.844 50 10 IJGE C[C@H]1CCN(Cc2ccc(I)c(Br)c2)[C@H]1CCl 2306222257 ROJRWGWSFCUBMF-ZANVPECISA-N 428.539 4.503 50 10 IJGE FC1(F)CC[C@H]1CO[C@@H](CI)c1ccc(Br)cc1 2313734616 YKYCLKCTVCZGEU-JQWIXIFHSA-N 431.058 4.987 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc(-c3ccc(OC)cc3)nc2C)cc1OCC 2321218485 ZJZZAXJWQGZXLU-UHFFFAOYSA-N 433.508 4.627 50 10 IJGE Brc1cccc(CN2C[C@H]3CC[C@H]2[C@H](Br)C3)c1Br 2325467159 XQHVOBQQDORORJ-BIMULSAOSA-N 438.001 4.959 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3CC[C@H]2[C@H](Br)C3)c1 2325470280 UUCFPGSWDBAIOX-FZZIBODNSA-N 438.001 4.959 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H](Br)CC12CCC2 2327403386 BMHRWVVQGIBWIU-LLVKDONJSA-N 440.550 4.837 50 10 IJGE COc1ccc(OC)c(-c2csc(C(C#N)=C(O)c3cc4ccccc4oc3=O)n2)c1 2331326009 ONOYAYQFRSPAPL-UHFFFAOYSA-N 432.457 4.884 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccccc1C(F)(F)F 2343418054 KKDSHWGKSOBSGZ-HNNXBMFYSA-N 430.264 4.806 50 10 IJGE N#C/C(C(=O)Nc1ccccc1)=C1\S[C@@H](Cc2ccccc2)C(=O)N1c1ccc(F)cc1 1889073 WJVVHEGFWMXKEO-SCIJIFGBSA-N 443.503 4.891 50 10 IJGE COc1ccc([C@H](Br)c2csc(I)c2)cc1F 123463168 LOCKBRVJWAJWEY-LBPRGKRZSA-N 427.076 4.985 50 10 IJGE COc1ccc(Br)cc1CNCCCCCCI 234817120 RBFYYOOIYLBBJV-UHFFFAOYSA-N 426.136 4.543 50 10 IJGE ClCCc1nc2cc(I)ccc2n1Cc1ncc(Cl)s1 719410618 CGWWBRGQKBORLH-UHFFFAOYSA-N 438.121 4.580 50 10 IJGE O=C(NCC1(c2ccc(Cl)cc2)CCCCC1)NNC(=O)c1cccc2cccnc12 726260603 FLONSZHHADERPL-UHFFFAOYSA-N 436.943 4.734 50 10 IJGE Cc1nc(C)c(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)s1 751298206 JOVAQCFEABBWMI-MHWRWJLKSA-N 436.928 4.736 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OCc2ncc(-c3ccccc3)o2)c(-c2ccccc2)n1 761403287 RBGUNCGDLHBIDX-KGENOOAVSA-N 449.470 4.769 50 10 IJGE Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)NNC(=O)c1cccc2cccnc12 781682796 YHIDNHOJJMNLRS-UHFFFAOYSA-N 441.274 4.580 50 10 IJGE N#CCCn1cc(/C=C(/C#N)c2ncc(C(F)(F)F)cc2Cl)c(-c2ccncc2)n1 788349379 KDOFWYBBPHHWAI-ZSOIEALJSA-N 428.805 4.990 50 10 IJGE CCCNC(=O)c1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1Cl 799391173 XWQNEBIKQVCOBE-UHFFFAOYSA-N 439.825 4.519 50 10 IJGE O=C(CSCC(=O)Nc1ccccc1)NN=Cc1ccc2cc3ccccc3cc2c1 1084244022 KAZUPBNCEFLUEE-UHFFFAOYSA-N 427.529 4.815 50 10 IJGE Cc1ccccc1SCC(=O)NN=C1C(=O)N(C/C=C\c2ccccc2)c2ccccc21 1084573666 CUHQAGXZJPLLRX-MEDIROGLSA-N 441.556 4.668 50 10 IJGE C/C(=C/c1ccccn1)C(=O)NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1 1349064473 NPHNUNQDVZMLKT-VLGSPTGOSA-N 435.549 4.584 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2Cl)[C@H]1c1ccncc1 1865700574 XTVKVUYWOULJIM-NRFANRHFSA-N 439.906 4.865 50 10 IJGE Cn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(OC(=O)c2ccccc2)cc1 1865705019 KDIZXAHFBYRNGL-QFIPXVFZSA-N 448.482 4.524 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(Br)cc1O 1914609550 UVXGCABDHGOREW-LBPRGKRZSA-N 427.136 4.581 50 10 IJGE C[C@H]1CN(C(=O)c2csc(Br)c2Br)CC[C@@H]1Br 1945189439 QMQKPDOGNHQBPS-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE CN(c1ncc(Br)cc1Br)C1(CBr)CCCC1 2003899471 ILCRFMRXYGFVQG-UHFFFAOYSA-N 426.978 4.751 50 10 IJGE C[C@@]1(CCBr)CCN1C(=O)c1cc(Br)sc1Br 2025216527 PKDWVHJSLQWLFN-LLVKDONJSA-N 446.002 4.663 50 10 IJGE CC(C)[C@H](CCBr)NC(=O)c1cccc(Br)c1Br 2031486186 LUDCJLUYVJJDLV-NSHDSACASA-N 441.989 4.751 50 10 IJGE CC(C)C[C@H](Br)CNC(=O)c1cccc(Br)c1Br 2031487108 QLOKKJSIUMQVEF-VIFPVBQESA-N 441.989 4.751 50 10 IJGE CC(C)[C@@H](Br)[C@H](C)NC(=O)c1cc(Br)ccc1Br 2041309123 XTEDTRGZVKUGEN-QPUJVOFHSA-N 441.989 4.749 50 10 IJGE Brc1cccc(Br)c1CN1CC[C@H](Br)[C@@H]1C1CC1 2067014901 FENHIIRXWTXIOA-KBPBESRZSA-N 438.001 4.959 50 10 IJGE COc1cc(CBr)cc(Br)c1OC[C@H]1C[C@@H](Br)C1 2076259624 MEWHHROPUZWSTE-AOOOYVTPSA-N 442.973 4.905 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCN(C[C@H](Br)C(F)(F)F)c2ccccc21 2106782859 USZCNWMVQDUCHK-WFASDCNBSA-N 437.300 4.831 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CCC2(CC1)C[C@@H]2CBr 2115926955 DQMAGFPXLOPWPJ-MRVPVSSYSA-N 427.589 4.801 50 10 IJGE CCCN(C(C)(C)C)S(=O)(=O)c1cc(CBr)sc1Br 2123205787 OZXFVQQHWXNNRY-UHFFFAOYSA-N 433.231 4.605 50 10 IJGE CCCC(CBr)(CCC)CN1CCC(N(CCO)C(=O)OC(C)(C)C)CC1 2163059816 WVZDQPKZXHJKEP-UHFFFAOYSA-N 449.474 4.662 50 10 IJGE O=[N+]([O-])c1ccc(N2[C@H]3CCC[C@@H]2CN(Cc2ccccc2)C3)c(CBr)c1 2234690933 TYLQQKOZIHYPJM-BGYRXZFFSA-N 430.346 4.733 50 10 IJGE BrCC(CBr)(Cc1ncco1)c1cccc(Br)c1 2260809714 SYYOPZDLJXLGED-UHFFFAOYSA-N 437.957 4.707 50 10 IJGE COc1cc(Cl)c(CNCCSSCCNC(=O)OC(C)(C)C)cc1Cl 2266849101 AWTCOFYHRAECON-UHFFFAOYSA-N 441.446 4.998 50 10 IJGE CC(C)(C)OC(=O)NCCCCCCCCCC(=O)NCC1CC(Br)C1 2269422928 LOSCUGGNXLWLCH-UHFFFAOYSA-N 433.431 4.922 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CC23CCOCC3)cc1I 2269540751 HFFIXRUVMIOMLI-RISCZKNCSA-N 437.115 4.553 50 10 IJGE CC1CC(CBr)(CNC(=O)c2cc(F)c(Br)cc2Cl)C1 2282968963 YLSQRCMYUUTBNI-UHFFFAOYSA-N 427.539 4.783 50 10 IJGE C[C@@H](Br)CN(CCC(C)(C)C)S(=O)(=O)c1cc(Br)cs1 2288050478 WTQHVBDNOAVWNB-SNVBAGLBSA-N 447.258 4.721 50 10 IJGE N#CC(=Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1 2296700255 QKTDFUUSNRRRLD-UHFFFAOYSA-N 449.470 4.671 50 10 IJGE CN(Cc1sccc1I)C[C@H](Br)C1CCCC1 2301071429 NDOMLWLDCLWCHZ-NSHDSACASA-N 428.177 4.738 50 10 IJGE CC1(C)CN(Cc2sccc2I)C[C@@H]1CCBr 2301071451 NIQRHWPSVNPHQH-JTQLQIEISA-N 428.177 4.596 50 10 IJGE Cc1cc(C)cc(-n2c(C)cc(C=C(C#N)C(=O)N3CCN(c4ccccc4)CC3)c2C)c1 2313545748 CFIPVXKJRKZFAH-UHFFFAOYSA-N 438.575 4.967 50 10 IJGE C[C@@H]1CCCN(Cc2ccc(Cl)cc2I)[C@@H]1CBr 2318529891 WFQLNXRNJQCLIR-QMTHXVAHSA-N 442.566 4.940 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)NN=Cc1ccc(Br)cc1 2321242861 FKKBQDRANQGGJD-UHFFFAOYSA-N 430.252 4.862 50 10 IJGE CC(C)[C@H]1C[C@@H](Br)CN1Cc1ccc(I)c(Cl)c1 2321367405 DMBRTMZCTWZEEY-BXUZGUMPSA-N 442.566 4.938 50 10 IJGE CCc1nnsc1COc1c(Br)cc(CCl)cc1Br 2335910429 UTLVKICVBDNWQM-UHFFFAOYSA-N 426.561 4.943 50 10 IJGE Cc1ccc(I)c(C(=O)Nc2ccc(CBr)c(F)c2)c1 2367679122 XBLNMQNTPADRIK-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE C=CCOc1ccc(Br)c(C=NNC(=O)COc2ccc(CCCC)cc2)c1 2098289 QCOHNQBFFLSIIU-UHFFFAOYSA-N 445.357 4.886 50 10 IJGE CC[C@H](C)c1ccccc1OCC(=O)NNC(=O)[C@H](C)Oc1ccc(-c2ccccc2)cc1 14038555 HFGTTWQNFRFWAZ-PMACEKPBSA-N 446.547 4.861 50 10 IJGE CCOC(=O)/C(C#N)=C1/S[C@H](Cc2ccccc2Cl)C(=O)N1c1ccc(C)cc1 33729343 ZSSVYGAVFFLVSW-OXMAITBSSA-N 426.925 4.638 50 10 IJGE CC1CCC(NC(=O)[C@H](c2ccc(F)cc2)N(Cc2cccs2)C(=O)CCl)CC1 97914704 MUEYXYDVYZVOHF-RVAKQSJFSA-N 436.980 4.891 50 10 IJGE CCOc1cc(/C=N\NC(=O)Cc2ccc(O)cc2)ccc1OCc1cccc(Cl)c1 169901411 ZZECLTGKALOEAR-YSMPRRRNSA-N 438.911 4.716 50 10 IJGE O=C(Cc1csc(Nc2cccc(C(F)(F)F)c2)n1)NN=Cc1cccc([N+](=O)[O-])c1 263632056 JMXZTXJMMRDJPX-UHFFFAOYSA-N 449.414 4.507 50 10 IJGE Clc1ccc([C@@H](Br)c2cc(I)cc3c2OCC3)o1 302477254 GYEDZLYPXHXBOD-LBPRGKRZSA-N 439.474 4.957 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N1CCCC[C@@H]1C[C@H](C)Br 312939719 HPDCDBCEPDGCFL-GXSJLCMTSA-N 445.242 4.536 50 10 IJGE ClCCc1nc2ccc(Br)cc2n1C1[C@@H]2CN(Cc3ccccc3)C[C@@H]12 398447873 MFRNJAKMRYCCIP-IAGOWNOFSA-N 430.777 4.883 50 10 IJGE Cc1ccc([N+](=O)[O-])c([C@@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)c1 725405154 HOJNCBDLQGGCPZ-FUHWJXTLSA-N 433.302 4.650 50 10 IJGE O=C(O)c1ccc(COc2ccccc2C=NNC(=O)c2cc(F)c(F)cc2Cl)cc1 1084089231 LVXGMJJXBNXQHU-UHFFFAOYSA-N 444.821 4.659 50 10 IJGE O=C(NN=C1C(=O)N(Cc2c(Cl)cccc2Cl)c2ccccc21)c1cccc(F)c1 1084545890 PTXYZERMDCWBLG-UHFFFAOYSA-N 442.277 4.813 50 10 IJGE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)c1ccc(Cl)cc1Cl 1440355471 PEPYUYNLEIOHTF-CSKARUKUSA-N 433.213 4.757 50 10 IJGE CCCC[C@H](NC(=O)CCc1c[nH]c2ccccc12)C(=O)Nc1ccc(SC#N)cc1 1866573363 OGBMBSWQRZDYFR-QFIPXVFZSA-N 434.565 4.987 50 10 IJGE N#C[C@H]1CN(c2ccc(Br)cc2CBr)CCN1Cc1ccccc1 1914890975 KHJCSSGPHMUONC-SFHVURJKSA-N 449.190 4.558 50 10 IJGE O=C(N[C@H]1CC[C@@H](CBr)C1)c1cc(Br)c(Br)s1 1942368286 QVEOXVSVVDYRSD-RQJHMYQMSA-N 446.002 4.567 50 10 IJGE C[C@H](CCCBr)NC(=O)c1c(Br)cccc1Br 1945333314 OFVVQWONPAQBHV-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H]3CC[C@@H](Br)[C@H]3C2)c1 2027640886 BYPGQTGSLFPVAN-TVYUQYBPSA-N 440.550 4.550 50 10 IJGE O=C(NCC1(CBr)CCC1)c1cccc(Br)c1Br 2031479021 VFGUSSXOHNUBOE-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE CC(C)N(CCCBr)C(=O)c1cccc(Br)c1Br 2031487796 YOMZCDOEIRMZEI-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE Brc1cccc(Br)c1CN1C[C@@H]2CC[C@H](Br)[C@H]2C1 2033086014 HQIVPTFJPBEFGY-BHDSKKPTSA-N 438.001 4.817 50 10 IJGE CCOc1ccc(C(F)(F)F)cc1-n1nc(CBr)c(N)c1C(F)(F)F 2079226739 UQBBNITZMIMSGW-UHFFFAOYSA-N 432.162 4.786 50 10 IJGE CN(C[C@@H](Br)CCc1ccc(I)c(Cl)c1)C1CC1 2086650219 XUORMMOODASJGW-NSHDSACASA-N 442.566 4.735 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1c(Br)sc(C)c1C 2101004782 YFEMPUJIYNHSKM-JTQLQIEISA-N 429.243 4.764 50 10 IJGE Cc1ccc(Br)cc1C(=O)N[C@@H](C)CCCCCI 2117894153 KCYJELQHWMSKQZ-LBPRGKRZSA-N 438.147 4.871 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)[C@H](Br)C2CCCC2)CC12CCC2 2176868237 JYILDGBPOCOWTF-DOTOQJQBSA-N 443.426 4.626 50 10 IJGE Cc1cc(C(=O)NC[C@]2(CBr)C[C@@H]2C(F)(F)F)sc1Br 2192584292 XCUJDRPXMQVMEO-GZMMTYOYSA-N 435.103 4.512 50 10 IJGE Cc1cc(Br)c(C)c([C@@H](Cl)[C@H]2CCCS(=O)(=O)C2)c1Br 2201071227 QBJJJFBLYXVJGS-HZMBPMFUSA-N 444.616 4.933 50 10 IJGE COc1ccc([C@H](Br)C[C@H]2CO[C@@H](C)C2)cc1I 2257353250 GMBLPQKBMJACSU-JBLDHEPKSA-N 425.104 4.551 50 10 IJGE Cc1cc(C(=O)N(C[C@@H](C)Br)C(C)(C)C)ccc1I 2272450896 HYPCKUYRVRXOLF-LLVKDONJSA-N 438.147 4.624 50 10 IJGE CC1(C)CN(C(=O)c2cc(F)c(Br)cc2Cl)CC[C@@H]1Br 2282983897 UCWOBPQQAIQLRA-LBPRGKRZSA-N 427.539 4.877 50 10 IJGE C[C@@H]1CCC[C@](CCl)(NC(=O)c2ccc(Cl)c(I)c2)C1 2283655787 KEQAUOHKWRBKKP-BMIGLBTASA-N 426.125 4.862 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@@H](Br)C12CCC2 2285846258 LUCSRUDNQPPOCZ-GFCCVEGCSA-N 425.523 4.774 50 10 IJGE CCO[C@]1(COc2c(Br)cc(Cl)cc2CBr)CCOC1 2287071062 RZFFZNWEWMURGA-CQSZACIVSA-N 428.548 4.572 50 10 IJGE Cc1ccc(CBr)cc1NS(=O)(=O)Cc1ccsc1Br 2296212154 VHDJNUDJSDDIOT-UHFFFAOYSA-N 439.194 4.656 50 10 IJGE CC(C=NNC(=O)c1ccn(Cc2ccc([N+](=O)[O-])cc2)n1)=Cc1ccc(C(C)C)cc1 2297504616 WQHJGMTXJRPERK-UHFFFAOYSA-N 431.496 4.782 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1Cc1ccc(Cl)c(I)c1 2300236691 OJYYZBVFAARIMT-ZANVPECISA-N 428.539 4.692 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)Nc2ccccc2)ccc1OC(=O)c1ccc(OC)cc1 2313630279 CZVOCSFQMIQOHN-UHFFFAOYSA-N 442.471 4.859 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 2314572142 UJQQJEJKDIUYFB-UHFFFAOYSA-N 431.404 4.577 50 10 IJGE C[C@@H]1C[C@H](Br)CCN(Cc2ccc(Cl)c(I)c2)C1 2315554280 CXLJDMYORJXLFQ-ZYHUDNBSSA-N 442.566 4.940 50 10 IJGE N#CC(=Cc1ccc(Br)cc1)C(=O)Nc1ccccc1C(=O)NC1CCCC1 2329662921 PDSHAQLAIGWTFV-UHFFFAOYSA-N 438.325 4.667 50 10 IJGE CCOC(=O)c1cnn(-c2ccc3ccccc3n2)c1NC(C=O)=Cc1ccccc1C 2329811817 YJRLGPVBTANFOM-UHFFFAOYSA-N 426.476 4.558 50 10 IJGE CC1(C)CCN(C(=O)c2ccc(Cl)cc2I)C[C@@H]1CCl 2365597926 LSFHUNPJXIBRFM-JTQLQIEISA-N 426.125 4.672 50 10 IJGE O=C(Cc1ccc(C(F)(F)F)cc1)N[C@@H](CCBr)COCc1ccccc1 2369432643 FSQVZYRWFHNABA-SFHVURJKSA-N 444.291 4.735 50 10 IJGE CC(C)c1ccc(OCC(=O)N/N=C/c2c(O)ccc3ccccc23)c(Br)c1 12580081 GYCXVTCWYCRLGL-WYMPLXKRSA-N 441.325 4.960 50 10 IJGE CCc1cc(Br)ccc1OCC(=O)N/N=C/c1ccc(Cl)c(Cl)c1 40959778 WBMNUFGIYFFZIT-ZVBGSRNCSA-N 430.129 4.847 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@@H]1Br)c1cc(Br)ccc1Cl 123834113 DIOSTHVMASKCJU-ZFWWWQNUSA-N 429.539 4.893 50 10 IJGE CCOCCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccc(C)cc3)cc2)C1=O 214302495 VULVRQFSADAVLE-JLPGSUDCSA-N 444.531 4.593 50 10 IJGE O=C(NC[C@H]1CCC[C@H]1Br)c1cc(Br)sc1Br 232451400 OIXCRWNNSIBCNG-HTRCEHHLSA-N 446.002 4.567 50 10 IJGE CC(C)C[C@@H](Br)CNC(=O)c1cc(Br)cc(Br)c1 232583602 YQYOPBAQECKSSF-GFCCVEGCSA-N 441.989 4.751 50 10 IJGE Cc1cc(Br)cc(C)c1OCC(=O)NN=Cc1cc(Cl)cc(Cl)c1O 252623040 OISZCRNBHBBGHP-UHFFFAOYSA-N 446.128 4.607 50 10 IJGE CC(C)(C)C(=O)[C@H](Br)Cc1cc(I)ccc1Cl 304215843 YRETZKYPPMKJRK-SNVBAGLBSA-N 429.523 4.866 50 10 IJGE CC[C@H]1[C@@H](CBr)CCN1c1ncc(Br)cc1Br 385841488 VXSLLNCODAHWFY-KCJUWKMLSA-N 426.978 4.606 50 10 IJGE ClCc1ccc(Br)cc1N1CC[C@@]2(CN(Cc3ccccc3)CCO2)C1 717590452 DTDZFRJLNURJGG-OAQYLSRUSA-N 435.793 4.669 50 10 IJGE N#Cc1ccc(NNC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)c(C(F)(F)F)c1 799612840 DSTXWVDAPYCYMA-IBGZPJMESA-N 429.377 4.527 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cnc(OC2CCCCC2)c(Cl)c1 1301147347 DTIBWGWQYUPYOB-UHFFFAOYSA-N 429.933 4.809 50 10 IJGE C=CCNC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 1356379560 HSUYQBLWZQFRLB-RCCKNPSSSA-N 442.494 4.695 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)Nc3ccc(-n4ccc(O)n4)cc3)c2C)cc1 1586207851 DMNQPMUQNQUEGC-RCCKNPSSSA-N 437.503 4.840 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@H](c1ccc(C(=O)O)cc1)C(C#N)=C(N)O2 1865708726 DVVFUMVWUXKWAP-JOCHJYFZSA-N 436.471 4.504 50 10 IJGE CC(C)(NC(=O)[C@H](c1ccc(Cl)cc1)C1CC1)C(=O)Nc1ccc(SC#N)cc1 1866995573 KNASOBGBCXPXNH-IBGZPJMESA-N 427.957 4.940 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)N(C)CC2CC(Br)C2)cc1 1887828881 BTAABNPUOJPLIH-CBCUQQMYSA-N 425.367 4.518 50 10 IJGE Fc1cc(Br)c2nc(CCl)n(Cc3cnc(Br)s3)c2c1 1912664632 OTOIDYVZSLSJNE-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)Cc1ccc(Cl)c(C(F)(F)F)c1 1995148168 ZDIJYELTBPFSMH-NSHDSACASA-N 446.650 4.961 50 10 IJGE CC1(C)CC(CCl)(Nc2ncc(I)cc2Br)C1 2015765144 GSYBFBHDYNKHFE-UHFFFAOYSA-N 429.527 4.658 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H](Br)[C@@H](C3CC3)C2)c1 2030226631 LUZHZLVCTIKPHD-CHWSQXEVSA-N 440.550 4.550 50 10 IJGE CS(=O)(=O)c1csc([C@H](Br)c2ccc(F)cc2Br)c1 2093074680 OOLDDMJHNCXNIO-GFCCVEGCSA-N 428.142 4.538 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@@H]2CCC[C@H](Br)[C@H]2C1 2115923569 HUKFNEWHVZUKHS-CIUDSAMLSA-N 427.589 4.800 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@H]1CCN(C[C@@H](CBr)c2ccccc2)C1 2139885927 WLVWRXYXAKDJJV-MSOLQXFVSA-N 425.411 4.790 50 10 IJGE O=C(c1ccc(Cl)c(Br)c1)N1CC[C@H](C(F)(F)CBr)C1 2197763534 OCDSDBPVVDMPOW-VIFPVBQESA-N 431.502 4.595 50 10 IJGE Cc1cc([C@H](Br)c2ccc3c(c2)OCCO3)ccc1I 2207102928 LZYBWMJPHKLELH-INIZCTEOSA-N 445.094 4.855 50 10 IJGE Fc1cc(CBr)cc(F)c1OC[C@H]1CC1(Br)Br 2213081351 CHZRAUMNUFNKTM-SSDOTTSWSA-N 434.900 4.745 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OC1C2CC3CC(C2)CC1C3 2216643324 GDUQGUNMDUULIH-HXDXRCNISA-N 449.373 4.546 50 10 IJGE CN(C)CCN(CCCCCCCCCBr)CCNC(=O)OC(C)(C)C 2265854983 FHJULUDYCCMDCS-UHFFFAOYSA-N 436.479 4.500 50 10 IJGE Clc1ccc(CN[C@@H](CBr)CC2CC2)cc1I 2300240012 GYGLMCKBHDSYBG-LLVKDONJSA-N 428.539 4.598 50 10 IJGE CC(C)(CCCl)CNCc1ccc(I)c(Br)c1 2306232234 RORSQAUWGAUVFS-UHFFFAOYSA-N 430.555 4.798 50 10 IJGE Brc1ccc(CN2C[C@H]3CC[C@H]2C[C@@H]3Br)c(Br)c1 2315481566 WQXZYEKNTKOOSL-OSMZGAPFSA-N 438.001 4.959 50 10 IJGE Clc1ccc(CN2CC[C@@H](Br)[C@@H]3CC[C@@H]32)cc1I 2315548188 DQCYPLZRFLHJCS-WDMOLILDSA-N 440.550 4.692 50 10 IJGE COc1ccc(-c2ccc(C(=O)NN=C(C)c3ccc4c(c3)CCC4)c(C)n2)cc1OC 2321281103 GGGCNGKLUDJQEJ-UHFFFAOYSA-N 429.520 4.717 50 10 IJGE CCCCCOc1ccc(C=NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cc1 2323767151 YVQWDUHKOGKVIQ-UHFFFAOYSA-N 429.735 4.957 50 10 IJGE N#CC(=CNc1ccc(F)cc1)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 2324599308 SGGZEINISFSVCL-UHFFFAOYSA-N 440.522 4.579 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)C(C#N)=CNCc1ccccc1Br 2325078809 AGSCIJKIDCIKNH-MRXNPFEDSA-N 442.357 4.531 50 10 IJGE CC(C)C[C@H](CBr)CN=[S@@](C)(=O)C1CCN(C(=O)OC(C)(C)C)CC1 2328521352 NYAVAMUQYWUMOG-BZQUYTCOSA-N 439.460 4.541 50 10 IJGE COCCOc1ccc(C=C(C#N)C(=O)Nc2ccc(Oc3ccc(N)cc3)cc2)cc1 2331123454 YMXPNMGZQOYCDU-UHFFFAOYSA-N 429.476 4.632 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)c1 2340273492 WUFJSNYPYUYFRD-CALCHBBNSA-N 435.793 4.812 50 10 IJGE O=C(NC[C@H]1CCC[C@H](CCl)C1)c1ccc(Cl)cc1I 2365587159 UIKUOAJTBWWOQB-QWRGUYRKSA-N 426.125 4.720 50 10 IJGE FC(F)(F)Cc1cccc(CO[C@@H](CCl)[C@@H](I)CCl)c1 2381379396 BXQBXPRRXKAWHN-RYUDHWBXSA-N 441.058 4.958 50 10 IJGE Cc1cccc(C=NNC(=O)c2cc(-c3cccnc3)nc3c2c(C)nn3-c2ccccc2)c1 12510495 WJXPLUYOMQNCMR-UHFFFAOYSA-N 446.514 4.863 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2ccccc2OC(F)F)sc2c1CCCC2 33339913 QWBIOPSXJCUURD-KAMYIIQDSA-N 446.475 4.951 50 10 IJGE COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(Cl)c2)cc1 38651123 NUKNVVPBIOBQSN-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE CCCc1ccc(OCC(=O)N/N=C/c2ccc(OCCc3ccccc3)c(OC)c2)cc1 40888757 WJBWAZVXTKNHIL-TURZUDJPSA-N 446.547 4.798 50 10 IJGE CCCc1ccc(OCC(=O)Oc2ccc(C=C(C#N)C#N)cc2)c(Br)c1 40993047 QNKPNGQHHOMMOB-UHFFFAOYSA-N 425.282 4.817 50 10 IJGE CN(Cc1ccc(Cl)s1)S(=O)(=O)c1cc(CCl)sc1Br 91269539 SZYQXANRUYJRKD-UHFFFAOYSA-N 435.217 4.785 50 10 IJGE O=C1CCc2cc([C@H](Br)c3csc(I)c3)ccc2N1 124413171 OOCKROYOYUPXFM-AWEZNQCLSA-N 448.123 4.722 50 10 IJGE CCOc1ccc(N/C=C(/C#N)C(=O)Nc2ccc(Br)cc2)cc1OCC 216719826 XBQQVSLECBGPJL-YPKPFQOOSA-N 430.302 4.705 50 10 IJGE CC[C@H](NC(=O)/C(C#N)=C\Nc1ccc(Br)cn1)c1ccc2c(c1)CCCC2 217193749 KKZFYLUFYNAVGX-LVSKKATPSA-N 439.357 4.810 50 10 IJGE CCC[C@@H](CCBr)CNS(=O)(=O)c1ccc(Br)cc1Cl 227505845 OPIJTBRMPWUWPO-JTQLQIEISA-N 447.620 4.582 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1Br)c1ccc(Br)cc1Br 232486909 YGBRMIBNBXNRAB-ZYHUDNBSSA-N 439.973 4.648 50 10 IJGE O=C(NN=Cc1c(Cl)cccc1Cl)/C(=C/c1cccs1)NC(=O)c1ccccc1 252624790 PVEOPHGPQHCEQK-NXRABTBVSA-N 444.343 4.976 50 10 IJGE CC(C)c1ccc(OCC(=O)NN=Cc2ccc(OC(=O)/C=C/c3ccccc3)cc2)cc1 254746215 XBOQKYQOTGSITF-PWXRLQMVSA-N 442.515 4.958 50 10 IJGE CO[C@@H](CO[C@H](CI)c1ccccc1Br)C(C)C 380979455 YLCZXUYJWMFHRG-KGLIPLIRSA-N 427.120 4.613 50 10 IJGE CC[C@@H](Br)[C@@H](C)NC(=O)c1ccc(Br)cc1Br 395360272 JAQPTQAIIXQXGP-GMSGAONNSA-N 427.962 4.503 50 10 IJGE Clc1ccc(I)c(CN2CCC[C@@H](Br)CC2)c1 405349807 TUUCJTJFOCCLMP-LLVKDONJSA-N 428.539 4.694 50 10 IJGE ClCCC1(NCc2cc(Cl)ccc2I)CCSCC1 719674046 IJWDQHWGVJLNGV-UHFFFAOYSA-N 430.182 4.929 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N(C)[C@@H](c2ccccc2)C(F)(F)F)c1C 728499466 UOIWQIAXRAZKHC-JBDNFHNQSA-N 433.474 4.981 50 10 IJGE O=C(NNC(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1)c1cccc2cccnc12 730215659 HWCVYSUJWLQXIW-JOCHJYFZSA-N 431.492 4.669 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2csc(-c3ccc(Cl)cc3)n2)c1C 736695164 WUIBFFLHCPRYJZ-UHFFFAOYSA-N 436.928 4.689 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2ccc(F)cc2)cc(Br)c1OC(C)C 1084419609 ORRPLAVIQZRXBY-ZSOIEALJSA-N 433.277 4.930 50 10 IJGE Cc1c(C(=O)N2CCCC[C@H]2C)oc2c1C(=NNC(=O)c1ccc(Cl)cc1)CCC2 1772743444 AQWIGQBAFNMJMW-CQSZACIVSA-N 427.932 4.726 50 10 IJGE CC[C@@H](Br)[C@H](C)NC(=O)c1csc(Br)c1Br 1937737072 CNRDBQISZANWLA-CAHLUQPWSA-N 433.991 4.565 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC[C@@H]1CC12CCCCC2 1992224778 IWUOBMHXNARJAT-YOEHRIQHSA-N 437.362 4.692 50 10 IJGE C[C@H]1C[C@H](Br)CCN(Cc2cc(Cl)ccc2I)C1 2041568467 XWJOWIMJPPXAKK-CMPLNLGQSA-N 442.566 4.940 50 10 IJGE O=C(CCl)c1cc(I)c(OC(F)(F)F)c(C(F)(F)F)c1 2055120722 QEDMCTUHIVNXJK-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE O=C(NC[C@@H](Cl)CC(F)(F)F)c1csc(Br)c1Br 2055497293 LSINJKBQHWBFOT-BYPYZUCNSA-N 429.483 4.563 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCCCN2C[C@@H](Br)C(F)(F)F)CC1 2058040660 GCRCXKJEQVXMBK-CYBMUJFWSA-N 429.321 4.568 50 10 IJGE C[C@H]1CCc2nn(Cc3cc(F)ccc3I)c(CBr)c21 2080646208 CPJOFRNKGRLECV-VIFPVBQESA-N 449.105 4.620 50 10 IJGE FC(F)(F)c1ccc(NCC2CC(Br)C2)c(I)c1 2083656157 NEZJZEDACMVKPG-UHFFFAOYSA-N 434.037 4.895 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1c(Br)sc(C)c1C 2101004783 YFEMPUJIYNHSKM-SNVBAGLBSA-N 429.243 4.764 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2CN(CC3(CBr)CCCCCC3)C[C@H]2C1 2112471605 HBVJXUVXVNFIEP-MSOLQXFVSA-N 429.443 4.911 50 10 IJGE Fc1cc2nc(CCCl)n([C@@]34C[C@H]3CN(Cc3ccccc3)C4)c2cc1Br 2155866940 YUHHGSAIWRLQHD-YCRPNKLZSA-N 448.767 4.950 50 10 IJGE C[C@@]1(CBr)CC(F)(F)CN1C(=O)c1c(Cl)cccc1Br 2169456455 PQGYXGLDZXRXEK-LBPRGKRZSA-N 431.502 4.737 50 10 IJGE Cc1cc(Br)cc(CNCCSSCCNC(=O)OC(C)(C)C)c1 2215781547 VHLZVJGXVQNWNA-UHFFFAOYSA-N 435.453 4.753 50 10 IJGE O=C(NC[C@@H]1CCC[C@H](Br)C1)c1cc(F)c(Br)cc1Cl 2282970429 OLMPSJANCIRCIZ-BDAKNGLRSA-N 427.539 4.925 50 10 IJGE CC[C@@H]1CN(Cc2ccc(I)c(Br)c2)C[C@@H]1Cl 2306219933 RLFQXMYCFOUYCD-PWSUYJOCSA-N 428.539 4.503 50 10 IJGE CC(C)[C@@H](Cl)[C@H](C)NCc1ccc(I)c(Br)c1 2306224460 QFXXURWHGCILEL-TVQRCGJNSA-N 430.555 4.795 50 10 IJGE CCOC(=O)C(C#N)=Cc1cccc(OC(=O)COc2ccccc2-c2ccccc2)c1 2314760597 PDUUGRHHKUNENJ-UHFFFAOYSA-N 427.456 4.808 50 10 IJGE Cc1nc(Br)c(C[C@@H](Br)c2ccc(Br)cc2)n1C 2315671573 GDGWZZVGAMAAQA-LLVKDONJSA-N 436.973 4.932 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN(Cc2ccc(Cl)cc2I)C1 2318513937 YDEUGYXMEXLAAD-PWSUYJOCSA-N 442.566 4.940 50 10 IJGE O=C(Cc1ccc(Cl)c(F)c1)N[C@H](CCBr)COCc1ccccc1 2320357694 DVAZJZNYTNYWEI-MRXNPFEDSA-N 428.729 4.508 50 10 IJGE C[C@H]1[C@H](Br)C[C@@H](C)CN1Cc1cc(I)ccc1Cl 2327396711 GUHJPOVGCFQQRG-GBIKHYSHSA-N 442.566 4.938 50 10 IJGE CN(C[C@@H](Br)CCc1cc(I)ccc1Cl)C1CC1 2327407528 RSNGIOMZUCWASU-NSHDSACASA-N 442.566 4.735 50 10 IJGE CCOC(=O)c1cnn(-c2ccc(C)cc2)c1NC(=O)C(C#N)=Cc1cccc(Cl)c1 2329687523 NPJFNQPYAUDBNZ-UHFFFAOYSA-N 434.883 4.557 50 10 IJGE FC(F)(F)CC1(CBr)CCN(Cc2nc(Br)cs2)CC1 2368845164 UVILBFIHXZWVMF-UHFFFAOYSA-N 436.135 4.835 50 10 IJGE CC[C@@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1 9874146 GZMKZUAEXATLDN-MOPGFXCFSA-N 426.557 4.854 50 10 IJGE Cc1ccc(-c2n[nH]c3c2[C@H](c2ccc(F)c(Br)c2)C(C#N)=C(N)O3)cc1 10013819 URIPJPAJSDXFCA-MRXNPFEDSA-N 425.261 4.505 50 10 IJGE CC[C@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)c1ccc(OCC(C)C)cc1 10683831 WFJDQBXDYQGDAO-GCJKJVERSA-N 426.557 4.854 50 10 IJGE O=C(NC1CCCCC1)[C@@H](c1ccccc1F)N(Cc1ccc(F)cc1)C(=O)CCl 97914211 OLNKABULIXNQOT-JOCHJYFZSA-N 434.914 4.722 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@@H](O[C@H]2CCCc3ccccc32)C1 303741193 JAMLKWUCFSKNJN-ULQDDVLXSA-N 443.325 4.504 50 10 IJGE BrCc1ccc(Br)cc1N1C[C@H]2C[C@H]1CN2Cc1ccccc1 309800820 JVLJFWIZFRRHHZ-MSOLQXFVSA-N 436.191 4.807 50 10 IJGE CCc1ccc(CC)c([C@@H](Br)c2cnn(C)c2I)c1 379229842 YUZJFRJMOQZTAN-CQSZACIVSA-N 433.131 4.634 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@H](c2ccc(F)c(Br)c2)C1 382693821 ANTMUFJZZCQKOM-NEPJUHHUSA-N 437.147 4.934 50 10 IJGE CCCC[C@@H](Cl)CC[C@H](COC(=O)CCc1ccccc1)C(=O)CCCNC(C)=O 585667012 NMCYRDUXKPNNTK-FGZHOGPDSA-N 438.008 4.842 50 10 IJGE C[C@@H]1[C@@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1cc(Br)sc1Br 686186468 QXTWWMNNCNRVLN-GTDKDYCYSA-N 427.589 4.894 50 10 IJGE CN(Cc1ccccc1)C(C)(C)Cn1c(CCCl)nc2cc(Br)cnc21 714229261 ZBBZZHYGLMYKNC-UHFFFAOYSA-N 435.797 4.886 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3ccccc3CCC(F)(F)F)n[nH]2)cc1C 757659142 XEFKYLOENSEBNI-UHFFFAOYSA-N 445.445 4.655 50 10 IJGE CC(=NNC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1nc(C(F)(F)F)cs1 767359166 DXOYFGFVXJPNKJ-UHFFFAOYSA-N 441.438 4.926 50 10 IJGE O=C(/C=C/c1cn(-c2ccccc2)nc1-c1cccs1)NNC(=O)c1ccccc1Cl 1087766450 UEPQIBAAOZGPEU-OUKQBFOZSA-N 448.935 4.729 50 10 IJGE Cc1c([C@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)cccc1[N+](=O)[O-] 1614630303 QATJJLYVXRCVBI-WMZOPIPTSA-N 433.302 4.650 50 10 IJGE C/C(=C\C(=O)NNC(=O)COc1ccccc1Cc1ccccc1)c1ccccc1Cl 1654115559 WHXXDGUZVWAQBO-OBGWFSINSA-N 434.923 4.561 50 10 IJGE CCCc1nn(-c2ccccn2)c2c1[C@@H](c1c(OC)ccc3ccccc13)C(C#N)=C(N)O2 1865688268 ODKBOLFSGOWBEK-HSZRJFAPSA-N 437.503 4.600 50 10 IJGE CCc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865700315 PPRYIAFLQKXECF-OAQYLSRUSA-N 429.911 4.847 50 10 IJGE N#C/C(=C(/O)CCN1C(=O)c2ccccc2C1=O)c1nc(-c2cccc(Cl)c2)cs1 1872818013 INGLCKZTMIHWID-ZPHPHTNESA-N 435.892 4.942 50 10 IJGE CC(C)[C@@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(Br)s1 1915264029 URPQWEMDDJJUON-CQSZACIVSA-N 436.824 4.965 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1ccc(Br)cc1O 1915737538 GPPWCCHENHDTHS-UHFFFAOYSA-N 441.163 4.971 50 10 IJGE CCC[C@@H](Br)CCNC(=O)c1scc(Br)c1Br 1942751467 UKUGPJMWOJNJQJ-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE CN(c1ncc(I)cc1Br)[C@H](CCl)C(C)(C)C 2015761983 FMRWJXKXLVMHAM-SNVBAGLBSA-N 431.543 4.538 50 10 IJGE Cc1ccccc1CO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 2024649250 QHWXYVHVAGLLHM-IBGZPJMESA-N 445.341 4.716 50 10 IJGE CC[C@H](Cl)CN(CC)C(=O)c1cc(Br)ccc1I 2044540512 CXYYHTDYDXZISD-JTQLQIEISA-N 444.538 4.533 50 10 IJGE CC[C@@H](Br)CN(CC)C(=O)c1cc(Br)cc(Br)c1 2044551359 SVMJAFSYBFZCAX-SNVBAGLBSA-N 441.989 4.847 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCCC2)CC(F)(F)C1 2044701011 TXSIMBOQRFUPCB-UHFFFAOYSA-N 425.358 4.520 50 10 IJGE C[C@@H]1CN(C[C@H](CBr)c2ccccc2)C[C@@H](C)N1C(=O)OCc1ccccc1 2044701307 VDAANXGEJYEOPT-KNKQGSTJSA-N 445.401 4.897 50 10 IJGE Clc1cc(C[C@H](CBr)C2CCOCC2)ccc1I 2086664563 JFKLNGKLTVWRKJ-GFCCVEGCSA-N 443.550 4.925 50 10 IJGE CCCN1CC[C@H]([C@H](Br)c2ccccc2OCc2ccccc2)S1(=O)=O 2089515875 TUDGOGYSCQWWNE-WOJBJXKFSA-N 438.387 4.516 50 10 IJGE CC(C)[C@H]1N(C(=O)OC(C)(C)C)CC12CCN(CC1(CBr)CCC1)CC2 2106787391 IQGPXWYBYBATJA-QGZVFWFLSA-N 429.443 4.909 50 10 IJGE CC(C)[C@H](CBr)CN(C1CC1)[C@@H](CCNC(=O)OC(C)(C)C)C(F)(F)F 2106788301 ONHRJESCGAKGGL-HIFRSBDPSA-N 445.364 4.964 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2[C@H]1CCN(Cc2ccccc2)C1 2137609356 YDHXKQHMXFNMSE-HNNXBMFYSA-N 434.765 4.993 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1CCCl)c1cc(Cl)ccc1I 2146741698 YRKGRONGEKOKKE-YGRLFVJLSA-N 426.125 4.862 50 10 IJGE Cc1c(Cl)cc(CN2C[C@H](CBr)OC(C)(C)C2)cc1Br 2167396879 UBPNDNIMVGOSOF-LBPRGKRZSA-N 425.592 4.785 50 10 IJGE Cc1sc([C@@H](Br)c2ccc3c(c2)CCS3(=O)=O)cc1Br 2170065686 CMWLGGQZCPGPRL-AWEZNQCLSA-N 436.190 4.633 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@@H]1CN(Cc2ccccc2)C[C@@H]1C 2184936327 VSNDSURDPLDEBR-KBXCAEBGSA-N 447.808 4.977 50 10 IJGE O=[N+]([O-])c1cc(N2CC[C@H]3CC[C@@H](C2)N3Cc2ccccc2)ccc1CBr 2188579218 XFDJENUDWYEBFK-QUCCMNQESA-N 430.346 4.733 50 10 IJGE CCOCc1cc(Br)c([C@@H](Cl)c2cn(C)c(Br)n2)s1 2224788958 LUTAUSZLEHVVNU-JTQLQIEISA-N 428.577 4.871 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1sc(C)c(C)c1Br 2229321346 DBAILMZZMYXZFX-SNVBAGLBSA-N 429.243 4.764 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CCO[C@@H](C)C2)cc1I 2257365330 QNBRUDDEYHKCLH-PXWWUCIGSA-N 425.104 4.551 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@H](CBr)CC2CC2)[C@@H](C(F)(F)F)C1 2266310758 SLLVYMVTFZWOBH-RBSFLKMASA-N 443.348 4.718 50 10 IJGE C=CC[C@]1(CCl)CCN(C(=O)c2cc(Br)sc2Br)C1 2272155717 GVFKZBOXJPDCAU-CYBMUJFWSA-N 427.589 4.920 50 10 IJGE C[C@H]1CCCN(C(=O)c2cc(F)c(Br)cc2Cl)[C@@H]1CBr 2282978959 SXYYBBLOGSNUBB-ISVAXAHUSA-N 427.539 4.877 50 10 IJGE O=S1(=O)CC[C@@H]([C@H](Cl)c2cc(Br)ccc2OCc2ccccc2)C1 2299504317 MHRHHYCYUGFZEQ-KDOFPFPSSA-N 429.763 4.743 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(N)cc2)ccc1OCc1ccc(C(C)(C)C)cc1 2323310528 BWMNXUBTHCAKJO-UHFFFAOYSA-N 431.536 4.918 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@@H](Br)c1c(Br)ncn1C 2337277482 UGEOWRYPGQMQCR-SNVBAGLBSA-N 428.939 4.982 50 10 IJGE ClCCCN(Cc1ccc(Cl)c(I)c1)C1CCOCC1 2381150581 DOFBEVRFDOQPCT-UHFFFAOYSA-N 428.141 4.555 50 10 IJGE CS(=O)(=O)c1cccc([C@H](Cl)c2cc(Br)ccc2Br)c1 40269139 LQKDWPUETWKDBV-AWEZNQCLSA-N 438.568 4.943 50 10 IJGE O=C1COc2ccc([C@@H](Br)c3cc(Br)ccc3Cl)cc2N1 40288729 FLYPRZNNFWMLKE-OAHLLOKOSA-N 431.511 4.918 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccccc4)ccc32)c1 40529743 UNYVCIFDEPUUFR-SANMLTNESA-N 440.499 4.842 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)ccc1OC(=O)c1ccc(Cl)cc1 40869934 IGKIOGZMZRXTOL-DEDYPNTBSA-N 446.890 4.791 50 10 IJGE Cc1ccc(-c2ccccc2)n1-c1ccc(C(=O)N/N=C/c2ccc3c(c2)OCCO3)cc1 59679887 LASPXZOFOFBAHK-MTDXEUNCSA-N 437.499 4.988 50 10 IJGE Cc1ccc(C(=O)Oc2ccc(/C=C(/C#N)C(=O)Nc3cccc([N+](=O)[O-])c3)cc2)cc1 102957447 JIYPZAVSQUPJIL-UYRXBGFRSA-N 427.416 4.668 50 10 IJGE FC(F)(F)C(F)(F)[C@@H](Br)c1cc2c(cc1Br)OCCO2 109865436 PCUKWQYWGAQCGL-VIFPVBQESA-N 425.973 4.854 50 10 IJGE O=S(=O)(Nc1cccc(CCCBr)c1)c1ccc(Br)cc1 139456914 WTMHJZHZRNOFFG-UHFFFAOYSA-N 433.165 4.577 50 10 IJGE CC[C@H](Br)c1nc(-c2ncc(Br)cc2Br)no1 139785426 YBLVTYMBCJSTMJ-LURJTMIESA-N 425.906 4.503 50 10 IJGE CCO[C@@H]1[C@@H](Br)C[C@H]1Oc1ccc(Br)cc1Br 252845078 GABOEOACVNXCIY-MVWJERBFSA-N 428.946 4.531 50 10 IJGE CCc1ccc(CC)c([C@H](Br)c2cnn(C)c2I)c1 379229833 YUZJFRJMOQZTAN-AWEZNQCLSA-N 433.131 4.634 50 10 IJGE CC[C@@H](COc1c(Br)cc(Br)cc1CBr)OC 397079760 QBMCJFKOJKRPGH-JTQLQIEISA-N 430.962 4.910 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1cccc([C@@H]2COCCN2S(=O)(=O)c2ccccc2)c1 616642533 OPFULBSCHNDNFF-QFIPXVFZSA-N 447.673 4.971 50 10 IJGE CCN(C(=O)c1cc(Br)sc1Br)C(C)(C)CBr 688311424 PIKDVAHTUXLSQA-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE Clc1ccc(N2CC[C@]3(CN(Cc4ccccc4)CCO3)C2)c(CBr)c1 717596562 YRJDMPDAKNVSBW-NRFANRHFSA-N 435.793 4.716 50 10 IJGE C=CCn1c(CCc2ccccc2)nnc1SCC(=O)NN=C(C)/C=C\c1ccccc1 1084128107 XQHSHQWNPAOVSP-CNKUFBAKSA-N 445.592 4.547 50 10 IJGE C=CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](O[Si](C)(C)C(C)(C)C)C1 1149156856 UWNVMDDQIIVEQJ-MSOLQXFVSA-N 426.674 4.859 50 10 IJGE O=C(NNc1ccc(OCC(F)(F)F)cc1)c1cc2cccc(C(F)(F)F)c2nc1O 1151474154 KTMFVXFPTMQTBU-UHFFFAOYSA-N 445.319 4.657 50 10 IJGE C[C@H](CNC(=O)NNC(=O)c1ccc(Br)cc1)c1c(Cl)cccc1Cl 1318311320 RJAXABJJRUGRDY-SNVBAGLBSA-N 445.144 4.504 50 10 IJGE COc1ccc(NNC(=O)c2ccc3c(c2)nc(O)n3C2CCCC2)c(C(F)(F)F)c1 1457835249 FQAKQYYDVAGOSE-UHFFFAOYSA-N 434.418 4.641 50 10 IJGE C=CCN(Cc1cc(Br)ccc1F)S(=O)(=O)c1ccc(CCCl)cc1 1463002207 SPHQGZVHJVIAJR-UHFFFAOYSA-N 446.769 4.746 50 10 IJGE C=CCSCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Br)cc2)c1C 1584672867 DBQSAQLTOQNBSL-QGOAFFKASA-N 444.398 4.799 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2)c1 1865694416 UVRIYOVLLSTARP-SFHVURJKSA-N 440.425 4.898 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@H]1c1ccc(F)cc1 1865708614 ZGVUQUWQOSSLKP-INIZCTEOSA-N 448.807 4.961 50 10 IJGE CN(C)c1ccc([C@H](CNC(=O)/C(C#N)=C/c2ccc(Cl)cc2)N2CCCCC2)cc1 1866127837 IGWYAECQDFZNLD-VGBYGFDOSA-N 436.987 4.656 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)C(=O)c1cc(Br)ccc1O 1914226420 FKCRFJWJYYYTOG-GFCCVEGCSA-N 427.136 4.581 50 10 IJGE Cc1cc(C(=O)N(C)C[C@H](Br)COCc2ccccc2)c2ccccc2n1 1916355454 UVEYXERJQUVNJC-SFHVURJKSA-N 427.342 4.596 50 10 IJGE FC(F)OCCOc1c(Br)cc(Br)cc1CBr 1945108435 ZOSDIVNEMMGIMF-UHFFFAOYSA-N 438.888 4.725 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]23CCC[C@@]2(CN(C[C@H](CBr)C2CCC2)C3)C1 1966579047 JZMYTGIOWXOZES-DZFGPLHGSA-N 427.427 4.521 50 10 IJGE C[C@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)[C@@H](CBr)C1CC1 2009644929 GTCKKELGBRFEFH-KDOFPFPSSA-N 428.417 4.815 50 10 IJGE Cc1nc(Br)c(Br)n1C[C@@H](CBr)c1ccccc1 2027360090 PSXGHHGGMKCMPZ-LLVKDONJSA-N 436.973 4.895 50 10 IJGE CC1(C)C[C@H](CBr)N(Cc2cc(Cl)ccc2I)C1 2033714028 AESAXWUTRXCHPP-GFCCVEGCSA-N 442.566 4.940 50 10 IJGE BrC[C@H]1CC2(CC2)CN1Cc1c(Br)cccc1Br 2037825263 NTFWQFWJJBQYPX-SNVBAGLBSA-N 438.001 4.961 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1C(=O)c1ccc(Br)cc1Br 2073321450 ZHJZPIXWAQSTTA-PRHODGIISA-N 439.973 4.600 50 10 IJGE Clc1cc(CN2CC[C@@H](Br)C23CCC3)ccc1I 2086651819 KZFGWZBRLBQUTH-CYBMUJFWSA-N 440.550 4.837 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2[C@@]1(C)CCN(Cc2ccccc2)C1 2096813962 UUPKXEYVDZERGR-FQEVSTJZSA-N 433.781 4.862 50 10 IJGE CC1(CC(CBr)(CBr)[C@@H]2CCS(=O)(=O)C2)CCCCC1 2143857066 MNXVYXPFCGEQKH-CYBMUJFWSA-N 430.246 4.558 50 10 IJGE CN(C(=O)c1ccc(I)c(Cl)c1)C1(CCl)CCSCC1 2171185324 HOMBRLVZLKRBCJ-UHFFFAOYSA-N 444.165 4.521 50 10 IJGE Brc1ccc([C@@H](CI)OC2CC(n3cccn3)C2)cc1 2183662427 JCPWYXUSTDHFDR-YMAMQOFZSA-N 447.114 4.542 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@@H](Br)CC12CCC2 2282989844 KVCLCKSXUIWEBF-QMMMGPOBSA-N 425.523 4.774 50 10 IJGE Cc1scc(C(=O)NCCCCCCI)c1Br 2303648106 LYIVWHSAIFMEGG-UHFFFAOYSA-N 430.149 4.544 50 10 IJGE CC[C@H](C[C@H](C)Cl)NCc1ccc(I)c(Br)c1 2306222397 UBIHKQGFNAWQKY-GXSJLCMTSA-N 430.555 4.939 50 10 IJGE Clc1ccc(I)cc1C[C@]1(CBr)CCCOC1 2307334245 OFCBPRMUHCTPGU-ZDUSSCGKSA-N 429.523 4.679 50 10 IJGE Cc1cccc(COc2c(Cl)cc(C=C(C#N)C(=O)N(C)C)cc2Br)c1 2313567758 OEGQVDHLYQIEHO-UHFFFAOYSA-N 433.733 4.985 50 10 IJGE CCOC(=O)c1ccccc1NC=C(C#N)C(=O)N[C@@H](CC)c1ccc2c(c1)CCCC2 2325079492 GLISEPXPHOWBKK-QHCPKHFHSA-N 431.536 4.829 50 10 IJGE COc1cc(F)c(CO[C@H](CCl)[C@@H](I)CCl)c(Cl)c1 2339215977 APDXMQLQNPEHMQ-NWDGAFQWSA-N 441.495 4.654 50 10 IJGE COc1ccc(/C(C#N)=C\c2ccc(OC(=O)c3cccc(NC(C)=O)c3)cc2)cc1OC 31901139 KJLHWYBIWUPJCE-BKUYFWCQSA-N 442.471 4.946 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)CCCOc2ccc(C)cc2C)c(OC)c1 33378362 IBFGWRZSTRTJEU-ZHZULCJRSA-N 437.492 4.547 50 10 IJGE Cc1ccc(NC(=O)COc2ccc(/C=C(/C#N)c3nc(O)c4ccccc4n3)cc2)cc1 34988224 NVVPYRNJEZZKRW-RGEXLXHISA-N 436.471 4.726 50 10 IJGE O=C(CCl)N(Cc1ccc2c(c1)OCO2)C1(C(=O)NC2CCCCCC2)CCCCC1 35229251 ZUCWWOHFKQZMQN-UHFFFAOYSA-N 448.991 4.525 50 10 IJGE Cc1cc(Oc2ncnc(NNC(=O)c3cccc(Cl)c3)c2[N+](=O)[O-])cc(C)c1Cl 40658595 ODNNFAVXYQJWDW-UHFFFAOYSA-N 448.266 4.858 50 10 IJGE CCc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)Cc1ccccc1)CCC2 40815717 PNWSHXKOLYZIPV-SGWCAAJKSA-N 429.520 4.802 50 10 IJGE CC(C)Sc1nc2ccc(C(=O)N/N=C\c3cc(Cl)c(O)c(Cl)c3O)cc2[nH]1 169917909 CAFZHMCTKOEVSZ-YXSASFKJSA-N 439.324 4.545 50 10 IJGE CCOC(=O)[C@](C)(CC)n1nc([C@H](C)O[Si](C)(C)C)nc1[C@@H](C)O[Si](C)(C)C 195814670 OEWOHBKIZHWRIV-KHYOSLBOSA-N 429.710 4.791 50 10 IJGE Cc1nn(-c2ccccc2)c(C)c1C=NNC(=O)c1cc(-c2ccc3ccccc3c2)n[nH]1 254633482 ZNACHRTUFLHBPR-UHFFFAOYSA-N 434.503 4.796 50 10 IJGE CC[C@H](C)N(CCBr)C(=O)c1cc(Br)sc1Br 383468647 OXJYTQFGBMIFQA-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE CC(C)[C@@H](CBr)CNC(=O)c1cc(Br)c(Br)s1 394168672 AWEMIHLTGZYGDL-ZETCQYMHSA-N 448.018 4.670 50 10 IJGE ClCc1ccc(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@@H]32)c(Br)c1 404200914 RCLJMVMDVSUQBS-SFTDATJTSA-N 435.793 4.668 50 10 IJGE CC[C@H](Oc1ccccc1C(C)C)C(=O)NNC(=O)c1ccc(COc2ccccc2)o1 729966309 HUEVXSYUKWAPMW-NRFANRHFSA-N 436.508 4.601 50 10 IJGE C[C@H]1CN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)CCC1(F)F 753016460 GHDYJHBCMHAYKR-ZCQLHAAUSA-N 443.885 4.528 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=O)C(=O)Nc2ccccc2Sc2ccccc2)cc1 763795379 MYAZFNTUKZUFHK-UHFFFAOYSA-N 447.560 4.535 50 10 IJGE COc1ccc(C=NNC(=O)CSc2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1 1084259842 SKAHFCPNHSDFIT-UHFFFAOYSA-N 442.544 4.995 50 10 IJGE CCOc1ccc(NC(=O)C(=O)NN=Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)cc1 1084458451 HIOJBJJBTKJNOQ-UHFFFAOYSA-N 446.290 4.741 50 10 IJGE C=CCNC(=S)NNC(=O)[C@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 1290174088 WYWYNUWIRRYXPH-MRXNPFEDSA-N 426.394 4.508 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1ccc(F)cc1 1349304794 IVNKXOPQPAOTOS-JQIJEIRASA-N 438.886 4.923 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3cccc4c(O)nccc34)c2C)cc1 1449492436 YVZBBDOUGQYPPS-RGEXLXHISA-N 438.487 4.902 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccc(Cl)cc2)[C@@H]1c1ccccc1F 1865684149 UTYMYQZUJVJJER-OAHLLOKOSA-N 434.780 4.902 50 10 IJGE CCn1nc(C(F)(F)F)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(OCc2ccccc2)cc1 1865690265 NARPAOHKXKIOSC-SFHVURJKSA-N 440.425 4.719 50 10 IJGE CC[C@](C)(NC(=O)c1cc(C)n(-c2cccc(C)c2)n1)C(=O)Nc1ccc(SC#N)cc1 1866847880 UIHYEKWPZCOWMJ-DEOSSOPVSA-N 447.564 4.600 50 10 IJGE O=S(=O)(c1ccc(N(Cc2ccccc2)[C@H](CBr)C2CC2)cc1)C(F)F 1915189434 PRNBISXHIDHVIF-GOSISDBHSA-N 444.341 4.863 50 10 IJGE O=S(=O)(c1ccccc1Br)N(Cc1ccccc1)[C@@H](CCl)C1CC1 1915216793 KGKVNXHNKQIXMB-KRWDZBQOSA-N 428.779 4.657 50 10 IJGE COc1ccc([C@H](Br)C2(Br)CC2)c(OC)c1Br 2002807386 UCEPJLJUXQJKEN-NSHDSACASA-N 428.946 4.830 50 10 IJGE FC1(F)C[C@@]1(Br)COc1cccc(Br)c1CBr 2023780010 FWLIGCBVFKDPHV-SNVBAGLBSA-N 434.900 4.896 50 10 IJGE FC1(F)C[C@]1(Br)COc1cccc(CBr)c1Br 2023782085 KGQSAFVXHDYOFU-JTQLQIEISA-N 434.900 4.896 50 10 IJGE CC[C@](C)(CCBr)NC(=O)c1c(Br)cccc1Br 2033094073 MLTNYGGYMMLKQN-CYBMUJFWSA-N 441.989 4.895 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCCCN(C[C@@H](Br)C(F)(F)F)C1 2046336560 VVHZUFQNEGVKAB-OAHLLOKOSA-N 429.271 4.546 50 10 IJGE C[C@H](c1cnn(Cc2ccccc2)c1)n1c(CCl)nc2cc(Br)cnc21 2090023022 DATNQWLOEJCGBI-CYBMUJFWSA-N 430.737 4.787 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H]1CN(CC3(CBr)CCCC3)C[C@@H]21 2106786963 WPVIEJYMYSKPIB-OWSLCNJRSA-N 427.427 4.519 50 10 IJGE COCc1nnc(COc2c(Br)cc(Br)cc2CCl)s1 2186555858 ZAPGVLANNLSIPS-UHFFFAOYSA-N 442.560 4.527 50 10 IJGE Cc1ccc(C(=O)N2[C@H]3CCC[C@H]2CC(Br)C3)cc1I 2232824014 SZPUVBFBGDYTNZ-KBPBESRZSA-N 448.142 4.520 50 10 IJGE CO[C@H](CSC)Cn1c(CCl)nc2cc(Br)c(Br)cc21 2234171100 JKFSUUXGYVTSPY-QMMMGPOBSA-N 442.604 4.678 50 10 IJGE CC1(C)CN(C(=O)c2cc(Br)c(F)cc2Cl)CC[C@@H]1Br 2285844943 SXUQOPRYEFWDBB-LBPRGKRZSA-N 427.539 4.877 50 10 IJGE CCO[C@@H]1[C@H](Br)C[C@H]1OCc1c(Br)cccc1Br 2318173536 XZDJUDNDRXNSEM-JHJVBQTASA-N 442.973 4.669 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H](CBr)C2(CC2)C1 2327393314 UDKCOVPXSKOSKH-LLVKDONJSA-N 440.550 4.552 50 10 IJGE O=C(NC[C@H]1CCC[C@@H](CCl)C1)c1ccc(Cl)cc1I 2365599063 UIKUOAJTBWWOQB-MNOVXSKESA-N 426.125 4.720 50 10 IJGE Cc1cc(S(=O)(=O)Nc2ccc(CBr)c(F)c2)sc1Br 2367689873 SBYICBZCZIZBPM-UHFFFAOYSA-N 443.157 4.654 50 10 IJGE CN(CCCC1(C)CC1)S(=O)(=O)c1cc(CBr)sc1Br 2368643830 DBNVOFJPZWCMPW-UHFFFAOYSA-N 445.242 4.606 50 10 IJGE Cc1scc(C(=O)NC[C@]2(F)CC[C@H](CBr)CC2)c1Br 2369600287 NGGZTTOZQXRSDI-YPFXGUDJSA-N 427.177 4.842 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C[C@@](C)(CBr)C(C)(C)C)C2(CCOCC2)C1 2380203944 VRVGGLRCUFBMDL-OXQOHEQNSA-N 447.458 4.582 50 10 IJGE COc1cccc([C@@H](C(=O)NC2CCCCC2)N(Cc2cccs2)C(=O)CCl)c1 3039802 ACNNEPOCCHRVKH-NRFANRHFSA-N 434.989 4.514 50 10 IJGE COc1cc(/C=N/NC(=O)Nc2ccc(C)cc2C)ccc1OCc1cccc(C(=O)O)c1 59302215 WMAZFOORMASMFL-VULFUBBASA-N 447.491 4.745 50 10 IJGE CC(=O)Oc1ccc(-n2c(C)cc(/C=N/NC(=O)c3ccc4ccccc4c3)c2C)cc1 59427060 DZLBDHSWFAEMHK-JVWAILMASA-N 425.488 4.937 50 10 IJGE O=C(NN=Cc1c(Cl)cccc1Cl)/C(=C/c1ccccc1)NC(=O)c1ccccc1 252588391 ABWWNTYHQDSKEH-FSOQTDKFSA-N 438.314 4.915 50 10 IJGE COc1cc(C=NNC(=O)c2cc3c(ccc4ccccc43)o2)c(Br)cc1O 252604805 GDJMEMFYBBOSQP-UHFFFAOYSA-N 439.265 4.827 50 10 IJGE CC[C@H](C)c1ccc(OCC(=O)NN=Cc2cccc(OC(=O)/C=C\c3ccco3)c2)cc1 254462029 CQICXCDVBKVFRO-GSLCMMJNSA-N 446.503 4.941 50 10 IJGE CCCC(=NNC(=O)[C@@]1(C)CC1(Br)Br)c1ccc(Cl)cc1 254501388 PRRIMQPMYSKYET-CQSZACIVSA-N 436.575 4.857 50 10 IJGE ClCCc1nc2c(Br)cccc2n1Cc1cnn(Cc2ccccc2)c1 390388565 GLKRXUPAMPKJEG-UHFFFAOYSA-N 429.749 4.873 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H]1Cn1c(CCCl)nc2cc(Br)cnc21 708568338 MUANAWMBGZQZLW-RDJZCZTQSA-N 447.808 4.743 50 10 IJGE CCCc1c(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cnn1-c1ccc(F)cc1 799751547 VXXCLUJOYPVZGE-UHFFFAOYSA-N 431.393 4.611 50 10 IJGE CC(=O)c1ccc(OCCCC(=O)NNc2cc(Cl)ccc2Br)cc1 1558280183 FDKHNQUWRSNQEG-UHFFFAOYSA-N 425.710 4.607 50 10 IJGE C#CC[C@H](CCOC)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1587382700 LPKFYELHIPEWAN-CNSVBDKNSA-N 443.469 4.565 50 10 IJGE C=C(CBr)CN1CCC[C@@]1(C)Cc1ccc(I)cc1 1654965763 WEJJFPFATVPWKU-INIZCTEOSA-N 434.159 4.639 50 10 IJGE N#CSc1ccc(NC(=O)Oc2ccc(CNC(=O)Cc3ccc(F)cc3)cc2)cc1 1858898001 XJPPLVGZUSJWFY-UHFFFAOYSA-N 435.480 4.869 50 10 IJGE Cc1ccc(C)c(Cn2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2cccn2C)c1 1865699444 UKXLBLJJNWXJIC-HSZRJFAPSA-N 435.531 4.772 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)/C=C/c1cccs1 1865759618 JWYZFEDZSZIGLG-WEVVVXLNSA-N 432.332 4.900 50 10 IJGE CC(=O)Nc1ccc2nc(NC(=O)/C(C#N)=C/c3cccc(Br)c3)sc2c1 1866131579 BYLWZGPLYGPVEM-NTUHNPAUSA-N 441.310 4.563 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1c(F)ccc(NC(=O)OC(C)(C)C)c1F 1887830293 VSPYQHNOJGLZNF-UHFFFAOYSA-N 433.293 4.557 50 10 IJGE CN(C[C@](C)(CBr)C(C)(C)C)[C@H]1CC[C@@H]1NC(=O)OCc1ccccc1 1904843105 AKNXJQFIMSAVAN-WFXMLNOXSA-N 425.411 4.823 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Cl)Cc1c(Br)ccc(Cl)c1F 1905370619 BNBUIOCMWVVJCW-SECBINFHSA-N 431.088 4.688 50 10 IJGE CCC[C@@H](CCBr)NC(=O)c1csc(Br)c1Br 1945189271 MUBGMDSNMIXGNT-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE Brc1ccc(Br)c(CNCCCCI)c1 1962458010 DDVVRYMRBWICLI-UHFFFAOYSA-N 446.952 4.516 50 10 IJGE Fc1cccc([C@H](CI)OCCOCCOCc2ccccc2)c1 2007814709 WOEQFKBCJGPXPA-IBGZPJMESA-N 444.284 4.552 50 10 IJGE O=S(=O)(c1cc(CBr)ccc1Cl)N(Cc1ccccc1)C1CCC1 2009623100 YTQKEJPZZYJKAX-UHFFFAOYSA-N 428.779 4.978 50 10 IJGE C[C@H](NC(=O)c1cc(Br)cc(Br)c1)C(C)(C)CBr 2030077226 BLFSFZIODBCYRQ-QMMMGPOBSA-N 441.989 4.751 50 10 IJGE CN(CC(C)(C)CBr)C(=O)c1c(Br)cccc1Br 2033570085 ZQQSXYZINQROQJ-UHFFFAOYSA-N 441.989 4.705 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCCCN(C[C@H](Br)C(F)(F)F)C1 2046336559 VVHZUFQNEGVKAB-HNNXBMFYSA-N 429.271 4.546 50 10 IJGE C[C@@H]1Cc2cc([C@@H](Br)c3cc(I)sn3)ccc2O1 2056486978 GVZYXSKDALDZON-FUXBKTLASA-N 436.112 4.555 50 10 IJGE CN(C(=O)c1cc(Br)sc1Br)[C@H](CCCl)C(F)F 2058231830 LHRYLDXNGGMUBR-ZCFIWIBFSA-N 425.520 4.608 50 10 IJGE O=C(CBr)c1c(C(F)(F)F)ccc(C(F)F)c1I 2060392974 ZWSLRVAPAADBCN-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE COc1cc(CBr)cc(Br)c1OC[C@H]1C[C@H](Br)C1 2076259625 MEWHHROPUZWSTE-MGCOHNPYSA-N 442.973 4.905 50 10 IJGE Cn1ncc(Br)c1COc1c(Cl)cc(Cl)cc1CBr 2087325080 IPRVLXMTAFHBRY-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE C[C@@H](CCn1c(CCCl)nc2cncc(Br)c21)N(C)Cc1ccccc1 2095448610 XGGMAUYQPKWKMZ-HNNXBMFYSA-N 435.797 4.886 50 10 IJGE CC(C)(C)OC(=O)NCCC1CCN(C[C@H](CBr)c2ccccc2)CC1 2106786296 UHAMHYLWVDQLND-IBGZPJMESA-N 425.411 4.792 50 10 IJGE COCC(C)(C)N(Cc1ccccc1)S(=O)(=O)c1ccc(CBr)c(C)c1 2123199218 PKIZHXABJZZYCD-UHFFFAOYSA-N 440.403 4.506 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2C[C@@H]1CCN(Cc2ccccc2)C1 2128516537 AEINDAJXAWNZIU-MRXNPFEDSA-N 433.781 4.763 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)[C@H](Br)C2CCCC2)c2ccccc21 2167035466 YZUDAVMROBUMOF-SJLPKXTDSA-N 437.378 4.943 50 10 IJGE CCCC1CCN(S(=O)(=O)c2cc(CBr)sc2Br)CC1 2179787769 TZUURTSOVIWFQU-UHFFFAOYSA-N 445.242 4.606 50 10 IJGE O=C(c1ccc(Cl)c(Br)c1)N1CC[C@@H](C(F)(F)CBr)C1 2197763533 OCDSDBPVVDMPOW-SECBINFHSA-N 431.502 4.595 50 10 IJGE Cc1ccc(C(=O)N[C@@H](C)CCCCCBr)cc1I 2224629109 PCRRECAVBCNXJU-LBPRGKRZSA-N 438.147 4.673 50 10 IJGE CCn1nc(C)c(CBr)c1N1CCN(Cc2ccccc2)[C@@](C)(C2CC2)C1 2281304201 TVEDASNEIAXKMX-JOCHJYFZSA-N 431.422 4.597 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2cc(-c3ccccc3)nc(N3CCCCC3)n2)cc1 2318417928 KMKOIEZZFQELSE-UHFFFAOYSA-N 443.551 4.687 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2N)ccc1OCc1c(Cl)cccc1Cl 2323202942 CGKVGFKMDWKITE-UHFFFAOYSA-N 444.318 4.927 50 10 IJGE C[C@H]1CN(Cc2cc(I)ccc2Cl)C[C@H](C)C1Br 2327401447 ALRMWUJSDGEVMP-UWVGGRQHSA-N 442.566 4.796 50 10 IJGE CCc1ccc(-c2csc(C(C#N)=C(O)[C@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1 2331245430 KWSRXCYLPROIJB-AWEZNQCLSA-N 429.501 4.850 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)C1(C(F)(F)F)CCCCC1 2343416621 RYMOJTYNWZNHMS-MRXNPFEDSA-N 436.312 4.986 50 10 IJGE C[C@@H]1CCCN(C[C@@]2(CBr)CC2(F)F)[C@@H]1CCCNC(=O)OC(C)(C)C 2351888100 UATYCCRTQMMPJZ-RKVPGOIHSA-N 439.385 4.812 50 10 IJGE Cc1c(/C=C(/C#N)C(=O)Nc2nccs2)c2ccccn2c1C(=O)c1ccc(F)cc1 33527693 QQMOAFMMFSIRAP-VBKFSLOCSA-N 430.464 4.620 50 10 IJGE O=C(N/N=C/c1cccc(OCc2ccccc2)c1)[C@@H]1COc2cc3ccccc3cc2O1 36046482 UDEMVASRFKDHDL-YYKYCJCRSA-N 438.483 4.709 50 10 IJGE CCOc1cc(/C=C2/C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 38606934 GQAFHVWNXNWRII-RGVLZGJSSA-N 434.492 4.506 50 10 IJGE C=CCNC(=O)/C(C#N)=C1\S[C@H](Cc2ccccc2)C(=O)N1c1ccc(C(C)C)cc1 101241523 GKFPLBFYKMGRQC-CKVBZJJFSA-N 431.561 4.538 50 10 IJGE COc1ccc(C[C@@H](Br)c2ccc(I)cc2)cc1OC 110295443 UXFOGXCZAVRLMF-CQSZACIVSA-N 447.110 4.987 50 10 IJGE COc1cccc(/C=N\NC(=O)c2ccc3nc(N)sc3c2)c1OCc1cccc(C)c1 169916952 OKRGAMZHOVXZEX-ZMFRSBBQSA-N 446.532 4.538 50 10 IJGE CCCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccc(F)cc3)c(OC)c2)C1=O 214231122 ZPEPWYJAJDUEAC-BKUYFWCQSA-N 448.494 4.806 50 10 IJGE C=CCc1ccccc1OCC(=O)NN=Cc1ccc(OC(=O)/C=C/c2ccccc2)cc1 254346930 FPPODVZTOHXBJW-ZJIQPCGZSA-N 440.499 4.563 50 10 IJGE COc1ccccc1OCCn1cc(C=NNC(=O)Nc2ccccc2)c2ccccc21 254616472 QOCCHDWYMWUMMI-UHFFFAOYSA-N 428.492 4.885 50 10 IJGE O=C(NC[C@@H](Br)C1CCC1)c1cc(Br)c(Br)s1 316281386 JVJZPDHQZNPCPJ-MRVPVSSYSA-N 446.002 4.567 50 10 IJGE CC(C)N(CCCBr)Cc1cc(Cl)ccc1I 405332194 HFUKLMCYUBUZDM-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE C[C@H]1CCCN(C(=O)c2ccc(I)c(Cl)c2)[C@@H]1CCCl 697196113 YJZYKKCRHUUBDV-IINYFYTJSA-N 426.125 4.814 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1C[C@H]2C[C@@H](CN(Cc3ccccc3)C2)C1 719372573 FRFNWNYOVGGXAZ-HOTGVXAUSA-N 436.375 4.510 50 10 IJGE O=C(NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)c1cc(Cl)sc1Cl 734259737 UDNHTFCBACCXIS-UHFFFAOYSA-N 434.230 4.683 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CSc2ccc3c4c(cccc24)CC3)c1C 736697533 ZJPYMNWBPRDVLM-UHFFFAOYSA-N 441.560 4.643 50 10 IJGE CCOc1ccc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N[C@H](C)c2cc3ccccc3o2)cc1 744569331 AEUJMKWDDRBQPL-ARHDRIAESA-N 432.476 4.548 50 10 IJGE COc1ccccc1NC(=O)c1ccc(NC(=O)NNc2ccc(F)c(F)c2F)cc1 769937319 CGNADPXHRKZKIK-UHFFFAOYSA-N 430.386 4.513 50 10 IJGE CCCn1c(C)cc(/C=C(/C#N)C(=O)OCc2coc(-c3ccc(C(=O)OC)cc3)n2)c1C 782299902 HGRPDYBEIKMDMY-MTJSOVHGSA-N 447.491 4.607 50 10 IJGE C=C[C@@H]1OCCC[C@H]1NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1273305514 BHKBKEPHSAJFQT-KZSGTBTDSA-N 443.469 4.870 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2ccc3nc(O)[nH]c3c2)c(C)n1-c1cccc(Cl)c1 1466346182 UYXIGBLNWYQXBI-VCHYOVAHSA-N 445.910 4.553 50 10 IJGE CCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(OC(C)C)c(OC)c1 1865696112 CKVALKLRHDBCHU-NRFANRHFSA-N 430.508 4.584 50 10 IJGE COC(=O)c1c(NC(=O)Cc2ccc(Br)cc2)sc(/C(C)=C/C#N)c1C 1873428366 ORLXFRYEXQCJAS-DHZHZOJOSA-N 433.327 4.714 50 10 IJGE C[C@H](c1ccc(F)c(Br)c1)[C@H](CBr)NC(=O)OC(C)(C)C 1885093146 KWYIBMHSWPUJPS-RNCFNFMXSA-N 425.136 4.980 50 10 IJGE CC(C)(CCCl)C(=O)NCCCONC(=O)OCC1c2ccccc2-c2ccccc21 1887412293 CGHOQMRPQAMHHR-UHFFFAOYSA-N 444.959 4.618 50 10 IJGE C[C@@H]1OCCO[C@@H]1[C@H](Br)c1sc(Br)cc1Br 1922880498 DRHRSWFAVPOAPQ-HQLVHBAOSA-N 434.975 4.513 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@@]2(CC[C@@](C)(CI)O2)C1 1939622036 XZAGPEWGANENJW-JCGIZDLHSA-N 437.362 4.834 50 10 IJGE C[C@H]1C[C@H]1N(CCBr)C(=O)c1cc(Br)c(Br)s1 2002024077 OMVMCIMOBKVPQU-POYBYMJQSA-N 446.002 4.519 50 10 IJGE CCC[C@H](CCCl)CNc1ncc(I)cc1Br 2015757712 WDFSRFSJOZUNKR-SECBINFHSA-N 431.543 4.906 50 10 IJGE CCOC(C)(C)CO[C@@H](CI)c1ccc(Br)cc1 2033160533 SJTQAHNPNFJVRO-ZDUSSCGKSA-N 427.120 4.757 50 10 IJGE Brc1ccc(C[C@H]2CN(C3CC3)C[C@H]2Br)c(Br)c1 2039252813 ZJIXQQHZXDATEV-IINYFYTJSA-N 438.001 4.612 50 10 IJGE FC1(F)[C@@H]2COC[C@@]21[C@H](Br)c1cc(Br)ccc1Br 2043521222 PNPOBFVPGYGCTJ-MXWKQRLJSA-N 446.911 4.929 50 10 IJGE O=C(CBr)c1cc(Br)c(Br)c(OC(F)(F)F)c1 2054919305 OANSMMCKOQMWFA-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1ccc(Br)c(Cl)c1 2081235363 FEVWPKJPVXNTBR-UFBFGSQYSA-N 444.538 4.682 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@H]1CCC[C@@]2(C1)CC2(F)F 2099946172 QGFUIUDQJTWKGI-JENIJYKNSA-N 430.333 4.641 50 10 IJGE O=S(=O)(Nc1cccc(CCCBr)c1)C1CC(OCc2ccccc2)C1 2105020411 CHHUKZNVTVEGRU-UHFFFAOYSA-N 438.387 4.504 50 10 IJGE C[C@@]1(CBr)CC(F)(F)CN1C(=O)c1ccc(Cl)cc1Br 2159050782 VQKJOOBZZZTNKU-LBPRGKRZSA-N 431.502 4.737 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)[C@@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2162915121 JDWLGMJQPVJDDT-ZWKOTPCHSA-N 439.394 4.737 50 10 IJGE Cc1cc(S(=O)(=O)N(C)[C@@H]2CCCCC[C@@H]2Br)sc1Br 2172543415 KPQBFXAIXBBNNG-WDEREUQCSA-N 445.242 4.536 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@@H]1C[C@@H]2CC[C@H](C1)O2 2181362936 TXXKKHNJYLYLFN-CQROYNQRSA-N 449.126 4.620 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)[C@@H]1[C@H]2COC[C@H]21 2213491739 ICCPIPVVMUGZFA-QEPVFIOASA-N 428.921 4.679 50 10 IJGE Cc1ccc(NC(=O)[C@@H](Br)C2CCCC2)cc1CNC(=O)OC(C)(C)C 2231338332 IVVZZLGRIMCJMS-KRWDZBQOSA-N 425.367 4.912 50 10 IJGE COc1ccc([C@H](Br)[C@H](C)[C@H]2CCCO2)cc1I 2257373781 ONOGCELSGPSSIX-GAJTVXKRSA-N 425.104 4.551 50 10 IJGE CN(Cc1cccc(OC(F)(F)F)c1)C[C@H](Br)COCc1ccccc1 2271212087 UWCYJOIPBKJMAC-KRWDZBQOSA-N 432.280 4.997 50 10 IJGE O=[N+]([O-])c1cc(Cl)cc(Br)c1OCC1(CBr)CC(F)C1 2280374775 RNKPKNYSKMFQJX-UHFFFAOYSA-N 431.483 4.903 50 10 IJGE Cc1cc(Br)c([C@@H](Br)[C@H]2C[C@H](S(C)(=O)=O)C2)c(C)c1Cl 2285394352 GNURVDMTTITMOA-KWBADKCTSA-N 444.616 4.979 50 10 IJGE C[C@@H]1C[C@H](CBr)CN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285844572 OPECOIJNVRMNFH-RKDXNWHRSA-N 427.539 4.735 50 10 IJGE N#CC(=CNc1cc([N+](=O)[O-])ccc1F)c1nc(-c2cc3ccccc3oc2=O)cs1 2296763904 BLSUKNYETMTYHZ-UHFFFAOYSA-N 434.408 4.940 50 10 IJGE C[C@H]1CC[C@H](Br)CN1Cc1ccc(Cl)cc1I 2302326759 SPDNBSMZWNFVBW-ONGXEEELSA-N 428.539 4.692 50 10 IJGE Clc1ccc(I)cc1C[C@]1(CBr)CC=CCO1 2307328176 KDXYVAFBTOUFDC-ZDUSSCGKSA-N 427.507 4.597 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)NCc2ccccc2)ccc1OCc1ccccc1C#N 2313574093 MSICKANOBNRQOY-UHFFFAOYSA-N 437.499 4.759 50 10 IJGE CC1=C(C#N)C(=O)N([C@@H](C)c2ccccc2)C(=O)C1=CNc1ccccc1Br 2314579165 LHTGBVIGJOFXOC-HNNXBMFYSA-N 436.309 4.715 50 10 IJGE CC[C@@H](C)N1C(=O)C(=Cc2ccc(OCc3ccccc3F)c(OC)c2)C(C)=C(C#N)C1=O 2314610823 MRWNDAGWSXQUNC-MRXNPFEDSA-N 448.494 4.804 50 10 IJGE C[C@@H](Br)CC1C[C@@H]2CC[C@H](C1)N2C[C@@H]1CC1(Br)Br 2318712592 PFIKSWVGGACBKN-FOJMLEQCSA-N 444.049 4.909 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccsc1C(F)(F)F 2320357549 CHOKNUNKYGKAOO-CYBMUJFWSA-N 436.293 4.867 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(C)cc2)cc([N+](=O)[O-])c1OCc1ccc(C)cc1 2323075956 AZNFOSXEDSPIDK-UHFFFAOYSA-N 433.464 4.563 50 10 IJGE CN(Cc1c(Br)c(Br)nn1C)c1ccc(CCl)c(Cl)c1 2364332470 FGYHSIXGRGMBQE-UHFFFAOYSA-N 441.982 4.974 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1COC2(CCN(C[C@@](C)(CBr)C(C)(C)C)CC2)C1 2380177579 WBKXDYPQJLDBTE-OXQOHEQNSA-N 447.458 4.582 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)COc2ccc([C@@H](C)CC)cc2)cc1 14028434 SDIDTUPHDKCIID-IBGZPJMESA-N 426.557 4.999 50 10 IJGE CC(C)CCOc1ccc(C(=O)NNC(=O)c2ccc(OCCc3ccccc3)cc2)cc1 14041625 ORGBGFCKIHAPEV-UHFFFAOYSA-N 446.547 4.808 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4F)ccc32)cc1 38685906 JQZCTJJOPVHPRM-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE COc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(C)cc1)CCC2 40804707 RORABKUFRWKZKG-ZXVVBBHZSA-N 431.492 4.628 50 10 IJGE O=S(=O)(N[C@@H]1CCCCC[C@H]1Cl)c1c(Cl)cc(Br)cc1Cl 136223109 DJERWOMGBVSEJW-BXKDBHETSA-N 435.598 4.974 50 10 IJGE N#C/C(=C/Nc1ccc(N2CCCCC2)cc1)C(=O)Nc1ccc(Br)cc1 216788078 KWWKSACPPIPQBV-NXVVXOECSA-N 425.330 4.897 50 10 IJGE CCc1cccc(CC)c1NC(=O)/C(C#N)=C\NCCc1cccc(Br)c1 217209319 BBKPMVRCDRTUJH-CYVLTUHYSA-N 426.358 4.752 50 10 IJGE Cc1ccc(N/C=C(/C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c(Br)c1 217234729 NBDVZUZUDKMTCL-LUAWRHEFSA-N 435.665 4.777 50 10 IJGE CCC(CC)[C@@H](Cl)CNS(=O)(=O)c1cc(Br)ccc1Br 230666038 NYHVERSJHQQYSD-LBPRGKRZSA-N 447.620 4.534 50 10 IJGE CCN(C[C@](C)(CI)OCCC(C)(C)C)C(=O)OC(C)(C)C 231317833 LTSFGZXDAKFETG-KRWDZBQOSA-N 427.367 4.890 50 10 IJGE COc1ccc(C=NNC(=O)Cc2ccccc2)cc1CSc1nc2ccccc2o1 252604802 GDIGZZBFYGKCQL-UHFFFAOYSA-N 431.517 4.822 50 10 IJGE Clc1cc(N2CC[C@@H](N3CCN(Cc4ccccc4)CC3)C2)ccc1CBr 380138666 UTVQUHOPLXTKEO-OAQYLSRUSA-N 448.836 4.631 50 10 IJGE BrCc1c(Br)cccc1N1C[C@H]2C[C@H]1CN2Cc1ccccc1 394697972 GPCXXUXBXIGOQI-CVEARBPZSA-N 436.191 4.807 50 10 IJGE C[C@H](CCCCCl)NC(=O)c1cc(I)ccc1Br 398592748 QAUGBKRNKLBUKA-SECBINFHSA-N 444.538 4.581 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1C(=O)c1cc(Br)ccc1Br 399441774 WJLFPDPZQYAKDE-PSASIEDQSA-N 439.973 4.600 50 10 IJGE CCC[C@@H](CCBr)NC(=O)c1ccc(I)c(Cl)c1 716855896 POALPXCECUOZIU-JTQLQIEISA-N 444.538 4.628 50 10 IJGE O=C(NCC1CC1)[C@H](c1cccs1)N(C(=O)CCl)c1cccc(C(F)(F)F)c1 725240268 UQCSANNORIUPTA-KRWDZBQOSA-N 430.879 4.606 50 10 IJGE O=C(NNc1ccc(OCC(F)(F)F)cc1)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 748694027 HWVGFBBHDRFYRC-CABCVRRESA-N 434.336 4.773 50 10 IJGE O=C(/C=C(/c1ccc(Cl)cc1)C(F)(F)F)NNC(=O)C12CC3CC(CC(C3)C1)C2 761702207 JBSVAKVNOTTWNV-IUXPMGMMSA-N 426.866 4.650 50 10 IJGE Cc1cc(C=NNC(=O)CSCc2ccc([N+](=O)[O-])cc2)c(C)n1-c1ccccc1F 1084338673 JXCLPTJKBJERQN-UHFFFAOYSA-N 440.500 4.525 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccn2)[C@@H]1c1cccc(Cl)c1 1865683167 HPGQEUYKWDKXRW-HXUWFJFHSA-N 425.879 4.806 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2-c1ccc(OC)cc1 1865691476 SXSUDJFAFOLBSB-HSZRJFAPSA-N 442.519 4.616 50 10 IJGE CCc1nn(Cc2ccccc2)c2c1[C@@H](c1ccc(OC(C)C)c(OC)c1)C(C#N)=C(N)O2 1865696708 JERLQYBLOYURND-QHCPKHFHSA-N 444.535 4.508 50 10 IJGE CCCc1nn(Cc2ccc(F)cc2)c2c1[C@@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865700264 OFHCQEADGSUNMP-JOCHJYFZSA-N 427.483 4.722 50 10 IJGE CCCn1c(C)c(C)c(S(=O)(=O)c2ccccc2)c1NC(=O)/C(C#N)=C/c1ccccc1 1873711874 LNTKLXLENLNWOI-LTGZKZEYSA-N 447.560 4.893 50 10 IJGE COC(=O)[C@]1(C(C)C)C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 1912260391 SGCVWFPRCVYWRR-AUSIDOKSSA-N 435.637 4.987 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1ccc(Br)cc1O 1915133310 SDMJMWFEWWUJDS-ZDUSSCGKSA-N 441.163 4.971 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12 1917525366 JQQMZYNWIUUJHY-RJNRESKCSA-N 445.138 4.954 50 10 IJGE C[C@@H](Br)[C@@H]1CCN(Cc2ccc(I)c(Cl)c2)C1 2026567408 RPIIJLQGTNTHLM-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE Cn1ncc(Br)c1C[C@@H](CBr)c1ccc(Br)cc1 2027121543 FYBQOZBXSLBSHJ-JTQLQIEISA-N 436.973 4.666 50 10 IJGE BrC[C@@]1(Cc2cccc(Br)c2Br)C[C@@]12CCOC2 2039026144 WWJDGJILUFSALN-ZIAGYGMSSA-N 438.985 4.946 50 10 IJGE C[C@]1(NC(=O)c2cc(Br)ccc2Br)CCC[C@@H]1Br 2062574704 VEMFEXSRPRFZKI-AAEUAGOBSA-N 439.973 4.648 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CCCCN(C[C@H](CBr)c2ccccc2)C1 2106786255 TUWJMCDYRWHBFK-MJGOQNOKSA-N 425.411 4.792 50 10 IJGE COc1cc(Cl)c([C@@H](Cl)c2nn(C)cc2Br)cc1Br 2137641693 WSNCWARQMSTQND-LLVKDONJSA-N 428.939 4.935 50 10 IJGE Br[C@@H]1CC[C@H]2CCN(Cc3ccc(I)cc3)C[C@@H]2C1 2139246762 BLAOYMLCRIAQHS-SOUVJXGZSA-N 434.159 4.677 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2C1[C@H]2CN(Cc3ccccc3)C[C@H]12 2153115062 VBMVDWJYWWQETL-HOTGVXAUSA-N 445.792 4.586 50 10 IJGE CN([C@H]1CC[C@H]1OCc1ccccc1)S(=O)(=O)c1cc(F)c(Cl)c(CCl)c1 2156441241 FFEGKLOHYBIMNL-ZWKOTPCHSA-N 432.344 4.586 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CC2(CBr)CCCC2)C[C@@H]1c1ccccc1 2163057772 DZQFOAFMWBTDRN-MOPGFXCFSA-N 437.422 4.934 50 10 IJGE CCCC[C@H](CC)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2193562649 RKFJUEULARWWCX-JTQLQIEISA-N 447.258 4.995 50 10 IJGE BrC[C@H]1CCC2(CCC2)CN1C[C@@H]1CC1(Br)Br 2213086924 BSLDYQSBERSSQA-WDEREUQCSA-N 430.022 4.522 50 10 IJGE CCC(CC)[C@H](Br)CNC(=O)Cc1ccc(Br)cc1Cl 2237436665 NDOLCSIUQJWAPI-CYBMUJFWSA-N 425.592 4.961 50 10 IJGE COC(=O)c1ccccc1NC(=O)C(C#N)=Cc1ccc(OCc2ccc(F)cc2)cc1 2295459773 WGRSULWHDLUJFH-UHFFFAOYSA-N 430.435 4.737 50 10 IJGE C=CC[C@@]1(CBr)CCN(Cc2sccc2I)C1 2301071251 LQVSPKNGIWLSKN-ZDUSSCGKSA-N 426.161 4.516 50 10 IJGE CC(C)N(C)C[C@@H](Br)CCc1ccc(Cl)c(I)c1 2315550095 ZQXNRTAAHAPHBX-LBPRGKRZSA-N 444.582 4.981 50 10 IJGE COc1ccc(C(C#N)=Cc2cccc(OC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)c2)cc1 2320511406 SVMUYPBKHVBTKE-UHFFFAOYSA-N 445.387 4.795 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NN=Cc2c(Cl)nc3scc(C)n23)c(C)n1 2321250921 VUOGNKOLJBELGH-UHFFFAOYSA-N 439.928 4.501 50 10 IJGE CC(C)(C)OC(=O)NCCC[C@@H]1CCCCN1C[C@@]1(CBr)CC1(F)F 2326917282 NRJFLVQHIXNVCJ-YOEHRIQHSA-N 425.358 4.566 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)cc1 14025461 IIXLCEULSDAIGI-UHFFFAOYSA-N 426.557 4.918 50 10 IJGE CCCCCCOc1ccc(Br)cc1C(=O)NNC(=O)CCc1ccccc1 14648255 AOKMGLSONFZWHT-UHFFFAOYSA-N 447.373 4.802 50 10 IJGE N#CC(=C\c1c[nH]nc1-c1cccc([N+](=O)[O-])c1)/C(O)=N/c1ccc([N+](=O)[O-])cc1Cl 35518587 WYXUHGKFPJRVRS-WUXMJOGZSA-N 438.787 4.742 50 10 IJGE Cc1c(C(=O)Nc2cccc(Cl)c2)oc2c1/C(=N/NC(=O)Cc1ccccc1)CCC2 40815830 DKOXISOBQYTLFD-ZXVVBBHZSA-N 435.911 4.893 50 10 IJGE N#C/C(=C/c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1)C(=O)Nc1ccccc1C(=O)O 103485586 MLHYMIKCHGPWBX-XFXZXTDPSA-N 437.795 4.752 50 10 IJGE O=C(NC[C@H]1CCC[C@H]1Br)c1ccc(Br)c(C(F)(F)F)c1 124440077 XSIIHGCUWWSNBE-MWLCHTKSSA-N 429.074 4.761 50 10 IJGE CC[C@@H](N/C=C(/C#N)C(=O)N[C@@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 217171580 DVGWFEJTONCTNB-VZBHIUKOSA-N 447.579 4.908 50 10 IJGE C[C@@H](Cl)c1nc2cc(I)ccc2n1C[C@@H]1CSCCS1 229627143 FLMSTSAVZOEPNY-MWLCHTKSSA-N 438.787 4.789 50 10 IJGE O=C(c1cc(Cl)ccc1I)N1CCC(CCCCl)CC1 401004766 BFUVPCHLHOXNSH-UHFFFAOYSA-N 426.125 4.816 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1)/C(=C/C=C\c1ccccc1)NC(=O)c1ccccc1 1082989100 MGXWQTWUORMQEL-LVEJYOBLSA-N 429.907 4.817 50 10 IJGE C=CCOc1ccc(-n2c(C)cc(C=NNC(=O)CC[C@@H](O)c3ccccc3)c2C)cc1 1084638528 NIVFXKFXHSCQGK-RUZDIDTESA-N 431.536 4.623 50 10 IJGE CCc1cc(Br)cc2c1O[C@]1(C=C2)CCN(C(=O)[C@@H](Br)CC)C1 1859497419 GALKTKCYSUTZKY-MAUKXSAKSA-N 443.179 4.562 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccc(Cl)cc2)[C@@H]1c1ccccn1 1865700598 YKZVNLFWRACXJQ-NRFANRHFSA-N 439.906 4.865 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1ccccc1OC)C(C#N)=C(N)O2 1865710267 SLPMLQHQZDBTIE-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE CCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@H]2c1ccc(C(F)(F)F)cc1 1865711022 OEBPZVOPJXYQRS-GOSISDBHSA-N 440.425 4.816 50 10 IJGE O=C(NC1(C(F)(F)F)CCC(Br)CC1)c1ccc(Br)s1 1924688584 ASJNOLZXWJFJPR-UHFFFAOYSA-N 435.103 4.879 50 10 IJGE CN(CCN(Cc1ccccc1)C[C@H](Br)C(F)(F)F)Cc1ccccc1 1931962066 OPSDFRLOPRDBCH-IBGZPJMESA-N 429.324 4.946 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]3(CCC[C@@H](CI)O3)CC[C@@H]21 1935705003 BJUPSZIDYHZWDY-LLDVTBCESA-N 435.346 4.539 50 10 IJGE CC[C@H](Br)[C@H](C)NC(=O)c1csc(Br)c1Br 1937737073 CNRDBQISZANWLA-FSPLSTOPSA-N 433.991 4.565 50 10 IJGE BrC[C@@H]1CCCN(Cc2cccc(Br)c2Br)C1 1943880438 FGMBKLRXHHZWIK-JTQLQIEISA-N 425.990 4.819 50 10 IJGE O=C(NC1CC(CCBr)C1)c1csc(Br)c1Br 1945188859 CSVWQIPOROHHDW-UHFFFAOYSA-N 446.002 4.567 50 10 IJGE CC(C)(C)OC(=O)NC1CCC2(CC1)CC1(CCC[C@H](CI)O1)C2 2007712559 COQIVKOOWRUNGX-LQWAXRAISA-N 449.373 4.977 50 10 IJGE CCC[C@H](Cl)CCNC(=O)c1cc(I)ccc1Br 2029922609 MDPGHOBBGOSUBC-VIFPVBQESA-N 444.538 4.581 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](Br)C(F)(F)F)C2(CCCCC2)C1 2044704952 HRGRUAWNGUQOJR-ZDUSSCGKSA-N 429.321 4.568 50 10 IJGE C[C@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1ccc(CBr)cc1F 2059264392 FFQAXFQOJSZKSK-CQSZACIVSA-N 426.351 4.710 50 10 IJGE BrC[C@@]12CC[C@@H]1CN(Cc1c(Br)cccc1Br)C2 2078146656 ZJANMRVPIHJSBR-QMTHXVAHSA-N 438.001 4.819 50 10 IJGE CC1(C)OCCO[C@@H]1[C@@H](Br)c1ccc(Br)cc1Br 2083338154 MBMADQFAWJWPLW-NWDGAFQWSA-N 442.973 4.842 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCC([C@@H](F)CCl)CC1 2106949847 IEBRHHPLTASUTB-VIFPVBQESA-N 433.568 4.702 50 10 IJGE CN(Cc1ncc(Br)cc1Cl)C1(CBr)CCSCC1 2127190458 SDOWDCCHDTYVKA-UHFFFAOYSA-N 428.621 4.590 50 10 IJGE Cc1sc(Br)c(C(=O)N2CC(F)(F)C[C@@]2(C)CBr)c1C 2159049212 MARDKIRIWJHSCC-LBPRGKRZSA-N 431.140 4.762 50 10 IJGE O=C(NC1(C(F)(F)F)CCC(Br)CC1)c1cc(Br)cs1 2172564347 HFYOMAJNFMHYOJ-UHFFFAOYSA-N 435.103 4.879 50 10 IJGE CN(C(=O)[C@@H](Br)C1CCCC1)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 2197469240 KJSNSOOSOLFAIH-ROUUACIJSA-N 439.394 4.665 50 10 IJGE Clc1ccc(Br)c(CC23COC(CI)(C2)C3)c1 2216261342 GGXCKTKTQNRQIF-UHFFFAOYSA-N 427.507 4.629 50 10 IJGE CC(C)N(CCCCI)C[C@H]1CCCCN1C(=O)OC(C)(C)C 2243586376 PASDPNMEFQMWOU-MRXNPFEDSA-N 438.394 4.702 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1C(=O)c1cc(Br)ccc1Br 2260370455 CJFQGSRWRMSLIJ-NWDGAFQWSA-N 439.973 4.600 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)C2CC3(COC3)C2)c1 2263507935 HACOGXPSJZHXCJ-ZDUSSCGKSA-N 438.985 4.944 50 10 IJGE COc1ccnc(N(C)[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c1CBr 2281101848 QPLKMUYAORJUQW-BWTSREIZSA-N 430.390 4.617 50 10 IJGE CN(C[C@H](Cl)C1CCCC1)C(=O)c1ccc(Cl)c(I)c1 2283668391 YOARWNUELKZQTA-ZDUSSCGKSA-N 426.125 4.814 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC[C@H]2C[C@@H]3CC[C@H]2C3)C1 2298751492 MGJUTUZILHAWSG-OLMMMNRUSA-N 449.373 4.644 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1Cc1ccc(Cl)c(I)c1 2300239138 UNVUTUTXRDVMOE-MWLCHTKSSA-N 428.539 4.692 50 10 IJGE Cc1cccc(OCCCC(=O)Oc2ccc(C=C(C#N)C(=O)NCc3ccco3)cc2)c1 2314760291 JMWFLFMFQCNRHZ-UHFFFAOYSA-N 444.487 4.576 50 10 IJGE Cc1cc(I)c(Oc2ncc(CBr)cn2)cc1Cl 2314962222 DVIXIFZVZUHKPX-UHFFFAOYSA-N 439.478 4.730 50 10 IJGE ClC[C@@H]1C[C@@H]2CC[C@H]1N2Cc1ccc(I)c(Br)c1 2325212046 BWLYUSDRDHOPBL-COPLHBTASA-N 440.550 4.645 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Br)c2)CC[C@H]1Cl 2325213607 VGSQCXIPLFXXLS-CYBMUJFWSA-N 442.566 4.893 50 10 IJGE CC[C@@H]1CN(Cc2cc(I)ccc2Cl)C[C@H]1CBr 2327394315 CZYJTOMKTUVGFS-ZYHUDNBSSA-N 442.566 4.798 50 10 IJGE C[C@@](CI)(OCc1ccncc1)c1ccccc1Br 2340084964 NABDVATZZGPAIX-HNNXBMFYSA-N 432.099 4.711 50 10 IJGE N#C/C(=C/c1c[nH]c2ccc(OCc3ccccc3)cc12)C(=O)Nc1ccccc1C(=O)O 2793052 GIPYZZUSZPRSGP-PDGQHHTCSA-N 437.455 4.991 50 10 IJGE O=C(N/N=C/c1ccc(/C=N/NC(=O)c2ccc(Cl)cc2)cc1)c1ccc(Cl)cc1 12571986 YCXGPSMUGUQKSI-BKHCZYBLSA-N 439.302 4.521 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)Nc2ccccc2Cc2ccccc2)cc1 22562208 FQVLLBMHSZBYDF-BFWROUECSA-N 440.499 4.763 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)cc1C 38678203 FCSQBFVAMZNSBY-RUZDIDTESA-N 444.462 4.645 50 10 IJGE Cc1ccc(CNC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccc(C)c2)CCC3)cc1 40811300 UPRWZIKQLGBVSP-SGWCAAJKSA-N 429.520 4.605 50 10 IJGE N#C/C(=C\c1ccc(OC(=O)/C=C/c2ccc(Cl)cc2)cc1)C(=O)NCc1ccco1 40926714 PXRDICOXGHKFPR-DXGLHLNISA-N 432.863 4.775 50 10 IJGE CCCN(CCC)c1ccc(C(=O)N/N=C/c2cc(Br)ccc2OC)cc1 59167281 HJTNQCFQIWYMQW-HZHRSRAPSA-N 432.362 4.848 50 10 IJGE CCOC(=O)c1ccc(NC(=O)/C(C#N)=C\N(c2ccccc2)c2ccc(N)cc2)cc1 217102969 IDZNLKKLVAOLAM-ZPHPHTNESA-N 426.476 4.630 50 10 IJGE CCOCCCN(C(=O)CCl)[C@H](C(=O)N[C@H]1CCCC[C@H]1C)c1ccccc1Cl 252587622 ZMXUFBUKLSDQGJ-PBEJRMEISA-N 443.415 4.570 50 10 IJGE CC(C)(C)[C@@H]1CCc2[nH]nc(C(=O)NN=C/C(Br)=C/c3ccccc3)c2C1 254835787 AGJBWSPGTINURG-RYJIUJLLSA-N 429.362 4.712 50 10 IJGE CC(=NNC(=O)[C@@]1(C)CC1(Br)Br)c1ccc(Cl)cc1Cl 263627777 YSOJURILHBNSTH-GFCCVEGCSA-N 442.966 4.730 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1)c1ccc(C(=O)NN=Cc2ccc(Cl)cc2)cc1 263629833 JXIKMFDYIOCZOZ-UHFFFAOYSA-N 439.302 4.521 50 10 IJGE Brc1cc(Br)cc([C@H]2CC[C@H](CI)O2)c1 307601032 UFHIKHJTQVNFOD-GHMZBOCLSA-N 445.920 4.867 50 10 IJGE C[C@H]1C[C@@H](Br)CN(C(=O)c2cc(Br)c(Br)s2)C1 401884275 DPULGXTZYWNBKB-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE CC[C@H]1[C@H](CBr)CCN1Cc1cc(Cl)ccc1I 405279667 AVAGSNBKMLUTAE-HZMBPMFUSA-N 442.566 4.940 50 10 IJGE Fc1ccc2nc(CCl)n(C3[C@H]4CN(Cc5ccccc5)C[C@H]34)c2c1Br 689722712 GSLZTNWWMPACJL-KBPBESRZSA-N 434.740 4.980 50 10 IJGE CC[C@H](C[C@H](C)Cl)NC(=O)c1ccc(I)c(Br)c1 721601913 IOKXWJJQTXSYCZ-WCBMZHEXSA-N 444.538 4.580 50 10 IJGE O=C(NNc1ccc(Br)cc1C(F)(F)F)c1cccc(CN2CCCC2)c1 731478009 WNWAUWMOBSMNJM-UHFFFAOYSA-N 442.279 4.821 50 10 IJGE C[C@H](NC(=O)NNc1cccc(F)c1F)c1cccc(NC(=O)Cc2ccccc2F)c1 745503369 HRTWVLIBQKBMKP-AWEZNQCLSA-N 442.441 4.672 50 10 IJGE CO[C@@H](C(=O)NN=Cc1c(Br)c(C)n(-c2ccccc2)c1C)c1ccccc1 1084270260 KERCLEFMZKNFCB-OAQYLSRUSA-N 440.341 4.694 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C[C@H](CBr)C3CC3)CC2)C1 1307924880 WOYQDEJYAPLNGL-OALUTQOASA-N 429.443 4.767 50 10 IJGE C#CCSCCNC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1465292142 VNPWLBIWIHWLSE-ATVHPVEESA-N 432.376 4.791 50 10 IJGE C=C(C)[C@@H](NC(=O)NNc1cc(OC)ccc1Br)c1ccc(F)c(F)c1 1469857756 XAYPBBQLWVKELI-QGZVFWFLSA-N 426.261 4.679 50 10 IJGE COc1cc(C=NNC(=O)CSc2ccc(C)cc2)ccc1OCCc1ccccc1 1772756408 XPBVRXBOFIHZQA-UHFFFAOYSA-N 434.561 4.868 50 10 IJGE Cc1ccc(C)c(NC(=O)COc2cccnc2NC(=O)Nc2ccc(SC#N)cc2)c1 1858832831 QELVBKOGTFDZEM-UHFFFAOYSA-N 447.520 4.933 50 10 IJGE CC(C)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccn2)cc1 1865686472 WPGIGALQMICEOG-KRWDZBQOSA-N 425.414 4.628 50 10 IJGE CCc1nn(-c2ccc(Cl)cc2)c2c1[C@@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689345 QBGSGWAULCZUIT-SFHVURJKSA-N 427.291 4.665 50 10 IJGE Cc1nc(-c2ccc(F)cc2)ccc1C(=O)N/N=C\c1ccc(F)c(Br)c1 1865760866 SPQHKWAFTYDQBR-MYKKPKGFSA-N 430.252 4.862 50 10 IJGE Cc1cccc(-c2nc(CC(=O)NC(C)(C)C(=O)Nc3ccc(SC#N)cc3)c(C)o2)c1 1866647921 DREGWTNCUJDPNG-UHFFFAOYSA-N 448.548 4.608 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)cc(Cl)c1 1914636929 INMXCBHRNMEQSK-GFCCVEGCSA-N 437.186 4.968 50 10 IJGE Cc1sc([C@@H](Br)c2cc(Br)n(C)n2)cc1Br 1937822145 UJJVTZLKGUOJRA-JTQLQIEISA-N 428.975 4.799 50 10 IJGE CCn1ncc(Br)c1[C@@H](Br)c1sccc1Br 1937908672 YTDFRCBTZHGDFS-MRVPVSSYSA-N 428.975 4.974 50 10 IJGE Cc1cc(Br)sc1[C@H](Br)c1cn(C)nc1Br 1981646363 IRNGMWAJNUMUCN-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE CN(C(=O)c1cccc(Br)c1Br)[C@@H]1CCC[C@@H]1Br 2031477426 LULKMHDYRUVTBF-GXSJLCMTSA-N 439.973 4.600 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(CC2(CBr)CCCC2)CCC1(F)F 2044697914 XSRBTJMZYUFMNE-AWEZNQCLSA-N 425.358 4.566 50 10 IJGE CC(C)[S@](=O)(=NCC[C@H](C)CCBr)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2063273349 LQRNAKIHKSQKEX-WHEFHEQHSA-N 439.460 4.683 50 10 IJGE ClC[C@@H]1CCC[C@@H](CNc2ncc(I)cc2Br)C1 2069526477 WJNPWYNOZZPUMF-NXEZZACHSA-N 443.554 4.906 50 10 IJGE BrC[C@@H]1CCN(Cc2cccc(Br)c2Br)C12CC2 2070104408 FSXQOXZSWJBCSH-NSHDSACASA-N 438.001 4.961 50 10 IJGE CCOc1ccc(Cn2nc(CCl)c(I)c2C(F)(F)F)cc1 2079211005 GRIAGMCCQVOAOL-UHFFFAOYSA-N 444.622 4.692 50 10 IJGE CC(C)N1C[C@H](Br)[C@H](Cc2ccc(I)c(Cl)c2)C1 2086651950 LZGNKCYBQWKHET-NEPJUHHUSA-N 442.566 4.591 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Br)c2n1Cc1cnn(Cc2ccccc2)c1 2095438757 ZYEJJBHKSQQXAL-CYBMUJFWSA-N 430.737 4.787 50 10 IJGE Cn1cc(Br)c(CC(CCl)(CCl)c2cccc(Br)c2)n1 2143634242 MESFBTMEBHUPCF-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE CN(c1ccc([N+](=O)[O-])c(CBr)c1)[C@H]1CN(Cc2ccccc2)C(C)(C)C1 2154826678 BLUOAJQEGOADCA-LJQANCHMSA-N 432.362 4.979 50 10 IJGE CN(C(=O)c1c(Cl)cccc1Br)C1(CBr)CCSCC1 2171188074 NVFDUMDUECBUQK-UHFFFAOYSA-N 441.616 4.835 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1[C@H](CBr)NC(=O)OC(C)(C)C 2241493231 KWZHFAIHISXCKP-PMPSAXMXSA-N 449.430 4.804 50 10 IJGE CN(CC1(CBr)CCCCCC1)C[C@]1(O)CCCN(Cc2ccccc2)C1 2286347571 DVUNHFIDTBNUKQ-HSZRJFAPSA-N 437.466 4.681 50 10 IJGE O=C(NN=Cc1c(Cl)cccc1Cl)C(=Cc1cccs1)NC(=O)c1ccccc1 2293968640 PVEOPHGPQHCEQK-UHFFFAOYSA-N 444.343 4.976 50 10 IJGE C[C@H](Br)CCCN(C)Cc1ccc(I)c(Cl)c1 2299539072 BJKKRNVTKJRYQE-JTQLQIEISA-N 430.555 4.940 50 10 IJGE CC(C)[C@@H](Cl)[C@@H](C)NCc1ccc(I)c(Br)c1 2306224458 QFXXURWHGCILEL-NOZJJQNGSA-N 430.555 4.795 50 10 IJGE CC1(C)[C@H](Cl)CCN1Cc1ccc(I)c(Br)c1 2306231418 JEGWQNKLSHWGFV-GFCCVEGCSA-N 428.539 4.645 50 10 IJGE Clc1cc(CN2[C@H]3CC[C@@H]2C[C@@H]3CBr)ccc1I 2312130717 FUPATEVZXUMENC-GYSYKLTISA-N 440.550 4.692 50 10 IJGE Cc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)cc1 2314634117 NYNHJALQGRCOSB-RUZDIDTESA-N 426.447 4.971 50 10 IJGE FC1CC(CBr)(COCc2ccc(Cl)cc2I)C1 2317798492 YIEOSSRHGDPDCK-UHFFFAOYSA-N 447.513 4.974 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cc(Cl)c(F)cc1F 2320361382 RDTWLKYQCGWWBQ-CYBMUJFWSA-N 432.692 4.718 50 10 IJGE CN(Cc1nn(C)cc1Br)c1cc(Cl)c(F)cc1CBr 2362398687 VVLPQMFLRBVETP-UHFFFAOYSA-N 425.527 4.506 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(O[C@@H]2CCCCC23CCOCC3)C1 2368353747 IASJOSFWGYADHC-UTKZUKDTSA-N 446.426 4.907 50 10 IJGE CC(C)CCOc1cccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)c1 14644597 GOCSDIAIRLTXGT-CQSZACIVSA-N 439.339 4.647 50 10 IJGE COC(=O)c1ccccc1N/C=C(/C#N)c1nc(-c2cc3ccccc3oc2=O)cs1 102417351 ABDMTWKIQPIEBH-QINSGFPZSA-N 429.457 4.680 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CCCC[C@H]1CBr 161194874 FIFGZLPUMLVLDJ-JTQLQIEISA-N 439.973 4.601 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)CCCOc2ccccc2C)c(OCC)c1 206291099 ZMOPNXKOYDBGLL-HKWRFOASSA-N 437.492 4.628 50 10 IJGE CN(C)c1nc(N)nc(/C(C#N)=C\c2ccc(-c3ccc(Cl)c(C(F)(F)F)c3)o2)n1 229782610 DPMOBNKXGRQEOL-XFFZJAGNSA-N 434.809 4.516 50 10 IJGE N#C/C(N=Cc1ccc(Cl)cc1)=C(/C#N)NC(=O)Nc1ccc(OC(F)(F)F)cc1 254764821 PAMAMOBIHBGHGA-PIXHNBQOSA-N 433.777 4.738 50 10 IJGE CC[C@H](Br)[C@H](C)NC(=O)c1cc(Br)cc(Br)c1 386848772 ZAEAOOFOCUALJI-CPCISQLKSA-N 427.962 4.503 50 10 IJGE Cc1cccc(C(=O)NCCCC(C)(C)CBr)c1I 393415103 JRALAJSGADYNHA-UHFFFAOYSA-N 438.147 4.531 50 10 IJGE ClCc1cc(Br)c(OCCOC[C@@H]2CCCO2)c(Br)c1 693115154 GNFSBIZXNIBRCW-NSHDSACASA-N 428.548 4.525 50 10 IJGE C[C@H]1C[C@H](Br)CCN1C(=O)c1cc(Br)cc(Br)c1 705610515 DDFUWQGADIAAHR-WCBMZHEXSA-N 439.973 4.600 50 10 IJGE Cc1ccc(COc2cccc(C=NNC(=O)c3cc(Br)ccc3O)c2)cc1 1083958302 XASFLVWVQKASDF-UHFFFAOYSA-N 439.309 4.806 50 10 IJGE CCOC(=O)c1ccc(OCC(=O)NN=Cc2c3ccccc3cc3ccccc23)cc1 1084137201 YVTCORPVCSXPQC-UHFFFAOYSA-N 426.472 4.699 50 10 IJGE CCCc1nn(-c2ccc(Br)cc2)c2c1[C@H](c1ccccc1)C(C#N)=C(N)O2 1865680213 BWYDFEBMWKENRC-LJQANCHMSA-N 435.325 4.805 50 10 IJGE CCCc1nn(Cc2cccc(F)c2)c2c1[C@@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689178 LYMHGIWZHNPVMK-FQEVSTJZSA-N 438.890 4.600 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2Cl)[C@@H]1c1ccncc1 1865700423 SPPOEQPIUOKZGI-HXUWFJFHSA-N 425.879 4.806 50 10 IJGE CCCc1nn(Cc2ccccc2)c2c1[C@@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865701758 DSIUUFPSKMTZRL-DEOSSOPVSA-N 441.579 4.948 50 10 IJGE CCc1nn(Cc2ccc(F)cc2)c2c1[C@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2 1865711193 RVOACKAJXABFOX-LJQANCHMSA-N 442.416 4.870 50 10 IJGE Cc1ccc(Cn2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(Br)cc2)cc1 1865714810 QSSLLAOTUOOVTD-FQEVSTJZSA-N 435.325 4.529 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1ccc(OC)cc1)C(C#N)=C(N)O2 1865714981 SDPQNWHUIFDUBW-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE N#C/C(=C\c1ccc(Br)cc1)C(=O)Nc1ccccc1C(=O)NC1CCCC1 1866128846 PDSHAQLAIGWTFV-DTQAZKPQSA-N 438.325 4.667 50 10 IJGE CSCC[C@@H](NC(=O)/C(C)=C/c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1866810884 APYOTYDFTIEBNS-KETLNSEPSA-N 425.579 4.540 50 10 IJGE N#C/C(=C(/O)CCN1C(=O)c2ccccc2C1=O)c1nc(-c2ccccc2Cl)cs1 1872746504 LDAKUFVEBLXEDR-MNDPQUGUSA-N 435.892 4.942 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)C12CCC2 1882085701 VNVBZFBMGDRUCD-ZNMIVQPWSA-N 447.414 4.606 50 10 IJGE COc1cc(Br)ccc1C(=O)N(Cc1ccccc1)C[C@@H](C)Br 1914608907 CNNJSFNPCNCKHB-CYBMUJFWSA-N 441.163 4.884 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)Cc1cn(C)nc1Br 1915296539 VIURALKHPCCYIB-MRXNPFEDSA-N 429.200 4.604 50 10 IJGE C[Si]1(C)C[C@@H](C(=O)NN(Cc2ccccc2)Cc2ccccc2)N(Cc2ccccc2)C1 1923941696 CYPPVZKYPXRJED-SANMLTNESA-N 443.667 4.852 50 10 IJGE CC1(CO[C@@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)CCCC1 1938032816 LQRHNXOTXBCGKE-GOSISDBHSA-N 437.362 4.788 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCC3(CC[C@H](CI)O3)CC2)C1 1939410358 KOWQJMGUOSFWMV-RWBZWWBESA-N 435.346 4.540 50 10 IJGE CCCN(CCCBr)C(=O)c1cc(Br)sc1Br 1944437081 PPYPSTSELDWQTK-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1Cc1c(Br)cccc1Br 1945328304 ATZSMXUSFBYLIA-NXEZZACHSA-N 425.990 4.959 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1cscc1OCc1ccccc1 1993390809 LDAYWWKDAYIDLM-CJNGLKHVSA-N 443.350 4.907 50 10 IJGE BrCCCN(Cc1cc(Br)ccc1Br)C1CC1 2006496323 HDDDECBVLBVVLV-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE CCCN1C[C@H](Br)[C@H](Cc2ccc(Br)cc2Br)C1 2039263712 YFLTUZGHIJHPMJ-RISCZKNCSA-N 440.017 4.859 50 10 IJGE Brc1ccc(Br)c(CN2C[C@@H]3C[C@H](C[C@H]3Br)C2)c1 2054722241 PUKRVIMVBFMDBH-ISTVAULSSA-N 438.001 4.817 50 10 IJGE COC[C@H]1C[C@@H]1COc1c(Br)cc(Br)cc1CBr 2069753866 PHKNEVKWFXTYLI-NXEZZACHSA-N 442.973 4.768 50 10 IJGE ClCCc1nc2cc(Br)ccc2n1[C@@]12C[C@H]1CN(Cc1ccccc1)C2 2099678419 IMNHTUUCJQLMRY-HRAATJIYSA-N 430.777 4.811 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)N2CCC(Br)CC2)cc1 2106199013 FEIFFDHYGNVNIM-ZDUSSCGKSA-N 426.355 4.664 50 10 IJGE CC(C)[C@H]1CN(C(=O)OC(C)(C)C)CCN1C[C@@H](CBr)c1ccccc1 2106782663 SDRCWTRLSKRYHQ-RTBURBONSA-N 425.411 4.742 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H]3CC[C@@H](CN3CC3(CBr)CCCC3)[C@H]2C1 2106786380 FFPIZLKUICXEFC-MHORFTMASA-N 427.427 4.519 50 10 IJGE Cc1nc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)sc1CBr 2108213689 OHIIOHXGUBQUAV-XWSJACJDSA-N 432.431 4.693 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2C1[C@@H]2CN(Cc3ccccc3)C[C@@H]12 2128511375 ITMJGBQFVGOLJN-HUUCEWRRSA-N 431.765 4.544 50 10 IJGE Brc1ccccc1[C@H](CI)OC[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]32 2134544364 ZOZPKGYYFDPBLG-HHGUKAJPSA-N 433.127 4.844 50 10 IJGE COCC1CC(O[C@@](C)(CI)c2ccccc2Br)C1 2142497050 PTCLMWBBXADHSL-QOZQQMKHSA-N 439.131 4.541 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CCNC(=O)[C@@H](Br)C1CCCC1)c1ccccc1 2167049218 VSZWFIWCTSEHBM-ROUUACIJSA-N 439.394 4.712 50 10 IJGE Clc1c(Br)ccc(CBr)c1N1CCS[C@H]2COCC[C@H]21 2170504227 LKMRAOBXQAVOJG-NEPJUHHUSA-N 441.616 4.708 50 10 IJGE CN(C(=O)c1ccc(I)c(Cl)c1)[C@@H]1CCCCC[C@H]1Cl 2172547477 NZPMHTCECQXPBP-BXUZGUMPSA-N 426.125 4.957 50 10 IJGE COC[C@@]1([C@@H](Br)c2cc(Br)cc(Cl)c2OC)CCCO1 2203013819 YPAXLEHDGZYSBL-UONOGXRCSA-N 428.548 4.743 50 10 IJGE Clc1ccc(Br)cc1C[C@]12CO[C@](CI)(C1)C2 2216261243 FNLMHDUYHWZLLF-BETUJISGSA-N 427.507 4.629 50 10 IJGE COCCC1([C@H](Br)c2ccc(OC)c(I)c2)CC1 2257352380 CUKHFSDDBOAGLA-CYBMUJFWSA-N 425.104 4.553 50 10 IJGE CC(C)[C@H](Cl)C(=O)N1CCC(c2nc(-c3ccncc3)cc(=Nc3ccccc3)[nH]2)CC1 2296578169 MOGOBBKANZZQTD-QHCPKHFHSA-N 449.986 4.674 50 10 IJGE CCN(Cc1ccc(Cl)cc1I)C(C)(C)CBr 2302326326 OGLNEZXCPDHYBW-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE COc1cc(C=C2C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(F)cc1 2314611087 QEMALACJVVJCMT-UHFFFAOYSA-N 448.494 4.662 50 10 IJGE ClC[C@@]12CC[C@@H]1CN(Cc1ccc(I)c(Br)c1)C2 2325211602 KFJFRLKHIZIYFO-BXUZGUMPSA-N 440.550 4.505 50 10 IJGE CCc1cccc(C)c1NC=C(C#N)C(=O)Nc1ccc(I)cc1C 2325405964 AVBXBGXGZLSZPY-UHFFFAOYSA-N 445.304 4.929 50 10 IJGE CC1CC(CBr)(CN2C[C@@H]3CCC[C@@](N(C)C(=O)OC(C)(C)C)(C3)C2)C1 2334034495 AKPVIZPQZGLWKB-BWGXQHLSSA-N 429.443 4.909 50 10 IJGE Cc1scc(CN(C)c2ncc(Br)c(CCl)n2)c1Br 2343639450 SNCUHRMFYWRFEU-UHFFFAOYSA-N 425.577 4.747 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)NCC(C)(C)[C@H](Br)C(C)C 2365859391 APHOHAWREYEPAJ-GFCCVEGCSA-N 447.258 4.543 50 10 IJGE CC[C@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)COc1ccccc1C(C)C 10682313 CSLVROZOCBEZMT-NQIIRXRSSA-N 426.557 4.707 50 10 IJGE COc1ccc(C(=O)Oc2cc(/C=C(/C#N)C(=O)Nc3ccc(F)cc3)ccc2OC)cc1 33774141 RKIBQJXGECSVOJ-AQTBWJFISA-N 446.434 4.608 50 10 IJGE CCc1ccc(O[C@@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccs2)cc1 38656601 DKBYOKLZGYEOAF-NPMXOYFQSA-N 446.528 4.902 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2ccccc2C(C)(C)C)cc1 40987823 XXVNTBMIDHAQEE-CAPFRKAQSA-N 434.536 4.792 50 10 IJGE CC[C@H](Br)[C@@H](C)NC(=O)c1cc(Br)cc(Br)c1 386848773 ZAEAOOFOCUALJI-HQJQHLMTSA-N 427.962 4.503 50 10 IJGE Cn1ncc([C@H](Br)c2ccc(Cl)cc2Cl)c1I 393606487 ZPGASGCHZAZHME-SNVBAGLBSA-N 445.913 4.816 50 10 IJGE C[C@]1(CBr)CCCCN1c1ncc(Br)cc1Br 723019145 BQZKIPVVGKJUSC-GFCCVEGCSA-N 426.978 4.751 50 10 IJGE CCCCSc1ccc(C(=O)NNc2ccccc2S(C)(=O)=O)cc1C(F)(F)F 760918706 PSANWFWPIOEORJ-UHFFFAOYSA-N 446.516 4.758 50 10 IJGE O=S(=O)(c1cccc(S(F)(F)(F)(F)F)c1)N1CC[C@@H](Oc2ccncc2)C1 788701273 BHNOXILEICMYQL-CYBMUJFWSA-N 430.420 4.581 50 10 IJGE CC(C)c1ccc(OCC(=O)NN=Cc2c(O)ccc3ccccc23)c(Br)c1 1083948491 GYCXVTCWYCRLGL-UHFFFAOYSA-N 441.325 4.960 50 10 IJGE CCCOc1ccccc1C=NNC(=O)COc1ccc2ccccc2c1Br 1084347771 BRCSDOMGRLXVSI-UHFFFAOYSA-N 441.325 4.920 50 10 IJGE C=CCOCCCNC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1437775480 YDYVZWUKTDEEGR-UYRXBGFRSA-N 431.458 4.729 50 10 IJGE C=CC(=O)Nc1ccc(C(=O)NNc2c(Cl)cc(Br)cc2Cl)cc1 1444854821 PKSWKUWSPWXDNH-UHFFFAOYSA-N 429.101 4.637 50 10 IJGE CCc1nn(-c2ccc(OC)cc2)c2c1[C@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865701900 HOQLOPDSULYKIX-HSZRJFAPSA-N 443.551 4.508 50 10 IJGE CCc1nn(CC)c2c1[C@H](c1ccccc1OCc1ccc(Cl)cc1)C(C#N)=C(N)O2 1865703529 AJGGSEXQKJZIOT-OAQYLSRUSA-N 434.927 4.916 50 10 IJGE O=S(=O)(c1sccc1Br)N(Cc1ccccc1)C1(CCl)CCC1 1915760862 SYHVZDZGWABKBH-UHFFFAOYSA-N 434.808 4.863 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cccc(Br)c1 1916374118 GQIAZJWFUWNVMZ-KRWDZBQOSA-N 441.163 4.501 50 10 IJGE CC(C)(C)OC(=O)NCCCN(C[C@@H](CBr)C1CCC1)CC(F)(F)F 1966374276 QQFMEKYUVGWHDN-CQSZACIVSA-N 431.337 4.577 50 10 IJGE CN(Cc1cc(Br)ccc1Br)C[C@H](Br)C1CC1 2006499437 JIFGCAPTODRJQQ-ZDUSSCGKSA-N 425.990 4.817 50 10 IJGE FC1(CBr)CCN(Cc2ccc(Br)cc2Br)CC1 2039795733 YPWKFCVXYZNGIB-UHFFFAOYSA-N 443.980 4.911 50 10 IJGE C[C@@H]1OCC[C@H]1COc1c(Br)cc(Br)cc1CBr 2057465939 VEQMJOAGZTWMGA-IUCAKERBSA-N 442.973 4.910 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CN(C[C@@H](CBr)c3ccccc3)CC[C@H]21 2163062394 LAYMKFRTRNRVAS-VAMGGRTRSA-N 437.422 4.887 50 10 IJGE CCN(C(=O)[C@H](Br)C1CCCC1)[C@@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2167032813 OFZUVFJMNPXXFP-RCCFBDPRSA-N 445.442 4.872 50 10 IJGE O=C(c1c(Br)cccc1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Cl)C2 2190688642 XUCAGVSYORYBCE-RINBACNTSA-N 425.523 4.534 50 10 IJGE COc1cc(F)c([C@H](Cl)c2c(C)nn(C)c2Br)cc1Br 2202902836 WINQNRUEKBMDDY-LBPRGKRZSA-N 426.511 4.729 50 10 IJGE CCN(C[C@](C)(CI)OCCCCC(F)F)C(=O)OC(C)(C)C 2212213229 GIDHGXXMPPFCGY-INIZCTEOSA-N 449.320 4.889 50 10 IJGE Cc1c(Br)csc1C(=O)N1CC[C@@](CBr)(C(F)(F)F)C1 2234511356 ARUOAOXVKHLAKB-NSHDSACASA-N 435.103 4.609 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)Cc1ccc(C(F)(F)F)cc1Cl 2243963013 UOLWPSUUMKHYSS-GFCCVEGCSA-N 446.650 4.961 50 10 IJGE CC1CC(CBr)(CN(C[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)C1 2265311592 INBXDLPKJFPIBP-BATSVXPKSA-N 429.443 4.909 50 10 IJGE CN(C(=O)c1cc(Br)c(F)cc1Cl)[C@H](CBr)CC1CC1 2285849052 UNAWDDDHEVMGKH-VIFPVBQESA-N 427.539 4.877 50 10 IJGE C[C@H]1[C@@H](CBr)CCN1Cc1ccc(Cl)c(I)c1 2300240292 KIFFXXABILPAQL-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE CN(Cc1sccc1I)[C@@H]1CCCCC[C@H]1Br 2301068288 JYQHENGUKJHHAQ-ZYHUDNBSSA-N 428.177 4.881 50 10 IJGE Cl[C@@H]1CCCC[C@H]1NCc1ccc(I)c(Br)c1 2306232486 VLBUJJBDQGXRJA-DGCLKSJQSA-N 428.539 4.693 50 10 IJGE C[C@@H]1C[C@H](Br)CN(Cc2cc(I)ccc2Cl)C1 2307327523 BMSZJBVUOPFBMT-KOLCDFICSA-N 428.539 4.550 50 10 IJGE COc1cc(C=C(C#N)C(=O)NC(C)C)ccc1OC(=O)c1ccc(Cl)c(Cl)c1 2314740729 MIFDLOZTIYITPE-UHFFFAOYSA-N 433.291 4.653 50 10 IJGE CC1CC(CBr)(N(C)Cc2ccc(Cl)cc2I)C1 2318558055 QPPREANHSNLNDY-UHFFFAOYSA-N 442.566 4.940 50 10 IJGE Cc1cc(F)c(Br)cc1C(=O)N[C@H](CCCl)COCc1ccccc1 2320557475 FQMDWLJICDUFMV-OAHLLOKOSA-N 428.729 4.841 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(-c3ccc(Cl)cc3)nc2C)cc(OC)c1OC 2321213044 LRJYIHCFJPGKOX-UHFFFAOYSA-N 439.899 4.500 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(-c3ccc(Cl)cc3Cl)nc2C)ccc1O 2321242292 SCTVIJOBYBISCP-UHFFFAOYSA-N 430.291 4.842 50 10 IJGE CCCN1C[C@H](Cc2cc(I)ccc2Cl)[C@@H](Br)C1 2327407589 SNYJNVLJCLDGJE-AAEUAGOBSA-N 442.566 4.592 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2CC[C@H]3C[C@@H]2CO3)cc1I 2334463528 LAECCBRCWYEDSK-NWJSVONSSA-N 437.115 4.551 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CCCN(C[C@@]3(CBr)CC3(F)F)C2)C1 2351892674 SDXRIMPISIRZGT-ROUUACIJSA-N 437.369 4.520 50 10 IJGE C[C@H]1CCCN(C(=O)c2ccc(Cl)cc2I)[C@H]1CCCl 2365593187 SNYCBVXOYVHZMF-HZMBPMFUSA-N 426.125 4.814 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2-c1c(C)nsc1Br 2380355595 QZRVEZOVCJHBNN-UHFFFAOYSA-N 436.560 4.758 50 10 IJGE COc1ccc(/C=N/NC(=O)COc2ccc(C(C)(C)CC(C)(C)C)cc2)c(OC)c1 3084793 LPDIPLLAHCYTOJ-CVKSISIWSA-N 426.557 4.947 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2c[nH]nc2-c2ccccc2)sc2c1CCCC2 4113126 RNEXDXQHFMBJGJ-FOWTUZBSSA-N 446.532 4.739 50 10 IJGE NNC(=O)/C(=C/c1ccc(Oc2ccc(Cl)c(Cl)c2)cc1)NC(=O)c1ccccc1 34856802 DXPPRCPHRQKHIR-NDENLUEZSA-N 442.302 4.547 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccoc1C)CCC2 40823403 SMYPYCJHJGKGEG-YZSQISJMSA-N 435.480 4.529 50 10 IJGE COc1ccc(OC)c([C@@H](Br)c2ccc(I)cc2)c1 109842589 MWGIBGAFGKDURP-HNNXBMFYSA-N 433.083 4.793 50 10 IJGE N#C/C(=C/Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)NCCc1ccccc1 216707626 DQZRVFJVXRTWKQ-OWBHPGMISA-N 427.348 4.902 50 10 IJGE BrCc1cc(Br)c(O[C@@H]2CCCOC2)c(Br)c1 232484864 SYUAYOSXMULKOR-SECBINFHSA-N 428.946 4.664 50 10 IJGE CC(=NNC(=O)CSCc1ccc(Cl)cc1)c1cccc(NC(=O)C(F)(F)F)c1 254438542 YUIZGUJYRDVWFV-UHFFFAOYSA-N 443.878 4.614 50 10 IJGE CCCCCOc1ccc(O[C@H](C)C(=O)NN=Cc2cc(OC)ccc2OCC)cc1 254844167 XONVKNXGLOPWLA-GOSISDBHSA-N 428.529 4.581 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)NNc1ccc(Br)c(F)c1)O[C@H](C)C2 771678485 FSUDFVCKSGFSPG-DIOULYMOSA-N 449.320 4.557 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)O[C@H]2COc3cc(Cl)ccc32)c(-c2ccccc2)n1 774517485 GBXMVUIBRXVIFW-BVZCLVNKSA-N 444.878 4.701 50 10 IJGE COc1cc(Cl)ccc1COC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 795318814 ANZQMQGFMPRXIS-UNOMPAQXSA-N 446.894 4.776 50 10 IJGE N#Cc1ccc(OCc2cccc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c2)cc1 799753118 OHDJLDICFSIMAQ-UHFFFAOYSA-N 436.393 4.785 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCCCc2nc3ccccc3s2)c(C)n1C[C@H]1CCCO1 1087661252 TYVLARLRIBOMGC-JCZXDDDQSA-N 448.592 4.550 50 10 IJGE C=C1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 1301269479 PGWCTHVPAXLEJU-BOQARNTCSA-N 431.927 4.734 50 10 IJGE CCOc1ccc(OC)cc1C=NNC(=O)[C@@H](C)Oc1ccc(OCc2ccccc2)cc1 1565517699 TVWQKCISGOHBCG-LJQANCHMSA-N 448.519 4.591 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)c1C 1648570732 ZEMXSBLGZRNYTD-WBVHZDCISA-N 425.895 4.585 50 10 IJGE CCc1cccc(OCC(=O)NN=Cc2ccc(OCc3ccccc3C)c(OC)c2)c1 1772753444 HHULCGVFIOLPPB-UHFFFAOYSA-N 432.520 4.674 50 10 IJGE Cc1cc([C@H](CC(=O)N[C@@H](C)C(=O)Nc2ccc(SC#N)cc2)C(C)C)ccc1F 1866758418 VYUBCPGQGNXGLZ-OXJNMPFZSA-N 427.545 4.980 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CN(C(=O)OC(C)(C)C)C12CCCCC2 1883178940 DWDBWAOWJCXTES-CABCVRRESA-N 447.414 4.844 50 10 IJGE CC(C)CC(CC(C)C)O[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1I 1899502780 GYLGXAUOEUAWEH-HOTGVXAUSA-N 439.378 4.887 50 10 IJGE CN(C(=O)c1scc(Br)c1Br)C1(CCBr)CC1 2015859157 DIJRDFOJTGYNFB-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE CC[C@@H](C)[C@H](CBr)NCc1cc(Cl)ccc1I 2023040725 IRSPPFOLIIMJDR-RNCFNFMXSA-N 430.555 4.844 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Cl)c2)[C@H]1CBr 2026564555 UUAPGQSPKUCQJN-LBPRGKRZSA-N 428.539 4.550 50 10 IJGE F[C@]1(CBr)CCCN(Cc2c(Br)cccc2Br)C1 2039797622 XFHONCJFMMSCCF-ZDUSSCGKSA-N 443.980 4.911 50 10 IJGE CCCN(C[C@H](Br)C(F)(F)F)C1CCC(NC(=O)OC(C)(C)C)CC1 2044696226 KBTSXTODCBMSPJ-RUXDESIVSA-N 431.337 4.860 50 10 IJGE FC(F)Oc1ccc(OC(F)(F)F)c(I)c1CBr 2060226391 ZGCIBBHIBFWRQT-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE CCC(CC)(CBr)CN=[S@@](C)(=O)C1CC(CNC(=O)OC(C)(C)C)C1 2072485611 HSIUYWMPGBCMRS-VIYKHHQCSA-N 439.460 4.589 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2Cc1nccn1Cc1ccccc1 2090020464 CELOJUPUXHAJGE-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Br)c2cc(Br)ccc2F)c1 2093073433 BLGHDVRVDBNPIK-LBPRGKRZSA-N 428.142 4.538 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@@H]2C[C@@H](Cl)CC[C@H]21 2093947451 WTQBECOTSTZUCA-KHQFGBGNSA-N 427.589 4.895 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]23CCC[C@@]2(CN(C[C@@H](CBr)C(C)(C)C)C3)C1 2106780901 COOVRUORVKGZKK-HBGVWJBISA-N 429.443 4.767 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@@H]1CCCCN(C(=O)OC(C)(C)C)C1 2112846760 JSVKGJQMNKZDPD-RBUKOAKNSA-N 425.411 4.887 50 10 IJGE BrC[C@@]12CCC[C@@H](CN(Cc3ccc(I)cc3)C1)C2 2134964277 GNTCFRZYHMPKAZ-ZBFHGGJFSA-N 434.159 4.678 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCCC[C@H]1CN(C[C@H](CBr)c1ccccc1)C2 2169634115 OOQLNCGOWPUPJG-IPJJNNNSSA-N 437.422 4.934 50 10 IJGE Cc1c(Cl)cc(CN2C[C@@H](C)O[C@H](CCBr)C2)cc1Br 2179379843 CCRXTZGZSFFAMA-ZWNOBZJWSA-N 425.592 4.785 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2CCc1nccn1Cc1ccccc1 2184921724 AZQDZEOCJHLQQA-UHFFFAOYSA-N 444.764 4.729 50 10 IJGE Cc1nn(C)c(Br)c1COc1c(F)cc(Br)cc1CCl 2185794168 JCLDMKAMAHNEAR-UHFFFAOYSA-N 426.511 4.710 50 10 IJGE CS(=O)(=O)c1ccc([C@H](Cl)c2ccc(Br)cc2Br)cc1 2203683147 KHGGGXCQGXBHSO-AWEZNQCLSA-N 438.568 4.943 50 10 IJGE CC(C)(CCl)N(Cc1ccccc1)S(=O)(=O)Cc1ccccc1Br 2213761653 ZVMKZDLEFILGJG-UHFFFAOYSA-N 430.795 4.799 50 10 IJGE COc1ccc([C@H](Br)[C@H](F)C(F)(F)F)cc1I 2248896844 VUVYCGWKNGTNMN-IUCAKERBSA-N 426.973 4.636 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)CCc1cccc(OC(F)(F)F)c1 2249827407 CWOCMZDTMDWPGJ-ZDUSSCGKSA-N 442.231 4.578 50 10 IJGE CCOc1c(Br)cc(CN[C@H]2C[C@H](Br)C2)cc1Br 2263391294 OEDBUNFUKPMGRD-MGCOHNPYSA-N 441.989 4.626 50 10 IJGE O=C(Nc1cccc(CCBr)c1)c1c(F)cccc1I 2282810191 VXXDBBYUHPUJRD-UHFFFAOYSA-N 448.073 4.620 50 10 IJGE Cc1cc(Br)c([C@H](Cl)C2CC(S(C)(=O)=O)C2)c(C)c1Br 2285271672 OOPCGYOQZBRIFW-RPFQZYLTSA-N 444.616 4.932 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2C1[C@H]2CN(Cc3ccccc3)C[C@H]12 2286083585 IZDLNUOSSDXFQK-GJZGRUSLSA-N 446.776 4.849 50 10 IJGE Cc1cc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)cc(CBr)n1 2288422657 NIFUGVQEKCGCEG-QQUTXWOLSA-N 426.402 4.632 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CC[C@@H]2[C@@H](CCN2C(=O)OC(C)(C)C)C1 2297084587 DKDNOIRHHSBGMX-FXUDXRNXSA-N 447.414 4.700 50 10 IJGE C[C@H](NC(=O)C(C#N)=Cc1c[nH]nc1-c1ccc(Br)cc1)c1ccc(F)cc1 2297435329 CZRAEMMJAVSIDG-ZDUSSCGKSA-N 439.288 4.763 50 10 IJGE C[C@@H](Br)CCCN(C)C(=O)c1csc(Br)c1Br 2299512020 YCXKQBZZVITTNT-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE CC(C)(C)[C@](C)(CBr)CN1CC2(CC(NC(=O)OCc3ccccc3)C2)C1 2307108791 HFHXGQZAVUPGFG-OAQYLSRUSA-N 437.422 4.825 50 10 IJGE O=C(C=Cc1ccc(Cl)cc1)NNC(=O)CCCOc1ccc(Cl)cc1Cl 2313864118 AKTYXPGILWSZAZ-UHFFFAOYSA-N 427.715 4.667 50 10 IJGE CNC(=O)C(C#N)=C1S[C@H](Cc2cccc(Cl)c2)C(=O)N1c1ccc(C(C)C)cc1 2314593465 NDYPJOILHSMYBB-HXUWFJFHSA-N 439.968 4.636 50 10 IJGE CC[C@@H](NC=C(C#N)C(=O)N[C@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 2325044898 DVGWFEJTONCTNB-HOYKHHGWSA-N 447.579 4.908 50 10 IJGE Cc1c(CN(Cc2ccccc2)[C@@H](CBr)C2CC2)cnn1CC(F)(F)F 2342660835 BCYMVLGTXDRRFL-SFHVURJKSA-N 430.312 4.930 50 10 IJGE Cc1ccccc1Oc1nc2ccccn2c(=O)c1/C=C(\C#N)c1nc2ccccc2n1C 35549931 ZSFAAOIVKAARRK-OBGWFSINSA-N 433.471 4.746 50 10 IJGE Cc1cc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccc4ccccc24)CCC3)no1 40813627 YXVLIQZAOUUOJA-ZXVVBBHZSA-N 442.475 4.760 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2ccc(C)cc2)ccc1OC(=O)/C=C\c1ccccc1 59500485 GIWROVZCMJJBIL-OVTCYPRGSA-N 428.488 4.776 50 10 IJGE COc1cccc(N/C=C(/C#N)c2nc(-c3cc4cc([N+](=O)[O-])ccc4oc3=O)cs2)c1 100373583 NURRBFUDZVPPBF-KAMYIIQDSA-N 446.444 4.810 50 10 IJGE C[C@@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC/C2=N/NC(=O)c1cccc([N+](=O)[O-])c1 105436442 PEVAPRZFSJGMGN-DVWXMSKQSA-N 433.508 4.943 50 10 IJGE CSCC[C@@H](C)n1c(CCCl)nc2cc(I)c(F)cc21 131556813 XUTDNYKYZYUGMQ-SECBINFHSA-N 426.726 4.875 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1Cl)/C(=C/c1cccs1)NC(=O)c1ccccc1 252602785 FLOGWQKFERMLIW-NXRABTBVSA-N 444.343 4.976 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(OC(C(F)(F)F)C(F)(F)F)C1 301945356 BAZBSMRHUQJAOY-LBPRGKRZSA-N 444.210 4.661 50 10 IJGE CC[C@H](Br)[C@H](CC)NC(=O)c1cc(Br)c(Br)s1 313102116 FYQLCUGIVXHQRE-XPUUQOCRSA-N 448.018 4.955 50 10 IJGE CC[C@@H](Br)CCCNC(=O)c1cc(Cl)ccc1I 398570612 PJVKGMBLKFGBCJ-SECBINFHSA-N 444.538 4.628 50 10 IJGE CCN(C(=O)c1cc(Br)c(Br)s1)C(C)(C)CBr 688310487 JADHYVMRHCDOOT-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE ClCc1c(Br)cccc1N1CC[C@]2(CN(Cc3ccccc3)CCO2)C1 717594546 RBDREMGHIMCICI-NRFANRHFSA-N 435.793 4.669 50 10 IJGE C[C@H](NC(=O)NNc1nc(Cl)c(Cl)cc1Cl)c1ccc(-n2cccn2)cc1 745925043 BQPTWMIRPJDMME-JTQLQIEISA-N 425.707 4.615 50 10 IJGE Cc1cc(C)c(CNC(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(Cl)c3)c2C)c(O)n1 790437113 DAMKGAHSNOKTEO-GRSHGNNSSA-N 434.927 4.688 50 10 IJGE COc1ccc(SCC(=O)NN=Cc2ccc(-c3ccc(C(=O)O)c(Cl)c3)o2)cc1 1084492401 WUPVTQKCZDFOCD-UHFFFAOYSA-N 444.896 4.549 50 10 IJGE BrC[C@H](CN1CCC[C@@H]1c1ccc(I)cc1)C1CC1 1307642799 INHVKEHYSGQXFL-GDBMZVCRSA-N 434.159 4.849 50 10 IJGE C/C(=C\C(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1)c1ccc(C(F)(F)F)cc1 1641071637 OXIMROGKJUCJIC-MDJJKAFGSA-N 442.437 4.877 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865684372 XQYGHRYRWJYDIV-JOCHJYFZSA-N 447.970 4.821 50 10 IJGE CCCc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1cccs1)C(C#N)=C(N)O2 1865697848 CXSHJIHLXXOZDD-GOSISDBHSA-N 428.920 4.956 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2)[C@@H]1c1ccccc1[N+](=O)[O-] 1865709355 AIMOOGVQMUPGMS-OAQYLSRUSA-N 435.443 4.666 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)N/N=C\c1ccc2c(c1)OCCO2 1865760648 IKJYKPOWCMERDB-ROTLSHHCSA-N 442.302 4.899 50 10 IJGE Fc1cc(Br)c2nc(CCl)n(Cc3csnc3Br)c2c1 1925105674 KABSJXIROZOVRZ-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE CCCN(CCCBr)C(=O)c1cc(Br)c(Br)s1 1944436206 GOQRNKFSTIMXEI-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE ClC[C@H]1CCCC[C@H]1Nc1ncc(I)cc1Br 2015756820 LDUDJUXEPOTEPJ-LDYMZIIASA-N 429.527 4.658 50 10 IJGE CCN(Cc1ccc(I)c(Cl)c1)C(C)(C)CBr 2026565450 BGKQVKUEEGNZRC-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE CCCn1c(CBr)nnc1-c1c(Br)cccc1Br 2033095747 PXVUXHBDTXIGDB-UHFFFAOYSA-N 437.961 4.775 50 10 IJGE Cc1cc(C(=O)C(C#N)=Cc2ccc(N3CCOCC3)cc2)c(C)n1-c1ccccc1F 2040448174 DKUHBGQZXKBALP-UHFFFAOYSA-N 429.495 4.860 50 10 IJGE CC(C)[C@@H](Br)[C@@H](C)NC(=O)c1cccc(Br)c1Br 2041302464 DAUBWEUMPFSPDO-LDYMZIIASA-N 441.989 4.749 50 10 IJGE FC(F)[C@@H]1C[C@H]1[C@H](Br)c1cc(I)cc2c1OCC2 2041791473 ALTJHQICKBYXRA-KKZNHRDASA-N 429.042 4.563 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1C(=O)c1cc(Br)ccc1Br 2073311422 AIHGTFHEDNNWML-PELKAZGASA-N 439.973 4.600 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1ccc(Cl)c(Br)c1 2090384424 IDVMVCKIYGCYRS-JTQLQIEISA-N 429.605 4.739 50 10 IJGE CC(F)(F)[C@@H]1C[C@H]1[C@@H](Br)c1cc(I)cc2c1OCC2 2108180927 FRKVWIIOCBGLKO-YUSALJHKSA-N 443.069 4.953 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)[C@@H]1CCCCN(C(=O)OC(C)(C)C)C1 2112846761 JSVKGJQMNKZDPD-RTBURBONSA-N 425.411 4.887 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C(F)(F)F)N(C[C@H](CBr)CC2CC2)CC1 2112870433 CPHQKSGINMRYQL-LSDHHAIUSA-N 443.348 4.671 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2C[C@@H]1CCN(Cc2ccccc2)C1 2184942361 RPVGZPGWTZYTBQ-QGZVFWFLSA-N 447.808 4.806 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)c1cccc2c1CCCN2C(=O)OC(C)(C)C 2196914651 PKRZCSFBOPCCHX-SHTZXODSSA-N 437.378 4.620 50 10 IJGE C[C@@H](CCCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(Br)c1 2217391603 CPHJANJCARPBAD-ZDUSSCGKSA-N 434.758 4.797 50 10 IJGE Clc1ccc(I)c(CN2[C@H]3CC[C@H](Br)[C@H]2CC3)c1 2222301910 NHRWTQBBVARLLU-SGMGOOAPSA-N 440.550 4.835 50 10 IJGE C[C@@H]1C[C@@H](Br)[C@@H](C)N(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285847494 BYPLLCPXOMEVKE-NQMVMOMDSA-N 427.539 4.876 50 10 IJGE COC(=O)c1cccc(-n2c(C)cc(C=C(C#N)C(=O)Nc3ccccc3F)c2C)c1C 2297533937 DRZWKEGEQYXIGQ-UHFFFAOYSA-N 431.467 4.874 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2ccc3nc(Cc4ccccc4)[nH]c3c2)cc1OC 2323721347 LZHPGKUZMYZKJJ-UHFFFAOYSA-N 442.519 4.715 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2C[C@@H](Br)C[C@H]2C1 2327407186 PGTATQRPRDENLK-PEGIJTEDSA-N 440.550 4.550 50 10 IJGE FC(F)(CCl)C(F)(F)CNCc1ccc(Cl)cc1I 2341043953 AGLNLAFQSQVSIX-UHFFFAOYSA-N 430.010 4.544 50 10 IJGE Clc1nccc(N2CC[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1CBr 2344698324 JLUJHRQIQYJZAP-MSOLQXFVSA-N 434.809 4.978 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@](C)(CBr)C(C)(C)C)C2(CCOCC2)C1 2380199479 MLKCPETXVWBUEV-FQEVSTJZSA-N 447.458 4.536 50 10 IJGE CCCOc1ccc(/C=N/NC(=O)COc2ccccc2Br)c(OCCC)c1 20595459 PJMMOOWPARWALB-OEAKJJBVSA-N 449.345 4.556 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccc(Cl)cc3)ccc2[C@H]1c1cccc([N+](=O)[O-])c1 38653414 SEKWNAXGJZNNGH-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE COc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)Oc3ccc(C)cc3)c(C)c21 40813224 NQCMXNJFVASACX-LGUFXXKBSA-N 432.476 4.595 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1OCc1ccccc1F 207054909 XNVLIDHHBLDROR-WQRHYEAKSA-N 447.422 4.867 50 10 IJGE CC1=C(C#N)C(=O)N(C(C)C)C(=O)/C1=C\c1cn(-c2ccccc2)nc1-c1ccc(C)cc1 214247750 AHFZNTJWEQDRGR-UCQKPKSFSA-N 436.515 4.848 50 10 IJGE CC[C@@H](C)N1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccccc3)c(OC)c2)C1=O 214265559 ZJPMXPQWVUETIE-OJSPLJLUSA-N 430.504 4.665 50 10 IJGE N#C/C(=C/NCCc1ccccc1Br)C(=O)Nc1ccc(Cl)cc1Cl 217178330 ZKXQFCQCIDFCEI-QBFSEMIESA-N 439.140 4.934 50 10 IJGE COc1cc(C=NNC(=O)c2cc(-c3ccccc3C)nc3ccccc23)cc(OC)c1O 252620872 MODYXTHZDVMGCI-UHFFFAOYSA-N 441.487 4.697 50 10 IJGE COc1ccc(C(=O)Oc2ccc(C=NNC(=O)COc3ccc(C(C)C)cc3)cc2)cc1 254378156 DTHLENIXMCCJSI-UHFFFAOYSA-N 446.503 4.567 50 10 IJGE BrCc1c(N2CC[C@H]3[C@@H](CCCN3Cc3ccccc3)C2)nc2sccn12 715015000 MYSHJBWHNYNPAQ-ROUUACIJSA-N 445.430 4.782 50 10 IJGE CC[C@H](O[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1)C1CCC1 719658317 UFZDGUUHXFTUTN-YJBOKZPZSA-N 437.362 4.786 50 10 IJGE COc1ccc(Cl)cc1[C@H](CC(C)C)NC(=O)NNC(=O)c1cccc2cccnc12 738467733 KLUXFLYDOXDDJZ-IBGZPJMESA-N 440.931 4.628 50 10 IJGE COC(=O)c1ccoc1CSc1ccccc1C(=O)NNc1ccc(F)c(F)c1F 748219316 FCSZYHZYNGWWRY-UHFFFAOYSA-N 436.411 4.533 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(Cl)cc2)c([N+](=O)[O-])cc1OCc1ccccc1 767028007 HYPMAGDGWPMGIF-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE CC(C)(C)OC(=O)N1CCc2ccc(C(=O)NNc3c(F)cccc3Cl)cc2CC1 789208298 FXHIJTDSFCCFCQ-UHFFFAOYSA-N 433.911 4.572 50 10 IJGE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)Cc1ccc2ccccc2c1 1182367602 YHUWKQRVKDDSMC-QINSGFPZSA-N 428.410 4.532 50 10 IJGE CC(=O)c1cc(NC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)ccc1C 1310930545 IYRVNHRGVDDMKB-UHFFFAOYSA-N 438.311 4.516 50 10 IJGE C=CCOc1ccc(CNC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 1525527546 RYHAEXUXEZFZDS-KQWNVCNZSA-N 441.531 4.891 50 10 IJGE Cc1c(C(=O)N2CCCCCC2)oc2c1C(=NNC(=O)c1ccc(Cl)cc1)CCC2 1772743617 GPILQGZYVBNGPS-UHFFFAOYSA-N 427.932 4.728 50 10 IJGE CC(C)Oc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2-c1ccccc1 1865705199 OLNXNUZAHNOPBN-SFHVURJKSA-N 440.425 4.896 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@@H]1c1ccccc1O 1865707879 IKGCCWKTKZVLCY-MRXNPFEDSA-N 446.816 4.527 50 10 IJGE CCC[C@@H](NC(=O)c1cc(C)n(-c2cccc(C)c2)n1)C(=O)Nc1ccc(SC#N)cc1 1866840528 UKOXAAKCUAKJPF-OAQYLSRUSA-N 447.564 4.600 50 10 IJGE CC1(C)COCCN1c1cc(Nc2ccc(SC#N)cc2)nc(Cc2ccccc2)n1 1868207009 CDFCFYKPDDBOEI-UHFFFAOYSA-N 431.565 4.999 50 10 IJGE COc1cccc(-c2nc(Nc3ccc(SC#N)cc3)cc(N3CCOC[C@@H]3C)n2)c1 1868506397 WYNBHAFEQNPLNR-INIZCTEOSA-N 433.537 4.694 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)c3ccc(Cl)nc3)n2)c(OC)c1OC 1872759606 UHLGTCDERNAEBL-LGMDPLHJSA-N 429.885 4.834 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2[C@H]3CCOC[C@@H]32)s1 1900919357 MNEKBUOHAYFTHB-DWAQLAQLSA-N 433.536 4.725 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)[C@H](C)CCBr)c(OC)c1OC 1915091550 YRXWHFZHSRDALS-OAHLLOKOSA-N 436.346 4.528 50 10 IJGE C[C@H](Nc1ncc(I)cc1Br)[C@@H]1CCC[C@@H]1Cl 2015759067 QEKUSUOABRHZKB-ARENWVFISA-N 429.527 4.657 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](Br)C(F)(F)F)C2(CCCCC2)C1 2044704951 HRGRUAWNGUQOJR-CYBMUJFWSA-N 429.321 4.568 50 10 IJGE BrC[C@@H]1C[C@H]2CN(Cc3cc(Br)ccc3Br)C[C@@H]12 2054712058 HWGQNTSNTSSKBD-KWBADKCTSA-N 438.001 4.674 50 10 IJGE FC(F)(F)c1c(I)c(CCl)nn1-c1cnccc1C1CC1 2078881072 PEHDLQSXKWQKPW-UHFFFAOYSA-N 427.595 4.507 50 10 IJGE CC(C)[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1c1ccccc1 2106785804 QXXGPKAXIPKNKV-OALUTQOASA-N 425.411 4.948 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H]3CC[C@@H](CN3C[C@H](CBr)C(C)(C)C)[C@H]2C1 2106788887 UHIGIMVZKLBFDX-JCECYMMASA-N 429.443 4.621 50 10 IJGE O=C(NCC1CC2(CC(Cl)C2)C1)c1scc(Br)c1Br 2108258196 GKVROMROSZEDLE-UHFFFAOYSA-N 427.589 4.801 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccccc2)CCN1c1ncc(Br)cc1CCl 2130165874 IHFLNHACPGBXKN-INIZCTEOSA-N 448.714 4.836 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@H](Br)c2cc(Br)c(Cl)s2)C1 2137224882 DZZKFFAPCLSRAO-HNBZJPLGSA-N 448.629 4.815 50 10 IJGE CN(Cc1ccccc1)[C@@]1(Cn2c(CCl)nc3cccc(Br)c32)CCOC1 2155116176 QWQNLHZGWKSLKR-OAQYLSRUSA-N 448.792 4.829 50 10 IJGE CN([C@H]1CC[C@@H]1OCc1ccccc1)S(=O)(=O)c1cc(F)c(Cl)c(CCl)c1 2156441240 FFEGKLOHYBIMNL-ROUUACIJSA-N 432.344 4.586 50 10 IJGE Cn1ncc(Br)c1-n1c(CCl)nc2cc(Br)c(Cl)cc21 2159873078 CODLSSWSFSQTMJ-UHFFFAOYSA-N 438.938 4.676 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@H](CBr)C2CCC2)C[C@@H]1c1ccccc1 2163060174 ZYRDPYQGERNHID-VAMGGRTRSA-N 437.422 4.790 50 10 IJGE Brc1ccccc1[C@H](CI)OC1CC(n2cccn2)C1 2183662574 KRLRHOHQAXNBBU-QOZQQMKHSA-N 447.114 4.542 50 10 IJGE FC(F)(F)CN(c1c(CBr)ccc(Br)c1Cl)C1COC1 2196634312 SPWIFFXURZEHBB-UHFFFAOYSA-N 437.481 4.765 50 10 IJGE CN(CC[C@@H](O)c1ccc(Br)cc1Cl)C[C@H]1C[C@H](Br)C1 2196945373 SPADZOUKYRKVOP-IXPVHAAZSA-N 425.592 4.631 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@H]2C[C@@H]([C@H](F)CBr)C2)cc1Br 2199058462 OFRSNUQIRGPURF-DFAYQTQMSA-N 427.539 4.652 50 10 IJGE C[C@@](CBr)(OCCOCCOCCOCc1ccccc1)c1ccccc1 2236090508 YNDRXVFLLUCROM-QFIPXVFZSA-N 437.374 4.563 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1C(=O)c1scc(Br)c1Br 2251004839 SNWIMIXQLXDEOA-POYBYMJQSA-N 446.002 4.661 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CCSC[C@@H]1CCBr 2253545033 IUJXNDOGBGQLMK-ZETCQYMHSA-N 433.618 4.507 50 10 IJGE COc1ccc([C@H](Br)[C@H]2C[C@H]2C(F)(F)F)cc1I 2257353557 HUJMBIBYOABKKU-RNSXUZJQSA-N 435.021 4.934 50 10 IJGE O=S1(=O)CC[C@@H]([C@@H](Br)c2cc3sc(Br)cc3s2)C1 2263618589 RFOPNPIWPRTROZ-KSBSHMNSSA-N 430.208 4.596 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2COC3(CCC3)C2)cc1I 2269555807 YYYNGMQSNHUNCB-BXUZGUMPSA-N 437.115 4.695 50 10 IJGE C[C@@H]1C[C@@H](CBr)CCN1C(=O)c1cc(Br)c(F)cc1Cl 2285846751 RRIKBDTWMAZQBA-BDAKNGLRSA-N 427.539 4.877 50 10 IJGE CC[C@@H]1[C@H](CBr)CCN1C(=O)c1cc(Br)c(F)cc1Cl 2285958888 RRHHDZLSIXRBMQ-ISVAXAHUSA-N 427.539 4.877 50 10 IJGE CP(C)(=O)[C@@H]1CN(c2c(CBr)ccc(Br)c2Cl)CCO1 2289318812 FJLDABRBZUXJGV-LLVKDONJSA-N 445.519 4.783 50 10 IJGE COCCCN1C(=O)C(=CNc2ccc(N=Nc3ccccc3)cc2)C(C)=C(C#N)C1=O 2314579157 LCQKJECQONDHEU-UHFFFAOYSA-N 429.480 4.643 50 10 IJGE CCCCOc1ccc(C=C2C(=O)N(Cc3ccc(F)cc3)C(=O)C(C#N)=C2C)cc1OC 2314621154 ZVBGSHXYMOFOGQ-UHFFFAOYSA-N 448.494 4.806 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)C=Cc4ccccc4)ccc32)cc1 2314640696 OKQPNENPIVUNBJ-AREMUKBSSA-N 438.483 4.922 50 10 IJGE Cc1ccccc1C[C@H](Br)c1c(Br)c(Br)nn1C 2316700502 CDHCZTGXWSHEHK-JTQLQIEISA-N 436.973 4.932 50 10 IJGE N#CC(=CNC1CCN(Cc2ccccc2)CC1)C(=O)Nc1cccc(Cl)c1Cl 2324381135 QSQWCQXCKKVWNE-UHFFFAOYSA-N 429.351 4.594 50 10 IJGE COc1ccc(/C=N/NC(=O)Cc2ccc(Cl)cc2)cc1CN1CCCc2ccccc21 3064486 KWWCQAFKFSEBKV-OGLMXYFKSA-N 447.966 4.994 50 10 IJGE CC[C@H](C)Oc1ccc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)cc1 10291757 NSCKKYPORZJJQA-AWEZNQCLSA-N 439.339 4.791 50 10 IJGE COc1cccc(-c2nn(-c3ccccc3)cc2/C=C(/C#N)C(=O)NCc2ccccc2)c1 35446348 IVLCIWCWHZUHPR-JCMHNJIXSA-N 434.499 4.771 50 10 IJGE Cc1ccc(-n2c(SCC(=O)NN)nc(-c3ccccc3)c2-c2ccccc2)cc1C 35666741 PIAWKVVOIYEANM-UHFFFAOYSA-N 428.561 4.905 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(Cl)c4)ccc32)cc1 38650390 IYGLEHVJHDWFMX-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE Cc1cc(Cl)ccc1Nc1ncnc(NNC(=O)c2ccc(Cl)cc2Cl)c1N 40703368 NCEMWXDUWRFALK-UHFFFAOYSA-N 437.718 4.828 50 10 IJGE Cc1c(C(=O)Nc2cccc3ncccc23)oc2c1/C(=N/NC(=O)c1ccccc1)CCC2 40804351 JWYCUQPOILOYLK-XHLNEMQHSA-N 438.487 4.859 50 10 IJGE CC(C)c1ccc(/C=C(/C#N)C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)cc1 89893383 ITUIFSCNMZQWSF-QNGOZBTKSA-N 437.565 4.530 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccc(CBr)c(Br)c2)C1 96304777 VTXVXXBPDQQFDM-CYBMUJFWSA-N 435.156 4.732 50 10 IJGE CC1=C(C#N)C(=O)N(C)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1ccc2ccccc2c1 101332185 BNFOHKFNNHTZIM-BUVRLJJBSA-N 444.494 4.915 50 10 IJGE CCCCCCCCCC[C@@H](Oc1ccc(N2CCS(=O)(=O)CC2)cc1)C(=O)Cl 205171321 VYWXKUCFWXEDLQ-OAQYLSRUSA-N 444.037 4.965 50 10 IJGE ClCc1ccc2sc(I)c(I)c2c1 306895131 LZDYKBWGJNWBKB-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE ClCc1ccc(N2CC[C@@H](N3CCN(Cc4ccccc4)CC3)C2)cc1Br 380085242 JWMDNJIKILPGIN-OAQYLSRUSA-N 448.836 4.584 50 10 IJGE ClCc1ccc(Br)cc1N1CCO[C@H]2CCN(Cc3ccccc3)C[C@@H]21 404141003 FUMMNFMIXLGDHS-SFTDATJTSA-N 435.793 4.668 50 10 IJGE CCOC(=O)O[C@]1(C(=O)OCCl)CC[C@@H]2[C@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@@]21C 725239821 FVOOBFFVLCZGIJ-IHDINZNASA-N 448.943 4.866 50 10 IJGE Cc1cc(C)cc(-n2c(C)cc(C=NNC(=O)COc3ccc4ccccc4n3)c2C)c1 1084462726 LSOPDYLCMQYCHV-UHFFFAOYSA-N 426.520 4.788 50 10 IJGE C#CCO[C@H](C)C(=O)Nc1cc(Br)ccc1CO[Si](C)(C)C(C)(C)C 1539030711 YNROTVUOFPFQLU-CQSZACIVSA-N 426.427 4.948 50 10 IJGE CC(=O)c1cc(C(=O)NNC(=O)c2cc(-c3ccc(Cl)cc3)nc3ccccc23)cs1 1540694208 JSDCFOKPLRZRRE-UHFFFAOYSA-N 449.919 4.894 50 10 IJGE Cc1ccc([C@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)cc1[N+](=O)[O-] 1614689530 BHAVFUQYDCQFEI-QZTJIDSGSA-N 433.302 4.650 50 10 IJGE C#CC1CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)CC1 1643525497 JPDCEJGFZOMPHK-DEDYPNTBSA-N 425.454 4.892 50 10 IJGE N#C/C(=C\c1cccc(F)c1)C(=O)Nc1c(Br)cc(C#N)cc1Br 1866131534 ZMTKDQYACXSDKE-UUILKARUSA-N 449.077 4.768 50 10 IJGE CC(C)(C)OC(=O)N[C@@]12CCC[C@]1(F)CN(Cc1ccc(CBr)cc1)C2 1893715723 FBQQERTWDHPXDD-VQTJNVASSA-N 427.358 4.553 50 10 IJGE BrCC1(Cc2cccc(Br)c2Br)CCOCC1 1943885578 QWGHRDXZMDWOJD-UHFFFAOYSA-N 426.974 4.946 50 10 IJGE C[C@@H](C[C@@H](C)Br)NC(=O)c1cccc(Br)c1Br 1943887236 NSVIRFYCTPNTPO-SFYZADRCSA-N 427.962 4.503 50 10 IJGE BrCCCN(Cc1c(Br)cccc1Br)C1CC1 1945321532 HHHUYUIUOUBMOV-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE CCC(CC)(CBr)CN1C[C@H](C(F)(F)F)[C@@H](NC(=O)OC(C)(C)C)C1 2044693246 JANOJUPWXQIPGZ-STQMWFEESA-N 431.337 4.575 50 10 IJGE CCCN(CC1CCN(C(=O)OC(C)(C)C)CC1)C[C@H](Br)C(F)(F)F 2044701055 UAYGHXBRXOEDOP-AWEZNQCLSA-N 431.337 4.671 50 10 IJGE O=C(NC[C@H](Br)CC(F)(F)F)c1cc(Br)c(Cl)s1 2055499470 HQNZPBYBQFQDPB-SCSAIBSYSA-N 429.483 4.610 50 10 IJGE FC(F)c1cc(I)cc(CCl)c1I 2060240041 IDLNUVNKXPXRBO-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE Brc1ccc([C@H](CI)OC[C@@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)cc1 2134539236 KAVAGYWYUXTZBU-OVCQRUGDSA-N 433.127 4.844 50 10 IJGE CCN(C(=O)c1ccc(CBr)cc1)[C@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C 2162915148 JJYRACZAFCYKBP-MSOLQXFVSA-N 439.394 4.737 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1cccc2c1CCCN2C(=O)OC(C)(C)C 2196907303 PKRZCSFBOPCCHX-UHFFFAOYSA-N 437.378 4.620 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CC[S@](=O)(=NCCCCCCBr)C1(C)C 2223292823 ZYVMCAHRJFOJPC-SGANQWHYSA-N 439.460 4.733 50 10 IJGE CN[C@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@H](Br)C1 2260113333 FFOIOKDRMJSDEG-WPOIXZHQSA-N 447.943 4.924 50 10 IJGE O=C(NCC1(CBr)CC(F)(F)C1)c1ccc(Br)cc1Cl 2281656430 KOOAVXKTALHXFS-UHFFFAOYSA-N 431.502 4.643 50 10 IJGE N#CC(=Cc1ccc(OCc2ccc(Cl)cc2Cl)c(Br)c1)C(N)=O 2297558822 KJACUYUFGCFDRU-UHFFFAOYSA-N 426.097 4.727 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C2CCC3(CC2)CC[C@@H](CI)O3)C1 2307683654 NJULSESTESUHLM-IOSXPMGOSA-N 449.373 4.786 50 10 IJGE COc1ccc(CCN2C(=O)C(=CNc3cccc4ccccc34)C(C)=C(C#N)C2=O)cc1 2314579432 SPJKOYIMLLHKJM-UHFFFAOYSA-N 437.499 4.596 50 10 IJGE CC(C)Oc1ccc(C=NNC(=O)c2ccc(Nc3nc(O)c4ccccc4n3)cc2)cc1 2323766019 AWTPKWKWPCFVGO-UHFFFAOYSA-N 441.491 4.630 50 10 IJGE C[C@@H]1C[C@@H](CCl)CCN1Cc1ccc(I)c(Br)c1 2325205163 UXJUBBZDSGHIDT-MNOVXSKESA-N 442.566 4.893 50 10 IJGE CC[C@H]1[C@H](CCl)CCN1Cc1ccc(I)c(Br)c1 2325211663 AHHABFWIJMAEOW-FZMZJTMJSA-N 442.566 4.893 50 10 IJGE COc1cc(CCl)cc(Br)c1OCc1nc(Br)cs1 2342922635 XVJOLHOGHAQLAZ-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE C[C@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](CCBr)COCc1ccccc1 2343704076 FJNPDRSSGYCHFV-YJBOKZPZSA-N 440.765 4.594 50 10 IJGE Cc1cc(C)cc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2O)CCC3)c1 40826342 DLTWYFWINPCNCQ-ZXVVBBHZSA-N 431.492 4.633 50 10 IJGE O=[N+]([O-])c1cc(Cl)cc(Br)c1OC[C@H](Br)C(F)(F)F 96834981 SCMGLTVBBCKGMN-ZETCQYMHSA-N 427.398 4.715 50 10 IJGE CCCOC(=O)c1cccc(-c2ccc(/C=C3\C(=O)N(CCC)C(=O)C(C#N)=C3C)o2)c1 103693428 NWTIWKLFTHWLQS-ZHZULCJRSA-N 432.476 4.516 50 10 IJGE COc1ccc([C@@H](C)NC(=O)/C(C#N)=C\N[C@@H](C)c2ccc3c(c2)CCCC3)cc1OC 217171634 OPCXVARRIOFILS-GQYDPSLTSA-N 433.552 4.518 50 10 IJGE CCO[C@@H]1[C@@H](Br)C[C@@H]1Oc1ccc(Br)cc1Br 229353764 GABOEOACVNXCIY-ZMLRMANQSA-N 428.946 4.531 50 10 IJGE CC(C)[C@@H](CCBr)NC(=O)c1ccc(Br)cc1Br 231123589 AXDUZNNFPHSPSE-GFCCVEGCSA-N 441.989 4.751 50 10 IJGE C[C@H](Br)c1ccccc1NC(=O)c1ccc(I)c(O)c1 235412733 NSBYREQYASOLMT-VIFPVBQESA-N 446.082 4.705 50 10 IJGE CCOc1cc(C=NNC(=O)COc2ccc(C)c(C)c2)ccc1OCc1ccccc1 254698867 GYNINKFARNMMIZ-UHFFFAOYSA-N 432.520 4.810 50 10 IJGE O=C(NC[C@@H]1CC[C@@H](Br)C1)c1scc(Br)c1Br 705402012 SPMWYEGJXRNHOM-RNFRBKRXSA-N 446.002 4.567 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@H]2C[C@@H](Cl)CC[C@H]2C1 705436564 AIOITVOGIBOPTC-YIZRAAEISA-N 427.589 4.753 50 10 IJGE CN(Cc1ccccc1)C(=O)N1CCC(C(=O)Oc2ccc([N+](=O)[O-])c3ccccc23)CC1 757422102 MMSZVAUHDCGPNX-UHFFFAOYSA-N 447.491 4.617 50 10 IJGE CC(C)c1ccc(S(=O)(=O)c2ccc(NNC(=O)C3CCC(F)(F)CC3)cc2)cc1 759759107 ZNDAMHFOVWPWHG-UHFFFAOYSA-N 436.524 4.911 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc3ccccc3cc2NC(=O)C2CC2)c(C(F)(F)F)c1 799752127 WNOSNPYQHDFAQP-UHFFFAOYSA-N 438.409 4.836 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NCc2cccc3ccccc23)c(-c2ccccc2)n1 914478319 HJGLEHAHIBTOOV-XQNSMLJCSA-N 431.499 4.840 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)c1ccccc1Cl 1350374825 LOLWNKYUNUAVRM-PEZBUJJGSA-N 438.886 4.923 50 10 IJGE Cc1cc(C(=O)NNc2nc3ccccc3[nH]c2=S)cc(C)c1OCc1cccnc1 1470319453 IACPXUZOFMQJBY-UHFFFAOYSA-N 431.521 4.640 50 10 IJGE CC(=O)c1cc2c(cc1NC(=O)/C(C#N)=C/c1cc(C)n(-c3ccccc3F)c1C)OCO2 1522485206 QVYJPAOOLHSSRD-GIJQJNRQSA-N 445.450 4.710 50 10 IJGE C=CCO[C@@H]1CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1 1566816826 VBNQEFRTFQRMJW-GSERBOKHSA-N 443.469 4.823 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1cccc(F)c1 1624296280 JSWWDLWMHWKECL-SSZFMOIBSA-N 438.886 4.923 50 10 IJGE CC(=O)c1cc(NC(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)ccc1C 1663008489 JKBQDQZDBUUCHH-UHFFFAOYSA-N 429.402 4.822 50 10 IJGE Cc1ccc(COc2ccc([C@@H]3C(C#N)=C(N)Oc4c3c(C(F)(F)F)nn4C)cc2)cc1 1865692516 GREYGIRZCFOPPU-GOSISDBHSA-N 440.425 4.545 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNC(=O)CCCc2ccc(Cl)cc2)c(C)n1 1865760097 GJWDJHQQRVKMPK-UHFFFAOYSA-N 437.927 4.503 50 10 IJGE CCOc1ccc(/C=N\NC(=O)c2ccc(-c3ccc(OC)cc3)nc2C)cc1OCC 1865762323 ZJZZAXJWQGZXLU-QQXSKIMKSA-N 433.508 4.627 50 10 IJGE C[C@@H](NCc1cc(Br)ccc1Br)c1nnc(CCl)s1 1877557997 JKUTZMQARVZLAE-SSDOTTSWSA-N 425.577 4.653 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C[C@H]1CCN(C(=O)OC(C)(C)C)C1(C)C 1881456383 TUDYBADABYGPHP-ZIAGYGMSSA-N 435.403 4.700 50 10 IJGE CN(CC1CC(Br)C1)C(=O)CCC1(NC(=O)OC(C)(C)C)CCCCC1 1887822925 HRRWEGMQXZAFIT-UHFFFAOYSA-N 431.415 4.626 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)Cc1sc(Cl)cc1I 1889589972 YCFXJDNHUMDNPS-ZETCQYMHSA-N 436.142 4.681 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(Br)c(O)c1 1915080118 IYVUQYMZYSSVRR-OAHLLOKOSA-N 441.163 4.971 50 10 IJGE C[C@@H]1OCCO[C@@H]1[C@H](Br)c1cc(Br)sc1Br 1935560529 ZMBXYBCWJUXTII-NGESMGFYSA-N 434.975 4.513 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCCCN2C[C@H](Br)C(F)(F)F)CC1 2058040661 GCRCXKJEQVXMBK-ZDUSSCGKSA-N 429.321 4.568 50 10 IJGE C[C@]12CN(Cc3ccc(I)c(Cl)c3)C[C@]1(CBr)C2 2086652000 MJTNYODVDNDEOL-UONOGXRCSA-N 440.550 4.552 50 10 IJGE Cc1c(Br)sc([C@H](Cl)[C@@H]2CCn3ncnc3C2)c1Br 2108968478 HQSZIJSWHRGJRJ-GMSGAONNSA-N 425.577 4.716 50 10 IJGE Cc1cc(CNC(=O)OC(C)(C)C)cc(NC(=O)[C@H](Br)C2CCCC2)c1 2110728547 QFWKMSZMTYWYMU-QGZVFWFLSA-N 425.367 4.912 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)[C@]12COC[C@H]1C2 2213490825 XBJGIHHZZVJCDN-LKXWSVAYSA-N 428.921 4.823 50 10 IJGE CCN[C@H](Cc1cc(Br)cc(Br)c1)[C@H]1C[C@@H]1Br 2252833812 ZETWPHLJUMJUKF-RWMBFGLXSA-N 425.990 4.516 50 10 IJGE COc1ccc([C@@H](Br)[C@@]2(C)CCCOC2)cc1I 2257365978 WXPXCAILQQVOGB-KGLIPLIRSA-N 425.104 4.553 50 10 IJGE CCCOC1([C@@H](Br)c2ccc(OC)c(I)c2)CC1 2257369258 LXCDUCPDKQSUIJ-ZDUSSCGKSA-N 425.104 4.695 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)C1[C@@H]2COC[C@@H]12 2260069341 GXHKSPZWQIISJB-FJNYAOGASA-N 446.911 4.818 50 10 IJGE C[C@@](CBr)(NC(=O)c1cc(Br)c(F)cc1Cl)C(F)(F)F 2285958004 JUVYSRBTJWJHPR-JTQLQIEISA-N 441.444 4.687 50 10 IJGE C[C@@H](Br)CN(CC(C)(C)C)C(=O)c1ncc(Br)cc1Cl 2288047237 GGGZRYIIXGCYNP-SECBINFHSA-N 426.580 4.769 50 10 IJGE Cc1ccc(OCCOc2ccc(C=C(C#N)C(=O)NCc3ccco3)cc2Cl)cc1 2293993114 DUWWLNXFYUSCLK-UHFFFAOYSA-N 436.895 4.923 50 10 IJGE COC(=O)c1cc(OC)c(OC)cc1NC=C(C#N)c1nc(-c2ccc(F)cc2)cs1 2295948546 HXIMZBSXAPHXLA-UHFFFAOYSA-N 439.468 4.730 50 10 IJGE CN[C@H](c1c(C)cc(Br)c(F)c1Br)[C@@H]1C[C@H]1Br 2301487735 TZTXUORLCRDFMJ-QHMRUWFYSA-N 429.953 4.703 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@@H]1Cc1ccc(Cl)cc1I 2302316007 QDZJQZWRVBXJBO-OUJBWJOFSA-N 429.523 4.676 50 10 IJGE CC(C)[C@H](CBr)N(C)C(=O)c1cc(Br)sc1Br 2302536261 KUXWJUISNQTJOX-QMMMGPOBSA-N 448.018 4.765 50 10 IJGE CC[C@H](C[C@@H](C)Br)NCc1cc(I)ccc1Cl 2307315124 DFZJSJNXLMJRED-BXKDBHETSA-N 430.555 4.986 50 10 IJGE C[C@H]1C[C@@H]1N(CCBr)Cc1cc(I)ccc1Cl 2307332303 MUSJHQWVGCNGHL-ZANVPECISA-N 428.539 4.550 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)cc(Cl)c1O 2323168586 KQAVFWQUZPQHMS-CYBMUJFWSA-N 425.916 4.814 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@]3(NC(=O)OC(C)(C)C)CCC[C@@]3(F)C2)C1 2345008194 LXNVZEQSUSKNNM-UXHICEINSA-N 433.406 4.659 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCCCN(C[C@@]2(CBr)CC2(F)F)C1 2351890525 MLFSPHHQQVXAJK-KRWDZBQOSA-N 437.319 4.640 50 10 IJGE N#CC1=C(N)Oc2ccc(/C=N/c3ccc(Br)cc3)c(O)c2[C@@H]1c1ccco1 3616216 KKMOFSSDTLCZSV-CVHZQBDDSA-N 436.265 4.716 50 10 IJGE CSc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4F)ccc32)cc1 38682536 QWFZVWIOFUWTOX-JOCHJYFZSA-N 432.476 4.985 50 10 IJGE O=S(=O)(Nc1ccc(Br)cc1Cl)c1ccc(CBr)cc1 115917608 HPVXHVWKQUFBEU-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1Br)c1cc(Br)c(Br)s1 122898824 KKLKHICNKNHMPV-HTRCEHHLSA-N 446.002 4.709 50 10 IJGE CCCOc1ccc(/C=C\C(=O)Oc2ccc(/C=C(\C#N)C(=O)NC(C)C)cc2OC)cc1 206433381 BKUWYIYDTFPHJX-QNUPSSFOSA-N 448.519 4.534 50 10 IJGE COC(C)(C)CCO[C@@](C)(CI)c1ccccc1Br 234689097 SGYOUZFAOSAQDQ-HNNXBMFYSA-N 441.147 4.931 50 10 IJGE CCn1c2ccccc2c2cc(C=NNC(=O)CSc3nc4ccccc4n3C)ccc21 254519556 IUCHKWDQDCHPPQ-UHFFFAOYSA-N 441.560 4.944 50 10 IJGE C[C@@H]1CCC[C@@H](CO[C@@](C)(CI)CNC(=O)OC(C)(C)C)C1 300795841 VKVFUHHVOWKRAF-CPUCHLNUSA-N 425.351 4.548 50 10 IJGE O=C(NC[C@H](Br)C1CCC1)c1ccc(Br)cc1Br 315915888 VHGZUZFRPDTOBV-LBPRGKRZSA-N 439.973 4.505 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)CCN1S(=O)(=O)c1ccc(Cl)c(CCl)c1Cl 382648267 QYOOPBGHJZXISY-CQSZACIVSA-N 447.815 4.627 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NC(=O)c1cc(Cl)ccc1I 716938014 JOPRUCVTOYEFNJ-SCZZXKLOSA-N 444.538 4.627 50 10 IJGE CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNc1ccc(F)c(F)c1F 727759645 MGMRPOPZRCMNIV-OAHLLOKOSA-N 448.272 4.699 50 10 IJGE COc1ccccc1CC(=O)NNC(=O)N[C@H](C)c1ccccc1-c1ccc(Cl)cc1 740060919 AVYPBXTYPWGLAD-MRXNPFEDSA-N 437.927 4.650 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1 769974687 AESICGSGKVNIBA-UHFFFAOYSA-N 440.853 4.968 50 10 IJGE C=CCC[C@H](C(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1)c1ccccc1 1182112218 VMQBDXISCXMRSW-FQEVSTJZSA-N 444.560 4.906 50 10 IJGE C=CCc1cc(CNC(=O)NNc2c(Cl)cc(F)cc2Cl)cc(OC)c1OC 1225350582 NMCCBTKBLJNIGF-UHFFFAOYSA-N 428.291 4.705 50 10 IJGE C=CCC1(CNC(=O)NNC(=O)Nc2ccc(Br)cc2Cl)CCCC1 1312689433 WFRBOTKBYQYBFQ-UHFFFAOYSA-N 429.746 4.575 50 10 IJGE C#CCCOc1ccc(C(=O)NNc2ccc(Br)cc2C(F)(F)F)cc1 1443338946 BCNFTDOQZPTRCK-UHFFFAOYSA-N 427.220 4.627 50 10 IJGE C=COc1ccc(NC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)cc1 1466812495 HDVASOHMBAQZCX-UHFFFAOYSA-N 439.475 4.528 50 10 IJGE CCCc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1ccccc1O)C(C#N)=C(N)O2 1865708146 PJCOZECVHHSDCX-FQEVSTJZSA-N 438.890 4.600 50 10 IJGE CCN(C[C@@](C)(CBr)O[C@H]1COC2(CCCCC2)C1)C(=O)OC(C)(C)C 1879029295 KAPMDGJAKNWSSH-VQIMIIECSA-N 434.415 4.905 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CC[C@@H]2[C@@H](CCN2C(=O)OC(C)(C)C)C1 1882086692 DKDNOIRHHSBGMX-QKPAOTATSA-N 447.414 4.700 50 10 IJGE COc1ncc(Br)c(C)c1CN(Cc1ccccc1)C[C@@H](C)Br 1902508415 LKHUHKPVCKYMJP-CYBMUJFWSA-N 442.195 4.947 50 10 IJGE C[C@H](Br)C[C@H](C)CNC(=O)c1csc(Br)c1Br 1945186802 NKYQXMBTHCFZCS-BQBZGAKWSA-N 448.018 4.813 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)c1csc(Br)c1Br 2020197735 DESDGVPYAFEMPJ-KNVOCYPGSA-N 446.002 4.519 50 10 IJGE CCOC(=O)[C@@]1(C[C@H]2C[C@@H](Br)C2)CCCN(C(=O)OCc2ccccc2)C1 2020241581 VZXIIILGNTZBSF-LVCYWYKZSA-N 438.362 4.532 50 10 IJGE Brc1cnc(N2CC[C@@H]3C[C@H](Br)CC[C@@H]32)c(Br)c1 2027435464 OQEINYHFWQOWIS-LNLATYFQSA-N 438.989 4.749 50 10 IJGE FC(F)(F)c1c(Br)c(CBr)nn1-c1ccnc(C2CC2)c1 2078911840 AGDUIDAXSMEHRL-UHFFFAOYSA-N 425.046 4.821 50 10 IJGE CC[C@H](C)[C@@H](CI)NCc1ccc(Br)c(F)c1F 2081255854 RRXMLSONUCJZGR-GZMMTYOYSA-N 432.090 4.667 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)[C@@H](Br)C2CCCC2)n1 2082962916 SGBYXMVSNYXTQT-MFKMUULPSA-N 432.384 4.621 50 10 IJGE CC(C)[C@H]1[C@H](Br)CCN1Cc1ccc(I)c(Cl)c1 2086660068 BELXRWUUXCNYJB-RISCZKNCSA-N 442.566 4.938 50 10 IJGE Fc1cc(Br)c2nc(CCl)n([C@@]34C[C@@H]3CN(Cc3ccccc3)C4)c2c1 2099678026 FLXUPRSULGAOSP-JLTOFOAXSA-N 434.740 4.908 50 10 IJGE C[C@H](CCCl)C(=O)N(CCCNC(=O)OC(C)(C)C)c1cccc(Br)c1 2126194925 LDZBQYRGHWMFMF-CQSZACIVSA-N 447.801 4.962 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@H](CBr)C2CCC2)C[C@H]1c1ccccc1 2163060172 ZYRDPYQGERNHID-HSALFYBXSA-N 437.422 4.790 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@]2(F)CCC[C@@]2(CCl)C1 2176642003 WYSPWLGDTPJHNK-CHWSQXEVSA-N 445.579 4.846 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@@H](CBr)C2CC2)C[C@@H]1c1ccccc1 2185528324 HBLILFWUYYNPPS-VAMGGRTRSA-N 437.422 4.648 50 10 IJGE CC1CC(CBr)(CN2C[C@@]34CCC[C@@]3(C2)CN(C(=O)OC(C)(C)C)C4)C1 2265307630 IOWITXGPBGZGBW-PUPGKCOFSA-N 427.427 4.521 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@H](Br)CC2(CC2)C1 2285956913 CAZANNFOGAAOOH-MRVPVSSYSA-N 425.523 4.631 50 10 IJGE CCOC(=O)COc1c(Cl)cc(C=C(C#N)c2nc3ccc(OC)cc3[nH]2)cc1Cl 2294284622 MSDMDIKAOBFNKU-UHFFFAOYSA-N 446.290 4.884 50 10 IJGE CC(=CC#N)N1C(=O)c2ccc(C(=O)Nc3ccc(-c4nc5ccccc5o4)cc3)cc2C1=O 2313944565 YLOIFHLCWLFBFE-UHFFFAOYSA-N 448.438 4.770 50 10 IJGE C=CCN1C(=O)C(=Cc2cn(-c3ccccc3)nc2-c2cc(C)ccc2C)C(C)=C(C#N)C1=O 2314617084 QKVLOWVQCSTTBJ-UHFFFAOYSA-N 448.526 4.934 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@H](C3CN(C(=O)OC(C)(C)C)C3)C2)C1 2345018169 AVLFMSWEKAOTGX-INIZCTEOSA-N 429.443 4.767 50 10 IJGE CCc1nc(C(=O)NCC(C)(C)[C@H](Br)C(C)C)c(Br)s1 2365868301 PXHISHCFUMKCPS-LLVKDONJSA-N 426.218 4.644 50 10 IJGE Cc1c(Cl)cccc1Nc1ncnc(NNC(=O)c2ccc(Cl)cc2Cl)c1N 40701612 GGILQGQOZGVRHP-UHFFFAOYSA-N 437.718 4.828 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1Br)c1cc(C(F)(F)F)ccc1Br 123004408 GRLSEJJDTNWHQF-RYUDHWBXSA-N 429.074 4.904 50 10 IJGE C[C@@H](CCCBr)NC(=O)c1cc(Br)ccc1Br 161226890 XKOMVNOVAWWTDN-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE C[C@@H](Br)CCCNC(=O)c1cc(Br)ccc1Br 227713679 LLPVTLKEVPHAPO-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE CC[C@@H](O[C@@](C)(CI)CNC(=O)OC(C)(C)C)c1ccccc1 403282396 OTEQQTXAEBYROY-QAPCUYQASA-N 433.330 4.873 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1[C@@H]1CN(Cc2ccccc2)C[C@H]1CI 725418565 QICHPAZBIHGYDP-VQIMIIECSA-N 436.293 4.554 50 10 IJGE O=C(NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)[C@H]1C[C@@H]1c1cccc2ccccc12 734259812 CIBRPJHNJCKVJG-MSOLQXFVSA-N 449.436 4.957 50 10 IJGE Cc1cc(C)n(-c2ccc(CNC(=O)NNc3cccc(F)c3F)c(C(F)(F)F)c2)n1 745781527 SJWOEIOSRCNGMF-UHFFFAOYSA-N 439.388 4.612 50 10 IJGE Cc1ccccc1CC(=O)NNC(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1 755447442 NFKTWGVRGWUGNJ-UHFFFAOYSA-N 430.533 4.591 50 10 IJGE N#C[C@H](c1ccccc1)c1ccc(NC(=O)NNC(=O)c2ccc(Br)cc2)cc1 1254703626 FMZXWEUNJLGEQO-HXUWFJFHSA-N 449.308 4.571 50 10 IJGE CC(=O)c1ccc(CCNC(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(C)c3)c2C)cc1 1446730139 KAIAJAAXZAQORR-XYGWBWBKSA-N 425.532 4.871 50 10 IJGE C#CCOc1ccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 1456313299 CKJXATZCQRCYOR-PGMHBOJBSA-N 425.488 4.660 50 10 IJGE CC[C@@](C)(NC(=O)c1nc(CC(C)C)n2ccccc12)C(=O)Nc1ccc(SC#N)cc1 1866869420 MOZFUTDZPSNNDO-XMMPIXPASA-N 449.580 4.643 50 10 IJGE CN(Cc1csc(Br)c1)C[C@@H](Br)COCc1ccccc1 1904143648 IZCQGIUELFSNOG-OAHLLOKOSA-N 433.209 4.923 50 10 IJGE CCO[C@@H](C)C(CBr)(CBr)c1ccccc1Br 1941147272 BCELPPAUCCAHQF-JTQLQIEISA-N 428.990 4.902 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Br)cc(Br)cc1C(=O)CCl 1951908191 UDMOXFHKXWQISJ-UHFFFAOYSA-N 427.520 4.980 50 10 IJGE Cc1nn(Cc2ccccc2)c(C)c1Cn1c(Cl)nc(Cl)c1CBr 2014372573 UWSRPMVHAMRCLD-UHFFFAOYSA-N 428.161 4.995 50 10 IJGE ClC[C@@H]1CCC[C@H]1CNc1ncc(I)cc1Br 2015756444 FZGZDCFPRMNWBX-IUCAKERBSA-N 429.527 4.516 50 10 IJGE C[C@]1(CCBr)CCN1Cc1cc(Br)ccc1Br 2025216000 KJKQXBSJWXBKDD-ZDUSSCGKSA-N 425.990 4.961 50 10 IJGE C[C@H]1CCO[C@@H]1COc1c(Br)cc(CBr)cc1Br 2034998022 ZYLONPISRDVGHN-QPUJVOFHSA-N 442.973 4.910 50 10 IJGE CCC(CC)(CBr)CN=[S@](C)(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2044697370 TZOJBXPVARXHBY-SGANQWHYSA-N 439.460 4.685 50 10 IJGE CCC[C@H](CBr)CNC(=O)c1c(Br)cccc1Br 2057116249 AIFSHQBCLJZXCK-SECBINFHSA-N 441.989 4.753 50 10 IJGE C[C@H]1CC[C@@H](CBr)N(Cc2ccc(I)c(Cl)c2)C1 2086651387 HMLLESSCWWOZEI-JQWIXIFHSA-N 442.566 4.940 50 10 IJGE ClCCc1nc2cccc(Br)c2n1[C@@]12C[C@H]1CN(Cc1ccccc1)C2 2099679989 WKGBABOMPMAGDN-HRAATJIYSA-N 430.777 4.811 50 10 IJGE C[C@@H]1CCCC[C@]1(CNC(=O)OC(C)(C)C)NC(=O)[C@@H](Br)C1CCCC1 2110723287 NFYUJJKAALLQKS-PTSWNOGYSA-N 431.415 4.530 50 10 IJGE Cc1cc(Br)c(C)c([C@@H](Cl)[C@H]2CCS(=O)(=O)C2)c1Br 2136372514 UNBMQSWQUJFOII-ZANVPECISA-N 430.589 4.543 50 10 IJGE CCCC(CBr)(CCC)CN1CC(C)(C)OC[C@H]1CNC(=O)OC(C)(C)C 2194647572 CICJSVWCDDRFHQ-QGZVFWFLSA-N 449.474 4.972 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)ccc2n1C[C@H]1COCCN1Cc1ccccc1 2194650112 QAWZYXLPUJGHTQ-YJBOKZPZSA-N 448.792 5.000 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)c2cnsn2)c1 2246006304 XEHIGZRLFBAJBE-VIFPVBQESA-N 426.959 4.742 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@H]2[C@H]3CCCO[C@H]32)c1 2263514352 AIMRLQXKYUXFEA-ZOBORPQBSA-N 438.985 4.943 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CCC(F)(F)[C@H](CBr)C1 2264504975 UWWFWQVSYCLXLZ-ZCFIWIBFSA-N 437.531 4.656 50 10 IJGE C[C@@H](Br)CN(CCC(C)(C)C)S(=O)(=O)c1sccc1Br 2288046853 DQFCTLZESYRSEO-SNVBAGLBSA-N 447.258 4.721 50 10 IJGE Cc1cccn2c(=O)c(C=C(C#N)c3nc4ccccc4[nH]3)c(Oc3ccc(F)cc3)nc12 2314436838 MZBLAEDIIKYKAO-UHFFFAOYSA-N 437.434 4.875 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)COc2ccc(Cl)cc2C)c(OCC)c1 2314736046 QHQHPYTXHGETHS-UHFFFAOYSA-N 443.883 4.502 50 10 IJGE COc1ccc([C@H](C)NC=C(C#N)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)cc1OC 2325108048 JKBSTEFYNKKDKT-ZWKOTPCHSA-N 433.552 4.518 50 10 IJGE COc1ccc(Cl)cc1N1C[C@@H](C(O)=C(C#N)c2nc(C(C)(C)C)cs2)CC1=O 2331307228 TVCVEALVPCFDEN-LBPRGKRZSA-N 431.945 4.948 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cccc(C(F)(F)F)c1 2343414270 LSYANMWFFXBZKD-QGZVFWFLSA-N 430.264 4.806 50 10 IJGE COc1c(Br)cc(C)c([C@@H](Cl)[C@@H]2OCCO[C@@H]2C)c1Br 2365176955 VFGIHRPNCXTFSB-BZHVJNSISA-N 428.548 4.612 50 10 IJGE FC(F)(F)[C@@H]1[C@H](Br)CCCN1Cc1ncc(Br)cc1Cl 2370295049 QEQIHSJKSGHWLU-KCJUWKMLSA-N 436.497 4.788 50 10 IJGE CC(C)(C)[C@@](C)(CBr)CS(=O)(=O)Cc1ccc(Br)cc1 2380201824 DVRGRMQBXPLBFA-HNNXBMFYSA-N 426.214 4.811 50 10 IJGE CCOc1ccc(C=NNC(=O)Cc2csc(Nc3cccc(C(F)(F)F)c3)n2)cc1 15985744 PBVQJXWLMSSUSI-UHFFFAOYSA-N 448.470 4.997 50 10 IJGE aggregator COC(=O)c1ccsc1NC(=O)/C(C#N)=C\c1cccc(OC)c1OCc1ccccc1 96438579 XTMDSYURNKPXKR-AQTBWJFISA-N 448.500 4.668 50 10 IJGE COc1ccc(CN(C(=O)CCl)[C@H](C(=O)NC2CCCCC2)c2ccccc2C)cc1 97914453 DUKRWHJLUMZXNA-DEOSSOPVSA-N 442.987 4.761 50 10 IJGE N#C/C(=C(\c1ccc(-c2ccccc2F)o1)N1NC(=O)CC1=N)c1nc2ccccc2s1 104505027 JTNUIZJFRZYLQT-GGFKGUJPSA-N 443.463 4.801 50 10 IJGE CC1(C)C[C@H](N=C=O)C[C@@](C)(CNC(=O)NC[C@]2(c3ccc(F)cc3F)CC2(C)C)C1 170290754 KVOAOFVALQDWEF-VWMXVWASSA-N 433.543 4.853 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C\NCc1ccc(Br)cc1)c1ccc2c(c1)CCCC2 217204679 UROOVRHIFHEUEU-NOEYKIMYSA-N 438.369 4.702 50 10 IJGE O=S(=O)(Nc1cc(Br)cc(Br)c1)c1cccc(CCl)c1 690359610 YWYKADOGMOQBRX-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)c2ccccc2Nc2cccc(C(F)(F)F)c2)cc1 748131082 LAZNKYVSBRWQOK-UHFFFAOYSA-N 449.454 4.609 50 10 IJGE Cc1ccc(NC(=O)CSc2ccccc2C(=O)NNc2cccc(F)c2F)cc1 748796158 ISOUWJZOVMWALP-UHFFFAOYSA-N 427.476 4.761 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N(C)Cc2cn(C)nc2C(F)(F)F)c(C)n1C1CCCCC1 749872266 WAQBIWJUKQKHFK-WOJGMQOQSA-N 447.505 4.928 50 10 IJGE O=C(NNc1ccc(Br)c(F)c1)c1cnc(-c2ccc(F)c(F)c2)s1 771683196 YUYBNJFRAZUSIN-UHFFFAOYSA-N 428.233 4.747 50 10 IJGE O=C(CN(Cc1ccccc1)Cc1ccccc1)NN=Cc1ccc(Br)cc1 1084294863 WOFHNMSMPBSCEP-UHFFFAOYSA-N 436.353 4.602 50 10 IJGE Cc1nn(-c2cccc([N+](=O)[O-])c2)c(C)c1C=NNC(=O)[C@@H](C)c1ccc(CC(C)C)cc1 1084296172 RVWFHKYUUAWWBV-KRWDZBQOSA-N 447.539 4.850 50 10 IJGE C=CC1(CC(=O)N2CCC[C@@H](O[Si](C)(C)C(C)(C)C)C2)CN(C(=O)OC(C)(C)C)C1 1642182281 RMVCONLEYYPRGK-GOSISDBHSA-N 438.685 4.812 50 10 IJGE Cc1ccccc1COc1ccc(C=NNC(=O)CSc2nc3ccccc3[nH]2)cc1 1772760590 XBEGPLMKVPVBKP-UHFFFAOYSA-N 430.533 4.693 50 10 IJGE O=C(CCBr)N1CCC2(C=Cc3ccc(OCc4ccccc4)cc3O2)CC1 1859496473 UOIOSAAKRLOJRE-UHFFFAOYSA-N 442.353 4.817 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)c3c2[C@H](c2ccccc2F)C(C#N)=C(N)O3)cc1 1865682988 CJWNQOPCAOQQPZ-JOCHJYFZSA-N 438.462 4.905 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)Cc1ccc(Cl)cc1C(F)(F)F 1902483754 IAFKVDXOZPCHDU-LLVKDONJSA-N 446.650 4.961 50 10 IJGE CN(Cc1cccc(Br)c1Br)[C@@H]1CCC[C@@H]1Br 1943885497 WISIFWFQYGDRDI-CMPLNLGQSA-N 425.990 4.959 50 10 IJGE C[C@]12CN(Cc3ccccc3)C[C@H]1CN(c1nc(Cl)c(CBr)s1)C2 1949582908 DGKUNVVJFUCGFS-KBXCAEBGSA-N 426.811 4.650 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc([C@]2(C)CC[C@@H](CI)O2)cc1 1987516540 ADSVXUJSQKRPMU-YJBOKZPZSA-N 431.314 4.541 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1C(=O)c1cc(Br)c(Br)s1 2018118418 BASOYSWSNXWEHH-XPUUQOCRSA-N 446.002 4.661 50 10 IJGE CC(C)[C@H](Br)CN(C)C(=O)c1cccc(Br)c1Br 2048727765 JTLRVZFUSWWJIP-LLVKDONJSA-N 441.989 4.703 50 10 IJGE Fc1ccc(-n2nc(CCl)c(Br)c2C(F)(F)F)nc1C(F)(F)F 2078866302 RAPQCDGFUIESGP-UHFFFAOYSA-N 426.517 4.945 50 10 IJGE CCCN1CC[C@H]([C@@H](Br)c2ccccc2OCc2ccccc2)S1(=O)=O 2089515873 TUDGOGYSCQWWNE-UXHICEINSA-N 438.387 4.516 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]23CCC[C@@]2(CN(C[C@@H](CBr)CC2CC2)C3)C1 2112867115 UZYGOTNILHDMDF-UIFIKXQLSA-N 427.427 4.521 50 10 IJGE Cc1nc(-c2ncc(Br)cc2Br)nc(C)c1CCBr 2130809296 HWNJFFDLXNBBOW-UHFFFAOYSA-N 449.972 4.618 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C[C@@H](CBr)c2ccccc2)CCC1(F)F 2163057416 BFYKMUHCLXSXAV-SJORKVTESA-N 447.364 4.790 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)c2ccccc2)[C@@](C)(C2CC2)C1 2163058660 MIOLFIVJJPZBBI-XMSQKQJNSA-N 437.422 4.887 50 10 IJGE CC[C@@H](Br)[C@H]1CCCCN1S(=O)(=O)c1cc(Br)sc1C 2170612542 JCENSLXXHZOEBQ-GHMZBOCLSA-N 445.242 4.536 50 10 IJGE O=S(=O)(Nc1ccc(Br)c(Br)c1)c1ccc(CCl)cc1 2185907081 IWIJGIOPABEGIY-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@H]1C[C@H](C(C)(C)C)CN(C(=O)OC(C)(C)C)C1 2196908349 XFGRECCYHAZLPH-QAETUUGQSA-N 445.442 4.538 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)[C@@H]2CCCOC2)c1 2252836778 GUDHOBWPYWAJSX-ZWNOBZJWSA-N 426.974 4.944 50 10 IJGE Cn1cc(COc2c(Cl)cc(CBr)cc2Cl)c(Br)n1 2278818058 NGTHBDDVQQGVAE-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE O=C(N1CCC[C@@H]([C@@H]2CCCCN2CCCCCCCBr)C1)C(F)(F)F 2294697557 COPYETOOTJCDMU-SJORKVTESA-N 441.376 4.987 50 10 IJGE CC(C)[C@@H](Br)C(=O)N(C)Cc1c(Br)cccc1Br 2318202883 MCJKGRRYPQSJIA-GFCCVEGCSA-N 441.989 4.590 50 10 IJGE C[C@H](CCBr)CCN1C[C@H]2CC(F)(F)CC[C@]2(NC(=O)OC(C)(C)C)C1 2344056674 DTQJMSBJTXYQFU-RKVPGOIHSA-N 439.385 4.812 50 10 IJGE CC(C)(C)[C@](C)(CBr)COCCOCCOCCOCc1ccccc1 2352092640 NTOKQGNEXACJGV-OAQYLSRUSA-N 431.411 4.700 50 10 IJGE CC(C)c1ccc(OCC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c(Br)c1 12489244 KWIQQIRDWKJOOM-UHFFFAOYSA-N 447.373 4.710 50 10 IJGE O=S(=O)(c1ccccc1)[C@H](Br)CN(Cc1ccccc1)Cc1ccccc1 21987408 CGEHWTYGSURBJV-QFIPXVFZSA-N 444.394 4.884 50 10 IJGE O=C(/C=C\c1cccc2ccccc12)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1 33398180 RSBRPZPARYORNL-SDXDJHTJSA-N 435.483 4.567 50 10 IJGE C=CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(F)c2)cc1 38678090 HWFDSSOUNKJQIW-DEOSSOPVSA-N 442.446 4.828 50 10 IJGE CCN(c1ncnc(NNC(=O)c2ccc(F)cc2)c1[N+](=O)[O-])c1cccc2ccccc12 40589266 UGJHRYNWBDEWTG-UHFFFAOYSA-N 446.442 4.592 50 10 IJGE COc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)Oc4cc(C)cc(C)c4)c(C)c32)cc1 40813801 KBUYCZQGTHIQKO-SZXQPVLSSA-N 446.503 4.903 50 10 IJGE N#C/C(=C/NCCc1cccc(Br)c1)C(=O)Nc1cccc(C(F)(F)F)c1 217148000 DNKMAFVPLKKLAY-OWBHPGMISA-N 438.247 4.646 50 10 IJGE COc1cc([N+](=O)[O-])ccc1N/C=C(/C#N)C(=O)Nc1ccc(Oc2ccccc2)cc1 217210346 LVTAGMCKJIOFAC-NXVVXOECSA-N 430.420 4.854 50 10 IJGE CC[C@@H](CCBr)NC(=O)c1ccc(Br)cc1Br 233874028 RZSCEHQOZIHKBY-VIFPVBQESA-N 427.962 4.505 50 10 IJGE CC[C@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1 251348766 MCTGXALYZVQMRM-FHWLQOOXSA-N 434.536 4.736 50 10 IJGE Nc1ccc([C@@H]2CN(Cc3ccccc3)C[C@@H]2CI)c(Cl)c1 382683665 GJFYNIOGWBHEJY-WMLDXEAASA-N 426.729 4.573 50 10 IJGE C[C@H]1[C@H](Br)CCCN1C(=O)c1cc(Br)cc(Br)c1 384230789 GGEGAYJCWAYGQL-QPUJVOFHSA-N 439.973 4.600 50 10 IJGE C[C@@H](CCCCCl)NC(=O)c1cc(I)ccc1Br 398592749 QAUGBKRNKLBUKA-VIFPVBQESA-N 444.538 4.581 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc(-c3cc(F)c(F)c(F)c3)cc2)c1C 743462749 LQPZRFCEGBVEAF-UHFFFAOYSA-N 449.436 4.997 50 10 IJGE N#Cc1cccc(COc2ccc(C=NNC(=O)c3ccccc3Br)cc2)c1 1084296177 UVPFRVGXCFKXJI-UHFFFAOYSA-N 434.293 4.664 50 10 IJGE O=C(CCCSc1nc2ccc([N+](=O)[O-])cc2s1)NN=Cc1cccc(Cl)c1 1084351019 DUHBKQCYFPSNQC-UHFFFAOYSA-N 434.930 4.881 50 10 IJGE CCCCCC(C)=NNC(=O)COc1c(C)cc(Br)cc1Br 1084402928 GUTZGOHMHUOIBU-UHFFFAOYSA-N 434.172 4.971 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(Oc3ccccc3)cc2C)cc1 1623043532 AWXJPFHDANIJLU-GOSISDBHSA-N 447.491 4.610 50 10 IJGE CC(=O)c1cccc(C(=O)NNC(=O)c2ccc(COc3ccc(Cl)c(C)c3)cc2)c1 1624327240 YLXLGBXDOMDIOY-UHFFFAOYSA-N 436.895 4.505 50 10 IJGE CCc1nn(-c2ccc(C)cc2)c2c1[C@@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865702011 KPJAIHSIPNLXDJ-QHCPKHFHSA-N 427.552 4.808 50 10 IJGE Cc1ccc(-c2csc(/C(C#N)=C(\O)CN3C(=O)COc4ccc(Cl)cc43)n2)cc1 1872749372 OKUFQOTXVIOXNC-MNDPQUGUSA-N 437.908 4.990 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cccc(Br)c1 1902790905 QRUOCHMLRVQZFG-KRWDZBQOSA-N 441.163 4.549 50 10 IJGE Cc1cc(F)cc(C)c1S(=O)(=O)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915171711 GRKKCXZXFSGMMV-LJQANCHMSA-N 440.378 4.807 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)C[C@@H]1C[C@H]1C(C)(F)F 2046142673 WUXPACCCRSNOEQ-BBWFWOEESA-N 438.378 4.529 50 10 IJGE CCc1ccc(O)c(-n2nc(CCl)c(I)c2C(F)(F)F)c1 2079211802 BFFJDAXMPKOEDJ-UHFFFAOYSA-N 430.595 4.503 50 10 IJGE Clc1cc(CN2C[C@H]3CC[C@@]3(CBr)C2)ccc1I 2086654953 KFABHNAOWXCJNW-BXUZGUMPSA-N 440.550 4.552 50 10 IJGE C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CCN1C[C@@H](CBr)c1ccccc1 2106786339 UNTDSOZSVCMNQV-ZHALLVOQSA-N 425.411 4.790 50 10 IJGE Clc1cccc(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)c1CBr 2129053547 NNDWVVPQESMCDL-SFTDATJTSA-N 435.793 4.715 50 10 IJGE O=C(NC[C@@]12CC[C@H]1CCCN2CC1(CBr)CCCCCC1)C(F)(F)F 2163059777 WHRVKECWQYAVCE-QAPCUYQASA-N 439.360 4.645 50 10 IJGE ClCc1ccc(Br)c(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)n1 2177043963 JQQFTKAOBJVFSQ-LYSIVYOWSA-N 446.820 4.930 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc(Cl)cc1NC(=O)N1CCC(Br)CC1 2268694638 CMVUKHVTKOOYTA-UHFFFAOYSA-N 446.773 4.756 50 10 IJGE C[C@H]1CC[C@](CBr)(NC(=O)c2cc(Br)c(F)cc2Cl)C1 2285962929 JNRMBRPVYHXRBG-RTHLEPHNSA-N 427.539 4.925 50 10 IJGE CCC[C@@H]1CN(Cc2sccc2I)C[C@H]1CBr 2301074715 VHEHPNYKURAWLC-GHMZBOCLSA-N 428.177 4.596 50 10 IJGE CC(C)N(Cc1ccc(Cl)cc1I)C[C@H](C)Br 2302325686 JNOMLKFRJVEGFY-JTQLQIEISA-N 430.555 4.938 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@H]1Cc1cc(I)ccc1Cl 2307339148 BNZVADWBUOPDAC-GBIKHYSHSA-N 429.523 4.676 50 10 IJGE Clc1ccc(I)c(CN2CCC3CC2(CBr)C3)c1 2314890034 KSKGBVXYMIENIM-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE Cc1ccc2nc(-c3ccc(NC=C(C#N)C(=O)N4C[C@@H](C)O[C@H](C)C4)cc3)sc2c1 2318455277 QEULCJZEPLBXKE-IAGOWNOFSA-N 432.549 4.727 50 10 IJGE N#CC(=CNCc1ccccc1Br)C(=O)Nc1cc(Cl)ccc1Cl 2324392535 RIKGCXJQVKODIM-UHFFFAOYSA-N 425.113 4.892 50 10 IJGE COc1ccc([C@H](Br)[C@]23C[C@H](C[C@H](C)O2)C3)cc1I 2342811735 UOGAYOLPCKPSHU-FCIDVOKBSA-N 437.115 4.693 50 10 IJGE Cc1cc(Br)ccc1S(=O)(=O)C[C@@](C)(CBr)C(C)(C)C 2380199613 NFIOVCMZZMPGOI-OAHLLOKOSA-N 426.214 4.979 50 10 IJGE COc1ccc(/C=N/NC(=O)[C@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1Br 40847511 PSKNHMSAGNIVDV-LKYUAURQSA-N 439.737 4.646 50 10 IJGE Cc1ccc(C)c(OCCCC(C)(C)C(=O)NNC(=O)COc2cccc3ccccc23)c1 66201444 RVROXEPFZSAQIA-UHFFFAOYSA-N 448.563 4.868 50 10 IJGE CCS(=O)(=O)CCCC(CBr)(CBr)c1ccc(Cl)cc1 118876941 FUHHDQUQJBKZLC-UHFFFAOYSA-N 446.632 4.583 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Br)c3cccc(Cl)c3F)cc2[nH]1 124913055 AOMBLXZYPBNKIB-LBPRGKRZSA-N 434.490 4.896 50 10 IJGE CC(C)C[C@@H](CBr)NC(=O)c1cc(Br)ccc1Br 161220185 HEROEXZOZCQUDN-JTQLQIEISA-N 441.989 4.751 50 10 IJGE CN1CCc2nc(N/C=C(/C#N)C(=O)Nc3ccccc3Sc3ccccc3)sc2C1 217243787 OZOLPVZCJLFAAB-PEZBUJJGSA-N 447.589 4.740 50 10 IJGE Cc1cc([C@H](Br)c2ccc3c(c2)C(=O)NCCC3)sc1Br 228228835 ISPMVPUZFKSUIY-CQSZACIVSA-N 429.177 4.979 50 10 IJGE ClCc1c(I)sc2cccc(I)c12 306609037 JVBWXLMATDRJGE-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE O=C(NCCCCCCI)c1ccc(OCc2ccccc2)cc1 310485285 GASUMFUPUJAXGH-UHFFFAOYSA-N 437.321 4.991 50 10 IJGE BrCC(CBr)(C[C@H]1CCOC1)c1ccccc1Br 400589435 PBCRYQFZLQJRRB-LLVKDONJSA-N 441.001 4.903 50 10 IJGE Cc1ccc(C(=O)CBr)c(SC(F)(F)F)c1I 575707856 BMCDJFMXPCSPQN-UHFFFAOYSA-N 439.034 4.789 50 10 IJGE COC1CCC(O[C@@H](CI)c2ccccc2Br)CC1 686231782 ODHPKXLFORRJTL-QOZQQMKHSA-N 439.131 4.899 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1C(=O)c1cc(Br)c(Br)s1 705503166 VSUPQEIHGOKQEU-RNFRBKRXSA-N 446.002 4.661 50 10 IJGE CC(C)(C)S(=O)(=O)CCC[C@@H](CBr)c1ccccc1Br 718763084 NYOGIVBOCTYVPO-LBPRGKRZSA-N 426.214 4.921 50 10 IJGE O=C(CCc1cc(Cl)cs1)NNC(=O)c1ccccc1OCc1ccc(F)cc1 736455382 RBENWQLQSWATGW-UHFFFAOYSA-N 432.904 4.513 50 10 IJGE Cc1cc(C)cc(-n2c(C)c(Br)c(C=NNC(=O)c3cccnc3)c2C)c1 1084142575 OGDNAJWORWRUGY-UHFFFAOYSA-N 425.330 4.632 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1[C@@H]1CN(C(=O)OCc2ccccc2)C[C@@H]1CBr 1614643598 UBYXTBMTUAKLBT-QFBILLFUSA-N 433.302 4.650 50 10 IJGE Cc1ccccc1NC(=O)N/N=C1\c2ccccc2C[C@@H]1NC(=O)c1cccc(Cl)c1 1614970127 FUCGSALEKPTHAR-LDMZPDAISA-N 432.911 4.529 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)c1ccc(OCC(C)C)cc1 1865755733 NSXAVYWMDKRWQN-UHFFFAOYSA-N 437.927 4.820 50 10 IJGE CC(C)N(Cc1ccccc1)S(=O)(=O)c1cc(Br)cc(CCl)c1F 1946864136 WNGNDFNWKKSQNF-UHFFFAOYSA-N 434.758 4.926 50 10 IJGE C[C@@]1(CI)CCC2(O1)[C@H]1CCC[C@H]2CN(Cc2ccccc2)C1 1979910726 UFKVKZOIONOSEC-FHWLQOOXSA-N 425.354 4.661 50 10 IJGE BrCc1cc(Br)c(OCCC2COC2)c(Br)c1 1998054754 OWWPYRULSROGGJ-UHFFFAOYSA-N 428.946 4.522 50 10 IJGE Cc1c(Br)c(CC(CBr)(CBr)C2CCC2)nn1C 2032837093 XGBISKMINIEIKU-UHFFFAOYSA-N 443.021 4.610 50 10 IJGE C[C@H](CCBr)CCN=[S@](C)(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C 2044705059 IJBGHXUOOCKYIS-KDCSIKNMSA-N 441.476 4.835 50 10 IJGE CCCC(CBr)(CCC)CN=S1(=O)CCN(C(=O)OC(C)(C)C)CC1 2044707081 ZTXCBAMHDPLDHN-UHFFFAOYSA-N 439.460 4.687 50 10 IJGE C[C@@]12CN(Cc3ccc(Br)cc3Br)C[C@]1(CBr)C2 2046797245 IIVVJVFMMMLZKH-ZIAGYGMSSA-N 438.001 4.819 50 10 IJGE CC(C)c1ncccc1-n1nc(CCl)c(I)c1C(F)(F)F 2078890032 GHDWSVSCWILGML-UHFFFAOYSA-N 429.611 4.753 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1cccc(Br)c1Cl 2081237487 YDGRBGJBGJYOCS-GZMMTYOYSA-N 444.538 4.682 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1cccc(Br)c1Br 2081239244 PUFUMGZYHJYYGP-GZMMTYOYSA-N 441.989 4.751 50 10 IJGE Fc1cc(Br)c2nc(CCl)n([C@@]34C[C@H]3CN(Cc3ccccc3)C4)c2c1 2099678027 FLXUPRSULGAOSP-VBKZILBWSA-N 434.740 4.908 50 10 IJGE CCN(CC)[C@H](C)CO[C@@H](CI)c1cccc(Br)c1 2119217492 HMQCRVBYPXOTPV-DOMZBBRYSA-N 440.163 4.672 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CCC([C@@H](F)CCl)CC1 2163239114 WAQKWHHSDMJQBS-ZDUSSCGKSA-N 427.539 4.641 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CCC[C@@]23CCC[C@@H](CI)O3)C1 2213354086 IOGQEPVWFYEKHH-YYAJDYIMSA-N 449.373 4.786 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2-c1csnc1Br 2224708481 JFFBDLYKMCWREO-UHFFFAOYSA-N 425.508 4.885 50 10 IJGE COc1ccc([C@H](Br)C[C@@H]2CCO[C@H]2C)cc1I 2257356999 MLLNLTDNCOVDGB-JBLDHEPKSA-N 425.104 4.551 50 10 IJGE C[C@@H](Br)CN(CCC(C)(C)C)S(=O)(=O)[C@H]1C[C@H](OCc2ccccc2)C1 2272427549 BMRZDQAXFFXJGD-BHIYHBOVSA-N 446.451 4.586 50 10 IJGE C[C@H](Br)[C@H]1CCN(Cc2ccc(Cl)c(I)c2)C1 2300240694 PCHAVQDRFXYJAS-ONGXEEELSA-N 428.539 4.550 50 10 IJGE Cl[C@@H]1CCOCC[C@H]1Cc1ccc(I)c(Br)c1 2306200133 UHBQXCZLFLFIPD-CMPLNLGQSA-N 429.523 4.630 50 10 IJGE ClCC[C@H]1C[C@@H](NCc2ccc(I)c(Br)c2)C1 2306216425 FZTVBACAPLIOMH-JGZJWPJOSA-N 428.539 4.551 50 10 IJGE Br[C@@H]1CCC[C@H]2CN(Cc3sccc3I)CC[C@H]12 2316763601 CSOKFMKIAXIJGB-SDDRHHMPSA-N 440.188 4.738 50 10 IJGE CC(C)[C@@H](CBr)N(C)C(=O)c1ccc(Br)cc1Br 2318849170 MQVRWQNFYUJVKW-GFCCVEGCSA-N 441.989 4.703 50 10 IJGE CC(C)Oc1ccc(C=NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cc1Cl 2323766824 FKZLMTUXDJMCEG-UHFFFAOYSA-N 436.126 4.829 50 10 IJGE COc1ccc(C=C(C#N)C(=O)N[C@H](CC(C)C)C(=O)Nc2ccc3ccccc3c2)cc1 2329611084 JIABUPGQWYFYJH-RUZDIDTESA-N 441.531 4.925 50 10 IJGE N#CC(=C(O)CN1C(=O)COc2ccc(Cl)cc21)c1nc(-c2ccc(F)cc2)cs1 2331344497 RHWLNVOVCSORGC-UHFFFAOYSA-N 441.871 4.821 50 10 IJGE C/C(N)=C(/C#N)C(=O)CSc1nc2cc(C(F)(F)F)ccc2n1Cc1ccccc1 9562849 QIVNFERHOOLCHQ-DTQAZKPQSA-N 430.455 4.521 50 10 IJGE CCOc1ccc(NC(=O)CCC(=O)N/N=C/c2ccccc2OCc2ccccc2)cc1 12579198 ROJUMGFAKWWVOZ-OVVQPSECSA-N 445.519 4.533 50 10 IJGE CC/C(=N/NC(=O)COc1ccc(Br)cc1Br)c1ccccc1 34107469 OPZYJLNOCPRIJX-HKWRFOASSA-N 440.135 4.521 50 10 IJGE CCOC(=O)[C@](C)(CC)n1nc([C@@H](C)O[Si](C)(C)C)nc1[C@@H](C)O[Si](C)(C)C 195814668 OEWOHBKIZHWRIV-CLCXKQKWSA-N 429.710 4.791 50 10 IJGE Cc1cc(I)ccc1NC(=O)/C(C#N)=C\N(CC(C)C)CC(C)C 217254175 ISOMKNYOKMONRN-VBKFSLOCSA-N 439.341 4.560 50 10 IJGE O=C(N[C@@H](CCl)Cc1ccccc1)c1cc(Br)sc1Br 236037640 KSVCCPZCVLDGCW-SNVBAGLBSA-N 437.584 4.853 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(OC(C(F)(F)F)C(F)(F)F)CC1 305755287 HGEDWFGAFRVZNA-UHFFFAOYSA-N 444.210 4.661 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCC[C@@H](Br)CC1 378674457 NNCVIJFHVRCCQT-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE Cn1ncc([C@H](Br)c2ccc(F)c3ccccc23)c1I 379204449 JKVCFFFIJILEIQ-CQSZACIVSA-N 445.073 4.801 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@H](c2cc(Br)ccc2F)C1 382696386 VPLRNTMYLKDETK-ZWNOBZJWSA-N 437.147 4.934 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@@H]1CCC[C@]12CC[C@@H](CI)O2 686242767 SZQKDQKGSHMYJB-GGXPGOJBSA-N 449.373 4.929 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc(Cl)c(Cl)c2)cc(Br)c1O 1084016815 VBPDRCOKZIEFLS-UHFFFAOYSA-N 432.101 4.624 50 10 IJGE CC(=O)c1cccc(O[C@H](C)C(=O)NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 1468388490 GQTJGNLSHCOSHO-LLVKDONJSA-N 434.336 4.837 50 10 IJGE C#C[C@@H](NC(=O)NNc1nc2ccc(Cl)cc2s1)c1ccc(Br)cc1 1478896789 RHVXZEBXYRCBFT-CYBMUJFWSA-N 435.734 4.713 50 10 IJGE BrC[C@H](CN1CC[C@@H](Cc2cccc(I)c2)C1)C1CC1 1645784589 YJAMVMGXCXKOEU-GOEBONIOSA-N 448.186 4.577 50 10 IJGE COc1ccc(-c2nn(CC(C)C)c3c2[C@H](c2ccc(F)cc2F)C(C#N)=C(N)O3)cc1 1865701933 IQLDNRAZPIPUOX-HXUWFJFHSA-N 436.462 4.711 50 10 IJGE C[C@@H](Br)C(C)(C)NC(=O)c1c(Br)cccc1Br 1945333205 MQTDCKCDLLBDMP-SSDOTTSWSA-N 427.962 4.503 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@H]([C@@]2(C)CC[C@](C)(CI)O2)CC1 1993736344 WAQQOMDDQRBYFY-DTTOXWODSA-N 437.362 4.833 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1ccsc1Br 2006100483 HOUDHOKCPDCFHN-SECBINFHSA-N 430.149 4.624 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@@](C)(CI)O2)C[C@H]1C1CCC1 2018371740 OMMWTXWVQMOFSK-ZYSHUDEJSA-N 449.373 4.929 50 10 IJGE C[C@H](CCBr)CCN=[S@]1(=O)CC[C@@H](CNC(=O)OC(C)(C)C)C1(C)C 2044706710 WMICHSGKWQEQAS-XESHVACXSA-N 439.460 4.589 50 10 IJGE O=C(CCl)c1cc(OC(F)(F)F)c(C(F)(F)F)cc1I 2055155641 KDDMZAVPLFMTIO-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE Brc1cccc(CN2CC[C@@H](Br)[C@@H]2C2CC2)c1Br 2067016707 NHJBFLASAMHFSN-OCCSQVGLSA-N 438.001 4.959 50 10 IJGE CC(C)N1C[C@@H](Br)[C@@H](Cc2ccc(I)c(Cl)c2)C1 2086651951 LZGNKCYBQWKHET-NWDGAFQWSA-N 442.566 4.591 50 10 IJGE CC1(CNC(=O)OC(C)(C)C)CCN(C[C@H](CBr)c2ccccc2)CC1 2106784175 GRWWVYMQNUNXJS-SFHVURJKSA-N 425.411 4.792 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1ccnn1[C@@H]1CC1(F)F 2121752963 AXXXXWHHGLIWHP-IAGOWNOFSA-N 426.305 4.525 50 10 IJGE O=C(c1ccc(Cl)c(Br)c1)N1CC[C@H](Br)C(F)(F)CC1 2150020028 XGBUQJKRAWLNQW-NSHDSACASA-N 431.502 4.737 50 10 IJGE O=S(=O)(CCC(CCl)CCl)Nc1ccc(Br)c(Cl)c1Cl 2160949102 PBJJJFGNQVWUAS-UHFFFAOYSA-N 444.005 4.982 50 10 IJGE COC[C@]12C[C@]([C@@H](Br)c3cc(Br)c(Cl)cc3F)(CO1)C2 2206081833 JJMNFYZHLVBMAR-IHRRRGAJSA-N 428.523 4.873 50 10 IJGE CC[C@H]1[C@H](Br)CCN1Cc1c(Br)cccc1Br 2251037209 ANJPRIWNASMRRS-OLZOCXBDSA-N 425.990 4.959 50 10 IJGE O=C(c1scc(Br)c1Cl)N1[C@H]2CC[C@@H]1C[C@H](CBr)C2 2264514242 LRCLMHRBJZDFLT-AYMMMOKOSA-N 427.589 4.942 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)[C@@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 2274219766 ICCPFUBNWXOVFU-QZTJIDSGSA-N 425.411 4.742 50 10 IJGE Cc1cncc(CO[C@@H](CI)c2ccccc2Br)c1 2279019867 PLJBNKHGYHZHGC-HNNXBMFYSA-N 432.099 4.845 50 10 IJGE O=C(N[C@@H]1CCC[C@H](CBr)C1)c1cc(F)c(Br)cc1Cl 2282983546 QQJUHJPHMPFBKK-DTWKUNHWSA-N 427.539 4.925 50 10 IJGE CCCNC(=O)C(C#N)=Cc1ccc(OC(=O)C=Cc2ccc(C(C)C)cc2)c(OC)c1 2293202213 YNEJDKDGXGDGPF-UHFFFAOYSA-N 432.520 4.871 50 10 IJGE Clc1ccc(CN2CCC[C@@H]2CCBr)cc1I 2300238379 KCMGYXYNBMDFEU-LLVKDONJSA-N 428.539 4.694 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)cc2I)[C@H]1CBr 2302337363 WWJAEUVSYOYGRM-LBPRGKRZSA-N 428.539 4.550 50 10 IJGE C[C@@H](CCBr)CCN1CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2312817560 AKTHADSPCJDKQO-MELADBBJSA-N 431.337 4.718 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCc2ccccc2)ccc1OC(=O)c1ccc(Cl)cc1 2314737032 IGKIOGZMZRXTOL-UHFFFAOYSA-N 446.890 4.791 50 10 IJGE O=C(NN=Cc1c(Cl)cccc1Cl)c1cccn(Cc2cccc(Cl)c2)c1=O 2323652703 POILAJREYXJSDS-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE Cc1cc(C)c(NC=C(C#N)C(=O)Nc2ccc(I)cc2C)c(C)c1 2325406086 VJJCIFPEXPHFJS-UHFFFAOYSA-N 445.304 4.983 50 10 IJGE CCN(CC)C(=O)c1cc(C)ccc1NC(=O)C(C#N)=Cc1ccc(Br)cc1 2329662860 DUKGWTSXZHAWNG-UHFFFAOYSA-N 440.341 4.785 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@H]1CN(C[C@@]1(CBr)CC1(F)F)C1CC1 2351887631 BBRKVRRRRXPJSM-YJBOKZPZSA-N 437.369 4.661 50 10 IJGE COc1c(F)c(F)cc(C(=O)N(Cc2ccccc2)[C@@H](CBr)C2CC2)c1F 2361224836 HTCTUULLJKYOKM-INIZCTEOSA-N 442.275 4.928 50 10 IJGE Cc1sc(C(=O)N2CCC[C@H](Br)[C@H]2C(F)(F)F)cc1Br 2370254787 ONUVNQYSMMESTR-XVKPBYJWSA-N 435.103 4.749 50 10 IJGE CCCCN(CCCC)Cc1ccc(C(=O)NNC(=S)Nc2ccc(OCC)cc2)o1 20734876 ZPRWCHYZAGIBNP-UHFFFAOYSA-N 446.617 4.712 50 10 IJGE CCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccccc1OC 38650085 UUNWCQAPWYCCKL-XMMPIXPASA-N 442.471 4.531 50 10 IJGE O=C(CCCc1c(-c2ccc3ccccc3n2)[nH]c2ccccc12)NNC(=O)c1ccco1 39867154 RUZXPJIMAGKYHI-UHFFFAOYSA-N 438.487 4.760 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=NNC(=O)COc3ccc(Cl)c(C)c3)o2)cc1 254618003 UNISAEAKUWLGMG-UHFFFAOYSA-N 440.883 4.614 50 10 IJGE Cn1cc(C[C@H](CBr)c2ccccc2Br)c(Br)n1 714085766 QSALKPHIEMIBMP-SECBINFHSA-N 436.973 4.666 50 10 IJGE CCOc1cc(C=NNC(C)=O)cc(Br)c1OCc1ccccc1Cl 725402684 CQKOYAWKLJVYFC-UHFFFAOYSA-N 425.710 4.550 50 10 IJGE CC[C@H](Oc1ccccc1C(C)C)C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1 729968261 LNWRTYNMHSZOAL-SFHVURJKSA-N 437.462 4.517 50 10 IJGE O=C(Nc1ccccc1S[C@H](Cl)C(F)(F)F)N[C@H]1CCN(c2ccccc2)C1=O 731751930 JRQAJMHAMBZITD-YOEHRIQHSA-N 443.878 4.833 50 10 IJGE C[C@@H](NC(=O)NNC(=O)Cc1ccccc1F)c1ccccc1-c1ccc(Cl)cc1 740060962 BIYZFTPBGFRCPI-OAHLLOKOSA-N 425.891 4.780 50 10 IJGE COc1cc(/C=C(\C#N)c2ncc(C(F)(F)F)cc2Cl)ccc1OCCC(=O)O 763372205 ARNISEJXVGEZTN-WUXMJOGZSA-N 426.778 4.680 50 10 IJGE O=C(NNc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 773648230 QKBCYPUDUZTXTQ-UHFFFAOYSA-N 445.262 4.650 50 10 IJGE O=C(NNc1ccc2c(=O)[nH]ccc2c1)[C@@H](Oc1ccc(F)c(Cl)c1)c1ccccc1 803439295 ZQDRTZGVCUCGBO-NRFANRHFSA-N 437.858 4.584 50 10 IJGE Cc1cc(C=NNC(=O)C(=O)Nc2ccc(C(C)C)cc2)c(C)n1-c1ccc(Cl)cc1 1084183939 BDGBVXZVXLBFHS-UHFFFAOYSA-N 436.943 4.960 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3ccc(-n4ccc(O)n4)cc3)c2C)cc1 1586207847 DMNQPMUQNQUEGC-QNGOZBTKSA-N 437.503 4.840 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)CCc1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 1679305469 NCQIGGPKPHOUMS-HXUWFJFHSA-N 449.473 4.685 50 10 IJGE C#Cc1cccc(CNC(=O)NNC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)c1 1683150750 FKMPBRSBZGBPFS-UHFFFAOYSA-N 449.963 4.758 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1ccccc1OC)C(C#N)=C(N)O2 1865709739 FXHVOHJPDDGKLE-HXUWFJFHSA-N 438.890 4.513 50 10 IJGE CN(CC(C)(C)CI)[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 1904651987 WDLDGLPJWIYGLZ-BWTSREIZSA-N 426.386 4.575 50 10 IJGE CC(C)(CCl)N(Cc1ccccc1)C(=O)c1ccccc1I 1915772024 UAMKVVCTDFQHSI-UHFFFAOYSA-N 427.713 4.951 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1ccc(C(F)(F)F)cc1 1916350201 XQHYHUWIVWMYHG-QGZVFWFLSA-N 430.264 4.758 50 10 IJGE C[C@H]1OCC[C@@]1(CBr)Cc1cccc(Br)c1Br 1943886828 YGOZOZVKUJKNBF-RNCFNFMXSA-N 426.974 4.944 50 10 IJGE Cc1nc(C(=O)N(CCCBr)Cc2ccccc2)c(Br)s1 1956719988 KLXZAVNWAAATPF-UHFFFAOYSA-N 432.181 4.641 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1nc(C)ccc1Br 1980431012 VPAHQEURRKCAMH-OAHLLOKOSA-N 440.179 4.968 50 10 IJGE Cc1ccc(CO[C@](C)(CI)CNC(=O)OC(C)(C)C)cc1C 1994340504 VMOFSJPZCJYBGF-GOSISDBHSA-N 433.330 4.538 50 10 IJGE Cc1cccc(COC2(CI)CCN(C(=O)OC(C)(C)C)CC2)c1 2024647382 YUCXFNHXJMUTMM-UHFFFAOYSA-N 445.341 4.716 50 10 IJGE Cc1nn(C)c(CC(CBr)(CBr)C2CCC2)c1Br 2029226314 VDHJYXSMXZKXMA-UHFFFAOYSA-N 443.021 4.610 50 10 IJGE FC(F)C1CC(O[C@@H](CI)c2ccc(Br)cc2)C1 2035654750 OZNZIGONVSDOLT-NHNAUAITSA-N 431.058 4.986 50 10 IJGE O=C(N[C@@H](CBr)CC(F)(F)F)c1cc(Br)c(Cl)s1 2052453385 INXLFOQUDXJWAF-SCSAIBSYSA-N 429.483 4.610 50 10 IJGE BrC[C@H]1C[C@@]2(CCN2Cc2cccc(Br)c2Br)C1 2061793701 VCRGWHVSNNNZAR-YPFXGUDJSA-N 438.001 4.961 50 10 IJGE FC(F)(F)c1c(Br)c(CBr)nn1-c1cccnc1C1CC1 2078909758 LUUVLBVRLLSYIQ-UHFFFAOYSA-N 425.046 4.821 50 10 IJGE COc1ncc(C)c(-n2nc(CBr)c(Br)c2C(F)(F)F)c1C 2078914924 ZUHRZRCBGUCDFZ-UHFFFAOYSA-N 443.061 4.569 50 10 IJGE CCN(C[C@@H](CBr)c1ccccc1)C[C@H]1CCCN1C(=O)OC(C)(C)C 2106782948 VKSGQJUQIZMCHN-RTBURBONSA-N 425.411 4.887 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1C[C@@H](CBr)[C@H](C(F)(F)F)C1 2107044735 ITKVKSUHBRBQGD-UKRRQHHQSA-N 448.304 4.973 50 10 IJGE Cn1cc(S(=O)(=O)N(Cc2ccccc2)CC2CCCCC2)cc1CBr 2123231277 BUNALXICMCCYTO-UHFFFAOYSA-N 439.419 4.691 50 10 IJGE FC(F)[C@@H]1CCN(c2c(CBr)ccc(Br)c2Cl)CCO1 2154364868 LVGYVMUHQWGJLH-JTQLQIEISA-N 433.518 4.858 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H](C(=O)O)N(CCCCCCCCCBr)C1 2188789624 YBMCFNJALMOGBS-SJORKVTESA-N 449.430 4.554 50 10 IJGE COC[C@]12C[C@]([C@H](Br)c3cc(Cl)c(Br)cc3F)(CO1)C2 2206079261 UPXNDEKWMINHJI-MGPQQGTHSA-N 428.523 4.873 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@@H]1CCl 2208030626 TZHFOYZPOLTWCK-VHSXEESVSA-N 438.058 4.794 50 10 IJGE C[C@H]1C[C@@H](CCNC(=O)OC(C)(C)C)CCN1CCCCCI 2211188183 YQPKSAZTWFKYRF-HOTGVXAUSA-N 438.394 4.607 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)S(=O)(=O)Cc1ccc(Br)cc1 2213761181 RPFFERPYTIYXHC-SFHVURJKSA-N 430.795 4.799 50 10 IJGE ICCCCCN1C[C@]23CCC[C@]2(C1)CN(Cc1ccccc1)C3 2214705323 QFICAVMLHHYZTB-SFTDATJTSA-N 438.397 4.580 50 10 IJGE Br[C@@H]1CCC[C@@H]2CN(Cc3ccc(I)cc3)CC[C@@H]21 2225475351 UMUUTYXWLIRBDT-VNQPRFMTSA-N 434.159 4.677 50 10 IJGE Cc1cccc([C@H](CBr)OCCOCCOCCOCc2ccccc2)c1 2236089116 PCQXYAUBKJMSLN-QFIPXVFZSA-N 437.374 4.698 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(CCCCI)c2ccccc21 2243586410 POMFZNNNBIGCHG-HNNXBMFYSA-N 430.330 4.678 50 10 IJGE C[C@]1(CNc2ncc(I)cc2Br)CCC[C@H]1Cl 2249866242 XJXZGSFETVLIBR-ZYHUDNBSSA-N 429.527 4.658 50 10 IJGE COc1ccc([C@H](Br)[C@H]2C[C@@H]3CC[C@H](C2)O3)cc1I 2269542310 FUKZHWOIOAJRRK-OHTBPHCPSA-N 437.115 4.693 50 10 IJGE COc1ccc([C@H](Br)C2C[C@H](C)O[C@@H](C)C2)cc1I 2269555935 KCQPSNMVCAVRTB-YHAQOWFVSA-N 439.131 4.939 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CC(F)C2)[C@@H](c2ccccc2)C1 2280358282 AEXLEQUYEWQYNW-IDYZSHNDSA-N 441.385 4.794 50 10 IJGE COc1ccnc(N(C)[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c1CBr 2281101850 QPLKMUYAORJUQW-REPLKXPHSA-N 430.390 4.617 50 10 IJGE C[C@@H]1CC[C@@H](CBr)CN1C(=O)c1cc(F)c(Br)cc1Cl 2282973913 FIRFQSMFJVFMHD-BDAKNGLRSA-N 427.539 4.877 50 10 IJGE Cc1ccccc1[C@@H](C)NC(=O)C(C#N)=Cc1c[nH]nc1-c1ccc(Br)cc1 2297435331 DHOWSVPAUOLUNY-OAHLLOKOSA-N 435.325 4.932 50 10 IJGE C[C@](CCl)(NCc1ccc(I)c(Br)c1)C1CC1 2306221282 GEFBCUCCVFUBRJ-CYBMUJFWSA-N 428.539 4.551 50 10 IJGE CCCOc1c(Br)cc(C=C(C#N)C(=O)Nc2ccccc2F)cc1OC 2313631565 RXRWLNOVSFASOQ-UHFFFAOYSA-N 433.277 4.931 50 10 IJGE C[C@@H](Br)CCCN(C)C(=O)c1cc(Br)ccc1Br 2314600016 ZNQBIKHRDANCLS-SECBINFHSA-N 441.989 4.847 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC(=O)C(C#N)=CNc1ccc(Cl)c(C(F)(F)F)c1 2325217023 ULMMWPCFIHCTDW-UHFFFAOYSA-N 440.765 4.734 50 10 IJGE Cc1sc(Br)cc1C(=O)N1CCC[C@@H](Br)[C@@H]1C(F)(F)F 2370247771 ODXXWHKXJVPORJ-PSASIEDQSA-N 435.103 4.749 50 10 IJGE COCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@](C)(CBr)C(C)(C)C 2380165134 QGWXHCFTNWTEFS-UWJYYQICSA-N 449.474 4.782 50 10 IJGE COc1ccc2c(Cl)c(C(=O)N/N=C3\C(=O)N(CC(C)C)c4ccccc43)sc2c1 6171071 YWTOHRCQKCDAOC-CLCOLTQESA-N 441.940 4.700 50 10 IJGE CC[C@H](C)c1nc(N2CCN(C(=O)[C@@H](C)Cl)CC2)c2c3c(sc2n1)CCCCC3 35892444 CXMQCXPXPCXWFC-LSDHHAIUSA-N 435.037 4.750 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccc([C@@H]2CN(S(=O)(=O)c3ccccc3)CCO2)cc1 616602385 ITHCYPQOAQGWTP-QFIPXVFZSA-N 447.673 4.971 50 10 IJGE C[C@@H](O[C@](C)(CI)CNC(=O)OC(C)(C)C)C1CCCCC1 719737137 PYLMBVDLSRSLJB-CXAGYDPISA-N 425.351 4.690 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)/C=C(\c2ccc(Cl)cc2)C(F)(F)F)c1C 771023065 PUDYVMSRTVEUTE-LICLKQGHSA-N 447.848 4.898 50 10 IJGE Cn1cc([C@H](NS(=O)(=O)c2cccc(S(F)(F)(F)(F)F)c2)C(F)(F)F)cn1 774947170 CZOZOFIXCPEODE-NSHDSACASA-N 445.357 4.659 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1OCc1ccccc1 1083981539 SQBOMHMKCLSZSI-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE C=CC[C@@H](CO)CNC(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1152930139 LNSUGFSSXAFGKL-TWIVVOHQSA-N 432.351 4.609 50 10 IJGE C=CCCC[C@H](C(=O)NNC(=O)Nc1cc(Cl)c(OC)cc1OC)c1ccccc1 1155427663 OHOUCFZZLIADHD-INIZCTEOSA-N 431.920 4.650 50 10 IJGE Cc1cc(Cl)ccc1NNC(=O)[C@H](C)SCc1nc(O)c2c(C)c(C)sc2n1 1303447039 KBUGPWLZKWEYDU-LBPRGKRZSA-N 436.990 4.741 50 10 IJGE C#CCN(C(=O)CCCC[C@@H]1CCSS1)C1CCN(C(=O)OC(C)(C)C)CC1 1455815133 XWPKRWIJOVZWJB-GOSISDBHSA-N 426.648 4.562 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)COc1ccccc1-c1ccccc1)c1ccccc1 1478257182 JLZOOAKFLLNZQS-HSZRJFAPSA-N 429.520 4.770 50 10 IJGE C=C(C)Cn1c(SCC(=O)NNc2cccc(Cl)c2Cl)nnc1-c1ccco1 1570158669 GNWAGZXAQWRTSR-UHFFFAOYSA-N 438.340 4.656 50 10 IJGE C=C(Cl)C[C@@H](NS(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1)C(=O)OCC 1670885802 CNCKEBCLFCMYDB-GFCCVEGCSA-N 443.843 4.697 50 10 IJGE CCOc1ccc(C=NNC(=O)COc2cc(C)c(Cl)c(C)c2Br)cc1 1772756506 FZRJWIAOAKCRQZ-UHFFFAOYSA-N 439.737 4.647 50 10 IJGE COc1ccc(Cc2nc3ccc(C(=O)Nc4ccc(SC#N)cc4)cc3[nH]2)cc1OC 1861849269 BYWHEGRAAREDJL-UHFFFAOYSA-N 444.516 4.996 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@H](c1ccccc1C(=O)O)C(C#N)=C(N)O2 1865703772 FKISULKPDYVDOF-JOCHJYFZSA-N 436.471 4.504 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Cl)CCc1ccc(Cl)c(Br)c1 1905406421 SLMREMKDSWUGEL-LBPRGKRZSA-N 427.125 4.939 50 10 IJGE CCCn1nc(Br)nc1N(Cc1ccccc1)C1(CBr)CCC1 1905467258 RELXEMJUZBLTBV-UHFFFAOYSA-N 442.199 4.775 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)Cc1ccc(C(F)(F)F)cc1 1916355554 WABWMTRDLCNPLM-SFHVURJKSA-N 444.291 4.687 50 10 IJGE COC[C@]1([C@@H](Br)c2cc(Br)sc2Br)CCCO1 1943037280 RAVYERHCHFIRFZ-ONGXEEELSA-N 449.002 4.905 50 10 IJGE CCC[C@H](CBr)CN(Cc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 1953585894 YZNBLULNFWEWFU-GOSISDBHSA-N 425.411 4.919 50 10 IJGE CC[C@H](Br)CN(C)C(=O)c1csc(Br)c1Br 1977855898 VGGPTOTVELINQY-LURJTMIESA-N 433.991 4.519 50 10 IJGE CC(C)(C)[C@H](CCl)CNc1ncc(I)cc1Br 2015765863 HPQMGDCYFRWDLX-MRVPVSSYSA-N 431.543 4.762 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1c(Cl)cccc1Br 2081246893 RGAPWSCIGDPMHQ-KWQFWETISA-N 444.538 4.682 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CC2(CBr)CCC2)CC[C@@H]1C(F)(F)F 2106785311 OOXVHGMDJKWGTF-KGLIPLIRSA-N 443.348 4.577 50 10 IJGE CCC[C@H](CBr)CN1CC[C@@H](C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)C1 2106787496 ZHXDUCPPUTVMSM-RBSFLKMASA-N 445.364 4.823 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H]3CC[C@@H](CN3C[C@@H](CBr)C(C)(C)C)[C@H]2C1 2106788888 UHIGIMVZKLBFDX-PNKHAZJDSA-N 429.443 4.621 50 10 IJGE C[C@@H]1CCCC[C@@]1(CNC(=O)OC(C)(C)C)NC(=O)[C@@H](Br)C1CCCC1 2110723285 NFYUJJKAALLQKS-IIMJZQEZSA-N 431.415 4.530 50 10 IJGE CCN(c1ccc([N+](=O)[O-])cc1CBr)C1CCN(Cc2ccccc2)CC1 2143592979 FNQZTSKQQHIMEI-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE Cc1sc(Br)cc1[C@@H](Br)c1ccc2c(c1)CCS2(=O)=O 2170066471 HPLKYWPONNFWSR-AWEZNQCLSA-N 436.190 4.633 50 10 IJGE O=C(c1ccccc1OCc1ccccc1)N1CCC(OCCCBr)CC1 2207532124 OVOMBZNTMZAHPB-UHFFFAOYSA-N 432.358 4.672 50 10 IJGE Cc1sc(C(=O)N2C[C@]3(F)CCC[C@@]3(CBr)C2)cc1Br 2234472770 YFJKFHYNYIYUHI-ZIAGYGMSSA-N 425.161 4.548 50 10 IJGE Cc1cccc(Oc2nc3sccn3c2CBr)c1I 2277897133 OTMOUEXAOBDNAM-UHFFFAOYSA-N 449.111 4.996 50 10 IJGE COc1ccc(CNC(=O)[C@H](Br)C2CCCC2)cc1NC(=O)OC(C)(C)C 2284168785 FIQCULWJXJRGKX-QGZVFWFLSA-N 441.366 4.612 50 10 IJGE CCOc1cc(C=C(C#N)c2nc3ccccc3[nH]2)ccc1OCc1ccc(C(=O)O)o1 2297372173 BMCGMJYOCVEJAB-UHFFFAOYSA-N 429.432 4.896 50 10 IJGE COc1ccc(-c2ccc(C(=O)NN=C(C)c3ccc(SC)cc3)c(C)n2)cc1OC 2321281162 YALQLDDJDBNTER-UHFFFAOYSA-N 435.549 4.950 50 10 IJGE COc1ccc(C=NNC(=O)c2cccnc2)cc1OCc1ccc(Cl)cc1Cl 2321681353 OCYRBVDONNJANF-UHFFFAOYSA-N 430.291 4.740 50 10 IJGE CCCCCOc1c(OC)cc(C=NNC(=O)Nc2ccc(Cl)cc2)cc1[N+](=O)[O-] 2323858106 FHKBKQMKWSHRKW-UHFFFAOYSA-N 434.880 4.981 50 10 IJGE Cc1ccc(NC=C(C#N)C(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1 2324598910 DJQMYXARCBYREO-UHFFFAOYSA-N 436.559 4.748 50 10 IJGE C[C@H]1CC[C@H](CBr)N(Cc2cc(I)ccc2Cl)C1 2327402150 UZYTZFMTMUXWNH-GXFFZTMASA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NN=Cc1ccc(Cl)cc1Cl 2328826231 GVCNBMFUUBALNU-SFHVURJKSA-N 436.339 4.580 50 10 IJGE CC(C)N1C(=O)c2ccc(C(O)=C(C#N)c3nc(-c4ccc(F)cc4)cs3)cc2C1=O 2331342636 NFQSKMHNYXGIOI-UHFFFAOYSA-N 433.464 4.903 50 10 IJGE CN(Cc1cc(Br)cs1)c1c(CBr)c(C(F)F)nn1C 2365335088 ILOHDSPFYDUYCS-UHFFFAOYSA-N 429.128 4.713 50 10 IJGE O=C(/C=C/c1cccc2ccccc12)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1 13982202 RSBRPZPARYORNL-OBGWFSINSA-N 435.483 4.567 50 10 IJGE CCCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(I)cc2C)cc1 33378334 AAQOMBGAJNWIPN-VBKFSLOCSA-N 446.288 4.934 50 10 IJGE CCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cccc(OC)c1 38650240 YEYPTDATPAREMQ-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE Cc1cc(C)cc(Nc2ncnc(NNC(=O)c3cccc4ccccc34)c2[N+](=O)[O-])c1 40583055 RMZDGFRWPGQXAO-UHFFFAOYSA-N 428.452 4.655 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCc3csc(C(C)C)n3)c2C)cc1 111124581 JFAIDTLYBPENBJ-ODLFYWEKSA-N 434.565 4.906 50 10 IJGE CCCCCCOc1ccccc1C(=O)/C=N/NC(=O)Cc1cc(OC)ccc1Cl 169922009 SGOSUPMMCPKESJ-PCLIKHOPSA-N 430.932 4.835 50 10 IJGE O=[N+]([O-])c1cc(CBr)ccc1Oc1ccc(I)cc1 218201239 PTTAVRQYYQZYGZ-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE CCOc1ccc(C=NNC(=O)c2nc(-c3ccccc3)cc(-c3ccccc3)n2)c(O)c1 252608333 HJHZAHOUMNZUQA-UHFFFAOYSA-N 438.487 4.679 50 10 IJGE C#CCOc1ccccc1C=NNC(=O)CNC(=O)CCCCCCCCCCCCC 254438879 GXRZNFDYRSOZIV-UHFFFAOYSA-N 441.616 4.966 50 10 IJGE Clc1cc(CBr)ccc1N1CCO[C@H]2CCN(Cc3ccccc3)C[C@H]21 404143985 GZPMCDLQORLUCV-RTWAWAEBSA-N 435.793 4.715 50 10 IJGE O=C(c1cccc(OCc2ccccc2)c1)N1C[C@@H](CBr)[C@H](C(F)(F)F)C1 709886693 FEOWUSJHNKFFLQ-SJLPKXTDSA-N 442.275 4.911 50 10 IJGE CCN(C[C@](C)(CI)OCCCC1CC1)C(=O)OC(C)(C)C 711532973 IDAVGJDLIYCSPT-KRWDZBQOSA-N 425.351 4.644 50 10 IJGE Clc1ccc(I)c(CN[C@H](CBr)C2CCC2)c1 717646880 BPBQWPRYKPLJQE-CYBMUJFWSA-N 428.539 4.598 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@H]2CC[C@H](Cl)[C@H]1C2 721559251 HZQAYYJCQHGBND-FKTZTGRPSA-N 427.589 4.895 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2C[C@@H]3CCCC[C@H]3C2)c(-c2ccc(Cl)cc2)n1 750139892 IQFBYJKCONNJEL-HPNAEPITSA-N 433.943 4.673 50 10 IJGE CN(C[C@H]1CC=CCC1)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 784316493 ASXPKPPGLVYRIZ-OFBHVFLISA-N 433.943 4.839 50 10 IJGE CCOc1cc(OCC)c(C=NNC(=O)c2cc3ccccc3o2)cc1Br 1083962981 WCSFQWNDCSBIIW-UHFFFAOYSA-N 431.286 4.757 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)c1cccc(Cl)c1 1523453795 WIDFTDWCKNDFAH-SSZFMOIBSA-N 438.886 4.923 50 10 IJGE CCOc1ccc(OC)cc1C=NNC(=O)[C@H](C)Oc1ccc(OCc2ccccc2)cc1 1565517698 TVWQKCISGOHBCG-IBGZPJMESA-N 448.519 4.591 50 10 IJGE O=C(CCCC(=O)NN=Cc1ccc2ccccc2c1)NN=Cc1ccc2ccccc2c1 1565517867 MDLHALBVLUFVET-UHFFFAOYSA-N 436.515 4.764 50 10 IJGE CC(=O)c1ccc(OCCCC(=O)NNc2ccc(Cl)cc2Br)cc1 1642289810 SPTWVHWLYCISMS-UHFFFAOYSA-N 425.710 4.607 50 10 IJGE Cc1cc(C)c(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)c(C)c1Br 1650818009 UFRUQMAUUGQDSO-UHFFFAOYSA-N 440.345 4.600 50 10 IJGE O=C(CCBr)c1ccc(I)c(SC(F)(F)F)c1 1848425910 QZGJHUAQCCWJQE-UHFFFAOYSA-N 439.034 4.871 50 10 IJGE CCCc1nn(-c2cccc(Cl)c2)c2c1[C@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706207 QEDKAKZTKPHGBK-LJQANCHMSA-N 435.871 4.605 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@H]1c1cccc(F)c1 1865710888 KTCHAUAXACDUBW-INIZCTEOSA-N 448.807 4.961 50 10 IJGE COc1ccc(OC)c(/C(C)=N/NC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)c1 1865762910 JUDHNVNJQRJSIT-MZJWZYIUSA-N 425.435 4.506 50 10 IJGE Cc1cc(Cl)c(C[C@@H](Br)CN2C(=O)c3ccccc3C2=O)c(Cl)c1 1893708322 GFYSEZSEFRNCPY-LLVKDONJSA-N 427.125 4.904 50 10 IJGE CCN(C[C@@](C)(CI)OC[C@H]1CC12CCC2)C(=O)OC(C)(C)C 1902102929 VIWAXXIPARWFSE-RHSMWYFYSA-N 437.362 4.644 50 10 IJGE Cc1cccc(C(=O)N(Cc2ccccc2)C[C@@H](C)Cl)c1I 1914638637 PIQSBKLVMRJLSZ-CQSZACIVSA-N 427.713 4.869 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)Cc1ccc(Cl)c(Cl)c1 1916334010 BFUKNEIJPXCHBZ-MRXNPFEDSA-N 445.184 4.975 50 10 IJGE ClCCc1nc2cccc(Br)c2n1Cc1csnc1Br 1925106363 WVOKNXRGWOVSNW-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CCCN1C[C@@H](Br)[C@@H](c2c(Br)cccc2Br)C1 1950850555 LDYPZSGVGMLQPX-JOYOIKCWSA-N 425.990 4.784 50 10 IJGE CC(C)[C@@H](CCl)N(Cc1ccccc1)S(=O)(=O)C1CC(OCc2ccccc2)C1 1958927926 GQJXZEABLDLRNJ-XPPIMPSXSA-N 436.017 4.830 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC1(C2)CC2(CC[C@H](CI)O2)C1 2012872809 CSAWJWCWYZZIHL-SOUVJXGZSA-N 447.357 4.681 50 10 IJGE C[C@@H](CCBr)CCNCc1ccc(I)c(Cl)c1 2026562482 BGRSUCRBYVZVGX-JTQLQIEISA-N 430.555 4.845 50 10 IJGE COc1cccc(NC=C(C#N)C(=O)CSc2ncc(C(F)(F)F)cc2Cl)c1 2038554935 LNRIWWMJQFQTJD-UHFFFAOYSA-N 427.835 4.943 50 10 IJGE O=C(Nc1ccc(I)cc1Cl)[C@H](Br)C1CCCC1 2048139360 JAYLGKLXCOODQX-GFCCVEGCSA-N 442.522 4.837 50 10 IJGE CC(C)[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)ccc1F 2059264136 ASWXCTOWMSKXPS-OAHLLOKOSA-N 428.367 4.956 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1cc(Cl)cc(Br)c1 2090386409 ZOHZSEPFDLWWTI-SNVBAGLBSA-N 429.605 4.739 50 10 IJGE ClCc1cc(N2CC[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)ncc1Br 2092524710 SNTHLABIAOLOCR-MJGOQNOKSA-N 434.809 4.931 50 10 IJGE C[C@@H]1CC[C@@H](C[C@H](Br)c2cc(I)cc3c2OCC3)O1 2104815146 YVRLCVAGBQTZEA-LQJRIPTKSA-N 437.115 4.620 50 10 IJGE ClCc1nc2cncc(Br)c2n1C[C@]12CC[C@H]1CN(Cc1ccccc1)C2 2201228588 JOBSCLICQLQACS-HRAATJIYSA-N 445.792 4.845 50 10 IJGE COC[C@]1([C@@H](Br)c2cc(Br)cc(Cl)c2OC)CCCO1 2203013817 YPAXLEHDGZYSBL-KBPBESRZSA-N 428.548 4.743 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1sc(C)c(Br)c1C 2218969682 PCALAXHLSFYJFH-GMSGAONNSA-N 444.176 4.707 50 10 IJGE Cc1c(Br)csc1C(=O)N1C[C@]2(F)CCC[C@@]2(CBr)C1 2234508778 WXEJUKRRGJOQPR-ZIAGYGMSSA-N 425.161 4.548 50 10 IJGE C[C@](CBr)(OCCOCCOCCOCc1ccccc1)c1ccccc1 2236090506 YNDRXVFLLUCROM-JOCHJYFZSA-N 437.374 4.563 50 10 IJGE CC(C)(C)OC(=O)NC1CC(C[S@@](C)(=O)=NCCCCCCCBr)C1 2263161422 ACXNFCHPPGMHLU-ZLWIMJCWSA-N 439.460 4.733 50 10 IJGE CN(C)C(=O)C(C#N)=Cc1cc(Cl)c(OCc2ccccc2F)c(Br)c1 2313567185 HUOBUNBEJKPGPB-UHFFFAOYSA-N 437.696 4.816 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)[C@H](C)Oc2ccc(Cl)cc2C)cc1 2314776821 CMELECQTWWYROT-KRWDZBQOSA-N 440.927 4.845 50 10 IJGE CCN(CC)Cc1ccc(C=NNC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)cc1 2321218329 AJSBASREVOHZEQ-UHFFFAOYSA-N 436.506 4.941 50 10 IJGE C[C@@H]1C[C@@H](CCl)CN(Cc2ccc(I)c(Br)c2)C1 2325206300 DBWYRXUTPLEYAZ-PWSUYJOCSA-N 442.566 4.751 50 10 IJGE CC(C)(C)[C@H]1CCc2c(sc(NC(=O)C(C#N)=Cc3ccc(F)cc3)c2C(N)=O)C1 2329644226 NZEDSFRNXFTUDT-HNNXBMFYSA-N 425.529 4.683 50 10 IJGE CCCCCCOc1ccccc1C(=O)NNC(=O)COc1ccccc1[C@@H](C)CC 7659864 PIZJZHRWEIUCII-IBGZPJMESA-N 426.557 4.999 50 10 IJGE Br[C@H](c1ccc(I)cc1)c1ccc2c(c1)OCCO2 109851214 XETLBHRTLXHOJY-OAHLLOKOSA-N 431.067 4.547 50 10 IJGE O=C(N[C@@H](CBr)Cc1ccccc1)c1ccc(Br)c(Cl)c1 122436202 GWRNMFGWEAQXTA-CYBMUJFWSA-N 431.555 4.839 50 10 IJGE CCCOc1cc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccccc4)nc3c2)ccc1OC 169925820 HEMRHHHKRJEVIA-PKAZHMFMSA-N 442.519 4.715 50 10 IJGE COc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4)nc3c2)cc1Br 169926817 XHMGLCYAIKLYRB-ZMOGYAJESA-N 449.308 4.765 50 10 IJGE C[C@@H](CCBr)CCNC(=O)c1ccc(Br)cc1Br 397737993 IVEXUCIPMQRJSK-VIFPVBQESA-N 441.989 4.753 50 10 IJGE ClCc1ccc(Br)cc1N1CC[C@]2(CN(Cc3ccccc3)CCO2)C1 717590451 DTDZFRJLNURJGG-NRFANRHFSA-N 435.793 4.669 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cn(Cc3ccccc3)c3ccccc23)c1C 736691152 INHQWZMYGUSLRE-UHFFFAOYSA-N 448.530 4.915 50 10 IJGE Cc1ccccc1SCC(=O)NN=Cc1c(C)nn(Cc2ccccc2Cl)c1C 1084268929 WBMHZAPBLNITIR-UHFFFAOYSA-N 426.973 4.752 50 10 IJGE CC(=O)N(c1nc(/C=C\C(=O)Oc2ccc([N+](=O)[O-])c(C)c2)cs1)c1ccccc1F 1086866709 DXIXZOIZJQNUSL-YFHOEESVSA-N 441.440 4.802 50 10 IJGE CC(=O)N(C)c1ccc(CNC(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(C)c3)c2C)cc1 1529209820 JURVLNRPLCCLRL-IWIPYMOSSA-N 440.547 4.609 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2F)[C@H]1c1ccc(Cl)cc1 1865683518 LQDSJJDSSJVMSW-INIZCTEOSA-N 448.807 4.961 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccccc2F)cc1 1865692199 KKVDILRDNPRGJZ-HSZRJFAPSA-N 432.499 4.776 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)C(c3ccccc3)c3ccccc3)c(C)n2)cc1 1865757524 HQNFQOZQXMEQFI-UHFFFAOYSA-N 435.527 4.959 50 10 IJGE CCCC[C@@H](NC(=O)c1cc(-c2ccccc2)on1)C(=O)Nc1ccc(SC#N)cc1 1866823341 UVKZZTNQDIGRGA-LJQANCHMSA-N 434.521 4.842 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(OCCCOCc2ccccc2)C1 1881762289 ALZNOEGJSNKNRL-OAQYLSRUSA-N 442.394 4.775 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)CCc1cc(Cl)ccc1Cl 1905345124 YMSLTYOBFJYNET-LBPRGKRZSA-N 427.125 4.986 50 10 IJGE Brc1cccnc1C[C@@H](Br)c1nscc1Br 1924863862 IZWHTMVRBJXJOM-SSDOTTSWSA-N 426.959 4.742 50 10 IJGE Fc1cc(Br)cc(N(Cc2ccccc2)C2COC2)c1CBr 1961320053 BACAILDOHVSNIY-UHFFFAOYSA-N 429.127 4.889 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CCC[C@H](CI)O2)C12CCC2 1991821665 SROLOEFCGUGCDQ-RDTXWAMCSA-N 435.346 4.683 50 10 IJGE Clc1sc(Br)c(Cl)c1[C@H](Br)[C@@H]1CO[C@H]2COC[C@H]12 2040325159 JSJHUUGFHXUNJW-MNCSTQPFSA-N 436.980 4.915 50 10 IJGE CCC(CC)(CBr)CN=[S@@](C)(=O)CC1CC(NC(=O)OC(C)(C)C)C1 2052164959 MOBKDKRPNCQRON-VIYKHHQCSA-N 439.460 4.589 50 10 IJGE CC(C)[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1cc(F)ccc1CBr 2059268185 WFTMBPJHLUWMCD-OAHLLOKOSA-N 428.367 4.956 50 10 IJGE Cl[C@H]1CCC12CC(CNc1ncc(I)cc1Br)C2 2074781028 FCBXKPJMOFOZJY-SAVVLTDYSA-N 441.538 4.658 50 10 IJGE CCCc1ccnc(-n2nc(CBr)c(Br)c2C(F)(F)F)c1 2078914475 QMSGMZOQRIAGLO-UHFFFAOYSA-N 427.062 4.896 50 10 IJGE Cc1cc(Cn2nc(CCl)c(I)c2C(F)(F)F)ccc1F 2079211470 SFPBYCGTLBMDHQ-UHFFFAOYSA-N 432.586 4.741 50 10 IJGE CC[C@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@H]1CBr 2086660219 CEHVJVQBQXHLBL-NWDGAFQWSA-N 442.566 4.798 50 10 IJGE CCCc1nc(Br)c(Br)n1CCc1nc(CCl)cs1 2087651207 VJCNWCJPCQHQAH-UHFFFAOYSA-N 427.593 4.799 50 10 IJGE CC(C)[C@H](Br)C(=O)N1C[C@@H](NC(=O)OC(C)(C)C)CC12CCCCCC2 2106597075 NCLOKGIJTVNSBW-HOTGVXAUSA-N 431.415 4.625 50 10 IJGE CC(C)CN(C[C@@H](CBr)c1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 2106787476 ZECNZXHDDACMPY-GOSISDBHSA-N 425.411 4.742 50 10 IJGE CC(C)(C)OC(=O)NCCC[C@@H]1CCCCN1C(=O)[C@H](Br)C1CCCC1 2110716717 AFFNDMVYBWBNIM-DLBZAZTESA-N 431.415 4.626 50 10 IJGE Cn1cnc(Cl)c1COc1c(Br)cc(Br)cc1CCl 2111946427 MYCXQTGMCLEUAU-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CN(C[C@H](CBr)CC2CC2)C2CC2)CC1 2112869367 SHPKIHYOZBKYTL-SFHVURJKSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCC[C@H](NC(=O)c2ccc(CBr)cc2)CC1 2133337559 RDJWVONBPVPHQR-IRXDYDNUSA-N 425.367 4.537 50 10 IJGE COCc1cc(Br)c([C@H](Br)[C@H]2C[C@H](OC)[C@H](OC)C2)s1 2174889809 VMULKBAXOGEDML-WRSRJMLGSA-N 428.186 4.533 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@]2(F)CCC[C@@]2(CBr)C1 2176641183 SAECQLNAIZSIRZ-CHWSQXEVSA-N 445.579 4.893 50 10 IJGE CC1CC(CBr)(CN2CC[C@H](C(F)(F)F)[C@@H](NC(=O)OC(C)(C)C)C2)C1 2265313827 MMGOSCNIHOMWBI-CWVKQELPSA-N 443.348 4.575 50 10 IJGE O=C(N[C@@H]1CC[C@H]2C[C@@]21CBr)c1cc(F)c(Br)cc1Cl 2282990568 SYXAJEBDIATXIG-AAAAQAOESA-N 425.523 4.535 50 10 IJGE CCC[C@@H]1CN(C(=O)c2ccc(Cl)c(I)c2)C[C@@H]1CCl 2283652326 SVTPFRAJBHKYBP-NEPJUHHUSA-N 426.125 4.672 50 10 IJGE O=C(c1ccc(Cl)c(I)c1)N1CCC[C@H](CCCl)CC1 2283655890 VZRMIJRYDXEMKJ-LLVKDONJSA-N 426.125 4.816 50 10 IJGE CCO[C@@H]1[C@@H](Br)C[C@@H]1Oc1cc(Br)cc(Br)c1 2301115263 OJKRTZOZDJPANW-SDDRHHMPSA-N 428.946 4.531 50 10 IJGE CC[C@@H](Br)CN(CC)Cc1cc(I)ccc1Cl 2307331597 GJENAXKSWWROPN-LLVKDONJSA-N 430.555 4.940 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccc(C(F)(F)F)cc1 2343417700 YZLPQJVCCQVUHB-KRWDZBQOSA-N 430.264 4.806 50 10 IJGE FC(F)(F)[C@H]1C[C@H](Br)CCN1Cc1ncc(Br)cc1Cl 2361429922 QROKXFAMQNEEIW-RDDDGLTNSA-N 436.497 4.788 50 10 IJGE Cc1csc(C(=O)N2CCC[C@@H](Br)[C@@H]2C(F)(F)F)c1Br 2370253286 VSGILXMSDYXOJB-GMSGAONNSA-N 435.103 4.749 50 10 IJGE Cc1ccc(CN(C(=O)CCl)[C@@H](C(=O)NC2CCCCC2)c2ccccc2F)cc1 3033936 MARYHBUHQUEBAF-HSZRJFAPSA-N 430.951 4.892 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](CC)C(=O)NNC(=O)c1ccccc1Br 10683801 QSYJMEYGESNHLV-KBXCAEBGSA-N 433.346 4.581 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1 33930362 AYCSWVCTYSRLBN-XFXZXTDPSA-N 438.783 4.962 50 10 IJGE COc1cc(Br)c(O)c(/C=N\NC(=O)c2sc3ccccc3c2Cl)c1 38803943 KHSVYLZKFVICQV-ZBKNUEDVSA-N 439.718 4.795 50 10 IJGE Cc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)N4c5ccccc5C[C@@H]4C)c(C)c32)c1 40811335 OLZHJANKNYKSGC-ZCZMWGMNSA-N 441.531 4.958 50 10 IJGE Cc1c(C(=O)NC2CCCCC2)oc2c1/C(=N/NC(=O)c1cccc(Cl)c1)CCC2 40813312 VXJHRLYEOTXXPL-NLRVBDNBSA-N 427.932 4.774 50 10 IJGE COc1cc(CBr)cc(Br)c1OCc1cn2ccsc2n1 148791839 JGVURBZPZRLPRN-UHFFFAOYSA-N 432.137 4.641 50 10 IJGE COc1ccc(Br)cc1/C=N\NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 169890032 OHNRYEWCPGSYAF-FMCGGJTJSA-N 426.314 4.582 50 10 IJGE N#C/C(=C/Nc1ccc(Cl)c(C(F)(F)F)c1)C(=O)N1CCN(Cc2ccccc2)CC1 217257189 LWNXGMHDBSRFFM-VKAVYKQESA-N 448.876 4.523 50 10 IJGE C[C@@H]1[C@@H](C)N(Cc2ccccc2)[C@H](C)CN1c1nc2sccn2c1CBr 404295727 WZWNLWBSRJJDBV-BZUAXINKSA-N 433.419 4.778 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N(C)Cc2cnccn2)c(C)n1-c1cccc(Cl)c1Cl 735482893 MOMXKBLSIIMIFF-YVLHZVERSA-N 440.334 4.757 50 10 IJGE O=C(NNc1c(F)cccc1F)c1cccnc1Oc1ccc(F)cc1Br 735697808 IPZFMTOEVPYUES-UHFFFAOYSA-N 438.203 4.811 50 10 IJGE O=C(NNc1c(F)cc(F)cc1Br)c1cccc(OCc2cscn2)c1 741981655 VFNHKOYTPCIPRF-UHFFFAOYSA-N 440.269 4.520 50 10 IJGE Cc1ccc(-n2ncc(C(=O)NNc3nc4ccccc4[nH]c3=S)c2C(F)(F)F)cc1 1641877492 UQEVDKBCQCDGDX-UHFFFAOYSA-N 444.442 4.562 50 10 IJGE COc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2ccc(Cl)c(Cl)c2)cc1 1865685871 NXHPNQCFHXWEKV-LJQANCHMSA-N 427.291 4.714 50 10 IJGE Cc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699459 UXGYPEJOVMEADC-QFIPXVFZSA-N 429.911 4.603 50 10 IJGE CN(C[C@](C)(CBr)C(C)(C)C)[C@H]1CC[C@H]1NC(=O)OCc1ccccc1 1904843102 AKNXJQFIMSAVAN-LQWHRVPQSA-N 425.411 4.823 50 10 IJGE CC(C)[C@@H](CI)NC(=O)c1cscc1OCc1ccccc1 1934835391 DEJJQSDFZWJEEO-OAHLLOKOSA-N 429.323 4.517 50 10 IJGE CCCN(CCCBr)C(=O)c1scc(Br)c1Br 1944452845 POAVVKNQJLJWNW-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE O=C(N[C@H]1CCC[C@H](Br)C1)c1csc(Br)c1Br 1945187599 YLLPZNNQOMLIRX-BQBZGAKWSA-N 446.002 4.709 50 10 IJGE CCn1cc(Br)c([C@H](Br)c2ccc(Br)s2)n1 1985208156 AWUJGCYLGGVCSJ-SECBINFHSA-N 428.975 4.974 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CC12CCC1(CCC[C@@H](CI)O1)CC2 1996430044 GOYKHCZFNCGYRS-OMGLFLRBSA-N 449.373 4.834 50 10 IJGE C[C@]1(CBr)CCCN1Cc1cc(Br)ccc1Br 2006502337 ZUYVNVVFIUFHRE-CYBMUJFWSA-N 425.990 4.961 50 10 IJGE C[C@@H]1C[C@H]1N(CCBr)Cc1cc(Br)ccc1Br 2006509095 YJFCYAMPMFPJRU-NOZJJQNGSA-N 425.990 4.817 50 10 IJGE Fc1cccc(-n2c(Cl)nc(Cl)c2CBr)c1I 2006648294 QYRSXGFAOVGPAF-UHFFFAOYSA-N 449.876 4.818 50 10 IJGE C[C@@]1(CCBr)CCN1Cc1cc(Br)ccc1Br 2025215999 KJKQXBSJWXBKDD-CYBMUJFWSA-N 425.990 4.961 50 10 IJGE CCC(CC)(CBr)CN1CC[C@H](NC(=O)OC(C)(C)C)C(F)(F)CC1 2044696401 LMCDTHVXKDZBTB-AWEZNQCLSA-N 427.374 4.812 50 10 IJGE FC(F)(F)c1c(I)c(CCl)nn1-c1cc(C2CC2)ccn1 2078880693 GIOSXUBIJYUKCO-UHFFFAOYSA-N 427.595 4.507 50 10 IJGE Fc1cc2nc(CCl)n(Cc3nccn3Cc3ccccc3)c2cc1Br 2090022611 XUGVVMNIRPRKNU-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCC2(CC1)C[C@H]2CCl 2092482942 ZLPNLAUUNYAPJE-QMMMGPOBSA-N 427.589 4.754 50 10 IJGE C[C@](CI)(OC[C@H]1CCCOC1)c1ccccc1Br 2116006775 RUVYYJQPFWXISZ-SWLSCSKDSA-N 439.131 4.543 50 10 IJGE Fc1cccc(N2CCC[C@]3(CN(Cc4ccccc4)CCO3)C2)c1CBr 2151739777 OQSAQLPMBLTMDX-QFIPXVFZSA-N 433.365 4.592 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Cl)C2 2190670683 MJHQPIZVQCRSQU-RNJOBUHISA-N 425.523 4.534 50 10 IJGE O=C(NCC1(CBr)CC(F)(F)C1)c1cscc1OCc1ccccc1 2255488490 FAVFFSFQMJSJIJ-UHFFFAOYSA-N 430.314 4.867 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCCCBr)[C@@H](CC(F)F)C1 2263161708 CZVIWAKMLTVSQH-HNNXBMFYSA-N 427.374 4.908 50 10 IJGE O=C(N[C@@H](CBr)c1ccsc1)c1cc(F)c(Br)cc1F 2282712538 RNSKBOLHRLPKQQ-LBPRGKRZSA-N 425.092 4.655 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1NC(=O)C(C#N)=Cc1ccc(OC(=O)c2ccccc2)cc1 2297551421 IWWUVWGDSRKPQO-UHFFFAOYSA-N 427.416 4.668 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)c(I)c2)CC[C@@H]1Br 2300239166 UWCIQDMFXDEIHU-KOLCDFICSA-N 428.539 4.550 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)[C@@H]3CC[C@H]32)cc1I 2315552395 DQCYPLZRFLHJCS-COPLHBTASA-N 440.550 4.692 50 10 IJGE Br[C@H]1CN(Cc2sccc2I)CC12CCCCC2 2316759685 ZSXCBBFATBAORW-ZDUSSCGKSA-N 440.188 4.882 50 10 IJGE CCCCCCOc1ccccc1C(=O)C=NNC(=O)Cc1cc(OC)ccc1Cl 2318418184 SGOSUPMMCPKESJ-UHFFFAOYSA-N 430.932 4.835 50 10 IJGE COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)C(C#N)=Cc1cccc(F)c1 2329673766 IJMRWKMXDGSKKV-UHFFFAOYSA-N 445.450 4.641 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Cl)c1ccc([C@@H]2CCOC2)s1 2364049003 ALGQIAHTXCBLNW-HQJQHLMTSA-N 440.588 4.839 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3[C@@H](C2)[C@H]2CC[C@@H]3N(C(=O)OC(C)(C)C)C2)C1 2371131627 PPUDINVNWYDILO-FJIDUMEYSA-N 441.454 4.765 50 10 IJGE CCCCCCOc1ccccc1C(=O)NNC(=O)COc1cc(C)ccc1C(C)C 7659956 KEGBXPUWOGLEDZ-UHFFFAOYSA-N 426.557 4.918 50 10 IJGE Cc1ccccc1C(=O)Nc1ccc(C(=O)NNC(=O)c2cc(Cl)cc(Cl)c2)cc1 10384382 YBPUYXXAOSCODQ-UHFFFAOYSA-N 442.302 4.629 50 10 IJGE C=CCOc1ccccc1C(=O)NNC(=O)[C@H](CC)Oc1ccc(-c2ccccc2)cc1 14768926 AVPUDLTXGRFSJJ-QHCPKHFHSA-N 430.504 4.537 50 10 IJGE O=S(=O)(c1ccccc1)[C@@H](Br)CN(Cc1ccccc1)Cc1ccccc1 21987406 CGEHWTYGSURBJV-JOCHJYFZSA-N 444.394 4.884 50 10 IJGE Cc1ccc2cccc(Oc3ncnc(NNC(=O)c4cccc5ccccc45)c3N)c2n1 40752336 XFZGIZCEDBIOPH-UHFFFAOYSA-N 436.475 4.618 50 10 IJGE C[C@H](CBr)COc1c(I)cc(Cl)c2cccnc12 96869848 OBOIIQHHDGZELI-MRVPVSSYSA-N 440.506 4.903 50 10 IJGE C[C@@H]1CCC[C@](CBr)(NC(=O)c2c(F)cc(Br)cc2F)C1 125131660 IMJHXYOAOTXOST-PSLIRLAXSA-N 425.111 4.801 50 10 IJGE COc1ccc2nc(CCl)n(-c3ccc(Br)cc3Br)c2n1 157204741 YSYYFUKXQJRMPL-UHFFFAOYSA-N 431.515 4.693 50 10 IJGE O=C(N/N=C\c1c(Cl)cccc1Cl)c1cccn(Cc2ccccc2Cl)c1=O 169920884 OAWRYYVMPNHGCC-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE CN(C(=O)/C(C#N)=C/c1ccccc1)c1nnc(-c2ccc(Br)cc2)s1 170530011 DFQGQESBMPNEKA-RVDMUPIBSA-N 425.311 4.538 50 10 IJGE C[C@H](Br)CCCNC(=O)c1cc(Br)ccc1Br 227713683 LLPVTLKEVPHAPO-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE O=C(COc1cc(Cl)ccc1Cl)NN=Cc1cccc(OC(=O)c2cccs2)c1 252641875 ZHHSNVYYPVQBSM-UHFFFAOYSA-N 449.315 4.803 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3ccccc3)n2-c2ccc(C)cc2)cc1 254512220 JDSQHUBIAURIIT-UHFFFAOYSA-N 441.560 4.794 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cc1 254852294 SWCOVFIQJOLZJO-UHFFFAOYSA-N 432.499 4.688 50 10 IJGE O=C(NC[C@H]1CCC[C@H](CCl)C1)c1ccc(I)c(Cl)c1 312858103 YZQBOTHKQQTUKJ-QWRGUYRKSA-N 426.125 4.720 50 10 IJGE C[C@@H](Br)C[C@H]1CCCCCN1S(=O)(=O)c1ccc(Br)s1 312913614 AVXNUSNYZOZZGB-GHMZBOCLSA-N 445.242 4.617 50 10 IJGE Nc1c(Cl)cccc1[C@H]1CN(Cc2ccccc2)C[C@@H]1CI 394531078 XZLPRFLEYRUURX-HOCLYGCPSA-N 426.729 4.573 50 10 IJGE COc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CBr)cc1Br 394588094 YOWHHPMIHKVXNZ-OLZOCXBDSA-N 449.183 4.803 50 10 IJGE C[C@H](CCCCBr)NC(=O)c1cc(Cl)ccc1I 398812138 YLLPVAIGSVTXNX-SECBINFHSA-N 444.538 4.628 50 10 IJGE Clc1ccc(I)c(CN[C@H](CBr)C2CCCC2)c1 405298127 LVYSOQABTCDSHB-CQSZACIVSA-N 442.566 4.988 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@@H]1C(C)(C)[C@]21CCC[C@H](CI)O1 686236027 GMRUYJCMOIJXDX-GPINWOSQSA-N 449.373 4.785 50 10 IJGE CC(C)(C)S(=O)(=O)CCCC(CBr)(CBr)C1CCCC1 718787789 WLASJFPUCSZINW-UHFFFAOYSA-N 432.262 4.946 50 10 IJGE Cc1ccc(C(=O)NN=C2C(=O)N(C/C=C/c3ccccc3)c3ccccc32)cc1Cl 1084022908 HETOYGIHKJBIFZ-ILABFYHRSA-N 429.907 4.843 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2Cc1ccccc1F 1865691380 QMPIFVYZPMDUBN-HSZRJFAPSA-N 444.510 4.806 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccc(Cl)cc2)[C@H]1c1cccnc1 1865699728 BAIFXXDNTUURJC-NRFANRHFSA-N 439.906 4.865 50 10 IJGE CC(C)COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(Br)cc2)cc1 1866128685 GCRYTEYCBMFOOG-GZTJUZNOSA-N 427.298 4.808 50 10 IJGE CCc1cc(Br)c(C[C@H](CBr)NC(=O)OC(C)(C)C)s1 1882086098 YXLCNZUKXGXMLS-SECBINFHSA-N 427.202 4.904 50 10 IJGE Brc1cccc(CN2C[C@H](Br)CC3(CC3)C2)c1Br 1925992309 DPHLVWUOBFPFTM-LLVKDONJSA-N 438.001 4.961 50 10 IJGE CC[C@@H]1CN(Cc2ccc(Br)cc2Br)C[C@@H]1Br 1943856851 BYWYVCBKQBPXNR-RNCFNFMXSA-N 425.990 4.817 50 10 IJGE CCC(CC)(CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](CC(F)F)C1 2057193478 SJSBUNCSXQBJQX-AWEZNQCLSA-N 427.374 4.764 50 10 IJGE C[C@@H]1CCOC[C@H]1O[C@](C)(CI)c1ccccc1Br 2096205181 YLIHSNZELNDMLJ-KCPJHIHWSA-N 439.131 4.541 50 10 IJGE C[C@@H]1CC[C@H](C[C@@H](Br)c2cc(I)cc3c2OCC3)O1 2104815143 YVRLCVAGBQTZEA-GAJTVXKRSA-N 437.115 4.620 50 10 IJGE COCC(C)(C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)ccc1C 2123200601 KFGOXARWFBSRDX-UHFFFAOYSA-N 440.403 4.506 50 10 IJGE CC(C)(C)OC(=O)N1CCO[C@]2(CCN(CCCCCCCCCBr)C2)C1 2163061929 JAZJAGYPECQFDK-NRFANRHFSA-N 447.458 4.824 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2CN(C[C@@H](CBr)c3ccccc3)C(C)(C)[C@H]2C1 2163064464 UPUHKFAIPGFONE-QRVBRYPASA-N 437.422 4.742 50 10 IJGE Cc1cc(S(=O)(=O)N(C)c2ccc(Br)cc2)sc1CBr 2179822982 CXRYUBVOCXELNE-UHFFFAOYSA-N 439.194 4.539 50 10 IJGE COc1cc(F)c(Cl)cc1[C@H](Br)c1nn(C)c(Br)c1C 2207367677 GHMKDELZXOMRBX-NSHDSACASA-N 426.511 4.776 50 10 IJGE CCN(c1ncc(Br)cc1Br)[C@H]1CCC[C@@H]1Br 2212910298 FWYZDHCDFLCCCO-ONGXEEELSA-N 426.978 4.749 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)C2(C)CS(=O)(=O)C2)c(C)c1Br 2227346039 BIUYAFXCYCCUBS-GFCCVEGCSA-N 430.589 4.543 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@H]1C[C@@H]2CCC[C@H](C1)C2(F)F 2233637898 IYORMYVGIDFYTQ-OKYOBFRVSA-N 444.360 4.887 50 10 IJGE CC[C@]1([C@H](Br)c2ccc(OC)c(I)c2)CCCO1 2257353228 CEZRFJVGXFBAFZ-ZIAGYGMSSA-N 425.104 4.695 50 10 IJGE CC1(C)[C@@H](Br)CC[C@H]1NC(=O)c1cc(Br)c(F)cc1Cl 2285836941 IEKMRMBFMJIWFE-NWDGAFQWSA-N 427.539 4.924 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)NC2CCCCC2)ccc1OCCOc1ccccc1 2293344039 SBRZKXIWYBNVPR-UHFFFAOYSA-N 434.536 4.899 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@@H](Br)C1COCCOC1 2295262549 KCZIBHJOGIPRJN-ZDUSSCGKSA-N 428.548 4.519 50 10 IJGE CCCn1c(C)cc(C=C(C#N)C(=O)Nc2cc3c(cc2Br)OCCO3)c1C 2297367673 HJWJJQYHRXMHBU-UHFFFAOYSA-N 444.329 4.594 50 10 IJGE C[C@@H](Cl)c1nc2cc(I)ccc2n1C[C@@H]1C[C@H]1Br 2311265962 HAQXLAJKUBZBSB-KHQFGBGNSA-N 439.522 4.724 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2cccc(OC)c2)sc2c1CC[C@H](CC)C2 2314571950 PHMPDLINOGNYPN-HNNXBMFYSA-N 438.549 4.994 50 10 IJGE CC1=C(C#N)C(=O)N([C@H](C)c2ccccc2)C(=O)C1=CNc1ccccc1C(F)(F)F 2314579646 YZMSEWFRFOYOHJ-OAHLLOKOSA-N 425.410 4.971 50 10 IJGE COC(=O)C(C#N)=Cc1ccc(OC(=O)C=Cc2ccc(Cl)c(Cl)c2)c(OC)c1 2314736702 STJMFSPVJUCEBN-UHFFFAOYSA-N 432.259 4.701 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)CCc2ccc(Cl)cc2)c(OCC)c1 2314790272 ZMVKRTBQIFXLPW-UHFFFAOYSA-N 427.884 4.747 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)C(C#N)=CNc1cccc(Br)c1 2325074096 ABEXBBVZCJVPPE-HNNXBMFYSA-N 428.330 4.853 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Br)c2)[C@H](C)C[C@H]1Cl 2325225726 IJDZHHXZYDXSSZ-GIPNMCIBSA-N 442.566 4.891 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C)CN(C[C@@](C)(CBr)C(C)(C)C)CC1(F)F 2352107321 MXWBFVBKHHPCNS-QZTJIDSGSA-N 441.401 4.916 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(O[C@@H]2CCOc3ccc(F)cc32)C1 2364439040 VYDLKFGZDIYUOK-XLIONFOSSA-N 444.341 4.831 50 10 IJGE O=C(NNC(=O)c1ccccc1OCCc1ccccc1)c1ccc(Cl)cc1Cl 10508925 IJGCLJGKCHQOLC-UHFFFAOYSA-N 429.303 4.690 50 10 IJGE COc1cc(/C=N/NC(=O)[C@H](C)c2ccc(CC(C)C)cc2)cc(Br)c1O 20468774 OYMHQBZVJAERGE-CHOFVFFHSA-N 433.346 4.616 50 10 IJGE Cc1c(C(=O)NCCc2ccccc2)oc2c1/C(=N/NC(=O)c1ccc(Cl)cc1)CCC2 40811654 RIOFAEAJEVBXCY-VFCFBJKWSA-N 449.938 4.684 50 10 IJGE Cc1cc(OCC(=O)N/N=C/c2ccccc2Cl)c(Br)c(C)c1Cl 40950677 NDORIRZVPFANQS-ODCIPOBUSA-N 430.129 4.902 50 10 IJGE CCN(C[C@](C)(CI)OCC1CCCC1)C(=O)OC(C)(C)C 231318331 QFFJBHGXXKRFSV-KRWDZBQOSA-N 425.351 4.644 50 10 IJGE CCOc1ccccc1OCC(=O)NN=Cc1cn(Cc2ccccc2)c2ccccc12 252622129 NPKKUKWETXECAX-UHFFFAOYSA-N 427.504 4.617 50 10 IJGE CCOc1cc(Br)cc(C=NNC(=O)c2ccc(Cl)cc2Cl)c1O 252638011 XYONSQRKQDYZBV-UHFFFAOYSA-N 432.101 4.624 50 10 IJGE Cc1ccc(C(C)C)c(OCC(=O)NN=C2C(=O)N(Cc3ccccc3)c3ccccc32)c1 254762990 UTOHMDBMGFBVLG-UHFFFAOYSA-N 441.531 4.565 50 10 IJGE Clc1ccccc1C(CBr)(CBr)CO[C@H]1CCCOC1 383627561 IAOQGJSNVNZBMX-LBPRGKRZSA-N 426.576 4.563 50 10 IJGE CC(C)N(C[C@H](C)Br)C(=O)c1cc(Br)sc1Br 691354680 CTARRWBJQFFEJU-ZETCQYMHSA-N 448.018 4.907 50 10 IJGE CN(C(=O)c1cc(Br)c(Br)s1)[C@H]1CCC[C@@H]1Br 709100578 AXRKAWNXHCYVIQ-XPUUQOCRSA-N 446.002 4.661 50 10 IJGE O=C(CCCC[C@@H]1CCSS1)NNC(=O)c1ccccc1OCc1ccc(F)cc1 725933364 PRSVLRALYFPWBM-GOSISDBHSA-N 448.585 4.880 50 10 IJGE O=C(NNC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12)c1ccc(Br)cc1Cl 730752515 HEFPYYJCOAEWHO-QZTJIDSGSA-N 443.728 4.820 50 10 IJGE Cc1ccc(C[C@@H](NC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c2ccccn2)cc1 734685846 WOBHFDGUGOGYIH-HSZRJFAPSA-N 430.552 4.616 50 10 IJGE CC(=O)N(C)c1cccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(C)cc3)c2C)c1 744777240 QRWSSSDSMBHQHU-HYARGMPZSA-N 426.520 4.931 50 10 IJGE O=C(CCOc1ccccc1)NNC(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1 755446268 PWMJPYUMGDUWEY-UHFFFAOYSA-N 446.532 4.509 50 10 IJGE Cc1cccc2c1[C@@H](OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)CCO2 814033061 HBWSTVGEZKALBO-FIWMFUAISA-N 438.487 4.746 50 10 IJGE C=CCOc1ccc(Br)c(C=NNC(=O)CCc2c[nH]c3ccccc23)c1 1084070882 VMMRFVIHFWYECC-UHFFFAOYSA-N 426.314 4.578 50 10 IJGE Cc1[nH]nc(O)c1NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1160090001 VZAXYWIBBQZNSI-ZSOIEALJSA-N 430.295 4.684 50 10 IJGE CC(C)(C)c1ccc(NNC(=O)c2cc(-c3ccc(F)cc3)nc3onc(C4CC4)c23)nn1 1339252249 LYJGTKKWSICMGC-UHFFFAOYSA-N 446.486 4.751 50 10 IJGE Cc1ccc(NNC(=O)[C@@H](C)SCc2nc(O)c3c(C)c(C)sc3n2)c(Cl)c1 1627770774 RSWZIIFSVXVIJZ-GFCCVEGCSA-N 436.990 4.741 50 10 IJGE CC(=O)C1CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)CC1 1644957528 QEGBUURWBQRRPU-UDWIEESQSA-N 443.469 4.848 50 10 IJGE C=CCc1cc(CNC(=O)NNc2nc3ccc(Cl)cc3s2)cc(OC)c1OC 1676274377 AGRMSXTXDFYOFB-UHFFFAOYSA-N 432.933 4.522 50 10 IJGE CN(Cc1cc(Cl)ccc1I)C1(CBr)CCC1 1914992027 XATGDNBENLCCEN-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE CC(C)N(C[C@@H](C)Br)C(=O)c1csc(Br)c1Br 1945186051 ACHBDYOFHCHGMC-SSDOTTSWSA-N 448.018 4.907 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@H](CI)O2)[C@@H]1C(C)(C)C 1987729210 ZDOYXACJADMYEF-QWQRMKEZSA-N 437.362 4.785 50 10 IJGE CCc1nn(CC(CC)(CC)CBr)c(CC)c1I 2032917671 DDUXJYHIXGPDIW-UHFFFAOYSA-N 427.168 4.814 50 10 IJGE CCCN1C[C@@H](Br)[C@@H](Cc2c(Br)cccc2Br)C1 2039264211 BWBBOYYVKFOVAZ-IINYFYTJSA-N 440.017 4.859 50 10 IJGE CCn1nnc(Br)c1C[C@H](Br)c1cccc(Br)c1 2050572090 QSUGNOWUQYISFP-JTQLQIEISA-N 437.961 4.502 50 10 IJGE O=C(CBr)c1ccc(C(F)(F)F)c(OC(F)(F)F)c1Br 2054796656 PKAGNQBLUWPDLU-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE ClCCc1nc2cncc(Br)c2n1C1CCN(Cc2ccccc2)CC1 2095445065 BJKSOGUSEYTULO-UHFFFAOYSA-N 433.781 4.812 50 10 IJGE Fc1cc(Br)cc(CBr)c1OCCOC1CCSCC1 2144861486 ZHKMWFHBMRAQRA-UHFFFAOYSA-N 428.161 4.774 50 10 IJGE O=C(N[C@H](CCl)Cc1ccccc1)c1csc(Br)c1Br 2150344221 GAGUHVGYMGZEDB-JTQLQIEISA-N 437.584 4.853 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(C[C@@H](CBr)c2ccccc2)CC12CCC2 2163059442 SZYYKGOAPVAJAM-MOPGFXCFSA-N 437.422 4.792 50 10 IJGE Cc1ccc(C(=O)N[C@@H](CBr)CC(C)(C)C)cc1I 2224620037 HPSRZBUNKZZFEU-GFCCVEGCSA-N 438.147 4.529 50 10 IJGE Cc1ccc(I)c(C(=O)Nc2ccccc2CBr)c1 2232167151 POXIRHWSXUZZHA-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE COc1ccc([C@@H](Br)CC[C@@H]2CCCO2)cc1I 2257370143 ZSGYEXSEWSJUMQ-RYUDHWBXSA-N 425.104 4.695 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(CC2(CBr)CCCC2)[C@@H](C(F)(F)F)C1 2266311130 XCEBAJJPROLSPE-ZIAGYGMSSA-N 443.348 4.862 50 10 IJGE CCCOc1ccc(C=C(NC(=O)c2ccccc2)C(=O)NN=C(C)c2ccccc2)cc1 2296734179 NNRZWSCTUQJFNN-UHFFFAOYSA-N 441.531 4.787 50 10 IJGE O=C(NN=CC=Cc1ccccc1)C(=Cc1cccs1)NC(=O)c1ccccc1Cl 2297450796 HDEGMMMKAFSUJO-UHFFFAOYSA-N 435.936 4.988 50 10 IJGE CCCCN(C=C(C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)CCC 2324605321 HQQBNVQADIQSLD-UHFFFAOYSA-N 444.623 4.840 50 10 IJGE ClC1[C@H]2CC[C@H]1CN(Cc1ccc(I)c(Br)c1)C2 2325205235 VWGHKLVETPAFSC-QWRGUYRKSA-N 440.550 4.503 50 10 IJGE CCCCOc1ccc(C=NNC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1OCC 2328822735 JSDDXHMWVQOHLB-IBGZPJMESA-N 449.592 4.654 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)C(Cl)(Cl)Cl)n2)c(OC)c1OC 2331413680 KIMWGFUQOWGGTH-UHFFFAOYSA-N 435.716 4.999 50 10 IJGE CN(C[C@@H](CBr)C1CCC1)C1C[C@@H]2C[C@H](C1)CN(C(=O)OC(C)(C)C)C2 2339978670 WFYTWBIBMAVTLO-LUTGFWOYSA-N 429.443 4.765 50 10 IJGE Cn1cc(I)c(C[C@@H]2C[C@@H](C(C)(C)C)CC[C@H]2Br)n1 2341856363 JUHBKNYQFMLHHD-SDDRHHMPSA-N 439.179 4.793 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3CCC[C@]3(CNC(=O)OC(C)(C)C)C2)C1 2345004575 MIXPRSJCIREXIO-KKSFZXQISA-N 429.443 4.815 50 10 IJGE Cc1cc(C)cc(OCC(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2C(C)(C)C)c1 14661617 BKDCJKXFDFMGLZ-UHFFFAOYSA-N 440.584 4.504 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2O)CCC3)c(C)c1 40826330 STPIRMMDNCHFMR-ZXVVBBHZSA-N 431.492 4.633 50 10 IJGE CC1CCC(NC(=O)[C@@H](c2ccc(F)cc2)N(Cc2ccccc2)C(=O)CCl)CC1 97914697 NNAJEAXDCLPWSV-MUEFNIMKSA-N 430.951 4.829 50 10 IJGE CCCOc1c(OC)cc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)cc1OC 169891173 IQQCVCKKYCQHMW-DGLVQCRBSA-N 449.551 4.863 50 10 IJGE CCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C\c2ccccc2OCCC)c(OC)c1 207004426 QPQSETPZWGSAEL-WOXKRFSJSA-N 448.519 4.536 50 10 IJGE CCc1ccc(N(C(=O)/C(C#N)=C\c2ccc(OC)cc2)S(=O)(=O)c2ccccc2)cc1 207128671 MFNQBBPAPZWELT-FXBPSFAMSA-N 446.528 4.587 50 10 IJGE CC[C@@H](NC(=O)/C(C#N)=C\Nc1cc(Br)ccn1)c1ccc2c(c1)CCCC2 217193780 WYAQDPMUVQMYKB-BKHFDQEPSA-N 439.357 4.810 50 10 IJGE CC(=NNC(=O)CCC(=O)N(c1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 254291678 MONSHZVKUOXOKA-UHFFFAOYSA-N 430.464 4.580 50 10 IJGE COc1ccc(-c2cc(C(=O)NN=C(C)c3cccnc3)c3cc(C)ccc3n2)cc1OC 254305570 IWLFGYFKYSZPOB-UHFFFAOYSA-N 440.503 4.776 50 10 IJGE CC[C@@H](C)N(CCBr)C(=O)c1cc(Cl)ccc1I 310948761 QLJIRKMFZWPOKG-SECBINFHSA-N 444.538 4.580 50 10 IJGE Oc1ccc(Cl)cc1[C@H]1CN(Cc2ccccc2)C[C@@H]1CI 382700400 NXPKONZKPJYNDU-YOEHRIQHSA-N 427.713 4.696 50 10 IJGE O=[N+]([O-])c1ccc(N2CC[C@H]3CC[C@@H](C2)N3Cc2ccccc2)c(CBr)c1 399850413 RNIZXXOJQBRKQT-QUCCMNQESA-N 430.346 4.733 50 10 IJGE Cl[C@@H](c1cc2c(cc1Br)OCCO2)c1ncsc1Br 698651105 DLPPPEQPCPAJFO-JTQLQIEISA-N 425.529 4.768 50 10 IJGE O=C(C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)NNc1cccc(F)c1F 743721823 YPXKBLFQSHNPJK-LJQANCHMSA-N 429.854 4.623 50 10 IJGE CCc1ccccc1OCC(=O)NN=Cc1ccc(OCc2ccccc2C)c(OC)c1 1772753622 VPAGFQAITFJFBK-UHFFFAOYSA-N 432.520 4.674 50 10 IJGE O=C(COc1ccc(-c2ccccc2)cc1Br)NN=Cc1cccc(F)c1 1772753830 AAZFLFBZOKAUEQ-UHFFFAOYSA-N 427.273 4.784 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(Cl)cc2)cc1 1865694593 XNKVFADIBZIVIX-JOCHJYFZSA-N 434.927 4.900 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C[C@H]1CN(C(=O)OC(C)(C)C)C(C)(C)C1 1881244841 WYJXHRWVZKTXLM-ZIAGYGMSSA-N 435.403 4.700 50 10 IJGE Cc1cnc2c(S(=O)(=O)N(Cc3ccccc3)[C@H](C)CCBr)cccc2c1 1915110540 OEJRAFWOVMNFHT-QGZVFWFLSA-N 447.398 4.908 50 10 IJGE Cc1cc(F)ccc1S(=O)(=O)N(Cc1ccccc1)C1(CBr)CCC1 1915750274 FSKYZMBXVZTCRX-UHFFFAOYSA-N 426.351 4.643 50 10 IJGE O=S(=O)(c1ccc(CCl)c(Br)c1)N(Cc1ccccc1)C1CCC1 1946851836 QHJSDTOIBPYKOB-UHFFFAOYSA-N 428.779 4.931 50 10 IJGE Clc1nc(N2CC[C@H]3CC[C@@H](C2)N3Cc2ccccc2)sc1CBr 1949584386 SQULQQMBOPYWOS-CABCVRRESA-N 426.811 4.935 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3C[C@H]2CC[C@@H]3Br)c1 2028278912 ZQEALWNGTXCUIL-WQAKAFBOSA-N 440.550 4.692 50 10 IJGE O=C(N[C@H](CBr)CC1CC1)c1ccc(Br)cc1Br 2029978135 RYANHHIENWVECT-JTQLQIEISA-N 439.973 4.505 50 10 IJGE CC[C@H](C)[C@@H](Br)CNC(=O)c1cccc(Br)c1Br 2031482204 PPIWXCDBGPYUPS-KWQFWETISA-N 441.989 4.751 50 10 IJGE Clc1cc(CN2C[C@@H](CBr)C3(CC3)C2)ccc1I 2086661793 PIAKGWMLVADFDG-LLVKDONJSA-N 440.550 4.552 50 10 IJGE C[C@H](c1nscc1Br)N(C)c1ncc(CCl)cc1Br 2130018439 IRCGDWDORZFDEJ-SSDOTTSWSA-N 425.577 4.999 50 10 IJGE CC(C)N(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)CC1(CBr)CCOCC1 2163065114 XPFVBSHIZVLGRF-SFHVURJKSA-N 447.458 4.536 50 10 IJGE C[C@@H](C(=O)N(C)C[C@H]1C[C@H](Br)C1)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 2196913799 HLBLTTPJGGXVQV-JOCBIADPSA-N 439.394 4.520 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CC[C@H](C(F)(F)CCl)C1 2197765581 FLHYRSLEYKOJJV-QMMMGPOBSA-N 431.502 4.548 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1c(F)ccc(Cl)c1F 2219411359 RWZIUEHMYSFCGE-CYBMUJFWSA-N 432.692 4.671 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1Cc2ccc(NC(=O)[C@H](Br)C3CCCC3)cc2C1 2234141483 XMRWRKLSZIQUJO-ZWKOTPCHSA-N 437.378 4.571 50 10 IJGE Cc1sc(C(=O)NC[C@]2(F)CC[C@H](CBr)CC2)cc1Br 2234475062 MQMBVFOLERDCNL-YPFXGUDJSA-N 427.177 4.842 50 10 IJGE CN[C@H](Cc1cc(Br)cc(Br)c1)[C@H]1C[C@H](Br)C1 2252836549 DCDMCNLYSAIZQB-OASPWFOLSA-N 425.990 4.516 50 10 IJGE O=C(N[C@@H]1CCCN(C[C@H](CBr)c2ccccc2)C1)OCc1ccccc1 2253195065 NSEBIJXSQXJURZ-LEWJYISDSA-N 431.374 4.556 50 10 IJGE Cc1cc(N(C)Cc2ccccc2I)ncc1CBr 2265542970 DTDUYOKIQGQCGD-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE COc1ccc([C@@H](Br)C[C@@H]2COC(C)(C)C2)cc1I 2269542350 JUQXSZFHLRKEML-JQWIXIFHSA-N 439.131 4.941 50 10 IJGE CS(=O)(=O)C1CC([C@H](Br)c2cc(C3CC3)c(Br)s2)C1 2269762379 RZFANTJQAJOMMD-KWPJZBAWSA-N 428.211 4.647 50 10 IJGE CC1(C)OCCO[C@H]1[C@H](Cl)c1c(F)cc(Br)c(F)c1Br 2288358254 NCROVOIRBGVSFS-PWSUYJOCSA-N 434.502 4.964 50 10 IJGE N#CC(C(=O)Nc1ccccc1)=C1S[C@@H](Cc2ccccc2)C(=O)N1c1ccccc1 2296509328 OHKVOWSLKADTAZ-QFIPXVFZSA-N 425.513 4.752 50 10 IJGE N#CC(=Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)C(=O)NCc1cccnc1 2296727442 BGITWBBRXWZLAH-UHFFFAOYSA-N 439.906 4.811 50 10 IJGE Cc1ccccc1NC(=O)C(C#N)=Cc1cc(Br)cc(Br)c1O 2313518158 NSVBQLDROOOJOI-UHFFFAOYSA-N 436.103 4.771 50 10 IJGE Cn1c(C(C#N)=Cc2c(Oc3ccc(F)cc3)nc3ccccn3c2=O)nc2ccccc21 2314436959 RWFPMMUXLTTYKV-UHFFFAOYSA-N 437.434 4.577 50 10 IJGE CN[C@H](c1c(C)cc(Br)c(OC)c1Br)[C@@H]1C[C@H]1Br 2317397956 GPLJDFMKDYREMF-RWYTXXIDSA-N 441.989 4.573 50 10 IJGE O=C(N[C@@H](CCCl)COCc1ccccc1)c1cc(F)c(Br)cc1F 2320602025 HDKZQZUKNCPICU-ZDUSSCGKSA-N 432.692 4.671 50 10 IJGE C[C@H](NC(=O)C(C#N)=CNCc1cccc(Br)c1)c1ccc2c(c1)CCCC2 2325118880 AGCLLDRBSQBYRV-INIZCTEOSA-N 438.369 4.702 50 10 IJGE CS(=O)(=O)Nc1ccc(C(O)=C(C#N)c2nc(-c3cccc(Cl)c3)cs2)cc1 2331293880 NHYQPPNTZZFMAS-UHFFFAOYSA-N 431.926 4.785 50 10 IJGE N#CC1=C2N=C(N)c3ccccc3N2C2=C(C(=O)CCC2)[C@H]1c1ccc(Br)cc1 2500594 WECJIWRTRNOUGI-FQEVSTJZSA-N 445.320 4.514 50 10 IJGE C[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)c1ccc(Cl)cc1Cl 14038570 OZABQVIZKGUGGT-CQSZACIVSA-N 429.303 4.889 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2ccc(Cl)cc2Cl)c(C)n1C[C@H]1CCCO1 15303753 YPERKVKIXVEZLX-KHVWPYCOSA-N 432.351 4.814 50 10 IJGE COc1ccc(/C=C(/C#N)c2nc(-c3cc4cc([N+](=O)[O-])ccc4oc3=O)cs2)cc1 33398781 ONSSQLSDPRBTAN-NVNXTCNLSA-N 431.429 4.897 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3)ccc2[C@H]1c1ccc(Br)cc1 38651563 QWDPBSSIZSBDPT-OAQYLSRUSA-N 447.288 4.886 50 10 IJGE Cc1occc1C(=O)N/N=C1\CCCc2oc(C(=O)Oc3cccc4cccnc34)c(C)c21 40823570 BAYZMHNPCORERJ-OVVQPSECSA-N 443.459 4.727 50 10 IJGE Cc1c(C(=O)NNC(=O)c2ccccc2F)oc2c1/C(=N\Nc1ccccc1)CC(C)(C)C2 101109076 PJOIWTALXQHQNK-USHMODERSA-N 448.498 4.591 50 10 IJGE N#C/C(=C/NCCc1ccccc1Br)C(=O)Nc1cc(Cl)ccc1Cl 217136385 MFBHZVMEONKZAY-QBFSEMIESA-N 439.140 4.934 50 10 IJGE C[C@@H](CBr)CCCNC(=O)c1ccc(Br)cc1Br 228274014 LKWNMLWULRZBAS-SECBINFHSA-N 441.989 4.753 50 10 IJGE CCCC[C@H](CC)CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1I 231313551 VXSXVTQFBVRSGL-SOUVJXGZSA-N 425.351 4.642 50 10 IJGE O=C(NCCCCCCI)c1cc(Cl)cc(Br)c1 236032394 CTPSLCRBDGJCOU-UHFFFAOYSA-N 444.538 4.828 50 10 IJGE O=C(COc1cccc(Cl)c1)NN=Cc1cn(-c2ccccc2)nc1-c1ccccc1 252615482 JSYJKIPZLKDXMP-UHFFFAOYSA-N 430.895 4.722 50 10 IJGE CC(=O)O[C@@]1(C(C)=O)CC[C@@H]2[C@H]3CCC4=CC(=O)CC[C@]4(C)[C@]3(Cl)[C@H](Cl)C[C@@]21C 263627069 LULGNBXHOOJRRU-HGYFENDRSA-N 441.395 4.988 50 10 IJGE CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(C=NNC(=O)CCC(C)C)cs1 727261682 AKRHNYRYFMJFNG-UHFFFAOYSA-N 426.464 4.733 50 10 IJGE CC(C)NC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)C[C@H](C)C2 745139348 CFDTZEGGPDQVBY-BYFYWULKSA-N 428.536 4.710 50 10 IJGE CC(C)c1csc([C@H](C#N)C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)n1 747197372 FNZPBODRAAKNTB-ZMUHTPIZSA-N 440.532 4.827 50 10 IJGE C[C@H](OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)c1cc(F)ccc1F 920156129 GTCRUGPOOJXJAH-IQFISFIMSA-N 432.430 4.953 50 10 IJGE C/C(=C\c1ccccn1)C(=O)NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1 1349064471 NPHNUNQDVZMLKT-FBMGVBCBSA-N 435.549 4.584 50 10 IJGE C#CC[C@H](CCOC)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1530713172 OIJNQLITWGARQE-HJDVLLJCSA-N 444.362 4.853 50 10 IJGE O=C(CSc1nc2ccccc2[nH]1)NN=Cc1cccc(OCc2ccccc2F)c1 1772760309 ASIANXAKOQRKAK-UHFFFAOYSA-N 434.496 4.523 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)Oc1cccc2c1C(=O)OC2=O 1865742714 UYFOEABAYNRMLH-UHFFFAOYSA-N 428.227 4.894 50 10 IJGE F[C@@]1(CBr)CCN(Cc2cccc(Br)c2Br)C1 1917144778 GRURLPNQBFDEBY-GFCCVEGCSA-N 429.953 4.521 50 10 IJGE CC1([C@H](Br)c2c(Cl)sc(Br)c2Cl)CS(=O)(=O)C1 1925567199 UQZCLMWODATSJB-ZCFIWIBFSA-N 443.009 4.688 50 10 IJGE Cl[C@H](c1cc(I)cc2c1OCC2)C1(Br)CCC1 2002788143 PYFSGLVTGQARMP-GFCCVEGCSA-N 427.507 4.824 50 10 IJGE CC[C@H](CCCBr)NC(=O)c1c(Br)cccc1Br 2036509407 DVSLKDDRUWCVKX-SECBINFHSA-N 441.989 4.895 50 10 IJGE O=C(CBr)c1cc(Br)cc(OC(F)(F)F)c1Br 2054921535 AYFNPLOKNOREBZ-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE Cl[C@H](CNc1ncc(I)cc1Br)c1ccccc1 2069525745 LCBSKZBDXSOOPW-GFCCVEGCSA-N 437.506 4.841 50 10 IJGE CC(C)(C)c1cncc(-n2nc(CCl)c(I)c2C(F)(F)F)c1 2078890148 JEBCNVMDBOIZSU-UHFFFAOYSA-N 443.638 4.927 50 10 IJGE Cc1cc(Br)c([C@H](Cl)C2CCS(=O)(=O)CC2)cc1Br 2089856222 BYGCPZHYBKALMV-CYBMUJFWSA-N 430.589 4.625 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1cccc(NC(=O)N2CCC(Br)CC2)c1 2106201277 VCZGBCDFZCZGDY-ZDUSSCGKSA-N 426.355 4.664 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@@H]1CC12CCC(F)(F)CC2 2107097567 ZFLAIGBIKVKAMU-IRXDYDNUSA-N 430.333 4.641 50 10 IJGE Fc1cc(Br)c2nc(CCCl)n([C@@]34C[C@H]3CN(Cc3ccccc3)C4)c2c1 2155873729 QYDJKBRNYGVEKC-YCRPNKLZSA-N 448.767 4.950 50 10 IJGE CC(C)(C)OC(=O)N1CCc2cccc(NC(=O)[C@@H](Br)C3CCCC3)c2C1 2167040274 PNVXVIFKHTZHFY-SFHVURJKSA-N 437.378 4.872 50 10 IJGE C[C@]1(CC(CBr)(CBr)c2ccccc2Cl)COCCO1 2174171464 MTQZGLHKQMOSQV-AWEZNQCLSA-N 426.576 4.563 50 10 IJGE FC[C@]12C[C@](COc3c(Br)cc(CCl)cc3Br)(CO1)C2 2202753191 BOWAONDCBDRHFZ-OKILXGFUSA-N 428.523 4.848 50 10 IJGE Cc1sc(Br)c([C@@H](Br)c2nn(C)nc2Br)c1C 2214372676 JNRDMVNFMVHUAN-SSDOTTSWSA-N 443.990 4.503 50 10 IJGE COc1ccc([C@H](Br)C[C@H]2CCO[C@H]2C)cc1I 2257356997 MLLNLTDNCOVDGB-HOSYDEDBSA-N 425.104 4.551 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1ccc(C(F)(F)F)s1 2263311821 NAPRGCYQQOPRLZ-ZDUSSCGKSA-N 436.293 4.819 50 10 IJGE CCn1c(SCC(=O)NN=CC=Cc2ccco2)nnc1-c1ccc(C(C)(C)C)cc1 2293707274 YCOARULTPCXJPJ-UHFFFAOYSA-N 437.569 4.763 50 10 IJGE Clc1ccc(C[C@@]2(CBr)C[C@@]23CCOC3)cc1I 2315554318 DGIXSKRMAANWTR-KGLIPLIRSA-N 441.534 4.679 50 10 IJGE Cc1scc([C@@H](Br)c2cc(S(C)(=O)=O)cs2)c1Br 2320489688 MUFLBISQFSAJQI-LLVKDONJSA-N 430.208 4.768 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Cl)C1(S(C)(=O)=O)CC1 2339659522 TUHJDHDXBNTXOK-LLVKDONJSA-N 434.552 4.516 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H]2CC[C@H](C2)[C@H]1CBr 2359507861 QALOAQLFQPJNSJ-BFHDXFOESA-N 425.523 4.630 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)[C@@](C)(C(=O)O)c1ccc(OCc2ccccc2)cc1 2374470231 QFWDSVSJZLUCQY-ZWCUEREDSA-N 432.358 4.671 50 10 IJGE O=C(NC1CCCC1)[C@@H](c1ccc(Cl)cc1)N(Cc1ccc(F)cc1)C(=O)CCl 3039490 BHPDRIDUNMIMCH-OAQYLSRUSA-N 437.342 4.847 50 10 IJGE CCOc1cc(/C=N/NC(=O)CSc2nc3ccccc3s2)ccc1OCC(C)C 32520833 XAOWWADPNOBFFQ-FSJBWODESA-N 443.594 4.972 50 10 IJGE N#C/C(=C/c1ccc(COc2ccc(Br)cc2)o1)C(=O)Nc1nccs1 96438655 AVAUBBJFMGWYCO-XFXZXTDPSA-N 430.283 4.623 50 10 IJGE CCOC1=N/C(=C(C#N)\N=N\c2ccc(OC)cc2)NC(=N)[C@@H]1/N=N/c1ccc(OC)cc1 104767190 OZMQFSNQCOMIOT-SXZLTESNSA-N 446.471 4.648 50 10 IJGE COc1ccc(C(=O)Oc2ccc3ccccc3c2C=NNC(=O)c2ccccc2O)cc1 254868001 INRHXYUKEFAKBQ-UHFFFAOYSA-N 440.455 4.537 50 10 IJGE C[C@@H](Cl)C[C@H]1CCCCN1C(=O)c1cc(Cl)ccc1I 312800223 ITSPXMFGTUGBIS-ZYHUDNBSSA-N 426.125 4.957 50 10 IJGE CO[C@H](CO[C@H](CI)c1cccc(Br)c1)C(C)C 386715848 WRZBIAFXWXDCEV-ZIAGYGMSSA-N 427.120 4.613 50 10 IJGE CCCSCCn1c(CCCl)nc2cc(I)c(F)cc21 397329819 QILACUKZVSABQU-UHFFFAOYSA-N 426.726 4.705 50 10 IJGE O=C(CBr)c1cc(Br)c(OC(F)(F)F)cc1OC(F)F 575681048 RKZHFEIALRUUNS-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N(C)[C@H](c2ccccc2)C(F)(F)F)c(C)n1C[C@H]1CCCO1 728499866 YMHXZYZQWPLQDR-GIKWTXSCSA-N 445.485 4.953 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)OCc2nnc(C3CC3)n2C2CC2)c(C)n1-c1ccc(F)cc1 783107533 DFNMZOOFQRPPQD-XDHOZWIPSA-N 445.498 4.687 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccccc2)cc1OCC 1865689249 NHBPIWGOTNHDOL-QHCPKHFHSA-N 444.535 4.509 50 10 IJGE C[C@@H](Br)CCOc1cc(Br)cc(I)c1 1888224985 OLWGRUKPWCBYJT-SSDOTTSWSA-N 433.909 4.606 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@@H]2C[C@H]2C2CCC2)CC1 1910847207 ZASOGZGLUKTRAF-HOTGVXAUSA-N 449.373 4.644 50 10 IJGE Brc1ccc(Br)c(CN2CC[C@H](Br)[C@H]3CC[C@H]32)c1 2070006757 HCWAMOSDOWKNGD-KWCYVHTRSA-N 438.001 4.959 50 10 IJGE COc1ccc(C)cc1-n1nc(CCl)c(I)c1C(F)(F)F 2079212602 WWHZOKPCJNNGRQ-UHFFFAOYSA-N 430.595 4.552 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1cc(Br)cc(Br)c1 2081243318 WPGRPYGTDKFAAM-QPUJVOFHSA-N 441.989 4.751 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1ccnn1[C@H]1CC1(F)F 2121752965 AXXXXWHHGLIWHP-SJORKVTESA-N 426.305 4.525 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)c2ccccc2)C[C@H]1CC(F)F 2177310843 AWUQVPJKENOLIA-IAGOWNOFSA-N 447.364 4.742 50 10 IJGE CC(C)CNCc1cc(Br)c(OC[C@H]2C[C@@H]2Cl)c(Br)c1 2196896954 TUBQKIGXPROQSQ-RISCZKNCSA-N 425.592 4.963 50 10 IJGE Clc1cc(CN2[C@H]3CC[C@H](Br)[C@H]2CC3)ccc1I 2222293108 PGIZCQWZKADWBV-COPLHBTASA-N 440.550 4.835 50 10 IJGE Cc1ccc(C(=O)N[C@@H](CCBr)C(C)(C)C)cc1I 2224619060 SWFLDMGQXVVRTG-ZDUSSCGKSA-N 438.147 4.529 50 10 IJGE CP(C)(=O)Cn1c(CCCl)nc2cc(Br)c(Br)cc21 2225703301 XTLPNLJWDQPMIY-UHFFFAOYSA-N 428.492 4.923 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1C1CCN(CCCCCCBr)CC1 2231086837 FXXVMOJSQRNREN-UHFFFAOYSA-N 429.403 4.891 50 10 IJGE O=C(NCCCCCI)c1cc(F)c(Br)cc1Cl 2256015812 YERWPSNMLHZOQS-UHFFFAOYSA-N 448.501 4.577 50 10 IJGE CS(=O)(=O)[C@H]1C[C@H]([C@H](Br)c2cc(Cl)c(Br)cc2F)C1 2269773597 XXXNLJYUQDBXGD-WSFZALMZSA-N 434.552 4.501 50 10 IJGE ClCc1nc2cc(Br)c(Br)cc2n1CCc1cnsc1 2280122739 OLIDJPWNVKGVDS-UHFFFAOYSA-N 435.572 4.999 50 10 IJGE COc1ccc(Br)cc1C=C(C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 2297551367 FIOWNLRERYZHHL-UHFFFAOYSA-N 436.649 4.565 50 10 IJGE COc1ccc(C=NNC(=O)[C@H]2CC2(c2ccccc2)c2ccccc2)cc1Br 2297710499 MBGCNBPIZAUZQY-HXUWFJFHSA-N 449.348 4.914 50 10 IJGE Cl[C@@H]1CCOCC[C@@H]1Cc1ccc(I)c(Br)c1 2306200136 UHBQXCZLFLFIPD-ZYHUDNBSSA-N 429.523 4.630 50 10 IJGE COc1cccc(OCC(=O)Oc2ccc(C=C(C#N)c3ccc(OC)c(OC)c3)cc2)c1 2318356366 XKDAZEKYTSLAJB-UHFFFAOYSA-N 445.471 4.761 50 10 IJGE Cc1cc(C)c2nc(-n3ncc(C#N)c3NC(=O)C(C#N)=Cc3ccccc3)cc(C)c2c1 2320450685 CHEHKPJIPIVPDF-UHFFFAOYSA-N 432.487 4.763 50 10 IJGE Cl[C@H]1CCCC[C@@H]1CNCc1ccc(I)c(Br)c1 2325211332 HQPBKAIHZRJFMW-YPMHNXCESA-N 442.566 4.941 50 10 IJGE Clc1ccc(I)cc1COc1cnccc1CBr 2327242786 WHBXFEPHISPZRG-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE CCCN1C[C@H](Br)[C@H](Cc2cc(I)ccc2Cl)C1 2327407592 SNYJNVLJCLDGJE-YPMHNXCESA-N 442.566 4.592 50 10 IJGE COc1ccccc1-c1csc(C(C#N)=C(O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)n1 2331282420 RWZHJTWCPSXLRH-UHFFFAOYSA-N 438.421 4.893 50 10 IJGE Cc1csc(C(=O)N2CCC[C@H](Br)[C@@H]2C(F)(F)F)c1Br 2370253287 VSGILXMSDYXOJB-OIBJUYFYSA-N 435.103 4.749 50 10 IJGE COc1ccc(OCCn2cc(/C=C(/C#N)C(=O)NCc3ccco3)c3ccccc32)cc1 33932099 UASRIFHXNYNMTD-CYVLTUHYSA-N 441.487 4.545 50 10 IJGE Cc1c(C(=O)Nc2nccs2)oc2c1/C(=N/NC(=O)c1cccc3ccccc13)CCC2 40813595 QBZXNKXCDXTZDQ-OVVQPSECSA-N 444.516 4.920 50 10 IJGE CCCCCCCCC(CBr)(CBr)[C@@H]1CCS(=O)(=O)C1 118875275 AUUNGJDWVUCHOT-CQSZACIVSA-N 432.262 4.948 50 10 IJGE COc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(C)cc2)cc1 205640515 NFBLGNZWRPZJSE-GUAXOKFESA-N 438.483 4.841 50 10 IJGE Cc1cc(Br)c(F)cc1NS(=O)(=O)c1ccc(CBr)cc1 224490935 KXAPCRROBFTKQB-UHFFFAOYSA-N 437.128 4.592 50 10 IJGE CCC(CC)(CBr)NC(=O)c1ccc(Br)cc1Br 232852164 AAOIBAGUSDBCLU-UHFFFAOYSA-N 441.989 4.895 50 10 IJGE ClCc1sc2cc(I)ccc2c1I 307118541 XCSZWRAONSTJAI-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE BrCc1cc(Br)cc(Br)c1O[C@H]1CCCOC1 310292307 NYMIVAIBCHGVMU-JTQLQIEISA-N 428.946 4.664 50 10 IJGE Br[C@H](c1ccc2c(c1)OCCO2)c1sccc1I 310864697 RFNJZFFPUIXBFO-GFCCVEGCSA-N 437.096 4.608 50 10 IJGE O=C(NC[C@H]1CC[C@H](Br)C1)c1scc(Br)c1Br 705402007 SPMWYEGJXRNHOM-BQBZGAKWSA-N 446.002 4.567 50 10 IJGE CN1C(=C(C#N)C(=O)CCC(=O)NC(C2CCCC2)C2CCCC2)N(C)c2ccccc21 735473837 DMMNPOUHHSNFSY-UHFFFAOYSA-N 434.584 4.522 50 10 IJGE CC(=C/c1ccc(Cl)cc1)/C=C(/C#N)c1nnc(N2CCOCC2)n1-c1ccccc1 753714019 LLLYUMKUCOTIJE-MBJQRLBQSA-N 431.927 4.768 50 10 IJGE CSCc1ccc(CNC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cc1 804701269 DSDMGPRGQRQRII-HMAPJEAMSA-N 441.560 4.550 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 1084536105 WUYOAOQUNSLKPP-LCYFTJDESA-N 438.783 4.962 50 10 IJGE C#CCOc1ccc(COC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 1127864608 SJMWHMSCEUOROX-JCMHNJIXSA-N 428.463 4.896 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2ccc(Oc3cccc(Cl)c3)cn2)c1C 1182729540 NPRKSLJALSWXNN-UHFFFAOYSA-N 446.898 4.753 50 10 IJGE CCOc1c(OC)cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2CC(C)C 1865694010 SVMIKHQPSCGEBD-OAQYLSRUSA-N 444.535 4.832 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)CNC(=O)c3ccccc3)n2)cc1Cl 1872757809 WYFGDUICPVGWLE-SDXDJHTJSA-N 425.897 4.695 50 10 IJGE CCn1nc(C)c(Br)c1CN(CCCBr)Cc1ccccc1 1914648911 DRVIGHFDJSELHA-UHFFFAOYSA-N 429.200 4.761 50 10 IJGE CC(C)[C@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1 1915275913 ITSYXDZEGNTFGK-SFHVURJKSA-N 430.795 4.903 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2nc3sccn3c2CBr)C1 1921469088 IMXHDKFEXVDEMO-HZPDHXFCSA-N 433.419 4.638 50 10 IJGE C[C@@H](c1ccncc1Br)[C@H](Br)c1cc(Br)n(C)n1 1924063910 XJZUGBVQCMPBBF-MADCSZMMSA-N 437.961 4.580 50 10 IJGE Brc1cccc(Br)c1CNCCCCI 1930705593 SCWIFPBYZKBWQO-UHFFFAOYSA-N 446.952 4.516 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@@H]1CCCN(C[C@H](CBr)C2CC2)C1 1966339754 SWKPNBWNWFVFSJ-CEXWTWQISA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@](C)(CI)O2)[C@@H]1C(C)(C)C 1987727474 NJCTUSFVHJYWTR-MORSLUCNSA-N 437.362 4.785 50 10 IJGE Brc1ccc(C[C@@H]2CCOCC[C@H]2Br)c(Br)c1 2001023410 PEKVTYVOYRGQGN-CMPLNLGQSA-N 426.974 4.944 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1cc(Br)c(Br)s1 2023028728 NYOZWUFIHZODIH-POYBYMJQSA-N 448.018 4.813 50 10 IJGE Cc1cc(F)c(F)cc1[C@@H](Br)c1cc(I)sn1 2024718418 VALCTURMJREJNE-LLVKDONJSA-N 430.055 4.819 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](I)[C@H](OC2CC3(C2)CC2(CCC2)C3)C1 2025070492 BFWJUXUDOZBRBR-HUUCEWRRSA-N 447.357 4.539 50 10 IJGE CC(C)[C@@H](Br)CCNC(=O)c1ccc(Br)cc1Br 2029915706 BFIKLKWUXYRDAP-NSHDSACASA-N 441.989 4.751 50 10 IJGE CC(C)CN(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(CBr)c1F 2059311734 ATTWJRODDNLLJK-UHFFFAOYSA-N 432.330 4.707 50 10 IJGE FC(F)Oc1cc(I)cc(CBr)c1OC(F)(F)F 2060220388 UXTSFEJTTTUSFH-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE O=C(CBr)c1c(C(F)(F)F)ccc(I)c1C(F)F 2060393957 UJJUJCOLKAMKLX-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE COC1CC2(C1)CC(CBr)(Cc1ccc(I)cc1)C2 2100346984 JEXIHLDKGQFYHZ-UHFFFAOYSA-N 435.143 4.804 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN(C[C@@H](CBr)C2CCC2)C1 2106787295 YOTOJZRMPYNTQL-GUDVDZBRSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C(F)(F)F)CCCN1C[C@H](CBr)CC1CC1 2112864897 WHAYTJLPWRUSIJ-WMLDXEAASA-N 443.348 4.719 50 10 IJGE ClCc1ccc(N2CC[C@H]3COC[C@@H](C2)N3Cc2ccccc2)cc1Br 2139651949 JHGDXAQNQZAXLP-VQTJNVASSA-N 435.793 4.668 50 10 IJGE Cc1c(CCl)cc(Cl)cc1S(=O)(=O)N(Cc1ccccc1)C[C@H]1CCCO1 2152214887 LHKJSIGTVSWTMT-LJQANCHMSA-N 428.381 4.757 50 10 IJGE Cn1cc(CC(CBr)(CBr)c2cccc(Cl)c2)c(Cl)n1 2168230802 CLOIJIKRQMULHL-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)C12CCC(CC1)OC2 2192888355 LZBWBVJPBQBNFW-NRAUKZCXSA-N 449.126 4.621 50 10 IJGE O=C(N[C@H]1CCCN(C[C@H](CBr)c2ccccc2)C1)OCc1ccccc1 2253195068 NSEBIJXSQXJURZ-SFTDATJTSA-N 431.374 4.556 50 10 IJGE CCCO[C@@H]1[C@H](Br)C[C@H]1Oc1cc(I)ccc1Cl 2259921226 OHKRVWQKOJCBFU-OASPWFOLSA-N 445.522 4.654 50 10 IJGE O=C(c1scc(Br)c1Cl)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Br)C2 2264500975 IASDRTJLIAUWJS-UEGXPFIPSA-N 431.552 4.643 50 10 IJGE O=C(N[C@H](CCl)C1CCCCC1)c1ccc(Cl)c(I)c1 2283651944 NSVMKTIKHZSPCO-CQSZACIVSA-N 426.125 4.862 50 10 IJGE O=C(N[C@@H]1CCC[C@H](CBr)C1)c1cc(Br)c(F)cc1Cl 2285843991 GZYYYFCUXZLUAQ-DTWKUNHWSA-N 427.539 4.925 50 10 IJGE CC1(C)CCN(Cc2sccc2I)C[C@@H]1CBr 2301069343 VSLYTQUDAPJBHW-JTQLQIEISA-N 428.177 4.596 50 10 IJGE C[C@@H](CBr)CC1CN(Cc2ccc(Cl)cc2I)C1 2318545493 JIXUKOXCDNVONM-SNVBAGLBSA-N 442.566 4.798 50 10 IJGE CCOc1ccc(CCNC=C(C#N)C(=O)Nc2ccc(C)c(Cl)c2)cc1OCC 2324281679 UTIABEPBLSPAMZ-UHFFFAOYSA-N 427.932 4.624 50 10 IJGE Cc1ccc(S(=O)(=O)NCC(O)=C(C#N)c2nc(-c3cccc(Cl)c3)cs2)cc1 2331295687 RQDWSSBHKFKQIQ-UHFFFAOYSA-N 445.953 4.543 50 10 IJGE C[C@@H](CC(=O)N(C)C[C@@H]1C[C@H]1Br)c1ccc(NC(=O)OC(C)(C)C)cc1 2332465372 OYYBWYZIWMKNAN-JLJPHGGASA-N 425.367 4.769 50 10 IJGE C[C@@H]1CCC[C@H](CO[C@@H](CI)c2cccc(Br)c2)O1 2338704611 FLBQMECFUHCNDM-DFBGVHRSSA-N 439.131 4.899 50 10 IJGE CN(CC1(CBr)CC(C)(C)C1)[C@H]1CCN(C(=O)OC(C)(C)C)CC12CC2 2345007653 DKYKIQNALWMODE-INIZCTEOSA-N 429.443 4.909 50 10 IJGE CC(C)[C@H](Br)C(C)(C)NS(=O)(=O)c1ccc(Cl)c(Br)c1 2365957517 UAFFSFGBMMVTTG-LBPRGKRZSA-N 447.620 4.579 50 10 IJGE Cc1cc(S(=O)(=O)NCC(C)(C)[C@@H](Br)C(C)C)sc1Br 2365994757 LAWMORZLJQHQEW-NSHDSACASA-N 447.258 4.543 50 10 IJGE C/C(=N/NC(=O)c1ccc(COc2cccc3cccnc23)cc1)c1ccc([N+](=O)[O-])cc1 33370877 IVJCWXOOYJNGNX-PKAZHMFMSA-N 440.459 4.876 50 10 IJGE C=CCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C\c2ccc(C(C)C)cc2)c(OC)c1 34896124 NZOWAOVBMFEJIB-FRHHWIBZSA-N 430.504 4.647 50 10 IJGE CC(C)c1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccco2)cc1 38657540 UWCZDAMETKJURE-DEOSSOPVSA-N 430.460 4.606 50 10 IJGE Cc1cccc(NC(=S)NNC(=O)c2sc3nc(C(F)(F)F)ccc3c2C)c1C 71873022 YCSGIMISBWAQIM-UHFFFAOYSA-N 438.500 4.872 50 10 IJGE CCOc1c(Cl)cc(/C=N\NC(=O)CSc2nc3ccccc3n2C)cc1Cl 169876391 PMTOWWYRWHSZEW-YVNNLAQVSA-N 437.352 4.521 50 10 IJGE CCC[C@@H](CCCl)CNS(=O)(=O)c1cc(Br)ccc1Br 227504941 OZCKBPGWLKLXFM-JTQLQIEISA-N 447.620 4.535 50 10 IJGE O=C(NCCCCCBr)c1cc(Br)c(Br)s1 229221309 DZHJHEGTNAPIDL-UHFFFAOYSA-N 433.991 4.568 50 10 IJGE CC[C@@](C)(CBr)NC(=O)c1cc(Br)sc1Br 233945738 KOMGMQAHOUNLRH-JTQLQIEISA-N 433.991 4.567 50 10 IJGE CC[C@H](NC(=O)c1cc(Br)c(Br)s1)[C@H](Br)CC 313102115 FYQLCUGIVXHQRE-SVRRBLITSA-N 448.018 4.955 50 10 IJGE O=[N+]([O-])c1cc(CBr)ccc1N1CC[C@H]2CC[C@@H](C1)N2Cc1ccccc1 399850337 RCRWGCRLHHWLRH-MOPGFXCFSA-N 430.346 4.733 50 10 IJGE C[C@H]1CN(Cc2cc(Cl)ccc2I)CC[C@H]1Br 405351921 VFDPKYPAKKFNIN-JOYOIKCWSA-N 428.539 4.550 50 10 IJGE C[C@H](NC(=O)c1scc(Br)c1Br)C1(CBr)CC1 707836953 DOTHMFUTBAMGFA-LURJTMIESA-N 446.002 4.567 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N(C[C@@H]2CCCO2)c2ccncc2)c(C)n1-c1ccc(F)cc1 733972698 WPHFKXNCEBALPB-WZLQQZPBSA-N 444.510 4.747 50 10 IJGE C=CCOc1ccc(/C=C\C(=O)NNc2ccc(Cl)c(Br)c2)cc1OC 1156739911 BXQJMCZFDSBQTC-UITAMQMPSA-N 437.721 4.832 50 10 IJGE CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)C[C@H](CBr)C1CC1 1460053125 RMJSRDCHSBRDEX-IBGZPJMESA-N 425.411 4.825 50 10 IJGE C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccc(OCc2ccccc2)cc1 1557605620 KYZVUVSBADOEEM-FQEVSTJZSA-N 445.947 4.745 50 10 IJGE C#CCOCCC(=O)Nc1ccc(Br)cc1CO[Si](C)(C)C(C)(C)C 1595534540 IREJUWWJOMSVBF-UHFFFAOYSA-N 426.427 4.949 50 10 IJGE C#CC[C@@]1(C(=O)NNc2ccccc2Cc2ccccc2)CCCN1C(=O)OC(C)(C)C 1639907602 IQLPONCBNJPOIF-SANMLTNESA-N 433.552 4.514 50 10 IJGE C=CC[C@H]1CCCC[C@@H]1NC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1 1687035977 FKQCOUBMFGWYHD-AVRDEDQJSA-N 441.959 4.998 50 10 IJGE CN1CCN(c2cc(Nc3ccc(SC#N)cc3)nc(-c3ccc(Cl)cc3)n2)CC1 1859834043 YWLZRABXAHZUKE-UHFFFAOYSA-N 436.972 4.866 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccc(OC)cc1)nn2CCC 1865690793 BEYZWWOERUPDSV-QFIPXVFZSA-N 442.519 4.752 50 10 IJGE COc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2-c1cccc(Cl)c1 1865710030 MXIZAORJMPRPQK-INIZCTEOSA-N 446.816 4.771 50 10 IJGE N#C/C(=C\c1ccc(Cl)cc1)C(=O)NC[C@H](c1c(F)cccc1Cl)N1CCCC1 1866127828 HUVUWLXFZUHWKD-ZRNYNZGJSA-N 432.326 4.993 50 10 IJGE COCc1cc(Br)c([C@H](Cl)c2c(Br)c(C)nn2C)s1 1877182203 PWLLOGBRAMETOC-SNVBAGLBSA-N 428.577 4.790 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)C(=O)Cc1ccccc1I 1915082241 JBGTVRFTMVVYSL-QGZVFWFLSA-N 441.740 4.880 50 10 IJGE O=S(=O)(c1ccc2c(c1)CCC2)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915173550 ZGYVGVJYTHVJTQ-OAQYLSRUSA-N 434.399 4.540 50 10 IJGE CN(C)CCN(Cc1ccccc1)c1ccc(CBr)cc1Br 1931934825 BTIJEXWUCMWUSP-UHFFFAOYSA-N 426.196 4.912 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@H](CCBr)C1 1945189661 WUZUNWIUHGXTEC-ZETCQYMHSA-N 446.002 4.520 50 10 IJGE CN(C[C@@H](Br)Cc1c(Br)cccc1Br)C1CC1 1949865509 ZPQDTRWGXKTZIA-VIFPVBQESA-N 425.990 4.612 50 10 IJGE F[C@@H]1CC[C@H]([C@H](Br)c2cc(I)cc3c2OCC3)C1 2032983177 DNQLSQNZXULSLL-PLMOITTCSA-N 425.079 4.800 50 10 IJGE C[C@]1([C@@H](Br)c2cc(I)cc3c2OCC3)CC1(F)F 2036108002 GPNONSHBDMMIKK-NWDGAFQWSA-N 429.042 4.707 50 10 IJGE CCC[C@@H](Br)c1cn(-c2cc(I)ccc2Cl)nn1 2057426560 GULFJUGFAFMPTJ-SECBINFHSA-N 440.510 4.761 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@@H]2CCC[C@H](C1)C2Cl 2111473584 LHXWSGFGNLGGDY-OQJHAAMPSA-N 427.589 4.753 50 10 IJGE Cc1c(Cl)cc(C(=O)N2CCSC[C@H]2CCBr)cc1Br 2167376408 IJKKRZYTBIBPRX-LLVKDONJSA-N 441.616 4.754 50 10 IJGE CP(C)(=O)CCn1c(CCl)nc2cc(Br)c(Br)cc21 2225704969 ROLHKLPRRCKNIK-UHFFFAOYSA-N 428.492 4.923 50 10 IJGE C[C@@]1(CI)CCC2(CCC(NC(=O)OCc3ccccc3)CC2)O1 2241903167 GQNVNUKPCKICPD-AVAKVYKDSA-N 443.325 4.598 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@@H]1Br)c1scc(Br)c1Cl 2279183758 NUBQQYHZRWKZBW-JOYOIKCWSA-N 435.568 4.955 50 10 IJGE COC[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)N(CC2(CBr)CCCCCC2)C1 2289590995 YHXZSHOTYUQZJT-QZTJIDSGSA-N 447.458 4.584 50 10 IJGE CCCN1CC(=Cc2ccc(OC)cc2)C2=C(C1)[C@H](c1ccc(OC)cc1)C(C#N)=C(N)O2 2295993284 FVBNCSSBLXIBEE-RUZDIDTESA-N 443.547 4.575 50 10 IJGE C=CCNC(=O)C(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc(OC(C)C)c(C)c1 2296703450 OSFCKVNQWWFKGK-UHFFFAOYSA-N 426.520 4.844 50 10 IJGE CC1(C)CCN(Cc2sccc2I)C[C@H]1CBr 2301069344 VSLYTQUDAPJBHW-SNVBAGLBSA-N 428.177 4.596 50 10 IJGE C[C@H](CCBr)CCNCc1ccc(Cl)cc1I 2302325775 KBEVUJVEVDCIBB-SNVBAGLBSA-N 430.555 4.845 50 10 IJGE CCOC(=O)C(C#N)=Cc1cccc(OC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)c1 2314770765 YVSPMBGSZGBZGD-MRXNPFEDSA-N 427.884 4.800 50 10 IJGE ClC[C@H]1CCCC[C@@H]1NCc1ccc(I)c(Br)c1 2325211681 AJHIEDFRANAHFA-RISCZKNCSA-N 442.566 4.941 50 10 IJGE CC(C)C[C@H](CBr)CN=[S@](C)(=O)C1CCN(C(=O)OC(C)(C)C)CC1 2328521358 NYAVAMUQYWUMOG-SGANQWHYSA-N 439.460 4.541 50 10 IJGE O=C(NC1CCCCC1)[C@@H](c1ccc(F)cc1)N(CCc1ccccc1)C(=O)CCl 3037407 VFBVCNZAMOXNAW-HSZRJFAPSA-N 430.951 4.626 50 10 IJGE CC[C@@H](C)Oc1cccc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)c1 10661725 IENLJGXOVPRFMG-CQSZACIVSA-N 439.339 4.791 50 10 IJGE Cc1ccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2[N+](=O)[O-])c(C)c1 40621189 ZWUMCVPVXMYDEP-UHFFFAOYSA-N 447.282 4.809 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)COc2ccccc2)CCC3)cc1 40816229 CLMUVZRLHYQEPJ-SZXQPVLSSA-N 446.503 4.605 50 10 IJGE CC(C)(C)S(=O)(=O)CC[C@H](CBr)Cc1cccc(Br)c1 232677528 FVNNKUOIJHQBGN-ZDUSSCGKSA-N 426.214 4.606 50 10 IJGE O=C(c1cc(Cl)ccc1I)N(CCCl)C1CCCCC1 236019812 FCXOADVKZGASMG-UHFFFAOYSA-N 426.125 4.958 50 10 IJGE CC[C@H](NC(=O)c1cc(Br)ccc1Br)[C@H](C)Br 386650614 BNYUKNCBOBDVLU-CPCISQLKSA-N 427.962 4.503 50 10 IJGE CC(C)[C@@](C)(CBr)NC(=O)c1cc(Br)sc1Br 398541102 FUJFSHJUGFJNBP-LLVKDONJSA-N 448.018 4.813 50 10 IJGE C[C@H]1CC[C@@H](CBr)CN1c1ncc(Br)cc1Br 688663830 IIZNUDUMGKPSLK-IUCAKERBSA-N 426.978 4.606 50 10 IJGE CC(CBr)(CBr)NC(=O)c1cc(C(F)(F)F)ccc1Cl 695012598 CWICFMXPWOUFTM-UHFFFAOYSA-N 437.481 4.637 50 10 IJGE Cc1cc(Br)ccc1NNC(=O)C1CCN(c2nc3ccccc3s2)CC1 748750549 IOQLNNCQKLAYOR-UHFFFAOYSA-N 445.386 4.727 50 10 IJGE CC(C)(C)c1cc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)n(-c2ccccn2)n1 799411756 ULJRWCUQNMPPGZ-UHFFFAOYSA-N 443.433 4.604 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)[C@@H](Oc2cccc(C(C)C)c2)c2ccccc2)c1 1154050519 PRJDJCORTPPOCB-DEOSSOPVSA-N 443.572 4.929 50 10 IJGE C=CCOCCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1437775477 YDYVZWUKTDEEGR-CPNJWEJPSA-N 431.458 4.729 50 10 IJGE C=CCCC[C@H](NC(=O)NNC(=O)c1cc(F)ccc1Br)c1ccccc1 1684893723 GXDZFGNWLOHXRB-SFHVURJKSA-N 434.309 4.630 50 10 IJGE CCc1nn(Cc2ccc(C)cc2)c2c1[C@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 1865714600 MWZPZFZOQLLPNS-HXUWFJFHSA-N 449.352 4.783 50 10 IJGE Cc1ccc(C(=O)CCC(=O)NNC(=O)c2ccc(-c3ccc(C)c(C)c3)nc2C)c(C)c1 1865756442 ZBYYUVLNSVULFO-UHFFFAOYSA-N 443.547 4.715 50 10 IJGE N#C/C(=C\c1cccc(Cl)c1)C(=O)Nc1ccc(I)cc1F 1866129792 LPDCPXHVUOJJLO-IZZDOVSWSA-N 426.616 4.629 50 10 IJGE COc1cccc(Br)c1C(=O)N(CCCBr)Cc1ccccc1 1914628552 VRFNZXSSJDATCD-UHFFFAOYSA-N 441.163 4.885 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H](C)N(c2ccc([N+](=O)[O-])cc2CBr)C1 1921470798 SQOUMTHLNJTRIP-IRXDYDNUSA-N 432.362 4.837 50 10 IJGE CCc1nc(C(=O)N(Cc2ccccc2)[C@H](C)CBr)c(Br)s1 1961181543 BQCKVBSTKFLFNG-LLVKDONJSA-N 446.208 4.894 50 10 IJGE CCn1cc(Br)c([C@H](Br)Cc2ccncc2Br)n1 2060850408 CHFIKIWSVGOBQB-SECBINFHSA-N 437.961 4.502 50 10 IJGE C[C@@]1(CCBr)CCN(Cc2cc(Cl)ccc2I)C1 2068170126 UQMNWQFHTFSVII-CQSZACIVSA-N 442.566 4.942 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC2(CCC2)C[C@H]1CCl 2095169251 WZJLVQFNZKDQDR-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C1 2106780817 BVFKWVHHZWBYMY-IAGOWNOFSA-N 435.447 4.582 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCN(C[C@H](CBr)CC3CC3)CC2)CC1 2112868298 IMDAEFFBLUQDAC-SFHVURJKSA-N 429.443 4.911 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2C[C@@H]1CCN1Cc1ccccc1 2128497651 QSVYFKGFRFYXFZ-INIZCTEOSA-N 433.781 4.558 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@@H](CBr)C12CCC2 2133828029 ONDWUJXLHJIQRM-QMMMGPOBSA-N 427.589 4.944 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2C[C@H]1CCN(Cc2ccccc2)C1 2153120810 XRCYGPWKZZVKEK-KRWDZBQOSA-N 447.808 4.806 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@@]2(CCl)CCC[C@]2(F)C1 2176640090 LBEZDBUJBGJLNW-STQMWFEESA-N 445.579 4.846 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)c2ccccc21 2196912918 BFOUODMDMMTSQO-HLLBOEOZSA-N 437.378 4.547 50 10 IJGE CC(C)(C)OC(=O)N1Cc2ccccc2CN1CCCCCI 2211186935 RDRJPIWFQBEBGD-UHFFFAOYSA-N 430.330 4.760 50 10 IJGE O=C(N[C@H](CCBr)C(F)(F)F)c1scc(Br)c1Cl 2253552299 PFWOIESRPOWJFQ-RXMQYKEDSA-N 429.483 4.610 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)[C@H](C)CBr)c(Cl)c1OC 2256279384 HSRJYMHQJFRMHF-CYBMUJFWSA-N 426.738 4.783 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Br)c2cc(F)c(Br)cc2F)c1 2282135475 FQUYCPOKPKWZIS-LBPRGKRZSA-N 446.132 4.677 50 10 IJGE O=C(N[C@H](CBr)c1ccsc1)c1cc(F)c(Br)cc1F 2282712537 RNSKBOLHRLPKQQ-GFCCVEGCSA-N 425.092 4.655 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H]2CC[C@H]1CC(Br)C2 2285845163 WPENQKGLSBDQLG-IUCAKERBSA-N 425.523 4.772 50 10 IJGE N#CC(=Cc1ccc(OCc2cccc(C(=O)O)c2)c(Cl)c1)C(=O)Nc1ccc(O)cc1 2297534839 CLORGKNJMUHRAZ-UHFFFAOYSA-N 448.862 4.868 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@@H]2CCCC[C@@H]3C[C@H]32)CC1 2302876316 RWRYBCLCFKEFCP-BZUAXINKSA-N 449.373 4.786 50 10 IJGE CC(C)C[C@@H](CCl)NCc1ccc(I)c(Br)c1 2306218209 XSRGYOVRNUPUKY-NSHDSACASA-N 430.555 4.797 50 10 IJGE Cc1nc(-c2ccc(F)cc2)ccc1C(=O)NN=Cc1c(Cl)nc2scc(C)n12 2321244572 BBYPTBUROSVWNN-UHFFFAOYSA-N 427.892 4.631 50 10 IJGE CCOc1cc(C=NNC(=O)Cc2ccc(OC)cc2)ccc1OCc1ccc(C)cc1 2323331842 SDJLTQYXFVBDJU-UHFFFAOYSA-N 432.520 4.674 50 10 IJGE CC[C@H](NC=C(C#N)C(=O)N[C@@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 2325044901 DVGWFEJTONCTNB-UUOWRZLLSA-N 447.579 4.908 50 10 IJGE ClCc1csc(CCOCc2ccc(Cl)cc2I)n1 2340149448 GIGLKDYZDVONIJ-UHFFFAOYSA-N 428.122 4.899 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]3C2(C)C)C1 2345004479 KZJWUKIOEWEUOM-JKSUJKDBSA-N 429.443 4.765 50 10 IJGE CC1(C)CCCN(C(=O)c2ccc(Cl)cc2I)[C@@H]1CCl 2365592066 OIYCWKNCGBRNLF-CYBMUJFWSA-N 426.125 4.814 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ccc(Cl)cc2I)C[C@@H]1CCl 2366680343 QSAWGPNYUATGKF-ONGXEEELSA-N 438.058 4.794 50 10 IJGE CC1(C)[C@H]2CC[C@]1(C)/C(=N\NC(=O)c1ccccc1OCC(=O)Nc1ccccc1F)C2 9539746 JQQARAYVABICFB-DVOBICHMSA-N 437.515 4.775 50 10 IJGE N#C/C(=C\c1ccccc1)C(=O)/N=C1\N=C/C(=N\Nc2cccc(C(F)(F)F)c2)S1 12559306 QGWOUCXNHWZOSJ-MIAZFVAUSA-N 427.411 4.738 50 10 IJGE CC(C)CCOc1ccc(C(=O)NNC(=O)c2ccccc2OCc2ccccc2)cc1 14036694 HOBPTCDBWSMULX-UHFFFAOYSA-N 432.520 4.765 50 10 IJGE N#C/C(=C/c1ccc(OC(=O)CN2C(=O)c3ccccc3C2=O)cc1)c1ccc(Cl)cc1 31901263 CGCCNFUXJKKQKD-AQTBWJFISA-N 442.858 4.606 50 10 IJGE O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N/N=C/c1c(O)ccc2ccccc12 59202508 JCDPVRNIUFLCNI-YSURURNPSA-N 449.410 4.715 50 10 IJGE Cn1ccnc1COc1ccc(/C=C(/C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 98008588 FRJAOHWLKVUQRP-NVNXTCNLSA-N 427.291 4.852 50 10 IJGE CCCCCCOc1ccc(C(=O)N/N=C/c2cc(Br)c(O)c(OC)c2)cc1 100437542 KJHQNUQBSBQEMT-OEAKJJBVSA-N 449.345 4.886 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Br)Cc3ccc(Cl)cc3)cc2[nH]1 109884118 XXCIFCRIEBQRQM-NSHDSACASA-N 430.527 4.951 50 10 IJGE CCOc1c(Cl)cc(/C=N\NC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc1OC 169917907 WRLXZOIAXIERAR-KSEXSDGBSA-N 446.960 4.888 50 10 IJGE COc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)cc1 205652603 UDMPWYMVBARZDE-GRLJGPAPSA-N 442.446 4.671 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C\NCc1ccccc1Br)c1ccc2c(c1)CCCC2 217204595 TUCJEDJUYMMKAL-NOEYKIMYSA-N 438.369 4.702 50 10 IJGE CCC[C@H](C)CO[C@@](C)(CI)CN(CC)C(=O)OC(C)(C)C 233337123 HVYMGRFPMYJIDS-YOEHRIQHSA-N 427.367 4.890 50 10 IJGE CCOc1ccc(C=NNC(=O)c2cc(-c3ccc(OCc4ccccc4)cc3)n[nH]2)cc1 254745630 YTCXPKHMZFFGHF-UHFFFAOYSA-N 440.503 4.818 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H](CCl)C1)c1ccc(I)c(Cl)c1 312858100 YZQBOTHKQQTUKJ-GHMZBOCLSA-N 426.125 4.720 50 10 IJGE O=C(N[C@H]1CCC[C@@H](Br)C1)c1cc(Br)ccc1Br 694508034 STDCRMFCDNASCO-SCZZXKLOSA-N 439.973 4.648 50 10 IJGE C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1[C@H](Br)c1cc(I)cc2c1OCC2 716444323 OGAQKQRVTFCCSD-WMCDLHDESA-N 433.127 4.954 50 10 IJGE CC(=O)N(C)c1ccccc1NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(F)cc2)c1C 735640599 LBCFMZSDAKFTJI-ZHZULCJRSA-N 430.483 4.762 50 10 IJGE C=CCOc1cn(-c2ccccc2)nc1C(=O)NNc1nc2cc(Cl)ccc2cc1C 779042133 GUBZVCYFZSXFDS-UHFFFAOYSA-N 433.899 4.704 50 10 IJGE C[C@H](OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1)c1cccnc1 781865618 BVRBAFLLZWCCLE-JJBLJPBOSA-N 431.883 4.724 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2cccc3c2CN(c2ccccn2)C3)c(C(F)(F)F)c1 799408077 JCUVZNFIIOIAAY-UHFFFAOYSA-N 438.413 4.641 50 10 IJGE N#Cc1ccc(NNC(=O)NCc2nc(-c3ccccc3F)cs2)c(C(F)(F)F)c1 799631975 XZHALZUUOOCLFJ-UHFFFAOYSA-N 435.406 4.666 50 10 IJGE CC(C)c1ccc(NC(=O)C(=O)NNc2ccc(C#N)cc2C(F)(F)F)c(C(C)C)c1 799840521 LRAYCHDISJTXMQ-UHFFFAOYSA-N 432.446 4.906 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)N(C)C)c(Br)cc1OCc1cccc(C)c1 1083906134 PWOJNFOTLHEADP-VCHYOVAHSA-N 443.341 4.730 50 10 IJGE Cc1ccc(CSCC(=O)NN=Cc2ccc(OCc3ccc([N+](=O)[O-])cc3)cc2)cc1 1084092443 XZZVXKGROYKLPA-UHFFFAOYSA-N 449.532 4.866 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)N(C)C)cc(Br)c1OCc1cccc(F)c1 1084222461 CJBHNCDLEOKGON-LZYBPNLTSA-N 447.304 4.561 50 10 IJGE CCN(CC)c1c(C=NNC(=O)CCCNc2ccc(C)cc2)c(C)nn1-c1ccccc1 1084491106 CASKLPYNKADXKB-UHFFFAOYSA-N 446.599 4.678 50 10 IJGE C=CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1cc(Cl)ccc1Br 1558283846 VZIOYTOHTYFCJS-AWEZNQCLSA-N 446.773 4.795 50 10 IJGE C#C[C@H](NC(=O)NNc1c(F)cc(F)cc1Br)c1ccc(Cl)cc1F 1683516631 FNJQWCNDHGJGHB-AWEZNQCLSA-N 432.627 4.520 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)Cc2ccccc2)CCC3)c(C)c1 1772749188 RCRAZRGLFHMJGQ-UHFFFAOYSA-N 429.520 4.856 50 10 IJGE CCCc1nn(-c2cccc3ccccc23)c2c1[C@@H](c1ccc(O)c(O)c1)C(C#N)=C(N)O2 1865680544 NXLPQQOYKJGKQS-QHCPKHFHSA-N 438.487 4.607 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1ccc(F)cc1 1865702770 FBQDVSFQURVQEU-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE CCOc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3CC)ccc1OCc1ccccc1C 1865702967 JQTMDXCRBNJHGF-XMMPIXPASA-N 444.535 4.716 50 10 IJGE Cc1ccc(C)c(-c2csc(/C(C#N)=C(\O)[C@@H](C)N3C(=O)c4ccccc4C3=O)n2)c1 1872749830 JZEDQAPRYZJTIF-DSGGYQJVSA-N 429.501 4.904 50 10 IJGE O=S(=O)(N[C@H](CBr)CC1CCCCC1)c1cscc1Br 1926787765 WKEQIQNQINWGHY-NSHDSACASA-N 445.242 4.523 50 10 IJGE COC[C@@]1([C@H](Br)c2cc(Br)c(Br)s2)CCCO1 1943035467 CQYBVJVCUZPARY-MWLCHTKSSA-N 449.002 4.905 50 10 IJGE C[C@H]1C[C@H]1N(CCBr)C(=O)c1cc(Br)sc1Br 2002024999 ZAPVKRUVXBQKKZ-POYBYMJQSA-N 446.002 4.519 50 10 IJGE CCN(C)C[C@H](Br)CCc1cc(Br)ccc1Br 2006499663 KKHUHPOVENOVFB-GFCCVEGCSA-N 428.006 4.859 50 10 IJGE O=S(=O)([C@@H]1CC[C@H](CBr)C1)N(Cc1ccccc1)Cc1cccs1 2009647588 VLJWKEBWDRUKKN-FUHWJXTLSA-N 428.417 4.644 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1Cc1ccc(Br)cc1Br 2018116688 GDYLARCLVJXEGU-NOZJJQNGSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(CC2(CBr)CCCCC2)CC1(F)F 2044700612 RJEVGXUMZVGYEX-AWEZNQCLSA-N 425.358 4.566 50 10 IJGE Fc1cc(Cl)ncc1-n1nc(CBr)c(Br)c1C(F)(F)F 2078911942 CPQKCXZZPRDHKK-UHFFFAOYSA-N 437.416 4.736 50 10 IJGE Fc1ccc2nc(CCl)n([C@@]34C[C@@H]3CN(Cc3ccccc3)C4)c2c1Br 2099679046 NJPRJXAYCAGYAM-JLTOFOAXSA-N 434.740 4.908 50 10 IJGE C[C@H]1CC[C@@H](CNC(=O)C(F)(F)F)N(CC2(CBr)CCCCCC2)C1 2106783845 CZEUHANRWHKHQT-GJZGRUSLSA-N 427.349 4.501 50 10 IJGE CN(CC[C@@H]1CCCCN1C(=O)[C@@H](Br)C1CCCC1)C(=O)OC(C)(C)C 2110716097 UJEHDKSWXGHQSL-IRXDYDNUSA-N 431.415 4.578 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]23CCC[C@]2(CN(Cc2ccc(CBr)cc2)C3)C1 2182844672 HAVVBIWXECMLGF-VXKWHMMOSA-N 435.406 4.805 50 10 IJGE C[C@H](CC1CCN(C(=O)c2ccc(CBr)cc2)CC1)NC(=O)OC(C)(C)C 2203523110 GMKYVWYFJWMGKP-OAHLLOKOSA-N 439.394 4.737 50 10 IJGE CCC(CBr)(CBr)NC(=O)Cc1cc(Cl)cc(Cl)c1 2232214060 WFABANARBFOARS-UHFFFAOYSA-N 431.983 4.591 50 10 IJGE CCCN[C@H](Cc1cc(Br)cc(Br)c1)[C@@H]1C[C@H]1Br 2263513544 OYVMJDPUYKAONC-MGPQQGTHSA-N 440.017 4.906 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@@H](Br)C1CC(S(C)(=O)=O)C1 2269880021 NULBWHAAYBKYOS-RPTIHFLNSA-N 430.589 4.670 50 10 IJGE CCOC(=O)C(C#N)=C1S[C@H](Cc2ccccc2Cl)C(=O)N1c1ccc(C)cc1 2293039298 ZSSVYGAVFFLVSW-LJQANCHMSA-N 426.925 4.638 50 10 IJGE Cc1ccc2nc(C(C#N)=Cc3cc(Cl)c(OCC(=O)O)c(Br)c3)[nH]c2c1 2294284572 GHDNLFWRSSNNLJ-UHFFFAOYSA-N 446.688 4.815 50 10 IJGE COc1ccc(C(=O)Oc2cc(C=C(C#N)C(=O)Nc3ccccc3C)ccc2OC)cc1 2295459692 NVODYUNDOSTTKE-UHFFFAOYSA-N 442.471 4.777 50 10 IJGE CC1(C)CN(Cc2cc(I)ccc2Cl)[C@@H]1CBr 2307315048 CQOPNRGPWQVBRG-GFCCVEGCSA-N 428.539 4.550 50 10 IJGE C[C@@H]1C[C@H]1N(CCBr)Cc1cc(I)ccc1Cl 2307332300 MUSJHQWVGCNGHL-NOZJJQNGSA-N 428.539 4.550 50 10 IJGE CCCOc1ccccc1C=C(C#N)C(=O)Nc1sc(C(C)=O)c(C)c1C(=O)OCC 2314774169 WKCQCPMSQXSGHM-UHFFFAOYSA-N 440.521 4.770 50 10 IJGE C[C@]1(CCl)CCCN(Cc2ccc(I)c(Br)c2)C1 2325208105 TZMQHDXBSHJOBW-CQSZACIVSA-N 442.566 4.895 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2CC[C@H]1[C@H](Br)C2 2325465264 GFQWKVCAXVDOKB-FZZIBODNSA-N 438.001 4.959 50 10 IJGE Cc1ccc(-c2csc(C(C#N)=C(O)CCN3C(=O)c4ccccc4C3=O)n2)c(C)c1 2331309033 PEGWZNPADINFNB-UHFFFAOYSA-N 429.501 4.906 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H](NC(=O)OC(C)(C)C)[C@H](C(F)(F)F)C2)C1 2345012090 YJTQBFBHYZKAST-OLZOCXBDSA-N 443.348 4.575 50 10 IJGE Cc1scc(C(=O)N2C[C@@]3(F)CCC[C@@]3(CBr)C2)c1Br 2369603207 KCKZWMIFAIJMIN-KGLIPLIRSA-N 425.161 4.548 50 10 IJGE Clc1nccc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)c1CBr 2370824611 LCKOKICTIHSVCQ-MDNKFWRPSA-N 446.820 4.977 50 10 IJGE CC(C)COc1cccc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)c1 10280317 MGUAHRWQSQWVTN-UHFFFAOYSA-N 439.339 4.648 50 10 IJGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CCCc1nc2ccccc2s1 12689070 OIFIDQGBYZLDJS-UHFFFAOYSA-N 436.562 4.512 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)COc3ccccc3)ccc2[C@@H]1c1ccccc1Cl 38650980 KCPMHKGAAFHOPR-QHCPKHFHSA-N 432.863 4.543 50 10 IJGE COc1ccc([C@H](Br)c2csc(I)c2)c(OC)c1 124412416 CWPDCDZVKNWAMJ-CYBMUJFWSA-N 439.112 4.854 50 10 IJGE Nc1c(Cl)c(Cl)nc(C(=O)N/N=C/c2ccccc2COc2ccccc2)c1Cl 169928017 MTIGIRDOCYRDLY-KIBLKLHPSA-N 449.725 4.967 50 10 IJGE O=C(N[C@@H]1CCC[C@@H]1CBr)c1cc(Br)sc1Br 231543420 BXPOXWDCXFDWLN-HTRCEHHLSA-N 446.002 4.567 50 10 IJGE Cc1ccc(C(=O)OCC(=O)N(N=Cc2ccccc2)c2cccc(C(F)(F)F)c2)o1 254749333 PIGSONRWPZXYEG-UHFFFAOYSA-N 430.382 4.831 50 10 IJGE O=C(N[C@@H]1CCC[C@@H](Br)C1)c1cc(Br)sc1Br 694585369 CPTAXKDTGFKHPI-RNFRBKRXSA-N 446.002 4.709 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1C(=O)c1ccc(Br)cc1Br 705610502 CXOXSLKCRLLTMU-WPRPVWTQSA-N 439.973 4.600 50 10 IJGE Cc1ccc(C)c(-n2c(C)cc(C=NNC(=O)C(=O)Nc3ccc(C(C)C)cc3)c2C)c1 725381820 INMFETHTSBFRTA-UHFFFAOYSA-N 430.552 4.923 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cc(C(N)=O)ccc2Cl)c(C)n1-c1ccc(F)cc1 732121550 CQBBEXVDVFWBKD-YVLHZVERSA-N 436.874 4.531 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 775993752 BHVPFJZEIAYDMV-ZDUSSCGKSA-N 439.743 4.606 50 10 IJGE CCOc1cc(C=NNC(=O)COc2ccc(Cl)cc2)ccc1OCc1ccccc1 1083939449 ZINMAWDTQWTIIE-UHFFFAOYSA-N 438.911 4.847 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)N(C)C)cc(Br)c1OCc1cccc(C)c1 1083999845 JJVFUAIZJKAQDZ-VCHYOVAHSA-N 443.341 4.730 50 10 IJGE C=C[C@@](C)(CCOC)C(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12 1540613661 CBIZOIVKBSQVBC-DEOSSOPVSA-N 437.927 4.545 50 10 IJGE CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C[C@@H](CBr)C3CC3)C2)CC1 1559992746 HMBSOFPBSHXCLK-RBUKOAKNSA-N 429.443 4.767 50 10 IJGE N#C/C(=C\c1cccc(Br)c1)C(=O)NCCc1nc(-c2ccccc2)cs1 1866131122 ZCRAFRJWRXSJTI-GZTJUZNOSA-N 438.350 4.838 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(Cc2ccccc2)C[C@]2(CBr)CC2(F)F)C1 1893489420 OKGMSRKOCXCITO-LJQANCHMSA-N 445.348 4.528 50 10 IJGE CCC(CC)(CBr)CN=[S@@](C)(=O)C1CCN(C(=O)OC(C)(C)C)CC1 2044698378 BJTNNNLPEQUMGB-VWLOTQADSA-N 439.460 4.685 50 10 IJGE COC(=O)c1sc2cc(Br)ccc2c1NC(=O)C(C#N)=Cc1ccccc1 2085278391 CQSFBUMZSYBHNU-UHFFFAOYSA-N 441.306 4.996 50 10 IJGE CC(C)[C@H](Br)C(=O)N[C@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21 2106200740 RTVVIEFLZWBVPZ-IRXDYDNUSA-N 425.367 4.947 50 10 IJGE C[C@@H]1CCC[C@@H](CNC(=O)OC(C)(C)C)N1C[C@H](CBr)c1ccccc1 2106782413 QGGFAAGNVPNUHS-NEWSRXKRSA-N 425.411 4.933 50 10 IJGE C[C@H](CCBr)CCN1C[C@@H](NC(=O)OC(C)(C)C)[C@@H](c2ccccc2)C1 2106786177 STLZHRWOFRZHEM-BHIYHBOVSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@H](CBr)CC2CC2)CC[C@H]1C(F)(F)F 2112873945 HWGVUXATFBZRKL-RRFJBIMHSA-N 443.348 4.575 50 10 IJGE CC(C)(CCl)[C@H]1CCCN1C(=O)c1ccc(I)c(Cl)c1 2155828707 IGYXPTPPOAGPTE-CYBMUJFWSA-N 426.125 4.814 50 10 IJGE CCC(CC)(CBr)CN1CCCC[C@H]1[C@@H]1CCCN(C(=O)C(F)(F)F)C1 2163062437 LITMYFPEPKKKIN-CVEARBPZSA-N 441.376 4.843 50 10 IJGE COCc1cc(Br)c([C@@H](Br)[C@H]2C[C@H](OC)[C@H](OC)C2)s1 2174889807 VMULKBAXOGEDML-KNDHEWATSA-N 428.186 4.533 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@@H](Cl)c2ccc(Br)cc2Br)C1 2203682412 HRKXWPFYRPOADW-QCZZGDTMSA-N 442.600 4.706 50 10 IJGE C[C@@H]1CCCN(CCCCI)[C@H]1CCCNC(=O)OC(C)(C)C 2243585947 IZBURZGFRDVWPO-CVEARBPZSA-N 438.394 4.607 50 10 IJGE CCCO[C@@H]1[C@@H](Br)C[C@H]1Oc1cc(I)ccc1Cl 2259921232 OHKRVWQKOJCBFU-ZWKOPEQDSA-N 445.522 4.654 50 10 IJGE C[C@H]1CCCN(CC2(CBr)CC(F)C2)[C@H]1CCCNC(=O)OC(C)(C)C 2265638703 NPVOZFIWSOMYTQ-HMFCVHIJSA-N 435.422 4.905 50 10 IJGE C[C@@H]1OCC[C@@]1(CBr)Cc1ccc(Cl)c(I)c1 2300242379 JVBHTJSWJRSGKM-ZANVPECISA-N 429.523 4.677 50 10 IJGE Clc1ccc(I)cc1CN[C@@H](CCBr)C1CC1 2307328342 LSINOKQCNYXRAA-ZDUSSCGKSA-N 428.539 4.598 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(C)C[C@H]2CC[C@H]1C[C@]21CC[C@](C)(CI)O1 2307494024 AJJVEBQKRHMUPP-RMIBSVFLSA-N 449.373 4.833 50 10 IJGE COCCOc1ccc([C@@H](Br)[C@@H]2C[C@H]2Br)cc1Br 2311266261 ALBVFINHVCAWDX-GIPNMCIBSA-N 442.973 4.694 50 10 IJGE CCCOc1ccc(C=C2C(=O)N(Cc3ccccc3)C(=O)C(C#N)=C2C)cc1OCC 2314617952 DPJBLJICCQZSHZ-UHFFFAOYSA-N 430.504 4.667 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)[C@@H](CBr)CC1CC1 2315548733 KDPVEEJJWUXGQA-GFCCVEGCSA-N 442.566 4.940 50 10 IJGE CCOc1c(Cl)cc(C=NNC(=O)c2nn(-c3ccccc3)c3c2CCC3)cc1Cl 2318418194 SPBABYIVSJFULR-UHFFFAOYSA-N 443.334 4.830 50 10 IJGE CC1(C)[C@@H](CBr)CCN1Cc1ccc(Cl)cc1I 2318556786 DRGPISLCJPHSSK-LLVKDONJSA-N 442.566 4.940 50 10 IJGE COc1cc(C=NNC(=O)c2cc3ccccc3n2C)cc(Br)c1OC(C)C 2323739158 OUJNPJBUKFVETF-UHFFFAOYSA-N 444.329 4.501 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)C(C#N)=CNc1cc(OC)c(Cl)cc1OC 2325075935 OMAOOAIWPRRANU-OAHLLOKOSA-N 443.931 4.761 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)C)cc2)cc1 14040292 ZGQCCMUYIYONSW-IBGZPJMESA-N 426.557 4.998 50 10 IJGE CCCOc1ccc(/C=N/NC(=O)COc2ccc(CCC)cc2Br)cc1 40960033 MUXRJMSSGVYDKH-OEAKJJBVSA-N 433.346 4.720 50 10 IJGE N#C/C(=C/c1ccccc1OCc1ccc(Br)cc1)C(=O)NCc1ccco1 96545246 FSIAJBNMBRTOMH-PDGQHHTCSA-N 437.293 4.844 50 10 IJGE C[C@H](Br)c1ccccc1NS(=O)(=O)c1ccc(Br)s1 136603983 MPLYCLDPGWZVPX-QMMMGPOBSA-N 425.167 4.767 50 10 IJGE Cc1cccc([C@@H](Br)c2ccc3c(c2)CC(=O)N3)c1I 235994198 JSLDTKLRXBQUER-HNNXBMFYSA-N 442.094 4.579 50 10 IJGE O=C(NN=Cc1c(O)ccc2ccccc12)c1cccc(NC(=O)c2ccc(F)cc2)c1 254312790 RNVKBHQZJZRXOX-UHFFFAOYSA-N 427.435 4.701 50 10 IJGE CC[C@@H](Br)CCCNC(=O)c1ccc(Br)cc1Br 398526384 ABFHDNDMOQVKLN-SECBINFHSA-N 441.989 4.895 50 10 IJGE CC(C)(C)S(=O)(=O)CCC[C@@H](CBr)c1ccc(Br)cc1 718766882 WNBFUAIYYMWLRV-ZDUSSCGKSA-N 426.214 4.921 50 10 IJGE O=C(NNc1cccc(F)c1F)[C@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1 743720883 DHDAWEHLGJZNDB-YADARESESA-N 435.474 4.588 50 10 IJGE C=CCN(CCOC)C(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1525143485 AUZZHTJZFVGNKC-UYRXBGFRSA-N 431.458 4.681 50 10 IJGE Cc1ccc(-c2nc(C)c(C(=O)NNc3nc(-c4ccccn4)nc(C)c3C)s2)c(F)c1 1610902860 HLNYLIFXGJBOQE-UHFFFAOYSA-N 448.527 4.792 50 10 IJGE Cc1ccc([N+](=O)[O-])cc1[C@@H]1CN(C(=O)OCc2ccccc2)C[C@H]1CBr 1614639739 TVRWHKOEACMCCP-VQIMIIECSA-N 433.302 4.650 50 10 IJGE O=[N+]([O-])c1ccccc1-n1nc(-c2ccc(I)cc2)cc1CCl 1614816882 BFNPWXATOXWMSF-UHFFFAOYSA-N 439.640 4.791 50 10 IJGE CCOC(=O)c1c(NC(=O)NN=Cc2ccc(C(C)(C)C)cc2)sc(C(C)=O)c1C 1772753121 DVWQAZDNEMUVTD-UHFFFAOYSA-N 429.542 4.889 50 10 IJGE CCC[C@@H](NC(=O)c1nc(C(C)(C)C)n2ccccc12)C(=O)Nc1ccc(SC#N)cc1 1866874630 DSLMNZFFDVJFTG-GOSISDBHSA-N 449.580 4.742 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1c(Cl)cccc1Br 1882086205 ZQFUGZSYPHYUQG-VIFPVBQESA-N 427.564 4.933 50 10 IJGE CC(C)(CCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)cc1Br 1915765802 PNZIVCUCHSFBQU-UHFFFAOYSA-N 434.758 4.797 50 10 IJGE Clc1cc2c(cc1[C@@H](Br)c1csnc1Br)OCCO2 1925250229 IMSKIKNGRUBOQV-LLVKDONJSA-N 425.529 4.815 50 10 IJGE C[C@@H]1CO[C@](CBr)(Cc2ccc(Br)cc2Br)C1 1943840876 DUMBPKKZVPEOJK-ZANVPECISA-N 426.974 4.944 50 10 IJGE Cc1ccc(Br)c(C(=O)N(CCCBr)Cc2ccccc2)n1 1961084290 WETYOJDRQKUSIT-UHFFFAOYSA-N 426.152 4.580 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@H]2CCCC23CC3)CC1 1986118785 MUOIWHJMEGSVQR-AWEZNQCLSA-N 435.346 4.540 50 10 IJGE CCN(C[C@](C)(CI)OCCC1(F)CCC1)C(=O)OC(C)(C)C 1994682718 ZFTURUHRGCGVHN-INIZCTEOSA-N 443.341 4.736 50 10 IJGE CCC(CC)N(CCCl)c1ncc(I)cc1Br 2015758149 ZLNQVVCYLJXOAP-UHFFFAOYSA-N 431.543 4.683 50 10 IJGE Clc1cc(C[C@H]2CCOCC[C@H]2Br)ccc1I 2026571283 YUQYUVSWUWHYIS-GHMZBOCLSA-N 429.523 4.677 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN(C[C@@H](CBr)CC2CC2)C1 2112870047 ZGLHYTBCQUCLKP-GUDVDZBRSA-N 429.443 4.909 50 10 IJGE CCN(CC)CCCO[C@H](CI)c1cccc(Br)c1 2119263924 MBEFVJOGKYVGGP-OAHLLOKOSA-N 440.163 4.674 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Cl)C2 2134124758 NSXXKTSYBRKJCV-LHGNLISDSA-N 431.552 4.596 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@@H](Cl)c2cc(Br)c(Br)s2)C1 2137228868 QKXJNNFMNWUTHX-JWYUURKGSA-N 448.629 4.768 50 10 IJGE CC[C@@H](Cl)[C@@H]1CCCCN1C(=O)c1cc(Cl)ccc1I 2170620507 ZEYJALZJRJKDSP-OCCSQVGLSA-N 426.125 4.957 50 10 IJGE CCCC(CBr)(CCC)CN1[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]1COC2 2204525788 NEVXMBGBCNOLBG-ROUUACIJSA-N 447.458 4.678 50 10 IJGE F[C@@H]1C[C@@H](Br)CN(Cc2c(Br)cccc2Br)C1 2213904188 QVEMLNSWHXBWKD-RKDXNWHRSA-N 429.953 4.519 50 10 IJGE Cc1ccc([C@H](Br)c2ccc3c(c2)CC(=O)N3)cc1I 2232834058 QWBXFBSGIZDWIC-MRXNPFEDSA-N 442.094 4.579 50 10 IJGE COc1ccc([C@@H](Br)C[C@H]2C[C@@H](OC)C2)cc1I 2257371069 WSSHFTNTQWIODN-WCQGTBRESA-N 425.104 4.551 50 10 IJGE COc1ccc([C@H](Br)c2nn(C)cc2Cl)c(Br)c1Cl 2268268661 SUMLYVFBMPLQDW-JTQLQIEISA-N 428.939 4.982 50 10 IJGE O=C(N[C@@]1(CCl)C[C@H]2CC[C@H]1C2)c1cc(Br)sc1Br 2268624633 BPJKGPSIENXBHT-UVPNAGLESA-N 427.589 4.801 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1CCCl)c1ccc(Cl)c(I)c1 2283653814 KFIHRQHVXBSGPM-YGRLFVJLSA-N 426.125 4.862 50 10 IJGE CC(C)(CI)CN1CC[C@H](NC(=O)OC(C)(C)C)c2ccccc21 2306819542 VRWYEUDVWYAHTQ-HNNXBMFYSA-N 444.357 4.924 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@H](Br)[C@H]2CC3)cc1I 2315548984 MWVNVKOVWUMCCD-COPLHBTASA-N 440.550 4.835 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)cc2I)CC[C@@H]1CBr 2318556793 DTBJFJGMSLVYCP-WDEREUQCSA-N 442.566 4.798 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cc(F)c(F)cc1Cl 2320362919 ZGZHPKUFKFMVAW-CYBMUJFWSA-N 432.692 4.718 50 10 IJGE CN1CCc2nc(NC=C(C#N)C(=O)NC3CCCCCCCCCCC3)sc2C1 2325480218 QDRWXKRMZXANIF-UHFFFAOYSA-N 429.634 4.740 50 10 IJGE COc1c(Br)cc(C)c([C@H](Cl)[C@@H]2OCCO[C@H]2C)c1Br 2365176954 VFGIHRPNCXTFSB-AQUOVQTQSA-N 428.548 4.612 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1CCCl)c1ccc(Cl)cc1I 2365594392 ZTHHENDPKPBMLB-HZMBPMFUSA-N 426.125 4.862 50 10 IJGE Cc1c(C(=O)N2CCCCCC2)oc2c1/C(=N/NC(=O)c1ccc(Cl)cc1)CCC2 40811653 GPILQGZYVBNGPS-XIEYBQDHSA-N 427.932 4.728 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(O)cc2)CCC3)c(C)c1 40812014 UETFELWAGCXLOC-NHFJDJAPSA-N 431.492 4.633 50 10 IJGE N#C/C(=C\c1ccccc1OCc1ccc(Br)cc1)C(=O)NC1CCCC1 59224882 YFGQAFJTOGJQFD-QGOAFFKASA-N 425.326 4.994 50 10 IJGE CC1=C(C#N)C(=O)N([C@@H](C)c2ccccc2)C(=O)/C1=C/Nc1ccccc1C(F)(F)F 101233454 YZMSEWFRFOYOHJ-VUODPORTSA-N 425.410 4.971 50 10 IJGE CC(=O)c1cc2c(cc1N/C=C(/C#N)c1nc(-c3ccc([N+](=O)[O-])cc3)cs1)OCO2 102422092 ZDIXYMLJAGFZAB-ZROIWOOFSA-N 434.433 4.626 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Br)c3cc4c(s3)CCC4)cc2[nH]1 109884145 VJFXEGFBQBNBKQ-AWEZNQCLSA-N 428.149 4.653 50 10 IJGE CCCOc1c(Cl)cc(/C=N/NC(=O)Cc2cc(OC)ccc2Cl)cc1OCC 169922046 VARXAZPRXWRCHN-ZMOGYAJESA-N 439.339 4.882 50 10 IJGE O=C(NC[C@H]1CC[C@@H](Br)C1)c1cc(Br)c(Br)s1 227667769 LFMPBAQMCLFNSU-NKWVEPMBSA-N 446.002 4.567 50 10 IJGE O=C(NC[C@@H]1CC[C@H](Br)C1)c1cc(Br)cc(Br)c1 227678403 KCXUKOODNNSTRL-SCZZXKLOSA-N 439.973 4.505 50 10 IJGE CC(C)COCCO[C@@H](CI)c1ccccc1Br 232675771 AQHHNZIVWPSODH-AWEZNQCLSA-N 427.120 4.614 50 10 IJGE O=C(NN=Cc1ccc(OC(F)(F)F)cc1)c1cnn(-c2ccccc2)c1C(F)(F)F 254741722 KHDYKWQNOFDNPN-UHFFFAOYSA-N 442.319 4.554 50 10 IJGE BrCC(CBr)(C[C@@H]1CCOC1)c1cccc(Br)c1 400528668 GUUNVRHFNJZKAQ-NSHDSACASA-N 441.001 4.903 50 10 IJGE CC[C@@H](C[C@H](C)Br)NC(=O)c1cc(Br)ccc1Br 716936362 FUVMWKNILQOHNI-WPRPVWTQSA-N 441.989 4.894 50 10 IJGE Cc1ccc([N+](=O)[O-])cc1[C@H]1CN(Cc2ccccc2)C[C@H]1CI 725379749 JNVWRXKGYWAYJR-APWZRJJASA-N 436.293 4.554 50 10 IJGE COc1ccccc1Oc1ccc(NC(=O)NNC(=O)c2cccc3cccnc23)cc1 755571209 SNAKKXQMJFFEMS-UHFFFAOYSA-N 428.448 4.502 50 10 IJGE CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)[C@H](Br)C(C)(C)C 767958270 DFDODLQRNYGIIW-HNNXBMFYSA-N 437.300 4.691 50 10 IJGE CC[C@H](Cc1ccccc1Br)C(=O)NNc1nc2ccccc2[nH]c1=S 1167430335 BVFCFSZTNFMYDU-GFCCVEGCSA-N 431.359 4.767 50 10 IJGE Cc1occc1C(=O)NN=C1CCCc2oc(C(=O)N3c4ccccc4C[C@@H]3C)c(C)c21 1772750111 XSFFNWMOQYPADY-AWEZNQCLSA-N 431.492 4.551 50 10 IJGE CCc1nn(-c2ccc(C)cc2)c2c1[C@@H](c1ccc(OC(C)C)c(OC)c1)C(C#N)=C(N)O2 1865696757 KBMXGCKQTHHOEL-QHCPKHFHSA-N 444.535 4.757 50 10 IJGE Cc1ccc(-c2csc(/C(C#N)=C(\O)[C@@H](C)N3C(=O)c4ccccc4C3=O)n2)c(C)c1 1872748875 QQUCOSAEGFLJPN-DSGGYQJVSA-N 429.501 4.904 50 10 IJGE CCC[C@@H](CCNC(=O)OC(C)(C)C)CCC(=O)N(C)CC1CC(Br)C1 1887830557 ZGKIKPHXZLHQJE-KLAILNCOSA-N 433.431 4.730 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)c1ccccc1S(=O)(=O)C(F)(F)F 1914650999 KYXMLQMAHXPGTH-CYBMUJFWSA-N 436.293 4.770 50 10 IJGE O=C(NCC1CCC(CCl)CC1)c1ccc(I)c(Cl)c1 1922694562 CRAOSSUWKIYYRB-UHFFFAOYSA-N 426.125 4.720 50 10 IJGE CC[C@H](Br)[C@@H](C)NC(=O)c1csc(Br)c1Br 1937737075 CNRDBQISZANWLA-VDTYLAMSSA-N 433.991 4.565 50 10 IJGE Cc1sc([C@H](Br)c2cc(Br)n(C)n2)cc1Br 1937822146 UJJVTZLKGUOJRA-SNVBAGLBSA-N 428.975 4.799 50 10 IJGE C[C@H](CCBr)CCNC(=O)c1csc(Br)c1Br 1945187371 VMODJORWUZEHJR-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE C[C@H]1CCN(Cc2ccc(I)c(Cl)c2)C[C@H]1Br 2026560970 OHSXJHICNRKRES-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE CC(C)[C@H](Br)[C@H](C)NC(=O)c1cc(Br)ccc1Br 2041309124 XTEDTRGZVKUGEN-UFBFGSQYSA-N 441.989 4.749 50 10 IJGE Cc1ccnc(-n2nc(CCl)c(I)c2C(F)(F)F)c1C1CC1 2078881547 ZFDNNWGHMPDZJU-UHFFFAOYSA-N 441.622 4.815 50 10 IJGE CS(=O)(=O)c1csc([C@H](Br)c2cc(Br)ccc2F)c1 2093073432 BLGHDVRVDBNPIK-GFCCVEGCSA-N 428.142 4.538 50 10 IJGE Brc1ccccc1[C@@H](CI)OC[C@H]1CCCCCO1 2096321535 FMIGFOHUSVWALX-IUODEOHRSA-N 439.131 4.901 50 10 IJGE C[C@@H]1CN(C[C@H](CBr)c2ccccc2)C(C)(C)CN1C(=O)OC(C)(C)C 2106786371 USIJPYPNWIVTKT-AEFFLSMTSA-N 425.411 4.885 50 10 IJGE O=C(c1cccc(C(F)(F)F)n1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 2116171291 WPVXSXONNBQYPP-INIZCTEOSA-N 427.264 4.916 50 10 IJGE CCn1ncc(Br)c1COc1c(F)cc(Br)cc1CCl 2150695985 UZQOWOZNZUTCQT-UHFFFAOYSA-N 426.511 4.885 50 10 IJGE Cc1csc(C(=O)NC[C@@]2(CBr)C[C@@H]2C(F)(F)F)c1Br 2192583146 BLHMVNOUWBUIRA-CPCISQLKSA-N 435.103 4.512 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2[C@]12C[C@H]1CN(Cc1ccccc1)C2 2202302269 YDQGLZKXJFWAPY-BTYIYWSLSA-N 446.776 4.777 50 10 IJGE Fc1ccc([C@@H](Br)c2cc(I)sn2)c(F)c1F 2213678986 RWUQLRPAGZKCCQ-MRVPVSSYSA-N 434.018 4.649 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C1CC([C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1 2241364338 HJQHTFNQOUHWOX-LMPOIIKSSA-N 447.414 4.558 50 10 IJGE C[C@@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)CC1(CBr)CC1 2251569664 DXGQJTZFTMUYDS-HNNXBMFYSA-N 428.417 4.816 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CC2(CBr)CC(F)C2)C2(CCCCC2)C1 2265632575 NZOLTJIBLBMHME-WUJZJPHMSA-N 433.406 4.802 50 10 IJGE Cc1cc(F)c(CBr)c(N2CC[C@H]3OCCN(Cc4ccccc4)[C@H]3C2)c1 2283531291 JQFNTUHXFIVVCF-FCHUYYIVSA-N 433.365 4.509 50 10 IJGE O=C(NCC1CCC(Br)CC1)c1cc(Br)c(F)cc1Cl 2285844164 JIYOQCRFEWHKDU-UHFFFAOYSA-N 427.539 4.925 50 10 IJGE CC[C@](C)(CCCl)NCc1ccc(I)c(Br)c1 2306232840 ZJEDVJRXRCROTG-CYBMUJFWSA-N 430.555 4.941 50 10 IJGE ClC[C@]12C[C@@H]1CC[C@H]2NCc1ccc(I)c(Br)c1 2325209032 KVRNKEGNJZKJAN-ZLKJLUDKSA-N 440.550 4.551 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)C(C#N)=CNc1ccc(N(CC)CC)cc1 2325309723 BTFHBZYNBNRLPY-UHFFFAOYSA-N 434.540 4.948 50 10 IJGE CC1CC(CBr)(N(C)Cc2cc(I)ccc2Cl)C1 2327389486 MPTUVMMZHDPRDA-UHFFFAOYSA-N 442.566 4.940 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(Cc2cc(I)ccc2Cl)[C@H]1C 2327409348 NFPYAWOBPGXGAV-KWBADKCTSA-N 442.566 4.938 50 10 IJGE O=C(N/N=C/c1ccc(OC(F)(F)F)cc1)c1cnn(-c2ccccc2)c1C(F)(F)F 1881175 KHDYKWQNOFDNPN-NSKAYECMSA-N 442.319 4.554 50 10 IJGE CCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C/c2ccc(C(C)C)cc2)c(OC)c1 6360080 YNEJDKDGXGDGPF-TWSKGESGSA-N 432.520 4.871 50 10 IJGE Cc1nn(-c2ccccc2)c2sc(C(=O)NN=C3CCN(Cc4ccccc4)CC3)cc12 12563923 YQHSMEREXHUEDQ-UHFFFAOYSA-N 443.576 4.777 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc(C)cc2)cc([N+](=O)[O-])c1OCc1ccccc1C 169885814 RIOSOISVYNDKEX-QFEZKATASA-N 433.464 4.563 50 10 IJGE COc1cc(/C=N\NC(=O)c2cccc(N)c2)ccc1OCc1ccc(Cl)cc1Cl 169894093 UKXVFOZKBWEFBO-ZRGSRPPYSA-N 444.318 4.927 50 10 IJGE CCCCCN1C(=O)C(C#N)=C(C)/C(=C/Nc2ccccc2C(=O)c2ccccc2)C1=O 209909202 CQQGLRRXVCJLQW-XLNRJJMWSA-N 427.504 4.612 50 10 IJGE Cc1ccc(-c2ccccc2)n1-c1ccc(C(=O)NN=Cc2cccc([N+](=O)[O-])c2O)cc1 254813424 LZUXFQLWNFBWGJ-UHFFFAOYSA-N 440.459 4.830 50 10 IJGE Cc1nn(-c2ccccc2)c(C)c1C=NNC(=O)c1n[nH]c2c1C[C@H](CC(C)(C)C)CC2 254860922 WIMNZWGOHQQGFP-GOSISDBHSA-N 432.572 4.517 50 10 IJGE COc1ccc(CNC(=O)c2cccc(NC(=O)Nc3ccc(SC#N)cc3)c2)cc1 586699914 CIMVMZSKEVIVJE-UHFFFAOYSA-N 432.505 4.842 50 10 IJGE CC[C@@H](C[C@H](C)Cl)NC(=O)c1ccc(I)c(Br)c1 721601915 IOKXWJJQTXSYCZ-WPRPVWTQSA-N 444.538 4.580 50 10 IJGE O=C(CCCC[C@H]1CCSS1)NNC(=O)c1ccccc1OCc1ccc(F)cc1 725933365 PRSVLRALYFPWBM-SFHVURJKSA-N 448.585 4.880 50 10 IJGE Cc1ccncc1[C@@H](C)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 771378795 BZRFFQGDBDTXEB-UEXNTNOUSA-N 444.926 4.605 50 10 IJGE Cc1cc(C)cc(CSCC(=O)NN=Cc2ccc(OC(=O)c3ccccc3)cc2)c1 1084216132 BQKSKRHVVFZNFT-UHFFFAOYSA-N 432.545 4.906 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2cc3c(nc2O)CCCC3)c(C)n1-c1ccc(F)cc1 1538250365 WNZKOUOJMOLBJE-XDHOZWIPSA-N 430.483 4.758 50 10 IJGE O=C(COc1cccc(Br)c1)NN=Cc1ccccc1OCc1ccccc1 1772753719 FAGGZRSOOLSKLG-UHFFFAOYSA-N 439.309 4.557 50 10 IJGE C[C@H](Br)C(=O)c1c(I)cccc1SC(F)(F)F 1848425904 PLFUOJGCBJJQAV-YFKPBYRVSA-N 439.034 4.869 50 10 IJGE Cc1nn(-c2cccc3ccccc23)c2c1[C@@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689601 UCYIVHCASDJXIP-QFIPXVFZSA-N 428.879 4.911 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(CCC)nn3-c2ccc(OC)cc2)c1 1865693506 KDLRDYOBENBPPR-HSZRJFAPSA-N 444.535 4.840 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C(C)(C)C(=O)NC[C@H]2C[C@H](Br)C2)cc1 1887783601 HCLBXGKAZCQBIF-CTYIDZIISA-N 425.367 4.601 50 10 IJGE CCCCOCCOCCOCCN(Cc1ccccc1)[C@@H](CBr)C1CC1 1915143517 PBXOWZPMQFZLIT-QFIPXVFZSA-N 442.438 4.512 50 10 IJGE Cc1c(Br)sc([C@H](Cl)C2CCS(=O)(=O)CC2)c1Br 1922912519 OCPICXWZZFPXHK-SECBINFHSA-N 436.618 4.686 50 10 IJGE O=S1(=O)CCC[C@H]1[C@H](Br)c1c(Cl)sc(Br)c1Cl 1925619144 YDUFVKMGFHJSPW-NJGYIYPDSA-N 443.009 4.831 50 10 IJGE CC(CBr)(CBr)NC(=O)c1cscc1OCc1ccccc1 1934836859 YHPOSEVNRASQTN-UHFFFAOYSA-N 447.192 4.605 50 10 IJGE C[C@H]1CCN(Cc2cccc(Br)c2Br)[C@@H]1CBr 1943882391 VQKKCWFYRIBITM-JOYOIKCWSA-N 425.990 4.817 50 10 IJGE CC[C@H](C[C@@H](C)Br)NC(=O)c1csc(Br)c1Br 1945183661 KUHZQTGOBLLJSX-RNFRBKRXSA-N 448.018 4.955 50 10 IJGE CC1(C)[C@H](Br)CCN1C(=O)c1csc(Br)c1Br 1945189710 YCRHYPZSIWHMMQ-SSDOTTSWSA-N 446.002 4.661 50 10 IJGE C[C@H]1CN(C[C@@H](CBr)C(C)(C)C)C[C@@H](C)N1C(=O)OCc1ccccc1 1977953052 SSJSABSWMOSKLH-ZIFCJYIRSA-N 425.411 4.775 50 10 IJGE CC1(C)[C@@H](Nc2ncc(I)cc2Br)CC[C@H]1Cl 2026157990 WOYFDOSYXCMOAD-ZJUUUORDSA-N 429.527 4.657 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2C[C@H](Br)C[C@H]1C2 2033094991 RSMDKCFHBFZNQF-GARJFASQSA-N 438.001 4.959 50 10 IJGE C[C@@H](C[C@@H](Br)c1cc(I)cc2c1OCC2)C(F)F 2036589979 CWPYRQSEFHZLDJ-WRWORJQWSA-N 431.058 4.953 50 10 IJGE COc1cc(C=CC(=O)NNc2c(Cl)cc(Cl)cc2Cl)ccc1OCC#N 2040437092 JAHIRDDUMCVKKT-UHFFFAOYSA-N 426.687 4.714 50 10 IJGE Oc1nc2cc([C@@H](Br)[C@H]3C[C@@H](Br)C3)c(Br)cc2[nH]1 2076182530 SWRYNLQBSYOWIN-CPZGKSPBSA-N 438.945 4.641 50 10 IJGE Cc1cc(Cn2nc(CBr)c(Br)c2C(F)(F)F)cc(C)c1O 2079229085 DLQKMAPQSUWRGW-UHFFFAOYSA-N 442.073 4.930 50 10 IJGE Clc1cc(CN2CCC(CCBr)CC2)ccc1I 2086650824 CTJQDGAPHMWLGK-UHFFFAOYSA-N 442.566 4.942 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@@H]2CCCCN(CC3(CBr)CCCC3)C2)C1 2106784701 KLUAGXGKNHBPKE-QGZVFWFLSA-N 429.443 4.911 50 10 IJGE C[C@H]1CC[C@@H](CNC(=O)C(F)(F)F)N(CCCCCCCCCBr)C1 2106786346 UOHIGLFCZVJLFG-HOTGVXAUSA-N 429.365 4.891 50 10 IJGE COc1ccc(Cl)cc1[C@@H](Br)c1nn(C)c(Cl)c1Br 2110720056 ALPREQCAGCTJJZ-SECBINFHSA-N 428.939 4.982 50 10 IJGE CCN(CC)CCCO[C@@H](CI)c1ccccc1Br 2119264408 PULLTTAWOOMGEM-HNNXBMFYSA-N 440.163 4.674 50 10 IJGE Brc1ccc([C@H](CI)OC[C@H]2C3C[C@@H]4C2[C@@H]4C3)cc1 2134517751 KAVAGYWYUXTZBU-LVNJGXIJSA-N 433.127 4.844 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1CCCl)c1cc(Cl)ccc1I 2146741697 YRKGRONGEKOKKE-QMTHXVAHSA-N 426.125 4.862 50 10 IJGE CCN(CC)CCN(Cc1ccccc1)S(=O)(=O)c1ccc(CCl)c(Cl)c1 2152215360 RUBVURDYOLAFOM-UHFFFAOYSA-N 429.413 4.612 50 10 IJGE Cc1sc(Br)cc1C(=O)NC[C@]1(CBr)C[C@H]1C(F)(F)F 2192585899 IYZOOCJAPBEFIE-LDYMZIIASA-N 435.103 4.512 50 10 IJGE CCc1cc(Br)c([C@H](Br)[C@@]23CCC[C@@H]2CS(=O)(=O)C3)s1 2201878809 MOIRTONFJHDVJC-BIGNPOOSSA-N 442.238 4.724 50 10 IJGE CS(=O)(=O)C[C@@H](Br)c1c(Br)cc(Cl)c(Cl)c1Cl 2212843020 BBUDCTQOGHRODW-RXMQYKEDSA-N 445.387 4.890 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CCCCCCBr)C[C@H]1C(F)(F)F 2223283105 PAKRGWKXINRPSS-UONOGXRCSA-N 431.337 4.577 50 10 IJGE Cc1cc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)cc(CBr)n1 2272810769 KSZTYJVTEAXGOA-SFHVURJKSA-N 428.296 4.538 50 10 IJGE O=S1(=O)CCC([C@@H](Br)c2cc3sc(Br)cc3s2)CC1 2278112000 NBKFESAZTFXBEX-GFCCVEGCSA-N 444.235 4.986 50 10 IJGE COC(=O)c1ccccc1NC(=O)C(C#N)=Cc1ccc(OC(=O)c2ccc(C)cc2)cc1 2293034605 BDFMMGRBQXQDRX-UHFFFAOYSA-N 440.455 4.547 50 10 IJGE C[C@H]1C[C@@H](Br)CN(Cc2cc(I)ccc2Cl)C1 2307327522 BMSZJBVUOPFBMT-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE Cc1cccc(N2CCN(C=C(C#N)C(=O)Nc3ccc(Oc4ccccc4)cc3)CC2)c1 2325141417 RGERJBCTAGAWCA-UHFFFAOYSA-N 438.531 4.956 50 10 IJGE Clc1ccc(I)cc1CN1[C@H]2CC[C@H]1[C@@H](CBr)C2 2327389776 NUCABRUPJXPCES-LQJRIPTKSA-N 440.550 4.692 50 10 IJGE Cn1nc(C(F)(F)F)c(CBr)c1N1CCC[C@H](OCc2ccccc2)C1 2339704633 CTYDKMZFUCTVNK-AWEZNQCLSA-N 432.284 4.519 50 10 IJGE Cc1nc(Br)c([C@@H](Cl)c2c(F)cc(F)c(Br)c2F)n1C 2362444999 TVHGQPGEULPSJX-VIFPVBQESA-N 432.465 4.999 50 10 IJGE N#CC1=C2N=C(N)c3ccccc3N2C2=C(C(=O)C[C@@H](c3ccccc3)C2)[C@@H]1c1cccnc1 9590746 GLSSQZYFICLYKJ-UQBPGWFLSA-N 443.510 4.540 50 10 IJGE CCOc1ccccc1NC(=O)[C@@H](NNC(=O)c1ccc(C(C)(C)C)cc1)c1ccccc1 24518217 QKSFAKQYXSTRTE-DEOSSOPVSA-N 445.563 4.997 50 10 IJGE C[C@H](Oc1ccc(F)cc1)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(F)cc1 38652828 YELBSFLTWXFIEP-PSLXWICFSA-N 448.425 4.556 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2ccc(Cl)cc2F)[C@@H](CI)C1 382682281 CKLMSHNOHAGMEP-GWCFXTLKSA-N 439.696 4.865 50 10 IJGE COc1ccc(Br)c([C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CBr)c1 382685632 ILUNRTCHHYNWNV-BXUZGUMPSA-N 449.183 4.803 50 10 IJGE CC[C@@H](Br)[C@@H](CC)NC(=O)c1scc(Br)c1Br 705438336 LSZUGILNOSKDNF-HTRCEHHLSA-N 448.018 4.955 50 10 IJGE COc1ccc(OC[C@H](CBr)c2ccccc2)cc1I 712913066 CISPPFHIRABFTI-ZDUSSCGKSA-N 447.110 4.857 50 10 IJGE Cc1cccc(-n2c(C)c(Br)c(C=NNC(=O)COc3ccccc3)c2C)c1 725399033 BJOKNPSCFLCWII-UHFFFAOYSA-N 440.341 4.694 50 10 IJGE COc1ccc2ccccc2c1C=NNC(=O)COc1ccc(Br)cc1Cl 1084276256 IDTUDPWMCUHSIS-UHFFFAOYSA-N 447.716 4.793 50 10 IJGE O=C(Cc1ccc(F)cc1)NN=Cc1ccccc1OCc1ccc(Br)cc1 1084428131 MMFCNJXVMCCWOS-UHFFFAOYSA-N 441.300 4.860 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2ccccc2OCc2ccccc2)cc1 1084528158 SRPRDUGOKFQMAX-DEOSSOPVSA-N 432.520 4.628 50 10 IJGE Cc1ccc(N(CC(=O)NN=C2CCCC[C@H]2C)S(=O)(=O)c2ccccc2)cc1Cl 1084598977 LIEVUWRKBIIYEL-QGZVFWFLSA-N 447.988 4.526 50 10 IJGE O=C(N/N=C1\O[C]2C=Cc3ccccc3C2=C[C@@H]1C(=O)Nc1ccccc1)c1ccccc1 1615016781 SAHGUMOFHCEFTJ-JVEWKGNHSA-N 434.475 4.657 50 10 IJGE Cc1nc(SC2CCCC2)sc1CC(=O)NNc1nc2ccccc2[nH]c1=S 1646017614 OSHPMHJACBOBPZ-UHFFFAOYSA-N 431.612 4.778 50 10 IJGE Cc1ccc(-c2csc(/C(C#N)=C(\O)CCCN3C(=O)c4ccccc4C3=O)n2)cc1 1872749545 WIXFOSCSCKXEPL-VZCXRCSSSA-N 429.501 4.988 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1ccc(Br)c(Cl)c1 1882086930 GFCJXEUSCWEFPC-JTQLQIEISA-N 427.564 4.933 50 10 IJGE C[C@@H](C(=O)N(C)C[C@H]1C[C@@H](Br)C1)c1ccc(NC(=O)OC(C)(C)C)cc1 1887829161 GIQDESXJXHTLPZ-FMKPAKJESA-N 425.367 4.769 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)C(=O)Cc1cccc(Br)c1 1914609238 TUOSJRYRGLJZTM-CQSZACIVSA-N 425.164 4.804 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)Cc1cccc2ccccc12 1916346628 DMDFJRPMRURTJT-NRFANRHFSA-N 426.354 4.821 50 10 IJGE Cc1cc2c(cn1)nc(CCl)n2CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 1917822216 RKJSHAKAGDMXMS-UHFFFAOYSA-N 446.982 4.950 50 10 IJGE Cc1nn(-c2cc(Cl)ccc2CBr)c(C)c1I 1945162072 LYFBGSCYJUNOME-UHFFFAOYSA-N 425.495 4.642 50 10 IJGE Clc1nc(N2C[C@H]3CCN(Cc4ccccc4)C[C@@H]3C2)sc1CBr 1949583776 LNGSJDLJSBEDSG-HUUCEWRRSA-N 426.811 4.650 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]23CCC[C@@]2(CN(C[C@H](CBr)C2CCC2)C3)C1 1966579048 JZMYTGIOWXOZES-IOMROCGXSA-N 427.427 4.521 50 10 IJGE CC(C)(C)OC(=O)N[C@H](C[S@](C)(=O)=NCCCCCBr)C(C)(C)C 1999513749 DQOZXTNMXPWTMO-SHACYNPGSA-N 427.449 4.589 50 10 IJGE C[C@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)[C@H]1C[C@@H](CBr)C1 2009644196 HZQHVJRCLCJIJM-OIISXLGYSA-N 428.417 4.815 50 10 IJGE Cl[C@@H]1CCC[C@@H]1CCNc1ncc(I)cc1Br 2015765234 NIIQVLDUDADGAB-LDYMZIIASA-N 429.527 4.658 50 10 IJGE CN(C(=O)c1cc(Br)c(Br)s1)C1(CCBr)CC1 2015865393 QWLJZYVUJPQYTO-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE O=C(NCC[C@@H](Br)C1CC1)c1c(Br)cccc1Br 2033090999 MCGWKGIBSSTENA-SECBINFHSA-N 439.973 4.505 50 10 IJGE O=C(CBr)c1ccc(C(F)(F)F)c(Br)c1OC(F)(F)F 2054797665 DNXSPLRLCZDNGR-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCN[C@@H]1CCc2c(Br)cccc21 2061265225 YCPFHJFXAYUKFS-MRXNPFEDSA-N 447.464 4.932 50 10 IJGE Brc1ccc(Br)c(CN2CC[C@@H](Br)[C@H]2C2CC2)c1 2067010480 BFCYFZQTBLJZEC-ZIAGYGMSSA-N 438.001 4.959 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)[C@H]2CCCS(=O)(=O)C2)cc1Br 2089861665 UBIZKCAFKHMJTC-ZANVPECISA-N 430.589 4.625 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(C[C@H](CBr)C(C)(C)C)C[C@H]21 2106785796 QWVPMCSNFXQLGD-ILOCAZANSA-N 429.443 4.621 50 10 IJGE CCc1nc(Br)c(Br)n1C[C@@H](C)c1nc(CCl)cs1 2109993793 CSXDBGCMPRSQBQ-SSDOTTSWSA-N 427.593 4.970 50 10 IJGE C[C@H]1[C@@H](Br)C[C@H]2CC[C@H]1N2C(=O)c1cc(Br)c(Cl)s1 2115941801 DQGZTGUNNWKZFH-PYHGXSLLSA-N 427.589 4.941 50 10 IJGE O=C(N[C@@H](CBr)CC1CCOCC1)c1ccc(OCc2ccccc2)cc1 2195481022 DDQYJUDJTCDCBQ-HXUWFJFHSA-N 432.358 4.576 50 10 IJGE F[C@@H]1C[C@@H](Br)CN(Cc2ccc(Br)cc2Br)C1 2213901138 PRGXSFMUPFEPRX-GHMZBOCLSA-N 429.953 4.519 50 10 IJGE COc1ccc([C@H](Br)c2sccc2OC)cc1I 2257367509 BKHIKTXCRJWQNW-LBPRGKRZSA-N 439.112 4.854 50 10 IJGE Cc1ccc(C[C@H]2SC(=C(C#N)C(=O)N3CCC(C)CC3)N(c3ccccc3)C2=O)cc1 2295998919 HTQCWUCIEFHFOG-HSZRJFAPSA-N 445.588 4.680 50 10 IJGE O=C(CCCSc1nc2ccc([N+](=O)[O-])cc2s1)NN=CC=Cc1ccccc1 2313587812 HFFKTEDUCDDMQT-UHFFFAOYSA-N 426.523 4.892 50 10 IJGE CC(C)NC(=O)c1cc2ccc(OC(=O)C(C#N)=Cc3ccc(C(C)C)cc3)cc2oc1=O 2314751230 XUTDLZOSJWSNQP-UHFFFAOYSA-N 444.487 4.567 50 10 IJGE Br[C@@H]1CC[C@@H]2CCN(Cc3sccc3I)C[C@H]2C1 2316764705 PICONBPJPZEKTG-IJLUTSLNSA-N 440.188 4.738 50 10 IJGE C[C@]1(CBr)CCCN(Cc2ccc(Cl)cc2I)C1 2318540253 PJWHUPLWICVAGB-CQSZACIVSA-N 442.566 4.942 50 10 IJGE COc1ccc(CC(O)=C(C#N)c2nc(-c3cc(OC)ccc3OC)cs2)c(OC)c1 2331324443 AQCLITYSSLQTCE-UHFFFAOYSA-N 438.505 4.880 50 10 IJGE O=C(N[C@@H]1C[C@@H](CBr)C12CCC2)c1scc(Br)c1Cl 2351615016 SIWUPVMKHGCGFY-IONNQARKSA-N 427.589 4.848 50 10 IJGE O=C(N[C@H]1CC[C@@H]2C[C@]12CBr)c1cc(F)c(Br)cc1Cl 2359286284 SYXAJEBDIATXIG-FDHQVAJDSA-N 425.523 4.535 50 10 IJGE CC(C)C(CBr)(CBr)CCCS(=O)(=O)c1ccccc1 2369360579 UYHCLQAJXMPPME-UHFFFAOYSA-N 426.214 4.673 50 10 IJGE Cc1cccc(C)c1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cccc(F)c1 38678045 GGQWSMQDEFFEEV-DEOSSOPVSA-N 444.462 4.645 50 10 IJGE Cc1cccc([C@H](Br)c2ccc3c(c2)CC(=O)N3)c1I 236010289 JSLDTKLRXBQUER-OAHLLOKOSA-N 442.094 4.579 50 10 IJGE Cc1ccsc1CCNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 773668404 DZRUMGHFFODGMS-QGOAFFKASA-N 449.967 4.753 50 10 IJGE Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799749080 LZUYQGAYNRROKD-UHFFFAOYSA-N 447.848 4.849 50 10 IJGE O=C(NN=C/C=C\c1ccccc1)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1 886005292 WGKLJUJAFSGPNM-CSQCQVGPSA-N 439.924 4.570 50 10 IJGE CCOc1ccc(NC(=O)CCC(=O)NN=Cc2ccc(OCc3ccccc3)cc2)cc1 1083921039 CFPLKQXWIANXMM-UHFFFAOYSA-N 445.519 4.533 50 10 IJGE Cc1ccc(NC(=O)CCC(=O)NN=Cc2cccc(OCc3ccccc3)c2)cc1C 1084163562 CALOWIUPLBRCJG-UHFFFAOYSA-N 429.520 4.751 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1Cl)C(=O)Nc1ccc(OCc2ccccc2)cc1 1084382409 BSSCSHABINQODI-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE O=C(COc1ccc(Cl)cc1Br)NN=Cc1c(Cl)cccc1Cl 1084545867 DZKBQXKEWKHKTM-UHFFFAOYSA-N 436.520 4.938 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)[C@H](Sc2ccccc2F)c2ccccc2)c1 1471691195 SISJTKKJVVJCLT-OAQYLSRUSA-N 435.549 4.658 50 10 IJGE C=C(C)C[C@@H](CO)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1633175921 VNQYSPCVQATLMK-OJEAVSNDSA-N 432.351 4.751 50 10 IJGE Cc1occc1C(=O)NN=C1CCCc2oc(C(=O)Nc3ccccc3Cl)c(C)c21 1772749530 OFNLFODQYPAOEU-UHFFFAOYSA-N 425.872 4.866 50 10 IJGE Cc1nn(Cc2cccc(F)c2)c2c1[C@@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 1865685157 DWIMJEGKSZHMRH-IBGZPJMESA-N 429.282 4.904 50 10 IJGE CCCn1nc(C(F)(F)F)c2c1OC(N)=C(C#N)[C@@H]2c1c(OC)ccc2ccccc12 1865687945 DRPLOEGHXDKMIM-QGZVFWFLSA-N 428.414 4.692 50 10 IJGE N#C/C(=C\c1ccc(Br)cc1)C(=O)Nc1c(Cl)cc(Cl)cc1C(=O)O 1866128675 FOVHRTOTONSYBL-BJMVGYQFSA-N 440.080 5.000 50 10 IJGE COCCc1nc(Nc2ccc(SC#N)cc2)cc(N2CCc3ccc([N+](=O)[O-])cc32)n1 1868253915 XXDDEIFFEQRGGB-UHFFFAOYSA-N 448.508 4.585 50 10 IJGE N#CSc1ccc(Nc2cc(N3CCC[C@H](CO)C3)nc(-c3ccc(F)cc3)n2)cc1 1868456046 IHXMBYJFJOJQAY-INIZCTEOSA-N 435.528 4.808 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@@H](C(F)(F)CCl)C1 1892721091 XAVZBEGCBIRTQR-ZCFIWIBFSA-N 437.531 4.609 50 10 IJGE CN(Cc1ccccc1Br)C[C@@H](Br)COCc1ccccc1 1916353067 DATUCOKUVCOCDW-QGZVFWFLSA-N 427.180 4.861 50 10 IJGE FC(F)c1cc(I)c(I)cc1CCl 2060238862 SVLUNZVGDXRCQL-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE Fc1cccc(Cn2nc(CCl)c(I)c2C(F)(F)F)c1F 2079207756 KNDBVZUUNRKQOP-UHFFFAOYSA-N 436.549 4.572 50 10 IJGE C[C@@H](CCBr)CCN1CCC[C@@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2129042650 JSIMLGGIKOCERZ-LSDHHAIUSA-N 429.403 4.747 50 10 IJGE CN(Cc1cccc(CNC(=O)[C@H](Br)C2CCCC2)c1)C(=O)OC(C)(C)C 2167030409 BJMUZQPQHMHGGD-GOSISDBHSA-N 439.394 4.623 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@](CNC(=O)[C@H](Br)C2CCCC2)(C(C)(C)C)C1 2167031947 KOMVEXWQEHYNBT-IIBYNOLFSA-N 445.442 4.730 50 10 IJGE CCN(C(=O)[C@H](Br)C1CCCC1)[C@@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2167032811 OFZUVFJMNPXXFP-KZNAEPCWSA-N 445.442 4.872 50 10 IJGE ClCc1nc2cncc(Br)c2n1CCc1ccsc1Br 2186669718 ZKEZHUNXMMXYOP-UHFFFAOYSA-N 435.572 4.999 50 10 IJGE CC1(C)CN(c2ncc(Br)cc2Br)C[C@H]1CCBr 2222544514 ZXDLYWSAXDFWQH-SECBINFHSA-N 441.005 4.854 50 10 IJGE O=[N+]([O-])c1cc(CBr)ccc1N1[C@H]2CCC[C@@H]1CN(Cc1ccccc1)C2 2234689115 GORUOKCOZRYYOO-KDURUIRLSA-N 430.346 4.733 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CCN(CCCCI)C2 2243585938 IWMKEDGUZVKHLX-UHFFFAOYSA-N 430.330 4.607 50 10 IJGE Cc1sc([C@@H](Br)c2nn(C)nc2Br)c(Br)c1C 2246428152 VRPPRRYRIROWKV-ZETCQYMHSA-N 443.990 4.503 50 10 IJGE CC1CC(CBr)(CN(C)[C@@H](CNC(=O)OC(C)(C)C)c2ccccc2)C1 2265304227 MNXRBKVLMYJZPB-JGCRXCKMSA-N 425.411 4.995 50 10 IJGE COc1ccc([C@H](Cl)c2c(Br)cnn2C)c(Br)c1Cl 2268264429 SIZQUUIEGRJMAZ-JTQLQIEISA-N 428.939 4.935 50 10 IJGE C[C@H]1CC[C@](CBr)(NC(=O)c2cc(F)c(Br)cc2Cl)C1 2282974134 FOEBIPUDKHBXNS-RTHLEPHNSA-N 427.539 4.925 50 10 IJGE ClC[C@@H]1CCCN(Cc2ccc(I)c(Br)c2)C1 2306216366 FJEQTSVQDSPVBW-NSHDSACASA-N 428.539 4.505 50 10 IJGE CNC(=O)C(C#N)=C1S[C@@H](Cc2ccc(Cl)cc2)C(=O)N1c1ccc(C(C)C)cc1 2314593980 WXVDGBVENXTEGK-FQEVSTJZSA-N 439.968 4.636 50 10 IJGE Clc1ccc(CN2CC[C@@H](Br)[C@@H]2C2CC2)cc1I 2315547948 AYOBKWUKOLRENI-RISCZKNCSA-N 440.550 4.692 50 10 IJGE C[C@H]1CCN(Cc2ccc(Cl)c(I)c2)C[C@H]1CBr 2315551335 PNOVDJFVBBOGGV-CMPLNLGQSA-N 442.566 4.798 50 10 IJGE C[C@@H](CCBr)CCN1CC[C@H](C(F)(F)F)C[C@@H]1CNC(=O)OC(C)(C)C 2329542854 NUYVLALBNLAOAN-SOUVJXGZSA-N 445.364 4.965 50 10 IJGE N#CC(=C(O)C=Cc1ccc2c(c1)OCCO2)c1nc(-c2cccc([N+](=O)[O-])c2)cs1 2331232900 XDRPVWFLUVFISL-UHFFFAOYSA-N 433.445 4.996 50 10 IJGE Cc1cnc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)cc1CBr 2352269616 KCRGLIYSQQVEDB-QGZVFWFLSA-N 428.296 4.538 50 10 IJGE Cc1sc([C@@H](Br)[C@]23CCC[C@H]2CS(=O)(=O)C3)c(C)c1Br 2357952203 QTONSBQCEUFFMI-GDLCADMTSA-N 442.238 4.778 50 10 IJGE C[C@H](Br)COCc1cn(-c2ccc(Cl)c(Br)c2Cl)nn1 2362101567 VURFJWOQUVRDAK-ZETCQYMHSA-N 443.954 4.637 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)N/N=C/c3ccc([N+](=O)[O-])cc3)cc2)cc1 12491716 SRVKFLMHLRMRCA-WGOQTCKBSA-N 444.491 4.909 50 10 IJGE O=C(COc1ccc(Br)cc1Cl)N/N=C/c1cccc(Cl)c1Cl 13977873 BXNNBOJWSLUKMV-IFRROFPPSA-N 436.520 4.938 50 10 IJGE CC(C)Oc1ccc(Br)cc1C(=O)NNC(=O)c1ccc(Cl)cc1Cl 14667952 PREUHEVCEVFJJX-UHFFFAOYSA-N 446.128 4.618 50 10 IJGE Cc1cccn2c(=O)c(/C=C(/C#N)c3nc4ccccc4[nH]3)c(Oc3ccccc3F)nc12 33584189 DCFYUJAYSGMJPO-SSZFMOIBSA-N 437.434 4.875 50 10 IJGE COc1ccc([C@@H](C(=O)NC2CCCC2)N(Cc2ccccc2Cl)C(=O)CCl)cc1 97915044 QFUHMQHFULUQKP-QFIPXVFZSA-N 449.378 4.716 50 10 IJGE CCCCOCCOCCOCCC(CBr)(CBr)C(C)C 127945047 JOWRUHCGKCPFDB-UHFFFAOYSA-N 432.237 4.659 50 10 IJGE COc1cc(/C=C2\C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(C)cc1 214275847 WEAYIZCVHUSPAI-UUYOSTAYSA-N 444.531 4.831 50 10 IJGE CCc1cccc(CC)c1NC(=O)/C(C#N)=C\NCCc1ccccc1Br 217209285 HCVKFANTTCQUCY-CYVLTUHYSA-N 426.358 4.752 50 10 IJGE C[C@@H](N/C=C(/C#N)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C12CC3CC(CC(C3)C1)C2 217228539 BJWQFQZBVZEQRZ-LSXFSIBFSA-N 428.920 4.789 50 10 IJGE CC(=O)N(N=Cc1ccc(Cl)cc1)C1=NN(C(C)=O)[C@H](c2ccc(Cl)cc2)S1 254792888 SOCPILHROBFYQC-SFHVURJKSA-N 435.336 4.741 50 10 IJGE ClCc1cccc2sc(I)c(I)c12 306935852 ITNFHYKJTIOKGX-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE N#CSc1ccc(NC(=O)Nc2cccc(C(=O)Nc3ccc(C(=O)O)cc3)c2)cc1 586732871 RFNVKSUZHKGLFA-UHFFFAOYSA-N 432.461 4.854 50 10 IJGE CCN(C[C@H](C)Br)C(=O)c1cc(Br)c(Br)s1 691306114 JARGQJDKUZYOCZ-LURJTMIESA-N 433.991 4.519 50 10 IJGE ClCCc1nc2c(Br)cccc2n1Cc1cnc(Br)s1 718874328 RXOKHSOLSSWBRS-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc(C3SCCCS3)cc2)c1C 736695217 ZQZGXGIXPNKDOG-UHFFFAOYSA-N 437.594 4.781 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)c1cccc(CS(=O)(=O)c2ccccc2)c1 916044311 JZAUMGGLCYGUKF-UHFFFAOYSA-N 437.473 4.516 50 10 IJGE Cc1cc(O)nc2cc(C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C(C)(C)C)C4)ccc12 1540342021 OYUOAZIUPPILNM-INIZCTEOSA-N 437.565 4.536 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2ccnc(Oc3ccc(C(C)C)cc3)c2)c1 1644012132 XNOBUCCTQJYPSN-UHFFFAOYSA-N 430.533 4.610 50 10 IJGE Cc1cc(Cl)ccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1cccnc1)CCC2 1772746605 XAZPXPJWEGMWSK-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE Cc1c(C(=O)Oc2cccnc2)oc2c1C(=NNC(=O)c1cccc3ccccc13)CCC2 1772748185 OIPWYVIFWHLGDN-UHFFFAOYSA-N 439.471 4.826 50 10 IJGE CCCSc1ccccc1C(=O)NNC(=O)c1ccc(-c2ccc(F)c(F)c2)nc1C 1865757142 OWERJZCRRKKMSZ-UHFFFAOYSA-N 441.503 4.912 50 10 IJGE CCOc1ccc(OCC)c(-c2csc(/C(C#N)=C(\O)[C@H]3CC(=O)N(C(C)C)C3)n2)c1 1872754604 AHMSJDCFEOZWTG-YUCJCZDXSA-N 441.553 4.657 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)C(=O)c1cccc(I)c1 1915090283 JMEBLCGFCQWSRU-INIZCTEOSA-N 427.713 4.951 50 10 IJGE Cc1nn(-c2ccccc2)c(N(Cc2ccccc2)[C@@H]2CCOC2)c1CBr 1915478923 JYYPSPCJSIQFFH-HXUWFJFHSA-N 426.358 4.871 50 10 IJGE CC1(C)CN(Cc2ccc(Br)cc2Br)C[C@H]1Br 1943860173 VQJQUMPXTKCCOO-GFCCVEGCSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC2CC3(CCC3)C2)C1 1985548915 BWOYONJJLAUYDS-SFHVURJKSA-N 435.346 4.540 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](Br)[C@H](OCc2cc(Cl)cc(Cl)c2)C1 1992070468 BHFJZLIEIMWCPP-ZIAGYGMSSA-N 425.150 4.893 50 10 IJGE O=S(=O)(c1ccc(CBr)c(Cl)c1)N(Cc1ccccc1)CC1CC1 2009622531 RLVIBEGWSWESLR-UHFFFAOYSA-N 428.779 4.836 50 10 IJGE F[C@@H](CBr)C1CCN(c2ncc(Br)cc2Br)CC1 2044832041 KKSIWHMYOJXVEN-NSHDSACASA-N 444.968 4.556 50 10 IJGE C[C@H]1CO[C@H](COc2c(Br)cc(CBr)cc2Br)C1 2047588542 ACSRKOCLZWYTLA-SCZZXKLOSA-N 442.973 4.910 50 10 IJGE CC(C)[C@@H](CBr)CN1C[C@H](CNC(=O)OC(C)(C)C)Cc2ccccc21 2106787171 YEMFOHPRYFRKHW-WMZOPIPTSA-N 425.411 4.857 50 10 IJGE O=C(c1scc(Br)c1Br)N1[C@H](CCl)C[C@H]2CCC[C@H]21 2108397730 VYDJWGORGYUBEX-KHQFGBGNSA-N 427.589 4.895 50 10 IJGE CN(Cc1cccc(NC(=O)OC(C)(C)C)c1)C(=O)[C@@H](Br)C1CCCC1 2110715889 RKHOCCFPMDGHNM-KRWDZBQOSA-N 425.367 4.946 50 10 IJGE ClCc1cc(Br)ccc1N1CC[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2129050226 CNXLZRPFSQRPPM-RTWAWAEBSA-N 435.793 4.668 50 10 IJGE Cc1cc(C(=O)NCC(C)(C)CCCBr)ccc1I 2142108293 WGSNKJIMWAHFCN-UHFFFAOYSA-N 438.147 4.531 50 10 IJGE O=C(NC[C@]12CC[C@H]1CCCN2Cc1ccccc1)c1ccc(CBr)cc1 2145607679 OTGPCWGUGUSALT-FYYLOGMGSA-N 427.386 4.756 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Br)c2n1Cc1ncc(Br)s1 2151781016 WRXGMNQMRWSJDT-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@@H](OC)C[C@H]1CNC(=O)OC(C)(C)C 2163060301 AOOVJLYMIUDKGM-ZWKOTPCHSA-N 449.474 4.972 50 10 IJGE Cn1nc([C@H](Cl)c2cc(Br)c3c(c2)CCO3)c(Br)c1Cl 2167044490 XQEWOZRFZMWAOU-SNVBAGLBSA-N 440.950 4.862 50 10 IJGE Cc1c([C@@H](Cl)c2c(Br)cc(F)c(F)c2F)nn(C)c1Br 2168218979 VLFAYLASRRCCGD-QMMMGPOBSA-N 432.465 4.999 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@H]([C@@H](C)Br)C(F)(F)F)cc1Br 2195309668 JMSYGUNZJSCNQA-LHLIQPBNSA-N 437.481 4.855 50 10 IJGE C[C@H](C(=O)N(C)C[C@H]1C[C@H](Br)C1)[C@H](NC(=O)OC(C)(C)C)c1ccccc1 2196913800 HLBLTTPJGGXVQV-LAQRGFTBSA-N 439.394 4.520 50 10 IJGE Cc1c(Cl)cc(C(=O)NC2CC([C@@H](F)CBr)C2)cc1Br 2199058475 OFRSNUQIRGPURF-RHYVWVDMSA-N 427.539 4.652 50 10 IJGE COc1cccc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)c1CBr 2203205163 RPDXUAQDYFSZRD-LJQANCHMSA-N 443.307 4.843 50 10 IJGE CC(C)(C)OC(=O)NCCC[C@@H]1CCCCN1CCCCCI 2211186586 ADCZJFRFPSCULU-INIZCTEOSA-N 438.394 4.751 50 10 IJGE CC1(CO[C@@H](CCl)[C@@H](I)CCl)CC2(CC(F)(F)C2)C1 2230633480 KHAGJNDVGJLWKD-UWVGGRQHSA-N 427.100 4.868 50 10 IJGE CCCN(Cc1cc(Cl)ccc1I)C[C@H](C)Br 2250505835 WXJBXVJMWPXKGY-JTQLQIEISA-N 430.555 4.940 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCSC[C@H]1CCBr 2282977674 DTRYEVNUQRBGRH-MRVPVSSYSA-N 445.579 4.584 50 10 IJGE C[C@H]1CCCN(C(=O)c2ccc(Cl)c(I)c2)[C@H]1CCCl 2283660256 BWIUSEPHENKKJZ-HZMBPMFUSA-N 426.125 4.814 50 10 IJGE CC(C)(C)C[C@@H](CCl)CNC(=O)c1ccc(Cl)c(I)c1 2283665328 VMKQSKAATBSUGD-JTQLQIEISA-N 428.141 4.966 50 10 IJGE O=C(N[C@H](CBr)c1cscn1)c1cc(Br)c(F)cc1Cl 2285837211 LVBYWVPAJSNYFS-SNVBAGLBSA-N 442.535 4.564 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCC(CCBr)CC1 2285843750 CWYSTVHXUUWUEV-UHFFFAOYSA-N 427.539 4.879 50 10 IJGE COC(=O)c1ccc(COc2ccc(C=C(C#N)C(=O)N[C@@H](C)c3ccccc3)cc2)cc1 2293191884 JHOHTTJXZQKGJR-IBGZPJMESA-N 440.499 4.837 50 10 IJGE CCCN1CC(=Cc2ccc(OC)cc2)C2=C(C1)[C@@H](c1ccc(OC)cc1)C(C#N)=C(N)O2 2295993285 FVBNCSSBLXIBEE-VWLOTQADSA-N 443.547 4.575 50 10 IJGE Clc1ccc(C[C@]2(CBr)CCCOC2)cc1I 2300240819 QSEKNHRENXCFNW-ZDUSSCGKSA-N 429.523 4.679 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](N)[C@H]1C[C@@H](Br)C1 2301490881 ZLAZINVVLFCLKW-KJNMHVQDSA-N 429.953 4.832 50 10 IJGE CC1=C(C#N)C(=O)N(CCc2ccccc2)C(=O)C1=CNc1cc(Cl)ccc1Cl 2314578959 FSFLJNJSRPWPLT-UHFFFAOYSA-N 426.303 4.741 50 10 IJGE F[C@@]1(CBr)CCCN(Cc2ccc(Cl)cc2I)C1 2318539069 KTMWLAXNEIDLRT-CYBMUJFWSA-N 446.529 4.644 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@](C)(CBr)C(C)(C)C)CC(F)(F)C1 2327080859 QSEVDSOMLSIWRS-SUMWQHHRSA-N 427.374 4.668 50 10 IJGE Cc1ccccc1COc1ccc(C=NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc1 2328833119 CMPPYNFEBWFLHJ-QFIPXVFZSA-N 439.556 4.573 50 10 IJGE COc1ccc(C=C(C#N)C(=O)N[C@@H](CC(C)C)C(=O)Nc2ccc3ccccc3c2)cc1 2329611085 JIABUPGQWYFYJH-VWLOTQADSA-N 441.531 4.925 50 10 IJGE CCCc1sc(Br)cc1[C@@H](Br)[C@@H]1CCCS(=O)(=O)C1 2338024621 WNQDXYQMRGDBDC-RNCFNFMXSA-N 430.227 4.724 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@@H]3CN(C(=O)OC(C)(C)C)CC[C@@H]32)C1 2345005631 BGEVHJWUADJWGD-SJORKVTESA-N 429.443 4.909 50 10 IJGE CC(C)[C@@H](Cl)C(C)(C)NS(=O)(=O)c1cc(Br)ccc1Br 2366094786 QZMJGSKOORIHOM-GFCCVEGCSA-N 447.620 4.532 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc2ccccc2c1O 2369677172 IRYKBFNXWZVLOJ-GOSISDBHSA-N 428.326 4.646 50 10 IJGE CC[C@@H](C)c1ccc(OCC(=O)NNC(=O)[C@H](C)Oc2ccc(-c3ccccc3)cc2)cc1 14038773 BVBRIJOLDLWGGG-UXHICEINSA-N 446.547 4.861 50 10 IJGE N#C/C(=C/c1cccc(OC(=O)CN2C(=O)c3ccccc3C2=O)c1)c1cccc(Cl)c1 31902475 ZZJVGZZMLXBUMM-WQRHYEAKSA-N 442.858 4.606 50 10 IJGE CCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C\c2ccc(C(C)C)cc2)c(OC)c1 34715384 YNEJDKDGXGDGPF-FRHHWIBZSA-N 432.520 4.871 50 10 IJGE C[C@H](Br)C[C@@H](C)NC(=O)c1cc(Br)cc(Br)c1 235399999 YEOLVBNHBIJVCA-JGVFFNPUSA-N 427.962 4.503 50 10 IJGE COc1ccc(C(=O)NN=Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)c(OC)c1 729938141 GWDVICTXCSXPLZ-UHFFFAOYSA-N 435.427 4.610 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2cc(C)n(-c3cccc(C)c3)c2C)cc1 1084081510 ZPUPTGNRTXSERP-VWLOTQADSA-N 433.552 4.765 50 10 IJGE C#CC[C@@H](CCOC)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1530713170 OIJNQLITWGARQE-BIRYMOPTSA-N 444.362 4.853 50 10 IJGE Cc1c(C(=O)Nc2ccc(Oc3ccccc3)cc2)oc2c1C(=NNC(N)=O)CC(C)(C)C2 1772729509 RHEJPQGXLOGBAR-UHFFFAOYSA-N 446.507 4.977 50 10 IJGE Cc1c(C(=O)Oc2cccc3cccnc23)oc2c1C(=NNC(=O)c1cccs1)CCC2 1772749403 MVQLDTSCNFCVHE-UHFFFAOYSA-N 445.500 4.887 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2Cc1cccc(F)c1 1865691278 OJHKYRXGRRHIBO-HSZRJFAPSA-N 444.510 4.806 50 10 IJGE CCCc1nn(Cc2ccccc2)c2c1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865705992 LKUGGCLCUZLUPF-FQEVSTJZSA-N 449.898 4.664 50 10 IJGE COC(=O)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccc2)cc1 1865709048 MEQMJLGVNWSMRW-JOCHJYFZSA-N 448.482 4.544 50 10 IJGE Cc1cc(-c2csc(/C(C#N)=C(\O)[C@@H](C)N3C(=O)c4ccccc4C3=O)n2)ccc1F 1872749826 JVRPJGSHAQQCRM-PWLTZZKVSA-N 433.464 4.735 50 10 IJGE COc1c(C(=O)N(Cc2ccccc2)[C@@H](CBr)C(C)C)cccc1[N+](=O)[O-] 1915275101 YFJTXVWFSCFLEQ-SFHVURJKSA-N 435.318 4.665 50 10 IJGE O=C(N[C@@H](CBr)CC1CC1)c1cc(Br)sc1Br 1942804860 DFHXPJHHSDSDJM-SSDOTTSWSA-N 446.002 4.567 50 10 IJGE Cn1nc(C(=O)N(Cc2ccccc2)C2(CCl)CCC2)c(Br)c1Cl 2001991159 KWZYQBDJWTVIOL-UHFFFAOYSA-N 431.161 4.640 50 10 IJGE C[C@H]1CN(Cc2cc(Br)ccc2Br)C[C@@H]1CBr 2006500205 MNHNAXLTHBIPJK-ONGXEEELSA-N 425.990 4.674 50 10 IJGE Clc1cc(CN2CC[C@@H](CCBr)C2)ccc1I 2026560785 MVLIVNAAGFECOY-SNVBAGLBSA-N 428.539 4.552 50 10 IJGE Brc1ccc(CN2CC[C@@H](Br)[C@H]2C2CC2)c(Br)c1 2067015100 FUFNCDSMCOWPJO-TZMCWYRMSA-N 438.001 4.959 50 10 IJGE BrC[C@@]12CC[C@H]1CN(Cc1ccc(Br)cc1Br)C2 2078136078 XOLJILJODADAIK-SMDDNHRTSA-N 438.001 4.819 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1c(Br)cccc1Br 2081241075 DMCASVTVIOAAKP-LDYMZIIASA-N 441.989 4.751 50 10 IJGE CC[C@H](Cl)CCCNC(=O)c1ccc(Br)cc1I 2086150423 BAZYNMQWTXWWAX-JTQLQIEISA-N 444.538 4.581 50 10 IJGE COC[C@H]1CN(C(=O)OC(C)(C)C)CCN1CCCCCCCCCBr 2106781559 IYRHELKKIHSWLY-GOSISDBHSA-N 435.447 4.680 50 10 IJGE CC(F)(F)[C@@H]1C[C@H]1[C@H](Br)c1cc(I)cc2c1OCC2 2108180924 FRKVWIIOCBGLKO-JLLWLGSASA-N 443.069 4.953 50 10 IJGE CC[C@@H]1CN(C(=O)[C@@H](Br)C2CCCC2)[C@H](CC)CN1C(=O)OC(C)(C)C 2110715452 NLZHAXAACNTQOI-ZACQAIPSSA-N 431.415 4.577 50 10 IJGE COCC(C)(C)N(Cc1ccccc1)S(=O)(=O)c1ccc(CBr)cc1C 2123204429 JDRREUKTUZENQW-UHFFFAOYSA-N 440.403 4.506 50 10 IJGE O=C(c1scc(Br)c1Br)N1[C@H]2CC[C@@H]1C[C@@H](CCl)C2 2128150842 ZELNMQZMCBVYJC-PSVAKVPMSA-N 427.589 4.895 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CCCN(C(=O)[C@@H](Br)C3CCCC3)C2)C1 2167034530 XDCANFZFEXNHCN-UWJYYQICSA-N 443.426 4.580 50 10 IJGE Cn1nc([C@@H](Cl)c2cc(Br)cc3c2OCC3)c(Br)c1Cl 2167048542 ROUUTICQOJTACU-JTQLQIEISA-N 440.950 4.862 50 10 IJGE CC[C@@H](Cl)[C@@H]1CCCCN1C(=O)c1ccc(I)c(Cl)c1 2170618730 REUWDICRJBZZQC-RISCZKNCSA-N 426.125 4.957 50 10 IJGE C[C@@H](Br)CN(Cc1ccc(Cl)c(I)c1)C1CC1 2300241169 VTXXRKPQPYPPLM-SECBINFHSA-N 428.539 4.692 50 10 IJGE CN(Cc1sccc1I)[C@H]1CCCCC[C@H]1Br 2301068287 JYQHENGUKJHHAQ-PWSUYJOCSA-N 428.177 4.881 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCN(CCCCBr)[C@H](C(F)(F)F)C1 2315835031 TXQZSYPZXSZKSI-KBPBESRZSA-N 431.337 4.719 50 10 IJGE Br[C@@H]1C[C@H]2CCCC[C@@H]2N(Cc2sccc2I)C1 2316765478 XMPVEOSHMSASMR-WZRBSPASSA-N 440.188 4.881 50 10 IJGE C[C@]12CN(Cc3ccc(Cl)cc3I)C[C@@]1(CBr)C2 2318557592 MTFFCAWCDQNIBZ-KBPBESRZSA-N 440.550 4.552 50 10 IJGE CCC[C@@H]1CC[C@H](Br)[C@@H](Cc2nn(C)cc2I)C1 2319222459 CYBZFPJBJVJPRU-UTUOFQBUSA-N 425.152 4.547 50 10 IJGE O=C(NN=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc2[nH]c3c(c2c1)CCCC3 2321672307 HTJBBRGAJVITRL-UHFFFAOYSA-N 428.448 4.979 50 10 IJGE ClC[C@H]1CC[C@@H](NCc2ccc(I)c(Br)c2)CC1 2325229921 LFRHHOMFXMGLEF-KLPPZKSPSA-N 442.566 4.941 50 10 IJGE COc1cc(C(O)=C(C#N)c2nc(-c3ccc4c(c3)OCO4)cs2)cc(OC)c1OC 2331332930 CHACHLGMZINYOI-UHFFFAOYSA-N 438.461 4.514 50 10 IJGE CN(C[C@H]1CN(CC2(CBr)CCCCC2)CC12CC2)C(=O)OC(C)(C)C 2340535973 KIYXHJTWXWIDKG-KRWDZBQOSA-N 429.443 4.911 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N(C[C@@H](C)Br)C1CCCC1 2368873585 PCRBWTVCTWGZFU-SECBINFHSA-N 445.242 4.536 50 10 IJGE CC[C@H](C)c1nc(N2CCN(C(=O)CCCl)CC2)c2c3c(sc2n1)C[C@@H](C)CC3 35865718 YPNDOAIXAOVHJE-GJZGRUSLSA-N 435.037 4.607 50 10 IJGE Cc1cc(C)cc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(O)cc2)CCC3)c1 40812019 UNUWMBREINTZOE-LHLOQNFPSA-N 432.476 4.600 50 10 IJGE Cc1c(C(=O)NC2CCCCC2)oc2c1/C(=N/NC(=O)c1ccc3ccccc3n1)CCC2 40825813 QZBYRKCBADHBRU-ZTKZIYFRSA-N 444.535 4.669 50 10 IJGE Cc1cc(C)c(/C(CSc2nc3ccccc3[nH]2)=N\NC(=O)c2cccnc2)cc1C 59460755 ICJTWPOFMIAPDR-SLMZUGIISA-N 429.549 4.810 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccco2)C(=O)/C1=C/c1ccc(OCc2ccccc2F)cc1 101336872 ZEQIPDWAWKFHQM-LPYMAVHISA-N 442.446 4.790 50 10 IJGE [C-]#[N+][C@H](c1ccc(Br)c(Br)c1)S(=O)(=O)c1ccc(C)cc1 138944618 IOZWLLBEPSQIMR-HNNXBMFYSA-N 429.133 4.912 50 10 IJGE COc1cccc(C=NNC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)c1OC 256017181 AERSMISWYQMUAI-UHFFFAOYSA-N 432.520 4.559 50 10 IJGE O=S1(=O)CCC[C@@H]1[C@@H](Br)c1scc(C(F)(F)F)c1Br 694620821 GODDBGNBVWJGGF-HTRCEHHLSA-N 442.116 4.543 50 10 IJGE C[C@@H](Br)C[C@@H](C)CNC(=O)c1scc(Br)c1Br 705442274 NNDMZUUTLIBDNU-RNFRBKRXSA-N 448.018 4.813 50 10 IJGE CCN(CCCBr)C(=O)c1scc(Br)c1Br 705513539 QCFUEJUCXGKYBL-UHFFFAOYSA-N 433.991 4.520 50 10 IJGE C[C@H](NC(=O)NNc1cccc(F)c1F)c1ccc(NC(=O)c2ccc(F)cc2)cc1 745705701 XCBNXIIEVCBMNQ-ZDUSSCGKSA-N 428.414 4.744 50 10 IJGE CN(C[C@H]1CC=CCC1)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 784316492 ASXPKPPGLVYRIZ-HJHGFDQJSA-N 433.943 4.839 50 10 IJGE CCCCCOc1ccccc1C(=O)NN=C1C(=O)N(Cc2ccccc2)c2ccccc21 1084062392 VDBINEQBXCDVIV-UHFFFAOYSA-N 441.531 4.937 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)CCc2c(-c3ccccc3)[nH]c3ccccc23)c1 1176937498 OIGIMRGRZPNAIF-UHFFFAOYSA-N 438.556 4.767 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)Nc3ccc(-n4ccc(O)n4)cc3)c2C)c1 1454280735 MCVYTBPBDSVIES-RCCKNPSSSA-N 437.503 4.840 50 10 IJGE C/C(=C\c1ccccc1Cl)C(=O)NNC(=O)COc1ccccc1Cc1ccccc1 1654118794 VBFNIFDMIRFNHT-OBGWFSINSA-N 434.923 4.561 50 10 IJGE O=S(=O)(c1cc(F)ccc1Cl)N(Cc1ccccc1)C1(CBr)CCC1 1915750832 LUCGGKCKSBMMHV-UHFFFAOYSA-N 446.769 4.988 50 10 IJGE CC1(C)OC[C@@H](Cc2ccc(Br)cc2Br)[C@@H]1Br 1943859986 UEQSWCRKXCPWAY-SKDRFNHKSA-N 426.974 4.943 50 10 IJGE C[C@H](CCl)N(Cc1ccccc1)C(=O)c1cc(I)ccc1F 1961216087 REYAINQWCAZSIM-GFCCVEGCSA-N 431.676 4.700 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@@H](CI)O2)C[C@H]1C1CCC1 1990242577 UJKSWCHSZXJMSD-RLFYNMQTSA-N 435.346 4.539 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)CCc1ccc(C(F)(F)F)cc1 1994838672 YJUZICCCZDSOGV-CQSZACIVSA-N 426.232 4.698 50 10 IJGE O=C(N[C@@H]1CC[C@H](CBr)C1)c1cc(Br)ccc1Br 2029535590 NTDNDXHVGUIROH-WCBMZHEXSA-N 439.973 4.505 50 10 IJGE Clc1cc(CN2C[C@H](Br)CC23CCC3)ccc1I 2086662050 RBKQARLJTRBQHE-LLVKDONJSA-N 440.550 4.837 50 10 IJGE CC(C)[C@H]1N(C(=O)OC(C)(C)C)CC12CCN(C[C@H](Br)C(F)(F)F)CC2 2106787867 LCPPMVVSZGSNDA-UONOGXRCSA-N 443.348 4.670 50 10 IJGE O=C(c1scc(Br)c1Br)N1[C@H](CCl)C[C@H]2CCC[C@@H]21 2108397733 VYDJWGORGYUBEX-WEDXCCLWSA-N 427.589 4.895 50 10 IJGE O=C(NC[C@@H]1C[C@@H](Cl)C12CCC2)c1cc(Br)c(Br)s1 2115599232 LWKJSPVXUCRVMM-OIBJUYFYSA-N 427.589 4.801 50 10 IJGE CC[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1N(C)C(=O)c1ccc(CBr)cc1 2163625849 VVDMIQSFOSACDZ-AEFFLSMTSA-N 439.394 4.689 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CNC(=O)[C@H](Br)C3CCCC3)CCC[C@@H]12 2167033095 PLWMOSNPGRCHEP-LZJOCLMNSA-N 443.426 4.626 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1c1ccc(NC(=O)[C@H](Br)C2CCCC2)cc1 2167047800 LMTGBNWVOUJZNF-KZNAEPCWSA-N 437.378 4.959 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N(C)[C@@H]1CCCCC[C@@H]1Br 2172541857 AEHUZITUDZIIQI-WDEREUQCSA-N 445.242 4.536 50 10 IJGE COc1cc2c(cc1Br)nc(CCCl)n2C[C@H]1CCN1Cc1ccccc1 2202310582 YVDCVCOVGAINPD-MRXNPFEDSA-N 448.792 4.863 50 10 IJGE CCN(C[C@](C)(CI)OC[C@H]1CC[C@@H](C)C1)C(=O)OC(C)(C)C 2243467587 OQUXXRPDKHEUMC-VKJFTORMSA-N 439.378 4.890 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@@H](OCC[C@H]2CCCCC23CC3)C1 2246605885 HUQUJNZTNJMDQQ-PMPSAXMXSA-N 449.373 4.786 50 10 IJGE CC1(C)C[C@@H](CCl)CN(C(=O)c2ccc(Cl)c(I)c2)C1 2283656890 PYLTZHRUPLBJIQ-JTQLQIEISA-N 426.125 4.672 50 10 IJGE COc1ccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3ccc(C(=O)O)cc3C)c2C)cc1 2294181435 WOSWRNODWNLKHH-UHFFFAOYSA-N 429.476 4.655 50 10 IJGE Cc1cc(C=C(C#N)C(=O)OCC(=O)NCc2ccccc2Cl)c(C)n1CCC(C)C 2297486947 IYIOIEUVDWQYNO-UHFFFAOYSA-N 441.959 4.571 50 10 IJGE Clc1ccc(I)cc1CN1CCCC[C@H]1CBr 2307333462 CUQPDEPDYSGLAV-LBPRGKRZSA-N 428.539 4.694 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(N)cc2)ccc1OCc1c(Cl)cccc1Cl 2318415908 XHISIWYFZZTLHI-UHFFFAOYSA-N 444.318 4.927 50 10 IJGE CC(=O)N1CCc2cc(C(C)=NNC(=O)c3ccc(-c4ccc(Cl)cc4)nc3C)ccc21 2321260807 ATAIWDLAURRDKT-UHFFFAOYSA-N 446.938 4.773 50 10 IJGE Cc1cc(I)ccc1NC(=O)C(C#N)=CNc1ccc(Cl)cc1 2325406223 XCYGWQAGDQDUGS-UHFFFAOYSA-N 437.668 4.711 50 10 IJGE CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1cccc(OCc2ccccc2)c1 2328796652 OYDHNSHBVBBBHJ-QFIPXVFZSA-N 439.556 4.655 50 10 IJGE Cc1ccc(-c2csc(C(C#N)=C(O)[C@@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1C 2331382203 JYLKOAKNOUFXBA-OAHLLOKOSA-N 429.501 4.904 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CCC2CCN(C[C@@H]3C[C@H]3Br)CC2)CC1 2335924519 ISEDYVQYJCITEG-RBUKOAKNSA-N 429.443 4.909 50 10 IJGE CC(C)C[C@H](CBr)CN1CC[C@H](C(F)(F)F)[C@@H](NC(=O)OC(C)(C)C)C1 2353835440 SKDJTDCMEXWBFF-ILXRZTDVSA-N 445.364 4.821 50 10 IJGE FC(F)(CBr)C(F)(F)CN=c1[nH]c2ccc(Br)cc2s1 2361685767 BSOQURJUPZMHMS-UHFFFAOYSA-N 436.066 4.558 50 10 IJGE ClCCCN(Cc1ccc(Br)cc1Br)C1CCOCC1 2381159255 IXNRDVFADAGYPT-UHFFFAOYSA-N 425.592 4.822 50 10 IJGE O=C(O)[C@H]1Nc2ccc(Cl)cc2[C@@H]2[C@H](Cl)[C@@H](Sc3ccccc3[N+](=O)[O-])C[C@@H]12 8425368 FWTSKJIRYVHRKV-AJAORCOTSA-N 439.320 4.999 50 10 IJGE Cc1cc(Br)cc(Br)c1OCC(=O)N/N=C1\CCC[C@@H](C)C1 12483296 LNEJYPQQINUPKD-MUSWWTGGSA-N 432.156 4.581 50 10 IJGE O=C(N/N=C/c1ccccc1OCc1ccccc1Cl)c1ccc(N2CCCC2=O)cc1 58986245 JHTLBBQIJCZWPW-JVWAILMASA-N 447.922 4.810 50 10 IJGE O=C(N/N=C(/CSc1nc2ccccc2[nH]1)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 59460578 DTZSKQXPXVSPLJ-QOMWVZHYSA-N 449.467 4.537 50 10 IJGE Cc1cc([C@@H](Br)c2ccc(S(C)(=O)=O)cc2)c(C)cc1Br 70472213 SCILKHKTHMBUAO-INIZCTEOSA-N 432.177 4.954 50 10 IJGE BrCC1(COc2ccc(Br)cc2Br)CCOCC1 96870324 RIOQKNGLWXYWFU-UHFFFAOYSA-N 442.973 4.782 50 10 IJGE COc1ccc(-c2cc(C(=O)NN=Cc3ccc(OC)c(OC)c3)c3ccccc3n2)cc1 252598269 CZEKDNFFQJNYJU-UHFFFAOYSA-N 441.487 4.692 50 10 IJGE CCNc1ccc(C(=O)NN=Cc2c(-c3ccccc3)n(C)c3ccccc23)cc1[N+](=O)[O-] 254861945 LJCREMDTEZRBFC-UHFFFAOYSA-N 441.491 4.949 50 10 IJGE ClCc1c(I)ccc2cc(I)sc12 307307842 VVZHGBNQEMINQO-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE C[C@@H]1[C@H](CBr)CCN1C(=O)c1cc(Br)sc1Br 385758167 FBQWOLUQNMIOPL-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE FC(F)Oc1c(CBr)ccc(I)c1Br 575682014 GPKNZJJYQXCRLT-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE COc1ccccc1CNC(=O)Nc1cccc(C(=O)Nc2ccc(SC#N)cc2)c1 586627148 NOIFFXIHMSJWBR-UHFFFAOYSA-N 432.505 4.842 50 10 IJGE Cc1cccc2c1CCN2C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 746387175 FXXQHBWZEBENGF-XMHGGMMESA-N 441.922 4.922 50 10 IJGE Cc1c(COc2ccccc2)cccc1NC(=O)NNC(=O)c1cccc2cccnc12 756849006 SRXJMEXDUCKWJO-UHFFFAOYSA-N 426.476 4.589 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)OCc2cccc(Br)c2)c(C)n1C[C@H]1CCCO1 786381758 UPAHBBGERSTFET-ZNQKWNQWSA-N 443.341 4.697 50 10 IJGE O=C(NN=Cc1ccc(-c2cc[nH]n2)o1)c1ccc(CSc2nc3ccccc3[nH]2)cc1 788408610 VDFYOMUXSANZIS-UHFFFAOYSA-N 442.504 4.602 50 10 IJGE O=C(NN=Cc1cc(Br)c(O)c(Br)c1)c1ccc2ccccc2c1 1084047872 DNYDJSBYQKWJMU-UHFFFAOYSA-N 448.114 4.834 50 10 IJGE C=CCNC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccccc2C)c1C 1351447392 SZELCSJBOAKZGP-CJLVFECKSA-N 438.531 4.864 50 10 IJGE Cc1cccc(Cl)c1NNC(=O)CCc1nc(O)c2c3c(sc2n1)C[C@H](C)CC3 1636833651 YVVGBNRQPNLERP-LLVKDONJSA-N 430.961 4.559 50 10 IJGE CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NNc1cc(Cl)ccc1Br 1651620150 JKYYMYHQIKKALF-GOSISDBHSA-N 434.721 4.510 50 10 IJGE CCc1cccc(OCC(=O)NN=Cc2ccc(OCc3ccc(C)cc3)c(OC)c2)c1 1772753322 QOOYGYFZVQXPCL-UHFFFAOYSA-N 432.520 4.674 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2cccc(Cl)c2)[C@H]1c1ccc[nH]1 1865710037 MYQHMAIPZLPCFO-HXUWFJFHSA-N 427.895 4.798 50 10 IJGE CC[C@@H](NC(=O)[C@@H](c1ccc(Cl)cc1)C1CC1)C(=O)Nc1ccc(SC#N)cc1 1866999948 CPZOWEGYRHKHDV-WOJBJXKFSA-N 427.957 4.940 50 10 IJGE CCCN[C@H](c1sc(Cl)cc1I)[C@H]1C[C@H]1Br 1901025478 GZIGEAGFEHTDAC-PJKMHFRUSA-N 434.568 4.830 50 10 IJGE CCCN(CC(C)(C)CI)C1CCN(C(=O)OC(C)(C)C)CC1 1904650881 KSBBGPQEEJHLEI-UHFFFAOYSA-N 438.394 4.559 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ncsc1Br 1915111721 WDNXUOBZSKGOTD-GFCCVEGCSA-N 432.181 4.722 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)Cc1c(Br)c(C)nn1C 1915116598 WNRQYQWGNJKGBZ-OAHLLOKOSA-N 429.200 4.667 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1ccc(Br)cn1 1915288688 MCTWJBRGUANZLH-KRWDZBQOSA-N 440.179 4.906 50 10 IJGE Cc1c([C@@H](Br)c2sccc2Br)nn(C)c1Br 1980170846 RICYNULUXGJCSK-SSDOTTSWSA-N 428.975 4.799 50 10 IJGE CC(C)(C)OC(=O)N[C@H](C[S@@](C)(=O)=NCCCCCBr)C(C)(C)C 1999513747 DQOZXTNMXPWTMO-JBEBIEQOSA-N 427.449 4.589 50 10 IJGE CCC[C@H](CBr)CNC(=O)c1cc(Br)c(Br)s1 2008108390 GWTXLKNNLQVKPC-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE C[C@]1(CBr)C[C@H](NC(=O)c2cc(Br)c(Br)s2)C1 2009754718 NAUAOPKAVPCUES-MHWOZMEASA-N 446.002 4.567 50 10 IJGE ClC1([C@H](Br)c2cc(I)cc3c2OCC3)CCC1 2020450373 QDIMMPUFKSTPFP-GFCCVEGCSA-N 427.507 4.824 50 10 IJGE Br[C@H](Cc1ccc2c(c1)CCO2)c1csc(I)c1 2049594797 CVLVNLOMKCAQEQ-GFCCVEGCSA-N 435.124 4.966 50 10 IJGE ClCc1nc2cncc(Br)c2n1-c1ccccc1I 2095438415 VXIPDIBXIWGNSN-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 2095438851 BFHGMGGXEBZGMH-CTNYNGJSSA-N 431.765 4.797 50 10 IJGE CN(C[C@H](Cl)C1CCCC1)C(=O)c1cc(Cl)ccc1I 2167648403 VPVYXZVNEATOPO-ZDUSSCGKSA-N 426.125 4.814 50 10 IJGE CN(Cc1ccccc1)[C@H]1CCCCN(c2cc([N+](=O)[O-])ccc2CBr)C1 2176905171 SMTCHXKIWCFFQW-FQEVSTJZSA-N 432.362 4.981 50 10 IJGE CCCCCN(C(C)C)S(=O)(=O)c1cc(CBr)sc1Br 2179790358 CPOJAGLMYOJQEV-UHFFFAOYSA-N 447.258 4.995 50 10 IJGE O=C(c1ccc(Cl)c(Br)c1)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Br)C2 2190678181 KHKOEFZGAYHZRM-YPWHJJHSSA-N 425.523 4.581 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)S(=O)(=O)Cc1ccccc1Br 2213761138 QTDRVTZWUVEUTK-QGZVFWFLSA-N 430.795 4.799 50 10 IJGE COc1ccc(N2CCN(Cc3ccccc3)CC(F)(F)C2)c(CBr)c1 2227684817 YTIJVQOFKXKMGI-UHFFFAOYSA-N 425.317 4.548 50 10 IJGE COc1cc(F)c(Br)cc1[C@@H](Br)c1c(Cl)c(C)nn1C 2240930189 LIUYVZRABILGNW-LLVKDONJSA-N 426.511 4.776 50 10 IJGE C[C@@H]1COC[C@@H]1[C@H](Br)Cc1cc(Br)cc(Br)c1 2252838384 CDFORUCKTMRVTB-OXHMUOHRSA-N 426.974 4.800 50 10 IJGE CCCN(C[C@@H](C)Br)C(=O)c1cc(Cl)ccc1I 2259758928 ZGBKOTCLLLIKPN-SECBINFHSA-N 444.538 4.580 50 10 IJGE COc1ccc([C@H](Br)[C@@]23CCC[C@@H]2OCC3)cc1I 2269556778 RCWCIZPMSGUTEV-SOUVJXGZSA-N 437.115 4.695 50 10 IJGE C[C@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)CC[C@@H]1CBr 2282980195 KOLNCDZWQOSONJ-DTWKUNHWSA-N 427.539 4.735 50 10 IJGE N#CC(=Cc1cn(Cc2ccccc2)c2ccccc12)C(=O)N1CCN(c2ccccc2)CC1 2294175239 IEIBGDDFNOUQQV-UHFFFAOYSA-N 446.554 4.945 50 10 IJGE Cc1cccc(C)c1NC(=O)C(C#N)=Cc1ccc(Sc2nccn2C)c([N+](=O)[O-])c1 2297381738 MUVVYCVFUGOXKJ-UHFFFAOYSA-N 433.493 4.642 50 10 IJGE Cc1ccc(NC(=O)COc2ccc(C=C(C#N)C(=O)N[C@@H]3CCCC[C@H]3C)cc2)cc1 2297500521 LTHDIUBJMWFOSZ-NTKDMRAZSA-N 431.536 4.614 50 10 IJGE Clc1ccc(COC[C@H](CBr)C2CC2)c(I)c1 2301810366 KQNPVSMJQZEUFY-NSHDSACASA-N 429.523 4.882 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)C1CCC(C(F)(F)F)CC1 2343418655 QCHGIQPNSRVSRU-JCYILVPMSA-N 436.312 4.842 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1C1CCN(C[C@@]2(CBr)CC2(F)F)CC1 2351888540 XCSXELJUPVZSHA-QAPCUYQASA-N 437.369 4.518 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@@H](Br)[C@@H]2CC[C@@H]21 2359507611 KJBUCHVNRRJHQB-HBSDOPKDSA-N 425.523 4.630 50 10 IJGE C[C@@H]1CCC[C@@](CCl)(NC(=O)c2ccc(Cl)cc2I)C1 2365587073 SRQPXCXPIAIGBG-MEBBXXQBSA-N 426.125 4.862 50 10 IJGE C[C@@]12CC[C@@H](C/C1=N\OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)[C@@]2(C)CBr 33960381 XJKXRLUWKUHDCV-CFJZKHJGSA-N 429.698 4.982 50 10 IJGE O=C1CCc2cc([C@@H](Br)c3ccc(I)cc3)ccc2N1 40283389 ABPLEKNUFHJKLC-INIZCTEOSA-N 442.094 4.660 50 10 IJGE O=[N+]([O-])c1ccccc1C[C@@H](Br)c1csc(I)c1 124510970 HUCRSUCKUQGDLO-SNVBAGLBSA-N 438.084 4.940 50 10 IJGE CC(C)COc1ccccc1/C=N\NC(=O)c1ccc2[nH]c(Cc3ccccc3)nc2c1 169925742 XADZCRHQJWJJLP-YUMHPJSZSA-N 426.520 4.952 50 10 IJGE COc1cc(Br)c([C@H]2CC[C@](C)(CI)O2)cc1OC 311903448 BIPXIZNYPSXVRL-BXUZGUMPSA-N 441.103 4.512 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(OC[C@@H]2C[C@@H]3CCCC[C@H]3O2)C1 393257656 AKAUOIZGPIFTER-MIALQEHNSA-N 432.399 4.515 50 10 IJGE O=C(N[C@@H]1CCC[C@H](Br)C1)c1cc(Br)ccc1Br 694508038 STDCRMFCDNASCO-WCBMZHEXSA-N 439.973 4.648 50 10 IJGE Cc1sc([C@H](Br)c2cn(C)c(Br)n2)cc1Br 698416509 ANZRTTVOFDGMJG-SECBINFHSA-N 428.975 4.799 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H]1Cn1c(CCl)nc2cc(Br)cnc21 708510691 UVRWHLIDYKJWRK-GOEBONIOSA-N 433.781 4.701 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NC(=O)c1cc(Br)ccc1Br 716936352 FUVMWKNILQOHNI-SCZZXKLOSA-N 441.989 4.894 50 10 IJGE COc1ccc(CSCC(=O)NN=Cc2cc(C)n(-c3ccc(F)cc3)c2C)cc1 725418753 JELKTUTVHYXFIN-UHFFFAOYSA-N 425.529 4.625 50 10 IJGE Cc1ccc(F)c(NNC(=O)CCc2nc(C)c(-c3ccc(Br)cc3)o2)c1 760133667 CALGQXFCGMSSKL-UHFFFAOYSA-N 432.293 4.936 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OCc2cccc(F)c2Cl)c(-c2ccccc2)n1 771849542 FJULXYDGLMCHGF-LDADJPATSA-N 434.858 4.907 50 10 IJGE N#Cc1ccc(NNC(=O)NCc2cccc(NC(=O)C3CCCC3)c2)c(C(F)(F)F)c1 799555815 FVORHPMDZJNNTQ-UHFFFAOYSA-N 445.445 4.532 50 10 IJGE C[C@@H](OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)c1ccc(F)cc1F 920155670 BPEADYPLAWORAJ-YAJBTMAUSA-N 432.430 4.953 50 10 IJGE C[C@H](Cc1ccc(F)c(Br)c1)C(=O)NNc1nc2ccccc2[nH]c1=S 1470319857 RBNJLCFVOPXOOX-SNVBAGLBSA-N 435.322 4.516 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C)c1cccc(C(F)(F)F)c1 1538922137 ZRPZHURRLNZNBN-NTCAYCPXSA-N 441.453 4.977 50 10 IJGE O=[N+]([O-])c1ccccc1-n1nc(-c2cccc(I)c2)cc1CCl 1614821024 OELFOJHEPRBJJK-UHFFFAOYSA-N 439.640 4.791 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)NNC(=O)c1ccc(CSC(C)C)o1 1865757377 ZXNIQZHYKATAQH-UHFFFAOYSA-N 445.491 4.645 50 10 IJGE CC[C@](C)(NC(=O)CCCC(=O)c1cccs1)C(=O)Nc1ccc(SC#N)cc1 1866792542 MGYFXYJEMWIMHN-NRFANRHFSA-N 429.567 4.598 50 10 IJGE CC(C)[C@H](C(=O)NCC(=O)Nc1ccc(SC#N)cc1)c1ccc(Br)cc1 1868150560 BNQAURCVHHATRI-IBGZPJMESA-N 446.370 4.517 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1F 1915272117 ICRJPLNDDMAHSW-QGZVFWFLSA-N 441.272 4.935 50 10 IJGE CCn1cc([C@H](Br)Cc2ncccc2Br)nc1Br 1924866085 RGGMDLLPHIKQCY-SECBINFHSA-N 437.961 4.502 50 10 IJGE CCN(C)C[C@@H](Br)CCc1cc(Cl)ccc1I 1949934643 ICHVISAMMVLIMJ-NSHDSACASA-N 430.555 4.592 50 10 IJGE CCC[C@@](C)(CCl)NC(=O)c1cc(Br)ccc1I 2029946134 SKFQUKFCBPFYBH-ZDUSSCGKSA-N 444.538 4.581 50 10 IJGE CCC[C@H](Br)CCNC(=O)c1cccc(Br)c1Br 2031482195 PNDKQHDHYNMIOX-VIFPVBQESA-N 441.989 4.895 50 10 IJGE F[C@@]1(CBr)CCCN(Cc2cc(Cl)ccc2I)C1 2039786281 BEVGNGJDIPMUCJ-CYBMUJFWSA-N 446.529 4.644 50 10 IJGE CC(C)(C)OC(=O)NCC[S@@](=O)(=NCC1(CBr)CCC1)c1ccccc1 2107390309 DDDHYLUQYIRABE-SANMLTNESA-N 445.423 4.603 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1[C@H]2CC[C@@H]1C[C@H](CBr)C2 2128152277 RAFBUFSHBZNMJZ-AYMMMOKOSA-N 427.589 4.942 50 10 IJGE ClCCc1nc2cncc(Br)c2n1Cc1ccc(Br)s1 2151790650 RBDQDVHSGUSXHQ-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE F[C@@]12CCC[C@@]1(CCl)CN(Cc1cc(Cl)ccc1I)C2 2176637283 UCUBAYSRZLIDNS-HUUCEWRRSA-N 428.116 4.878 50 10 IJGE Brc1cccc([C@@H](CI)OC2CC(n3ccnc3)C2)c1 2183689875 WHQWPWXATVDYFS-YMAMQOFZSA-N 447.114 4.542 50 10 IJGE CCCN(CCCCCI)C1CCN(Cc2ccccc2)CC1 2211188067 DUFGGGHCKIVYKY-UHFFFAOYSA-N 428.402 4.968 50 10 IJGE Clc1nc(N2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)sc1CBr 2213940855 XRDCGCKGJVPHNB-GASCZTMLSA-N 426.811 4.935 50 10 IJGE Cc1ccc(C(=O)N2[C@@H](CBr)CCC23CCC3)cc1I 2232825006 DXJVMSOALFARRZ-CYBMUJFWSA-N 448.142 4.522 50 10 IJGE Fc1ccccc1[C@H](CI)O[C@H]1CCN(Cc2ccccc2)C1 2244803765 YZAUEYXAHVYYSZ-LPHOPBHVSA-N 425.285 4.593 50 10 IJGE O=S1(=O)CCC[C@H]1[C@H](Cl)c1cc(Br)ccc1OCc1ccccc1 2299535628 REMBCTNSMVZDLK-ZWKOTPCHSA-N 429.763 4.885 50 10 IJGE CCC[C@@H](Br)CCNC(=O)c1ccc(Cl)cc1I 2317776578 XUAFUJOOBRWIIH-SECBINFHSA-N 444.538 4.628 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NN=Cc2ccc(F)c(Br)c2)c(C)n1 2321250861 AXDFAWJROUCAQF-UHFFFAOYSA-N 442.288 4.731 50 10 IJGE C[C@@H]1CCC[C@@H](CO[C@@H](CI)c2ccccc2Br)O1 2338867664 QUUSRXBUEHVIDO-XUJVJEKNSA-N 439.131 4.899 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@H]1CCC[C@H](C(F)(F)F)C1 2343414619 QCAQKYUXQBNMKO-YESZJQIVSA-N 436.312 4.842 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1CCCl)c1ccc(Cl)cc1I 2365600237 ZTHHENDPKPBMLB-HZMBPMFUSA-N 426.125 4.862 50 10 IJGE O=C(N/N=C/c1ccccc1Oc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccncc1 3094845 AGBAZJNFXPQYIG-BRJLIKDPSA-N 430.342 4.565 50 10 IJGE COc1ccc(C(=O)Oc2cc(/C=C(/C#N)C(=O)Nc3ccccc3C)ccc2OC)cc1 33339001 NVODYUNDOSTTKE-ZHZULCJRSA-N 442.471 4.777 50 10 IJGE C[C@H](Br)[C@](Br)(CBr)C(=O)Oc1ccccc1Cl 205782719 CRFLXWUXTJXTLN-WRWORJQWSA-N 449.364 4.557 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc(COc3ccccc3Cl)o2)c(OC)c1C 252589645 ALSZPRQIWXWJGV-UHFFFAOYSA-N 428.872 4.602 50 10 IJGE aggregator CCn1c(SCC(=O)NN=C/C(Cl)=C/c2ccccc2)nnc1-c1ccc(C)cc1 254476070 ZXQAORULRONPBA-PXWWHBEFSA-N 439.972 4.747 50 10 IJGE CC(=NNC(=O)/C(=C/c1cccs1)NC(=O)c1ccccc1)c1ccc2c(c1)CCCC2 254478674 HDOQQTXZSSNRKG-CLIDQISESA-N 443.572 4.938 50 10 IJGE CC(C)[C@@](C)(CBr)NC(=O)c1ccc(Br)cc1Br 398563635 NBDLILSHBOETGA-CYBMUJFWSA-N 441.989 4.751 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2CCc3ccc(F)cc32)c(-c2ccc(Cl)cc2)n1 746805681 CHLPQVSVVFNWID-LDADJPATSA-N 445.885 4.753 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)c(C)n1-c1ccc(C(=O)O)c(Cl)c1 1084040189 YZJLQGUINXEYOK-YBFXNURJSA-N 433.895 4.669 50 10 IJGE C/C(=C/c1ccccc1Cl)C(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1 1650629266 UUZDHJKQJXHHJS-VKAVYKQESA-N 445.906 4.508 50 10 IJGE CC(C)(C)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccn2)cc1 1865682167 HSVPALPVALBULP-QGZVFWFLSA-N 439.441 4.802 50 10 IJGE Cc1ccsc1[C@@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2Cc1ccccc1F 1865698965 HBDPCBKSRQHHEZ-CQSZACIVSA-N 434.418 4.677 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706466 XLWYJLPBJOGBSC-JOCHJYFZSA-N 443.507 4.627 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccc(F)cc2)cc1 1865709277 SQRNMCRBSPWSJX-SFHVURJKSA-N 442.416 4.870 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2ccc(C)cc2)sc(C(=O)OC(C)C)c1C 1866127313 XIRKORSTYRTIJU-GZTJUZNOSA-N 440.521 4.653 50 10 IJGE CCCC[C@@H](NC(=O)Cc1cc(-c2ccccc2)on1)C(=O)Nc1ccc(SC#N)cc1 1866914445 WZZMPCXDXLSJIG-OAQYLSRUSA-N 448.548 4.771 50 10 IJGE C[C@@H]([C@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1)[C@@H](CBr)NC(=O)OC(C)(C)C 1884034200 GLUDYOZOFOXJDC-CAOSSQGBSA-N 449.430 4.994 50 10 IJGE CN(N[C@@H]1CCN(C(=O)OC(C)(C)C)C2(CCCCC2)C1)C(=O)OCc1ccccc1 1891720733 JEWXZTGRTNMCNO-HXUWFJFHSA-N 431.577 4.862 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1c(F)ccc([N+](=O)[O-])c1F 1915091011 RTFFWQKDXNPANR-LBPRGKRZSA-N 427.245 4.689 50 10 IJGE Cc1cc(F)cc(C)c1S(=O)(=O)N(Cc1ccccc1)[C@H](C)CCBr 1915094171 DTRHXNVDMSUJFW-MRXNPFEDSA-N 428.367 4.807 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1c(F)ccc([N+](=O)[O-])c1F 1915097176 RGJVMSAXAXGNPQ-ZDUSSCGKSA-N 427.245 4.689 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1ccncc1Br 1915768885 VPFAPXHOVWGWHL-UHFFFAOYSA-N 426.152 4.660 50 10 IJGE C[C@@H]1OCCO[C@H]1[C@@H](Br)c1cc(Br)sc1Br 1935544136 ZMBXYBCWJUXTII-WLGLDCGKSA-N 434.975 4.513 50 10 IJGE CC[C@@H](Br)[C@@H](C)NC(=O)c1csc(Br)c1Br 1937737074 CNRDBQISZANWLA-IYSWYEEDSA-N 433.991 4.565 50 10 IJGE CC[C@H](Br)CCNC(=O)c1csc(Br)c1Br 1937737555 KPRNVZPHMIRQNL-LURJTMIESA-N 433.991 4.567 50 10 IJGE O=C(OCc1ccccc1)N1CCC2(CC1)CCN2C[C@H](CBr)CC1CC1 2003376390 GFSOPDVAWNZXED-FQEVSTJZSA-N 435.406 4.675 50 10 IJGE C[C@@H]1OCC[C@]1(CBr)Cc1cc(Br)ccc1Br 2006502110 XPXBMFWAWUBHDO-TVQRCGJNSA-N 426.974 4.944 50 10 IJGE O=S(=O)(c1ccc(CBr)cc1Cl)N(Cc1ccccc1)CC1CC1 2009621250 CQGNDPODQWNVBY-UHFFFAOYSA-N 428.779 4.836 50 10 IJGE C[P@]1(=O)C[C@H](Br)[C@H](Cc2ccc(I)c(Cl)c2)C1 2026559707 CPQUKMUPJVLUEA-GPHJXTMHSA-N 447.478 4.873 50 10 IJGE C[C@H](CCBr)CCNC(=O)c1cccc(Br)c1Br 2031479438 XUCZZTMKASBLCE-SECBINFHSA-N 441.989 4.753 50 10 IJGE BrC[C@]12CC[C@@H]1CN(Cc1cc(Br)ccc1Br)C2 2078148055 QYLSFTMWRGIKJP-RISCZKNCSA-N 438.001 4.819 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@@H](Br)C(F)(F)F 2106781885 LVVKWGWESBUMNM-OAHLLOKOSA-N 437.300 4.790 50 10 IJGE CC(C)(C)OC(=O)NCc1cccc2c1N(C[C@H](Br)C(F)(F)F)CCC2 2106784769 LAVXDIWORGHEKM-AWEZNQCLSA-N 437.300 4.790 50 10 IJGE Fc1c(CN2CCSC[C@H]2CCBr)ccc(Cl)c1Br 2110525416 CRTAVRQMRMBCGN-SNVBAGLBSA-N 431.596 4.944 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CCCN(C[C@H](CBr)CC3CC3)C2)C1 2112868323 IRBAGDXEOAZZAM-GHTZIAJQSA-N 429.443 4.911 50 10 IJGE Clc1cc(N2CC[C@H]3OCCN(Cc4ccccc4)[C@H]3C2)ccc1CBr 2129050495 DILVKKWYZPUBOQ-LEWJYISDSA-N 435.793 4.715 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H]3CC[C@@H](CN3CC3(CBr)CCCCC3)[C@H]2C1 2163061867 IMOUUZJZAOEFKI-RDGPPVDQSA-N 441.454 4.909 50 10 IJGE CN(C(=O)c1cc(Cl)ccc1I)C1(CCl)CCSCC1 2171186725 XYSUDSMGCDLIKX-UHFFFAOYSA-N 444.165 4.521 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N[C@@H](C)CCCCCBr)c1Br 2174530912 VWRWPLVSSJNJBI-VIFPVBQESA-N 447.258 4.750 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2C1[C@H]2C[C@H]1CN(Cc1ccccc1)C2 2184942765 UVPMEBKOFLRLOC-HOTGVXAUSA-N 445.792 4.934 50 10 IJGE BrC[C@@H]1C[C@@H]2CCCC[C@H]2N1Cc1ccc(I)cc1 2231964297 KNASCRFVGUYHQI-CWRNSKLLSA-N 434.159 4.819 50 10 IJGE Cc1ccc(CBr)cc1NC(=O)c1csc(I)c1 2264066926 QOXKAEPVYAMMOQ-UHFFFAOYSA-N 436.112 4.808 50 10 IJGE CC1CC(CBr)(CN2CCC[C@@H]([C@@H]3CCCN3C(=O)OC(C)(C)C)C2)C1 2265311453 HDJXCFPXWXSSRG-IOBOIYPZSA-N 429.443 4.909 50 10 IJGE C[C@@]1(NCc2ccc(I)c(Br)c2)CCC[C@H]1Cl 2306226701 HLCWOYUXGPRUMY-CHWSQXEVSA-N 428.539 4.693 50 10 IJGE Cc1ccc(-n2c(C)cc(C=C(C#N)C(=O)N3CCN(c4ccccc4)CC3)c2C)c(C)c1 2313545901 NDJHSTZUKWGYCV-UHFFFAOYSA-N 438.575 4.967 50 10 IJGE CC[C@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@H]1CBr 2315548977 MWGFVAHWOHDOAU-NWDGAFQWSA-N 442.566 4.798 50 10 IJGE COc1ccc([N+](=O)[O-])cc1NC=C(C#N)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 2318463241 ZHYYWWQEYYOQEU-UHFFFAOYSA-N 440.765 4.734 50 10 IJGE O=C(NN=Cc1ccc(Cl)c(Cl)c1)c1cccn(Cc2cccc(Cl)c2)c1=O 2323652610 GIXDTRDSUAURFU-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE Cl[C@@H]1CCC[C@@H](CNCc2ccc(I)c(Br)c2)C1 2325224068 SVJWECGUWTZUKK-ZYHUDNBSSA-N 442.566 4.941 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@H]2C[C@H](Cl)CC[C@H]21 2328608804 WBXIGAGWDQPYFX-QXFUBDJGSA-N 427.589 4.895 50 10 IJGE CC(C)C[C@H](CBr)CN1CC[C@H](NC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2353821909 GUWPVROXWYVSGP-ILXRZTDVSA-N 445.364 4.964 50 10 IJGE O=C(N/N=C(\C=N\NC(=O)c1ccccc1Cl)c1ccccc1)c1ccccc1Cl 3093500 JKOGSDMGVNWNMV-YUWLOUFQSA-N 439.302 4.543 50 10 IJGE CC(C)CCOc1ccc(Br)cc1C(=O)NNC(=O)c1ccc(Cl)cc1 14650685 GDWSRLLZYYVNAK-UHFFFAOYSA-N 439.737 4.602 50 10 IJGE O=C1/C(=N/NC(=O)C23CC4CC(CC(C4)C2)C3)c2ccccc2N1Cc1ccccc1Cl 59166737 AXNDVLFLOJJNBV-WEMUOSSPSA-N 447.966 4.924 50 10 IJGE CCc1ccccc1NC(=O)N/N=C/c1ccc(OCc2cccc(C(=O)O)c2)c(OC)c1 59302488 VOCNVVBCSHEFDI-CVKSISIWSA-N 447.491 4.690 50 10 IJGE C=CCNC(=O)/C(C#N)=C1\S[C@@H](Cc2ccccc2F)C(=O)N1c1ccc(C(C)C)cc1 101241539 MXSMVMPYFGKAKB-WTALZMIHSA-N 449.551 4.678 50 10 IJGE CCOC(=O)c1cnc(Cl)c2c(CC(Br)Br)csc12 104909024 GQQQFQOKLXJVTM-UHFFFAOYSA-N 427.545 4.785 50 10 IJGE COc1ccc(OC)c([C@@H](Br)c2ccccc2I)c1 109842775 RVKLVBVBLXNJHR-HNNXBMFYSA-N 433.083 4.793 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1)/C(=C\c1ccccc1Cl)NC(=O)c1ccccc1 254624072 LCYJZOHDVNHRPV-GGASWYGPSA-N 438.314 4.915 50 10 IJGE C[C@H](Br)[C@@H]1CCN(Cc2cc(Cl)ccc2I)C1 719749185 UZFHSLYGYKKARK-VHSXEESVSA-N 428.539 4.550 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1CC[C@@H]1CCN(Cc2ccccc2)C1 723938086 JWTUWHWFMCNFHB-KRWDZBQOSA-N 447.808 4.887 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc(-c3nc4ccccc4s3)o2)c1C 736696245 BGDPAVNYAMHXNA-UHFFFAOYSA-N 442.504 4.782 50 10 IJGE CC(C)(C(=O)NNc1ccc(F)c(F)c1F)c1csc(-c2cc(F)ccc2F)n1 810327259 GMNPHGMELXDMBO-UHFFFAOYSA-N 427.398 4.927 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C/c2cc(Br)cc(Br)c2O)cc1 1084626792 JHTALYALUZLMPW-WUXMJOGZSA-N 436.103 4.771 50 10 IJGE C#CCOc1ccccc1CNC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2)c1C 1444159167 LRPOMIIEMJUELU-HMAPJEAMSA-N 443.934 4.983 50 10 IJGE Cc1c(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)nc(O)c2ccccc12 1624162238 JKNZOGNEIHBWJB-OAHLLOKOSA-N 437.565 4.536 50 10 IJGE N#CSc1ccc(NC(=O)c2cccc(NC(=O)c3ccc(Br)o3)n2)cc1 1860557000 IHQRRFBBXYNVNB-UHFFFAOYSA-N 443.282 4.515 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1cc(C)ccc1O)C(C#N)=C(N)O2 1865686984 GTEHAHGHBQJUIG-NRFANRHFSA-N 434.927 4.770 50 10 IJGE CCc1nn(-c2ccc(Br)cc2)c2c1[C@@H](c1cccc(C)c1)C(C#N)=C(N)O2 1865710702 FRLAGLIDHBJMSE-IBGZPJMESA-N 435.325 4.724 50 10 IJGE Cc1nn(Cc2ccccc2)c2c1[C@H](NC(=O)/C(C#N)=C/c1cccc(Cl)c1)CCC2 1866130023 WSXABTDNDSNEEF-WVWKGNOCSA-N 430.939 4.994 50 10 IJGE Cc1ccccc1-c1nc(Nc2ccc(SC#N)cc2)cc(N2CCC[C@@H](CO)C2)n1 1868301784 YAHTXRBUCFSSRT-GOSISDBHSA-N 431.565 4.978 50 10 IJGE COc1cc(/C(O)=C(\C#N)c2nc(-c3ccc(F)c(F)c3)cs2)c([N+](=O)[O-])cc1OC 1872751851 XBQOVZLQGRLHOB-UNOMPAQXSA-N 445.403 4.964 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCC[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21 1882066946 OQOLOYILZZDBHR-ZJIFWQFVSA-N 447.414 4.558 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cccc2cnccc12 1915078413 PWWCJOGURXVTHA-SFHVURJKSA-N 433.371 4.599 50 10 IJGE O=S(=O)(c1ccc(Br)cc1F)N(Cc1ccccc1)[C@@H](CCl)C1CC1 1915143100 KCYHPEHDFKFLNP-KRWDZBQOSA-N 446.769 4.797 50 10 IJGE COc1ccc(CC(=O)N(Cc2ccccc2)[C@H](CBr)C(C)C)cc1OC 1915272621 JSJIIRZPHVECRQ-LJQANCHMSA-N 434.374 4.695 50 10 IJGE COC(CBr)(CBr)Cc1cccc(Br)c1Cl 1979519211 CXUUCZLSUAMIOS-UHFFFAOYSA-N 435.381 4.820 50 10 IJGE C[C@H]1CC[C@H](CBr)N(Cc2cc(Cl)ccc2I)C1 2048064052 RUEPHGMIKGAGBT-GXFFZTMASA-N 442.566 4.940 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CCCC[C@H](Br)C1 2050107142 BPEBMIIPGHCGNA-JTQLQIEISA-N 439.973 4.601 50 10 IJGE C[C@H](Cl)C[C@@H]1CCCCN1c1ncc(I)cc1Br 2069526375 VFRNGUHKWCDXFN-ONGXEEELSA-N 443.554 4.825 50 10 IJGE CCCOCCCO[C@@](C)(CI)c1ccccc1Br 2092639472 VGTJHTNKORYFPZ-HNNXBMFYSA-N 441.147 4.933 50 10 IJGE CC[C@@H]1CCOC[C@@H]1O[C@@H](CI)c1cccc(Br)c1 2096207828 QNGNAVZQOBDORP-UGFHNGPFSA-N 439.131 4.757 50 10 IJGE Fc1ccc2nc(CCl)n([C@@]34C[C@H]3CN(Cc3ccccc3)C4)c2c1Br 2099679047 NJPRJXAYCAGYAM-VBKZILBWSA-N 434.740 4.908 50 10 IJGE CC(C)[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1c1ccccc1 2106785805 QXXGPKAXIPKNKV-RBUKOAKNSA-N 425.411 4.948 50 10 IJGE Cl[C@H](c1cc(Br)sn1)c1cc2c(cc1Br)OCCO2 2120041041 UGNNAHRIQGSFDA-LBPRGKRZSA-N 425.529 4.768 50 10 IJGE CCC[C@H]1CN(C(=O)c2ccc(I)c(Cl)c2)C[C@H]1CCl 2205698767 SQUVYYUNGYAGKO-NWDGAFQWSA-N 426.125 4.672 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C(F)(F)F)CCCN1CCCCCCBr 2223283130 PFVFWBXQNDMLKK-INIZCTEOSA-N 431.337 4.863 50 10 IJGE Fc1cccc([C@H](CBr)OCCOCCOCCOCc2ccccc2)c1 2236088036 BLSVNYKJTTZZFT-NRFANRHFSA-N 441.337 4.528 50 10 IJGE CCn1nc(C)c(CBr)c1N1CC[C@]2(CCCN(Cc3ccccc3)C2)C1 2281302208 QSPPZBJYKOPKLU-QFIPXVFZSA-N 431.422 4.599 50 10 IJGE Cc1c(CBr)cccc1NS(=O)(=O)Cc1ccsc1Br 2283650462 VFONEFWFQRPJMP-UHFFFAOYSA-N 439.194 4.656 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1OCc1ccccc1 2297551479 NADHNTWBKFDHFX-UHFFFAOYSA-N 447.422 4.867 50 10 IJGE N#CC(=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] 2297551480 NAFMGPRRQGNLGU-UHFFFAOYSA-N 438.783 4.962 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1Br 2313671230 SYHSGQUZKMYPDO-UHFFFAOYSA-N 436.649 4.565 50 10 IJGE C[C@H](Br)CCCN(C)C(=O)c1c(Br)cccc1Br 2314577494 WELQIKPNCWGJEE-VIFPVBQESA-N 441.989 4.847 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@@H](Cc2ccc(CC)cc2)C(=O)N1c1ccc(CC)cc1 2314593196 JCUVDOZULBYTTA-QHCPKHFHSA-N 445.588 4.540 50 10 IJGE CC(C)[C@@H]1[C@@H](Br)CCN1Cc1cc(I)ccc1Cl 2327407706 UQUIJPZTDUZAHE-GXTWGEPZSA-N 442.566 4.938 50 10 IJGE Cc1scc(C(=O)NC[C@]2(F)CC[C@@H](CBr)CC2)c1Br 2369604005 NGGZTTOZQXRSDI-WJONMLJTSA-N 427.177 4.842 50 10 IJGE CC[C@@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)C(c1ccccc1)c1ccccc1 9872009 PANFEYSVUJELBP-WOJBJXKFSA-N 430.548 4.947 50 10 IJGE O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)c1cc(Cl)cc(Cl)c1 10384349 BHYYBYRRUOXUDH-UHFFFAOYSA-N 436.122 4.920 50 10 IJGE Cc1ccc(Nc2ncnc(NNC(=O)C(c3ccccc3)c3ccccc3)c2N)c(C)c1 40755477 VIEYRMRKQKSTCY-UHFFFAOYSA-N 438.535 4.694 50 10 IJGE Cc1cc(Cl)ccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccco1)CCC2 40814425 LMBWVAMJZDKPBJ-PCLIKHOPSA-N 425.872 4.866 50 10 IJGE Cc1ccc(OCCCC(=O)N/N=C/c2c(F)cccc2Cl)c(Br)c1 40951134 RZDWIXCNIXFZDM-SSDVNMTOSA-N 427.701 4.859 50 10 IJGE O=S(=O)(Nc1ccccc1CCl)c1cc(Br)ccc1Br 96873087 YUIVPKOHRUPWEQ-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE O=C(NC[C@H]1CC[C@@H](Br)C1)c1cc(Br)ccc1Br 227672424 SMNWVWINOSMCHL-DTWKUNHWSA-N 439.973 4.505 50 10 IJGE C[C@H]1CCC[C@H](OC2(CI)CCN(C(=O)OC(C)(C)C)CC2)C1 231314449 LSGDJJZKFHUSNX-GJZGRUSLSA-N 437.362 4.786 50 10 IJGE CCOC[C@@H](C)O[C@@](C)(CI)c1ccccc1Br 233760026 YLCZEADFTXDHBY-RISCZKNCSA-N 427.120 4.541 50 10 IJGE COC(=O)[C@H](C)[C@@H]1CC[C@@H]2[C@@]34CC[C@@]5(C[C@H](OC(C)=O)CC[C@]5(C)C3=CC[C@]12C)OO4 254592070 FOTZVCWKWXRZRV-DXOAQTQGSA-N 432.557 4.513 50 10 IJGE Cc1ccsc1[C@@H]1CN(C(=O)OCc2ccccc2)C[C@H]1CI 394745642 ZZVIBZWGJIRFHP-HZPDHXFCSA-N 441.334 4.844 50 10 IJGE C#CCn1ccc(CN(CCOC)C(=O)Nc2ccc(S(F)(F)(F)(F)F)cc2)n1 788663799 SPSKHDDLNXMKAE-UHFFFAOYSA-N 438.422 4.854 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CC(=O)NNc1ccc(C#N)cc1C(F)(F)F)c1ccccc1 799749049 KYSYVTALMGFVPI-GOSISDBHSA-N 448.445 4.676 50 10 IJGE Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799750680 CIVFILWOTWWABM-UHFFFAOYSA-N 434.418 4.989 50 10 IJGE C/C(=C/c1ccc(Br)o1)C(=O)NNc1c(F)cc(F)cc1Br 1126540593 ZBQQYMGHXYSZFP-DAXSKMNVSA-N 436.050 4.629 50 10 IJGE C=CCOc1ccc(Br)cc1NC(=O)NNc1ncnc(Cl)c1C(C)C 1476729601 OGUALUTWPNNIRU-UHFFFAOYSA-N 440.729 4.729 50 10 IJGE CCCc1nn(Cc2ccccc2)c2c1[C@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865701759 DSIUUFPSKMTZRL-XMMPIXPASA-N 441.579 4.948 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865709857 ISJXSVXEAOVVNQ-HXUWFJFHSA-N 449.898 4.664 50 10 IJGE COc1ccc(-c2nn(-c3ccc(Cl)cc3)c3c2[C@@H](c2ccc[nH]2)C(C#N)=C(N)O3)cc1 1865710003 MBLNOVTZTGDMHA-HXUWFJFHSA-N 443.894 4.748 50 10 IJGE Cc1nn(Cc2ccc(F)cc2)c2c1[C@@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2 1865711210 SHBWSMPHNJZMET-IBGZPJMESA-N 428.389 4.616 50 10 IJGE CCCSc1ccccc1C(=O)NNC(=O)c1ccc(-c2ccc(OC)cc2)nc1C 1865757192 QPNVVGCSOUVXDK-UHFFFAOYSA-N 435.549 4.643 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCC12CCN(C(=O)OC(C)(C)C)CC2 1882757004 ZWLVBCHVDJJWKU-LSDHHAIUSA-N 447.414 4.702 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CC(C)(C)[C@H]1C)C(=O)OC(C)(C)C 1901847544 DXQSJPWYGIUVCF-IYOUNJFTSA-N 439.378 4.888 50 10 IJGE COc1ccc(Br)cc1C(=O)N(Cc1ccccc1)[C@@H](C)CBr 1914215754 OATHYQQDKHXCKB-ZDUSSCGKSA-N 441.163 4.884 50 10 IJGE O=C(c1ccncc1Br)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915314552 SIKPMRLWZWWAJI-KRWDZBQOSA-N 438.163 4.660 50 10 IJGE CN(CCN(Cc1ccccc1)S(=O)(=O)c1cc(CCl)cs1)Cc1ccccc1 1931969690 WCLHRSZTTDRWJL-UHFFFAOYSA-N 449.041 4.810 50 10 IJGE C[C@@H]1CN(Cc2cccc(Br)c2Br)CC[C@H]1Br 1943881446 QYEYUKDANHDIMY-MWLCHTKSSA-N 425.990 4.817 50 10 IJGE C[C@@H](Br)C[C@@H](C)CNC(=O)c1csc(Br)c1Br 1945186804 NKYQXMBTHCFZCS-RNFRBKRXSA-N 448.018 4.813 50 10 IJGE C[C@@H](CCBr)CCNC(=O)c1csc(Br)c1Br 1945187372 VMODJORWUZEHJR-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE Cc1csc(CBr)c1S(=O)(=O)N(Cc1ccccc1)[C@@H](C)C1CC1 2009640821 XQEUGLMRNUPQFB-AWEZNQCLSA-N 428.417 4.941 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1Cc1cccc(Br)c1Br 2018116070 YGUPTMGOIDUOBR-BXKDBHETSA-N 425.990 4.959 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1C(=O)c1scc(Br)c1Br 2018124036 VYUOPUACMFUXEG-XPUUQOCRSA-N 446.002 4.661 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC[C@@H]2CC23CCCC3)C1 2021267938 SSBNDZIEGMSZMA-HNAYVOBHSA-N 449.373 4.788 50 10 IJGE Cc1cccc(CO[C@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)c1 2024646470 COCBXJGNKJZEJW-IBGZPJMESA-N 445.341 4.716 50 10 IJGE O=C(CBr)c1c(I)ccc(C(F)F)c1C(F)(F)F 2060394061 XYMVOUJUOAHPOT-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC2(CC[C@H]1CCl)CC2 2097876447 FCOXOBJYVQXGPG-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE Cc1cc(C(=O)Nc2cccc(CBr)c2)ccc1I 2142106181 ILAOUQCYDYLPNK-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE C[C@@]1(CCl)CC(F)(F)CN1C(=O)c1cc(Br)cc(Br)c1 2159055471 WRIDHGGVLIEEDM-LBPRGKRZSA-N 431.502 4.690 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2Cc1nccn1Cc1ccccc1 2202293462 OBMNWDRWNLXTDB-UHFFFAOYSA-N 445.748 4.839 50 10 IJGE C[C@H]1[C@H](Br)C[C@@H](C)CN1Cc1ccc(I)c(Cl)c1 2220345117 QPCKGZYYZODVLR-JFGNBEQYSA-N 442.566 4.938 50 10 IJGE COc1ccc(N2CC[C@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c(CBr)c1 2235970543 QVTRNWZLIMPONP-TZIWHRDSSA-N 429.402 4.939 50 10 IJGE O=C(NC[C@H]1CCC[C@H]1CBr)c1cc(F)c(Br)cc1Cl 2282969516 DCSFZMSJSHZIIH-DTWKUNHWSA-N 427.539 4.783 50 10 IJGE C[C@H](CCCBr)CNCc1cc(I)ccc1Cl 2307329079 VVRODMNVPADPKY-SNVBAGLBSA-N 430.555 4.845 50 10 IJGE CCCCCCOc1ccc(C=C(C#N)C(=O)Nc2cccc(C(=O)OC)c2)cc1OC 2314728623 HLUVFVAWKKHYFP-UHFFFAOYSA-N 436.508 4.987 50 10 IJGE COc1cc(C=NNC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)cc(Br)c1OC 2323144453 JSHVESRHPROFON-UBWJNLJSSA-N 449.389 4.913 50 10 IJGE O=C(NN=Cc1c(Cl)cccc1Cl)c1cccn(Cc2ccccc2Cl)c1=O 2323653171 OAWRYYVMPNHGCC-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE COc1cc(C=NNC(=O)c2cc3ccccc3n2C)cc(OC)c1OCc1ccccc1 2323733101 ZHIXRRVKTCTOCG-UHFFFAOYSA-N 443.503 4.538 50 10 IJGE O=C(NN=Cc1c(F)cccc1Cl)c1ccc(Nc2nc(O)c3ccccc3n2)cc1 2323766237 PAACCZUFYQXWSG-UHFFFAOYSA-N 435.846 4.635 50 10 IJGE CC(C)C[C@H](CBr)CN1CCCN(C(=O)OC(C)(C)C)CC(F)(F)C1 2328519273 PXEITPKJMYTBCA-OAHLLOKOSA-N 427.374 4.622 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C)CN(C[C@@H](CBr)c2ccccc2)CC1(F)F 2379683780 UBOLCKVPHBFFLE-VQIMIIECSA-N 447.364 4.647 50 10 IJGE O=C(NC1CCCCCC1)[C@H](c1ccc(F)cc1)N(Cc1ccccc1)C(=O)CCl 3039032 SPKXGJCMYSHIML-QHCPKHFHSA-N 430.951 4.973 50 10 IJGE CCOc1c(I)cc(/C=C(/C#N)c2nc3ccccc3[nH]2)cc1OC 33399209 YJFNTXAFCGXTGR-JYRVWZFOSA-N 445.260 4.639 50 10 IJGE Cc1ccc(C(=O)NNc2ncnc(Oc3cc(C)c(Cl)c(C)c3)c2[N+](=O)[O-])cc1 40657492 HFNVQPRVYSWJRT-UHFFFAOYSA-N 427.848 4.513 50 10 IJGE CCOc1ccc2ccccc2c1/C=N/NC(=O)CSc1nnc(-c2ccccc2)s1 40947746 SLONHLXTTROBAS-ZVHZXABRSA-N 448.573 4.999 50 10 IJGE FC(F)(Br)OC(F)(F)C(F)(F)OOC(F)(F)C(F)(F)C(F)(F)F 97976239 NVEZAPBLDWADHV-UHFFFAOYSA-N 446.941 4.872 50 10 IJGE CC1(C)CC(N)CC(C)(C)N1/C=C(/C#N)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 217249837 SMUVOXUDRVKWLC-QXMHVHEDSA-N 428.886 4.685 50 10 IJGE CC[C@H](Br)[C@@H](CC)NC(=O)c1cc(Br)cc(Br)c1 313095282 WAPKEZUIWZEDRQ-NWDGAFQWSA-N 441.989 4.894 50 10 IJGE O=C(c1ccc(Br)c(Cl)c1)N1CCC(F)(F)[C@H](CBr)C1 403993025 SKXOLQAQXQFFKJ-SECBINFHSA-N 431.502 4.595 50 10 IJGE BrCCN1CCN(CCC=C2c3ccccc3Sc3ccccc32)CC1 575346806 PLTOTASWNUUBRB-UHFFFAOYSA-N 429.427 4.986 50 10 IJGE CN(C[C@@H]1CCCN(Cc2ccccc2)C1)c1nc2ccccn2c1CBr 720016538 KJNBQKHLJRHICK-IBGZPJMESA-N 427.390 4.578 50 10 IJGE Cc1cccc(NC(=S)NNC(=O)[C@@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)c1 732576941 DIYVSZDCFALDFS-XZOQPEGZSA-N 431.561 4.695 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cccc(COc3cccc(F)c3)c2)c1C 736695216 ZQHKUCXAIRNKJL-UHFFFAOYSA-N 443.482 4.630 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 756184985 VXMZVDZLOCIVRP-UHFFFAOYSA-N 443.290 4.712 50 10 IJGE Cc1ccc(Sc2c(Cl)cccc2NC(=O)C(=O)NNc2ccc(C)cn2)cc1 783485518 PRODAOOQRWDCMD-UHFFFAOYSA-N 426.929 4.585 50 10 IJGE N#C/C(=C\c1ncc(I)s1)c1ncc(C(F)(F)F)cc1Cl 794697723 LUXFLPQXEFKBDI-LZCJLJQNSA-N 441.603 4.879 50 10 IJGE C=C(CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1c1cccc(Cl)c1 1460009549 SMLNQGGLHZFLSQ-KRWDZBQOSA-N 429.786 4.885 50 10 IJGE Cc1cccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4ccc(Cl)cn4)c(C)c32)c1 1772744702 GRGZYTKDXSGHPO-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE CC[C@@H](Oc1cccnc1NC(=O)Nc1ccc(SC#N)cc1)C(=O)OCC(C)C 1858856739 XHRFEJHXTLBESX-QGZVFWFLSA-N 428.514 4.655 50 10 IJGE COc1ccc(-c2nn(Cc3ccccc3F)c3c2[C@H](c2ccco2)C(C#N)=C(N)O3)cc1 1865697864 DGFCWNCNEDDKNL-NRFANRHFSA-N 442.450 4.557 50 10 IJGE COc1ccc(-c2nn(Cc3ccc(C)cc3)c3c2[C@@H](c2cccnc2)C(C#N)=C(N)O3)cc1 1865700351 QPSCOVAWZHIBIQ-QHCPKHFHSA-N 449.514 4.529 50 10 IJGE COc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2-c1ccccc1Cl 1865709980 LSSXXLWQTLHRKG-INIZCTEOSA-N 446.816 4.771 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)c1ccc(F)cc1F 1865759217 OGRFBAQQXWPRDT-UHFFFAOYSA-N 436.245 4.717 50 10 IJGE N#C/C(=C\c1ccc(Br)cc1)C(=O)Nc1nc2ccc([N+](=O)[O-])cc2s1 1866129160 FUIDCBUDSUYMIA-YRNVUSSQSA-N 429.255 4.513 50 10 IJGE CC[C@@](C)(NC(=O)C[C@H](C)c1cccc(OC)c1)C(=O)Nc1ccc(SC#N)cc1 1867109977 GBHMBBYQPGVEJN-QMHKHESXSA-N 425.554 4.686 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(Br)c(O)c1 1914607961 NKBDVJRLIHSLRY-LBPRGKRZSA-N 427.136 4.581 50 10 IJGE CCc1nn(CC)c(CN(C)C[C@@H](Br)COCc2ccccc2)c1Cl 1916371963 XETGQHIQOVZZCY-MRXNPFEDSA-N 428.802 4.531 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1cccc(OCc2ccccc2)c1 2023034519 VNNWEXSJDHXSKE-BEFAXECRSA-N 437.321 4.845 50 10 IJGE CC[C@@H](C)[C@H](CBr)NC(=O)c1cc(Br)sc1Br 2023035376 IUGWOKGGXDRCRD-SVRRBLITSA-N 448.018 4.813 50 10 IJGE ClCCCC1(Nc2ncc(I)cc2Br)CCC1 2025419987 YDGCKYZESQPSNQ-UHFFFAOYSA-N 429.527 4.802 50 10 IJGE CC[C@H](C)[C@H](Br)CNC(=O)c1cc(Br)cc(Br)c1 2029977044 ILGDGQZSEBOVDJ-QPUJVOFHSA-N 441.989 4.751 50 10 IJGE CC(C)[C@H](Br)CN(C)C(=O)c1cc(Br)ccc1Br 2048729850 GHYCICVPQXLCLB-GFCCVEGCSA-N 441.989 4.703 50 10 IJGE C[C@@H](c1ccncc1Br)[C@@H](Br)c1cn(C)nc1Br 2052974903 CHKBIXLBGAAGPY-WRWORJQWSA-N 437.961 4.580 50 10 IJGE O=C(NN=CC1=C(N2CCOCC2)C(=Cc2ccccc2)CC1)Nc1ccc(Cl)cc1 2053607049 JLMWIWVRZYVAMU-UHFFFAOYSA-N 436.943 4.911 50 10 IJGE ClC[C@]12CCC[C@@]1(CNc1ncc(I)cc1Br)C2 2086659249 UVYLBMLLLJOBCM-OLZOCXBDSA-N 441.538 4.660 50 10 IJGE C[C@@H]1CCCN(Cc2ccc(I)c(Cl)c2)[C@@H]1CBr 2086661491 MXFIZDDQIBCFEB-QMTHXVAHSA-N 442.566 4.940 50 10 IJGE CC(C)[C@@H](CBr)CN1CC[C@](NC(=O)OC(C)(C)C)(c2ccccc2)C1 2106780832 BWIQFJRDDBQJIM-LAUBAEHRSA-N 425.411 4.779 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCCN(C[C@H](CBr)c2ccccc2)C1 2106781070 FCWHHNPANBHLCW-HKUYNNGSSA-N 425.411 4.792 50 10 IJGE CC(C)[C@@H](CBr)CN(C1CC1)[C@H](CCNC(=O)OC(C)(C)C)C(F)(F)F 2106788300 ONHRJESCGAKGGL-DZGCQCFKSA-N 445.364 4.964 50 10 IJGE O=C(NC[C@@H]1C[C@@H](Cl)C12CCC2)c1csc(Br)c1Br 2115610679 SWZAYIXUPGJXRB-IONNQARKSA-N 427.589 4.801 50 10 IJGE CCN(CC)[C@H](C)CO[C@H](CI)c1ccccc1Br 2119222328 YCAFGBQHGBUMJR-IUODEOHRSA-N 440.163 4.672 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@]2(C1)CN(C(=O)OC(C)(C)C)CCO2 2163063277 PJWZHSLKCOMVFV-NRFANRHFSA-N 447.458 4.680 50 10 IJGE C[C@@H](NC(=O)c1ccc(CBr)cc1)[C@@H](NC(=O)OC(C)(C)C)c1ccco1 2172878615 VSLFRDHUSPONQW-CXAGYDPISA-N 437.334 4.559 50 10 IJGE O=C(c1cc(Cl)cc(Br)c1)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Br)C2 2190680562 XBVKJQWLRIDICS-RNJOBUHISA-N 425.523 4.581 50 10 IJGE CN(CC1CC(Br)C1)C(=O)C[C@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 2196908738 ZOJIILFLKJWHCV-PCKAHOCUSA-N 437.378 4.547 50 10 IJGE COc1cc(Br)c([C@@H](Br)C2CC(Cl)C2)c(OC)c1OC 2197079666 FUGUMMSHHVYGMV-TYAJBCFHSA-N 428.548 4.928 50 10 IJGE CN(c1ncc(Br)cc1Br)[C@@H](CBr)CC1CC1 2213798422 NSYKUHFOMROMPQ-SNVBAGLBSA-N 426.978 4.606 50 10 IJGE FC(F)c1nc(-c2ccc(I)cc2)ncc1CBr 2221377792 RVUDBSSQHLTKMI-UHFFFAOYSA-N 425.014 4.581 50 10 IJGE CC(C)([C@H](Br)c1cc2sc(Br)cc2s1)S(C)(=O)=O 2263562732 FGFLOHBZIRPOJP-SNVBAGLBSA-N 432.224 4.985 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CC(F)(F)CN1CC1(CBr)CCCCCC1 2278900894 GOQYEHFFQUMZTQ-HNNXBMFYSA-N 439.385 4.956 50 10 IJGE O=C(NCC[C@@H]1CCCC[C@@H]1Cl)c1ccc(Cl)c(I)c1 2283671082 WXNHXQKFTZGYIX-JQWIXIFHSA-N 426.125 4.862 50 10 IJGE FC(F)(F)[C@H](Br)COCc1ccc(Cl)cc1I 2301810107 IBJCLYSGKLNDIZ-SECBINFHSA-N 443.428 4.787 50 10 IJGE COc1ccc(-c2ccc(C(=O)NN=Cc3ccc(C(F)(F)F)cc3)c(C)n2)cc1OC 2321248543 XIYBWDDENGVZKG-UHFFFAOYSA-N 443.425 4.857 50 10 IJGE O=C(NN=Cc1cc(Cl)c(O)c(Cl)c1)c1ccc2nc(Cc3ccccc3)[nH]c2c1 2323724288 WAWPBANUEUUEMJ-UHFFFAOYSA-N 439.302 4.930 50 10 IJGE CCOc1cc(C=NNC(=O)c2cc3ccccc3n2C)cc(Br)c1OCC 2323733233 NJGFUHFOXCYYOE-UHFFFAOYSA-N 444.329 4.502 50 10 IJGE O=C(NN=Cc1c(O)ccc2ccccc12)c1ccc(Nc2nc(O)c3ccccc3n2)cc1 2323766024 BSNMUIUPHWGSJQ-UHFFFAOYSA-N 449.470 4.702 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2OC[C@@H]3CCC[C@H]23)cc1I 2334464165 VLTZEJVSLMFACV-AZHAFVHUSA-N 437.115 4.551 50 10 IJGE CS(=O)(=O)c1ccc([C@H](Cl)c2sc(Cl)cc2I)cc1 2338562418 BROHTCGEMMEUFZ-NSHDSACASA-N 447.146 4.738 50 10 IJGE F[C@@]12CCC[C@]1(CCl)CN(Cc1ccc(Cl)c(I)c1)C2 2362380993 UTGJTPYZWFGZPZ-LSDHHAIUSA-N 428.116 4.878 50 10 IJGE COc1ccc(/C(C#N)=C\c2cccc(OC(=O)COc3ccccc3OC)c2)cc1OC 31902936 OEOTYIHGWJRNOQ-MOSHPQCFSA-N 445.471 4.761 50 10 IJGE O=C(CCCc1c(-c2ccccn2)[nH]c2ccc(Cl)cc12)NNC(=O)c1ccccc1 39852748 PXJQONGVWJFUII-UHFFFAOYSA-N 432.911 4.667 50 10 IJGE Oc1nc2ccc([C@@H](Br)c3ccc(I)cc3)cc2o1 40285815 WFBZVWOYXIANED-ZDUSSCGKSA-N 430.039 4.622 50 10 IJGE COc1cc(/C=N/NC(=O)c2cc3ccccc3o2)ccc1OCc1ccccc1C#N 59304829 GTYAIIVEWUQRGE-JFLMPSFJSA-N 425.444 4.656 50 10 IJGE CCCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C(/C#N)C(=O)NC(C)C)cc2OC)cc1 206433455 BKUWYIYDTFPHJX-ZABCAIROSA-N 448.519 4.534 50 10 IJGE N#C/C(=C/NCCc1cccc(Br)c1)C(=O)Nc1ccccc1C(F)(F)F 217067592 FJOVMCPWIQWVBY-OWBHPGMISA-N 438.247 4.646 50 10 IJGE COc1cccc(-c2cc(C(=O)NN=Cc3cccc(OC)c3OC)c3ccccc3n2)c1 252622210 NQTRZSUJDIHRGM-UHFFFAOYSA-N 441.487 4.692 50 10 IJGE CCCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)COc3ccccc3)cc2)cc1 254418986 DWSZLICZVIDUQQ-UHFFFAOYSA-N 446.503 4.614 50 10 IJGE CCCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3ccccc3)cc2OC)cc1 254702501 PIHUCEVNRUIMQI-UHFFFAOYSA-N 446.503 4.857 50 10 IJGE O=C(CCCCCC(=O)NN=Cc1ccc(Cl)s1)NN=Cc1ccc(Cl)s1 254855632 UFGOHRUNYFKXSS-UHFFFAOYSA-N 445.397 4.667 50 10 IJGE Nc1ccc(Cl)c([C@H]2CN(Cc3ccccc3)C[C@@H]2CI)c1 382696512 SFBRBWKAFIRAND-YOEHRIQHSA-N 426.729 4.573 50 10 IJGE O=C(NCCC1(CBr)CC1)c1cc(Br)ccc1Br 395972329 ZFPYKRCSDQLXGP-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccc([C@H]2COCCN2S(=O)(=O)c2ccccc2)cc1 616640913 CCDPYALMJIQDNB-JOCHJYFZSA-N 447.673 4.971 50 10 IJGE Cc1ccc([N+](=O)[O-])c([C@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)c1 725405156 HOJNCBDLQGGCPZ-WMZOPIPTSA-N 433.302 4.650 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cccc(OCc3cccs3)c2)c1C 736693884 JWSWBNRHLFHHTD-UHFFFAOYSA-N 431.521 4.553 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)c2c[nH]c3cccc(C)c23)c([N+](=O)[O-])cc1OC(F)F 826657261 CJVIJXQIDSYNTJ-AWNIVKPZSA-N 427.363 4.784 50 10 IJGE CCc1ccccc1NC(=O)C(=O)NN=Cc1cccc(OCc2ccccc2Cl)c1 1084028586 UYSIQKKRLVPGGD-UHFFFAOYSA-N 435.911 4.570 50 10 IJGE Cc1c([C@H]2CN(Cc3ccccc3)C[C@H]2CI)cccc1[N+](=O)[O-] 1614628005 BHHVQEDPYLAGND-AEFFLSMTSA-N 436.293 4.554 50 10 IJGE CC(=O)c1ccc(CCNC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 1623828499 OKPIWIBKAJZQJL-HZHRSRAPSA-N 429.495 4.702 50 10 IJGE Cc1nn(Cc2ccccc2F)c2c1[C@@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 1865685805 NHSHQFBWBYAXJP-SFHVURJKSA-N 429.282 4.904 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CCC)c1 1865694092 PHOWCPNJAKSQFA-QFIPXVFZSA-N 444.535 4.976 50 10 IJGE Cc1nc(Nc2ccc(SC#N)cc2)cc(N2CCN3CCc4c(F)cccc4[C@@H]3C2)n1 1868480063 FBGWMIXJKAVGGN-QFIPXVFZSA-N 446.555 4.660 50 10 IJGE CCCCOc1ccc(/C=C(\C#N)c2nc(O)c3cc(OC)c(OC)cc3n2)cc1OCC 1872727678 SAIOYTVICLTYDF-GZTJUZNOSA-N 449.507 4.994 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Cl)Cc1ccc(Br)c(Cl)c1F 1905341610 CECUZNZMRLIFQB-JTQLQIEISA-N 431.088 4.688 50 10 IJGE Cc1nn(-c2ccccc2)c(N(Cc2ccccc2)[C@H]2CCOC2)c1CBr 1915478920 JYYPSPCJSIQFFH-FQEVSTJZSA-N 426.358 4.871 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)c1ccc(CBr)cc1Br 2020227721 BPUNCPWUTQCNGY-XYPYZODXSA-N 425.990 4.954 50 10 IJGE CC(C)n1c(CBr)nnc1-c1cccc(Br)c1Br 2031485844 UHSWKSMSUNONRX-UHFFFAOYSA-N 437.961 4.946 50 10 IJGE CCCN1C[C@@H](Br)[C@H](Cc2ccc(Br)cc2Br)C1 2039263710 YFLTUZGHIJHPMJ-BXUZGUMPSA-N 440.017 4.859 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@H](Cl)CC2(CCC2)C1 2094999482 KRSDXGKCZZXNTK-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE CC(C)(C)OC(=O)N(CC(F)F)[C@H]1CCCN(CC2(CBr)CCCC2)C1 2106784130 GGXMYNFEAIBOPV-HNNXBMFYSA-N 439.385 4.908 50 10 IJGE C[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)N(C[C@H](CBr)c2ccccc2)C1 2106787545 ZTURUBRGGVOLQK-NZSAHSFTSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](NC(=O)c2ccc(CBr)cc2)CC1 2133337554 RDJWVONBPVPHQR-IAGOWNOFSA-N 425.367 4.537 50 10 IJGE C[C@@]1(COc2c(Br)cc(Br)cc2CCl)CSCCO1 2136557317 ZABZBUBDEUPZNE-CYBMUJFWSA-N 430.589 4.851 50 10 IJGE COc1cc2c(cc1Br)nc(CCCl)n2CCN(C)Cc1ccccc1 2137602858 ILKSGNXOYOFYMX-UHFFFAOYSA-N 436.781 4.721 50 10 IJGE O=C(N[C@H]1CN(Cc2ccccc2)C2(CCCC2)C1)c1ccc(CBr)cc1 2154527800 BAILEYHIXJACBJ-OAQYLSRUSA-N 427.386 4.899 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc2c(c1)N(C(=O)N1CCC(Br)CC1)CCC2 2162874482 WLKPLNLUODOJMD-UHFFFAOYSA-N 438.366 4.766 50 10 IJGE CCN(CC1(CBr)CCOCC1)[C@@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2163058838 OCLWODKORBLTTP-ZWKOTPCHSA-N 447.458 4.584 50 10 IJGE Cn1nc(CC(CCl)(CCl)c2ccc(Br)cc2)cc1Br 2168207425 BWYOJEMSVPSRDQ-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE Cc1sc(CBr)cc1S(=O)(=O)N(C)c1ccc(Br)cc1 2179812623 RMGKCOVCEXSMFC-UHFFFAOYSA-N 439.194 4.539 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]12CC[S@@](=O)(=NCCCCCCBr)C2 2223291838 WIXPJRXSSXDCAJ-CJAUYULYSA-N 437.444 4.583 50 10 IJGE CC(C)[S@@](=O)(=NCCCCCCBr)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2223291903 WLXIAESUZHRNGT-LMKMVOKYSA-N 439.460 4.828 50 10 IJGE C[C@H](CC[S@@](C)=O)n1c(CCl)nc2cc(Br)c(Br)cc21 2234063426 DHRHVKQDBGRZDV-ZPWHCFADSA-N 442.604 4.630 50 10 IJGE C[C@]1([C@H](Br)Cc2cc(Br)cc(Br)c2)CCOC1 2252836362 BFGVVBKGUJIPKP-OLZOCXBDSA-N 426.974 4.944 50 10 IJGE C[C@@H](Cl)CN(CC(C)(C)C)c1ncc(I)cc1Br 2259770421 QQDCQVCGEUHIDI-SECBINFHSA-N 445.570 4.929 50 10 IJGE CC(C)OC(=O)c1ccsc1NC(=O)C(C#N)=Cc1ccc(Br)s1 2295672375 ROKCNLGALQSEOD-UHFFFAOYSA-N 425.329 4.683 50 10 IJGE COc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(C)cc2)cc1 2314634250 NFBLGNZWRPZJSE-AREMUKBSSA-N 438.483 4.841 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)[C@@H](C)Oc2ccc(Cl)cc2C)cc1 2314776822 CMELECQTWWYROT-QGZVFWFLSA-N 440.927 4.845 50 10 IJGE CCCOc1c(C=NNC(=O)c2ccc3nc(-c4ccccc4)[nH]c3c2)cccc1OC 2318417760 FELFUHVGTHKOOB-UHFFFAOYSA-N 428.492 4.791 50 10 IJGE CC(C)[C@@H]1C[C@@H](Br)CN1Cc1ccc(Cl)cc1I 2321366865 ZNFBRLWPYLYYLL-RISCZKNCSA-N 442.566 4.938 50 10 IJGE Cl[C@H]1C[C@@H]2C[C@H]1C[C@@H]2NCc1ccc(I)c(Br)c1 2325231837 XGUNBOJZCMPMPQ-WRZDFSGXSA-N 440.550 4.549 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)c1 2340273494 WUFJSNYPYUYFRD-IRXDYDNUSA-N 435.793 4.812 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cc(F)ccc1C(F)F 2343416894 CHWKMOYZHAXRGZ-HNNXBMFYSA-N 430.264 4.864 50 10 IJGE O=C(NC[C@H]1CCC[C@@H](CCl)C1)c1ccc(Cl)cc1I 2365587158 UIKUOAJTBWWOQB-MNOVXSKESA-N 426.125 4.720 50 10 IJGE COc1ccc(N(C(=O)CCl)[C@H](C(=O)NC2CCCCC2)c2ccccc2F)cc1 3033996 GYUQWBJGCYYTHE-QFIPXVFZSA-N 432.923 4.596 50 10 IJGE CCOc1ccc(Br)cc1/C=N/NC(=O)COc1ccccc1C(C)(C)C 40911905 BSHNHGRKKWJCQL-YDZHTSKRSA-N 433.346 4.674 50 10 IJGE C=CCOc1ccccc1/C=N/NC(=O)COc1ccc(C(C)C)cc1Br 100437350 OASYYCFTZKKZNQ-YDZHTSKRSA-N 431.330 4.666 50 10 IJGE CCN1/C(=C(\C#N)c2nc(C#N)c(C#N)nc2Sc2ccc(C)cc2)Nc2ccccc21 103651209 DHYDSUZTYZGDPQ-HAVVHWLPSA-N 435.516 4.824 50 10 IJGE O=[N+]([O-])c1ccc(C[C@H](Br)c2csc(I)c2)cc1 124511230 LEEHUFBHUOYGLC-NSHDSACASA-N 438.084 4.940 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1Cc1sccc1Br 148436340 SGCQUCPGSNAMSP-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CC[C@@H](NC(=O)/C(C#N)=C\N[C@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 217189425 CCDOGXUQFZICQM-IGXFIWQZSA-N 447.579 4.908 50 10 IJGE ClCc1cc(I)cc2c(I)csc12 306619022 SRNMPZVQMOUFPL-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CCOCCCOc1c(Br)cc(Br)cc1CBr 310223068 XMDRRVDMZOZKIM-UHFFFAOYSA-N 430.962 4.912 50 10 IJGE C[C@H](Br)C[C@H]1CCCCN1C(=O)c1sccc1I 311059287 JMVICAQQJSAOOQ-VHSXEESVSA-N 442.160 4.521 50 10 IJGE Fc1cc2nc(CCl)n(C3[C@@H]4CN(Cc5ccccc5)C[C@@H]34)c2cc1Br 398452122 OJMUDXRUHSWAII-ZIAGYGMSSA-N 434.740 4.980 50 10 IJGE COc1ccc(NNC(=O)c2cc3sc(Nc4ccccc4OC)nc3s2)cc1 746887431 RWOJEHIRALZZAI-UHFFFAOYSA-N 426.523 4.876 50 10 IJGE CCN(CC)CC1CCN(C(=O)C(=O)Nc2cccc(S(F)(F)(F)(F)F)c2)CC1 762640606 PYTALNOGQVNRKW-UHFFFAOYSA-N 443.482 4.863 50 10 IJGE O=C(Nc1ccc2c(c1)CCCO2)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F 784163489 VQUBWQGAYYRZSL-GOSISDBHSA-N 444.862 4.808 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCn4c(C(C)C)nnc4[C@H]3C)c2C)cc1 784697974 FAKLJQFZKHXVLZ-YRXLECQKSA-N 442.567 4.628 50 10 IJGE CC(=O)Nc1ccc(C(=O)NN=Cc2ccc(COc3c(C)cccc3Cl)o2)cc1 1084120588 HLOSUQGCQVRIRB-UHFFFAOYSA-N 425.872 4.543 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNc2ncccc2Br)cc1 1472456536 XPTFWDFTOVVMEZ-UHFFFAOYSA-N 425.286 4.547 50 10 IJGE C[C@H](SCc1nc(O)c2ccccc2n1)C(=O)Oc1ccc([N+](=O)[O-])c2ccccc12 1517537338 ISIRLMMZGUGEGP-ZDUSSCGKSA-N 435.461 4.624 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCN(C[C@@H](CBr)C3CC3)C2)C1 1643212853 MIANQKOMPQWMHG-CEXWTWQISA-N 429.443 4.767 50 10 IJGE Cc1nn(Cc2ccc(F)cc2)c2c1[C@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2 1865711211 SHBWSMPHNJZMET-LJQANCHMSA-N 428.389 4.616 50 10 IJGE COc1ccccc1-c1ccc(C(=O)N/N=C\c2ccc(F)c(Br)c2)c(C)n1 1865762358 AXDFAWJROUCAQF-MSXFZWOLSA-N 442.288 4.731 50 10 IJGE N#C/C(=C(/O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2ccc(F)c(F)c2)cs1 1872751513 LLVFXWQXWDQFFD-ZESIPNTPSA-N 437.471 4.930 50 10 IJGE C[C@@H]1C[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)C1 1880756375 SYHMFMOZVXLZJT-KFWWJZLASA-N 435.403 4.558 50 10 IJGE C[C@@H]1C[C@@H]1CCCOC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1896109377 LJJLTEUSYVGDOT-CABCVRRESA-N 437.362 4.644 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC[C@@H]1C[C@H]1C1CCCC1 1897631600 IUJONRVOFKJHCA-MPGHIAIKSA-N 437.362 4.548 50 10 IJGE C[C@H](c1ccncc1Br)[C@@H](Br)c1c(Br)cnn1C 1924055626 HIXWUESUDRHNKC-RDDDGLTNSA-N 437.961 4.580 50 10 IJGE CN(NCc1scc(Br)c1Br)C(=O)OCc1ccccc1 1930752507 QTTJNVZMKPRINJ-UHFFFAOYSA-N 434.153 4.546 50 10 IJGE C[C@@H]1C[C@H]1N(CCBr)C(=O)c1scc(Br)c1Br 2002041297 PMQAHDUEMWKQHE-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)C[C@H]1C[C@H](Br)C1 2026583249 JQSYTRYKZFVORN-XYPYZODXSA-N 428.539 4.550 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3CC[C@@]2(CBr)C3)c1 2029252205 QEHKJZIECZCEOL-HZMBPMFUSA-N 440.550 4.694 50 10 IJGE Fc1ccc(Cn2nc(CBr)c(Br)c2C(F)(F)F)c(F)c1 2079231870 HRXJBIXKUFDJGC-UHFFFAOYSA-N 434.000 4.886 50 10 IJGE Cc1csc(CN(C)c2ncc(Br)c(CCl)n2)c1Br 2100799983 FLFLSMOJUNVZDA-UHFFFAOYSA-N 425.577 4.747 50 10 IJGE C[C@@H]1C[C@@H](C)N(C(=O)OC(C)(C)C)CCN1C[C@@H](CBr)c1ccccc1 2108184601 DUVXXECVPAMGHM-ZHALLVOQSA-N 425.411 4.885 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC2(CCC(Cl)CC2)C1 2124670839 IHZCEXWJYCPGFN-UHFFFAOYSA-N 427.589 4.897 50 10 IJGE O=C(c1cc(Br)ccc1Cl)N1CCC([C@@H](F)CBr)CC1 2163243447 CHKCTXBEXBHGTR-ZDUSSCGKSA-N 427.539 4.688 50 10 IJGE CC[C@@H](Br)[C@H]1CCCCN1S(=O)(=O)c1cc(C)c(Br)s1 2170612127 GSHWBNCSKFGWHI-GHMZBOCLSA-N 445.242 4.536 50 10 IJGE Cc1c(Cl)cc(CN2C[C@H](C)O[C@H](CCBr)C2)cc1Br 2179379841 CCRXTZGZSFFAMA-GXFFZTMASA-N 425.592 4.785 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Cl)C2 2190669253 BAIIZHUGXWZPJB-WTFGDDLMSA-N 425.523 4.534 50 10 IJGE BrCc1c(N2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)nc2sccn12 2226353630 GYUYQCBGNVIBJO-CALCHBBNSA-N 431.403 4.534 50 10 IJGE Clc1ccc(I)cc1OCCCCI 2242109598 FPPRHQVPGIHRDQ-UHFFFAOYSA-N 436.458 4.539 50 10 IJGE COc1ccc([C@@H](Br)CC2CCOCC2)cc1I 2257357603 YPOWZKUFDRKZLB-LBPRGKRZSA-N 425.104 4.553 50 10 IJGE BrCC(CBr)(Cc1ncco1)c1ccc(Br)cc1 2260806990 JNHVFDIDDYAXFY-UHFFFAOYSA-N 437.957 4.707 50 10 IJGE C[C@H]1C[C@@H](Cl)CCN1Cc1ccc(I)c(Br)c1 2306221634 KNNBADUSWQKFFA-ONGXEEELSA-N 428.539 4.645 50 10 IJGE CCC[C@@H](CCBr)NCc1cc(I)ccc1Cl 2307327900 HGNACEVMAVYMKU-LBPRGKRZSA-N 430.555 4.988 50 10 IJGE C=CCn1c(CCc2ccccc2)nnc1SCC(=O)NN=C(C)C=Cc1ccccc1 2313589010 XQHSHQWNPAOVSP-UHFFFAOYSA-N 445.592 4.547 50 10 IJGE Clc1ccc(CN2C[C@H]3[C@H](Br)CC[C@H]3C2)c(I)c1 2318529454 QJFAYBZCIZGCDR-ZWKOPEQDSA-N 440.550 4.550 50 10 IJGE CC(C)(C)c1nc(C(=O)N[C@H](CCBr)COCc2ccccc2)cs1 2320356867 SONQXPHCIASPJL-OAHLLOKOSA-N 425.392 4.541 50 10 IJGE C[C@H]1CC[C@@](CCl)(NCc2ccc(I)c(Br)c2)C1 2325232869 GYFLPNKNLCVKEW-IINYFYTJSA-N 442.566 4.941 50 10 IJGE N#CC(=C(O)CCN1C(=O)c2ccccc2C1=O)c1nc(-c2cccc(Cl)c2)cs1 2331293835 INGLCKZTMIHWID-UHFFFAOYSA-N 435.892 4.942 50 10 IJGE O=C(O)[C@H]1Nc2ccc(Cl)cc2[C@H]2[C@@H]1C[C@@H](Sc1ccccc1[N+](=O)[O-])[C@H]2Cl 8425370 FWTSKJIRYVHRKV-PIOPJCMFSA-N 439.320 4.999 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)N/N=C/c3ccccc3[N+](=O)[O-])cc2)cc1 12491832 KYLZNGNHPHTYIE-WGOQTCKBSA-N 444.491 4.909 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=S)NC(=O)c2sc3ccccc3c2Cl)cc1 13978951 WKFUYGNQBJDFBV-UHFFFAOYSA-N 445.997 4.802 50 10 IJGE CCCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(C)o2)cc1 38659233 OTESBFXCSHGSED-HSZRJFAPSA-N 430.460 4.814 50 10 IJGE Cc1c(C(=O)Oc2cccc3ccccc23)oc2c1/C(=N/NC(=O)c1ccncc1)CCC2 40814035 HNKZYPHALUBTSE-VFCFBJKWSA-N 439.471 4.826 50 10 IJGE CCCCCOc1ccc(/C=C/C(=O)Oc2cccc(/C=C(\C#N)C(=O)OC)c2)cc1OC 40926655 TZSJAYFVCLENOD-DTXJCZLISA-N 449.503 4.963 50 10 IJGE Cc1cc(/C=N/NC(=O)CC[C@H](O)c2ccccc2)c(C)n1-c1ccc(F)c(Cl)c1 58890746 GNOSQIRMUGGAPY-RVWJGDDESA-N 427.907 4.851 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(C)c1/C=N/NC(=O)CSCc1ccccc1 59157476 DCHLMAZPIUMLCX-WYMPLXKRSA-N 426.973 4.585 50 10 IJGE C[C@@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC/C2=N\NC(=O)c1ccc([N+](=O)[O-])cc1 59502062 KEQULFQWPVKPAT-KLEXSUDHSA-N 433.508 4.943 50 10 IJGE CCOC(=O)c1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCc3cccs3)c2C)cc1 83263179 WVVKLZAYCGMJQM-MOSHPQCFSA-N 433.533 4.556 50 10 IJGE COc1ccc(C=NNC(=O)c2[nH]c3ccc([N+](=O)[O-])cc3c2-c2ccccc2)cc1OC 254350194 LOQYIAFXGLQMNY-UHFFFAOYSA-N 444.447 4.524 50 10 IJGE N#C[C@@H](Br)c1ccc(I)c(OCc2ccccc2)c1 309751990 ZSPCRIOFTOSEEM-CYBMUJFWSA-N 428.067 4.830 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](c2ccc(Br)s2)[C@@H](CBr)C1 382732873 VKHWLBMXXXEZRE-VHSXEESVSA-N 425.186 4.856 50 10 IJGE Clc1cc(CBr)ccc1N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21 404143982 GZPMCDLQORLUCV-NHCUHLMSSA-N 435.793 4.715 50 10 IJGE CCC[C@@H](CCBr)NCc1cc(Cl)ccc1I 716936405 SEVNHFFTSDUKGG-LBPRGKRZSA-N 430.555 4.988 50 10 IJGE C[C@@]1(CBr)CCCN1C(=O)c1cc(Br)sc1Br 723002912 BCSJBAWVZPAGFM-NSHDSACASA-N 446.002 4.663 50 10 IJGE COc1ccc(-c2cc3[nH]c(/C(Cl)=C\c4cnn(CCCl)c4)nc(=O)c3s2)cc1 728698381 IRFWNZLBEXAFKG-OVCLIPMQSA-N 447.347 4.832 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)cc1 748130457 APYQVESFWCHKFY-UHFFFAOYSA-N 448.875 4.734 50 10 IJGE C[C@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1cccc(OCc2ccccc2)c1 764767534 CBWJZPIMVDFYAZ-SFHVURJKSA-N 440.503 4.519 50 10 IJGE CCOc1ccc(NC(=S)NNC(=O)/C=C(/c2ccc(Cl)cc2)C(F)(F)F)cc1 770953728 CWDXQXUPEUABIR-WJDWOHSUSA-N 443.878 4.702 50 10 IJGE CCOc1cc(C=NNC(=O)c2cc3ccccc3o2)cc(Br)c1OCC 1084306564 OIYLALMLGDZWSB-UHFFFAOYSA-N 431.286 4.757 50 10 IJGE O=C(Cc1cccc2ccccc12)NN=C1C(=O)N(C/C=C\c2ccccc2)c2ccccc21 1084493715 BLATVEQBPIWGLY-VDJAXONMSA-N 445.522 4.963 50 10 IJGE CCC(=NNC(=O)COc1ccc2ccccc2c1Br)c1ccc(O)cc1 1084599908 FUXYFDSGUNEEPP-UHFFFAOYSA-N 427.298 4.617 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@@H]1CCCN(C(=O)c2ccc3c(c2)nc(O)n3CC2CC2)C1 1275312864 AYGCCNKYTFILRL-GOSISDBHSA-N 429.637 4.778 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(O)cc2)CCC3)cc1C 1772744336 CGKXOHQBBUAJBN-UHFFFAOYSA-N 431.492 4.633 50 10 IJGE C[C@H](Br)C(=O)c1ccc(SC(F)(F)F)cc1I 1848425818 DDBQRQUMAVVJSV-YFKPBYRVSA-N 439.034 4.869 50 10 IJGE COc1ccc(CC(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)c(OC)c1 1860391442 HFYJKEDYYQDTCU-UHFFFAOYSA-N 446.528 4.589 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2)c2ccccc2)cc1 1867051717 FFRHISWFNFRRMI-YTFSRNRJSA-N 427.529 4.859 50 10 IJGE O=C(NCC1CC2(CC[C@@H]2Cl)C1)c1cc(Br)sc1Br 1882896413 CKKCUUJSBNEVOF-GAAAAHHMSA-N 427.589 4.801 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C2CC2)C1 1883307643 YDUHXRZKZYAXIO-OAGGEKHMSA-N 447.414 4.700 50 10 IJGE CC(C)(C)[C@](C)(CBr)CN1CCC[C@@H](NC(=O)OCc2ccccc2)C1 1904840506 IWVMIEFTEOFUAC-WIYYLYMNSA-N 425.411 4.825 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@]2(CCC[C@H](CI)O2)C1 1939617851 FTMNDOJPRSFOLP-DAYGRLMNSA-N 437.362 4.834 50 10 IJGE CC[C@@H](C)[C@H](Br)CNC(=O)c1cc(Br)sc1Br 1942803848 SBPVWAFOUSKZOW-HTRCEHHLSA-N 448.018 4.813 50 10 IJGE CC(C)C[C@@H](Br)CNC(=O)c1csc(Br)c1Br 1945183314 CCRAWMJDVSSRBK-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE Cc1nc(C(=O)N(Cc2ccccc2)C[C@H](C)Br)c(Br)s1 1956719182 GVAQSZUZYAFOGU-JTQLQIEISA-N 432.181 4.640 50 10 IJGE Clc1cc(CN2CCC(CBr)CC2)ccc1I 2026562209 YWSCLBSCFAXNCL-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE Clc1cc(CN[C@@H](CBr)C2CCC2)ccc1I 2026565470 BMHYCIRNKPCULO-ZDUSSCGKSA-N 428.539 4.598 50 10 IJGE CCn1nc(C)c(Br)c1CC(CBr)(CBr)C1CC1 2029212943 OQNSRRHOKRSJFF-UHFFFAOYSA-N 443.021 4.703 50 10 IJGE O=C(NC1(CCBr)CCC1)c1ccc(Br)cc1Br 2029624827 CSCHZGCREGCXDA-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)C(C)(C)C)C[C@@H]1C(F)(F)F 2066632825 JWEWQNYNDCPEDB-QWHCGFSZSA-N 431.337 4.527 50 10 IJGE CC1(NC(=O)OC(C)(C)C)CCC(NC(=O)c2ccc(CBr)cc2)CC1 2106204238 STCILYSAGXWUQJ-UHFFFAOYSA-N 425.367 4.537 50 10 IJGE Cn1nc(COc2c(F)cc(F)cc2CBr)c(Br)c1Cl 2153000536 KPCDIHVMLIQWCN-UHFFFAOYSA-N 430.474 4.588 50 10 IJGE CCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)c1ccc(CBr)cc1 2162911704 MMXMZNBVAYUORS-SFHVURJKSA-N 439.394 4.833 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)c2ccccc2)[C@](C)(C2CC2)C1 2163058657 MIOLFIVJJPZBBI-AVRDEDQJSA-N 437.422 4.887 50 10 IJGE COc1ccc(Br)c(CCl)c1OCc1nscc1Br 2227746833 REWHARATQVJHQV-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE C[C@@H](Cl)c1nc2cc(I)ccc2n1C1CSCCSC1 2237060826 HGWDSSNJPKQHOF-SECBINFHSA-N 438.787 4.962 50 10 IJGE Cc1cc(S(=O)(=O)Nc2ccccc2CCBr)sc1Br 2238844589 LANQAJACYLYDEC-UHFFFAOYSA-N 439.194 4.557 50 10 IJGE CC(C)(C)CCN(CCBr)C(=O)c1csc(I)c1 2261126792 OGVGRDWHZDTAMF-UHFFFAOYSA-N 444.176 4.626 50 10 IJGE CCn1nc(C)c(C=C(C#N)C(=O)Nc2sc(-c3ccccc3)cc2C(=O)OC)c1C 2295669856 AYUJDNSOQQXWPS-UHFFFAOYSA-N 434.521 4.581 50 10 IJGE C=CC[C@@H](Br)[C@@H]1CCN1Cc1cc(Cl)ccc1I 2314264724 CJPLICBTMJPERN-OCCSQVGLSA-N 440.550 4.859 50 10 IJGE Clc1ccc(CN2CCC[C@H](CBr)CC2)c(I)c1 2318527061 QIHJGOTWUHCYKJ-NSHDSACASA-N 442.566 4.942 50 10 IJGE CC(C)Oc1ccc(C=NNC(=O)c2cc(-c3ccccc3)nc(N3CCCCC3)n2)cc1 2323756260 BOSBFBAPKQFNRL-UHFFFAOYSA-N 443.551 4.685 50 10 IJGE Cc1ccnc(CO[C@@H](CI)c2ccccc2Br)c1 2343569622 MFCVCQYVTNIQKB-HNNXBMFYSA-N 432.099 4.845 50 10 IJGE CC(C)CN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2351885522 LAUGMEDNIQFRMJ-QAPCUYQASA-N 439.385 4.764 50 10 IJGE COC(=O)/C(C#N)=C\c1ccc(OC(=O)/C(=C/c2ccccc2)c2ccccc2)c(OC)c1 951089 FLHSZFGKYFGNLJ-XRBXDRSNSA-N 439.467 4.921 50 10 IJGE CCOc1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C(=O)O)c3)c2C)cc1 2307418 SMYXNBNRRVWWKG-DEDYPNTBSA-N 429.476 4.737 50 10 IJGE O=C(N/N=C\c1c(Cl)cccc1Cl)C1=NNC(c2ccccc2)(c2ccccc2)C1 27473022 BFANAQHBZZSFQI-YSMPRRRNSA-N 437.330 4.737 50 10 IJGE Cc1cccc(Nc2ncnc(NNC(=O)c3cccc4ccccc34)c2[N+](=O)[O-])c1C 40620670 HJEZFNVZSZXJOA-UHFFFAOYSA-N 428.452 4.655 50 10 IJGE Cc1cc(/C=N/NC(=O)CC[C@@H](O)c2ccccc2)c(C)n1-c1ccc(F)c(Cl)c1 58890750 GNOSQIRMUGGAPY-MNVTYAKESA-N 427.907 4.851 50 10 IJGE COc1cc(Br)c(OCc2nc(CCl)cs2)cc1Br 118642585 OVLNUMIHNZBECP-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE N#C/C(=C/NCc1cccc(Br)c1)C(=O)Nc1ccc(Cl)c(Cl)c1 217006792 FGVYCONSOZMTLY-BENRWUELSA-N 425.113 4.892 50 10 IJGE CCCC[C@@H](CC)CO[C@@](C)(CI)CNC(=O)OC(C)(C)C 231313499 QCLPPRFTYRYEEO-PBHICJAKSA-N 427.367 4.938 50 10 IJGE Fc1ccc2nc(CCCl)n(-c3cnn(Cc4ccccc4)c3)c2c1Br 689740145 BTEXEDLYOLACOF-UHFFFAOYSA-N 433.712 4.953 50 10 IJGE CC[C@H](C[C@@H](C)Br)NC(=O)c1cc(Br)c(Br)s1 716854512 ILNDOUWHAJGNQJ-RNFRBKRXSA-N 448.018 4.955 50 10 IJGE CC1(C)OB(c2cc(C(F)(F)F)cc(C(F)(F)F)c2CBr)OC1(C)C 725432275 FPWVSKUAAFTGMO-UHFFFAOYSA-N 432.995 4.918 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCCOc2cccc(Cl)c2Cl)c1C 736693906 LMUKGUSBLOXJTE-UHFFFAOYSA-N 446.338 4.765 50 10 IJGE CC(=O)Nc1ccc(O)c(C(C)=NNC(=O)Nc2c(Cl)cc(Cl)cc2Cl)c1 750936603 DJDOOPSFICWVSA-UHFFFAOYSA-N 429.691 4.857 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)nn1)/C(=C/c1ccc(Cl)cc1)c1ccc(F)cc1 755197177 ALKWWJCDSOCCEL-LFIBNONCSA-N 436.796 4.972 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCCCCO[C@@H]2CCC[C@@H](C)C2)c1C 767150164 MWVYKCWKCVBKEC-DYESRHJHSA-N 425.577 4.754 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccc(N3CCc4ccccc4C3)cc2)c(C(F)(F)F)c1 799750272 BUAHEHCSBRGXJF-UHFFFAOYSA-N 436.437 4.897 50 10 IJGE Cc1cccc(COc2ccc(/C=C(/C#N)C(=O)NCc3ccc4c(c3)OCO4)cc2)c1 1084653916 QGEZQGFFUNHTEE-UUYOSTAYSA-N 426.472 4.526 50 10 IJGE C#CCCCC(=O)NNC(=O)Nc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1C 1201210875 MCEWCANWFQHMPF-UHFFFAOYSA-N 435.503 4.688 50 10 IJGE C=CCCC[C@@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(=O)OC 1455839147 YFSLOKHHQOZZAF-PGPKDTDWSA-N 439.943 4.669 50 10 IJGE C=CCC(C)(C)CNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1 1564824290 BRMFONAAKGZSLI-UHFFFAOYSA-N 429.948 4.774 50 10 IJGE N#CC1=NN(c2ccccc2)[C@H](c2ccccc2)[C@@H]2[C@H]1OC(N)=C(C#N)[C@H]2c1ccccc1 1616047645 XEYUYBYGHLJCJG-POTDNYQPSA-N 431.499 4.620 50 10 IJGE Cc1cccc(C(=O)NN=C2CCCc3oc(C(=O)N4c5ccccc5C[C@H]4C)c(C)c32)c1 1772744936 OLZHJANKNYKSGC-QGZVFWFLSA-N 441.531 4.958 50 10 IJGE CCCOC(=O)c1oc2c(c1C)C(=NNC(=O)Cc1coc3cc(C)cc(C)c13)CCC2 1772751909 FPJAZGREHRUZID-UHFFFAOYSA-N 436.508 4.917 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2cccc(Cl)c2)[C@H]1c1ccccn1 1865699923 GPYJXDUYUBVQFG-HXUWFJFHSA-N 425.879 4.806 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C[C@H]1CN(C(=O)OC(C)(C)C)CC12CCC2 1883484716 BPDKHTIHCNFSOT-GJZGRUSLSA-N 447.414 4.702 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Cl)Cc1c(Cl)ccc(Br)c1F 1905438137 LSOIAQDESLZIFM-VIFPVBQESA-N 431.088 4.688 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1nscc1Br 1915107853 XOOBHHKJZGVCSW-GFCCVEGCSA-N 432.181 4.722 50 10 IJGE O=S(=O)(c1ccc(Br)cc1)N(Cc1ccccc1)[C@H](CCl)C1CC1 1915218067 WRIJJPWRLOHYFW-GOSISDBHSA-N 428.779 4.657 50 10 IJGE COc1nc(N(Cc2ccccc2)C2(CBr)CCC2)ncc1Br 1915756736 MHGLRBSHMFKIJO-UHFFFAOYSA-N 441.167 4.572 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)c1ncc(Br)cc1Cl 1916346765 DVEKLASIPPYULR-CQSZACIVSA-N 448.586 4.914 50 10 IJGE Cc1c(Br)sc([C@@H](Br)[C@@H]2[C@H]3COC[C@H]32)c1Br 1922895749 YSULNWHTEVGMOS-SZACMFPPSA-N 430.987 4.910 50 10 IJGE CCn1ncc(Br)c1[C@H](Br)c1ccc(Br)s1 1937907726 KMZAAWHBLYVMQA-SECBINFHSA-N 428.975 4.974 50 10 IJGE BrCC[C@H]1CCN(Cc2ccc(Br)cc2Br)C1 1943846829 MJEHKHMAQMSEGI-JTQLQIEISA-N 425.990 4.819 50 10 IJGE C[C@H](Br)c1cnnn1-c1ccc(Cl)c(I)c1Cl 1945188378 IEFFBNXHCFXOFB-YFKPBYRVSA-N 446.901 4.635 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](C[S@](C)(=O)=NCCCCCBr)C(C)(C)C 1999513746 DQOZXTNMXPWTMO-BSEYFRJRSA-N 427.449 4.589 50 10 IJGE CC[C@H](Br)c1nnc(-c2cc(I)ccc2F)s1 2003651501 GAKRPTNYRRKXAE-QMMMGPOBSA-N 427.080 4.795 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1Cc1cc(Br)ccc1Br 2006496680 KXOLIYHGXVLXOC-JOYOIKCWSA-N 425.990 4.959 50 10 IJGE CC(C)C[C@@H](CCl)CNc1ncc(I)cc1Br 2015762153 HTHKQXCRKKXUJQ-VIFPVBQESA-N 431.543 4.762 50 10 IJGE O=C(N[C@@H]1CCC[C@@H](Br)C1)c1c(Br)cccc1Br 2033089439 SWMKAIUGCXEBON-RKDXNWHRSA-N 439.973 4.648 50 10 IJGE Brc1cccc(Br)c1CN1CCC2(CC(Br)C2)C1 2053733370 UUICDFIHYVKSES-UHFFFAOYSA-N 438.001 4.961 50 10 IJGE C[C@@H]1OCC[C@@H]1COc1c(Br)cc(Br)cc1CBr 2057465938 VEQMJOAGZTWMGA-DTWKUNHWSA-N 442.973 4.910 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1cc(Cl)ccc1Br 2090386083 WEQSKRZMLAQXOM-VIFPVBQESA-N 429.605 4.739 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)CCCCBr)CC12CCCCC2 2106203806 MWGTWJVUEJYVQQ-MRXNPFEDSA-N 431.415 4.770 50 10 IJGE Fc1ccc2nc(CCCl)n([C@]34C[C@H]3CN(Cc3ccccc3)C4)c2c1Br 2155870767 BYDMDNUPGNTXIO-BTYIYWSLSA-N 448.767 4.950 50 10 IJGE COC[C@H](C)OC[C@H](Br)CCc1ccc(Cl)c(Br)c1F 2166830954 IUKAQIQEAONOFQ-GXSJLCMTSA-N 432.555 4.989 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ncc(Br)cc2Cl)C[C@@H]1CBr 2183590801 QQSHIYVIJIHSHQ-CBAPKCEASA-N 436.497 4.503 50 10 IJGE COc1cc(F)c(Br)cc1[C@H](Cl)c1c(Br)c(C)nn1C 2192374788 NBUFMDXKEHTPKM-LBPRGKRZSA-N 426.511 4.729 50 10 IJGE CN(C(=O)Cc1ccc(Br)cc1Cl)[C@@H](CBr)C(C)(C)C 2237444058 PUKXIYUUBSKTDY-ZDUSSCGKSA-N 425.592 4.913 50 10 IJGE Cc1cc(N(C)Cc2cccc(I)c2)cc(CBr)n1 2272795242 CJLBWFMIIKQHAJ-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE Br[C@H]1CN(Cc2sccc2I)C2(CCCC2)C1 2301070706 FQDCDTZFPDWMSI-SNVBAGLBSA-N 426.161 4.635 50 10 IJGE CC(C)N(Cc1cc(I)ccc1Cl)C[C@@H](C)Br 2307326891 UONXKVIKIWJJBV-SNVBAGLBSA-N 430.555 4.938 50 10 IJGE CC(C)Oc1cccc(C=NNC(=O)c2ccc(Nc3nc(O)c4ccccc4n3)cc2)c1 2323766051 FRFGZPGHHPVGCL-UHFFFAOYSA-N 441.491 4.630 50 10 IJGE C=CC[C@@H](Br)[C@H]1CCN1C(=O)c1cc(Br)c(F)cc1Cl 2360965869 ZKSXJBFQSVAWKX-NOZJJQNGSA-N 425.523 4.796 50 10 IJGE COc1ccc(C2=CS/C(=C(\C#N)c3nnc4n3-c3ccccc3SC4)N2C)cc1 12618899 DUMNPOCCCQEIBZ-CJLVFECKSA-N 431.546 4.751 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C\c2ccc(-c3cc(C(=O)O)cc(C(=O)O)c3)o2)cc1C 15228818 IMIQOKFGGXKBPX-WQRHYEAKSA-N 430.416 4.506 50 10 IJGE CC(C)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(S(=O)(=O)Nc3ccccn3)cc2)cc1 40867374 WUDMEBFQDQSFOZ-HMMYKYKNSA-N 446.532 4.551 50 10 IJGE C=CCOc1c(Br)cc(/C=N/NC(=O)c2cc3ccccc3o2)cc1OCC 59304403 DFASRVJSAFDAGE-YDZHTSKRSA-N 443.297 4.923 50 10 IJGE COc1cc(N/C=C(/C#N)c2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc(OC)c1OC 102418357 IFDJCOVYJLXXBS-KAMYIIQDSA-N 438.465 4.721 50 10 IJGE CCO[C@H]1[C@@H](Oc2ccc(Br)cc2Br)C[C@H]1Br 229353781 GABOEOACVNXCIY-ADEWGFFLSA-N 428.946 4.531 50 10 IJGE Cc1onc(-c2ccccc2)c1C(=O)NN=Cc1ccc(OC(=O)/C=C\c2ccco2)cc1 252620282 MBAVPOCZVRHVMN-QQHNUUJDSA-N 441.443 4.626 50 10 IJGE CC1(C)CN(C(=O)c2cc(Br)sc2Br)C[C@H]1Br 387894012 QFNYGOUKLOJWAX-SSDOTTSWSA-N 446.002 4.519 50 10 IJGE C[C@@]1(CBr)CCCN1C(=O)c1cc(Br)ccc1Br 723025784 GGCHSHOFDNAPTB-ZDUSSCGKSA-N 439.973 4.601 50 10 IJGE C[C@@H]1CCCC[C@@H]1O[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 725343871 LGQMFVQUMSCBDO-RVKKMQEKSA-N 437.362 4.786 50 10 IJGE CC(=NNC(=O)Cn1c2ccc(Cl)cc2c2nc3ccccc3nc21)c1ccccc1 725392812 UCBLZFKPHWZKGV-UHFFFAOYSA-N 427.895 4.932 50 10 IJGE O=[N+]([O-])c1cccc(-n2nc(-c3cccc(I)c3)cc2CCl)c1 725445465 HLQYXMIHZSWABZ-UHFFFAOYSA-N 439.640 4.791 50 10 IJGE Cn1cc(C(=O)NNC(=O)c2cn(C(C)(C)C)nc2-c2ccccc2Cl)c2ccccc21 730998645 AJZCJJGPIKZYCA-UHFFFAOYSA-N 449.942 4.525 50 10 IJGE O=C(NNc1nc(-c2cccnc2)no1)/C(=C/c1ccc(Cl)cc1)c1ccc(F)cc1 732110823 PCFMGWXIGFIDGQ-XDHOZWIPSA-N 435.846 4.608 50 10 IJGE CCCOc1ccccc1[C@@H](CC(C)C)NC(=O)NNC(=O)c1cccc2cccnc12 746427351 WVHCFBHMGMKOIJ-OAQYLSRUSA-N 434.540 4.755 50 10 IJGE O=C(CCc1cccc(C(F)(F)F)c1)NNC(=O)c1ccc(Br)cc1Cl 766461003 BFXPBLFTBDDQDV-UHFFFAOYSA-N 449.654 4.515 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCC(F)(F)C2)c(-c2ccc(Cl)cc2)n1 797558816 GJZBPEHQUNAGSC-ZXMBATIKSA-N 443.885 4.576 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)N(C)C)cc(Br)c1OCc1ccccc1Cl 1084059806 DPEKXHIWHLNEHG-NVNXTCNLSA-N 449.732 4.685 50 10 IJGE Cc1ccc(NC(=O)CCC(=O)NN=Cc2ccccc2OCc2ccccc2)cc1C 1084503950 HCSBOMVQPDZLOB-UHFFFAOYSA-N 429.520 4.751 50 10 IJGE C#CC[C@H](CCOC)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1623648919 HAUDEWRLWRZKPF-JKALPCAWSA-N 444.362 4.853 50 10 IJGE Cc1c(C(=O)NCc2ccccc2)oc2c1C(=NNC(=O)c1ccc(Cl)cc1)CCC2 1772744128 UKJYKKSOLKYAQU-UHFFFAOYSA-N 435.911 4.642 50 10 IJGE Cc1cc(C)c2c(CC(=O)NN=C3CCCc4oc(C(=O)N5CCCC5)c(C)c43)coc2c1 1772751737 LEDJIXBMQNFBKI-UHFFFAOYSA-N 447.535 4.586 50 10 IJGE CCCCCCOC(=O)COc1cccnc1NC(=O)Nc1ccc(SC#N)cc1 1858851398 IQSREKIRRDWDKY-UHFFFAOYSA-N 428.514 4.801 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccc(C)cc2)cc1 1865694563 XCXJATCZLQPTHE-GOSISDBHSA-N 440.425 4.816 50 10 IJGE CN(CCc1cnc[nH]1)c1cc(Nc2ccc(SC#N)cc2)nc(Cc2ccccc2)n1 1868208262 XWFIXSSRMPJSEU-UHFFFAOYSA-N 441.564 4.786 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CC(C)(C)[C@@H]1C)C(=O)OC(C)(C)C 1901847545 DXQSJPWYGIUVCF-LBTNJELSSA-N 439.378 4.888 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)CCc1cc(Cl)cc(Cl)c1 1905371575 MGMQDASRIPBCEF-GFCCVEGCSA-N 427.125 4.986 50 10 IJGE Cc1cccc(C(=O)N(Cc2ccccc2)[C@@H](C)CCl)c1I 1914224062 SLVUWQHNKNGOCV-AWEZNQCLSA-N 427.713 4.869 50 10 IJGE O=C(Cc1ccc(Br)cc1)N(CCCBr)Cc1ccccc1 1914628286 RHFHENDROUXXOO-UHFFFAOYSA-N 425.164 4.805 50 10 IJGE CN(CC1(CBr)CC1)C(=O)c1csc(Br)c1Br 1915537500 MYNJEFXAUWHEFB-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)cnc2n1Cc1csnc1Br 1926872353 LDPQHRPRGQSFLC-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE Cc1nn(C)c(Br)c1[C@@H](Br)c1ccc(Br)s1 1986902005 WUBOHBLLHOJALQ-VIFPVBQESA-N 428.975 4.799 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@]21CC[C@@](C)(CI)O1 1987456095 OHNOMBTVSTVBAU-FUHWJXTLSA-N 435.346 4.540 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)c1ccc(CBr)c(Br)c1 2020225267 PUPFTUNDNDXUKB-JGZJWPJOSA-N 425.990 4.954 50 10 IJGE Clc1nc(Cl)n(C[C@@]23CC[C@H]2CN(Cc2ccccc2)C3)c1CBr 2023079784 VXEHIRXIQULDOA-KSSFIOAISA-N 429.189 4.997 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@@H]2CCC[C@@]2(CBr)C1 2115939479 DWLJLYYSMQDWKA-ISVAXAHUSA-N 427.589 4.801 50 10 IJGE Cc1ccc(Br)c(C(=O)N[C@@H](C)CCCCCI)c1 2117895047 OTSCVECUVSLRAC-LBPRGKRZSA-N 438.147 4.871 50 10 IJGE COc1cc(Cl)c([C@H](Cl)c2cn(C)c(Br)n2)cc1Br 2137639635 ICEWHAOVDLSFDE-NSHDSACASA-N 428.939 4.935 50 10 IJGE CN(C)CCCN(Cc1ccccc1)S(=O)(=O)c1cc(CCl)c(Cl)cc1Cl 2152203478 OFMZYGLDMKKQIF-UHFFFAOYSA-N 449.831 4.875 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)C1CC2(C1)C(F)(F)C21CCC1 2195138234 PEKIYZUWDZMZJX-GNZRSQJKSA-N 442.344 4.641 50 10 IJGE COc1cc(Cl)c([C@H](Br)[C@H]2CCCCS2(=O)=O)cc1Br 2202349315 XMJIPEOBBJZTDT-OLZOCXBDSA-N 446.588 4.514 50 10 IJGE F[C@H]1C[C@H](Br)CN(Cc2c(Br)cccc2Br)C1 2213904187 QVEMLNSWHXBWKD-IUCAKERBSA-N 429.953 4.519 50 10 IJGE COc1ccc(N2C[C@@]3(C)CN(Cc4ccccc4)C[C@]3(C)C2)c(CBr)c1 2235961546 ZCQXCTTWCGSIJL-DHIUTWEWSA-N 429.402 4.939 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@H]2CCC2(C)C)CC1 2243132807 XRAVOPKNKLOYFW-CQSZACIVSA-N 437.362 4.644 50 10 IJGE CCCN(C[C@@H](C)Cl)S(=O)(=O)c1cc(Br)c(C)cc1Br 2288052265 LPLYHWWXCAHDGC-SNVBAGLBSA-N 447.620 4.548 50 10 IJGE COC(=O)c1cccc(-n2c(C)cc(C=C(C#N)C(=O)Nc3cccc(OC)c3)c2C)c1C 2294156161 VSZBBTAHOQUKDA-UHFFFAOYSA-N 443.503 4.743 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2c(C)cccc2C)cc(Br)c1OC(C)=O 2297551594 SUYBEMJHABEBQP-UHFFFAOYSA-N 443.297 4.546 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Br)c1ccc(F)cc1 2301043270 BYPPEECFLHLNOW-QMMMGPOBSA-N 426.909 4.569 50 10 IJGE C[C@@H](CBr)[C@@H]1CCCCN1Cc1sccc1I 2301076165 IQPFYEVLNXZXNZ-JQWIXIFHSA-N 428.177 4.738 50 10 IJGE O=S(=O)(N[C@@H](CCCl)COCc1ccccc1)c1cc(Cl)sc1Cl 2303761869 IYQJQXNXUFAPRA-LBPRGKRZSA-N 428.790 4.548 50 10 IJGE BrC[C@@]12CC[C@@H](C1)N(Cc1cc(Br)ccc1Br)C2 2314904610 CSXLECJOBSFXAY-GXTWGEPZSA-N 438.001 4.961 50 10 IJGE C[C@@H]1C[C@H](CBr)CN(Cc2ccc(Cl)cc2I)C1 2318540163 QKHGSNJYESXTBR-GHMZBOCLSA-N 442.566 4.798 50 10 IJGE CCCOc1cccc(C=NNC(=O)c2ccc(-c3ccc(OC)c(OC)c3)nc2C)c1 2321248527 RLEQCQLNAFNYTQ-UHFFFAOYSA-N 433.508 4.627 50 10 IJGE CCOc1ccc(-c2csc(C(C#N)=C(O)CCc3nc4ccccc4[nH]c3=O)n2)cc1 2331305755 QZNNFHSEBNQLMZ-UHFFFAOYSA-N 444.516 4.871 50 10 IJGE COc1ccc(-c2csc(C(C#N)=Cc3ccc(O)c([N+](=O)[O-])c3)n2)c(OC)c1OC 2331492651 DCIOYHGDXDVVPG-UHFFFAOYSA-N 439.449 4.514 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]3C2)C1 2345010876 OQZCMEBPRXWNLY-YESZJQIVSA-N 429.443 4.813 50 10 IJGE COCCCOc1ccnc(CN(Cc2ccccc2)C(C)(C)CBr)c1C 2364654404 AEQCPJFDDDAZQG-UHFFFAOYSA-N 435.406 4.981 50 10 IJGE O=C(N/N=C/c1cccc(OCc2ccc(Cl)c(Cl)c2)c1)c1cc(O)ccc1O 20410651 AMLHWELMUNNGIQ-BHGWPJFGSA-N 431.275 4.748 50 10 IJGE Clc1cc(I)c(OC2CC(Br)C2)c2ncccc12 97646918 WLHNPUKVOOMKOS-UHFFFAOYSA-N 438.490 4.798 50 10 IJGE C=CCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccccc3F)c(OCC)c2)C1=O 214356754 RGBKJOWVTHVRJE-MOSHPQCFSA-N 446.478 4.582 50 10 IJGE CC(C)CCCO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 231313663 KMVOCWOCPYORMS-KRWDZBQOSA-N 425.351 4.644 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N(CCBr)C1CCC1 232486684 DFOMHJXCZBYACC-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE CC(C)(CCBr)NC(=O)c1cc(Br)sc1Br 232520004 VNNDSIJHBBDCQO-UHFFFAOYSA-N 433.991 4.567 50 10 IJGE O=C(NN=Cc1c[nH]c2ccccc12)/C(=C/C=C/c1ccccc1)NC(=O)c1ccccc1 254592665 HGMWTWDZWWPSEF-FMBDXUTESA-N 434.499 4.645 50 10 IJGE C[C@H](CCBr)CCNC(=O)c1ccc(Br)cc1Br 397737992 IVEXUCIPMQRJSK-SECBINFHSA-N 441.989 4.753 50 10 IJGE C[C@@H](CCBr)CCNC(=O)c1scc(Br)c1Br 705441024 HPNDWCUVQHKAOM-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE CC[C@@H]1CN(C(=O)c2scc(Br)c2Br)C[C@@H]1Br 705442205 MUFVQPFLVHHJKJ-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE CCOc1ccc([C@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)cc1OC 725446996 MTAMEOVTIYGAPT-RTBURBONSA-N 448.357 4.841 50 10 IJGE CC(C)(C)c1cnc(COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)s1 790887391 BUANYTJNJARPBV-PDGQHHTCSA-N 445.548 4.868 50 10 IJGE CCOc1c(Cl)cc(/C=C(\C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1Cl 1083885891 FMKWOBRCHFOKEY-SFQUDFHCSA-N 430.335 4.648 50 10 IJGE COc1ccc(OC)c([C@@H](O)[P+](c2ccccc2)(c2ccccc2)c2ccccc2)c1 1615948321 UDMFHBSMLAEPCM-MHZLTWQESA-N 429.476 4.689 50 10 IJGE C/C(=C\C(=O)NNc1c(Br)cccc1Br)c1cccc(F)c1 1626143257 CEAHUEMAUNWJAD-CSKARUKUSA-N 428.099 4.897 50 10 IJGE O=C(COc1ccc(C2SCCCS2)cc1)NNc1nc2ccccc2[nH]c1=S 1646013112 GVKWEUFHHVEJMZ-UHFFFAOYSA-N 444.607 4.683 50 10 IJGE CCc1nn(CC(C)C)c2c1[C@H](c1cccc(OCc3ccccc3)c1)C(C#N)=C(N)O2 1865712428 YCUZDYFUXORIFX-HSZRJFAPSA-N 428.536 4.899 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CCl)Cc1cc(Br)c(Br)s1 1880740411 CQRSLOQCSLEJHH-SSDOTTSWSA-N 433.593 4.948 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCN(C(=O)OC(C)(C)C)C(C)(C)C1 1880760154 DTGXGAQTYKXQOB-ZIAGYGMSSA-N 435.403 4.700 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccccc1Br 1902794603 MRUUZGKHYMKVDH-HNNXBMFYSA-N 441.163 4.549 50 10 IJGE COc1cc(C(=O)N(Cc2ccccc2)[C@@H](C)CCBr)cc(OC)c1OC 1915091585 ZDQDUKMKJBMFSH-HNNXBMFYSA-N 436.346 4.528 50 10 IJGE Cc1cc(C)c(S(=O)(=O)N(Cc2ccccc2)[C@H](CBr)C2CC2)c(C)c1 1915185620 CLTQELOHZLTWFY-HXUWFJFHSA-N 436.415 4.976 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2ccc(CBr)cc2[N+](=O)[O-])C1 1921468087 CIHUVVWKXQZUSQ-DLBZAZTESA-N 432.362 4.837 50 10 IJGE C[C@]1(CBr)CCCN1Cc1ccc(Br)cc1Br 1943854581 ZBOCUQVTHLUMAE-CYBMUJFWSA-N 425.990 4.961 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Br)cc(Br)cc1C1(N=C=O)CC1 1951456175 XRHXFIDIOCBXQS-UHFFFAOYSA-N 432.112 4.884 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1csc(Br)c1Br 2023036643 BSIRZXMEFMVRKD-POYBYMJQSA-N 448.018 4.813 50 10 IJGE Cc1sc([C@H](Br)c2ccsc2S(C)(=O)=O)cc1Br 2033136140 PEDYKCQHHDHLOP-SNVBAGLBSA-N 430.208 4.768 50 10 IJGE Fc1ccc(Cn2nc(CBr)c(Br)c2C(F)(F)F)cc1F 2079232218 QCSAQFXXVGCXEY-UHFFFAOYSA-N 434.000 4.886 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1[C@]12C[C@@H]1CN(Cc1ccccc1)C2 2099678486 JAOOCDSFRQWAPN-AGKSTNPPSA-N 431.765 4.725 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1 2112432251 WILGEOBMXGCNPG-HZPDHXFCSA-N 436.375 4.510 50 10 IJGE C[C@H](CCCl)N(Cc1ccccc1)S(=O)(=O)Cc1ccccc1Br 2213761120 QKVYCRZIDPUKFU-OAHLLOKOSA-N 430.795 4.799 50 10 IJGE CC(C)[C@H](CBr)CN1CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2255002364 WMUCXYUNCDUUBN-MCIONIFRSA-N 431.337 4.574 50 10 IJGE O=C(NC[C@H]1CCCC[C@@H]1Br)c1cc(Br)c(F)cc1Cl 2285957383 GSJJVAOJMUUSJY-SCZZXKLOSA-N 427.539 4.925 50 10 IJGE CCOc1cccc(-c2cc(C(=O)NN=CC(Br)=Cc3ccccc3)n[nH]2)c1 2297450316 PNQMXFDWCSLROR-UHFFFAOYSA-N 439.313 4.627 50 10 IJGE CC1(C)OC[C@H](Cc2ccc(Cl)c(I)c2)[C@H]1Br 2300239092 UDQRTZLWPLMQSE-JOYOIKCWSA-N 429.523 4.676 50 10 IJGE Cl[C@H]1CC[C@@H]2CN(Cc3ccc(I)c(Br)c3)C[C@H]12 2325206697 JMRVQLIJBAFJBH-MDZLAQPJSA-N 440.550 4.503 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)[C@@H]3CC(=O)N(C(C)(C)C)C3)n2)c(C)c1C 2331362334 XPCRDBPXJZWZKY-OAHLLOKOSA-N 425.554 4.875 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)C1(S(C)(=O)=O)CC1 2339659523 TUHJDHDXBNTXOK-NSHDSACASA-N 434.552 4.516 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1ccnc(Cl)c1CBr)C2 2344739234 BXQMKDXBTMVDPN-OYRHEFFESA-N 434.809 4.978 50 10 IJGE Clc1cc(Br)c(CN2C[C@H](Br)C[C@]3(CCCO3)C2)s1 2345957448 BNBFCSZMPALHOH-NOZJJQNGSA-N 429.605 4.682 50 10 IJGE O=C(c1ccc(Cl)cc1I)N1CCC(CCCCl)CC1 2365588096 FKLWIGVMXJBXLR-UHFFFAOYSA-N 426.125 4.816 50 10 IJGE O=[N+]([O-])c1ccc(OCc2cccc(I)c2)cc1CBr 2367536780 JNJNRFVOOOEKFO-UHFFFAOYSA-N 448.054 4.673 50 10 IJGE Cc1ccc(C2=CS/C(=C(/C#N)C(=O)CN3CCC(Cc4ccccc4)CC3)N2)cc1 25140265 MSZDTEQYVGOGCK-RWEWTDSWSA-N 429.589 4.889 50 10 IJGE N#C/C(=C/c1ccc(Br)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 33930390 WMEFTMAELRMUDX-XFFZJAGNSA-N 440.175 4.922 50 10 IJGE Cc1noc(C)c1-c1ccc(C(=O)NNC(=O)C(c2ccccc2)c2ccccc2)s1 35565636 OAUMBBFMEOPIMI-UHFFFAOYSA-N 431.517 4.613 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4cccc(Cl)c4)ccc32)cc1 38649344 JEHZRAWHICZEIB-DEOSSOPVSA-N 446.890 4.851 50 10 IJGE Nc1c(NNC(=O)C(c2ccccc2)c2ccccc2)ncnc1Nc1ccc(Cl)cc1 40782169 AIMKECOWHUTHEC-UHFFFAOYSA-N 444.926 4.731 50 10 IJGE CCCCOc1ccc(/C=N/NC(=O)COc2c(C)cc(Br)cc2C)cc1 40888209 NCLHYTRUHFTREE-YDZHTSKRSA-N 433.346 4.774 50 10 IJGE C[C@H](N/C=C(/C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C12CC3CC(CC(C3)C1)C2 217234114 DZEUOLRPNLNNKE-UORUSPLLSA-N 428.920 4.789 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)ccc2n1C[C@@H]1CN(Cc2ccccc2)CCO1 312356615 AJZDCFLWYAIMQX-QAPCUYQASA-N 448.792 5.000 50 10 IJGE CN(C(=O)c1cc(Br)ccc1I)C(C)(C)CCCl 688376772 QMQNDEXAWMVEDP-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE C[C@H](Cl)c1nc2cc(I)c(F)cc2n1CC1SCCS1 692805991 IPPXSBYJRXZEOP-ZETCQYMHSA-N 442.750 4.886 50 10 IJGE Fc1ccc2nc(CCCl)n(C[C@H]3CCN3Cc3ccccc3)c2c1Br 716232723 ZMLHCLKKMHEASX-OAHLLOKOSA-N 436.756 4.994 50 10 IJGE N#Cc1ccc(NNC(=O)NCc2ccc(Oc3ccccc3)nc2)c(C(F)(F)F)c1 799564827 FYGZOJPOGBONMC-UHFFFAOYSA-N 427.386 4.591 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)NNc1ccc(C#N)cc1C(F)(F)F)O[C@H](C)C2 799746458 LSRPWNHGOFZLJF-ISTRZQFTSA-N 445.441 4.546 50 10 IJGE C=CCCC[C@@H](NC(=O)NNc1cc(C(=O)OC)ccc1Br)c1ccccc1 1479191178 TUFINGXLYAHAQT-GOSISDBHSA-N 446.345 4.959 50 10 IJGE C=CCOc1ccc(Br)cc1NC(=O)NNc1cc(Cl)nc2ncccc12 1625542535 LROOSHDTERZHOR-UHFFFAOYSA-N 448.708 4.759 50 10 IJGE Cc1sc2nc(CCC(=O)NNc3ccc(Cl)c(C(F)(F)F)c3)nc(O)c2c1C 1632195140 DZSUZBYNSWPJJK-UHFFFAOYSA-N 444.866 4.762 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(F)cc2)[C@@H]1c1cccc(Cl)c1 1865682949 BMJFGPWNVPQHEA-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE C=Cc1ccccc1OCC(=O)N[C@@H](C(=O)Nc1ccc(SC#N)cc1)c1ccccc1 1867265836 PPVSYNWFLBKANX-XMMPIXPASA-N 443.528 4.778 50 10 IJGE Cc1cc(-c2csc(/C(C#N)=C(\O)CCc3nc4ccccc4[nH]c3=O)n2)ccc1F 1872749945 OUNBFKHVNWWGIT-QNGOZBTKSA-N 432.480 4.920 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1ccc(C)c2ncccc12 1915078415 PXEKISXZOLNMHP-SFHVURJKSA-N 447.398 4.908 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@@]2(CCC[C@H]2Cl)C1 1918905940 ASXYVEGIXSLQAR-RNCFNFMXSA-N 427.589 4.897 50 10 IJGE C[C@@H](CCCBr)CNC(=O)c1cccc(Br)c1Br 2031480403 VMEONYNFKKXWJY-VIFPVBQESA-N 441.989 4.753 50 10 IJGE C[C@@H]1CCO[C@H]1COc1c(Br)cc(CBr)cc1Br 2034998020 ZYLONPISRDVGHN-PELKAZGASA-N 442.973 4.910 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([S@@](C)(=O)=NC[C@H](CBr)C(C)(C)C)C1 2044695422 CZOADLLRLHHNFH-XSKAOVLVSA-N 439.460 4.541 50 10 IJGE O=C(CCl)c1c(I)ccc(C(F)(F)F)c1OC(F)(F)F 2055164178 UBKFMNCYILEDNH-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE CCOc1ccc(-n2nc(CCl)c(I)c2C(F)(F)F)cc1 2079210713 YJGATILXDMJQCB-UHFFFAOYSA-N 430.595 4.633 50 10 IJGE C[C@@H]1C[C@H](CBr)CCN1Cc1ccc(I)c(Cl)c1 2086655553 OPRDITZKLDGTGO-GHMZBOCLSA-N 442.566 4.940 50 10 IJGE CCCC(CBr)(CCC)CN(C)C[C@@H]1COCCN1C(=O)OC(C)(C)C 2106788371 OYZCQZYIPYMCRL-QGZVFWFLSA-N 435.447 4.536 50 10 IJGE Cc1cc(C(=O)N(C)C2(CBr)CCSCC2)sc1Br 2114717341 ROFLWFHQVKYPON-UHFFFAOYSA-N 427.227 4.552 50 10 IJGE CC(C)(CC(CBr)(CBr)c1ccccc1Cl)S(C)(=O)=O 2167894466 JXBQSSGFTMCZHH-UHFFFAOYSA-N 446.632 4.581 50 10 IJGE Clc1c(Br)ccc(CBr)c1N1CCS[C@H]2COCC[C@@H]21 2170504237 LKMRAOBXQAVOJG-RYUDHWBXSA-N 441.616 4.708 50 10 IJGE CCCCN(CCCC)S(=O)(=O)c1cc(CBr)oc1Br 2179776074 QSOUYNPKPKNQTM-UHFFFAOYSA-N 431.190 4.528 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1C(=O)c1cc(Br)c(Br)s1 2251009892 NBAATJIFMHWIRG-POYBYMJQSA-N 446.002 4.661 50 10 IJGE Cc1ccc(NC(=O)COc2ccc(C=C(C#N)C(=O)N[C@H]3CCCC[C@@H]3C)cc2)cc1 2297500519 LTHDIUBJMWFOSZ-CYFREDJKSA-N 431.536 4.614 50 10 IJGE C[C@H]1[C@@H](Cl)CCCN1Cc1ccc(I)c(Br)c1 2306220396 XBBSVNJGFVLTRG-CABZTGNLSA-N 428.539 4.645 50 10 IJGE Cc1c(C=C(C#N)C(=O)NC[C@@H]2CCCO2)c2ccccc2n1Cc1ccccc1Cl 2313609464 JBSXUPSATMPARC-FQEVSTJZSA-N 433.939 4.854 50 10 IJGE CC1=C(C#N)C(=O)N(C)C(=O)C1=Cc1ccc(OCc2ccc(Cl)cc2Cl)cc1 2314617678 QXYHEYHOKQBWKL-UHFFFAOYSA-N 427.287 4.794 50 10 IJGE COc1ccc(CCN[C@@H](CCCl)COCc2ccccc2)c(Br)c1 2320563987 DHTNIQHIBHFILS-SFHVURJKSA-N 426.782 4.804 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(C)cc2)cc([N+](=O)[O-])c1OCc1ccccc1C 2323076028 RIOSOISVYNDKEX-UHFFFAOYSA-N 433.464 4.563 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@](C)(CBr)C(C)(C)C)C[C@H]1C(F)F 2327093816 UTTCJVYBRFPHAJ-SNUQEOBHSA-N 427.374 4.524 50 10 IJGE Cn1nc(C(F)F)c(CBr)c1Oc1ccc(I)cc1 2339720017 ZXMHAHYJUZCGPC-UHFFFAOYSA-N 443.029 4.650 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@]23CCC[C@@]2(C1)CN(C(=O)OC(C)(C)C)C3 2353822701 QRTGUCLWVFJISJ-UIFIKXQLSA-N 429.443 4.767 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4c(C)cccc4C)ccc32)cc1 38649220 QUCJDJNGXJNAAI-RUZDIDTESA-N 440.499 4.814 50 10 IJGE CC(C)(C)OC(=O)n1cc(CI)c2ccc(Br)nc21 95937092 KYVPYEIMJOGVQB-UHFFFAOYSA-N 437.075 4.517 50 10 IJGE Fc1ccccc1C(CBr)(CBr)Cc1cn2ccsc2n1 149648338 FPYKGABGEWLBFS-UHFFFAOYSA-N 432.156 4.805 50 10 IJGE N#C/C(=C/NCc1cccc(Br)c1)C(=O)Nc1ccc(Cl)cc1Cl 217178276 YCTVAWGPTSQHAT-BENRWUELSA-N 425.113 4.892 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)/C(C#N)=C\Nc1cc([N+](=O)[O-])ccc1Cl 217184048 WLBFVWIMKPOUOV-QAALXFNPSA-N 428.876 4.652 50 10 IJGE Cc1nc2ccccc2cc1C(=O)NN=Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1 254765812 NXXSJGLECOCNRI-UHFFFAOYSA-N 440.459 4.794 50 10 IJGE COc1cccc(/C=C\C(C)=NNC(=O)COc2ccc(OCc3ccccc3)cc2)c1 254766241 KQPRKIRFQBLJCI-HYEPHNNKSA-N 430.504 4.859 50 10 IJGE CCOc1ccc(C=NNC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)cc1OC 256017228 RIJJSDJDHQLMTH-UHFFFAOYSA-N 446.547 4.949 50 10 IJGE CCCCCC[C@H](C)O[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1I 299983701 XFMALKGUUOGLDL-RRFJBIMHSA-N 425.351 4.785 50 10 IJGE Cc1sc([C@H](Br)c2cnn(C)c2Br)cc1Br 379220335 SKXOUCSTELOCLO-SECBINFHSA-N 428.975 4.799 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2ccc(Br)c(O)c2)[C@@H](CBr)C1 382673324 GEWMQEMTOOHNRI-NWDGAFQWSA-N 435.156 4.500 50 10 IJGE COC[C@H](O[C@@](C)(CI)c1ccccc1Br)C(C)C 404098611 BZUFXQQAPCXFEG-GJZGRUSLSA-N 441.147 4.787 50 10 IJGE CC(C)N(C[C@H](C)Cl)C(=O)c1cc(Br)ccc1I 691348880 FOUKUJFGWGOZBM-VIFPVBQESA-N 444.538 4.532 50 10 IJGE FC(F)(F)COCCCC(CBr)(CBr)C1CCOCC1 696857034 AVEUBDBIIDMRMR-UHFFFAOYSA-N 426.111 4.548 50 10 IJGE FC(F)(F)c1cc(CBr)ccc1N1CC2(CN(Cc3ccccc3)C2)C1 706170488 RYFRBQZASGPBTK-UHFFFAOYSA-N 425.292 4.923 50 10 IJGE CC[C@H](C)Sc1ccc(NC(=O)C(=O)NNc2cccc(F)c2F)c(C(F)(F)F)c1 785019390 DAJGNOMBLOTMTM-JTQLQIEISA-N 447.429 4.956 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NC[C@H]2CCC(F)(F)C2)c(-c2ccc(Cl)cc2)n1 797558813 GJZBPEHQUNAGSC-ADFUCPMPSA-N 443.885 4.576 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccn(-c3ccc(Cl)c(Cl)c3)n2)c(C(F)(F)F)c1 799752076 YTOKIEVZJOIJDH-UHFFFAOYSA-N 440.212 4.826 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)Oc2c(F)c(F)cc(F)c2F)c(-c2ccccc2)n1 916865807 HSKLKWJNXVOIOQ-NTEUORMPSA-N 440.356 4.533 50 10 IJGE COc1ccc(/C(C#N)=C/c2ccc(OC(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1OC 1615099330 DPNMHPHFBSDSHL-XDHOZWIPSA-N 430.416 4.895 50 10 IJGE C#C[C@H](NC(=O)NNc1ccc(Cl)cc1Br)c1ccc(Cl)cc1F 1686922530 KZDNPEXXNBVBLY-AWEZNQCLSA-N 431.092 4.896 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)C(=O)Cc1ccc(Br)cc1F 1914638272 NUHBVTRAAAGZBD-CYBMUJFWSA-N 443.154 4.943 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)S(=O)(=O)c1ccc2c(c1)CCCC2 1915109428 GNICNUYXUGRYCO-KRWDZBQOSA-N 436.415 4.930 50 10 IJGE CCn1ncc(Br)c1[C@H](Br)Cc1ncccc1Br 1924877766 HACFKQYDUXPZLX-SECBINFHSA-N 437.961 4.502 50 10 IJGE CC1(C)[C@@H](CNc2ncc(I)cc2Br)C[C@H]1Cl 2015765346 NOMZLCNKCMRMQT-GMSGAONNSA-N 429.527 4.514 50 10 IJGE CN(Cc1cc(Br)ccc1Br)C1(CCBr)CC1 2015859354 GRUVSVCZIUFPDE-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE BrC[C@@H]1CCC2(CCC2)CN1Cc1ccc(I)cc1 2095703015 GCPRREDRRSTDSV-HNNXBMFYSA-N 434.159 4.821 50 10 IJGE C[C@H](CCBr)CCN1CC[C@@H](C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)C1 2106784952 MGLONUUWGYATDE-RBSFLKMASA-N 445.364 4.823 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)C1CCC(NC(=O)OC(C)(C)C)CC1 2106788487 PUGBWGIYBVFWGK-VIQWUECVSA-N 425.411 4.933 50 10 IJGE COc1ccc([C@H](Br)c2cn(C)c(Br)n2)c(Cl)c1Cl 2138628662 VOSULSMSGOEUDL-VIFPVBQESA-N 428.939 4.982 50 10 IJGE COc1ccc([C@@H](Cl)c2cnn(C)c2I)c(Cl)c1Cl 2138638248 YLDGBFRQRZBQHO-SECBINFHSA-N 431.488 4.668 50 10 IJGE Cc1ccc(C(=O)Nc2ccccc2CBr)cc1I 2230675807 GBTSYDKVJUPKEZ-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE Cn1cc(-n2c(CCl)nc3cc(Br)c(Cl)cc32)c(Br)n1 2238991921 QSSUXJPYEMBXEL-UHFFFAOYSA-N 438.938 4.676 50 10 IJGE FC(F)(F)c1cnc(N2CCSC[C@@H]2CCBr)c(Br)c1 2240938938 NHOXFYYZYSEKGG-VIFPVBQESA-N 434.119 4.570 50 10 IJGE O=C(c1cccc(Cl)c1Br)N1CC[C@@H](C(F)(F)CBr)C1 2283182049 ACOWELCVZKVHDF-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE Cc1c(CBr)cccc1NC(=O)c1c(F)cccc1I 2283561423 VPJRPFGRQAFMME-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@H](Br)C12CCC2 2285846259 LUCSRUDNQPPOCZ-LBPRGKRZSA-N 425.523 4.774 50 10 IJGE C[C@]1(CNC(=O)c2cc(Br)c(F)cc2Cl)CCC[C@H]1Br 2286883711 QMRKCCQQJFUJFX-TZMCWYRMSA-N 427.539 4.925 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccccc2)C(=O)C1=CNc1ccc(SC#N)c(Cl)c1 2297709175 FFPDKLIGBDOLAI-UHFFFAOYSA-N 434.908 4.618 50 10 IJGE CCCCN1C(=O)C(=Cc2ccc(OCc3ccccc3F)c(OC)c2)C(C)=C(C#N)C1=O 2314611625 YFQZRWHHYXBKLQ-UHFFFAOYSA-N 448.494 4.806 50 10 IJGE CCOc1ccc(C=CC(=O)Nc2cccc(C(=O)Nc3ccc(SC#N)cc3)n2)cc1 2321126281 AFNXMUTUVCNLAB-UHFFFAOYSA-N 444.516 4.958 50 10 IJGE CCOc1c(Cl)cc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)cc1OC 2323150920 YDAHGKBMOXXCGC-UHFFFAOYSA-N 425.916 4.871 50 10 IJGE Cc1ccc(NC=C(C#N)C(=O)Nc2ccc(I)cc2C)c(C)c1 2325406211 UIHVGAUQCPUXBW-UHFFFAOYSA-N 431.277 4.675 50 10 IJGE C[C@H]1CC2CC([C@@H](Br)c3cc(I)cc4c3OCC4)(C2)O1 2368035741 MNKXMJGYGGRWMH-NGZSKSNYSA-N 449.126 4.620 50 10 IJGE N#CC1=C(N)Oc2c(c(=O)n(-c3ccccc3)c3ccccc23)[C@@H]1c1ccc(Cl)cc1 20428288 RMLJMALYFPHECC-OAQYLSRUSA-N 425.875 4.862 50 10 IJGE Cn1c(/C(C#N)=C/c2c(Oc3ccc(F)cc3)nc3ccccn3c2=O)nc2ccccc21 35549742 RWFPMMUXLTTYKV-JQIJEIRASA-N 437.434 4.577 50 10 IJGE CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)/C=C\c3ccccc3)ccc21 205642179 OWZKGJUTTLWSJP-PYNJZACDSA-N 438.483 4.922 50 10 IJGE COC(=O)c1ccccc1NC(=O)/C(C#N)=C\N(Cc1ccccc1)Cc1ccccc1 217225613 SPZMEERXSYXOBN-QOCHGBHMSA-N 425.488 4.522 50 10 IJGE Cc1cc(I)ccc1NC(=O)/C(C#N)=C\NC(C)(C)CC(C)(C)C 217254078 TZESJGMDJHXKLP-KAMYIIQDSA-N 439.341 4.750 50 10 IJGE O=S(=O)(c1ccc(Cl)c(CCl)c1Cl)N1CC[C@H](OCc2ccccc2)C1 383924117 STQRXISWYPOXQG-AWEZNQCLSA-N 434.772 4.712 50 10 IJGE C[C@H]1CN(Cc2cc(Cl)ccc2I)CC[C@@H]1Br 405351919 VFDPKYPAKKFNIN-CABZTGNLSA-N 428.539 4.550 50 10 IJGE FC(F)Oc1cc(C(F)(F)F)cc(CBr)c1I 575722477 CRGIAHOKBUOHSV-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NN(Cc2ccccc2)c2ccccc2)C1 730137535 DUJJPIZFCVHNQX-NRFANRHFSA-N 438.572 4.555 50 10 IJGE C[C@@H]1Cc2ccccc2[C@H]1NC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F 732491598 HAZRBABCGQXLRL-DQNAHFDYSA-N 442.890 4.894 50 10 IJGE CCN(CCC(F)(F)F)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 748183344 HZTBGEZQBUMMQR-VBKFSLOCSA-N 449.864 4.825 50 10 IJGE C=C(CBr)CN1CCN(c2cccc(OCc3ccccc3Cl)c2)CC1 1559833019 IYBHDYCMQHQWOX-UHFFFAOYSA-N 435.793 4.992 50 10 IJGE COc1ccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4cc(C)cc(C)c4)c(C)c32)cc1 1772746762 ZTOSTNPLXSWWHU-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE CCCCCN1C(=O)C(=NNC(=O)c2cccc(Cl)c2)c2cc(Br)ccc21 1772752389 DCJWLBWFTCMCJX-UHFFFAOYSA-N 448.748 4.773 50 10 IJGE COc1ccc(C=NNC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1Br 1772752874 PSKNHMSAGNIVDV-CYBMUJFWSA-N 439.737 4.646 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2)[C@H]1c1ccc2c(c1)OCCO2 1865698641 ZIEXEHACVUZOJL-QHCPKHFHSA-N 448.482 4.529 50 10 IJGE CCOc1cccc(C(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3Cl)nc2C)c1 1865759504 DJTOJMZHFIKTEB-UHFFFAOYSA-N 444.318 4.837 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)CCc1ccc(Cl)c(Cl)c1 1905342958 MPOHGCDLYGZTRV-LBPRGKRZSA-N 427.125 4.986 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cccc(Br)c1 1916374119 GQIAZJWFUWNVMZ-QGZVFWFLSA-N 441.163 4.501 50 10 IJGE CC(C)[C@H](CI)NC(=O)c1cscc1OCc1ccccc1 1934835390 DEJJQSDFZWJEEO-HNNXBMFYSA-N 429.323 4.517 50 10 IJGE Cc1cc(Br)sc1[C@@H](Br)c1nn(C)cc1Br 1939452750 VXPLYMCWBXGJRW-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE COC[C@]1([C@H](Br)c2cc(Br)c(Br)s2)CCCO1 1943035466 CQYBVJVCUZPARY-KOLCDFICSA-N 449.002 4.905 50 10 IJGE CC[C@@H]1CN(Cc2ccc(Br)cc2Br)C[C@H]1Br 1943856850 BYWYVCBKQBPXNR-NOZJJQNGSA-N 425.990 4.817 50 10 IJGE CC[C@](C)(CBr)NC(=O)c1c(Br)cccc1Br 1945332525 DMDMSMASJTYWNH-GFCCVEGCSA-N 427.962 4.505 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(Br)cc1)C(F)(F)CBr 1951578086 UPVHOEPTBKJTDR-LBPRGKRZSA-N 443.126 4.915 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)[C@H]1CCC[C@@H]1Br 2026567338 QZWAONXCSMUUCF-GWCFXTLKSA-N 428.539 4.692 50 10 IJGE Clc1cc(CN(CCBr)CC2CC2)ccc1I 2026567894 WKVGZJVINZLMNF-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H](N(CCCCCBr)C1CC1)C(F)(F)F 2044704748 GFFBEIBRYHXZGH-AWEZNQCLSA-N 431.337 4.862 50 10 IJGE Brc1ccc(Br)c(C[C@@H]2CN(C3CC3)C[C@@H]2Br)c1 2054717874 KARYEAKOYJHGRR-YGRLFVJLSA-N 438.001 4.612 50 10 IJGE Cc1nnc(CN(C)c2c(CBr)ccc(Br)c2Cl)s1 2098112211 ZOSAICFCVUIIKF-UHFFFAOYSA-N 425.577 4.794 50 10 IJGE Clc1cc2c(cc1[C@@H](Br)c1cc(Br)sn1)OCCO2 2120038451 IIBIOLPSWWCEDJ-GFCCVEGCSA-N 425.529 4.815 50 10 IJGE C[C@@H]1C[C@H](C(F)(F)F)N(C[C@H](CBr)C2CC2)CCN1C(=O)OC(C)(C)C 2121769790 ASSPKMRJQWOOMD-VHDGCEQUSA-N 443.348 4.670 50 10 IJGE CN(C[C@H]1CCCN(Cc2ccccc2)C1)c1cc([N+](=O)[O-])ccc1CBr 2176906246 HZQBXYPLICJHLA-GOSISDBHSA-N 432.362 4.838 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CC[C@@H](CN(C[C@H](CBr)c3ccccc3)C1)C2 2176937301 NRHMDSCYMOWOQA-LZNRXBQRSA-N 437.422 4.792 50 10 IJGE O=C(c1sccc1Br)N1CCC(CBr)(CC(F)F)CC1 2188342181 WTBGJROZQDFMLY-UHFFFAOYSA-N 431.140 4.783 50 10 IJGE Cc1sc(Br)c(C)c1[C@H](Br)[C@]12CCC[C@@H]1CS(=O)(=O)C2 2234237629 SSDLHLGEZCAMJV-OSMZGAPFSA-N 442.238 4.778 50 10 IJGE ClCc1nc2cc(Br)c(Cl)cc2n1Cc1conc1Br 2238727760 XTQJYXGZCUAVNE-UHFFFAOYSA-N 439.922 4.990 50 10 IJGE Cc1cccc(O[C@@H]2C[C@H](Br)[C@H]2OCC(C)C)c1I 2277946474 CGCURKNDODTQLK-NJZAAPMLSA-N 439.131 4.555 50 10 IJGE C[C@@H]1CCc2c(sc(NC(=O)C(C#N)=Cc3ccc(-c4ccc(F)cc4)o3)c2C(N)=O)C1 2296509312 JUCIVKITMPHUNX-CYBMUJFWSA-N 449.507 4.917 50 10 IJGE C[C@H]1[C@H](Cl)CCCN1Cc1ccc(I)c(Br)c1 2306220397 XBBSVNJGFVLTRG-JOYOIKCWSA-N 428.539 4.645 50 10 IJGE CN(Cc1sccc1I)[C@@H](CBr)c1ccccc1 2316764560 NTZJNKBLBPNXAR-ZDUSSCGKSA-N 436.156 4.921 50 10 IJGE CCOc1ccc(CCNC(=O)C(C#N)=Cc2ccc(Br)cc2)cc1OCC 2329657515 LJHYKWCQRYMASG-UHFFFAOYSA-N 443.341 4.512 50 10 IJGE Cn1cc(I)c(CC(CCl)(CCl)c2ccc(Cl)cc2)n1 2367623549 MXARUYGETVKZGT-UHFFFAOYSA-N 443.543 4.636 50 10 IJGE CCCOc1cc(Br)c(/C=C(/C#N)C(=O)Nc2ccc(F)cc2)cc1OC 33644365 VNPZOFRBLBLFSA-ZROIWOOFSA-N 433.277 4.931 50 10 IJGE COc1ccc(C(=O)Nc2cccc(/C=C(/C#N)c3nnc(-c4ccccc4)n3C)c2)cc1 108967984 NBQOXUVJXRTUDE-QNGOZBTKSA-N 435.487 4.807 50 10 IJGE CCCCOCCCNC(=O)/C(C#N)=C\Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 216832520 XYSPZRNGZOWYEI-SEYXRHQNSA-N 437.384 4.867 50 10 IJGE O=C(COc1ccc(F)cc1)NN=Cc1c(OC(=O)c2ccccc2)ccc2ccccc12 254483929 WMAHKCYIMISHAX-UHFFFAOYSA-N 442.446 4.727 50 10 IJGE CC1(C)[C@@H](Br)CCN1C(=O)c1cc(Br)cc(Br)c1 311137437 YAINNEJDUFGTGL-NSHDSACASA-N 439.973 4.600 50 10 IJGE CC[C@@H](NC(=O)c1cc(Br)c(Br)s1)[C@H](C)Br 395706510 OHVGGBFPKZXDTG-CAHLUQPWSA-N 433.991 4.565 50 10 IJGE C[C@@H](CCCBr)CNCc1cc(Cl)ccc1I 405352943 WCNZEOLLSIZDFY-JTQLQIEISA-N 430.555 4.845 50 10 IJGE FC(F)(F)c1cc(I)cc(CBr)c1Br 575696174 SJMLYVKQKRZSDP-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE Cc1ccc([C@H](C)CNC(=O)NNC(=O)Nc2ccc(Br)cc2Cl)cc1 745833393 VMSBIBYLCKDBSZ-GFCCVEGCSA-N 439.741 4.550 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2CC3(CCCCC3)C2)c(-c2ccc(Cl)cc2)n1 773720453 AKSASNUSTVBMGW-UYRXBGFRSA-N 433.943 4.817 50 10 IJGE Cc1ccc(C(CSc2nc3ccccc3[nH]2)=NNC(=O)c2ccccc2O)c(C)c1 1083949736 IYFFFEWPTNOHBO-UHFFFAOYSA-N 430.533 4.812 50 10 IJGE O=C(NN=C1C(=O)N(Cc2c(Cl)cccc2Cl)c2ccccc21)c1ccc(F)cc1 1084085836 YJPKQBOEAYGBQZ-UHFFFAOYSA-N 442.277 4.813 50 10 IJGE CCOc1cc(Br)c(/C=C(\C#N)C(=O)Nc2ccc(F)cc2)cc1OCC 1084398423 FZAXDJDHWOJWCP-NTEUORMPSA-N 433.277 4.931 50 10 IJGE C=CCCCCCCNC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1 1478606008 RHEDPRZOTKXIER-UHFFFAOYSA-N 431.540 4.620 50 10 IJGE CC(=O)c1ccc(C(=O)NNC(=S)Nc2cc(C(F)(F)F)ccc2Cl)cc1C 1587185011 DVGBAINYNZBEDD-UHFFFAOYSA-N 429.851 4.501 50 10 IJGE CC[C@H](Cc1cccc(Br)c1)C(=O)NNc1nc2ccccc2[nH]c1=S 1646013294 JKNWUTPPSXLOLF-CYBMUJFWSA-N 431.359 4.767 50 10 IJGE C=C(C)[C@@H](NC(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1)c1ccc(F)c(F)c1 1680280757 PTPJTTDKYXMYEI-OYHNWAKOSA-N 439.462 4.533 50 10 IJGE Cc1c(C(=O)Nc2ccccc2)oc2c1C(=NNC(=O)c1ccc3ccccc3n1)CCC2 1772751551 UCRRTQMWDKHWPC-UHFFFAOYSA-N 438.487 4.859 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2cccc(F)c2)[C@H]1c1cccc(O)c1 1865681371 LMVMSDSRNJBFQT-QFIPXVFZSA-N 438.462 4.661 50 10 IJGE CCCOc1c(OC)cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2CC 1865692442 FWIRIUYNIUYORH-HXUWFJFHSA-N 430.508 4.586 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]2CCCN(CC3(CBr)CCC3)C2)C1 1879198675 OTMDECZOXHWFDD-ZWKOTPCHSA-N 429.443 4.911 50 10 IJGE BrCC[C@@H]1CCN(Cc2cccc(Br)c2Br)C1 1943881490 RKEPDCWAKRFMQC-SNVBAGLBSA-N 425.990 4.819 50 10 IJGE O=C(N[C@@H](CBr)CC1CC1)c1csc(Br)c1Br 1945189174 KPYXYCCFFNLETH-SSDOTTSWSA-N 446.002 4.567 50 10 IJGE CCC[C@@H](Br)CNC(=O)c1c(Br)cccc1Br 1945333631 SQMVGANMAZGVIC-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE CC(C)[C@H](Br)CN(C)Cc1cc(Cl)ccc1I 2002416884 BYNQQLDLTNULSJ-GFCCVEGCSA-N 430.555 4.796 50 10 IJGE F[C@@]1(CBr)CCCN(Cc2cccc(Br)c2Br)C1 2039793779 APZDDQGZWIHSPO-CYBMUJFWSA-N 443.980 4.911 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc([S@@](C)(=O)=NC(=O)CCCCBr)cc1 2044530244 FHBNSMJIHWVJQS-RUZDIDTESA-N 433.368 4.582 50 10 IJGE Cc1nn(C)c(Br)c1CC(CBr)(CBr)C1CCC1 2065917102 JBYZFMZYOKEOLO-UHFFFAOYSA-N 443.021 4.610 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1C(=O)c1cccc(Br)c1Br 2073326224 HNEVIFWOSMKFFX-KWQFWETISA-N 439.973 4.600 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@@H]2CC[C@@H](Cl)C[C@H]2C1 2093941792 CGMSJIGVAJJYCE-XHNCKOQMSA-N 427.589 4.753 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@@H]2CCC[C@H](Cl)[C@H]2C1 2094592416 VXXHBTGOQSJNEW-NRPADANISA-N 427.589 4.753 50 10 IJGE CCOc1ccc(S(=O)(=O)N(Cc2ccccc2)C2CCC2)cc1CBr 2123245168 FGIDHPIFGRRNBC-UHFFFAOYSA-N 438.387 4.724 50 10 IJGE CCN(C(=O)c1ccc(CBr)cc1)C1CCC(NC(=O)OC(C)(C)C)CC1 2162915398 KKZDJOUPAZNZQR-UHFFFAOYSA-N 439.394 4.880 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(CC2(CBr)CCOCC2)c2ccccc21 2163057894 GFPJAKPHQUTQDO-KRWDZBQOSA-N 439.394 4.654 50 10 IJGE O=[N+]([O-])c1ccc(CBr)c(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1 2176907725 BVPVGYNLLNIPQR-NRFANRHFSA-N 430.346 4.592 50 10 IJGE COc1cc(F)c([C@@H](Cl)c2c(Br)nn(C)c2C)cc1Br 2202902642 SYGDAFQTLJQNTR-GFCCVEGCSA-N 426.511 4.729 50 10 IJGE O=C(N1CCC[C@H]([C@@H]2CCCCN2CCCCCCBr)C1)C(F)(F)F 2231102139 CDTOELTWNVDYEG-HOTGVXAUSA-N 427.349 4.597 50 10 IJGE COC(=O)c1ccc(COc2ccc(C=C(C#N)C(=O)N[C@H](C)c3ccccc3)cc2)cc1 2293191885 JHOHTTJXZQKGJR-LJQANCHMSA-N 440.499 4.837 50 10 IJGE CC(C)(C)[C@H](CBr)NCc1ccc(Cl)c(I)c1 2300239222 VKYVYGZAUJXYRO-LBPRGKRZSA-N 430.555 4.844 50 10 IJGE CCC(CBr)(CBr)Cc1c(Br)cnn1C(C)C 2303023885 OXOOKZCNCMOSBF-UHFFFAOYSA-N 431.010 4.955 50 10 IJGE ClC[C@H]1CCC[C@@H]1NCc1ccc(I)c(Br)c1 2306232380 TZGWIFYKOJRWBF-MFKMUULPSA-N 428.539 4.551 50 10 IJGE CC1(C)C[C@H](CBr)CN1Cc1ccc(Cl)c(I)c1 2315546184 DQUBEWDTMOIAQS-LLVKDONJSA-N 442.566 4.940 50 10 IJGE Br[C@@H]1CCC[C@H]2CN(Cc3sccc3I)CC[C@@H]12 2316763600 CSOKFMKIAXIJGB-QJPTWQEYSA-N 440.188 4.738 50 10 IJGE CN(Cc1cc(I)ccc1Cl)C[C@H]1CCC[C@H]1Br 2327398478 FCFDIZXLYBBBLY-ZWNOBZJWSA-N 442.566 4.940 50 10 IJGE N#CC(=Cc1ccc(F)cc1)C(=O)Nc1c(Br)cc(C#N)cc1Br 2329638769 JHKVKAZTYKISLF-UHFFFAOYSA-N 449.077 4.768 50 10 IJGE BrC[C@@H]1Cc2ccccc2CN1Cc1sccc1I 2338760740 PVINZRULKWFOEE-ZDUSSCGKSA-N 448.167 4.675 50 10 IJGE COc1cc(Cl)c(CBr)c(N(C)C[C@]2(Br)CC2(F)F)c1 2365819181 MACABQHHVSOFOB-GFCCVEGCSA-N 433.518 4.852 50 10 IJGE CCn1c2ccccc2c2cc(/C=N/NC(=O)C(NC(=O)c3ccccc3)=C(C)C)ccc21 27520867 BSABPMBVLDMYRU-OGLMXYFKSA-N 438.531 4.988 50 10 IJGE Cc1c(/C=N/NC(=O)CSc2nc3ccccc3s2)c(Cl)nn1-c1ccccc1 32519861 WZQFRWSXWZPQTM-SSDVNMTOSA-N 441.969 4.686 50 10 IJGE CCOc1cccc(-c2nn(-c3ccccc3)cc2/C=C(\C#N)C(=O)NCc2ccco2)c1 33561142 UAYIKRWXNMTGMT-XSFVSMFZSA-N 438.487 4.754 50 10 IJGE C[C@@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(F)cc1 38652807 UUCIQEJGHDOMEW-FATZIPQQSA-N 448.425 4.556 50 10 IJGE COc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4cc(C)cc(C)c4)c(C)c32)cc1 40813802 ZTOSTNPLXSWWHU-SGWCAAJKSA-N 445.519 4.936 50 10 IJGE Cc1ccc(-n2nc(C)c(/C=N/NC(=O)COc3ccc(Cl)cc3Cl)c2C)cc1 59167365 IAMLRKYDJSCQDG-BHGWPJFGSA-N 431.323 4.633 50 10 IJGE COc1ccc([C@H](C(=O)NC2CCCCCC2)N(Cc2cccs2)C(=O)CCl)cc1 97914999 JMYTTYQOIRDOFF-JOCHJYFZSA-N 449.016 4.904 50 10 IJGE Fc1cc2c(cc1I)nc(CCCl)n2C[C@@H]1CCCCS1 156555493 FCULFFIXBJZBGT-JTQLQIEISA-N 438.737 4.847 50 10 IJGE CCCCCOc1ccc(/C=C\C(=O)Oc2cccc(/C=C(\C#N)C(=O)OC)c2)cc1OC 206679612 TZSJAYFVCLENOD-PIFYNPJRSA-N 449.503 4.963 50 10 IJGE O=C(NCCCCCBr)c1cc(Br)ccc1Br 229210934 PZBQWUABQNJSJX-UHFFFAOYSA-N 427.962 4.507 50 10 IJGE COc1cccc(C=NNC(=O)c2ccccc2)c1OCCCOc1ccc(C)c(C)c1 254558890 OXIIILNEFIAILU-UHFFFAOYSA-N 432.520 4.924 50 10 IJGE Cc1ccc(O[C@@H](C)C(=O)NN=Cc2ccc(Cl)cc2Cl)c(Br)c1 256017630 XEKOOAUXNGNCRY-NSHDSACASA-N 430.129 4.982 50 10 IJGE BrCc1ccc2c(c1)c(I)nn2Cc1ccccc1 306798017 ZXRGEGDXAIVXFK-UHFFFAOYSA-N 427.083 4.584 50 10 IJGE N#C/C(=C1/CCN(C(=O)OCc2ccccc2)C1)c1ccc(I)cc1 309949327 FIMZNAMPQIDMTD-HTXNQAPBSA-N 444.272 4.611 50 10 IJGE Cn1ncc([C@H](Br)c2cc(F)c(Br)cc2F)c1Br 379226892 XCXQCPDEGOOODZ-SNVBAGLBSA-N 444.899 4.708 50 10 IJGE Cl[C@@H](c1coc(Br)c1)c1cc(I)cc2c1OCC2 386106497 SMNXTUWOFAOFHA-LBPRGKRZSA-N 439.474 4.910 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1C1CCN(Cc2ccccc2)CC1 387054585 QNXLYIBIRUACFP-UHFFFAOYSA-N 433.781 4.812 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1[C@H]2CC[C@H]1CC(CCl)C2 719286311 PNNBCMRTKKKXLA-IUCAKERBSA-N 427.589 4.895 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c1C 738542187 FTYGIPMPWGERGK-UHFFFAOYSA-N 435.491 4.528 50 10 IJGE O=C(NNc1cccc(F)c1F)c1ccc(NC(=O)c2cccc(Br)c2)cc1 743724390 GPWDIQAWPPSDND-UHFFFAOYSA-N 446.251 4.737 50 10 IJGE Cc1cccc2c1[C@H](OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)CCO2 814033065 HBWSTVGEZKALBO-HVQRGMKJSA-N 438.487 4.746 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N[C@H]2CCSc3ccccc32)c(-c2ccccc2)n1 914463483 GRQKJCWSCHTMJQ-ZHFOUCBBSA-N 439.544 4.724 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc3cccc(C(F)(F)F)c3nc2O)c(C(F)(F)F)c1 1448230889 SUYVANYRXPXMQC-UHFFFAOYSA-N 440.303 4.607 50 10 IJGE C#CCOc1ccccc1NC(=O)NNc1cc(C(F)(F)F)ccc1Br 1466207713 WRIPEEVXVMHYFJ-UHFFFAOYSA-N 428.208 4.629 50 10 IJGE C=CCN(CCOC)C(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1538839940 MUTYQGIDYDFILX-QGOAFFKASA-N 432.351 4.969 50 10 IJGE C=CCOc1c(Br)cc(CNC[C@@]2(C)C[C@@H]2Br)cc1OCC 1658338096 HFXBXSLHTXAACU-DOTOQJQBSA-N 433.184 4.676 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(SC(C)(C)C)c(F)c2)cc1 1670382101 SRVMJQZCHKUEOX-CQSZACIVSA-N 447.532 4.539 50 10 IJGE C[C@@]12CC[C@@H](CC1=NOC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)[C@]2(C)CBr 1772722836 XJKXRLUWKUHDCV-JECHBYEQSA-N 429.698 4.982 50 10 IJGE CCCCCCOc1ccc(C=NNC(=O)COc2cccc(Br)c2)cc1 1772753778 IKHJEJBMXVDOLG-UHFFFAOYSA-N 433.346 4.937 50 10 IJGE CCCc1nn(Cc2ccccc2)c2c1[C@H](c1cccc(OC)c1OCC)C(C#N)=C(N)O2 1865693896 RQLRHDZDZKCTQX-JOCHJYFZSA-N 444.535 4.509 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CC)cc1 1865694171 QUFDTBLBDWQOIZ-OAQYLSRUSA-N 430.508 4.586 50 10 IJGE CN(Cc1cccc(Br)c1)C[C@H](Br)COCc1ccccc1 1916355178 RADGIIURIQMIAK-SFHVURJKSA-N 427.180 4.861 50 10 IJGE CC(C)(C)OC(=O)NCCN(Cc1ccccc1)C[C@H](CBr)C1CCC1 1953584358 KAXUCFSWDHKWJQ-IBGZPJMESA-N 425.411 4.825 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCC13CCC3)CC[C@@](C)(CI)O2 1983725573 UVVBNXKTSQRTJD-FUHWJXTLSA-N 435.346 4.683 50 10 IJGE CCS(=O)(=O)C[C@@H](Cl)c1c(Br)sc(Br)c1Cl 1988339822 POTSJXPAGCGMAP-SCSAIBSYSA-N 430.998 4.641 50 10 IJGE C[C@@H]1CO[C@@](CBr)(Cc2cc(Br)ccc2Br)C1 2006498783 GFBKZXXXQDRETQ-TVQRCGJNSA-N 426.974 4.944 50 10 IJGE CCCN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)cc(CBr)c1F 2009658648 RZOAQOQBJXQVBE-UHFFFAOYSA-N 434.758 4.975 50 10 IJGE C[C@@H]1C[C@@H]1N(CCBr)Cc1ccc(I)c(Cl)c1 2026563360 JISYQLMFZPPKNE-RNCFNFMXSA-N 428.539 4.550 50 10 IJGE C[C@@H]1CCCN(C[C@H](CBr)c2ccccc2)[C@@H]1CNC(=O)OC(C)(C)C 2106782686 SFSSKXMIHYYXBV-NZSAHSFTSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2CN(CC3(CBr)CCCCC3)C[C@@H]21 2106787576 IZTZDVJIFUCSMY-OKZBNKHCSA-N 429.443 4.957 50 10 IJGE C[C@@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(CBr)c1F 2123269343 IGVCGPLGLRRYFG-ZDUSSCGKSA-N 444.341 4.849 50 10 IJGE C=CCC1(NC(=O)c2ccc(CBr)cc2)CCN(C(=O)OC(C)(C)C)CC1 2162590260 ZPAXTNLKCOTIHD-UHFFFAOYSA-N 437.378 4.657 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCCN1C(=O)c1ccc(CBr)cc1 2162912255 SUKPSXQCMFBQIO-MSOLQXFVSA-N 437.378 4.586 50 10 IJGE CCCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2167033890 TZKCSFJQVSQSAY-MSOLQXFVSA-N 445.442 4.968 50 10 IJGE CN(Cc1ccccc1CNC(=O)[C@H](Br)C1CCCC1)C(=O)OC(C)(C)C 2167047662 KJJVYAYVVUTUHE-GOSISDBHSA-N 439.394 4.623 50 10 IJGE CN(C(=O)[C@H](Br)C1CCCC1)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 2197469239 KJSNSOOSOLFAIH-QZTJIDSGSA-N 439.394 4.665 50 10 IJGE C[C@@H]1C[C@H](Br)[C@@H](C)N(Cc2ccc(I)c(Cl)c2)C1 2220345116 QPCKGZYYZODVLR-FOGDFJRCSA-N 442.566 4.938 50 10 IJGE CN[C@@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@H](Br)C1 2260113332 FFOIOKDRMJSDEG-IJESPZCISA-N 447.943 4.924 50 10 IJGE O=C(NCC1(CCl)CC(F)(F)C1)c1csc(Br)c1Br 2266910264 SZBLXFPESDXGJB-UHFFFAOYSA-N 437.531 4.657 50 10 IJGE O=C(NC[C@@H](CBr)C(F)(F)F)c1cc(Br)c(F)cc1Cl 2285846423 NPSFPPJRVNIISE-RXMQYKEDSA-N 441.444 4.545 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1cc(Br)c(F)cc1C 2285968495 CUJTVRJYGXGXKR-SNVBAGLBSA-N 427.177 4.533 50 10 IJGE COc1ccc2nc(C(C#N)=Cc3cc(C)n(-c4cc([N+](=O)[O-])ccc4OC)c3C)[nH]c2c1 2297371022 MKAKIFTYWPEMQI-UHFFFAOYSA-N 443.463 4.960 50 10 IJGE C[C@@H](Br)CCCN(C)Cc1cc(I)ccc1Cl 2307328625 PFQVONVWHVKTAY-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)[C@@H]2[C@@H]3CCCO[C@@H]32)c1 2313495373 AIMRLQXKYUXFEA-CRWXNKLISA-N 438.985 4.943 50 10 IJGE C=CCOc1c(Cl)cc(C=C(C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1Cl 2313567924 PTHNSCUQCMLVNE-UHFFFAOYSA-N 442.346 4.814 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)C=Cc2ccccc2OCC)c(OCC)c1 2314774571 QNARZRCPTVOJFR-UHFFFAOYSA-N 435.476 4.573 50 10 IJGE CC[C@H]1[C@H](CBr)CCN1Cc1ccc(Cl)c(I)c1 2315551748 VMYQSXYYQNUGBB-FZMZJTMJSA-N 442.566 4.940 50 10 IJGE Clc1cc(Br)c(CN2C[C@H]3OCCC[C@]3(CBr)C2)s1 2345960213 USKRLWDGOMNSMC-YPMHNXCESA-N 429.605 4.540 50 10 IJGE Cc1cc(C(=O)N2CC[C@@H](Br)C[C@@H]2C(F)(F)F)sc1Br 2361454286 HWAOMOGNPJBVTR-VXNVDRBHSA-N 435.103 4.749 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(C)c4)ccc32)c1 38684832 TVKUYNIEHVCLBY-DEOSSOPVSA-N 426.472 4.831 50 10 IJGE Cc1ccc2[nH]c(/C(C#N)=C\c3ccc(OS(=O)(=O)c4ccc(F)cc4)cc3)nc2c1 50717177 RKIHYCJEHSOYSJ-LGMDPLHJSA-N 433.464 4.842 50 10 IJGE O=C(N/N=C/c1cccc(Br)c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 97729960 SJHXDBSFGGSWGK-ZMOGYAJESA-N 440.272 4.604 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Br)Cc3cccc(Cl)c3)cc2[nH]1 109884463 ODNULYYMUMWNKX-LLVKDONJSA-N 430.527 4.951 50 10 IJGE C[C@@H]1CC(O[C@@H](CI)c2cccc(Br)c2)C[C@@H](C)O1 162586631 KCMDHBIQMFYPCF-HFAKWTLXSA-N 439.131 4.898 50 10 IJGE CC(C)(C)CCOC1(CI)CCN(C(=O)OC(C)(C)C)CC1 231317894 UGAHXLJQJJJSMX-UHFFFAOYSA-N 425.351 4.644 50 10 IJGE COc1ccc(-c2ccc(C=NNC(=O)c3ccc(Cl)c(Cl)c3)o2)c([N+](=O)[O-])c1 252628249 SLTFSUQNGTXCMM-UHFFFAOYSA-N 434.235 4.934 50 10 IJGE CCCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3ccc(O)cc3)cc2)cc1 254488445 SICVLHQLZXEAKV-UHFFFAOYSA-N 432.476 4.554 50 10 IJGE COc1ccc(-c2cc(C(=O)NN=Cc3cccc(Oc4ccccc4)c3)[nH]n2)cc1OC 254851141 MKQZDVSUIUVVDG-UHFFFAOYSA-N 442.475 4.650 50 10 IJGE BrCc1cc(Br)cc(Br)c1OC[C@H]1CCCO1 310369992 NJCAMLGXLITEIP-SNVBAGLBSA-N 428.946 4.664 50 10 IJGE CC[C@@H](C)N(CCBr)C(=O)c1cc(Br)ccc1Br 380777414 VLJCKJAGGBSRKC-SECBINFHSA-N 441.989 4.847 50 10 IJGE C[C@H]1CN(c2ccc(CBr)cc2[N+](=O)[O-])[C@H](C)[C@@H](C)N1Cc1ccccc1 404276176 NNJWROSXMMTJBC-GVDBMIGSSA-N 432.362 4.977 50 10 IJGE N#CSc1ccc(NC(=O)Nc2cccc(C(=O)NCc3ccc4c(c3)OCO4)c2)cc1 586700726 QUGYZOWMYKDHIS-UHFFFAOYSA-N 446.488 4.562 50 10 IJGE C[C@@H](CCl)[C@@H]1CCCCN1C(=O)c1ccc(I)c(Cl)c1 696714631 POUUULKOJJGAHW-HZMBPMFUSA-N 426.125 4.814 50 10 IJGE CSc1ccc(C=NNC(=O)COc2ccc3ccccc3c2Br)cc1 1084608156 FVAMHSBPGAUNCO-UHFFFAOYSA-N 429.339 4.853 50 10 IJGE C#CC1(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Br)cc3)c2C)CCCC1 1625026686 HBQNCIJVRBXWQJ-RGEXLXHISA-N 436.353 4.826 50 10 IJGE C[C@@H](NC(=O)COc1cccnc1NC(=O)Nc1ccc(SC#N)cc1)c1ccccc1 1858842027 FUVGYOFJHJUGCX-MRXNPFEDSA-N 447.520 4.555 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1ccc(Cl)cc1 1865690924 FCFXEEHPGMANFU-JOCHJYFZSA-N 446.938 4.930 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1cc(C)ccc1C 1865690947 FQYOTKFNKHHEFE-XMMPIXPASA-N 440.547 4.894 50 10 IJGE CCc1nn(Cc2ccc(F)cc2)c2c1[C@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865701542 XSIRSUPCFRNWOD-HSZRJFAPSA-N 445.542 4.697 50 10 IJGE CC[C@@H](CCBr)NC(=O)c1cccc(Br)c1Br 1943887773 VEAAPFAWSIEGBF-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE COc1ccc([C@H](Cl)c2cc(I)sn2)cc1Br 2007646225 WIMRWOKLYXQTOG-NSHDSACASA-N 444.519 4.847 50 10 IJGE CC1(C)OCCO[C@H]1[C@@H](Br)c1cc(Br)c(Br)s1 2013745501 VHCSCDQSYQAIHJ-IUCAKERBSA-N 449.002 4.903 50 10 IJGE Clc1ccc(I)c(CN2[C@H]3CC[C@@H]2C[C@H](Br)C3)c1 2037416886 PMPXPGCDHCIRMT-LMKPVCQUSA-N 440.550 4.835 50 10 IJGE CCCN1C[C@@H](Br)[C@H](Cc2cccc(Br)c2Br)C1 2039263861 ZJLKQCDWTYFAJR-DGCLKSJQSA-N 440.017 4.859 50 10 IJGE CC[C@H](Br)CN(CC)C(=O)c1cc(Br)ccc1Br 2044551850 YCAWHDOOKKBALF-VIFPVBQESA-N 441.989 4.847 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C[C@H](Br)C(F)(F)F)C2(CCCCC2)C1 2044696191 JVJVZFBPWCWNTM-OLZOCXBDSA-N 429.321 4.614 50 10 IJGE O=[N+]([O-])c1c(CBr)nn(Cc2ccc(C(F)(F)F)cc2)c1C(F)(F)F 2079259431 WQPCNTMHLYANCD-UHFFFAOYSA-N 432.118 4.772 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1cccc(Br)c1Br 2081239247 PUFUMGZYHJYYGP-LDYMZIIASA-N 441.989 4.751 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1ccc(Br)cc1Cl 2090383809 CDZGLRGZQBNAFF-VIFPVBQESA-N 429.605 4.739 50 10 IJGE COCCCN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)cc(CCl)c1Cl 2095872983 YBJIHARSRZLTIJ-UHFFFAOYSA-N 436.788 4.960 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]12CC[S@@](=O)(=NCC1(CBr)CCCC1)C2 2106788324 ORSWQJCOGVIPSG-BCHFMIIMSA-N 449.455 4.583 50 10 IJGE O=C(c1cccc(Br)c1Cl)N1CC[C@@H](CBr)C(F)(F)C1 2146376347 YTYFIZBUYCZTKO-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE FC(F)[C@H]1CCN(c2c(CBr)ccc(Br)c2Cl)CCO1 2154364869 LVGYVMUHQWGJLH-SNVBAGLBSA-N 433.518 4.858 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)C[C@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 2196915572 ZOJIILFLKJWHCV-JYJNAYRXSA-N 437.378 4.547 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Br)[C@@H]1CCCCS1(=O)=O 2203005493 XAJHNOFWQZXOAH-NWDGAFQWSA-N 446.588 4.514 50 10 IJGE CCc1nn(-c2cccc(OC)c2CBr)c(CC)c1I 2203215006 YCIHNBFBDLAHQB-UHFFFAOYSA-N 449.130 4.505 50 10 IJGE C[C@H](CC1CCN(CC2(CBr)CCOCC2)CC1)N(C)C(=O)OC(C)(C)C 2203640491 QOJSGRKDACFEIW-QGZVFWFLSA-N 447.458 4.536 50 10 IJGE Cc1cc([C@@H](Br)c2ccc3nc(O)oc3c2)ccc1I 2207105502 USVBTXIHJLDSAH-CQSZACIVSA-N 444.066 4.931 50 10 IJGE CCN(C[C@](C)(CI)O[C@H]1CCC(F)(F)C1)C(=O)OC(C)(C)C 2212200755 PPKNAUSOQDFYDV-WFASDCNBSA-N 447.304 4.642 50 10 IJGE O=C(c1ccccc1I)N1C[C@H](Br)CC12CCCCC2 2241033635 ZXQQROFJDKTCBR-GFCCVEGCSA-N 448.142 4.604 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@]12CCC[C@@H](CI)O2 2243432841 FDBKYQRENDSWII-RLFYNMQTSA-N 437.362 4.642 50 10 IJGE C=CC[C@@]1(CBr)CCN(C(=O)c2cc(Br)c(Cl)s2)C1 2272143814 OBSLRYKIEZDNNF-ZDUSSCGKSA-N 427.589 4.967 50 10 IJGE C[C@@H](Cl)CC(C)(C)CNC(=O)Cc1cc(Br)cc(Br)c1 2295315854 QUCMLQPFVRRFEU-SNVBAGLBSA-N 425.592 4.914 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)C=Cc3cccs3)ccc2[C@H]1c1ccc(F)cc1F 2297640450 KXXRABGILWHZJH-JOCHJYFZSA-N 436.439 4.863 50 10 IJGE C[C@H]1C[C@H](CBr)CCN1Cc1ccc(Cl)c(I)c1 2315554274 CWFVZRIUSQSDMZ-WDEREUQCSA-N 442.566 4.940 50 10 IJGE Clc1ccc(CN2C[C@H](Br)CC3(CC3)C2)cc1I 2315554966 LKTQNHSSXDITHG-LLVKDONJSA-N 440.550 4.694 50 10 IJGE COC[C@@H]1C[C@H](Br)[C@H](Cc2ccc(Cl)cc2I)C1 2318528864 KALFIMZSKDCAIN-GAFUQQFSSA-N 443.550 4.923 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1Cl)c1cccn(Cc2cccc(Cl)c2)c1=O 2323652475 RWSZICOTCRCGEX-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE Cc1cnc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)cc1CBr 2352269615 KCRGLIYSQQVEDB-KRWDZBQOSA-N 428.296 4.538 50 10 IJGE CCO[C@@H]1CN(CCCCCCCCCBr)C[C@H]1CNC(=O)OC(C)(C)C 2354609155 WKIUFIVZZNLROA-RTBURBONSA-N 449.474 4.974 50 10 IJGE COc1c(Br)cc(C)c([C@H](Cl)[C@@]2(C)COCCO2)c1Br 2365232761 RALKKOWLZWSVSN-UONOGXRCSA-N 428.548 4.614 50 10 IJGE CC(C)CCOc1cccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)c1 14644599 GOCSDIAIRLTXGT-AWEZNQCLSA-N 439.339 4.647 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3cccc([N+](=O)[O-])c3)ccc2[C@H]1c1cccc(Cl)c1 38651271 NRKMNSHHTFYLLV-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE O=C(c1cc(C(F)(F)F)ccc1Br)N1CCC[C@@H](CBr)C1 159884709 WDVDFRSCRSEENJ-VIFPVBQESA-N 429.074 4.715 50 10 IJGE COc1cc(/C=C(/C#N)c2nc3ccccc3c(=O)[nH]2)cc(OC)c1OCc1ccccc1 169941520 BABUBDZBAFIYEZ-UNOMPAQXSA-N 439.471 4.583 50 10 IJGE O=C(OCC(=O)N(N=Cc1ccccc1)c1cccc(C(F)(F)F)c1)c1cccs1 254392794 CXZLKRNPZVZRIF-UHFFFAOYSA-N 432.423 4.991 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OCc2ccccc2F)C1 303740733 DXGSKUWDNLPYRJ-SFHVURJKSA-N 449.304 4.547 50 10 IJGE O=C(NCCCCCBr)c1scc(Br)c1Br 705512613 NXBMCXOGGDDLSR-UHFFFAOYSA-N 433.991 4.568 50 10 IJGE ClCCc1nc2cccc(Br)c2n1Cc1ncc(Br)s1 714934733 YNASNMYMJIROFR-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CC(=O)c1cccc(S(=O)(=O)NC(=O)c2ccc(S(F)(F)(F)(F)F)cc2)c1 760184090 UXYDIKQWBHKOHO-UHFFFAOYSA-N 429.388 4.665 50 10 IJGE Cn1nccc1[C@@H]1CCCCN1C(=O)C(=O)Nc1cccc(S(F)(F)(F)(F)F)c1 799274529 SSKVGWOYCDQHJH-HNNXBMFYSA-N 438.422 4.770 50 10 IJGE Cc1nn(-c2ccccc2)c(C)c1C=NNC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 1084543520 LDDLJRVJIQXFTR-HNNXBMFYSA-N 431.323 4.714 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNC(=O)c1cc(F)ccc1Br 1584831735 AUNSIVWBGOOZLD-VQHVLOKHSA-N 446.103 4.760 50 10 IJGE CCOc1cc(C=NNC(=O)CSc2nc3ccccc3s2)ccc1OC(C)C 1772760498 SMSAETQQQYMQHU-UHFFFAOYSA-N 429.567 4.725 50 10 IJGE N#CSc1ccc(NC(=O)c2ccnc(NC(=O)COc3ccc(Cl)cc3)c2)cc1 1860507561 GDTOFQVESGQPJH-UHFFFAOYSA-N 438.896 4.578 50 10 IJGE CCc1nn(-c2cccc(Cl)c2)c2c1[C@@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865688875 DALWRDWBXUCDDZ-SFHVURJKSA-N 427.291 4.665 50 10 IJGE O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)CCCSc1ccccc1 1865756389 WCFNWXKNYABPPX-UHFFFAOYSA-N 441.380 4.872 50 10 IJGE O=C(c1ccc(F)cc1I)N(CCCCl)Cc1ccccc1 1914602152 DPTSYOYGNBEDQM-UHFFFAOYSA-N 431.676 4.702 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCCC2(CCC2)[C@@]12CC[C@@H](CI)O2 1924804170 ZVJMHHSRMMWSMF-YZVOILCLSA-N 449.373 4.834 50 10 IJGE Brc1cccnc1C[C@H](Br)c1nscc1Br 1924863863 IZWHTMVRBJXJOM-ZETCQYMHSA-N 426.959 4.742 50 10 IJGE O=C(OCc1ccccc1)N1CCC2(CC1)CCN2C[C@@H](CBr)C1CCC1 1999502577 UDPPSHVLLOBOHT-HXUWFJFHSA-N 435.406 4.675 50 10 IJGE C=CC[C@@H](CBr)CNC(=O)c1cc(Br)c(Br)s1 2023521868 WNUZJEVMJDEJOS-ZETCQYMHSA-N 446.002 4.590 50 10 IJGE C[C@@H](C[S@@](C)(=O)=NCC1(CBr)CCCCCC1)NC(=O)OC(C)(C)C 2044699432 KYXIOESLMPKTQO-ODCWNRFASA-N 439.460 4.733 50 10 IJGE CCC[C@H](CBr)CNC(=O)c1cc(Br)cc(Br)c1 2057120843 VFGDFDBTZJKZBR-SECBINFHSA-N 441.989 4.753 50 10 IJGE Cc1nn(C)c(Br)c1[C@H](Br)c1ccc(F)c(Br)c1 2065885238 BGOPXYLRCJEHMA-LLVKDONJSA-N 440.936 4.877 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CC[C@@H](Cl)C(F)(F)CC1 2150039971 RQAKQSRGJIQEDB-LLVKDONJSA-N 431.502 4.690 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN(C(=O)[C@H](Br)C2CCCC2)C1 2167034573 XHVPXOOVFURZGU-KZNAEPCWSA-N 443.426 4.578 50 10 IJGE O=C(c1ccc(Cl)cc1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Br)C2 2190677307 HVAWVKJZZHMMLJ-OQCKYNKVSA-N 425.523 4.581 50 10 IJGE O=C(c1cccc(Br)c1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Cl)C2 2190688719 YFRQTAWZOUIQAG-LXOIKGMDSA-N 425.523 4.534 50 10 IJGE CCCCN(C1CCC1)S(=O)(=O)c1cc(CBr)sc1Br 2197125261 JGJFDRRVTDYLRF-UHFFFAOYSA-N 445.242 4.749 50 10 IJGE CCC[C@@H](CCBr)CNC(=O)c1ccc(C)c(I)c1 2224619658 XVEPOWPGKHHKQD-LBPRGKRZSA-N 438.147 4.531 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1C[C@@H](C)[S@@](C)=O 2234060239 MEYXQLWPMRXLJQ-SMPFOWEGSA-N 442.604 4.628 50 10 IJGE CCCN(CCCCI)C[C@@H]1CCCCN1C(=O)OC(C)(C)C 2243591784 ZHPFADZGIMPGQG-INIZCTEOSA-N 438.394 4.703 50 10 IJGE COc1ccc([C@H](Br)C[C@@H]2CC[C@@H]2OC)cc1I 2257365214 PQCYGYOTVLFXAG-LOWVWBTDSA-N 425.104 4.551 50 10 IJGE CC[C@H]1[C@H](Br)CCN1C(=O)c1cc(Br)ccc1Br 2260370454 CJFQGSRWRMSLIJ-NEPJUHHUSA-N 439.973 4.600 50 10 IJGE CC1CCN(C(=O)C(C#N)=Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)CC1 2296701131 WPXNJBSDKDZBOQ-UHFFFAOYSA-N 441.491 4.613 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](N)[C@H]1C[C@H](Br)C1 2301504250 ZLAZINVVLFCLKW-WSFZALMZSA-N 429.953 4.832 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)[C@@H]1CCC[C@H]1Cl 2306224831 UBHNVWHQVCTXRK-DGCLKSJQSA-N 428.539 4.645 50 10 IJGE CN(Cc1cc(I)ccc1Cl)[C@@H]1CCC[C@@H]1Br 2307315186 DXUDDZVEDNOTDI-WCQYABFASA-N 428.539 4.692 50 10 IJGE O=S1(=O)C[C@H]2C([C@H](Cl)c3cc(Br)ccc3OCc3ccccc3)[C@@H]2C1 2314439268 GKAQSVDDISJPDZ-GPMSIDNRSA-N 441.774 4.599 50 10 IJGE CC[C@@H](C)N1C(=O)C(=Cc2ccc(OCc3ccccc3)c(OC)c2)C(C)=C(C#N)C1=O 2314611727 ZJPMXPQWVUETIE-QGZVFWFLSA-N 430.504 4.665 50 10 IJGE COc1cc(C=C2C(=O)N(CCc3ccccc3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 2314617477 YXWDDGRSWADDAL-UHFFFAOYSA-N 444.531 4.565 50 10 IJGE COc1c(CBr)cccc1OCc1sccc1I 2318944498 QQTGEVXVVJIGHB-UHFFFAOYSA-N 439.112 4.835 50 10 IJGE CC[C@@H](NC(=O)C(C#N)=CNc1cc(Br)ccn1)c1ccc2c(c1)CCCC2 2325092831 WYAQDPMUVQMYKB-HXUWFJFHSA-N 439.357 4.810 50 10 IJGE C[C@H]1C[C@@H](Br)[C@H](C)CN1Cc1cc(I)ccc1Cl 2327404739 KJQTTWXXKLHBPM-GBIKHYSHSA-N 442.566 4.938 50 10 IJGE Cc1cc(C(=O)NC(C)(C)[C@@H](Br)C(C)C)ccc1I 2340403741 WFEZLJSVTHQUAQ-ZDUSSCGKSA-N 438.147 4.528 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)c2cccc(C)c2)cc1Br 14640654 OTEOPFDQBXZKOH-UHFFFAOYSA-N 433.346 4.791 50 10 IJGE N#C/C(=C/c1c(Oc2ccccc2)nc2ccccn2c1=O)C(=O)Nc1ccc(Cl)cc1 39858483 AMCVWHVJTNRZGD-PEZBUJJGSA-N 442.862 4.686 50 10 IJGE Cc1ccc(C)c(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)Cc2ccccc2)CCC3)c1 40815741 OZUVYMVUZRQGQX-VFCFBJKWSA-N 429.520 4.856 50 10 IJGE Cc1c(/C=N\NC(=O)CC[C@@H](O)c2ccccc2)c2ccccc2n1Cc1ccccc1 58888713 RJQICWFYFZZRAU-JQXKRNIHSA-N 425.532 4.962 50 10 IJGE N#CCOC(=O)c1cc(-c2ccc(/C=C(/C#N)C(=O)Nc3ccccc3)o2)ccc1Cl 59862555 HBEDUXOAPWHKCZ-VBKFSLOCSA-N 431.835 4.826 50 10 IJGE COc1ccc(/C(C)=N\NC(=O)c2ccc(COc3cccc4cccnc34)cc2)cc1 96698194 VGDGUNWUCLWGCQ-VEILYXNESA-N 425.488 4.976 50 10 IJGE COc1cccc(CN(C(=O)CCl)[C@@H](C(=O)NC2CCCCC2)c2ccc(C)cc2)c1 97914440 HQTMDGLBQSTSAK-XMMPIXPASA-N 442.987 4.761 50 10 IJGE COc1ccc([C@H](C(=O)NC2CCCCCC2)N(Cc2ccccc2)C(=O)CCl)cc1 97915001 SWGYLHKTBMYBQC-XMMPIXPASA-N 442.987 4.843 50 10 IJGE COc1cc(CBr)cc(Br)c1OCc1c(C)nn(C)c1Cl 166883769 GGLHFALJQBOVPT-UHFFFAOYSA-N 438.547 4.627 50 10 IJGE COc1ccc(C(=O)NN=C2CCN[C@@H]3CCCC[C@@H]23)cc1COc1ccccc1Cl 254527550 MDTKETGJOMDZSA-UYAOXDASSA-N 441.959 4.566 50 10 IJGE COc1cc(C=NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc(OC)c1OC 254855534 ORPGZLBLFJCUCW-UHFFFAOYSA-N 441.487 4.692 50 10 IJGE O=S(=O)(NCc1ccc(OCc2ccccc2)cc1)c1ccc(CBr)cc1 312538657 HQHBPZGZFIASGF-UHFFFAOYSA-N 446.366 4.639 50 10 IJGE Cn1ncc([C@@H](Br)c2cc(Cl)ccc2Cl)c1I 383249094 DTUBTOBWLOEREO-JTQLQIEISA-N 445.913 4.816 50 10 IJGE C[C@H](CCCCBr)NC(=O)c1ccc(Br)cc1Br 398536301 SSUHCAYWQJHUPE-SECBINFHSA-N 441.989 4.895 50 10 IJGE O=C(N[C@@H]1CCC[C@@H](Br)C1)c1cc(Br)ccc1Br 694508029 STDCRMFCDNASCO-PSASIEDQSA-N 439.973 4.648 50 10 IJGE CN(C(=O)c1scc(Br)c1Br)C(C)(C)CBr 705515799 UVWHXTJAMWOZMK-UHFFFAOYSA-N 433.991 4.519 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)cnc2n1Cc1cnc(Br)s1 718873900 NOSROMCBDPTMBT-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE O=C(NCC1(c2ccc(Cl)cc2Cl)CCC1)NNC(=O)c1cccc2cccnc12 769704547 BNYWXAKADDQPJI-UHFFFAOYSA-N 443.334 4.608 50 10 IJGE C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](O[Si](C)(C)C(C)(C)C)C1 1149155865 BXOPKCWSNYTNQD-HZPDHXFCSA-N 433.065 4.645 50 10 IJGE BrC[C@@H](CN1CC2(CCOCC2)c2ccc(Br)cc21)C1CC1 1175129072 PVRBQBWGJHUFME-AWEZNQCLSA-N 429.196 4.738 50 10 IJGE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2 1463643025 OUJQXRQUGHRMQV-IXJPEXDMSA-N 438.471 4.636 50 10 IJGE C#CCOc1cc(F)ccc1NC(=O)NNc1cc(C(F)(F)F)ccc1Br 1562441467 CCFFOPVKJUMVEF-UHFFFAOYSA-N 446.198 4.768 50 10 IJGE C=CC[C@H]1CCCC[C@H]1NC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12 1565063750 SEDFICIXTJKUGM-PGRDOPGGSA-N 428.536 4.981 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)[C@H](c1c(F)cccc1Cl)N1CCCCC1 1633440190 VITYNFXTACXAII-SFHVURJKSA-N 445.951 4.755 50 10 IJGE CCN(C(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccc1F)CCC2)c1ccccc1 1772744655 ZQPQLQLERIMEHO-UHFFFAOYSA-N 433.483 4.864 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@H](c1ccc(OC)cc1)C(C#N)=C(N)O2 1865714063 BTWNMKAHKATHCV-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE O=C(N[C@H](CCl)[C@@H]1CC=CCC1)c1cc(Br)c(Br)s1 1885070341 VOKSSLRTKOORED-PSASIEDQSA-N 427.589 4.967 50 10 IJGE CC(C)(CI)CN1Cc2ccccc2CN1C(=O)OC(C)(C)C 1904653141 IXHMXSFZVSBNTB-UHFFFAOYSA-N 430.330 4.616 50 10 IJGE O=S1(=O)CC[C@H]([C@@H](Br)c2c(Cl)sc(Br)c2Cl)C1 1925570089 AYWSGRDPSPNCHS-UJURSFKZSA-N 443.009 4.688 50 10 IJGE C[P@]1(=O)C[C@@H](Br)[C@@H](Cc2cc(Cl)ccc2I)C1 2005165377 SBEQROXFSKMNLP-VKHBWIJISA-N 447.478 4.873 50 10 IJGE CCN1CCC[C@H]([C@@H](Br)c2cccc(OCc3ccccc3)c2)S1(=O)=O 2089516900 ZSKHJEQLCAPDAB-UXHICEINSA-N 438.387 4.516 50 10 IJGE CC1(C)[C@@H]([C@@H](Br)c2cc(I)cc3c2OCC3)C1(F)F 2097390564 NCBXUFRWPRJXOV-CMPLNLGQSA-N 443.069 4.953 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCCN1C[C@@H](CBr)c1ccccc1 2106786542 VEBMUCKHVKVALD-UHOSZYNNSA-N 425.411 4.933 50 10 IJGE C[C@@H](Cl)c1nc2cncnc2n1CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 2219824080 KBASRWIPNHEXMQ-LJQANCHMSA-N 447.970 4.598 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=Cc2ccc(-c3ccc([N+](=O)[O-])cc3C)o2)cc1 2293366986 NTCUMTRFKCTULR-UHFFFAOYSA-N 445.431 4.886 50 10 IJGE CC(C)(C)OC(=O)NC1C[C@@H]2CSC[C@H](C1)C21C[C@]1(CBr)C(F)(F)F 2318656233 SWZOIETYXZJKTH-LIRLIREKSA-N 444.357 4.986 50 10 IJGE CC[C@H](Cl)c1cnn(Cc2ccc(I)c(Br)c2)c1 2325174580 FVDUZVDDJFRPJH-LBPRGKRZSA-N 439.522 4.988 50 10 IJGE C[C@H]1CC[C@@H](CCl)CN1Cc1ccc(I)c(Br)c1 2325214895 TWAYZMGLBYLLGV-JQWIXIFHSA-N 442.566 4.893 50 10 IJGE COC[C@]1(C)C[C@]1(CCl)Cc1ccc(I)c(Br)c1 2325224244 VOPWILIXJUTKQY-KBPBESRZSA-N 443.550 4.878 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@@H]3[C@H](CCN3Cc3ccccc3)C2)c1 2340266722 BFLXZTXDMBTXGF-IIBYNOLFSA-N 435.793 4.954 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 2343414616 QCAQKYUXQBNMKO-BRWVUGGUSA-N 436.312 4.842 50 10 IJGE C=CCOc1c(Br)cc(/C=C(\C#N)C(=O)c2ccccc2OC)cc1OC 11334367 WFJXTECQGIRRSQ-XNTDXEJSSA-N 428.282 4.821 50 10 IJGE CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(NC(=O)c3ccccc3C)cc2)cc1 12578605 JCSHXBQATXWPCB-OVVQPSECSA-N 428.536 4.857 50 10 IJGE CCCCCCOc1ccc(/C=C(\C#N)C(=O)Nc2cccc(C(=O)OC)c2)cc1OC 40853586 HLUVFVAWKKHYFP-XSFVSMFZSA-N 436.508 4.987 50 10 IJGE CCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@@H]2CCOc3ccc(Br)cc32)c1C 108784634 DMVDLXIDGBNKQZ-ZZODWALSSA-N 442.357 4.824 50 10 IJGE O=[N+]([O-])c1ccccc1C[C@@H](Br)c1cccc(I)c1 110296483 AKEWABAADNQKCQ-CYBMUJFWSA-N 432.055 4.878 50 10 IJGE COc1ccc(OC)c(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4Cl)nc3c2)c1 169926797 FYVJJSDXVWGBJW-DHRITJCHSA-N 434.883 4.664 50 10 IJGE COc1ccc(C(=O)Oc2ccc3ccccc3c2C=NNC(=O)c2ccccc2F)cc1 254399507 WDXVZQFFAKTDIX-UHFFFAOYSA-N 442.446 4.971 50 10 IJGE CC(=NNC(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1)c1ccc2ccccc2c1 254505143 UNECYWUZUSMZTQ-UHFFFAOYSA-N 449.557 4.856 50 10 IJGE CO[C@H]1C[C@@H](COc2c(Br)cc(CBr)cc2Br)C1 721907040 FEIGGDYUFROMEQ-AOOOYVTPSA-N 442.973 4.910 50 10 IJGE O=C(CC[C@@H](O)c1ccccc1)NN=Cc1ccc(-c2ccc(Br)cc2)o1 725423541 QTFOHQADRUIFCL-LJQANCHMSA-N 427.298 4.673 50 10 IJGE O=C(NCc1ccccc1-c1ccc(Cl)cc1)NNC(=O)c1cccc2cccnc12 726799490 OUQUVFFSMKYUSS-UHFFFAOYSA-N 430.895 4.699 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N(C)[C@H](C)Cc2ccc(Cl)cc2)c(C)n1C[C@H]1CCCO1 736516471 GHKDFPPEXUHRKZ-XJXBXUCDSA-N 439.987 4.934 50 10 IJGE CCOc1ccccc1NC(=O)C(=O)NN=Cc1ccc(-c2ccc(Cl)c(Cl)c2)o1 1084274850 WLAIQXBZQKLHIO-UHFFFAOYSA-N 446.290 4.741 50 10 IJGE C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@]2(c3ccccc3)C[C@H]2Br)cc1 1142298645 POODPCIZWCAOJL-OFNKIYASSA-N 439.353 4.545 50 10 IJGE C#CCOc1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 1456313295 CKJXATZCQRCYOR-LTGZKZEYSA-N 425.488 4.660 50 10 IJGE C=CCC[C@H](CO)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1627412995 XWXFZCHYINUUSR-WSDUQJHMSA-N 432.351 4.751 50 10 IJGE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NNc1nc(-c2ccc(Cl)cc2)no1 1627960343 LRWZPCMWHQRLOD-KHPPLWFESA-N 438.793 4.835 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@H](c1cc(C)ccc1O)C(C#N)=C(N)O2 1865687213 MBFKHAKIYJZBTR-OAQYLSRUSA-N 434.927 4.770 50 10 IJGE CCN(CC)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2Cl)cc1 1865702043 LGVWFHOMCVRASX-QFIPXVFZSA-N 433.943 4.899 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@H]1c1ccccc1O 1865707878 IKGCCWKTKZVLCY-INIZCTEOSA-N 446.816 4.527 50 10 IJGE Cc1ccc(-c2csc(/C(C#N)=C(\O)CCN3C(=O)c4ccccc4C3=O)n2)cc1C 1872756627 SUYLETNLAMXTDT-VZCXRCSSSA-N 429.501 4.906 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Cl)CCc1cc(Cl)ccc1Br 1905343689 PXXKBOUTYDOHNV-CYBMUJFWSA-N 427.125 4.939 50 10 IJGE C[C@@H]([C@@H](Br)c1c(Cl)sc(Br)c1Cl)S(C)(=O)=O 1925575457 XYQMSUGPLHULBH-WVZVXSGGSA-N 430.998 4.687 50 10 IJGE CCCc1nc(Br)c(Br)n1C[C@H](CBr)C1CC1 1940509280 WBQXTARZDRTYNG-VIFPVBQESA-N 428.994 4.782 50 10 IJGE CC[C@@H]1CN(Cc2c(Br)cccc2Br)C[C@@H]1Br 1945324145 WFOBAURDAXMIKZ-RNCFNFMXSA-N 425.990 4.817 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1cscc1OCc1ccccc1 1950312897 DZODZPSQKRGDQU-OAHLLOKOSA-N 428.417 4.964 50 10 IJGE Cc1nc(C(=O)N(Cc2ccccc2)[C@@H](C)CBr)c(Br)s1 1956718988 CAFTVCXHAFHTLP-JTQLQIEISA-N 432.181 4.640 50 10 IJGE CC[C@H]1CN(Cc2cc(Br)ccc2Br)C[C@@H]1Br 2006497499 VFRQJBGOZORHMH-ZANVPECISA-N 425.990 4.817 50 10 IJGE O=C(NCC[C@@H](Br)C1CC1)c1cc(Br)ccc1Br 2029911946 OSAMLUWLXPJFRR-LLVKDONJSA-N 439.973 4.505 50 10 IJGE CCC(CC)(CBr)CN1CCCN(C(=O)OC(C)(C)C)CC(F)(F)C1 2044704189 AOOORROCUGCBRS-UHFFFAOYSA-N 427.374 4.766 50 10 IJGE Brc1cccc(CN2C[C@@H]3CC[C@H](C2)C3Br)c1Br 2048820047 AJXKOKUIWFIVSQ-QYJAPNMZSA-N 438.001 4.817 50 10 IJGE CC1(C)C[C@@H](CCl)CN(c2ncc(I)cc2Br)C1 2069530110 VLNOQHLTKVTACB-VIFPVBQESA-N 443.554 4.540 50 10 IJGE FC1(F)C[C@]12C[C@H]2[C@@H](Br)c1cc(I)cc2c1OCC2 2115294688 MPFJZIOYQPZMNO-GVXVVHGQSA-N 441.053 4.707 50 10 IJGE Cc1sc(CCl)cc1S(=O)(=O)N(C)[C@@H]1CC(C)(C)[C@H]1OCc1ccccc1 2156441973 KHDXXMUVGITLSE-MJGOQNOKSA-N 428.019 4.800 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@@H]2NC(=O)N1CCC(Br)CC1 2162494211 GIKRLCKVLWMJNT-KRWDZBQOSA-N 438.366 4.590 50 10 IJGE COc1ccc([C@H](Cl)c2ccoc2Br)cc1I 2248885800 DAQUEEVOQNSTLL-NSHDSACASA-N 427.463 4.984 50 10 IJGE Fc1ccc([C@@H](CI)OC2CCN(Cc3ccccc3)CC2)cc1 2250385943 IXTHTISXKDTNAW-HXUWFJFHSA-N 439.312 4.983 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@]23CCOC[C@H]2C3)c1 2263509825 KVWWWOSXTRKMGS-SWHYSGLUSA-N 438.985 4.944 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@H](CBr)CC2CC2)[C@H](C(F)(F)F)C1 2266310757 SLLVYMVTFZWOBH-KFWWJZLASA-N 443.348 4.718 50 10 IJGE O=C(N[C@@]1(CCl)C[C@H]2CC[C@H]1C2)c1scc(Br)c1Br 2268626516 NNAARCJKJLXPKX-UVPNAGLESA-N 427.589 4.801 50 10 IJGE C[C@@]1(CCBr)CCN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285835828 SULDFVYEPJPIPG-CQSZACIVSA-N 427.539 4.879 50 10 IJGE COc1cc(C=C(C#N)C(=O)N[C@@H]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OCc1ccccc1 2294516820 IVJIXOYYIQIRPV-DYESRHJHSA-N 449.507 4.784 50 10 IJGE C[C@@H](Br)CN(Cc1sccc1I)C1CCCC1 2303327311 KDEMJPOHYSTGCK-SNVBAGLBSA-N 428.177 4.881 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)C(C#N)=CN1CCC(Cc2ccccc2)CC1 2325069041 ZRBKBAYQJVPKET-NRFANRHFSA-N 431.580 4.933 50 10 IJGE CC[C@H]1CN(Cc2cc(I)ccc2Cl)C[C@H]1CBr 2327408624 CZYJTOMKTUVGFS-CMPLNLGQSA-N 442.566 4.798 50 10 IJGE CC(C)C[C@H](CBr)CN1CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2353821911 GUWPVROXWYVSGP-QLFBSQMISA-N 445.364 4.964 50 10 IJGE O=C(CSc1ccc(Cl)cc1)NNc1nc2c(Br)cccc2s1 10045941 LKGDORRBRMYUTD-UHFFFAOYSA-N 428.764 4.948 50 10 IJGE Cc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc(OCc3ccccc3)cc2)cc1C 12581147 HRMBINDAAUVQIY-WPWMEQJKSA-N 429.520 4.751 50 10 IJGE COc1ccc2nc(N(/N=C/c3ccc([N+](=O)[O-])s3)C(=O)c3ccco3)sc2c1 35565455 FEFSSXOCVRAUGB-VXLYETTFSA-N 428.451 4.549 50 10 IJGE Cc1cc(C)cc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)c1 38652944 BAPGGXOLBVVOSF-VWLOTQADSA-N 444.462 4.645 50 10 IJGE CCCCCN1C(=O)/C(=N\NC(=O)c2cccc(Cl)c2)c2cc(Br)ccc21 40846262 DCJWLBWFTCMCJX-NKFKGCMQSA-N 448.748 4.773 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2ccc(C(C)C)c(C)c2)cc1 40988744 VJLBJHHQGRYIRR-RCCKNPSSSA-N 434.536 4.926 50 10 IJGE C[C@@H](CCl)C(=O)Nc1c(Br)cc(Br)cc1Br 54711720 BOKJBHKWGLIVTH-YFKPBYRVSA-N 434.353 4.788 50 10 IJGE ClCCCc1ncc(-c2cc(I)ccc2Br)o1 236012175 UNZHLDFQJVCVKV-UHFFFAOYSA-N 426.479 4.880 50 10 IJGE O=C(NCC1(CCl)CCCCC1)c1cc(Cl)ccc1I 236015156 YWKSNCZFMFNHTM-UHFFFAOYSA-N 426.125 4.864 50 10 IJGE C[C@H]1[C@H](Br)CCCN1C(=O)c1ccc(Br)cc1Br 384217147 CPKJCZRNDFNPJV-GZMMTYOYSA-N 439.973 4.600 50 10 IJGE ClCCc1nc2ccc(Br)cc2n1C1[C@H]2CN(Cc3ccccc3)C[C@H]12 398447877 MFRNJAKMRYCCIP-IRXDYDNUSA-N 430.777 4.883 50 10 IJGE FC(F)Oc1ccc(CBr)c(I)c1Br 575682439 QMZCTKXHQYYWMF-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE C=Cc1ccc(CCNC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1 1312739117 FGMWAWXEYGRTOX-UHFFFAOYSA-N 436.515 4.732 50 10 IJGE C=CC1(CC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)CCCCC1 1463781106 DRNHJNSFCFDVPX-UHFFFAOYSA-N 428.536 4.827 50 10 IJGE CC(=O)CCc1ccc(OCc2cccc(C(=O)NC[C@@]3(C)C[C@@H]3Br)c2)cc1 1533793629 GVRWQHBFAJPZSR-JTHBVZDNSA-N 444.369 4.691 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1[C@@H]1CN(C(=O)OCc2ccccc2)C[C@H]1CBr 1614643599 UBYXTBMTUAKLBT-VQIMIIECSA-N 433.302 4.650 50 10 IJGE Cc1c(C(=O)Nc2cccnc2)oc2c1C(=NNC(=O)c1cccc3ccccc13)CCC2 1772747308 GAERPTDEDUSUJD-UHFFFAOYSA-N 438.487 4.859 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@H]2C)oc2c1C(=NNC(=O)Cc1ccccc1)CCC2 1772747578 DGVNGPQEJHHBDB-QGZVFWFLSA-N 441.531 4.579 50 10 IJGE CCCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3C)cc1OC 1865695755 SKNSRBOREMVECU-QFIPXVFZSA-N 444.535 4.883 50 10 IJGE CC(C)[C@@H](C(=O)NCC(=O)Nc1ccc(SC#N)cc1)c1ccc(Br)cc1 1868150561 BNQAURCVHHATRI-LJQANCHMSA-N 446.370 4.517 50 10 IJGE C[C@@H]([C@@H](Cl)c1c(Br)sc(Br)c1Cl)S(C)(=O)=O 1923049787 NQSJLHXMNFCFER-WVZVXSGGSA-N 430.998 4.640 50 10 IJGE C[C@@H]1CN(C[C@H](CBr)C(C)(C)C)C[C@@H](C)N1C(=O)OCc1ccccc1 1977952902 SSJSABSWMOSKLH-LMMKCTJWSA-N 425.411 4.775 50 10 IJGE C[C@@H]1CCC[C@@](CI)(OCCOCCOCc2ccccc2)C1 1983389999 OJTGTPNGDIIKLD-IEBWSBKVSA-N 432.342 4.620 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@@H]2OCCO[C@H]2C)cc1Br 2027178978 UNDZQPAUBORDOP-AQUOVQTQSA-N 442.973 4.760 50 10 IJGE CCOC(C)(C)CO[C@@H](CI)c1cccc(Br)c1 2033159937 OUKSPXFIWRZCHD-ZDUSSCGKSA-N 427.120 4.757 50 10 IJGE CC(C)[C@@H](Br)[C@@H](C)NC(=O)c1ccc(Br)cc1Br 2041305811 ASCMVHWEQBLZAJ-PRHODGIISA-N 441.989 4.749 50 10 IJGE ClC[C@@]12CCC[C@@]1(CNc1ncc(I)cc1Br)C2 2086659251 UVYLBMLLLJOBCM-STQMWFEESA-N 441.538 4.660 50 10 IJGE O=S1(=O)CCCC[C@H]1[C@@H](Br)c1cc(Br)c(Cl)cc1F 2097835181 QNFJLAFNPLOEGB-RYUDHWBXSA-N 434.552 4.645 50 10 IJGE Cl[C@@H](c1cc(Br)sn1)c1cc2c(cc1Br)OCCO2 2120041040 UGNNAHRIQGSFDA-GFCCVEGCSA-N 425.529 4.768 50 10 IJGE Cc1cc(CBr)cnc1N1CCN(Cc2ccccc2)C[C@@H]1C(F)(F)F 2130160521 WNTKPKKTVIRWQN-QGZVFWFLSA-N 428.296 4.538 50 10 IJGE Brc1ccccc1[C@@H](CI)OC[C@H]1C2C[C@@H]3C1[C@@H]3C2 2134523762 ZOZPKGYYFDPBLG-XMQOVEGBSA-N 433.127 4.844 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Cl)c1cn(C)c(Br)n1 2138243462 UMMBUAQPYJALTN-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE Br[C@@H]1CC[C@H]2CCN(Cc3ccc(I)cc3)C[C@H]2C1 2139246759 BLAOYMLCRIAQHS-RRFJBIMHSA-N 434.159 4.677 50 10 IJGE CN(C(=O)c1ccc(Br)c(Cl)c1)C1(CBr)CCSCC1 2171183212 XKXYPIDPKLEKCI-UHFFFAOYSA-N 441.616 4.835 50 10 IJGE Cc1cc(C(=O)N2C[C@]3(F)CCC[C@]3(CBr)C2)c(Br)s1 2176637823 WZSQXIYDJSUIFY-UONOGXRCSA-N 425.161 4.548 50 10 IJGE CC(C)N(CCCCI)CC1CCN(C(=O)OC(C)(C)C)CC1 2243586852 WSSYWRVCWCHLDY-UHFFFAOYSA-N 438.394 4.559 50 10 IJGE CC[C@H]1[C@H](Br)CCN1Cc1cccc(Br)c1Br 2251035887 AILKASXZBYKHFN-PWSUYJOCSA-N 425.990 4.959 50 10 IJGE C[C@@H](Cl)CN(c1ncc(I)cc1Br)C1CCCC1 2320057823 HRHJVTDBOMSVCS-SECBINFHSA-N 443.554 4.825 50 10 IJGE O=C1C(=Cc2cccc(Br)c2)Oc2cc(OC(=O)C(Cl)Cl)ccc21 2323752244 MDXWMJYMIDFKRX-UHFFFAOYSA-N 428.065 4.774 50 10 IJGE N#CC(=CNCc1ccc(Br)cc1)C(=O)Nc1cccc(Cl)c1Cl 2324381111 LSFAFMLMLTZRBK-UHFFFAOYSA-N 425.113 4.892 50 10 IJGE CCC[C@@H]1CN(C(=O)c2ccc(Cl)cc2I)C[C@H]1CCl 2365589781 ZHEAPMYDCQWAAM-GHMZBOCLSA-N 426.125 4.672 50 10 IJGE C[C@H]1[C@H](C)N(C(=O)c2cc(Br)c(F)cc2Cl)CC[C@H]1Br 2370657271 AZEFQCSBBBJAJE-OYNCUSHFSA-N 427.539 4.876 50 10 IJGE Cn1c(-c2ccc(C(=O)NNC(=O)c3ccc(Cl)cc3Cl)s2)nc2ccccc21 35553890 ZYGXEORYLOPSAH-UHFFFAOYSA-N 445.331 4.683 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccc(OC)cc4)ccc32)cc1 38677625 YLLRJOQIGQEJNH-AREMUKBSSA-N 440.499 4.624 50 10 IJGE C#CCOc1cc(Br)c(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)cc1OCC 59335633 QLRHZOZUNOUOTG-BOPFTXTBSA-N 439.309 4.714 50 10 IJGE O=C(N/N=C/C(=N/NC(=O)c1cccc(Cl)c1)c1ccccc1)c1cccc(Cl)c1 103714877 FJBVRZRXUXPHKK-BOOBRGSESA-N 439.302 4.543 50 10 IJGE Cc1cc(C)c(NS(=O)(=O)c2ccc(CBr)cc2)c(Br)c1 159900805 YSZSCNGMPSLKML-UHFFFAOYSA-N 433.165 4.762 50 10 IJGE CCc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NN=Cc2ccc(O)c(OC)c2)cc1 254869751 IFMJTGKVOOFZRQ-UHFFFAOYSA-N 440.503 4.580 50 10 IJGE COC(=O)[C@H](Br)C1(Oc2cc(Cl)c(Br)cc2Cl)CCC1 380157017 UVBRBIQWHRPDKQ-NSHDSACASA-N 446.950 4.994 50 10 IJGE CN([C@@H](CBr)C(C)(C)C)S(=O)(=O)c1ccc(Br)cc1Cl 708347822 QEQIUNSDIGOCGT-LBPRGKRZSA-N 447.620 4.533 50 10 IJGE Clc1cc(CBr)ccc1N1CC[C@@]2(CN(Cc3ccccc3)CCO2)C1 717593359 ODRLHAMFDGIKAH-OAQYLSRUSA-N 435.793 4.716 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)c2cccnc12 726933134 BOCLNDSVGPGXFG-HMMYKYKNSA-N 432.487 4.866 50 10 IJGE Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)NNC(=O)c3cn(C)c4ccccc34)s2)cc1 730829985 MGDUDOZIENPMEQ-INIZCTEOSA-N 447.564 4.624 50 10 IJGE Cc1cc(NC(=O)c2ccco2)sc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799749200 CARIAGATKNDRKR-UHFFFAOYSA-N 434.399 4.549 50 10 IJGE Cc1ccc(-n2nc(C)c(C=NNC(=O)c3cccc(Br)c3)c2C)cc1C 1084009007 NPLPICDRRCPACI-UHFFFAOYSA-N 425.330 4.632 50 10 IJGE CCc1ccc(OCC(=O)NN=Cc2ccc(OCc3ccccc3C)c(OC)c2)cc1 1772753702 CYUJAWMLCAGSGY-UHFFFAOYSA-N 432.520 4.674 50 10 IJGE CC(C)Cn1nc(C(F)(F)F)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(Br)cc1 1865714327 HIHLNSQOIJRBDN-ZDUSSCGKSA-N 441.251 4.539 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)CCC[C@@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1881164028 DEGRLXIRGIMRAB-QLFBSQMISA-N 435.403 4.558 50 10 IJGE Brc1ccc([C@@H](CI)O[C@@H]2COC3(CCC3)C2)cc1 1889721374 CSPOTDVWRRYCSG-UONOGXRCSA-N 437.115 4.653 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)Cc1ccccc1F 1915299831 JBEYTEFWNLRBMD-IBGZPJMESA-N 428.367 4.577 50 10 IJGE Cc1ncnc(N(Cc2ccccc2)C2(CBr)CCC2)c1Br 1915767334 ROWOYBRNLMAQAV-UHFFFAOYSA-N 425.168 4.872 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)C(=O)c1ccc(Br)c(Cl)c1 1916355064 PJUUHCPXPSFIQW-HNNXBMFYSA-N 431.157 4.999 50 10 IJGE C[C@H](Br)CCN(C)C(=O)c1csc(Br)c1Br 1937737283 GIAKGGIVSVNDGH-LURJTMIESA-N 433.991 4.519 50 10 IJGE COc1cc(C(=O)N(CCCBr)Cc2ccccc2)ccc1Br 1989503343 WRYFODIXIWZTEO-UHFFFAOYSA-N 441.163 4.885 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1Cc1cc(Br)ccc1Br 2006498634 FBCMLJYWUPTMPY-CABZTGNLSA-N 425.990 4.959 50 10 IJGE CC(C)(CBr)[C@@H]1CCCN1c1ncc(Br)cc1Br 2038314030 DLJOZRQVRWJAHB-NSHDSACASA-N 441.005 4.997 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)cc2C=C(C#N)c2nnc3n2CCCCC3)cc1 2040447337 RDHHVMZJBLMORZ-UHFFFAOYSA-N 436.519 4.930 50 10 IJGE BrCC1CC2(CCN2Cc2c(Br)cccc2Br)C1 2042652634 NVOMYARDPFPHJQ-UHFFFAOYSA-N 438.001 4.961 50 10 IJGE CC(C)[C@@H](CBr)CN1CCCCN(C(=O)OC(C)(C)C)CC(F)(F)C1 2046339758 PZKIIRXXSORGIF-HNNXBMFYSA-N 427.374 4.622 50 10 IJGE CC(C)[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(CBr)c1 2059265933 BGVBZUWYJXLVNY-HNNXBMFYSA-N 428.367 4.956 50 10 IJGE C[C@H](CCl)[C@H]1CCCCN1c1ncc(I)cc1Br 2069529835 SQAUNEBMPXSXDQ-BXKDBHETSA-N 443.554 4.683 50 10 IJGE CCOc1ccc(S(=O)(=O)N(Cc2ccccc2)CC(C)C)cc1CBr 2123246541 MQBAXQQASWZYSN-UHFFFAOYSA-N 440.403 4.827 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1C1CCN(C(=O)[C@H](Br)C2CCCC2)CC1 2167034461 RXMIDRKDPWJQSP-QZTJIDSGSA-N 443.426 4.578 50 10 IJGE Cn1ncc(-n2c(CCl)nc3cc(Cl)c(Br)cc32)c1Br 2169006370 JQRFAXBGVUBQNF-UHFFFAOYSA-N 438.938 4.676 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CBr)OCCCC(F)(F)C(F)(F)F 2217218085 XPDDTVRBYSUYHE-GFCCVEGCSA-N 428.236 4.659 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1ccc2c(c1)OC(F)(F)O2 2231587276 VMGBQAWLDNJAFE-CYBMUJFWSA-N 426.257 4.824 50 10 IJGE N[C@@H](c1c(F)cc(Br)c(F)c1Br)C1CC(Br)C1 2250746817 DLTFQLCQBXFKMG-ZROIKLNDSA-N 433.916 4.663 50 10 IJGE C[C@H](NC(=O)c1cc(Br)c(F)cc1Cl)[C@H]1CCC[C@H]1Br 2285836023 WCUDBYQXASWNNQ-QXFUBDJGSA-N 427.539 4.924 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@@H](Br)C(C)(C)S(C)(=O)=O 2295360209 OILVIKVFOPPBCX-GFCCVEGCSA-N 448.604 4.679 50 10 IJGE Clc1ccc(CN(CCCBr)C2CC2)cc1I 2300241029 UGMKZYMUWBZFFS-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE CCC[C@H](O[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1I)c1ccccc1 2302032137 RMLCNYSQNGNADX-IXDOHACOSA-N 445.341 4.967 50 10 IJGE C[C@@H](CCCCBr)NCc1ccc(Cl)cc1I 2302326528 QATRTCJMXNIOCP-JTQLQIEISA-N 430.555 4.988 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1Cc1cc(I)ccc1Cl 2307325094 VNYPCLJJQVTTJS-AAEUAGOBSA-N 428.539 4.692 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)c(I)c2)[C@H](C)C[C@H]1Br 2315552323 CSDXDQCUWYWFNR-CKYFFXLPSA-N 442.566 4.938 50 10 IJGE BrC[C@H]1C[C@@H]2CCCC[C@@H]2N1Cc1sccc1I 2316760799 YGOJSMAHYKGBKT-LOWVWBTDSA-N 440.188 4.881 50 10 IJGE Clc1ccc(CN2C[C@H](C3CC3)[C@@H](Br)C2)c(I)c1 2318557925 POEJYIUZSMLGGP-OLZOCXBDSA-N 440.550 4.550 50 10 IJGE CCCCCCCCCOc1ccc(C=NNC(=O)c2cc(C)nc(O)n2)cc1OCC 2323702570 WOFDMTBYMVUTQH-UHFFFAOYSA-N 442.560 4.783 50 10 IJGE O=C(NN=Cc1ccc(Br)cc1)c1ccc2nc(Cc3ccccc3)[nH]c2c1 2323725845 WVSRMOITTHVEQX-UHFFFAOYSA-N 433.309 4.680 50 10 IJGE COc1cccc(-c2csc(C(C#N)=C(O)CCCN3C(=O)c4ccccc4C3=O)n2)c1 2331246539 YDHFFXWVVSOZSO-UHFFFAOYSA-N 445.500 4.688 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)c3ccnc(Cl)c3)n2)c(OC)c1OC 2331412857 NPQKFKUBFNLLLW-UHFFFAOYSA-N 429.885 4.834 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@H](Br)c1c(Br)ncn1C 2337277481 UGEOWRYPGQMQCR-JTQLQIEISA-N 428.939 4.982 50 10 IJGE CCN(CC)CCN(Cc1ccccc1)c1c(CBr)c(C(F)F)nn1C 2339727992 XNWAPMXLNFCGEI-UHFFFAOYSA-N 429.353 4.601 50 10 IJGE CC1(C(=O)N[C@@H](CCBr)COCc2ccccc2)CC2(CC(F)(F)C2)C1 2343412323 OOGRZQLCRJSKTM-INIZCTEOSA-N 430.333 4.689 50 10 IJGE CN(C)CCCN(Cc1ccccc1)c1nc(C(F)(F)F)ccc1CBr 2343781102 LGIHRRQQSFMUDX-UHFFFAOYSA-N 430.312 4.954 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C[C@@]2(CBr)CC2(F)F)c2ccccc21 2351889298 SZYIIDYOYGRWBU-KSSFIOAISA-N 431.321 4.883 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)Cc2ccccc21 2353827028 PBOBEFWWIYICJL-AEFFLSMTSA-N 425.411 5.000 50 10 IJGE C[C@@H](CCl)[C@H]1CCCCN1C(=O)c1ccc(Cl)cc1I 2365594115 XPUWRFVHCZAVOW-IINYFYTJSA-N 426.125 4.814 50 10 IJGE COc1ccc(CCCCO[C@H](CCl)[C@@H](I)CCl)cc1 2370109840 CQZGPSUQERFXSR-LSDHHAIUSA-N 431.141 4.684 50 10 IJGE C/C(=N\NC(=O)CCC(=O)Nc1cccc(Cl)c1C)c1ccc(Br)cc1 12574659 QDOWWPPFWNNSRJ-YDZHTSKRSA-N 436.737 4.670 50 10 IJGE Cc1occc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3cccc4ncccc34)c(C)c21 40823607 SGWXKPXOWBWGSF-VFCFBJKWSA-N 442.475 4.760 50 10 IJGE CC(=O)Nc1ccc(/C=N/NC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)cc1 59151300 YMRJYMGVSIZYNQ-WPWMEQJKSA-N 429.520 4.500 50 10 IJGE CCCCOC(=O)c1ccccc1N/C=C(/C#N)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 217228676 CQKCARPBKJLQMI-YPKPFQOOSA-N 442.859 4.663 50 10 IJGE CC(=NNC(=O)CSc1nnc(-c2ccc(C)cc2)n1C1CCCCC1)c1ccco1 254865365 JWFIQHVABSKCLC-UHFFFAOYSA-N 437.569 4.984 50 10 IJGE Oc1ccc([C@H]2CN(Cc3ccccc3)C[C@H]2CI)cc1Cl 382687057 GGLZHAWAZMUHFO-HZPDHXFCSA-N 427.713 4.696 50 10 IJGE CN(Cc1ccccc1)C1(Cn2c(CCl)nc3cc(Br)cnc32)CCC1 386834923 WOWBZBKZOZMPKJ-UHFFFAOYSA-N 433.781 4.987 50 10 IJGE ClCc1c(Br)cccc1N1CC[C@H](N2CCN(Cc3ccccc3)CC2)C1 394694501 DDVHCGRECAQYKD-IBGZPJMESA-N 448.836 4.584 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccc([C@H]2CCc3ccccc3N2S(N)(=O)=O)cc1 616596342 WQDLYXZIHWSZIF-OAQYLSRUSA-N 432.662 4.906 50 10 IJGE C[C@@H]1CCCN(Cc2cc(Cl)ccc2I)[C@@H]1CBr 688704352 GKEISVMXPDRPHG-QMTHXVAHSA-N 442.566 4.940 50 10 IJGE C[C@@H]1CO[C@@](CBr)(Cc2cc(Cl)ccc2I)C1 718539004 YHUFWNMBDPHNGA-TVQRCGJNSA-N 429.523 4.677 50 10 IJGE Cc1sc2nc(CS[C@@H](C)C(=O)NNc3cccc(Cl)c3C)nc(O)c2c1C 748532733 IUFUJSBZUSTHEC-LBPRGKRZSA-N 436.990 4.741 50 10 IJGE CC(=C/c1ccc(Cl)cc1)/C=C(/C#N)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 753716329 YDMOKJIQYZVUGX-QAHWWWBRSA-N 432.911 4.630 50 10 IJGE CCOc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3cnn(C)c3C3CC3)c2C)cc1 771488514 DZRCKMHNZPKTBX-MOSHPQCFSA-N 429.524 4.649 50 10 IJGE O=C(NNc1cc(Cl)ccc1Cl)C(=O)Nc1nc2c3c(ccc2s1)CCCC3 783372000 ULURIXVQPFYLOL-UHFFFAOYSA-N 435.336 4.564 50 10 IJGE CC(C)(C)OC(=O)c1cnc(C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)cn1 801653524 HAPOZBQVTTYDQV-INIZCTEOSA-N 447.866 4.904 50 10 IJGE CCOc1cc(C=NNC(=O)CC[C@H](O)c2ccccc2)ccc1OCc1ccccc1 1084005518 BKVODXRRQGEUTK-QHCPKHFHSA-N 432.520 4.628 50 10 IJGE COCC(C)(C)N(NC(=O)Nc1cc(F)ccc1F)C(=O)c1cc(Cl)cc(Cl)c1 1088669517 MPTWIWMLHLULJI-UHFFFAOYSA-N 446.281 4.876 50 10 IJGE COc1ccc(/C(C#N)=C/c2cccc(OC(=O)Cc3ccc(OC)c(OC)c3)c2)cc1 1615066694 JYQMAHIYRWKDNE-FYJGNVAPSA-N 429.472 4.925 50 10 IJGE C=C(Cl)C[C@H](NS(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1)C(=O)OCC 1670885803 CNCKEBCLFCMYDB-LBPRGKRZSA-N 443.843 4.697 50 10 IJGE C#C[C@@H](NC(=O)NNc1ccc(Cl)c(Br)c1)c1ccc(Cl)cc1F 1682366285 BWMDNBRATXXPOL-OAHLLOKOSA-N 431.092 4.896 50 10 IJGE COc1cccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4cc(C)ccc4C)c(C)c32)c1 1772748878 FKTUGEPNRZHENW-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@@H](c1ccc(OC)c(O)c1)C(C#N)=C(N)O2 1865682755 XBZPRCJTVQOKHB-QHCPKHFHSA-N 438.487 4.520 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc(C(=O)NN(Cc2ccccc2)Cc2ccccc2)o1 1923613907 ZPNWZFYITDOHKP-UHFFFAOYSA-N 435.524 4.652 50 10 IJGE Cc1ccnc(C(=O)N(Cc2ccccc2)[C@H](C)CBr)c1Br 1927120529 CSONQRXJSJWXLS-CYBMUJFWSA-N 426.152 4.578 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCC13CCC3)CC[C@](C)(CI)O2 1983725574 UVVBNXKTSQRTJD-SJLPKXTDSA-N 435.346 4.683 50 10 IJGE C[C@@H](NC(=O)c1cc(Br)cc(Br)c1)C(C)(C)CBr 2030077223 BLFSFZIODBCYRQ-MRVPVSSYSA-N 441.989 4.751 50 10 IJGE CC(C)(C)OC(=O)NCCCC[S@@](C)(=O)=NCC1(CBr)CCCCC1 2047800243 KWCVUKHJXSQNHZ-RUZDIDTESA-N 439.460 4.735 50 10 IJGE CC[C@H](Br)[C@@H]1CCCCN1C(=O)c1sccc1I 2051079130 PEQWLVNKSZKRSZ-ONGXEEELSA-N 442.160 4.521 50 10 IJGE Cc1nn(C)c([C@H](Br)Cc2cccc(Br)c2)c1Br 2072306336 HJLISYOBJYTUDQ-LLVKDONJSA-N 436.973 4.932 50 10 IJGE CC1(C)C[C@H](CBr)N(Cc2ccc(I)c(Cl)c2)C1 2086657787 IEKNKPCRTRJKDA-LLVKDONJSA-N 442.566 4.940 50 10 IJGE CCC[C@]1(CNC(=O)[C@@H](Br)C2CCCC2)CCCN1C(=O)OC(C)(C)C 2110720098 BEONVKSVOQMOTD-OXJNMPFZSA-N 431.415 4.626 50 10 IJGE COc1ccc([C@H](Br)c2c(Br)cnn2C)c(Cl)c1Cl 2138620478 JDAPTPJJCVSEHK-VIFPVBQESA-N 428.939 4.982 50 10 IJGE C[C@]1(CCl)CC(F)(F)CN1C(=O)c1ccc(Br)cc1Br 2159053808 FQVYYBLCYFTZDX-GFCCVEGCSA-N 431.502 4.690 50 10 IJGE O=C(c1cc(Cl)cc(Br)c1)N1CCC([C@H](F)CBr)CC1 2163246662 RVKDJTHCHVISCW-CYBMUJFWSA-N 427.539 4.688 50 10 IJGE Brc1cccc([C@@H](CI)OC2CC(n3cccn3)C2)c1 2183661843 BCGWNUDVGGRIAS-YMAMQOFZSA-N 447.114 4.542 50 10 IJGE BrC[C@@H]1CC2(CCCC2)CN1C[C@H]1CC1(Br)Br 2213087925 KKLRHUCHHBDFDF-MNOVXSKESA-N 430.022 4.522 50 10 IJGE O=S(=O)(Cc1ccc(Br)cc1)N(Cc1ccccc1)[C@H](CCl)C1CC1 2218987603 NNTBGIDHLQPFAC-LJQANCHMSA-N 442.806 4.799 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@H]1CCOC1 2250737372 CDYTVLNSMDGXAJ-SSDLBLMSSA-N 434.900 4.962 50 10 IJGE CCCN(C[C@@H](C)Br)C(=O)c1ccc(Cl)c(I)c1 2259781090 ZPZXCZODWDEXSW-SECBINFHSA-N 444.538 4.580 50 10 IJGE Cc1ccc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)c(CBr)n1 2271443990 JBLNMAFMXXPNLA-GOSISDBHSA-N 428.296 4.538 50 10 IJGE C[C@H]1C[C@@H](Br)CCN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285846214 LJQSVJVLFYZMHM-IUCAKERBSA-N 427.539 4.877 50 10 IJGE O=C(NC[C@H](CBr)C(F)(F)F)c1cc(Br)c(F)cc1Cl 2285846424 NPSFPPJRVNIISE-YFKPBYRVSA-N 441.444 4.545 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@H](Br)[C@H]1OCCO[C@@H]1C 2295264778 JYCRNQWSJQJXQU-JCOFBHIZSA-N 428.548 4.659 50 10 IJGE CN(Cc1cc(I)ccc1Cl)[C@H]1CCC[C@H]1Br 2307315187 DXUDDZVEDNOTDI-YPMHNXCESA-N 428.539 4.692 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)c(I)c2)CC[C@@H]1Br 2315551562 SGYJIKYDSYBRHV-ZDUSSCGKSA-N 442.566 4.940 50 10 IJGE Clc1ccc(CN2CCC3(CC(Br)C3)C2)cc1I 2315554760 IYBMBGGNOYWZGF-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE Cc1ccc(C(=O)CCC(=O)NN=Cc2cc(Cl)cc(Br)c2O)c(C)c1 2321253273 IRUKPQACBUSOFH-UHFFFAOYSA-N 437.721 4.538 50 10 IJGE ClC[C@]12C[C@H]1CC[C@@H]2NCc1ccc(I)c(Br)c1 2325206803 KVRNKEGNJZKJAN-DDTOSNHZSA-N 440.550 4.551 50 10 IJGE ClC[C@H]1C[C@@]2(CCN2Cc2ccc(I)c(Br)c2)C1 2325232498 BYKHLICYMARXSB-YEORSEQZSA-N 440.550 4.647 50 10 IJGE CC[C@H](NC=C(C#N)C(=O)N1CCN(c2ccc(F)cc2)CC1)c1ccc2c(c1)CCCC2 2325272783 WWNIVMOYADZTTF-SANMLTNESA-N 446.570 4.501 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc(C(F)(F)F)cc1O 2369749133 WEKKEQQPUOOLMZ-OAHLLOKOSA-N 446.263 4.511 50 10 IJGE C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1 14665996 NYJWMWLPUVBAKJ-ROUUACIJSA-N 434.536 4.520 50 10 IJGE C/C(=C\C#N)N1C(=O)c2ccc(C(=O)Nc3ccc(-c4nc5ccccc5[nH]4)cc3)cc2C1=O 21141789 PGZZCQQZIPCEQC-NTCAYCPXSA-N 447.454 4.506 50 10 IJGE CC[C@@](C)(CBr)NC(=O)c1cc(Br)c(Br)s1 124755381 LVRFEQHNCKBOLX-JTQLQIEISA-N 433.991 4.567 50 10 IJGE COc1c(Br)cc(Br)cc1/C=N\NC(=O)Nc1ccccc1C 169941149 XPAKRGZGEZQVBA-OCKHKDLRSA-N 441.123 4.684 50 10 IJGE CC[C@H](Br)C(=O)Nc1oc(C)c(C(=O)OC)c1-c1nc2ccccc2s1 170499093 KPOCHSDNNRDJET-JTQLQIEISA-N 437.315 4.763 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@@H]1Br)c1cccc(Br)c1Cl 228459407 YFKIDHVUDWKJBJ-ZFWWWQNUSA-N 429.539 4.893 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)CSc2cc(C)c3cc(C)ccc3n2)c(O)c1 254711079 VWSSICOTMFUPID-UHFFFAOYSA-N 436.581 4.646 50 10 IJGE O=S1(=O)CCC[C@H]1[C@@H](Br)c1scc(C(F)(F)F)c1Br 694620827 GODDBGNBVWJGGF-POYBYMJQSA-N 442.116 4.543 50 10 IJGE Cn1nc(COc2c(Br)cc(CCl)cc2Br)cc1Cl 706166953 MGCFEDLXIVENHW-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE CCc1cccc(CC)c1NC(=O)/C(C#N)=C\c1cccc(Cl)c1S(=O)(=O)CC 774121148 PGDDHGZOILQCMR-AQTBWJFISA-N 430.957 4.804 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@H](c2cnn(C)c2)C(F)(F)F)c(C)n1C1CCCCC1 775145899 GMBNXBXDDDJDRC-OTJDAXFFSA-N 433.478 4.670 50 10 IJGE CC[C@@H](C(=O)NNc1nc(-c2ccccn2)nc(C)c1C)c1ccc(Br)cc1 1160812519 FYMWHYDJEXXAHN-QGZVFWFLSA-N 440.345 4.555 50 10 IJGE CC(=O)c1cccc(O[C@@H](C)C(=O)NNc2cc(C(F)(F)F)ccc2Br)c1 1639275330 BPTVLWOPSPDNPF-NSHDSACASA-N 445.235 4.581 50 10 IJGE CCN(C(=O)c1oc2c(c1C)C(=NNC(=O)c1ccoc1C)CCC2)c1cccc(C)c1 1772749451 NMENTZLZSHJOSH-UHFFFAOYSA-N 433.508 4.935 50 10 IJGE Cc1ccnc(CC(CBr)(CBr)C2CC2)c1Br 1926844613 CEGJNMUAHLHIGJ-UHFFFAOYSA-N 425.990 4.881 50 10 IJGE CC(C)(C)[C@H](CBr)CN1CCC[C@@H](CNC(=O)OCc2ccccc2)C1 1977953684 VKKUOACSVRRYIP-RBUKOAKNSA-N 425.411 4.682 50 10 IJGE Clc1ccc(I)c(CN2CC[C@H](Br)C3(CC3)C2)c1 2032259941 MRIZRQZFZBTBSW-ZDUSSCGKSA-N 440.550 4.694 50 10 IJGE CC[C@H](C[C@@H](C)Br)NC(=O)c1c(Br)cccc1Br 2033085723 GGPBETQPBUQHPX-RKDXNWHRSA-N 441.989 4.894 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](C(F)(F)F)CCN1CCCCCBr 2045430855 HGRMIZKOMFYFRF-KBPBESRZSA-N 431.337 4.719 50 10 IJGE C[C@H]1CC[C@H](CBr)CN1Cc1ccc(I)c(Cl)c1 2086662697 WTROMBPZCPPNDX-CMPLNLGQSA-N 442.566 4.940 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1N(C)C[C@H](CBr)c1ccccc1 2106780610 AHWUYWIMJAOCIK-NEWSRXKRSA-N 425.411 4.742 50 10 IJGE C[C@@H](CCCCCBr)NC(=O)c1cc(I)ccc1F 2117884872 YTWDSBSGNWWQDJ-JTQLQIEISA-N 442.110 4.504 50 10 IJGE COc1cc(CBr)ccc1S(=O)(=O)N(Cc1ccccc1)CC(C)(C)C 2123269742 KHDIUHYYVGWIBS-UHFFFAOYSA-N 440.403 4.827 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)c2ccccc2)[C@](C)(C2CC2)C1 2163058658 MIOLFIVJJPZBBI-GCJKJVERSA-N 437.422 4.887 50 10 IJGE O=C1C=C2CN(c3c(CBr)ccc(Br)c3Cl)CC[C@@H]2S1 2171117445 LWFWDUWFPJSMRF-NSHDSACASA-N 437.584 4.776 50 10 IJGE Cc1cc(Br)c(C)c([C@H](Cl)[C@@H]2CCCS(=O)(=O)C2)c1Br 2201071231 QBJJJFBLYXVJGS-QMTHXVAHSA-N 444.616 4.933 50 10 IJGE COc1cc(F)c(CBr)c(N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c1 2283538787 DPLDLAUBTHBVPT-ZWKOTPCHSA-N 433.365 4.688 50 10 IJGE N#CC(=CNc1ccc(F)cc1[N+](=O)[O-])c1nc(-c2cc3ccccc3oc2=O)cs1 2296763967 OVMVDGFUWLMVGO-UHFFFAOYSA-N 434.408 4.940 50 10 IJGE C[C@@H](Br)CCCN(C)Cc1ccc(Cl)cc1I 2302307959 VHCRZYUEHXWXAL-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE Clc1ccc(I)cc1CN1CCC[C@H]1CCBr 2307333474 CXSDKUKNDWVSTH-LBPRGKRZSA-N 428.539 4.694 50 10 IJGE BrC[C@]12C[C@H](CCN1Cc1cc(Br)ccc1Br)C2 2314958999 WDHRUCCLEPLNIQ-WJONMLJTSA-N 438.001 4.961 50 10 IJGE C[C@@H]([C@H](Cl)c1c(Cl)cc(Br)c(F)c1Br)S(C)(=O)=O 2315454147 UICPXRPRMPXYPY-IGJIYHIXSA-N 442.959 4.717 50 10 IJGE CC(C)N1C[C@H](Cc2ccc(Cl)c(I)c2)[C@@H](Br)C1 2315549981 YEQNCKFFDKMCRI-RYUDHWBXSA-N 442.566 4.591 50 10 IJGE CCCO[C@H]1[C@@H](Oc2cc(Br)cc(I)c2)C[C@H]1Cl 2316756541 FYLPXYGNKMRONM-FRRDWIJNSA-N 445.522 4.607 50 10 IJGE BrC[C@@H]1CN(Cc2sccc2I)CCC12CCC2 2316765635 ZDDKDSBCFZCQFH-LLVKDONJSA-N 440.188 4.740 50 10 IJGE Clc1ccc(C[C@@H](CBr)C2CCOCC2)c(I)c1 2318545368 IGPBVLDVSYIGSU-LBPRGKRZSA-N 443.550 4.925 50 10 IJGE CCN(C[C@@](C)(CBr)OCC1CC2(C1)CC(OC)C2)C(=O)OC(C)(C)C 2353035445 GJGQMGHYKSJOLV-VYJHHOQDSA-N 434.415 4.619 50 10 IJGE Cc1scc(C(=O)N2CCC[C@@H](Br)[C@H]2C(F)(F)F)c1Br 2370255048 QNFVQTGDDINLIG-SCZZXKLOSA-N 435.103 4.749 50 10 IJGE ClCc1c(OCc2cc(I)ccc2Cl)nc2sccn12 2380354486 ZWCFASTZJUHOJK-UHFFFAOYSA-N 439.105 4.972 50 10 IJGE COc1ccc(/C(C#N)=C\c2ccc(OC(=O)COc3ccccc3OC)cc2)cc1OC 31901043 OJTNOTACRNGDOR-ZHZULCJRSA-N 445.471 4.761 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccc(C)c(C)c2)ccc1OCc1ccccc1C 40911533 JWAZGNUIKOUKBO-JFLMPSFJSA-N 432.520 4.729 50 10 IJGE CCOc1cc(/C=N\NC(=O)CC[C@@H](O)c2ccccc2)ccc1OCc1ccc(C)cc1 58890321 XQBKWZXHBTXYRW-IVRBHCBNSA-N 446.547 4.937 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2cc(Cl)c(OCC)c(OCC)c2)cc1 58894874 WFMYZGBQHVPXRZ-FXONECCMSA-N 448.947 4.500 50 10 IJGE Fc1cccc(C(CBr)(CBr)Cc2cn3ccsc3n2)c1 149647708 BMPAEQNLLRDGIG-UHFFFAOYSA-N 432.156 4.805 50 10 IJGE O=S(=O)(c1ccc(CBr)cc1)N(Cc1ccccc1)Cc1ccccc1 309574880 SCLWGHQQSGQZHP-UHFFFAOYSA-N 430.367 4.973 50 10 IJGE FC(F)Oc1cc(I)c(CBr)c(C(F)(F)F)c1 575722844 HESYPWCQCNADDA-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2Cc1cnc(Br)s1 718873374 JFESWARAUCPEMA-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE CN(C[C@@H]1CCCCN1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1CBr 720015892 FGFXKGVXTVWAPM-FQEVSTJZSA-N 432.362 4.981 50 10 IJGE CC(=O)N(C)c1ccccc1NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(C)cc2)c1C 735640267 RATKJHKYVZVTFT-JCMHNJIXSA-N 426.520 4.931 50 10 IJGE CC(C)NC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)C[C@@H](C)C2 745139351 CFDTZEGGPDQVBY-VXNZKSKFSA-N 428.536 4.710 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)C(F)(F)c2cc(Cl)ccc2Cl)c1C 1457639088 SWGRUPNXDYZLQC-UHFFFAOYSA-N 438.265 4.697 50 10 IJGE C=C(CBr)CN(Cc1ccccn1)Cc1ccc(Br)cc1F 1460157248 JBHPHOXEDNUSEE-UHFFFAOYSA-N 428.143 4.937 50 10 IJGE Cc1cc([C@@H]2CN(Cc3ccccc3)C[C@H]2CI)ccc1[N+](=O)[O-] 1614640805 FYNWHKDXQZPYFG-MSOLQXFVSA-N 436.293 4.554 50 10 IJGE Cc1cc(Nc2ccc3c(c2)CCCC3)c(C(=O)NC[C@]2(C)C[C@@H]2Br)c(O)n1 1642130278 WEDPSADJCTUCHN-AVRDEDQJSA-N 444.373 4.621 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)Cc2ccccc2)CCC3)c1C 1772747862 GNZOINRVLVFVLG-UHFFFAOYSA-N 429.520 4.856 50 10 IJGE CC(=O)c1ccc(NC(=O)[C@H](Br)Cc2ccccc2Br)cc1 1858181187 HGPVGIYDCNVMLI-MRXNPFEDSA-N 425.120 4.596 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1cc(C)ccc1O)C(C#N)=C(N)O2 1865686886 DKZHWWSUNLYKGE-FQEVSTJZSA-N 438.890 4.519 50 10 IJGE Cc1nc(Cc2ccccc2)sc1C(=O)NNC(=O)/C=C/c1ccc(Cl)cc1Cl 1865844893 CIJXHAUCUVWMAW-CSKARUKUSA-N 446.359 4.824 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](NC(=O)[C@@H]2C[C@@H]2c2ccccc2)c2ccccc2)cc1 1867051714 FFRHISWFNFRRMI-DNVJHFABSA-N 427.529 4.859 50 10 IJGE COc1ccc2c(c1)c(/C=C1\Oc3cc(OC(=O)C(Cl)Cl)ccc3C1=O)cn2C 1871386383 ROGJQCIVSWODFV-WSVATBPTSA-N 432.259 4.512 50 10 IJGE C[C@@H](C1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](CBr)NC(=O)OC(C)(C)C 1880759863 BMKVRRULBSRLQW-DZGCQCFKSA-N 435.403 4.558 50 10 IJGE O=C(N[C@H](CCSC[C@H]1C[C@H]1Cl)C(=O)O)OCC1c2ccccc2-c2ccccc21 1883551940 LCHJKTXRJOLIKT-XMDBHEJHSA-N 445.968 4.729 50 10 IJGE CC(C)CC(CC(C)C)O[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1I 1899502782 GYLGXAUOEUAWEH-JKSUJKDBSA-N 439.378 4.887 50 10 IJGE CN(C(=O)c1cc(Br)ccc1Br)C1(CBr)CCC1 1915003087 OJYMWPWJMSZPSY-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE CCc1nn(C)c(CN(Cc2ccccc2)C(C)(C)CBr)c1Br 1915762302 HTGPERRUAXQAKG-UHFFFAOYSA-N 443.227 4.921 50 10 IJGE CC(C)[C@@H](CCl)N(Cc1ccccc1)C(=O)c1nn(C)c(Cl)c1Br 2001989963 FUQPINPYWNQIEV-CYBMUJFWSA-N 433.177 4.742 50 10 IJGE C[C@H]1C[C@H]1N(CCBr)Cc1ccc(Br)cc1Br 2002025355 BYFCEZCBOAJTME-TVQRCGJNSA-N 425.990 4.817 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@H]1Cc1ccc(Br)cc1Br 2007138519 WLPPINZIOQJACR-IRUJWGPZSA-N 426.974 4.943 50 10 IJGE CC1(C)OC[C@H](Cc2ccc(I)c(Cl)c2)[C@H]1Br 2026566282 IXGQWNQKICROBA-JOYOIKCWSA-N 429.523 4.676 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)Cc1c(Cl)cccc1Cl 2042866300 RGNIEKDZVSZWCO-HNNXBMFYSA-N 445.184 4.975 50 10 IJGE O=C1Cc2cc([C@@H](Br)C3(Br)CCC3)c(Br)cc2N1 2049229024 KJFANYGJNTYYGI-GFCCVEGCSA-N 437.957 4.697 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2[C@]1(C)CCN(Cc2ccccc2)C1 2128512343 VOMXNNDJDKPORR-HXUWFJFHSA-N 433.781 4.862 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCN(C[C@H](CBr)c3ccccc3)CC2)C1 2163057616 CTEJXOAPFOYHSN-IBGZPJMESA-N 437.422 4.888 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(C)CN(C[C@H](CBr)c3ccccc3)C[C@@]2(C)C1 2163065288 ZBAYZFROZZFFBT-NYVOZVTQSA-N 437.422 4.744 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@H]1CC2(CCC2)CO1 2166445579 XLKHHUZSVINTRD-ZIAGYGMSSA-N 449.126 4.621 50 10 IJGE Cc1cc(Br)c(CCl)c(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)c1 2185517145 XAWKNRZAJBSMEB-VXKWHMMOSA-N 449.820 4.976 50 10 IJGE C[C@H]1CN(c2ccc(CBr)c([N+](=O)[O-])c2)[C@H](C)[C@H](C)N1Cc1ccccc1 2188578579 YFEUVJUFYAAGKE-YESZJQIVSA-N 432.362 4.977 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@@]12CCCC[C@@H]1N(C(=O)OC(C)(C)C)CCC2 2196908447 XNCUVYRKTWJXTN-NWZZKEMCSA-N 443.426 4.578 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc2c(c1)CCN(CCCCCI)C2 2214704573 GQTQEONGQPMODS-UHFFFAOYSA-N 444.357 4.997 50 10 IJGE CO[C@H]1CC[C@@H]1COc1c(Br)cc(CBr)cc1Br 2220576036 KXAWEHIOTIPEPM-SKDRFNHKSA-N 442.973 4.910 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(OC2C3CC4CC(C3)CC2C4)C1 2230442799 AVHWTCURLJIMRM-WGRMAXNNSA-N 428.411 4.992 50 10 IJGE Cc1cccc(C(=O)N2C[C@@H](Br)CC23CCCC3)c1I 2241032119 UGIFZLVEWWJSBU-LBPRGKRZSA-N 448.142 4.522 50 10 IJGE Fc1ccccc1[C@H](CI)O[C@@H]1CCN(Cc2ccccc2)C1 2244803763 YZAUEYXAHVYYSZ-APWZRJJASA-N 425.285 4.593 50 10 IJGE CCOC1CC(C[C@@H](Br)c2ccc(OC)c(I)c2)C1 2269542802 LFBJEMUEZQBTIC-KGPNIALWSA-N 439.131 4.941 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)cc1 2296655616 LJOIYTHXEFUDHR-UHFFFAOYSA-N 431.404 4.577 50 10 IJGE C[C@H]1CCN(Cc2ccc(Cl)c(I)c2)C[C@H]1Br 2300237948 FBCKFNFWEPWEGG-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@H]1Cc1ccc(Cl)cc1I 2302316005 QDZJQZWRVBXJBO-GIPNMCIBSA-N 429.523 4.676 50 10 IJGE CC1([C@H](CBr)NCc2ccc(Cl)cc2I)CC1 2302335363 DFYOZCHFISSSIZ-LBPRGKRZSA-N 428.539 4.598 50 10 IJGE COc1cc(C=NNC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)ccc1OC(C)C 2323607280 BCJGGYBADPBXBF-UHFFFAOYSA-N 426.542 4.623 50 10 IJGE COc1c(C)cc(C(=O)N(C)C[C@@H](Br)COCc2ccccc2)cc1Cl 2337637057 XTTWMJKNBVIIQU-QGZVFWFLSA-N 440.765 4.709 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@H]3CCN(Cc4ccccc4)[C@H]3C2)c1 2340266721 BFLXZTXDMBTXGF-IERDGZPVSA-N 435.793 4.954 50 10 IJGE C[C@H](Cl)C[C@@H]1CCCCN1C(=O)c1ccc(Cl)cc1I 2365589204 SKXPBLDKSISDDU-JQWIXIFHSA-N 426.125 4.957 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(O[C@@H]2CCCCC23CCOCC3)C1 2368353745 IASJOSFWGYADHC-DYESRHJHSA-N 446.426 4.907 50 10 IJGE CCCCCCOc1ccccc1C(=O)NNC(=O)COc1ccc(Cl)cc1Cl 14032636 TWCDXZGHTJIUSZ-UHFFFAOYSA-N 439.339 4.793 50 10 IJGE CC(C)CCOc1cccc(C(=O)NNC(=O)COc2ccc(-c3ccccc3)cc2)c1 14644632 TYVYRVCELRJBRI-UHFFFAOYSA-N 432.520 4.619 50 10 IJGE COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2Cl)cc1 38650960 WQNKPSBIPJUMIN-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE COc1ccc(CCN2C(=O)C(C#N)=C(C)/C(=C/Nc3ccc4ccccc4c3)C2=O)cc1 39893859 NOCCUESPJQKNAI-UQQQWYQISA-N 437.499 4.596 50 10 IJGE Cc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4ccc(F)cc4F)c(C)c32)cc1 40804805 CTXQNKXGFRJVBQ-TURZUDJPSA-N 437.446 4.897 50 10 IJGE COc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4ccc(C)cc4C)c(C)c32)c1 40822164 RRCKDBKQBJPONR-SGWCAAJKSA-N 445.519 4.936 50 10 IJGE CCCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C(\C#N)C(=O)NC(C)C)cc2OC)cc1 40884579 BKUWYIYDTFPHJX-QZZJTICTSA-N 448.519 4.534 50 10 IJGE Cc1csc([C@@H](C)n2c(CCl)nc3cc(I)c(F)cc32)n1 97409373 XHUZDGNSIAWJBR-MRVPVSSYSA-N 435.693 4.893 50 10 IJGE CCOCCCN(C(=O)CCl)[C@@H](C(=O)NC1CCCCCC1)c1ccc(Cl)cc1 97914896 GETNWGWXSLBJQV-OAQYLSRUSA-N 443.415 4.714 50 10 IJGE Br[C@@H](c1ccc2c(c1)OCCCO2)c1ccccc1I 109843179 UZTQYUKTHTVYEK-INIZCTEOSA-N 445.094 4.937 50 10 IJGE BrCc1nnc(-c2cc(Br)ccc2Br)n1C1CC1 161341217 OCFVJGHRTXMVFH-UHFFFAOYSA-N 435.945 4.700 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N(CCCBr)C1CC1 404249836 LSYYMCHPYNJYDG-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE CC1(C)CN(Cc2cc(Cl)ccc2I)CC[C@@H]1Br 405311854 UMNYOEVJHJNNBW-ZDUSSCGKSA-N 442.566 4.940 50 10 IJGE CN(C(=O)c1ccc(I)c(Br)c1)C(C)(C)CCCl 721512419 XHCCHGLATPFPSN-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE Cc1ccc(-c2nc(C)c(C(=O)NNc3nc(-c4ccccn4)nc(C)c3C)s2)c(C)c1 734259681 MSVPKGPEMDANOH-UHFFFAOYSA-N 444.564 4.961 50 10 IJGE Cc1ccccc1CC(=O)NNC(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 756571230 CXZIMWJPSFSJNK-UHFFFAOYSA-N 444.413 4.597 50 10 IJGE COc1ccc([C@@H](NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)C(F)(F)F)cc1 799414058 HLMUFHSWYKQPBT-OAHLLOKOSA-N 432.324 4.515 50 10 IJGE COc1ccc(Cl)cc1-c1nc(SCC(=O)N/N=C2\C[C@H]3CC[C@@]2(C)C3(C)C)n[nH]1 1087633402 FQEBXQLWZZRTPT-BQFFBPCRSA-N 447.992 4.544 50 10 IJGE CC(=O)CCc1ccc(O[C@H](C)C(=O)NNc2ccc(Cl)c(Br)c2)cc1 1178799682 NPFBMWXBMNQCIQ-CYBMUJFWSA-N 439.737 4.535 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)c1cccc(F)c1 1540544760 MZTMFBCCWMGEFB-OBGWFSINSA-N 440.478 4.543 50 10 IJGE C#Cc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)cc1 1558895312 UQNVLPYMYWVHRK-UHFFFAOYSA-N 425.875 4.611 50 10 IJGE COc1ccc(CC(=O)Oc2ccc(/C=C(\C#N)c3ccc(OC)c(OC)c3)cc2)cc1 1615099363 NBSUUWSIWCHFRI-KGENOOAVSA-N 429.472 4.925 50 10 IJGE COc1ccc2cc(C(=O)ON=C3C[C@H]4CC[C@@]3(C)[C@@]4(C)CBr)c(=O)oc2c1 1772721836 ZBFCKTZGCANFNK-PZVFOTJXSA-N 448.313 4.536 50 10 IJGE Cc1sc(NC(=O)/C(C#N)=C/c2ccccc2)nc1-c1ccc2c(c1)CCCC(=O)N2 1859514144 ZJKROZGQBNICCX-XDHOZWIPSA-N 428.517 4.939 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N/N=C/c2ccc(-c3ccccc3Cl)o2)C1 1873499367 RJYUHGJXYJBSRA-MMTYYTLLSA-N 431.920 4.697 50 10 IJGE C[C@@H](c1cc(Br)ccc1F)[C@H](CBr)NC(=O)OC(C)(C)C 1885098291 XMVBMBNWKYPSIK-ZANVPECISA-N 425.136 4.980 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)CN1c1nc2sccn2c1CBr 1921469086 IMXHDKFEXVDEMO-CVEARBPZSA-N 433.419 4.638 50 10 IJGE IC[C@H]1CC[C@@]2(CN(Cc3ccccc3)C3(CCCCC3)C2)O1 1939537578 SXYNHPANIMVVSI-UYAOXDASSA-N 425.354 4.948 50 10 IJGE CC1(C)CN(Cc2ccc(Br)cc2Br)[C@H]1CBr 1944095735 MMXNMAVEOZHHHJ-LBPRGKRZSA-N 425.990 4.817 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Cl)c2)C[C@H]1Br 2026568030 XRHYJUCHXUVOMB-GFCCVEGCSA-N 428.539 4.550 50 10 IJGE CCC[C@H](CCBr)NC(=O)c1c(Br)cccc1Br 2033088028 YSOHEWRCELWOFA-SECBINFHSA-N 441.989 4.895 50 10 IJGE O=C(NC[C@H](Cl)CC(F)(F)F)c1csc(Br)c1Br 2055497294 LSINJKBQHWBFOT-SCSAIBSYSA-N 429.483 4.563 50 10 IJGE CC[C@H](C)N(CCCl)C(=O)c1ccc(Br)cc1I 2086147495 NTVVQLMQLZHWDH-VIFPVBQESA-N 444.538 4.533 50 10 IJGE CC[C@H]1[C@@H](CBr)CCN1Cc1ccc(I)c(Cl)c1 2086658805 QMEAQPQJDJOYGH-RISCZKNCSA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@H](CBr)C(C)(C)C)C[C@H]1C(F)(F)F 2106786457 VAGFLZDHLMWPPF-HZSPNIEDSA-N 445.364 4.679 50 10 IJGE C[C@]1(CC(CBr)(CBr)c2cccc(Cl)c2)COCCO1 2174170131 ANKSDZCFULXSQI-AWEZNQCLSA-N 426.576 4.563 50 10 IJGE O=C(c1ccc2c(c1)OC(F)(F)O2)N(Cc1ccccc1)C1(CBr)CCC1 2240230585 PMFFRXIJGMZNPW-UHFFFAOYSA-N 438.268 4.968 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@H](CBr)CC2CC2)[C@@H](C(F)(F)F)C1 2266310759 SLLVYMVTFZWOBH-RRFJBIMHSA-N 443.348 4.718 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@H]1[C@H](CBr)C2 2282978913 SNYCUBXSGZLNGL-UPFKWVMWSA-N 425.523 4.630 50 10 IJGE Fc1cc(OCc2sccc2I)ccc1CBr 2301074154 PGZICJDSNFTRHB-UHFFFAOYSA-N 427.076 4.966 50 10 IJGE C[C@H](Br)[C@@H]1CCN(Cc2ccc(Cl)cc2I)C1 2302325406 HFCPFWNLQZUTMN-VHSXEESVSA-N 428.539 4.550 50 10 IJGE CC1(C)[C@@H](OCc2cc(I)ccc2Br)C[C@H]1Cl 2302815193 XMOREWVHGHYMKW-NEPJUHHUSA-N 429.523 4.976 50 10 IJGE CC[C@H](CCCCl)NCc1ccc(I)c(Br)c1 2306222573 WBXWIJZCMLFZNZ-LLVKDONJSA-N 430.555 4.941 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@@H](Cc2ccc(C)cc2)C(=O)N1c1ccc(C(C)C)cc1 2314593254 KEYVVOBFMOIQSP-QHCPKHFHSA-N 445.588 4.847 50 10 IJGE CCOc1ccc(C=CC(=O)N2CCC(C(=O)Nc3ccc(SC#N)cc3)CC2)cc1 2322071774 LHHXBRMFWBKTBR-UHFFFAOYSA-N 435.549 4.549 50 10 IJGE CC(C)(C)OC(=O)NCCCC[S@](C)(=O)=NC[C@](C)(CBr)C(C)(C)C 2327074980 CXMQEZNRPJUTBE-BVZFJXPGSA-N 441.476 4.836 50 10 IJGE CCCCOC(=O)c1ccc(NC(=O)C(C#N)=Cc2cccc(Br)c2)cc1 2329698910 FFMRDEVTTRSBPI-UHFFFAOYSA-N 427.298 4.952 50 10 IJGE COc1ccc(CCNCCCCCCI)c(Br)c1 2339375888 WDUKJKNYMBHDAT-UHFFFAOYSA-N 440.163 4.585 50 10 IJGE CC(C)N(CC1CCN(C(=O)OC(C)(C)C)CC1)C[C@]1(CBr)CC1(F)F 2351888815 LBOUVSNKLDLYFJ-GOSISDBHSA-N 439.385 4.764 50 10 IJGE CC(C)[C@H](Br)C(=O)N1CCC(CC2CCN(C(=O)OC(C)(C)C)CC2)CC1 2361054679 LRHRBCJXTHCSRO-SFHVURJKSA-N 445.442 4.682 50 10 IJGE CCn1nc(C)c(CCl)c1OCc1ccc(Cl)cc1I 2365648640 WUOWTFCZQQWCBL-UHFFFAOYSA-N 425.097 4.787 50 10 IJGE COc1ccc([C@@H]2CC(=O)N3CN(c4cccc(Cl)c4)CSC3=C2C#N)cc1OC 9693112 VNGMFBXVPVLLGY-KRWDZBQOSA-N 441.940 4.577 50 10 IJGE COC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C/c2ccc(Cl)c(Cl)c2)c(OC)c1 40868238 STJMFSPVJUCEBN-MSNJMMSUSA-N 432.259 4.701 50 10 IJGE N#C/C(=C/c1ccccc1OC(F)(F)F)S(=O)(=O)c1ccc(Br)cc1 96926593 JRUKGSKJGZGNRX-ZROIWOOFSA-N 432.217 4.686 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Cl)c3cc(F)ccc3Br)cc2[nH]1 109883745 LMXSMBFZEKLJTP-CYBMUJFWSA-N 434.490 4.849 50 10 IJGE CCC(CC)N(CCBr)S(=O)(=O)c1ccc(Br)cc1Cl 147672833 WQBBLQREDKLRRC-UHFFFAOYSA-N 447.620 4.677 50 10 IJGE CC(C)COc1ccc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccccc4)nc3c2)cc1 169925812 FGMJGKVOPSZKBF-YUMHPJSZSA-N 426.520 4.952 50 10 IJGE CC(C)c1cccc(OCC(=O)Oc2ccc(/C=C(/C#N)C(=O)NCc3ccco3)cc2)c1 206738740 RVNAJJOZQGZMNU-BKUYFWCQSA-N 444.487 4.611 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccc(F)cc3)c(OCC)c2)C1=O 214223033 XZQAKCQJYSSUCF-BKUYFWCQSA-N 448.494 4.806 50 10 IJGE Cc1ccc2nc(-c3ccc(N/C=C(/C#N)C(=O)N4C[C@@H](C)O[C@H](C)C4)cc3)sc2c1 217196851 QEULCJZEPLBXKE-WKHYQZIASA-N 432.549 4.727 50 10 IJGE CC(=NNC(=O)Cn1ccc(C(F)(F)F)n1)c1ccc2c(c1)Nc1ccccc1S2 254429541 XVFPFRFTRBXORV-UHFFFAOYSA-N 431.443 4.651 50 10 IJGE CC[C@@H](Br)[C@@H](CC)NC(=O)c1cc(Br)cc(Br)c1 313095284 WAPKEZUIWZEDRQ-VXGBXAGGSA-N 441.989 4.894 50 10 IJGE CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNc1ccc(F)c(F)c1F 727759644 MGMRPOPZRCMNIV-HNNXBMFYSA-N 448.272 4.699 50 10 IJGE CC(C)c1nccnc1NNC(=O)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 773998699 UDPQPEPSOUKFRB-UHFFFAOYSA-N 444.322 4.656 50 10 IJGE C=CCCC[C@H](C(=O)NNC(=S)Nc1cccc(Br)c1)c1ccccc1 1440682644 JCZGIEYIARFRNJ-SFHVURJKSA-N 432.387 4.907 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2ccc3nc(O)n(C)c3c2)c(C)n1-c1ccc(Cl)cc1 1467381981 AFBWKNXMSNCXIZ-BOPFTXTBSA-N 445.910 4.886 50 10 IJGE C=CC[C@H]1CCCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)C1 1469920964 QRGWSUUOHLXIKL-OFBHVFLISA-N 433.943 4.839 50 10 IJGE CCCc1nn(-c2ccc(OC)cc2)c2c1[C@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865705068 LEUWHXJMSHDHCP-HSZRJFAPSA-N 444.535 4.839 50 10 IJGE Cc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865705288 QLRVEGFLQPPMHU-JOCHJYFZSA-N 434.927 4.899 50 10 IJGE CCOc1cc(/C=C(\C#N)c2nc(C(C)C)cs2)ccc1OCC(=O)N(CC)CC 1872791932 YMGOXTUAQXYZNG-WOJGMQOQSA-N 427.570 4.977 50 10 IJGE CCN[C@H](c1sc(Cl)cc1I)C1CC(Br)C1 1901028280 JOFBCJJODIZDTH-QIMWKCOFSA-N 434.568 4.830 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)C(=O)c1ccc(Cl)c(Br)c1 1916354686 KTMSOEPSNGQXPT-HNNXBMFYSA-N 431.157 4.999 50 10 IJGE CC(C)(C)OC(=O)Nc1ncccc1CC(=O)NN(Cc1ccccc1)Cc1ccccc1 1923614331 ONZWZSGVRNECKP-UHFFFAOYSA-N 446.551 4.705 50 10 IJGE CCn1ncc(Br)c1CC(CBr)(CBr)C(C)C 1945479385 WUKGZWKRIQRPHN-UHFFFAOYSA-N 431.010 4.640 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@H]2C[C@H]3CC[C@H]2C3)CC1 1997929678 MQBZJHLDDCTMJW-HRCADAONSA-N 449.373 4.644 50 10 IJGE COC[C@@H](C)COc1c(Br)cc(Br)cc1CBr 2022005211 LGUBTTATWDHCRQ-MRVPVSSYSA-N 430.962 4.768 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1Cc1ccc(I)c(Cl)c1 2026563767 MZEMDOMTOHQNAP-NOZJJQNGSA-N 428.539 4.692 50 10 IJGE BrC[C@@H]1C[C@H]2CC[C@H]1N2Cc1c(Br)cccc1Br 2039487045 BZZZDRLABOYARP-IMSIIYSGSA-N 438.001 4.959 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([S@](C)(=O)=NC[C@@H](CBr)C(C)(C)C)C1 2044695420 CZOADLLRLHHNFH-XESHVACXSA-N 439.460 4.541 50 10 IJGE N#CC(=Cc1ccccc1)C(=O)Nc1nnc(COc2ccc(Cl)cc2Cl)s1 2085219422 UNULLYYLORNLAI-UHFFFAOYSA-N 431.304 4.970 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CC2(CBr)CCCCC2)CC12CCC2 2106781703 KIURKKQBTNOARN-QGZVFWFLSA-N 429.443 4.959 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@H]2C[C@H](Br)CC[C@H]2C1 2115941152 XGEJREGYESSHSH-DJLDLDEBSA-N 427.589 4.800 50 10 IJGE CCN(CCCOCc1ccccc1)S(=O)(=O)c1cc(CBr)ccc1C 2123201464 XFTXKSVAFOUBBD-UHFFFAOYSA-N 440.403 4.507 50 10 IJGE C[C@H](Cl)c1nc2ccc(Br)cc2n1C[C@@H]1COCCN1Cc1ccccc1 2194650397 RNSNEDHQHGFHEG-MAUKXSAKSA-N 448.792 5.000 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCI)c2ccccc21 2211183997 AINKAGXNGPHXDL-UHFFFAOYSA-N 430.330 4.853 50 10 IJGE O=C(N[C@@H](CCCl)C1CCCC1)c1ccc(Cl)c(I)c1 2283653258 DPTVHFHLHANECT-AWEZNQCLSA-N 426.125 4.862 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)N[C@@H](C)c2ccccc2)cc(Br)c1OC 2293665326 JUMVUXNYZGUZIF-AWEZNQCLSA-N 429.314 4.641 50 10 IJGE C[C@@H](CCCBr)CNCc1ccc(Cl)cc1I 2302314755 AKHWANHRMMMTLL-JTQLQIEISA-N 430.555 4.845 50 10 IJGE CN[C@H](c1c(C)cc(Br)c(OC)c1Br)[C@H]1C[C@H]1Br 2317397957 GPLJDFMKDYREMF-SXMVTHIZSA-N 441.989 4.573 50 10 IJGE O=C(NN=Cc1cccc(Cl)c1Cl)c1cccn(Cc2cccc(Cl)c2)c1=O 2323652386 LSWVCSXXEDDIBG-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE Clc1ccc(I)cc1CC[C@H](Br)CN1CCCC1 2327407741 VBIZMVMCYNCVEY-LBPRGKRZSA-N 442.566 4.737 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](CN(C[C@]2(CBr)CC2(F)F)C2CC2)C1 2351886983 HJOFCNFZMMLUOZ-KBXCAEBGSA-N 437.369 4.518 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N[C@@H](C)c3ccc4c(c3)OCO4)c2C)cc1 25584299 AOYWSSWXWWLCJJ-RHLNUJDMSA-N 443.503 4.616 50 10 IJGE CCOc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(F)cc2)CCC3)cc1 40811948 MAMYZCWRDKPPRW-VFCFBJKWSA-N 449.482 4.849 50 10 IJGE COc1ccc(C(=O)Oc2ccc(/C=N/NC(=O)c3ccc(C(C)(C)C)cc3)cc2)cc1 48573291 KGFDBFZUQWJIGL-WPWMEQJKSA-N 430.504 4.976 50 10 IJGE N#CC1=NN(c2ccccc2)[C@@H](c2ccccc2)C2=C1OC(N)=C(C#N)[C@@H]2c1ccccc1 168467303 OOIRBZKJFJFCKO-ZCYQVOJMSA-N 429.483 4.889 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NC(C)C)ccc1OC(=O)/C=C/c1ccc(C(C)C)cc1 206432370 GTSPNMLJSXMCGN-PRSXHFSJSA-N 432.520 4.869 50 10 IJGE N#C/C(=C/NCCc1ccccc1Br)C(=O)Nc1cccc(C(F)(F)F)c1 217147936 XWMXLFZRVCQMLR-OWBHPGMISA-N 438.247 4.646 50 10 IJGE CC[C@H](NC(=O)/C(C#N)=C\Nc1ccc([N+](=O)[O-])cc1OC)c1ccc2c(c1)CCCC2 217189711 MVGOOALIUBAUDE-SACXWWFQSA-N 434.496 4.569 50 10 IJGE O=C(Nc1ccc(CBr)cc1)c1ccc(F)cc1I 236172140 OUKLRLHSPRTGPT-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE ClCc1c(Br)nn(-c2ccccc2Br)c1Br 309167719 AGLVEZGRVZJQBY-UHFFFAOYSA-N 429.337 4.899 50 10 IJGE C[C@H](Br)CC(C)(C)CNS(=O)(=O)c1ccc(Cl)c(Br)c1 393582049 JKVSWAITUJKCMA-VIFPVBQESA-N 447.620 4.581 50 10 IJGE C[C@H](NC(=O)c1cc(Br)ccc1Br)C1(CBr)CC1 696075403 DOQDRNDLAYQLKQ-QMMMGPOBSA-N 439.973 4.505 50 10 IJGE Cc1ccccc1NC(=O)C(=O)NN=Cc1cc(C)n(-c2cc(Cl)cc(Cl)c2)c1C 725410465 PCKJMLSIPMINTP-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE Cc1nc([C@H]2CCCCN2C(=O)/C(C#N)=C/c2cc(C)n(-c3ccccc3F)c2C)no1 737614950 HHUXHXBHIBDAME-OOIVEFLKSA-N 433.487 4.585 50 10 IJGE CCOc1ccc(C(=O)c2ccccc2C(=O)NNc2cccc(F)c2F)cc1OCC 743721183 MJIUFBFVKPFSOK-UHFFFAOYSA-N 440.446 4.750 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)NC2(C(F)(F)F)CCOCC2)c1C 776970451 QKILIQIDNIXILC-CPNJWEJPSA-N 431.458 4.537 50 10 IJGE Cc1onc(-c2ccc(Cl)cc2Cl)c1C(=O)NNC(=O)c1cccc2cccnc12 797846651 JZHVNDNQZFWXKT-UHFFFAOYSA-N 441.274 4.580 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2ccc(OCc3cccc(C#N)c3)c(OCC)c2)cc1 1084196983 QZRHOVFVTSTERC-UHFFFAOYSA-N 443.503 4.699 50 10 IJGE C[C@@H](SCc1nc(O)c2ccccc2n1)C(=O)NN(c1ccccc1)c1ccccc1 1264355910 IMGLUUSFYJVBBU-QGZVFWFLSA-N 430.533 4.827 50 10 IJGE C=CCn1c(SCC(=O)NNc2cccc(C)c2Cl)nnc1-c1ccc(Cl)cc1 1472214495 QBIQMOYMSRJSAZ-UHFFFAOYSA-N 448.379 4.982 50 10 IJGE Cc1c([C@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)cccc1[N+](=O)[O-] 1614630300 QATJJLYVXRCVBI-AEFFLSMTSA-N 433.302 4.650 50 10 IJGE Cc1c(C(=O)Nc2cccc3cccnc23)oc2c1C(=NNC(=O)c1ccccc1)CCC2 1772745401 ZYJDNMCNPFYZPQ-UHFFFAOYSA-N 438.487 4.859 50 10 IJGE Cc1c(C(=O)NC2CCCCC2)oc2c1C(=NNC(=O)c1ccc3ccccc3n1)CCC2 1772751441 QZBYRKCBADHBRU-UHFFFAOYSA-N 444.535 4.669 50 10 IJGE Cc1nn(Cc2ccc(F)cc2)c2c1[C@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 1865686174 RKJBUBJJKDWKDI-LJQANCHMSA-N 429.282 4.904 50 10 IJGE CC(C)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccn2)cc1 1865686473 WPGIGALQMICEOG-QGZVFWFLSA-N 425.414 4.628 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCCN(C(=O)OC(C)(C)C)C12CCC2 1883670723 QRCQUKAFHSBSDD-LSDHHAIUSA-N 447.414 4.844 50 10 IJGE Cn1ncc(Br)c1CN(Cc1ccccc1)C1(CBr)CCC1 1915750565 WKTDRTDPBJAQDY-UHFFFAOYSA-N 427.184 4.502 50 10 IJGE CC1(C)C[C@@H](Br)CN(Cc2cc(Cl)ccc2I)C1 1923148921 ZPPCUEBTWVCBNQ-LLVKDONJSA-N 442.566 4.940 50 10 IJGE O=C(NN(Cc1ccccc1)Cc1ccccc1)c1cc(Br)cnc1Cl 1923937329 BEGIEQJDHZWQNP-UHFFFAOYSA-N 430.733 4.845 50 10 IJGE CN(C)CCN(Cc1ccccc1)c1ccc(Br)cc1CBr 1931935327 JIVNLHKWUXPPTM-UHFFFAOYSA-N 426.196 4.912 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Br)cc(Br)cc1[C@H](O)CCl 1951632704 SGMZPCKSAPZOHN-SNVBAGLBSA-N 429.536 4.831 50 10 IJGE CC1(CBr)CC(NC(=O)c2scc(Br)c2Br)C1 2006992771 MWBXFXJLRPQILD-UHFFFAOYSA-N 446.002 4.567 50 10 IJGE CC(C)[C@@H](Br)CN(C)C(=O)c1ccc(Br)cc1Br 2048731577 QUDUMXGPJLHTCR-LBPRGKRZSA-N 441.989 4.703 50 10 IJGE FC(F)Oc1c(CBr)ccc(I)c1OC(F)(F)F 2060221203 NCSMEGDAWXOGIW-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE C[C@@H](Cl)[C@@H](NC(=O)c1scc(Br)c1Br)C(F)(F)F 2074713954 VMDUWBLRIGKQLS-WVBDSBKLSA-N 429.483 4.561 50 10 IJGE Cc1cccc(-n2nc(CBr)c(I)c2C(F)(F)F)c1 2079261034 VDXYNMCKBMHVKN-UHFFFAOYSA-N 445.020 4.699 50 10 IJGE CC(C)(CC(CBr)(CBr)c1ccc(Cl)cc1)S(C)(=O)=O 2167894854 MDARLTWXNCZHCS-UHFFFAOYSA-N 446.632 4.581 50 10 IJGE CC(C)(C)OC(=O)N1CC2(CCCC[C@]23CC[C@](C)(CI)O3)C1 2211826473 SYLXDBAQHKRGOQ-AEFFLSMTSA-N 435.346 4.540 50 10 IJGE Cc1ccc(C(=O)Nc2ccc(CCBr)cc2)cc1I 2232825064 CPYZZZXXALBDRI-UHFFFAOYSA-N 444.110 4.789 50 10 IJGE Cc1sc(C(=O)N2CCC([C@H](F)CBr)CC2)c(C)c1Br 2234476460 VSTUVKLHPUFMEE-LLVKDONJSA-N 427.177 4.713 50 10 IJGE CC[C@@](C)(CCBr)NC(=O)c1ccc(Cl)c(I)c1 2256385743 AKWXIMXBZACSBQ-ZDUSSCGKSA-N 444.538 4.628 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]2CCCN(CC3(CBr)CC(F)C3)C2)C1 2280360817 WVMBUBKRQITOKC-DQOAATFDSA-N 447.433 4.859 50 10 IJGE O=S1(=O)CCC[C@H]1[C@@H](Cl)c1cc(Br)ccc1OCc1ccccc1 2299535627 REMBCTNSMVZDLK-ROUUACIJSA-N 429.763 4.885 50 10 IJGE CC(C)(CCCl)C(=O)Nc1cc(I)ccc1Br 2300170044 HCCZBMYAVJNCRH-UHFFFAOYSA-N 430.511 4.647 50 10 IJGE C[C@]1(CBr)CCN(Cc2ccc(Cl)cc2I)C1 2302325580 IQJVSJWCBXZBSC-CYBMUJFWSA-N 428.539 4.552 50 10 IJGE Cc1cc(C=C(C#N)C(=O)Nc2ccc(F)cc2)c(C)n1-c1ccc(N2CCOCC2)cc1 2313624628 YUIWLKQOEQEWNX-UHFFFAOYSA-N 444.510 4.616 50 10 IJGE Clc1ccc(COc2ccnc(CBr)c2)c(I)c1 2317809344 AKIRPFMWCOKYKD-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE C[C@H]1CCC[C@](CBr)(Cc2nn(C)cc2I)CC1 2319152682 VPDDBDZPIHTMEE-SMDDNHRTSA-N 425.152 4.549 50 10 IJGE ClC[C@H]1CCC[C@H](NCc2ccc(I)c(Br)c2)C1 2325212608 PNWDULMKGUQMPU-JQWIXIFHSA-N 442.566 4.941 50 10 IJGE CN(C)c1ccc([C@H](CNC(=O)C(C#N)=Cc2cccc(Cl)c2)N2CCCCC2)cc1 2329676786 SDUZLRZHYBTNMT-DEOSSOPVSA-N 436.987 4.656 50 10 IJGE CC1(C)COC[C@H]1CO[C@@H](CI)c1cccc(Br)c1 2339010723 NBGQSHKRMZNXSD-JSGCOSHPSA-N 439.131 4.614 50 10 IJGE O=C(N[C@H]1C[C@@H](CBr)C12CCC2)c1scc(Br)c1Cl 2351615015 SIWUPVMKHGCGFY-CBAPKCEASA-N 427.589 4.848 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc2c(c1)CCN(C[C@@]1(CBr)CC1(F)F)C2 2351888402 HCBIZZOUBLPMSZ-SFHVURJKSA-N 431.321 4.812 50 10 IJGE O=C(NN=Cc1ccccc1Br)c1cc(-c2ccc3c4c(cccc24)CC3)[nH]n1 1741625 ZDADIMBXTFTENW-UHFFFAOYSA-N 445.320 4.855 50 10 IJGE O=C(CSc1ccc(/C=N/NC(=O)c2ccccc2)o1)Nc1ccc2ccccc2c1 3090486 NEALGMHFRFCZTE-MFKUBSTISA-N 429.501 4.928 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2cc(Br)ccc2O)sc(C)c1C 33339717 PMZKTLVAFFFQPM-QPEQYQDCSA-N 449.326 4.555 50 10 IJGE CCCCOc1ccc(/C=C(\C#N)C(=O)Oc2cccc(/C=C(/C#N)C(=O)OCC)c2)cc1 33689072 QEMGNNAHVDNOKI-JFJYUCGMSA-N 444.487 4.848 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(F)cc4)ccc32)cc1 38685658 AEHXDUDSIIIETA-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE COc1cccc(CN(C(=O)CCl)[C@H](C(=O)NC2CCCCC2)c2ccccc2C)c1 97914445 PQXBFQYEPQRMIK-DEOSSOPVSA-N 442.987 4.761 50 10 IJGE C=CCc1cc(C=NNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc(OCC)c1OCC 254622412 AKOACDREWLQPBR-UHFFFAOYSA-N 437.452 4.631 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1Cc1csc(Br)c1 397305480 HPTXGRGPXCAAHI-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE Clc1ccc(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@@H]32)c(CBr)c1 404213534 XTOVHVZCLUCXSY-LEWJYISDSA-N 435.793 4.715 50 10 IJGE CC(C)N(C[C@H](C)Br)C(=O)c1ccc(I)c(Cl)c1 691343096 HYJLLFOUCVVGHV-VIFPVBQESA-N 444.538 4.579 50 10 IJGE ClCc1ccc(N2CC[C@]3(CN(Cc4ccccc4)CCO3)C2)c(Br)c1 717596479 YAVVEOVXOKJDDB-NRFANRHFSA-N 435.793 4.669 50 10 IJGE C[C@@H](O[C@@](C)(CI)CNC(=O)OC(C)(C)C)C1CCCCC1 719737156 PYLMBVDLSRSLJB-DYVFJYSZSA-N 425.351 4.690 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N[C@@H]2CCCC(F)(F)C2)c(-c2ccc(Cl)cc2)n1 769341254 CSVKHZCYEBVYJX-KZIRBZLESA-N 443.885 4.718 50 10 IJGE COc1cc(F)cc(NNC(=O)C(=O)Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)c1 785237292 PEWJZJZLMWIZKG-UHFFFAOYSA-N 448.281 4.890 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc(Br)cc3cccnc23)c(C(F)(F)F)c1 799750509 HINUWBWMDNWNDR-UHFFFAOYSA-N 435.203 4.645 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)c(C(F)(F)F)c1 801884805 LZMVDBFGWHAMNU-UHFFFAOYSA-N 445.323 4.617 50 10 IJGE Cc1cc(Cl)ccc1NC(=O)C(=O)NN=Cc1cc(C)n(-c2ccccc2Cl)c1C 1084438758 NOVPRWBIKWEXCJ-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE C#CC[C@@]1(C(=O)NNc2ccc(OCc3ccccc3)cc2)CCCN1C(=O)OC(C)(C)C 1301224259 IAFUPHOSGKKPDX-SANMLTNESA-N 449.551 4.502 50 10 IJGE CC(=O)CCc1ccc2oc(C(=O)NNc3cccc(F)c3Br)c(C)c2c1 1303294798 ZNTQNNUDTQKNBC-UHFFFAOYSA-N 433.277 4.921 50 10 IJGE CCc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc(OC)cc1)CCC2 1772745553 DXQBNOAXOZTIIO-UHFFFAOYSA-N 445.519 4.882 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3-c2ccccc2)cc1OC 1865697191 PBMYOOIDZYVXSC-QHCPKHFHSA-N 444.535 4.840 50 10 IJGE CCc1nn(Cc2cc(C)ccc2C)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865698873 FJUAOEYPDBJOHV-XMMPIXPASA-N 437.547 4.821 50 10 IJGE Cc1ccsc1[C@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2Cc1cccc(F)c1 1865699598 XYHNURFAYKUGOA-AWEZNQCLSA-N 434.418 4.677 50 10 IJGE COc1ccc2c(c1)c(/C=N\NC(=O)c1ccc(-c3ccc(F)cc3F)nc1C)cn2C 1865760870 SWVPRBARUYKSMX-PPDIBHTLSA-N 434.446 4.599 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCC(C)(C)N(C(=O)OC(C)(C)C)C1 1880762847 YYZUIHNZJKQFMN-ZIAGYGMSSA-N 435.403 4.700 50 10 IJGE CC1(C)C[C@@H](N(Cc2ccccc2)S(=O)(=O)c2ccc(CCl)c(Cl)c2)CO1 1915479696 FNNDYTMLBDBONI-QGZVFWFLSA-N 428.381 4.837 50 10 IJGE C[C@@H]1CC[C@H](O[C@@](C)(CI)CNC(=O)OC(C)(C)C)[C@H](C)C1 1932262664 XHINTQMTUNXDMU-WVZRYYJFSA-N 425.351 4.546 50 10 IJGE Clc1ccc(I)c(CN[C@H](CBr)CC2CC2)c1 1942808072 NUTJYKURWUSLLA-LBPRGKRZSA-N 428.539 4.598 50 10 IJGE C[C@H](CNC(=O)c1csc(Br)c1Br)C[C@@H](C)Br 1945186803 NKYQXMBTHCFZCS-NKWVEPMBSA-N 448.018 4.813 50 10 IJGE ClCCC1(Nc2ncc(I)cc2Br)CCCC1 2015763141 UZBKYFRVFNYUSI-UHFFFAOYSA-N 429.527 4.802 50 10 IJGE Cc1c(Br)sc([C@H](Br)[C@@]2(C)COCCO2)c1Br 2021898310 XSGNABHENBQRAE-GXSJLCMTSA-N 449.002 4.823 50 10 IJGE O=C(N[C@@H](CBr)C1CCC1)c1c(Br)cccc1Br 2033086281 KLTCRHZKYIXYOL-NSHDSACASA-N 439.973 4.505 50 10 IJGE C/C(=N\NC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1ccc(C(C)C)cc1 2059031025 BKFDJVZJSSBULH-XQNSMLJCSA-N 441.578 4.826 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCCN(C[C@H](CBr)c2ccccc2)C1 2106781072 FCWHHNPANBHLCW-MJGOQNOKSA-N 425.411 4.792 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2cccnc2)C(=O)C1=Cc1ccc(-c2cccc(Cl)c2)o1 2314618719 SIIXKZDSBJFTPM-UHFFFAOYSA-N 429.863 4.787 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CBr)OCc1cc(F)ccc1C(F)F 2316335322 LGOOPNAOYBJKQV-KRWDZBQOSA-N 426.273 4.958 50 10 IJGE CC[C@H](CCCBr)NC(=O)c1ccc(Cl)cc1I 2317772737 GQJJWFIKKINFIQ-SNVBAGLBSA-N 444.538 4.628 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@H](C3)[C@@H]2CBr)c(I)c1 2318523748 GWQQHBFQYLNNQP-LQJRIPTKSA-N 440.550 4.692 50 10 IJGE CC(C)[C@@H](CBr)N(C)C(=O)c1cccc(Br)c1Br 2318854714 SQTSCLPDGIIGCP-LLVKDONJSA-N 441.989 4.703 50 10 IJGE COc1ccc([C@@H](C)NC=C(C#N)C(=O)NC(c2ccccc2)c2ccccc2)cc1OC 2324825724 RTUWNWOMXHTZJU-LJQANCHMSA-N 441.531 4.668 50 10 IJGE CC1(C)CC(N)CC(C)(C)N1C=C(C#N)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 2325382968 SMUVOXUDRVKWLC-UHFFFAOYSA-N 428.886 4.685 50 10 IJGE C[C@](CI)(OC[C@H]1C[C@H](F)C1)c1ccccc1Br 2327347894 FMUMOMSVGCVQMP-JTNHKYCSSA-N 427.095 4.864 50 10 IJGE COc1ccc(-c2csc(C(C#N)=Cc3cc(OC)c(OC)c(OC)c3)n2)c(OC)c1 2331473039 CBQVIMVJABQOBY-UHFFFAOYSA-N 438.505 4.917 50 10 IJGE CC(C)(C)C[C@H](CCl)CNC(=O)c1ccc(Cl)cc1I 2365599576 WKKMGRBXPXPMAL-SNVBAGLBSA-N 428.141 4.966 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(C(=O)c2cc(Br)c(F)cc2Cl)[C@@H]1C 2370657273 AZEFQCSBBBJAJE-XKSSXDPKSA-N 427.539 4.876 50 10 IJGE O=C(COc1ccccc1Cl)NNC(=O)N1c2ccccc2Sc2ccccc21 13988907 XQBTVNPEERGJBF-UHFFFAOYSA-N 425.897 4.763 50 10 IJGE CCCCOc1cccc(C(=O)NNC(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c1 14041641 KUZNVZPSTMDFPY-UHFFFAOYSA-N 445.519 4.501 50 10 IJGE CC[C@H](Br)CCNC(=O)c1cc(Br)cc(Br)c1 233976760 FQSRWHOWNSPVRD-VIFPVBQESA-N 427.962 4.505 50 10 IJGE CCc1ccc(C=NNC(=O)CSc2nnc(-c3ccccc3)n2-c2ccccc2)cc1 254396595 SPGQXKFJXMCMPT-UHFFFAOYSA-N 441.560 4.739 50 10 IJGE C[C@H]1CN(c2ccc(CBr)cc2[N+](=O)[O-])[C@H](C)[C@H](C)N1Cc1ccccc1 404276183 NNJWROSXMMTJBC-YESZJQIVSA-N 432.362 4.977 50 10 IJGE FC(F)Oc1ccc(C(F)(F)F)c(CBr)c1I 575723202 LUGATGPYJDABEB-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE CCC[C@H](CCCl)NC(=O)c1ccc(I)c(Br)c1 721592128 DYHCEJIKRQQTOR-SNVBAGLBSA-N 444.538 4.581 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(C)n([C@@H](C)c3ccccc3)c2C)c1C 736694256 TUSKMATWQFAWDG-IBGZPJMESA-N 440.551 4.940 50 10 IJGE Cc1ccc(COc2cccc(NC(=O)NNC(=O)c3cccc4cccnc34)c2)cc1 756533638 FYEGXOPKURRXBZ-UHFFFAOYSA-N 426.476 4.589 50 10 IJGE O=C(NCc1cccc(N2CCOCC2)n1)Nc1cccc(S(F)(F)(F)(F)F)c1 775776180 DEEHHYZQFKWCMQ-UHFFFAOYSA-N 438.422 4.897 50 10 IJGE COc1cc(C)cc(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)c1C 787660725 JHKPNNDFBMLIDU-XSFVSMFZSA-N 425.492 4.635 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2ccccc2OCc2ccc(C)cc2)cc1 1084274711 HWCJAWXFOTXCSY-VWLOTQADSA-N 446.547 4.937 50 10 IJGE CC(=O)N(C)c1ccc(CNC(=O)/C(C#N)=C\c2cc(C)n(-c3ccccc3C)c2C)cc1 1529209564 BRVKUZRQAIUAJH-IWIPYMOSSA-N 440.547 4.609 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)CCCOc3c(C)cccc3C)c(C)n2)cc1 1865759062 ZZZMUVYDXOCLFX-UHFFFAOYSA-N 445.563 4.856 50 10 IJGE CCc1ccc(OCCCC(=O)Oc2ccc([N+](=O)[O-])c(F)c2)c(Br)c1 1865772235 UZCYAAUJAKZVTE-UHFFFAOYSA-N 426.238 4.823 50 10 IJGE N#C/C(=C(/O)CCN1C(=O)c2ccccc2C1=O)c1nc(-c2ccc(Cl)cc2)cs1 1872748012 DCSVWGWUIZWZNT-ZPHPHTNESA-N 435.892 4.942 50 10 IJGE CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1cccc(OCc2ccccc2)c1 1873793538 OYDHNSHBVBBBHJ-SYOQMXFQSA-N 439.556 4.655 50 10 IJGE O=S(=O)(c1cccc2cnccc12)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915172483 NLHFKQQHRBWCBA-FQEVSTJZSA-N 445.382 4.599 50 10 IJGE Clc1ccc(I)c(CN[C@@H](CCBr)C2CC2)c1 1942806444 VYAGMQTUWNYSLE-ZDUSSCGKSA-N 428.539 4.598 50 10 IJGE CSCC[C@@H](Cl)CCNC(=O)c1cc(Br)c(Br)s1 2029921791 IKOZJBDWBQMRNJ-ZETCQYMHSA-N 435.634 4.754 50 10 IJGE FC(F)Oc1cc(OC(F)(F)F)cc(I)c1CBr 2060222494 RMTVJPZLBRQPIN-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE ClCc1nc2cncc(Br)c2n1CC[C@H]1CCN(Cc2ccccc2)C1 2095446680 ZGGPREPWFCNZAC-MRXNPFEDSA-N 433.781 4.845 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]23CCC[C@@]2(CN(C[C@H](CBr)C(C)(C)C)C3)C1 2106780904 COOVRUORVKGZKK-ZLGUVYLKSA-N 429.443 4.767 50 10 IJGE CN(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@H](CBr)c1ccccc1 2106787144 YCMBKVIFNOTWIF-MJGOQNOKSA-N 425.411 4.744 50 10 IJGE O=C(NC1(CCl)CC2(CCC2)C1)c1cc(Br)c(Br)s1 2107262831 CMAHWGBRLUSLRH-UHFFFAOYSA-N 427.589 4.945 50 10 IJGE ClCc1nc2ncccc2n1-c1ccc(Br)c(I)c1 2119395859 DRQGCLIIUNXOGI-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE C[C@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)N1CCC[C@@H](CCCl)C1 2166885549 BKCKVGMKMHKVAY-MJGOQNOKSA-N 427.035 4.897 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@]2(F)CCC[C@@]2(CCl)C1 2176640087 LBEZDBUJBGJLNW-CHWSQXEVSA-N 445.579 4.846 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCI)[C@H](C(C)(C)C)C1 2211186694 XCIGGCZDYFJFLD-HNNXBMFYSA-N 438.394 4.559 50 10 IJGE C[C@@H](CBr)CC1CN(Cc2cc(Cl)ccc2I)C1 2222844151 SUMJFSVRBKBYGA-SNVBAGLBSA-N 442.566 4.798 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C)CCC[C@@H]1[C@H](CBr)NC(=O)OC(C)(C)C 2241896368 GUUIGLGGKMWBBB-TYILLQQXSA-N 435.403 4.606 50 10 IJGE CC(C)(C)[C@@H](CBr)NCc1ccc(Cl)cc1I 2302315164 GLXLBFWKADYEEJ-GFCCVEGCSA-N 430.555 4.844 50 10 IJGE CN(Cc1ccc(Cl)cc1I)C[C@@H](Br)C1CC1 2302325474 HXPCIFIFZOQHDX-GFCCVEGCSA-N 428.539 4.550 50 10 IJGE CCCCOC(=O)c1ccccc1NC=C(C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 2325255083 UJYZTPZKRNETHN-UHFFFAOYSA-N 442.859 4.663 50 10 IJGE CN(C)c1ccc(C(O)=C(C#N)c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)cc1[N+](=O)[O-] 2331281408 UENVUVONUTXAEP-UHFFFAOYSA-N 437.437 4.642 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3CCC[C@H](NC(=O)OC(C)(C)C)[C@H]3C2)C1 2345010085 JKJJDWNBDTYSGS-ULQDDVLXSA-N 429.443 4.813 50 10 IJGE CC[C@@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)C(c1ccccc1)c1ccccc1 9871989 PANFEYSVUJELBP-UXHICEINSA-N 430.548 4.947 50 10 IJGE CC[C@@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)COc1ccc(-c2ccccc2)cc1 9873685 UYAXXNKBKQAICV-WOJBJXKFSA-N 446.547 4.861 50 10 IJGE Cc1ccc2c(O)nc(/C(C#N)=C/c3ccccc3OCC(=O)Nc3ccccc3)nc2c1 35519821 CNCGZUJFBJVIPL-XMHGGMMESA-N 436.471 4.726 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4)ccc32)c1 38684354 JIDQEUQHWBETQO-XMMPIXPASA-N 426.472 4.913 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(OC)cc4)ccc32)cc1 38685613 VHHOOCINGXTBRN-XMMPIXPASA-N 442.471 4.531 50 10 IJGE Cc1c(C(=O)NC2CCCCC2)oc2c1/C(=N/NC(=O)c1ccc(Cl)cc1)CCC2 40811644 KVYPKZIMDVWPKR-NLRVBDNBSA-N 427.932 4.774 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@@H]1Cl)c1cc(Br)c(Br)s1 137615346 UGTRSIJUGNRNAL-CMPLNLGQSA-N 435.568 4.908 50 10 IJGE CC(C)(CCl)C(=O)N1CCC(NC(=O)CCCOc2ccc(C(C)(C)C)cc2)CC1 169884853 ZFDQINLFVUJHCG-UHFFFAOYSA-N 437.024 4.515 50 10 IJGE C[Si](C)(C)O[C@@H]1CO[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C 195783614 KEOUSSOURMHEKN-QBPKDAKJSA-N 438.862 4.855 50 10 IJGE COc1ccc(CCN/C=C(/C#N)C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1OC 217209889 VHVXGGSTASZWLN-ZZEZOPTASA-N 443.503 4.674 50 10 IJGE C[C@]12CCCC[C@@H]1[C@@H]2C(=O)NN=Cc1ccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 254750137 MNSBUHVLKZLDLS-ZNLUXHQJSA-N 438.440 4.572 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)CCCOc2ccc(Cl)cc2Cl)c(O)c1 254853413 QSFGGRVZRGWOFA-UHFFFAOYSA-N 438.355 4.855 50 10 IJGE COC(=O)c1c(NC(=O)NN=Cc2ccc(Cl)cc2Cl)sc2c1CCCC2 256017314 DZWVQTJQORJJDA-UHFFFAOYSA-N 426.325 4.876 50 10 IJGE CC[C@@H](O[C@](C)(CI)CNC(=O)OC(C)(C)C)c1ccccc1 403282392 OTEQQTXAEBYROY-CRAIPNDOSA-N 433.330 4.873 50 10 IJGE COC[C@@H]1C[C@@H](Br)[C@@H](Cc2cc(Cl)ccc2I)C1 698765353 JCGBFZJVSQVXPD-OPQQBVKSSA-N 443.550 4.923 50 10 IJGE C=CCN(CC=C)C(=O)c1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1 799391455 OGORSYMNZJAVCP-UHFFFAOYSA-N 443.429 4.540 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)Nc2ccc(N3CCCC3)cc2)c(-c2ccccc2)n1 914470379 FSNINUJWXPDDOZ-FXBPSFAMSA-N 436.519 4.610 50 10 IJGE CC(=O)c1cc(C(=O)NNC(=O)Nc2ccc(-c3ccccc3)cc2)ccc1OC(C)C 1138910617 KKAFDDNJPXALMR-UHFFFAOYSA-N 431.492 4.810 50 10 IJGE Cc1ccc([C@@H]2CN(Cc3ccccc3)C[C@@H]2CI)cc1[N+](=O)[O-] 1614691907 JRMKCIQWMPTELL-ROUUACIJSA-N 436.293 4.554 50 10 IJGE C#C[C@@H](NC(=O)NNC(=O)c1ccc(COc2ccc3ccccc3c2)cc1)c1ccccc1 1636557260 NWNUHDHPPYKMTK-AREMUKBSSA-N 449.510 4.737 50 10 IJGE C#C[C@H](NC(=O)NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1)C(C)C 1681724431 LXJKOMXFILVCBZ-DEOSSOPVSA-N 441.531 4.534 50 10 IJGE COc1ccc2cc(C(=O)ON=C3C[C@H]4CC[C@@]3(C)[C@]4(C)CBr)c(=O)oc2c1 1772721835 ZBFCKTZGCANFNK-OBVPDXSSSA-N 448.313 4.536 50 10 IJGE N#CSc1ccc(NC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)cc1 1860596838 VAVPDQHLGCVGST-UHFFFAOYSA-N 433.455 4.769 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@H](CI)O2)[C@@H]1C(C)(C)C 1987729211 ZDOYXACJADMYEF-SUNYJGFJSA-N 437.362 4.785 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](Br)[C@@H](OCc2cc(Cl)cc(Cl)c2)C1 1992070465 BHFJZLIEIMWCPP-KBPBESRZSA-N 425.150 4.893 50 10 IJGE C[C@](CI)(OC1CC(F)(F)C1)c1ccccc1Br 2031585443 WKIVEGQSOBSZAM-GFCCVEGCSA-N 431.058 4.914 50 10 IJGE CCCN(CCCBr)C(=O)c1ccc(I)c(Cl)c1 2032094509 JYIQNDNTKGGFKN-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE CCCN(C[C@@H](Br)C(F)(F)F)C1CCC(NC(=O)OC(C)(C)C)CC1 2044696225 KBTSXTODCBMSPJ-JXQTWKCFSA-N 431.337 4.860 50 10 IJGE CC(C)(CBr)CN1CC[C@@H](C(F)(F)F)C[C@H]1CNC(=O)OC(C)(C)C 2045432410 UOPHITFVYIRDRB-OLZOCXBDSA-N 431.337 4.575 50 10 IJGE CCC[C@H](CBr)CN1CCCC[C@@H]1C(F)(F)CNC(=O)OC(C)(C)C 2065453438 ROGMIZSMIURULD-HUUCEWRRSA-N 427.374 4.812 50 10 IJGE COC[C@@H]1C[C@H](Br)[C@H](Cc2ccc(I)c(Cl)c2)C1 2086664021 GXEKCRDDYSUYBJ-TUAOUCFPSA-N 443.550 4.923 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C(F)(F)F)CCCN1C[C@H](CBr)C1CCC1 2106789160 WRJNUZXRVPJTFN-YOEHRIQHSA-N 443.348 4.719 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@H]1CCCCN1C(=O)[C@@H](Br)C1CCCC1 2143047237 JGJOSLOOHKRNMK-CVEARBPZSA-N 431.415 4.625 50 10 IJGE FC(F)(F)c1cnc(NC[C@H](CCl)C(F)(F)F)c(I)c1 2161573009 ZTVJXSRQSMBNHE-LURJTMIESA-N 432.533 4.534 50 10 IJGE CC(C)(C)OC(=O)N1CCO[C@@]2(CCN(CCCCCCCCCBr)C2)C1 2163061930 JAZJAGYPECQFDK-OAQYLSRUSA-N 447.458 4.824 50 10 IJGE Br[C@@H]1CN(Cc2ccc(I)cc2)C2(CCCCC2)C1 2232248167 KNMLIGICJGPIBT-AWEZNQCLSA-N 434.159 4.963 50 10 IJGE Cc1sc(C(=O)N(C)[C@H](CCBr)C(F)(F)F)c(Br)c1C 2237629897 OJCZAVBFRQCEJP-MRVPVSSYSA-N 437.119 4.915 50 10 IJGE C[C@]1(CNC(=O)c2cc(F)c(Br)cc2Cl)CCC[C@@H]1Br 2286879673 JEOLXTSIXURXGN-GXTWGEPZSA-N 427.539 4.925 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@H](Br)[C@]1(C)COCCO1 2295363051 QYHGJDYRZXRPNK-KBPBESRZSA-N 428.548 4.661 50 10 IJGE CC(C)[C@@H](Cl)C(=O)N1CCC(c2nc(-c3ccncc3)cc(=Nc3ccccc3)[nH]2)CC1 2296578168 MOGOBBKANZZQTD-HSZRJFAPSA-N 449.986 4.674 50 10 IJGE C[C@H]1C[C@@H](CBr)CCN1Cc1ccc(Cl)cc1I 2318540091 OUGUADSHNLIUTQ-QWRGUYRKSA-N 442.566 4.940 50 10 IJGE CCOc1ccc(NC=C(C#N)C(=O)N[C@@H](C)c2cc(C)ccc2OCC)cc1OCC 2325071412 MMTIHIYSYATMJQ-SFHVURJKSA-N 437.540 4.888 50 10 IJGE O=C(N[C@@H](CCl)C1CCCCC1)c1ccc(Cl)cc1I 2365585397 AAWOTLPOXGUGJO-AWEZNQCLSA-N 426.125 4.862 50 10 IJGE CCOc1ccc(NC(=O)/C(C#N)=C/c2cc(OCC)c(OC)cc2Br)cc1 59224811 ATMZQSUFDHYYJQ-XNTDXEJSSA-N 445.313 4.801 50 10 IJGE COC(=O)c1cc(OC)c(OC)cc1N/C=C(/C#N)c1nc(-c2ccc(F)cc2)cs1 102421014 HXIMZBSXAPHXLA-KAMYIIQDSA-N 439.468 4.730 50 10 IJGE CCCCCCCCCOc1ccc(/C=N/NC(=O)c2cc(C)nc(O)n2)cc1OCC 169924266 WOFDMTBYMVUTQH-KOEQRZSOSA-N 442.560 4.783 50 10 IJGE CCC(CC)[C@H](Br)CNS(=O)(=O)c1ccc(Cl)c(Br)c1 230664753 CHYXMXSSLCPWQB-GFCCVEGCSA-N 447.620 4.581 50 10 IJGE C[C@@H](Br)C(C)(C)NC(=O)c1cc(Br)cc(Br)c1 235106527 PBEQYXAYSMNLKH-SSDOTTSWSA-N 427.962 4.503 50 10 IJGE CC[C@@](C)(CO[C@H](CI)c1ccc(Br)cc1)OC 319151507 ZIKIKCPECWBZJM-KGLIPLIRSA-N 427.120 4.757 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H]1n1c(CCCl)nc2cc(Br)cnc21 389782724 JEZGEBPZHDNJEY-KSSFIOAISA-N 433.781 4.668 50 10 IJGE C[C@H]1[C@@H](Br)C[C@H]2CC[C@H]1N2c1ncc(Br)cc1Br 686175219 DPFFOHBFKAUJBZ-NCIFOGHDSA-N 438.989 4.747 50 10 IJGE O=S(=O)(Nc1cccc(Br)c1Cl)c1ccc(CBr)cc1 690820353 GMLHNCQKQNAWDT-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE Cc1cc(NNC(=O)C2CCN(c3nc4ccccc4s3)CC2)ccc1Br 734251302 MOQPJEDFKLLKIS-UHFFFAOYSA-N 445.386 4.727 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)[C@@H](Sc2ccccc2Cl)c2ccccc2)cc1 748131558 OUKOREIGDRIIOV-FQEVSTJZSA-N 446.981 4.720 50 10 IJGE O=C(NN=Cc1ccc(Br)c(Br)c1)c1cccc2cccnc12 757574033 FRLDMCXXXOJUGT-UHFFFAOYSA-N 433.103 4.524 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2CC3(CCCCC3)C2)c(-c2ccc(Cl)cc2)n1 773720451 AKSASNUSTVBMGW-CPNJWEJPSA-N 433.943 4.817 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)NCc2cccs2)ccc1OCCOc1ccccc1 1084584032 QJMXVHKNBOZOCM-HKWRFOASSA-N 448.544 4.828 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)O[C@@H]3N=C(/C(C#N)=C\c4ccc(Cl)cc4)S[C@@H]32)cc1 1088740826 VTBXPKSDIVVDMG-DDSBPDPSSA-N 448.935 4.603 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1 1142560157 XNESJFDESUMRMX-FLIBITNWSA-N 446.256 4.946 50 10 IJGE C=CCn1c(SCC(=O)NNc2cc(Cl)ccc2C)nnc1-c1ccc(Cl)cc1 1158089601 OJRJVLMQAVXXRS-UHFFFAOYSA-N 448.379 4.982 50 10 IJGE C=CCNC(=S)NNC(=O)/C(=C\c1cccc(OCc2ccccc2)c1)c1cccs1 1290173509 MIVYUVIXGHBEAI-PGMHBOJBSA-N 449.601 4.549 50 10 IJGE BrC[C@H](CN(Cc1cccc(Br)c1)C1CCOCC1)C1CC1 1473387185 VMLHBMRRNGBXQE-MRXNPFEDSA-N 431.212 4.851 50 10 IJGE C#C[C@@H](NC(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1)c1ccccc1 1682351863 CGORNXFOSJRPAQ-HSZRJFAPSA-N 447.922 4.546 50 10 IJGE CCc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccc(OC)c2)CCC3)cc1 1772750155 VPYPPUKLUUXDBJ-UHFFFAOYSA-N 445.519 4.882 50 10 IJGE Cc1ccc(/C=C/C(=O)N/N=C2\C(=O)N(Cc3ccccc3Cl)c3ccccc32)cc1 1860822628 JKUCNZWNOSKZNL-VCDUMFIBSA-N 429.907 4.729 50 10 IJGE CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1 1873795649 VNVSITPZMMFLQN-FOGHPNEFSA-N 447.620 4.987 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCN(C(=O)OC(C)(C)C)C(C)(C)C1 1880760152 DTGXGAQTYKXQOB-KGLIPLIRSA-N 435.403 4.700 50 10 IJGE Brc1cc(OCc2ccccc2)ccc1[C@H](Br)[C@@H]1COCCO1 1899860543 ONRFXHPGDMHXDX-ROUUACIJSA-N 442.147 4.880 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)O[C@@H]1CCC2(CCCC2)C1 1902880705 GDICXGNSWHNPBK-PBHICJAKSA-N 437.362 4.834 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)CCc1ccc(Cl)c(Cl)c1 1905342957 MPOHGCDLYGZTRV-GFCCVEGCSA-N 427.125 4.986 50 10 IJGE CN(C)CCN(Cc1ccccc1)c1cc(Br)ccc1CBr 1931935527 MAVLGXOSRMRHHO-UHFFFAOYSA-N 426.196 4.912 50 10 IJGE BrCC(CBr)(Cc1ncccc1Br)C1CCC1 1942093697 VDIKSJKOGCQCDH-UHFFFAOYSA-N 425.990 4.963 50 10 IJGE CC1(C)[C@@H](Br)CCN1Cc1cccc(Br)c1Br 1943882594 VQUCJWJJNBPGNN-NSHDSACASA-N 425.990 4.959 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN(c2ncc(Br)cc2Br)C1 1997236366 HZDZZTGZGNIAKZ-BDAKNGLRSA-N 426.978 4.606 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3C[C@@H](Br)C[C@H]3C2)c1 2065400051 RTMUOWYFXYLCLG-DDFAGTSDSA-N 438.001 4.817 50 10 IJGE CC(C)(C)[C@@H]1[C@@H](Br)CCN1c1ncc(Br)cc1Br 2065423896 WZEOMVCWDCXMAQ-ONGXEEELSA-N 441.005 4.995 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCC2(CC1)C[C@H]2CCl 2092487231 IYWXCGQBJBTAJO-QMMMGPOBSA-N 427.589 4.754 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C(=O)CCCCBr)C2(CCCCCC2)C1 2106596180 FIBKXDWKSVNZGV-MRXNPFEDSA-N 431.415 4.770 50 10 IJGE CC1(C)COC[C@H](COc2c(Br)cc(CCl)cc2Br)O1 2145714535 OBTHBKQCLZBJIB-SNVBAGLBSA-N 428.548 4.523 50 10 IJGE C[C@@H]1CCCC[C@@]1(CNC(=O)OC(C)(C)C)NC(=O)c1ccc(CBr)cc1 2162496113 XPSYWZFWGKUDRN-VFNWGFHPSA-N 439.394 4.785 50 10 IJGE O=C(NC[C@]1(C2CC2)CCN(CCCCCCCCCBr)C1)C(F)(F)F 2163064059 SKBYOPGUYPPEKJ-GOSISDBHSA-N 441.376 4.893 50 10 IJGE CN(C(=O)c1cc(Cl)ccc1I)[C@H](CCCl)C(F)(F)F 2178516400 VZERQUZGUMGEQA-SNVBAGLBSA-N 440.030 4.576 50 10 IJGE C[C@@H](Cl)[C@@H](Nc1ncc(C(F)(F)F)cc1I)C(F)(F)F 2195317620 JBWUPRDMNFDACY-CLZZGJSISA-N 432.533 4.675 50 10 IJGE C[C@@H](Cl)[C@H](Nc1ncc(C(F)(F)F)cc1I)C(F)(F)F 2195317621 JBWUPRDMNFDACY-FBCQKBJTSA-N 432.533 4.675 50 10 IJGE CN(CC1CC(Br)C1)C(=O)CC[C@H](NC(=O)OC(C)(C)C)c1ccccc1 2196906299 CCAJYZDLZACCLV-VJFUWPCTSA-N 439.394 4.665 50 10 IJGE COc1cc(N2C[C@]3(C)CN(Cc4ccccc4)C[C@]3(C)C2)ccc1CBr 2204547711 KZGZWAGARIEJOS-ZRZAMGCNSA-N 429.402 4.939 50 10 IJGE C[C@@H](Cl)c1nc2cc(Cl)cnc2n1C[C@@H]1CC1(Br)Br 2224805411 MZXRHZAWRKTRTA-RQJHMYQMSA-N 427.955 4.891 50 10 IJGE Br[C@H]1CCCCCC[C@H]1OCCOCCOCCOCc1ccccc1 2227779665 OQCBGBOPWXMBET-LEWJYISDSA-N 429.395 4.739 50 10 IJGE C[C@@H](Br)c1ccccc1NS(=O)(=O)Cc1ccsc1Br 2234500202 BSQZUZIAVADMMH-SECBINFHSA-N 439.194 4.908 50 10 IJGE CCN[C@H](c1c(F)cc(Br)c(F)c1Br)[C@@H]1C[C@@H]1Br 2260006477 SPCQWMZLVIHLAO-JPOPXJHUSA-N 447.943 4.924 50 10 IJGE Cc1cc(Br)c([C@@H](Br)C2(S(C)(=O)=O)CCC2)c(C)c1F 2279141669 KWSUVWVJSQNJHC-CYBMUJFWSA-N 428.161 4.608 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@@H](Br)C2(CC2)C1 2282983272 KHGKYBYHHVWICR-GFCCVEGCSA-N 425.523 4.631 50 10 IJGE COc1ccccc1NC(=O)C(C#N)=Cc1cc(C)n(-c2ccc(NC(C)=O)cc2)c1C 2297382180 PQFCUGJKAXPMMP-UHFFFAOYSA-N 428.492 4.607 50 10 IJGE Clc1ccc(CN2CC(CCCBr)C2)c(I)c1 2302328239 HTGUAXFHAOZNHM-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE C[C@H]1C[C@@H](CBr)CN(Cc2ccc(Cl)c(I)c2)C1 2315550805 IRCPKPMOCHAPCA-JQWIXIFHSA-N 442.566 4.798 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN(Cc2ccc(Cl)cc2I)C1 2318539094 LBEBAAXUWKSKQD-GHMZBOCLSA-N 442.566 4.940 50 10 IJGE Cc1c(F)ccc(C(=O)N[C@H](CCBr)COCc2ccccc2)c1Cl 2320357331 ZCTKBOXAUHKDHT-OAHLLOKOSA-N 428.729 4.888 50 10 IJGE N#CC(=CNCc1cccc(Br)c1)C(=O)Nc1ccc(Cl)c(Cl)c1 2324269485 FGVYCONSOZMTLY-UHFFFAOYSA-N 425.113 4.892 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@H]3CCC[C@@]32CNC(=O)OC(C)(C)C)C1 2345008337 NOXAHXXFVPKXOA-IIBYNOLFSA-N 429.443 4.957 50 10 IJGE Cc1cc(C(=O)N2CC[C@H](Br)C[C@@H]2C(F)(F)F)sc1Br 2361454285 HWAOMOGNPJBVTR-IONNQARKSA-N 435.103 4.749 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cccc(C(F)(F)F)c1F 2369434388 WVDNETCXJIHNSZ-CQSZACIVSA-N 448.254 4.945 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)cc1C 38652951 LBVHPLGGGXMHSM-RUZDIDTESA-N 444.462 4.645 50 10 IJGE Cc1cc(Oc2ncnc(NNC(=O)c3cccc(Cl)c3)c2[N+](=O)[O-])ccc1Cl 40658596 RMOFNKHRKQTFHQ-UHFFFAOYSA-N 434.239 4.549 50 10 IJGE CCOc1ccc(NC(=O)/C(C#N)=C/c2cc(Br)c(N3CCCC3)o2)cc1 59301885 SXJLRAQNQBLUNS-SDNWHVSQSA-N 430.302 4.587 50 10 IJGE Cc1cc(C)cc(NC(=O)C(=O)N/N=C/c2ccc(OCc3ccccc3Cl)cc2)c1 59517071 ALNLHFSQSFLROT-VULFUBBASA-N 435.911 4.625 50 10 IJGE CC1=C(C#N)C(=O)N(C(C)C)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1ccc(F)cc1 101333756 BQWMLCISDUNJSU-LPYMAVHISA-N 440.478 4.679 50 10 IJGE Cc1cccc(C(CBr)(CBr)Cc2c(C)nn(C)c2Cl)c1 167849830 UTOQXSJTFZDSNU-UHFFFAOYSA-N 434.603 4.961 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc(N)cc2)ccc1OCc1c(Cl)cccc1Cl 169900177 XHISIWYFZZTLHI-ZRGSRPPYSA-N 444.318 4.927 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc(Cl)c1O 169917905 QAZTUARGLPKWIJ-YVNNLAQVSA-N 432.933 4.585 50 10 IJGE Cc1[nH]c2ccccc2c1/C=N\NC(=O)c1cccn(Cc2ccc(C(C)(C)C)cc2)c1=O 169921173 DFVSQYHAQHHKII-NTFVMDSBSA-N 440.547 4.748 50 10 IJGE CCCCOc1ccc(/C=C2\C(=O)N(Cc3ccc(OC)cc3)C(=O)C(C#N)=C2C)cc1 214396702 ZDCBPJQWTWBEPB-HAHDFKILSA-N 430.504 4.667 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc(-c3ccccc3)cc2)cc(Br)c1O 254292251 ISBCTWRDODTVDO-UHFFFAOYSA-N 439.309 4.984 50 10 IJGE CC1(C)CN(Cc2cc(Cl)ccc2I)C[C@@H]1Br 405279885 AXGCXSWFIOFOJU-LBPRGKRZSA-N 428.539 4.550 50 10 IJGE CCCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@H](Cc2nccn2C)c2ccccc2)c1C 744350340 SDILZCPRZUJOMU-HDMRQQGGSA-N 429.568 4.646 50 10 IJGE O=C(CSc1nnc(-c2ccco2)n1C1CCCCC1)NNc1cccc2cnccc12 748759531 XFNYCDNVXOIPMZ-UHFFFAOYSA-N 448.552 4.827 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)C(C)(C)c1ccccc1 764975359 BSVWVUBJBWTNLG-RWVGPTSPSA-N 437.547 4.853 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)Nc2ccc(-c3cnco3)cc2)c(-c2ccccc2)n1 918626562 BESLBYHNXNESPE-MOSHPQCFSA-N 434.459 4.664 50 10 IJGE C=CC[C@@]1(C(=O)NNc2nc3cc(Cl)ccc3cc2C)CCCN1C(=O)OC(C)(C)C 1137829873 GVJSXKPAIRQYIK-QHCPKHFHSA-N 444.963 4.986 50 10 IJGE Cc1cc2ccc(Cl)cc2nc1NNC(=O)c1ccc2nc(O)n(CC(F)(F)F)c2c1 1566872929 OVXMGSRSPVGRID-UHFFFAOYSA-N 449.820 4.571 50 10 IJGE COc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)Nc3ccc(C)cc3)c(C)c21 1772745745 GBYLAZGENOYQPV-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE Cc1c(C(=O)NC(C)C)oc2c1C(=NNC(=O)C(c1ccccc1)c1ccccc1)CCC2 1772747446 BUHDYTNTOAZMOX-UHFFFAOYSA-N 443.547 4.715 50 10 IJGE N#C/C(=C\c1ccc(Br)cc1)C(=O)NCCc1nc(-c2ccccc2)cs1 1866128595 AROPOAQJLMJKDT-SFQUDFHCSA-N 438.350 4.838 50 10 IJGE CCCC[C@H](NC(=O)CCCC(=O)c1cccs1)C(=O)Nc1ccc(SC#N)cc1 1866794389 TUZIFDDERPEIHT-SFHVURJKSA-N 443.594 4.988 50 10 IJGE CC(C)N1C[C@@H](/C(O)=C(\C#N)c2nc(-c3ccc(Br)cc3)cs2)CC1=O 1872746585 OLPRDXVNNTUPER-VLFBTDHHSA-N 432.343 4.622 50 10 IJGE Clc1cc(Br)cc(Cl)c1OCCOCCI 1904662531 AYLIWYAFFBZQPG-UHFFFAOYSA-N 439.902 4.586 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1F 1915090670 NRPDLZUYOUJRDK-LBPRGKRZSA-N 427.245 4.689 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2ccc([N+](=O)[O-])c(CBr)c2)C1 1921467333 AIVAPWNLNAPCKJ-DLBZAZTESA-N 432.362 4.837 50 10 IJGE CC(C)C[C@H](CBr)NC(=O)c1csc(Br)c1Br 1945189242 MJJRLYFUHRAFEH-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(Cc2ccccc2)C[C@H](CBr)C2CCC2)C1 1954679510 CGUFMECNTHOWBD-IBGZPJMESA-N 437.422 4.919 50 10 IJGE C[C@@H](CBr)CCCNC(=O)c1c(Br)cccc1Br 2033096739 ZJMOFBNODOOONT-SECBINFHSA-N 441.989 4.753 50 10 IJGE CCC(CC)(CBr)CN1C[C@H](NC(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1 2044693244 JANOJUPWXQIPGZ-OLZOCXBDSA-N 431.337 4.575 50 10 IJGE C[C@@H](CCBr)CCN1CCN(C(=O)OC(C)(C)C)[C@@H](CC(F)(F)F)C1 2055947361 HAEYLDVBUHTGNG-KBPBESRZSA-N 431.337 4.671 50 10 IJGE CCCn1cc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)CC)cc1CBr 2059312607 NIBSWMOHMLTCNA-MRXNPFEDSA-N 427.408 4.782 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@H](CNC(=O)OC(C)(C)C)Cc2ccccc21 2106787166 YEMFOHPRYFRKHW-FUHWJXTLSA-N 425.411 4.857 50 10 IJGE COc1cc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)ccc1CBr 2204548726 GFCGODRJSMNANT-IBGZPJMESA-N 443.307 4.843 50 10 IJGE CN(C[C@@H](Br)C1CCCCC1)C[C@H]1CC1(Br)Br 2213093873 HQMKAHHDCRYMHN-VXGBXAGGSA-N 432.038 4.768 50 10 IJGE COc1cc(F)c(Br)cc1[C@H](Br)c1c(Cl)c(C)nn1C 2240930191 LIUYVZRABILGNW-NSHDSACASA-N 426.511 4.776 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC[C@@H]2CCC2(C)C)C1 2243127476 OLBLHEXNBVMUSY-KSSFIOAISA-N 437.362 4.644 50 10 IJGE CC[C@@H]1CC[C@@H]([C@H](Br)c2ccc(OC)c(I)c2)O1 2257356110 RLWUWJSKOKDKEF-DDTOSNHZSA-N 425.104 4.693 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@H](Cl)c1cnn(C)c1I 2264365021 PIPMRXSTDYJVBI-NSHDSACASA-N 431.488 4.668 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(OC[C@H]2CC(F)(F)C23CCC3)CC1 2266140206 GIKAWGCECLCGNE-CQSZACIVSA-N 438.353 4.993 50 10 IJGE COc1ccc([C@@H](Cl)c2nn(C)c(Cl)c2Cl)cc1I 2269539700 DWFPOWZZHRHVEN-SECBINFHSA-N 431.488 4.668 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2[C@H](C)O[C@@H](C)[C@@H]2C)cc1I 2269554886 UQOGYWBLLHJWQD-QMMYFYAZSA-N 439.131 4.795 50 10 IJGE O=C(N1CCN(CCCCCCCBr)CC12CCCCC2)C(F)(F)F 2277447558 INVWJMYZOPPARZ-UHFFFAOYSA-N 427.349 4.741 50 10 IJGE O=C(c1cccc(Cl)c1Br)N1CC[C@H](Br)C(F)(F)CC1 2283142667 MVPWAJFZKWPGHC-JTQLQIEISA-N 431.502 4.737 50 10 IJGE C[C@H](Br)CN(CCC(C)(C)C)S(=O)(=O)c1cscc1Br 2288046935 FAGSJYBNWWZIEJ-JTQLQIEISA-N 447.258 4.721 50 10 IJGE BrCCN(Cc1sccc1I)C1CCCCC1 2301074622 UKNRRDNDUFLPRL-UHFFFAOYSA-N 428.177 4.882 50 10 IJGE CCCOc1c(C=NNC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cccc1OC 2323607396 JJOUAVHNDUNCNJ-UHFFFAOYSA-N 426.542 4.625 50 10 IJGE Cc1cc(I)ccc1NC(=O)C(C#N)=CNc1cccc(C)c1C 2325406135 CJGLUVKDQWCQSU-UHFFFAOYSA-N 431.277 4.675 50 10 IJGE C[C@@]1(CBr)CCCN(Cc2cc(I)ccc2Cl)C1 2327403003 KXENQCLBVBFATN-AWEZNQCLSA-N 442.566 4.942 50 10 IJGE CC(C)C[C@H](CBr)CN1CC(F)(F)[C@](C)(CNC(=O)OC(C)(C)C)C1 2328529965 ZIKFORBNHNCZBD-RHSMWYFYSA-N 427.374 4.526 50 10 IJGE CCOc1ccc(-c2csc(C(C#N)=C(O)[C@@H]3CC(=O)N(C(C)C)C3)n2)c(OCC)c1 2331386551 LWIPFKJCWCXHGF-OAHLLOKOSA-N 441.553 4.657 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@H](NC(=O)OC(C)(C)C)Cc2ccccc21 2353827037 PBOBEFWWIYICJL-SJLPKXTDSA-N 425.411 5.000 50 10 IJGE C[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2I)[C@@H]1CCCl 2365593189 SNYCBVXOYVHZMF-QMTHXVAHSA-N 426.125 4.814 50 10 IJGE CCC(CBr)(CBr)NC(=O)CCc1cc(Cl)cc(Cl)c1 2366871429 DJSDWLHNSVGSPX-UHFFFAOYSA-N 446.010 4.981 50 10 IJGE CCCCCOc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)cc1 14029482 KOADDIALMXQTRE-AWEZNQCLSA-N 439.339 4.791 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccccc3)ccc21 38681237 VHBCOQYJRCIBAE-DEOSSOPVSA-N 426.472 4.913 50 10 IJGE CCc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)Cc2ccccc2)CCC3)cc1 40815719 QOIPJQRPRRWJCD-SGWCAAJKSA-N 429.520 4.802 50 10 IJGE CC(C)CC(=O)N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccc(Br)cc21 40846380 LQCVHUDHAQLNHF-CLCOLTQESA-N 448.748 4.516 50 10 IJGE CCOc1cc(/C=C2\C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(F)cc1 214253160 ZEFCRGDKOIWEHW-MTJSOVHGSA-N 448.494 4.804 50 10 IJGE O=C(NCC1(CCBr)CC1)c1cc(Br)sc1Br 232456141 VCNCQOGXIYJIIW-UHFFFAOYSA-N 446.002 4.568 50 10 IJGE CCO[C@@H]1[C@H](Br)C[C@H]1Oc1ccc(Br)cc1Br 252845079 GABOEOACVNXCIY-YUSALJHKSA-N 428.946 4.531 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CCC[C@@H]1CCBr 302615963 OMRZKZGEOMDMIZ-SNVBAGLBSA-N 439.973 4.601 50 10 IJGE COC[C@@H](O[C@@](C)(CI)c1ccccc1Br)C(C)C 404098607 BZUFXQQAPCXFEG-CABCVRRESA-N 441.147 4.787 50 10 IJGE Clc1ccc(I)c(CC2(CBr)CCOCC2)c1 405509232 FFEIMLFPLHESBP-UHFFFAOYSA-N 429.523 4.679 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccccc2OCc2ccc(F)cc2)c1C 736695117 SSKZXZMWAWFUAJ-UHFFFAOYSA-N 443.482 4.630 50 10 IJGE Cn1cc(C=NNC(=O)c2ccccc2OCc2ccc(F)cc2)c(-c2ccccc2)n1 771555933 RDUIIJWGJRHZRZ-UHFFFAOYSA-N 428.467 4.569 50 10 IJGE COc1ccc(C(=O)NN=Cc2c(Br)c(C)n(-c3ccc(C)cc3)c2C)cc1 1084280118 YYZSBQRGJUOXIP-UHFFFAOYSA-N 440.341 4.938 50 10 IJGE C=CCc1cc(/C=C(\C#N)C(=O)N(C)C)cc(Br)c1OCc1ccccc1 1084286867 DQTJKQTWCPJWDN-XDHOZWIPSA-N 425.326 4.752 50 10 IJGE C#CCCN(CC(F)(F)F)C(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(OCC)cc2)c1C 1458686896 BIUFKIQCMXIKMH-XSFVSMFZSA-N 443.469 4.814 50 10 IJGE Cc1ccc(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2sccc2C)cc1 1865699035 JAZZYUKPXWMORR-OAHLLOKOSA-N 430.455 4.847 50 10 IJGE Cc1nc(NC(=O)/C(C#N)=C/c2cccc(Br)c2)sc1C(=O)OCC(C)C 1866131568 BJRVAQUUAFTQHO-VGOFMYFVSA-N 448.342 4.573 50 10 IJGE CC[C@](C)(NC(=O)[C@H](c1ccc(OC)cc1)C(C)C)C(=O)Nc1ccc(SC#N)cc1 1866978898 GDLSPVIGACSGMO-URXFXBBRSA-N 439.581 4.932 50 10 IJGE O=C(c1nscc1Br)N(Cc1ccccc1)C1(CBr)CCC1 1915756537 KAFPWGDHRKZLGU-UHFFFAOYSA-N 444.192 4.866 50 10 IJGE CC(C)C[C@H](CNC(=O)OC(C)(C)C)[C@H]1CCC[C@H](CI)O1 1931100232 YHHBILQQZOQXLO-RBSFLKMASA-N 425.351 4.546 50 10 IJGE Cl[C@H]1CCC[C@H](CNc2ncc(I)cc2Br)C1 2015756426 FRSSRNQFTCEVFS-IUCAKERBSA-N 429.527 4.658 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1C(=O)c1cc(Br)sc1Br 2018105979 ADOIUOIDROCOHE-HTRCEHHLSA-N 446.002 4.661 50 10 IJGE CC[C@H](Br)[C@H](CC)NC(=O)c1cccc(Br)c1Br 2031476280 AFIAKTKKXSYYGA-ONGXEEELSA-N 441.989 4.894 50 10 IJGE O=C(N[C@H](CCl)CC(F)(F)F)c1csc(Br)c1Br 2032958525 GAUKXYQPVKHOEQ-BYPYZUCNSA-N 429.483 4.563 50 10 IJGE Cc1ccsc1C=C(C#N)S(=O)(=O)c1cc(Br)ccc1Br 2040461527 UVMWFXZNYLHDHI-UHFFFAOYSA-N 447.173 4.920 50 10 IJGE CC[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](C)C[C@H]1C(F)(F)F 2058048459 DWBHFDQSJAUIGZ-MCIONIFRSA-N 431.337 4.670 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Br)c2cc(F)ccc2Br)c1 2093074108 IKNXIDNTOSDGJJ-LBPRGKRZSA-N 428.142 4.538 50 10 IJGE FC1(F)[C@H]([C@H](Br)c2cc(I)cc3c2OCC3)C12CC2 2095597155 RBTPIKNIKZJEGC-ZYHUDNBSSA-N 441.053 4.707 50 10 IJGE CCC[C@H](CBr)CN1C[C@H](c2ccccc2)[C@@H](NC(=O)OC(C)(C)C)C1 2106784533 JHXQNCDZAXHVAK-QRQLOZEOSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2CCN(CC3(CBr)CCCCCC3)C[C@@H]2C1 2106784587 JQYDQPSIEAXDCV-ZWKOTPCHSA-N 429.443 4.911 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(C[C@@H](CBr)C(C)(C)C)C[C@H]21 2106785798 QWVPMCSNFXQLGD-ZKXLYKBJSA-N 429.443 4.621 50 10 IJGE O=C(N1CCC[C@H]([C@@H]2CCCCN2CC2(CBr)CCCC2)C1)C(F)(F)F 2163064100 SONMOPHCHVLDGL-HOTGVXAUSA-N 439.360 4.597 50 10 IJGE CC[C@H](Cl)[C@H]1CCCCN1C(=O)c1cc(Cl)ccc1I 2170620505 ZEYJALZJRJKDSP-GXTWGEPZSA-N 426.125 4.957 50 10 IJGE Cc1c(CCl)cc(Cl)cc1S(=O)(=O)N1CCC[C@H](OCc2ccccc2)C1 2186389870 OPBHPHZIAQHQFH-IBGZPJMESA-N 428.381 4.757 50 10 IJGE Cc1ccc(I)c(-n2c(Cl)nc(Cl)c2CBr)c1 2217300342 ZEGOEOTWOCFTSF-UHFFFAOYSA-N 445.913 4.987 50 10 IJGE CC1(C)[C@H]2CC[C@@H](C2)[C@]1(CI)O[C@H]1CCN(Cc2ccccc2)C1 2250384994 DZWXRQWHWBSEQY-IWFBPKFRSA-N 439.381 4.907 50 10 IJGE O=C(N[C@]1(CCl)C[C@H]2CC[C@H]1C2)c1csc(Br)c1Br 2268610412 OPSYVSJMQKNKJY-UPFKWVMWSA-N 427.589 4.801 50 10 IJGE Cc1cc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)cc(CBr)n1 2288422654 NIFUGVQEKCGCEG-HWHRFOGPSA-N 426.402 4.632 50 10 IJGE CC[C@H]1[C@H](Cl)CCN1Cc1ccc(I)c(Br)c1 2306232757 YKJIOVLGCGTUKW-YPMHNXCESA-N 428.539 4.645 50 10 IJGE C[C@H]1OCC[C@]1(CBr)Cc1cc(I)ccc1Cl 2307274150 JZZRDPGBIXWART-NOZJJQNGSA-N 429.523 4.677 50 10 IJGE C=CCOc1c(Br)cc(C=C(C#N)C(=O)Nc2ccccc2C)cc1OC 2313518130 LPHCATGRPAAKQF-UHFFFAOYSA-N 427.298 4.877 50 10 IJGE Cc1c(C=C(C#N)C(=O)NC[C@H]2CCCO2)c2ccccc2n1Cc1ccc(Cl)cc1 2313610209 VDCQQTAPNQSDBC-OAQYLSRUSA-N 433.939 4.854 50 10 IJGE C[C@H](Br)CCCN(C)C(=O)c1ccc(I)c(Cl)c1 2314464003 DCQFWDQKKIVKFO-VIFPVBQESA-N 444.538 4.580 50 10 IJGE CCOc1cc(C=C2C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(F)cc1 2314611702 ZEFCRGDKOIWEHW-UHFFFAOYSA-N 448.494 4.804 50 10 IJGE COc1cc(F)c(CO[C@@H](CCl)[C@H](I)CCl)c(Cl)c1 2339215974 APDXMQLQNPEHMQ-NEPJUHHUSA-N 441.495 4.654 50 10 IJGE F[C@@]12CCC[C@]1(CCl)CN(Cc1cc(I)ccc1Cl)C2 2380527231 KMLBYEIBCXMMQS-LSDHHAIUSA-N 428.116 4.878 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)cc1 38652645 SFRNJUBNLRQXSC-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE COc1ccc(/C(CSc2nc3ccccc3s2)=N\NC(=O)c2ccccc2O)cc1 59460775 OXXHBCUFNBHVIM-PLRJNAJWSA-N 449.557 4.937 50 10 IJGE C=CCNC(=O)/C(C#N)=C1\S[C@H](Cc2ccc(C)c(C)c2)C(=O)N1c1ccc(CC)cc1 101241475 HQPFPKPDKGOTIJ-YMGIJWJESA-N 445.588 4.594 50 10 IJGE C[Si](C)(C)O[C@@H]1OC[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C 231125953 KEOUSSOURMHEKN-YVSFHVDLSA-N 438.862 4.855 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1Cc1cc(Cl)ccc1I 705503772 YENMUOVVAMKURH-MWLCHTKSSA-N 428.539 4.692 50 10 IJGE O=C(NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl)[C@@H]1C[C@@H]1c1c(F)cccc1F 734861858 BEJSQPGCTKGHJU-VHSXEESVSA-N 449.832 4.758 50 10 IJGE Cn1c(=O)ccc2ccc(NS(=O)(=O)c3ccc(S(F)(F)(F)(F)F)cc3)cc21 782472493 ZYLVGDBVNSWQSB-UHFFFAOYSA-N 440.415 4.997 50 10 IJGE N#Cc1ccc(NNC(=O)NCc2nc3cc(Cl)ccc3s2)c(C(F)(F)F)c1 799559966 AWPCVZLEEBANFC-UHFFFAOYSA-N 425.823 4.666 50 10 IJGE COc1cccc(C(=O)NN=Cc2ccc(OCc3ccc(Br)cc3)cc2)c1 1081086750 DKWVIROICWAMIC-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE CO[C@@H](C(=O)NN=Cc1cc(C)n(-c2ccc(Br)cc2)c1C)c1ccccc1 1084191788 QHWJTQHBFMQQBK-OAQYLSRUSA-N 440.341 4.694 50 10 IJGE O=C(NN=Cc1cccc(Cl)c1Cl)C(=O)Nc1ccc(OCc2ccccc2)cc1 1084433456 XBDHYPRQOBEUGN-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE C=CC1(CC(=O)NNc2nc3ccccc3c(=O)n2-c2cccc(C)c2C)CCCCC1 1293481475 ODJYSVFIOONASF-UHFFFAOYSA-N 430.552 4.972 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNc3ncccc3Br)cc2)cc1 1558880279 JRUJCHHVEATPDT-UHFFFAOYSA-N 426.270 4.596 50 10 IJGE C#CCC1(C(=O)NNC(=O)c2ccc(COc3ccc(Cl)c(C)c3)cc2)CCCCC1 1618732214 NUPJOFATULVDBI-UHFFFAOYSA-N 438.955 4.962 50 10 IJGE C=C(C)C[C@@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(=O)OCC 1625184368 POEGJYCTJGDKFU-OOIVEFLKSA-N 439.943 4.669 50 10 IJGE C=CC[C@@H](CO)CNC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1637571004 JSMWSOFPFMWGLR-LTKMBJGESA-N 432.351 4.609 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@@H]2C)oc2c1C(=NNC(=O)c1ccccc1F)CCC2 1772744157 QYKIAARNTFHUIW-HNNXBMFYSA-N 445.494 4.789 50 10 IJGE COc1cccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4ccc(C)cc4C)c(C)c32)c1 1772749921 RRCKDBKQBJPONR-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE Cc1ccc(C)c(NC(=O)c2oc3c(c2C)C(=NNC(=O)COc2ccccc2)CCC3)c1 1772750220 XVMFNPXKKBZWKY-UHFFFAOYSA-N 445.519 4.693 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2cccc(Cl)c2)cc1 1865692935 GRXRKNYKYIMTTK-JOCHJYFZSA-N 434.927 4.900 50 10 IJGE N#C/C(=C(O)\C=C/c1ccc2c(c1)OCCO2)c1nc(-c2ccc3c(c2)OCO3)cs1 1872752728 PQACZYANHBKIOF-NSDFMJIVSA-N 432.457 4.816 50 10 IJGE C[C@H](NCc1cccc(Br)c1Br)c1nnc(CCl)s1 1877572767 BXMZKBIVZXUDFT-ZETCQYMHSA-N 425.577 4.653 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1ccccc1C(F)(F)F 1916349255 TWEGETYADDGTBI-HNNXBMFYSA-N 430.264 4.758 50 10 IJGE C[C@H](c1ccncc1Br)[C@H](Br)c1cnn(C)c1Br 1924047843 QJXPZELZOBGFQU-HQJQHLMTSA-N 437.961 4.580 50 10 IJGE CC(C)(C)OC(=O)N1CCCN(CC2(CBr)CCCC2)CC(F)(F)C1 2044706836 XMVGYPYKQHIDJU-UHFFFAOYSA-N 425.358 4.520 50 10 IJGE C[C@H](c1ccncc1Br)[C@H](Br)c1cn(C)nc1Br 2052974895 CHKBIXLBGAAGPY-HQJQHLMTSA-N 437.961 4.580 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1C(=O)c1cc(Br)cc(Br)c1 2073311885 FVHCYFUWAHCTPZ-PELKAZGASA-N 439.973 4.600 50 10 IJGE Cc1c(F)cccc1Cn1nc(CCl)c(I)c1C(F)(F)F 2079210430 RABMMHRTKWFIBZ-UHFFFAOYSA-N 432.586 4.741 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]2(CC13CCOCC3)C[C@]2(CBr)C(F)(F)F 2083260601 PTPKIBXOKGGUNE-GDBMZVCRSA-N 428.289 4.510 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@H]2CCCCN(CC3(CBr)CCCC3)C2)C1 2106784700 KLUAGXGKNHBPKE-KRWDZBQOSA-N 429.443 4.911 50 10 IJGE FC1(F)CCC2(CC1)[C@@H](OCCOCCOCc1ccccc1)C[C@H]2Br 2121105082 MPFHPRHRIBNTBN-MSOLQXFVSA-N 433.333 4.968 50 10 IJGE Cc1cnc(N2C[C@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)c(CBr)c1 2159684962 BRGGTIRMMSFSLO-DHIUTWEWSA-N 426.402 4.777 50 10 IJGE O=C(c1cc(Cl)ccc1I)N(CCCl)Cc1cccs1 2171086392 BPWROGQLGJNWJZ-UHFFFAOYSA-N 440.133 4.887 50 10 IJGE Cc1cc(Br)c(CCl)c(N2CC[C@@]3(CN(Cc4ccccc4)CCO3)C2)c1 2173450333 PEXGJWSQIWRBFJ-JOCHJYFZSA-N 449.820 4.978 50 10 IJGE Cc1cc(C(=O)NC[C@]2(F)CC[C@@H](CBr)CC2)sc1Br 2178589261 PCLKADAFQMKTJI-WJONMLJTSA-N 427.177 4.842 50 10 IJGE O=C(c1ccc(Cl)cc1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Br)C2 2190677309 HVAWVKJZZHMMLJ-WTFGDDLMSA-N 425.523 4.581 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1COC(C)(C)CN1CC1(CBr)CCCCCC1 2194647608 CSWHWZAAIUMRPH-KRWDZBQOSA-N 447.458 4.726 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1cc(C)c(Br)c(C)c1 2227416705 GRVOGNGSFIRSFW-NOZJJQNGSA-N 438.147 4.645 50 10 IJGE Cc1cccc(Oc2ncc(Br)c(CCl)n2)c1I 2263525289 BGFKAMWZOJDYLY-UHFFFAOYSA-N 439.478 4.683 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1)C(=Cc1ccccc1Cl)NC(=O)c1ccccc1 2297565243 LCYJZOHDVNHRPV-UHFFFAOYSA-N 438.314 4.915 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](N)[C@H]1C[C@H](Br)C1 2301504249 ZLAZINVVLFCLKW-NQYJQULFSA-N 429.953 4.832 50 10 IJGE C[C@H](Cl)CCCN(C)C(=O)c1ccc(Br)cc1I 2314589012 ULDVYTYAAPUDJD-VIFPVBQESA-N 444.538 4.533 50 10 IJGE C[C@@]1(CCl)CCCN(Cc2ccc(I)c(Br)c2)C1 2325208104 TZMQHDXBSHJOBW-AWEZNQCLSA-N 442.566 4.895 50 10 IJGE ClCC12CC(CCN1Cc1ccc(I)c(Br)c1)C2 2325229478 OAPFJJORWPGCSQ-UHFFFAOYSA-N 440.550 4.647 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)C(C#N)=CNc1cc(Cl)ccc1OC 2325306837 XYVHFQYELNYHAL-UHFFFAOYSA-N 427.888 4.764 50 10 IJGE COC[C@]1(C)C[C@@]1(CBr)Cc1cc(I)ccc1Cl 2327405723 PJXFRPCTFVMPIO-UONOGXRCSA-N 443.550 4.925 50 10 IJGE C[C@@H]1CCC[C@@H](CO[C@H](CI)c2ccccc2Br)O1 2338867663 QUUSRXBUEHVIDO-TYNCELHUSA-N 439.131 4.899 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3[C@@H]4CC[C@@H](CN4C(=O)OC(C)(C)C)[C@H]3C2)C1 2371131629 PPUDINVNWYDILO-MLHJIOFPSA-N 441.454 4.765 50 10 IJGE CC[C@@H](C)c1ccccc1OCC(=O)NNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 13980332 YBVNWALWQPDDRT-ZIAGYGMSSA-N 439.339 4.501 50 10 IJGE O=C(N/N=C/c1cc(Cl)cc([N+](=O)[O-])c1O)c1cc(-c2ccccc2)nc2ccccc12 27520178 MYZJQTICELRTHR-DHRITJCHSA-N 446.850 4.933 50 10 IJGE Cc1ccc2c(c1)/C(=N\NC(=O)[C@@H](C)Oc1ccc(Cl)cc1C)C(=O)N2CCC(C)C 33959338 HAEWBBSGLMVXCT-JMBSQFONSA-N 441.959 4.637 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3)ccc2[C@H]1c1ccccc1Br 38678430 SJHHSUATEGNFKJ-OAQYLSRUSA-N 447.288 4.886 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)CCCOc2ccccc2C)c(OCC)c1 40867341 ZMOPNXKOYDBGLL-HMMYKYKNSA-N 437.492 4.628 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1Br)c1cc(Br)ccc1Br 161220806 JMJYKIKQLNEJAF-VXGBXAGGSA-N 439.973 4.648 50 10 IJGE O=C(c1ccc(Cl)c(Br)c1)N1CCC(F)(F)[C@@H](CBr)C1 403966221 LRCMYDVRRFHASD-VIFPVBQESA-N 431.502 4.595 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccccc1[C@@H]1CN(S(=O)(=O)c2ccccc2)CCN1 616604105 URFUHEMJYORAER-QFIPXVFZSA-N 446.689 4.544 50 10 IJGE O=C(N[C@@H]1CCC[C@H](Br)C1)c1cc(Br)c(Br)s1 694586180 IENJNWOIPRWDMN-NKWVEPMBSA-N 446.002 4.709 50 10 IJGE O=C(NCCCCCCCl)c1ccc(I)c(Br)c1 721601177 FKYXTDYSPMZNOR-UHFFFAOYSA-N 444.538 4.583 50 10 IJGE CC(=NNC(=O)c1cccc(C)c1)c1ccc(C(C)=NNC(=O)c2cccc(C)c2)cc1 725436459 UTLCSYKGDOCUFU-UHFFFAOYSA-N 426.520 4.611 50 10 IJGE O=C(NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl)[C@H]1C[C@H]1c1cc(F)ccc1F 743301050 QYPOGKBLFMVSIY-JQWIXIFHSA-N 449.832 4.758 50 10 IJGE N#Cc1ccc(CNC(=O)NNc2c(Cl)cc(Br)cc2Cl)c(F)c1 745807486 XZLOHTKBXUDGHQ-UHFFFAOYSA-N 432.080 4.593 50 10 IJGE O=C(NNS(=O)(=O)c1cccc(S(F)(F)(F)(F)F)c1)c1ccc(Cl)cc1 777593390 KFVWEPAXLMIEDO-UHFFFAOYSA-N 436.811 4.621 50 10 IJGE CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NNc1nc(-c2cccnc2)nc(C)c1C 806888970 VWANQKTXUAKJFZ-QGZVFWFLSA-N 443.473 4.886 50 10 IJGE CCCOC(=O)c1ccc(OCC(=O)NN=C(C)c2ccc(-c3ccccc3)cc2)cc1 1084210777 UTZBBSIXFPOSLZ-UHFFFAOYSA-N 430.504 4.840 50 10 IJGE CC(=O)c1cc2c(cc1NC(=O)/C(C#N)=C\c1cc(C)n(-c3ccc(C)cc3)c1C)OCO2 1124396977 GMHJGSXUYFCZIF-JMIUGGIZSA-N 441.487 4.880 50 10 IJGE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NNc1nc(-c2ccc(Cl)cc2)no1 1627960344 LRWZPCMWHQRLOD-ZHACJKMWSA-N 438.793 4.835 50 10 IJGE C#C[C@H](NC(=O)NNc1ccc(Cl)c(Br)c1)c1ccc(Cl)cc1F 1682366284 BWMDNBRATXXPOL-HNNXBMFYSA-N 431.092 4.896 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccccc2F)cc1 1865694315 SXCFDCVJCYGSEZ-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE COc1ccc(/C(C)=N/NC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)c(OC)c1 1865762788 CNZYSDOOEUXJIK-MZJWZYIUSA-N 425.435 4.506 50 10 IJGE N#C/C(=C(O)\C=C/c1ccc2c(c1)OCCO2)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 1872746861 CDLZOSUBTZXVSJ-NIDXFDPDSA-N 433.445 4.996 50 10 IJGE Cc1nc(Br)c([C@@H](Br)c2ccc(Br)s2)n1C 1900420678 FNEUZGWRLFOTLR-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2[C@@H]3CCCO[C@@H]32)s1 1900923826 FKMLNWNCUULRNE-RAWIJENESA-N 433.536 4.867 50 10 IJGE COc1cccc(Br)c1C(=O)N(Cc1ccccc1)[C@@H](C)CBr 1914195644 QJQBAWTZXPUQOT-ZDUSSCGKSA-N 441.163 4.884 50 10 IJGE C[C@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1c(Cl)cccc1Br 1914664285 QXLINPUWLRIRRK-LBPRGKRZSA-N 437.186 4.921 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cscc1C(F)(F)F 1916374490 KIGQWFYBQHKRID-CYBMUJFWSA-N 436.293 4.819 50 10 IJGE C[C@H](c1ccncc1Br)[C@H](Br)c1c(Br)cnn1C 1924055624 HIXWUESUDRHNKC-HQJQHLMTSA-N 437.961 4.580 50 10 IJGE Cc1cc(Br)c([C@H](Br)c2cc(Br)n(C)n2)s1 1937821634 LDGATXMUNHNKNN-SECBINFHSA-N 428.975 4.799 50 10 IJGE O=C(N[C@@H]1CC[C@H](CBr)C1)c1ccc(Br)cc1Br 2029531653 AHMSEIRKDHSPGF-WCBMZHEXSA-N 439.973 4.505 50 10 IJGE F[C@]1(CBr)CCCN(Cc2cccc(Br)c2Br)C1 2039793780 APZDDQGZWIHSPO-ZDUSSCGKSA-N 443.980 4.911 50 10 IJGE Brc1ccc(Br)c(CN2CC[C@H](Br)[C@@H]2C2CC2)c1 2067010477 BFCYFZQTBLJZEC-KBPBESRZSA-N 438.001 4.959 50 10 IJGE C[C@H](Br)[C@H]1CCCN1C(=O)c1ccc(Br)cc1Br 2073321451 ZHJZPIXWAQSTTA-QPUJVOFHSA-N 439.973 4.600 50 10 IJGE BrC[C@@]12CC[C@H]1CN(Cc1c(Br)cccc1Br)C2 2078146655 ZJANMRVPIHJSBR-IINYFYTJSA-N 438.001 4.819 50 10 IJGE C[C@@H]1C[C@H](O[C@H](CI)c2ccccc2Br)CCO1 2084725646 QIDPVNKCVUHXBJ-JTNHKYCSSA-N 425.104 4.509 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H](OC)C[C@H]1CNC(=O)OC(C)(C)C 2106787420 IWJPPMUBZUOVAW-DLBZAZTESA-N 435.447 4.582 50 10 IJGE Cc1cc(Br)ccc1C(=O)N[C@H](C)CCCCCI 2117894116 JZYNHLDUNGBJFR-GFCCVEGCSA-N 438.147 4.871 50 10 IJGE O=C(c1cc(C(F)(F)F)ccn1)N(Cc1ccccc1)[C@H](CBr)C1CC1 2121515510 WCXGIQZJWDSTBH-QGZVFWFLSA-N 427.264 4.916 50 10 IJGE N#C[C@@H]1CN(c2cc(C(F)(F)F)ccc2CBr)CCN1Cc1ccccc1 2155759233 NWZROYRAFDVRLM-GOSISDBHSA-N 438.291 4.815 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)[C@H]1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2162872172 KZGNTMYEVKRDGU-BCDXTJNWSA-N 437.378 4.584 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1CN(CC1CC1)C(=O)[C@@H](Br)C1CCCC1 2167033135 PTXCIZUDSOUKRF-MSOLQXFVSA-N 443.426 4.578 50 10 IJGE Oc1nc([C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)nc(C2CC2)c1CBr 2187326643 VDVRVSLWNVAUDB-NNZMDNLPSA-N 428.374 4.865 50 10 IJGE FC(F)(F)CC1(CBr)CCN(C[C@]2(Br)CC2(F)F)CC1 2202508393 GNFMVRANERMXAR-SNVBAGLBSA-N 429.065 4.589 50 10 IJGE CC(C)(C)OC(=O)N[C@@]12CCC[C@@H](CN(C[C@@H](CBr)c3ccccc3)C1)C2 2207053897 UXQKOFLOTUNIDG-SFGWALBWSA-N 437.422 4.934 50 10 IJGE Cc1sc(C(=O)NC[C@]2(CBr)C[C@@H]2C(F)(F)F)cc1Br 2234474717 MMCTYTJYRIYZLE-GXSJLCMTSA-N 435.103 4.512 50 10 IJGE Cc1sc(CN(C)CC2(CBr)CCOCC2)c(Br)c1C 2237721765 BSWFHSLNUXMCNJ-UHFFFAOYSA-N 425.230 4.751 50 10 IJGE CCC[C@H](CCBr)NC(=O)c1ccc(Cl)c(I)c1 2256385267 JZEIYAROXOJCFG-SNVBAGLBSA-N 444.538 4.628 50 10 IJGE O=C(NC[C@@H](CBr)C1CCC1)c1cc(F)c(Br)cc1Cl 2282982783 HLGWKMYTNDSKMV-SECBINFHSA-N 427.539 4.783 50 10 IJGE N#CC(=Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Br 2293152577 FENNPBCTLWZJBA-UHFFFAOYSA-N 440.175 4.922 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)C=Cc4ccccc4)ccc32)c1 2314634759 HQNUVXDWHKDHMD-AREMUKBSSA-N 438.483 4.922 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)cc2I)C[C@@H](C)C1Br 2318537945 LCLIQUHJLFNXBQ-NXEZZACHSA-N 442.566 4.796 50 10 IJGE O=C(N[C@@H]1C[C@@H](CBr)C12CCC2)c1cc(Br)c(Cl)s1 2351615744 VCMACFIZVZXGAP-OIBJUYFYSA-N 427.589 4.848 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccc(C(F)(F)F)cc1O 2369677981 WEKKEQQPUOOLMZ-HNNXBMFYSA-N 446.263 4.511 50 10 IJGE Cc1ccccc1NC(=O)c1ccc(NS(=O)(=O)c2ccc(CCCl)cc2)cc1 3170329 IWZOQYVPTFMOGD-UHFFFAOYSA-N 428.941 4.829 50 10 IJGE COc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2Br)c2ccccc12 13986050 NHWABSVZLBDSSP-FOKLQQMPSA-N 447.716 4.793 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)NCCc1c[nH]c2ccccc12 33304615 SOAPORDUNHVOGC-AQTBWJFISA-N 426.432 4.602 50 10 IJGE C=CCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccccc3F)c(OCC)c2)C1=O 38607793 RGBKJOWVTHVRJE-DEDYPNTBSA-N 446.478 4.582 50 10 IJGE COC(=O)c1ccc(CN/C=C(/C#N)C(=O)NC2CCCCCCCCCCC2)cc1 217260151 QNCSDBNRLFNSKS-QOCHGBHMSA-N 425.573 4.760 50 10 IJGE O=C(NC[C@@H]1CCCC[C@H]1CCl)c1ccc(I)c(Cl)c1 232348876 PMYCYKORHVUEBR-RYUDHWBXSA-N 426.125 4.720 50 10 IJGE C[C@@H](Br)C[C@@H](C)CNC(=O)c1cc(Br)ccc1Br 397850832 SAVVIMXSLLFYKO-RKDXNWHRSA-N 441.989 4.751 50 10 IJGE C[C@H](NC(=O)c1cc(Br)cc(Br)c1)C1(CBr)CC1 696076757 QMIGYVRDPZGLLC-QMMMGPOBSA-N 439.973 4.505 50 10 IJGE O=C(NC[C@@H](Br)C1CCC1)c1scc(Br)c1Br 705439975 VOCZNQHENVCGCT-SSDOTTSWSA-N 446.002 4.567 50 10 IJGE O=C(NNC(=O)[C@H]1C[C@H]1c1cccc2ccccc12)c1ccc(Br)cc1Cl 730752516 HEFPYYJCOAEWHO-ROUUACIJSA-N 443.728 4.820 50 10 IJGE CCCCCCOc1ccc(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)cc1OC 736693398 FCYXJWQFAGRDTR-UHFFFAOYSA-N 449.555 4.880 50 10 IJGE O=C1CCN1c1ccc(NS(=O)(=O)c2cccc(S(F)(F)(F)(F)F)c2)cc1 799126773 JTMQKDRRVRKDIL-UHFFFAOYSA-N 428.404 4.882 50 10 IJGE CO[C@H](C(=O)NN=Cc1c(Br)c(C)n(-c2ccccc2)c1C)c1ccccc1 1084270259 KERCLEFMZKNFCB-NRFANRHFSA-N 440.341 4.694 50 10 IJGE O=C(COc1cccc(Br)c1)NN=Cc1ccc(-c2ccccc2Cl)o1 1084333040 NKZOXTSBMAVDLE-UHFFFAOYSA-N 433.689 4.892 50 10 IJGE Cc1cc(C=NNC(=O)CC[C@@H](O)c2ccccc2)c(C)n1-c1ccc(F)c(Cl)c1 1084637572 GNOSQIRMUGGAPY-JOCHJYFZSA-N 427.907 4.851 50 10 IJGE Cc1c(C(=O)NNC(=O)CC23C[C@H]4C[C@@H](CC(Br)(C4)C2)C3)oc2ccccc12 1086840330 OOFCMYZVPBEJQT-ZNAOMFPMSA-N 445.357 4.626 50 10 IJGE C/C(=C/C(=O)NNc1ccc([N+](=O)[O-])cc1Br)c1ccccc1C(F)(F)F 1296799667 RHLUUSUTONGJOH-NTMALXAHSA-N 444.207 4.923 50 10 IJGE CC[C@@H]1CN(C(=O)OCc2ccccc2)[C@H](CC)CN1C[C@@H](CBr)C1CC1 1615577247 FOKQUWRUKPDZTP-NJDAHSKKSA-N 437.422 4.919 50 10 IJGE C=CCC[C@H](NC(=O)NNc1cccc(C(=O)OC)c1F)c1ccc(C(F)(F)F)cc1 1679306261 WIBPKJISTGNPFK-INIZCTEOSA-N 439.409 4.965 50 10 IJGE COc1cc(C=NNC(=O)COc2c(C)ccc(C)c2C)ccc1OCCc1ccccc1 1772753421 DNGMDROSRNMBNY-UHFFFAOYSA-N 446.547 4.771 50 10 IJGE CCc1nn(-c2ccc(C)cc2)c2c1[C@@H](c1cccc(Br)c1)C(C#N)=C(N)O2 1865683816 ITLUQDJXQTYRHM-IBGZPJMESA-N 435.325 4.724 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccc(F)cc2)cc1 1865686003 PVQJQLDLYWPFGW-QGZVFWFLSA-N 428.389 4.616 50 10 IJGE Cn1cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2Cc1ccccc1Cl 1865698982 HTMZTVATVNROHV-NRFANRHFSA-N 441.922 4.808 50 10 IJGE CCCc1nn(C)c2c1[C@@H](c1ccccc1OCc1ccc(Cl)cc1)C(C#N)=C(N)O2 1865700694 BHFQCGYDDWGQAP-NRFANRHFSA-N 434.927 4.823 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2)[C@H]1c1ccccc1C(=O)O 1865704453 WHGLUBQAEDGODH-QFIPXVFZSA-N 448.482 4.515 50 10 IJGE CCN(c1ccccc1)S(=O)(=O)c1ccccc1NC(=O)/C(C#N)=C/c1ccc(C)cc1 1866127228 PLPSBROWMSLZLX-HEHNFIMWSA-N 445.544 4.756 50 10 IJGE Cc1ccc(S(=O)(=O)NC/C(O)=C(\C#N)c2nc(-c3ccccc3Cl)cs2)cc1 1872745764 BRJCYLBOUPFDKX-MNDPQUGUSA-N 445.953 4.543 50 10 IJGE Clc1ccc(I)c(CN2CC[C@@H](Br)C23CCC3)c1 1914397661 BELGZSDEBNVFRR-CYBMUJFWSA-N 440.550 4.837 50 10 IJGE CCc1nn(C)c(CN(Cc2ccccc2)C[C@@H](C)Br)c1Br 1914639235 RSVJUOBDAKIHPH-CYBMUJFWSA-N 429.200 4.531 50 10 IJGE CCC(CC)(CBr)CN1C[C@@H](C)N(C(=O)OCc2ccccc2)[C@H](C)C1 1977952869 SLMIKYOGKNYSFG-QZTJIDSGSA-N 425.411 4.919 50 10 IJGE Clc1cc(CN2CC[C@@H](CCBr)C2)ccc1I 2026563754 MVLIVNAAGFECOY-SNVBAGLBSA-N 428.539 4.552 50 10 IJGE Clc1c(Br)sc(Br)c1[C@H](Cl)[C@@H]1CO[C@H]2COC[C@@H]12 2040325990 OKHHADRTWKEMMJ-SKHQTKALSA-N 436.980 4.868 50 10 IJGE BrC[C@@H]1[C@@H]2CCN(Cc3cc(Br)ccc3Br)C[C@@H]12 2054718422 NDKWZRDQNVXNBM-YNEHKIRRSA-N 438.001 4.674 50 10 IJGE CCc1nn(-c2ccc(F)cc2CBr)c(CC)c1I 2093914458 CEIRUFFGPVYOOJ-UHFFFAOYSA-N 437.094 4.636 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](CN(C[C@@H](CBr)C2CCC2)C2CC2)C1 2106784032 FKKBNJFMZZZTPF-FUHWJXTLSA-N 429.443 4.909 50 10 IJGE O=[N+]([O-])c1ccc(N2CCN(Cc3ccccc3)C3(CCC3)C2)cc1CBr 2153349843 PSIWGGOXCVUTDM-UHFFFAOYSA-N 430.346 4.735 50 10 IJGE O=C(N[C@@H]1CN(Cc2ccccc2)C2(CCCCC2)C1)N1CCC(Br)CC1 2162076376 VQMABBXYGLRYHU-FQEVSTJZSA-N 434.422 4.533 50 10 IJGE CC(C)(C)OC(=O)N(CCO)[C@@H]1CCCN(CCCCCCCCCBr)C1 2163064749 VUBNBHDTVNRFCK-LJQANCHMSA-N 449.474 4.806 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@H](CNC(=O)[C@@H](Br)C1CCCC1)c1ccccc1 2175021216 UENZEMKJRKETQC-ROUUACIJSA-N 439.394 4.665 50 10 IJGE CN(C[C@]1(C)CSCCO1)c1c(CBr)ccc(Br)c1Cl 2201245707 QNWCDYTWVKGXBT-CQSZACIVSA-N 443.632 4.956 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(OC2C3CC4CC(C3)CC2C4)C1 2230442797 AVHWTCURLJIMRM-AMSLAILPSA-N 428.411 4.992 50 10 IJGE CCCN(C[C@@H](C)Br)C(=O)c1scc(Br)c1Br 2250584012 ZJRVLXFFMBUWOT-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(CCCCCCCBr)C[C@H]21 2277440983 YMLZUEUECLRIMU-MKXGPGLRSA-N 429.443 4.909 50 10 IJGE COc1cc(C=CC(=O)Cl)cc(I)c1OCc1ccc(F)cc1 2293940898 LMSMTBIGEGLVNN-UHFFFAOYSA-N 446.643 4.797 50 10 IJGE CC[C@H]1CN(Cc2ccc(Cl)cc2I)C[C@H]1Br 2302327126 WINVVLQEIVGGIC-JOYOIKCWSA-N 428.539 4.550 50 10 IJGE C[C@@H]1CC[C@@H](CCl)N(Cc2ccc(I)c(Br)c2)C1 2325226318 NHOUTCWKVCWZPN-PWSUYJOCSA-N 442.566 4.893 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H]2CC(Br)C[C@H]2C1 2327407188 PGTATQRPRDENLK-UWVGGRQHSA-N 440.550 4.550 50 10 IJGE C[C@@H]1[C@@H](C)N(Cc2ccccc2)[C@H](C)CN1c1nccc(N(C)C)c1CBr 2377484543 IOAFYGIGQPXDKF-KZNAEPCWSA-N 431.422 4.530 50 10 IJGE CCn1nc(Br)c(COc2c(Br)cc(Cl)cc2CCl)n1 2379957452 DRSQVTYRAUHEJG-UHFFFAOYSA-N 443.954 4.794 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(c2ccccc2)CCN(C[C@]2(CBr)CC2(F)F)C1 2379986520 SKWJXICNFSQGBI-RTBURBONSA-N 445.348 4.533 50 10 IJGE COc1ccc2c(c1)N(C)/C(=C1\S/C(=N\CCCl)N(Cc3ccccc3)C1=O)S2 2895924 RUHBMOZIONLIOK-JIQYJIFASA-N 445.997 4.777 50 10 IJGE CC[C@H](Oc1ccccc1[C@@H](C)CC)C(=O)NNC(=O)COc1ccc2ccccc2c1 10682925 VTTATCKEERUFMV-MBSDFSHPSA-N 434.536 4.737 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)N1CCN(c3cccc(Cl)c3)CC1)[C@@H]2Br 33514161 FRGCDDKBHSLWEF-AHRSYUTCSA-N 425.798 4.578 50 10 IJGE O=C(CCCSc1nc2ccc([N+](=O)[O-])cc2s1)N/N=C/c1ccccc1Cl 58989350 YYWCFLLMZLOHHD-RGVLZGJSSA-N 434.930 4.881 50 10 IJGE Cc1ccc(-c2ccccc2)n1-c1ccc(C(=O)N/N=C/c2ccc(O)c([N+](=O)[O-])c2)cc1 59303747 BWAMQJFIFJGKRC-WGOQTCKBSA-N 440.459 4.830 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc(C(=O)O)cc2)o1)c1nc2ncc(Br)cc2[nH]1 96663554 YCOMFVIQOCKRGU-QPEQYQDCSA-N 435.237 4.743 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Cl)Cc3cccc(Br)c3)cc2[nH]1 109883796 PXTYNWRMABQIHF-GFCCVEGCSA-N 430.527 4.904 50 10 IJGE C=CCc1cccc(C=NNC(=O)[C@H](C)Oc2ccc(OCc3ccccc3)cc2)c1O 254820656 VFYYVENQCWPRJH-IBGZPJMESA-N 430.504 4.617 50 10 IJGE Clc1cc(CBr)ccc1N1CC[C@@H](N2CCN(Cc3ccccc3)CC2)C1 380098482 MOQNXRDUMQQDIF-HXUWFJFHSA-N 448.836 4.631 50 10 IJGE C[C@H]1CCCN(Cc2cc(Cl)ccc2I)[C@H]1CBr 688704350 GKEISVMXPDRPHG-HZMBPMFUSA-N 442.566 4.940 50 10 IJGE Cn1cc(COc2c(Cl)cc(Cl)cc2CBr)c(Br)n1 714080879 SCJVCQGQGLASNH-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE O=C(NNC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1ccc(COc2ccccc2)o1 731185081 DNUAQLQZVFIFOR-XZOQPEGZSA-N 426.472 4.577 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)ccc1OCc1ccccc1C#N 1084038908 MSICKANOBNRQOY-ZVHZXABRSA-N 437.499 4.759 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2cc(C)n(-c3ccc(C)cc3)c2C)cc1 1084570516 LEMOTRREOXZAOB-VWLOTQADSA-N 433.552 4.765 50 10 IJGE CCCc1nn(-c2ccccn2)c2c1[C@@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 1865686461 WFAUACWESWKUIS-SFHVURJKSA-N 426.307 4.745 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3CC)cc1OCC 1865689328 PWEVHALBIQEZNJ-NRFANRHFSA-N 430.508 4.586 50 10 IJGE Brc1cc(Br)cc(OCCCCI)c1 1888183360 NDDWOJVFVGBCSJ-UHFFFAOYSA-N 433.909 4.806 50 10 IJGE CCc1nn(C)c(CN(Cc2ccccc2)[C@H](C)CBr)c1Br 1914375938 YRZBQTCJXQUTDB-CYBMUJFWSA-N 429.200 4.531 50 10 IJGE O=C(c1cncc(C(F)(F)F)c1)N(Cc1ccccc1)[C@H](CBr)C1CC1 1921649233 ZOJWIWXPASXNJO-QGZVFWFLSA-N 427.264 4.916 50 10 IJGE CC(C)N(Cc1ccc(I)c(Cl)c1)C[C@H](C)Br 2026567862 WCAUVAMAIBUKLK-JTQLQIEISA-N 430.555 4.938 50 10 IJGE CCc1ccc(S(=O)(=O)N(Cc2ccccc2)CC(F)F)cc1CBr 2059312855 QGHAQURIMBDTDB-UHFFFAOYSA-N 432.330 4.600 50 10 IJGE C[C@H](CCl)[C@@H]1CCCCN1c1ncc(I)cc1Br 2069529838 SQAUNEBMPXSXDQ-SKDRFNHKSA-N 443.554 4.683 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@H]1[C@H]1CCCN(C(=O)CCCCBr)C1 2106770897 CYXPNALOOVKYSD-IRXDYDNUSA-N 431.415 4.580 50 10 IJGE COc1cc(Cl)c([C@H](Br)c2cc(Cl)n(C)n2)cc1Br 2137655516 MIXXOMPFMOYELU-LBPRGKRZSA-N 428.939 4.982 50 10 IJGE Cc1ccc(NC(=O)OC(C)(C)C)cc1CNC(=O)[C@@H](Br)C1CCCC1 2139016132 ASBAJFPHTHMVBZ-KRWDZBQOSA-N 425.367 4.912 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CCC[C@H]1[C@@H]1CCN(Cc2ccccc2)C1 2145255941 RFWSIEROCCZQQY-YADHBBJMSA-N 427.386 4.708 50 10 IJGE CCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C(=O)c1ccc(CBr)cc1 2162911703 MMXMZNBVAYUORS-GOSISDBHSA-N 439.394 4.833 50 10 IJGE BrCC1(CN2CCC[C@]3(CCCN(Cc4ccccc4)C3)C2)CCOCC1 2163307070 PSKSRLXEZCONRG-QHCPKHFHSA-N 435.450 4.556 50 10 IJGE C[C@@H](Br)CCCc1cn(-c2cc(Br)c(Cl)cc2F)nn1 2189279938 QOJCVBSPVRSQQO-MRVPVSSYSA-N 425.527 4.928 50 10 IJGE COCC1(COC)C[C@@H](Cl)[C@@H](c2c(Br)cccc2Br)C1 2190817578 QEGTUCLFWNXXHF-GXFFZTMASA-N 426.576 4.976 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]12CC[S@](=O)(=NCCCCCCBr)C2 2223291841 WIXPJRXSSXDCAJ-IQGLISFBSA-N 437.444 4.583 50 10 IJGE CCOCc1cc(Br)c([C@@H](Cl)c2cnn(C)c2Br)s1 2224775271 RUTDQMPKTNIAOK-JTQLQIEISA-N 428.577 4.871 50 10 IJGE O=[N+]([O-])c1ccc(N2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)c(CBr)c1 2234715516 NMTQNQXPUMHYAU-BGYRXZFFSA-N 430.346 4.733 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C1CC([C@H]2CCN(C(=O)OC(C)(C)C)C2)C1 2241364337 HJQHTFNQOUHWOX-LBDPXKHJSA-N 447.414 4.558 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCc2ccccc2)ccc1OCCOc1cccc(C)c1 2293250298 QXMZQXXYPXCIKM-UHFFFAOYSA-N 442.515 4.685 50 10 IJGE COc1ccc(CNC(=O)C(C#N)=Cc2ccc(-c3ccc(Br)cc3)o2)cc1 2297556144 GMHJJWLJOYVINV-UHFFFAOYSA-N 437.293 4.941 50 10 IJGE C[C@H](Cl)C[C@H](C)CNCc1ccc(I)c(Br)c1 2306219779 PZVIWGDNIWSFBA-UWVGGRQHSA-N 430.555 4.797 50 10 IJGE Clc1ccc(I)cc1CN1CCC(CBr)CC1 2307333933 KIZNZGLPKSZABD-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE CCCN1C[C@H](Br)[C@H](Cc2ccc(Cl)c(I)c2)C1 2315548558 IIMLQPMNCQZRQI-NEPJUHHUSA-N 442.566 4.592 50 10 IJGE Clc1ccc(CN2C[C@@H]3C[C@H](C[C@@H]3Br)C2)cc1I 2315555320 PMIAILLNIQKOIL-WOPDTQHZSA-N 440.550 4.550 50 10 IJGE Cn1cc(I)c(C[C@@H]2CCCCCCC[C@H]2Br)n1 2319223062 JGKIONGHLUQFTK-NWDGAFQWSA-N 425.152 4.691 50 10 IJGE CC[C@H]1CN(Cc2ccc(I)c(Br)c2)C[C@@H]1CCl 2325234052 UANAXHJMJKSJIA-RYUDHWBXSA-N 442.566 4.751 50 10 IJGE CC(C)C[C@@H](CBr)CN=[S@](C)(=O)C1CCN(C(=O)OC(C)(C)C)CC1 2328521356 NYAVAMUQYWUMOG-ODCWNRFASA-N 439.460 4.541 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@@H]1CCCC[C@H]1C(F)(F)F 2343417126 VPBLMEYKWDLHQP-GVDBMIGSSA-N 436.312 4.842 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](NC(=O)OC(C)(C)C)C[C@@]1(C)COC 2364208793 MCFZBCOOHOQPCX-PXNSSMCTSA-N 449.474 4.972 50 10 IJGE COc1cccc([C@H](CBr)OCc2cccc(I)c2)c1 2367352396 KXLKKBYYJFQJPA-INIZCTEOSA-N 447.110 4.953 50 10 IJGE O=C(Cn1c(-c2ccc(Cl)cc2)n[nH]c1=S)NN=C(c1ccccc1)c1ccccc1 10130467 WKJPXUUEAATNIO-UHFFFAOYSA-N 447.951 4.830 50 10 IJGE Cc1ccc(C)c(NC(=O)CCC(=O)N/N=C/c2ccccc2OCc2ccccc2)c1 12577295 JFFLSRIGKXSJSX-WPWMEQJKSA-N 429.520 4.751 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1OCc1ccccc1 33930289 SKLNWLPZKMIWJH-UYRXBGFRSA-N 429.432 4.728 50 10 IJGE CCOc1cc(/C=C2/C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(F)cc1 38604612 ZEFCRGDKOIWEHW-CIAFOILYSA-N 448.494 4.804 50 10 IJGE Cc1cccc(C)c1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccccc1F 38652041 YKFAEDXXGSZCJI-DEOSSOPVSA-N 444.462 4.645 50 10 IJGE CCOC(=O)[C@@H](Cl)Cc1c(Br)cc(Br)cc1Br 134948118 QZLGBEHNMCFIQM-JTQLQIEISA-N 449.364 4.687 50 10 IJGE CCCOc1ccc(/C=N/NC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cc1Cl 169928031 XJHYCAKTVYJPEC-QPJQQBGISA-N 436.126 4.830 50 10 IJGE N#C/C(=C/NCc1ccccc1Br)C(=O)Nc1ccc(Cl)c(Cl)c1 217006732 KHHABOAODDEYAT-BENRWUELSA-N 425.113 4.892 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1Br)c1cc(Br)sc1Br 232459330 JBQQBYDCNBRPEZ-YUMQZZPRSA-N 446.002 4.709 50 10 IJGE Cc1ccc(C)c(OCC(=O)NN=Cc2ccccc2OC(=O)c2ccc(Cl)cc2)c1 254399861 ZMKLKBKCLKALTL-UHFFFAOYSA-N 436.895 4.705 50 10 IJGE O=C(CCn1cnc(-c2ccccc2)c1-c1ccccc1)NN=Cc1ccc([N+](=O)[O-])cc1 254514237 OHDVXVORNIDUSV-UHFFFAOYSA-N 439.475 4.666 50 10 IJGE CCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3ccccc3C)cc2OC)cc1 254517546 BWTUIDZFGSFYQX-UHFFFAOYSA-N 446.503 4.776 50 10 IJGE COc1ccc(C=NNC(=O)c2cc(Br)ccc2OCc2ccccc2)cc1 254660176 YQKZCUMETBVYKA-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE C[C@H]1[C@@H](CBr)CCN1C(=O)c1cc(Br)sc1Br 385758165 FBQWOLUQNMIOPL-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE C[C@H](CCBr)CCNC(=O)c1cc(Br)cc(Br)c1 397749476 OUEJNCRISPTMCO-SECBINFHSA-N 441.989 4.753 50 10 IJGE C[C@@H]1[C@@H](C)N(Cc2ccccc2)[C@H](C)CN1c1ccc(CBr)cc1[N+](=O)[O-] 404276171 NNJWROSXMMTJBC-BRWVUGGUSA-N 432.362 4.977 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1Cc1cc(Cl)ccc1I 405305838 QFKHXFSZJIXGPU-KOLCDFICSA-N 428.539 4.692 50 10 IJGE FC(F)Oc1ccc(I)c(Br)c1CBr 575682686 YSBMJGITCVHZLH-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE CCCCOCCCNC(=O)Nc1ccc(C(=O)Nc2ccc(SC#N)cc2)cc1 586611444 GVFGPIHCTOISFY-UHFFFAOYSA-N 426.542 4.840 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1cccc([C@@H]2CNCCN2S(=O)(=O)c2ccccc2)c1 616605192 VZHJLMXPOYCZCN-QFIPXVFZSA-N 446.689 4.544 50 10 IJGE CC[C@H](CCBr)NC(=O)c1scc(Br)c1Br 705517599 ZBUVOSNXCGYQIU-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE COc1ccc2cc([C@H](C)C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)ccc2c1 736693335 BUQUVTWKGLKURJ-INIZCTEOSA-N 427.508 4.564 50 10 IJGE O=C(NNC(=O)c1c[nH]cc1-c1ccc(F)cc1)c1ccccc1OCc1ccc(F)cc1 742033503 QZEDOHFMYJBMOD-UHFFFAOYSA-N 447.441 4.614 50 10 IJGE COc1cc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(F)cc3)c2C)ccc1NC(C)=O 916086765 AMYQLRISKYXEBC-XDHOZWIPSA-N 446.482 4.746 50 10 IJGE Cc1ccc(NC(=O)C(=O)NN=Cc2cc(C)n(-c3cccc(Cl)c3Cl)c2C)cc1 1084126882 ALZXKDTZFISUSW-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc3ccc(C(F)(F)F)cc3nc2O)c(C(F)(F)F)c1 1138825139 QJZMIFBATAVKSX-UHFFFAOYSA-N 440.303 4.607 50 10 IJGE CO[C@@H](COC1(CBr)CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1 1224325883 MTVDVUGITNSZEB-KRWDZBQOSA-N 428.367 4.555 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C)c1ccccc1C(F)(F)F 1290210284 IFPPXQUISOEMFJ-SQFISAMPSA-N 441.453 4.977 50 10 IJGE C=CC[C@]1(C(=O)Oc2ccc([N+](=O)[O-])c3ccccc23)CCCN1C(=O)OC(C)(C)C 1518799741 FQBIBYJVOGVTJH-HSZRJFAPSA-N 426.469 4.999 50 10 IJGE C/C(=C/c1ccc(Br)o1)C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1 1538859723 BJAUSEUCSNUSKF-KHPPLWFESA-N 449.301 4.774 50 10 IJGE O=[N+]([O-])c1ccc(Cl)c(-c2cc(CCl)n(-c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])n2)c1 1614819613 YVUCSVZNUOPERN-UHFFFAOYSA-N 438.183 4.656 50 10 IJGE Cc1ccccc1NC(=O)N/N=C1\c2ccccc2C[C@H]1NC(=O)c1cccc(Cl)c1 1614970129 FUCGSALEKPTHAR-PISCTYJTSA-N 432.911 4.529 50 10 IJGE CC[C@H](C)NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc(Cl)cc1Cl)CCC2 1772749120 WULWUAKWNZTRTC-NSHDSACASA-N 436.339 4.894 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2Cc1ccc(F)cc1 1865691081 IUCQGBYWTMTHSQ-QHCPKHFHSA-N 444.510 4.806 50 10 IJGE CN(Cc1ccc(Br)s1)C[C@@H](Br)COCc1ccccc1 1916350237 XUEZHRHEFABSLJ-CQSZACIVSA-N 433.209 4.923 50 10 IJGE ClCc1ccn(-c2cc(Br)c(Br)c(Br)c2)n1 1938594639 SDDNKCHWTCOKKE-UHFFFAOYSA-N 429.337 4.899 50 10 IJGE BrC[C@]1(Cc2ccc(Br)cc2Br)CCCOC1 1943848090 NXSUWYDZRUJSHC-CYBMUJFWSA-N 426.974 4.946 50 10 IJGE C[C@@H](NCCSSCCNC(=O)OC(C)(C)C)c1ccc(Br)o1 1985350235 NGFMSCZHSPGBNU-LLVKDONJSA-N 425.414 4.599 50 10 IJGE CN(CCCCCBr)C(=O)c1cccc(Br)c1Br 2031486976 PFJVDHBBUZIOKS-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE CSCC[C@@H](Cl)CCNC(=O)c1csc(Br)c1Br 2032958449 DMFURDGHFILCQH-ZETCQYMHSA-N 435.634 4.754 50 10 IJGE CC[C@]1([C@@H](Br)c2cc(I)cc3c2OCC3)CCCO1 2090698401 YMZIRXDBQBKKNP-LSDHHAIUSA-N 437.115 4.621 50 10 IJGE Fc1cc2c(cc1Br)nc(CCCl)n2[C@]12C[C@@H]1CN(Cc1ccccc1)C2 2155862866 KJUBBHIHJQHHNZ-VFNWGFHPSA-N 448.767 4.950 50 10 IJGE O=C(c1cc(Cl)ccc1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Br)C2 2190678752 NEOMXLWGRCMKHS-MHNYQROPSA-N 425.523 4.581 50 10 IJGE COc1ccc(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)c(CBr)c1 2235970541 QVTRNWZLIMPONP-FPOVZHCZSA-N 429.402 4.939 50 10 IJGE O=C(NCC1(CCl)CC(F)(F)C1)c1cc(Br)sc1Br 2266913153 FABSNDWVUSGUKO-UHFFFAOYSA-N 437.531 4.657 50 10 IJGE CS(=O)(=O)c1csc([C@H](Cl)c2ccc(Cl)c(I)c2)c1 2268288259 YKSIVFBWTRABJW-GFCCVEGCSA-N 447.146 4.738 50 10 IJGE N#CC(=Cc1ccc(-c2cccc(C(=O)O)c2)o1)c1nc2cc(Br)cnc2[nH]1 2294953956 LXMWWSMGNHKVET-UHFFFAOYSA-N 435.237 4.743 50 10 IJGE C[C@H](Cl)C(=O)N1CCC(c2nc(N(C)C)ncc2-c2ccc(C(F)(F)F)cc2)CC1 2296572540 NMSKKXYGKTVZMI-ZDUSSCGKSA-N 440.897 4.562 50 10 IJGE CN[C@@H](c1c(Br)cc(C)c(Br)c1C)[C@@H]1C[C@@H]1Br 2298079268 ZGQHTYQVBPUNJZ-VYUIOLGVSA-N 425.990 4.872 50 10 IJGE CC1(C)[C@H](Cl)C[C@H]1OCc1cc(I)ccc1Br 2302815196 XMOREWVHGHYMKW-VXGBXAGGSA-N 429.523 4.976 50 10 IJGE C[C@H](Br)[C@@H]1CCN(Cc2cc(I)ccc2Cl)C1 2307315740 KKYICNWGSLRSQZ-VHSXEESVSA-N 428.539 4.550 50 10 IJGE BrC[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(Br)cc1Br 2309694135 VKWFBCZEBNKPIY-SUHUHFCYSA-N 438.001 4.959 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2cccnc2)C(=O)C1=Cc1ccc(-c2ccc(Cl)cc2)o1 2314617927 DESDBGWVJBBPID-UHFFFAOYSA-N 429.863 4.787 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cc(Cl)cc(F)c1F 2320354257 IOYNWPQRGISVSO-CQSZACIVSA-N 432.692 4.718 50 10 IJGE CC1(C)CC(CBr)(CN2CC=CCC23CN(C(=O)OCc2ccccc2)C3)C1 2321759275 QDYPEHHTDQPWOK-UHFFFAOYSA-N 447.417 4.841 50 10 IJGE C[C@H](NCc1ccc(I)c(Br)c1)[C@H]1CCC[C@H]1Cl 2325203710 ICZWEOLJISFWKB-UFGOTCBOSA-N 442.566 4.939 50 10 IJGE BrCC1(Cc2ncc(I)cn2)CC2(CCCCC2)C1 2353312132 TURLZNKURXUHLY-UHFFFAOYSA-N 435.147 4.749 50 10 IJGE FC(F)(F)c1csc(CNCC(F)(F)C(F)(F)CI)c1 2361678598 BVEONLSCHBAESZ-UHFFFAOYSA-N 435.146 4.562 50 10 IJGE CCOc1ccc(NC(=O)[C@@H](c2ccccn2)N(C(=O)CCl)c2ccc(F)cc2)cc1 4789170 BPYQLEMEXSARLO-JOCHJYFZSA-N 441.890 4.571 50 10 IJGE Cc1ccc(Br)c(-c2c(C)sc3nc(CCBr)[nH]c(=O)c23)c1 36306295 DCKTWHDHSDQESV-UHFFFAOYSA-N 442.176 4.968 50 10 IJGE Cc1ccccc1Nc1ncnc(NNC(=O)c2ccc(Cl)cc2Cl)c1[N+](=O)[O-] 40648037 BIAMWOHBQJWPEJ-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE Cc1c(C(=O)Nc2ccc(Oc3ccccc3)cc2)oc2c1/C(=N\NC(N)=O)CC(C)(C)C2 101110150 RHEJPQGXLOGBAR-USHMODERSA-N 446.507 4.977 50 10 IJGE Cc1nn(C)c(CC(CBr)(CBr)CC(C)C)c1Br 118669972 BGBPTRHSXMIMLU-UHFFFAOYSA-N 445.037 4.856 50 10 IJGE BrCc1c(Oc2ccccc2I)nc2sccn12 218229473 DOADTZODXYWEHG-UHFFFAOYSA-N 435.084 4.688 50 10 IJGE Cc1cccc([C@H](Br)c2ccc3[nH]c(=O)oc3c2)c1I 236010566 PFBPQKZYMDHKLG-CYBMUJFWSA-N 444.066 4.518 50 10 IJGE COc1ccccc1C=NNC(=O)c1cc(Br)ccc1OCc1ccccc1 254744943 IPLCHBWGCVQJGI-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE C[C@H]1CN(c2ccc([N+](=O)[O-])c(CBr)c2)[C@H](C)[C@@H](C)N1Cc1ccccc1 404289076 UCIWFFUQEFYXSY-GVDBMIGSSA-N 432.362 4.977 50 10 IJGE O=C(N[C@H]1CCC[C@@H](Br)C1)c1cc(Br)sc1Br 694585370 CPTAXKDTGFKHPI-RQJHMYQMSA-N 446.002 4.709 50 10 IJGE CC(C)C[C@@H](Br)CNC(=O)c1scc(Br)c1Br 705400641 NMVYNWBRPJZHQU-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE C[C@@H](Br)CCN(C)C(=O)c1scc(Br)c1Br 705509462 DESCZGFDGTVPHF-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE C[C@]1(CBr)CCCN1Cc1cc(Cl)ccc1I 723029395 YZCVORPSBUDZDG-CYBMUJFWSA-N 428.539 4.694 50 10 IJGE COc1cccc(-c2ccc(CNC(=O)NNC(=O)Nc3ccc(C)cc3Cl)cc2)c1 745874877 GPIMMKDZAFWDQN-UHFFFAOYSA-N 438.915 4.860 50 10 IJGE Cc1cc2cc(NC(=O)NNC(=O)c3ccccc3OCc3ccc(F)cc3)ccc2[nH]1 756393845 VHWOOBATHXWLNJ-UHFFFAOYSA-N 432.455 4.661 50 10 IJGE COc1cc(F)cc(NNC(=O)c2cc(Oc3cccc(Br)c3)ccn2)c1 762554653 BKAVNEUWUHJSLI-UHFFFAOYSA-N 432.249 4.541 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)C(C)(C)c1ccccc1 764975351 BSVWVUBJBWTNLG-LCMCWVSWSA-N 437.547 4.853 50 10 IJGE CC(C)c1ccc([C@@H](NC(=O)NNC(=O)COc2ccccc2F)c2cccs2)cc1 913627936 HHBPOTIOVKZPEO-JOCHJYFZSA-N 441.528 4.509 50 10 IJGE COc1ccc(C(=O)NN=C/C=C(/C)CCC=C(C)C)cc1I 1084028549 FKNXGOPXHPSHSN-NYWKFCTQSA-N 426.298 4.708 50 10 IJGE CCc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCN(c4ccccc4)CC3)c2C)cc1 1084152688 AOPVCDQWSMDODF-NCELDCMTSA-N 438.575 4.912 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 1640943398 QQICJOFATZNPIE-UHFFFAOYSA-N 432.465 4.701 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(F)cc2)CCC3)cc1 1772744889 LZJWBQZKWICEHP-UHFFFAOYSA-N 434.467 4.979 50 10 IJGE CCc1nn(-c2ccc(Br)cc2)c2c1[C@H](c1ccc(C)cc1)C(C#N)=C(N)O2 1865685118 DDXWJSCQELPEJL-LJQANCHMSA-N 435.325 4.724 50 10 IJGE CCCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@H](c1cccnc1)C(C#N)=C(N)O2 1865700177 MKFVCDAXCPQEBW-LJQANCHMSA-N 440.334 4.804 50 10 IJGE C[C@H](/C(O)=C(\C#N)c1nc(-c2ccc(Cl)cc2)cs1)N1C(=O)c2ccccc2C1=O 1872748465 YNSALCSKHXKXSQ-JFLJVCDGSA-N 435.892 4.941 50 10 IJGE CN(C[C@@H]1C[C@@H]1Br)c1cc(Br)cc(F)c1CBr 1910159072 FMWYMEJIVKHTTO-XVKPBYJWSA-N 429.953 4.703 50 10 IJGE CCn1nc(C)c(Br)c1CN(Cc1ccccc1)[C@@H](C)CBr 1914372043 CWDNIBHGVRCUFH-ZDUSSCGKSA-N 429.200 4.760 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(OC)c(OC)c1OC 1915097983 AYRHIEYBDXSJCT-MRXNPFEDSA-N 436.346 4.528 50 10 IJGE CC(C)(C)OC(=O)N[C@H](Cc1ccc(Br)cc1)[C@H](F)CBr 1951578144 VHJJOQPSOWWTCM-CHWSQXEVSA-N 425.136 4.618 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCC[C@H](CI)O2)[C@@H]2CCCC[C@@H]21 1984438290 BKAJCQLHBOTHIY-ZXFNITATSA-N 435.346 4.539 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CC[C@@]23CCC[C@H](CI)O3)C1 1986986359 QRUAJJYWYACJHK-JLSDUUJJSA-N 435.346 4.540 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@H](Br)C(F)(F)F)C2(CCCCC2)C1 2044696193 JVJVZFBPWCWNTM-STQMWFEESA-N 429.321 4.614 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CCCC[C@@H](Br)C1 2050104817 NMVSAWXZIGVTGK-SECBINFHSA-N 439.973 4.601 50 10 IJGE FC(F)Oc1c(I)ccc(CBr)c1OC(F)(F)F 2060216426 SFCFDVONWDIPHS-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE CC(C)(C)OC(=O)NCC[S@](=O)(=NCC1(CBr)CCC1)c1ccccc1 2107390308 DDDHYLUQYIRABE-AREMUKBSSA-N 445.423 4.603 50 10 IJGE O=C(NC1(CBr)CC2(CCC2)C1)c1cc(Br)c(Cl)s1 2115939262 BUEXNPKYJUAYCF-UHFFFAOYSA-N 427.589 4.992 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2C1[C@@H]2CN(Cc3ccccc3)C[C@@H]12 2153115063 VBMVDWJYWWQETL-HZPDHXFCSA-N 445.792 4.586 50 10 IJGE CC(C)(C)C[C@@H](CCl)CNC(=O)c1cc(Cl)ccc1I 2156327649 ZMRFCHBDHKCEIE-JTQLQIEISA-N 428.141 4.966 50 10 IJGE Cc1cc(Br)c(C(=O)N(C)[C@@H](CCBr)C(F)F)cc1Cl 2178508996 BPMJBITYSNLLIQ-NSHDSACASA-N 433.518 4.902 50 10 IJGE Cc1csc(C(=O)NC[C@]2(CBr)C[C@H]2C(F)(F)F)c1Br 2192583151 BLHMVNOUWBUIRA-RDDDGLTNSA-N 435.103 4.512 50 10 IJGE C[C@H](Br)CN(Cc1sccc1I)CC(C)(C)C 2301077138 UDEPCVZRBOSPFB-JTQLQIEISA-N 430.193 4.984 50 10 IJGE CCN(C)C[C@@H](Br)CCc1cc(I)ccc1Cl 2307330955 TXMIPMKVUJDNDP-NSHDSACASA-N 430.555 4.592 50 10 IJGE Clc1ccc(CN2C[C@H]3[C@H](Br)CC[C@H]3C2)cc1I 2315552000 YHFUGLYPNLPBCG-QJPTWQEYSA-N 440.550 4.550 50 10 IJGE COc1cc(C=C(C#N)c2cccc(Cl)c2)ccc1OC(=O)CNC(=O)c1ccccc1 2320506983 VYYMDZAHIXIFOD-UHFFFAOYSA-N 446.890 4.748 50 10 IJGE CC1(C)[C@H](CCl)CCN1Cc1ccc(I)c(Br)c1 2325206856 LIAJZADZSHGYRG-NSHDSACASA-N 442.566 4.893 50 10 IJGE O=S1(=O)CC[C@H](C(CBr)(CBr)CC2CCCCCC2)C1 2364426295 GNSWJGLDWOOYRC-AWEZNQCLSA-N 430.246 4.558 50 10 IJGE O=C(N[C@@H](CCCl)C1CCCC1)c1ccc(Cl)cc1I 2365589531 WHGGVIUABNZAQD-AWEZNQCLSA-N 426.125 4.862 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCc2ccccc2N(C[C@@]2(CBr)CC2(F)F)C1 2379985832 LMFGJUBIVXKWKE-BEFAXECRSA-N 445.348 4.753 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C3N=C(N)c4ccccc4N3C3=C2C(=O)CC(C)(C)C3)cc1 3654533 SQNIBTPUSFZKDO-QHCPKHFHSA-N 438.531 4.786 50 10 IJGE CCc1ccc(OCC(=O)N/N=C/c2cccc(C(F)(F)F)c2)c(Br)c1 14017334 GBMYVARLQRGHAR-AUEPDCJTSA-N 429.236 4.559 50 10 IJGE CCCCCOc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2C(=O)OCC)cc1OC 34881065 UGXCNGXNEBVGES-CYVLTUHYSA-N 436.508 4.987 50 10 IJGE C[C@@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccc(F)cc1 38652793 UUCIQEJGHDOMEW-QKFKETGDSA-N 448.425 4.556 50 10 IJGE Cc1cc(C)cc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)COc2ccccc2)CCC3)c1 40815996 RQGOAHBSJBOYNH-SGWCAAJKSA-N 445.519 4.693 50 10 IJGE Cc1cc(OCC(=O)N/N=C/c2cccc(Cl)c2)c(Br)c(C)c1Cl 40950673 MORXTUNFMNJOSO-ODCIPOBUSA-N 430.129 4.902 50 10 IJGE CCOc1cc(/C=N\NC(=O)Cc2ccc(O)cc2)ccc1OCc1ccccc1Cl 169901405 RWLNJJWGBZSCGG-YSMPRRRNSA-N 438.911 4.716 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)N/C=C(/C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 217234156 HWJLABUHHZEJFW-QAALXFNPSA-N 428.876 4.652 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2cccc(NC(=O)c3ccccc3F)c2)cc1 254866534 LDXGCGMHCIGIAL-UHFFFAOYSA-N 432.499 4.688 50 10 IJGE C[C@@H](Br)CN(C(=O)c1cc(Br)ccc1Br)C1CC1 691366107 SDGDOTZUZUTGNT-MRVPVSSYSA-N 439.973 4.600 50 10 IJGE COc1ccc(Cl)cc1[C@@H](CC(C)C)NC(=O)NNC(=O)c1cccc2cccnc12 738467735 KLUXFLYDOXDDJZ-LJQANCHMSA-N 440.931 4.628 50 10 IJGE COc1ccc(-c2cc(C(=O)NN=C3CCC[C@@H](OC)C3)c3ccccc3n2)cc1OC 794478947 BKJABHNNYUNUKX-GOSISDBHSA-N 433.508 4.594 50 10 IJGE Cc1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1OCC1CCOCC1 799400524 IIACBKWJWVZZJI-UHFFFAOYSA-N 448.445 4.840 50 10 IJGE CC(C)n1ncc2c(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)cc(C3CC3)nc21 799750673 CCNMFCHCEOJLDE-UHFFFAOYSA-N 428.418 4.537 50 10 IJGE C=CCOc1ccccc1CN(C(=O)/C(C#N)=C\c1cnn(C)c1)c1ccc(C)c(C)c1 1627425849 QQBABQWMCXTBOX-UCQKPKSFSA-N 426.520 4.742 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3-c2ccccn2)cc1 1865709045 MDUHYAKDVUPONL-QHCPKHFHSA-N 449.514 4.723 50 10 IJGE CCc1ccc(-c2csc(/C(C#N)=C(\O)CCN3C(=O)c4ccccc4C3=O)n2)cc1 1872744586 ZCQUMOMMVCKXOI-VZCXRCSSSA-N 429.501 4.851 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCN(Cc2ccccc2)CC1(C)C 1880767447 PLDOIBADXOSTDM-ZWKOTPCHSA-N 425.411 4.823 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)c1ccccc1S(=O)(=O)C(F)(F)F 1914352232 DJNUBIQWFPGSOY-ZDUSSCGKSA-N 436.293 4.770 50 10 IJGE ClCc1cn(-c2cc(Br)c(Br)c(Br)c2)cn1 1938594892 VVJPEPNHNZPFSS-UHFFFAOYSA-N 429.337 4.899 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CC12CCC1(CC2)CC[C@](C)(CI)O1 1996430084 GSEVDOPMWRJWMK-BYXNGTQDSA-N 449.373 4.834 50 10 IJGE CSCC[C@H](Cl)CCNc1ncc(I)cc1Br 2015768781 XWASQSSMRDWRKX-MRVPVSSYSA-N 449.583 4.611 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@H]1CN(C[C@H](Br)C(F)(F)F)C1CC1 2044702025 XTIZRVSXWYNWLK-KBPBESRZSA-N 429.321 4.566 50 10 IJGE CCC[C@H](Cl)c1cn(-c2ccc(Br)c(I)c2)nn1 2057420819 JOTMLFMMAPIUDG-JTQLQIEISA-N 440.510 4.714 50 10 IJGE Cc1nn(C)c(Br)c1[C@@H](Br)Cc1cccc(Br)c1 2065885370 CWCGGJZSHYTVTA-NSHDSACASA-N 436.973 4.932 50 10 IJGE Clc1cc(CN2[C@H]3CC[C@@H]2C[C@@H](Br)C3)ccc1I 2086657323 DFNNPLMZBKKNLV-CNDDSTCGSA-N 440.550 4.835 50 10 IJGE C[C@H](CCCCCBr)NC(=O)c1cccc(F)c1I 2117888120 SMHVRLPGMATNAY-SNVBAGLBSA-N 442.110 4.504 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@@H]1CCCCN1C[C@@H](CBr)C1CCC1 2128719415 FCLCXFSOVAOODS-CVEARBPZSA-N 439.385 4.812 50 10 IJGE C[C@](CI)(O[C@@H]1[C@H]2C[C@H]2[C@H]2C[C@H]21)c1ccccc1Br 2143311169 LGJJUUYJYDHIPJ-MRIUDHDLSA-N 433.127 4.770 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@@H]2CCCN(C[C@H](CBr)c3ccccc3)C2)C1 2163064194 TVDKFJRHADCZIV-MOPGFXCFSA-N 437.422 4.744 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)c2ccc(CBr)cc2)CC1(C)C 2172476622 SGVRNSHCWCEAMV-INIZCTEOSA-N 439.394 4.737 50 10 IJGE F[C@H]1C[C@H](Br)CN(Cc2ccc(Br)cc2Br)C1 2213901140 PRGXSFMUPFEPRX-QWRGUYRKSA-N 429.953 4.519 50 10 IJGE CC[C@@H](Br)CN(CC)C(=O)c1ccc(Cl)c(I)c1 2256384748 GWJNPKWPCJSOBV-SNVBAGLBSA-N 444.538 4.580 50 10 IJGE CN(C(=O)c1scc(Br)c1Cl)[C@@H](CCBr)C(F)(F)F 2264515632 SEKLHBQACVJEOB-LURJTMIESA-N 443.510 4.952 50 10 IJGE FC(F)C1(CBr)CCN(Cc2ccc(I)cc2)CC1 2274147502 AMFKRYCBOGKMSY-UHFFFAOYSA-N 444.101 4.533 50 10 IJGE CC(C)(C)OC(=O)N1CCC(C2CCN(CC3(CBr)CC(F)C3)CC2)CC1 2280360773 WLJZENAJWNXOTN-UHFFFAOYSA-N 447.433 4.859 50 10 IJGE Cc1ccc(-n2c(C)cc(C=C(C#N)C(=O)N3CCN(c4ccccc4)CC3)c2C)cc1C 2313545860 KRGQLKWFDNRARI-UHFFFAOYSA-N 438.575 4.967 50 10 IJGE FC1(F)CC[C@@H]1CO[C@H](CI)c1ccccc1Br 2313738097 WYJWAKBSWKZMPU-BXKDBHETSA-N 431.058 4.987 50 10 IJGE C=CC[C@](C)(CCl)CNCc1ccc(I)c(Br)c1 2325212758 PZEPHAYYZYCQHQ-CQSZACIVSA-N 442.566 4.965 50 10 IJGE C[C@@H]1CCN(Cc2cc(I)ccc2Cl)C[C@H]1CBr 2327398421 DIVZJEZNVMTGFX-ZYHUDNBSSA-N 442.566 4.798 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1CN(CC1CC1)C[C@@]1(CBr)CC1(F)F 2351888912 LTFHGVBNERIYBK-YJBOKZPZSA-N 437.369 4.518 50 10 IJGE BrC[C@@]1(Cc2ncc(I)cn2)CCCCC12CCC2 2353312338 WAHZGCGASFVQMK-HNNXBMFYSA-N 435.147 4.749 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CC[C@H]2[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]32)C1 2371133524 NZYCJPFZSKPZJN-XDNAFOTISA-N 441.454 4.765 50 10 IJGE Cc1ccc(NC(=O)CCC(=O)N/N=C/c2cccc(OCc3ccccc3)c2)cc1C 12581158 CALOWIUPLBRCJG-WPWMEQJKSA-N 429.520 4.751 50 10 IJGE Cc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3ccc(F)cc3F)c(C)c21 40811563 ALECMWMWNWLSSX-TURZUDJPSA-N 437.446 4.897 50 10 IJGE COc1cc(CBr)c([N+](=O)[O-])cc1OCc1sccc1Br 43676027 TTXMBCZELAILJK-UHFFFAOYSA-N 437.109 4.901 50 10 IJGE Cc1cccc(C)c1OCC(=O)N/N=C/c1cc(/N=N\c2ccc([N+](=O)[O-])cc2)ccc1O 106094745 QQOPQMMKWLTBSG-BCIOHFFLSA-N 447.451 4.862 50 10 IJGE COc1cc(Cl)c([C@@H](Br)c2cnn(C)c2Br)cc1Cl 379203145 IWOVARIZPQZCLM-LLVKDONJSA-N 428.939 4.982 50 10 IJGE Br[C@@H](CC[C@H]1CCCO1)c1cc(I)cc2c1OCC2 388617659 DZGBRUXYDROHIO-OCCSQVGLSA-N 437.115 4.621 50 10 IJGE CC[C@@H](Cl)CCCNS(=O)(=O)c1cc(Br)c(C)cc1Br 398537605 DSFYURZZFOHFKH-SNVBAGLBSA-N 447.620 4.596 50 10 IJGE FC(F)(F)c1c(CBr)ccc(Br)c1I 575691797 OYPJBZLYYDPSHS-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE Cn1cc(Br)c([C@H](Br)c2cc(F)c(Br)cc2F)n1 693105729 DHGNYZPAGMSAQC-SNVBAGLBSA-N 444.899 4.708 50 10 IJGE C[C@@H]1CN(Cc2cc(Cl)ccc2I)C[C@]1(C)CBr 694632308 LCOZJIGOVRVBRW-YGRLFVJLSA-N 442.566 4.798 50 10 IJGE Clc1cccc(C(CBr)(CBr)CCO[C@@H]2CCOC2)c1 724985514 NEEZRKNEMKWIPZ-CQSZACIVSA-N 426.576 4.563 50 10 IJGE C[C@@H]1CC(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)C[C@H](C)C1 739653733 DMBPIKDKWOKRRL-HMXIJSGCSA-N 435.959 4.965 50 10 IJGE Cc1cc(C(=O)NNc2ccc(-c3ccccc3)nn2)ccc1NC(=O)c1cccs1 760168345 VWZHGLVJHZINSO-UHFFFAOYSA-N 429.505 4.523 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N[C@@H]2CCCC(F)(F)C2)c(-c2ccc(Cl)cc2)n1 769341242 CSVKHZCYEBVYJX-JVCXIRSZSA-N 443.885 4.718 50 10 IJGE C=CCOc1ccc(CC(=O)NNc2cc(C(F)(F)F)ccc2Br)cc1 1142347543 PZTQYIQFCMMDIF-UHFFFAOYSA-N 429.236 4.719 50 10 IJGE Cc1sc2nc(CS[C@H](C)C(=O)NNc3cc(F)cc(Cl)c3)nc(O)c2c1C 1300533179 OLTSYLCJEKWQJE-SNVBAGLBSA-N 440.953 4.571 50 10 IJGE CC(=O)CCc1ccc(OCc2cccc(C(=O)NNc3nc4cccnc4s3)c2)cc1 1453928904 AEGKAYBDASCNKG-UHFFFAOYSA-N 446.532 4.549 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CC)nn2-c1cccc(Cl)c1 1865690944 FPDGAUNNBGMPMB-NRFANRHFSA-N 432.911 4.871 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)N/N=C\c1ccc2c(c1)OCCO2 1865762434 FYTNTLDPGUTKLG-ROTLSHHCSA-N 442.302 4.899 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2C[C@@H]2c2ccccc2)cc1 1867059927 YMMWUPFIKJPLJD-SMIHKQSGSA-N 441.556 4.729 50 10 IJGE CCCCOc1ccc(/C=N/NC(=O)CCCCCNC(=O)OC(C)(C)C)cc1OCC 1873795408 HXVLNESENXBYRG-NLRVBDNBSA-N 449.592 4.799 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)c1c(F)ccc(NC(=O)OC(C)(C)C)c1F 1887824075 VSPYQHNOJGLZNF-XYPYZODXSA-N 433.293 4.557 50 10 IJGE CCCC(CBr)(CCC)Cn1ccnc1CCN1C(=O)c2ccccc2C1=O 1913015629 IBJCKTSBFDNSAI-UHFFFAOYSA-N 446.389 4.703 50 10 IJGE CCn1ncc(Br)c1CN(Cc1ccccc1)C1(CBr)CCC1 1915756251 WDJIMJLZQYOJIF-UHFFFAOYSA-N 441.211 4.985 50 10 IJGE CCN(C)C[C@@H](Br)CCc1cc(Br)ccc1Br 2006499664 KKHUHPOVENOVFB-LBPRGKRZSA-N 428.006 4.859 50 10 IJGE O=C(NC[C@H]1CCC[C@@H]1Br)c1cccc(Br)c1Br 2031487518 VMCDYFOMZHTKHW-SCZZXKLOSA-N 439.973 4.505 50 10 IJGE CC(F)(F)C[C@H](CCl)NC(=O)c1csc(Br)c1Br 2050369289 MKGBABYYJZDFHL-RXMQYKEDSA-N 425.520 4.656 50 10 IJGE CC(C)(C)OC(=O)N(C(=O)C(C#N)=Cc1ccccc1)[C@@H](CN)c1cccc(Cl)c1 2077614638 AXMBXFRPRLCSGE-FQEVSTJZSA-N 425.916 4.711 50 10 IJGE CCN(C[C@@H](CBr)c1ccccc1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2106784307 HTOLEKXCQBPEKQ-MOPGFXCFSA-N 425.411 4.887 50 10 IJGE C[C@@H]1C[C@@H](C(F)(F)F)N(CC2(CBr)CCC2)CCN1C(=O)OC(C)(C)C 2121770470 HVFHNMSYOTWRAX-KGLIPLIRSA-N 443.348 4.814 50 10 IJGE Cc1cc(CBr)cnc1N1C[C@]23CCC[C@@]2(CN(Cc2ccccc2)C3)C1 2153340116 AOANREFYVLSPBB-DHIUTWEWSA-N 426.402 4.777 50 10 IJGE Cc1cccc(C(=O)N2CC[C@H](Br)CC23CCC3)c1I 2169888649 PLZYJHXZXIILNK-LBPRGKRZSA-N 448.142 4.522 50 10 IJGE O=C(c1c(Br)cccc1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Cl)C2 2190688640 XUCAGVSYORYBCE-IRDCDUOOSA-N 425.523 4.534 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)C12CCC(CC1)OC2 2192888354 LZBWBVJPBQBNFW-DSSZZKGTSA-N 449.126 4.621 50 10 IJGE CN(CCCCCI)[C@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2211188414 ZIVLWOFUJXFYCT-CVEARBPZSA-N 438.394 4.607 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)C1[C@H]2COC[C@H]12 2213491742 ICCPIPVVMUGZFA-WSFZALMZSA-N 428.921 4.679 50 10 IJGE CCOCc1cc(Br)c([C@H](Br)[C@]2(COC)CCCO2)s1 2233033830 RTXRUHFHVVEGFY-UONOGXRCSA-N 428.186 4.679 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1C[C@H](C)[S@](C)=O 2234060240 MEYXQLWPMRXLJQ-VQXVYSPMSA-N 442.604 4.628 50 10 IJGE C[C@H]1[C@@H](Br)C[C@H]2CC[C@H]1N2C(=O)c1scc(Br)c1Cl 2264510441 UIWYLGARXOLUCY-PYHGXSLLSA-N 427.589 4.941 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1cc(F)c(Br)cc1Cl 2282973876 DLTNNGZXFNHPBB-MRVPVSSYSA-N 447.595 4.878 50 10 IJGE N#CC(=Cc1cccs1)C(=O)Nc1ccc(NC(=O)C(C#N)=Cc2cccs2)cc1 2297307122 SNWRPQHDXZMSGS-UHFFFAOYSA-N 430.514 4.901 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1Cc1ccc(Cl)cc1I 2302326756 SPDNBSMZWNFVBW-GXSJLCMTSA-N 428.539 4.692 50 10 IJGE CC[C@@H]1[C@@H](CBr)CCN1Cc1ccc(Cl)c(I)c1 2315551747 VMYQSXYYQNUGBB-BXUZGUMPSA-N 442.566 4.940 50 10 IJGE COc1c(Br)cc(C)c([C@@H](O)[C@H]2C[C@H](Br)C2)c1Br 2317420915 USCQJUSIQDQCSQ-UBJUHAIHSA-N 442.973 4.736 50 10 IJGE CC[C@H]1CN(Cc2ccc(Cl)cc2I)C[C@H]1CBr 2318542324 WKBVQODTUSQORY-CMPLNLGQSA-N 442.566 4.798 50 10 IJGE C[C@H]1C[C@H](Br)[C@H](C)CN1Cc1ccc(Cl)cc1I 2318557842 OXDIJHNSAVKFTR-NRUUGDAUSA-N 442.566 4.938 50 10 IJGE O=C(NN=Cc1cccc(Br)c1)c1ccc2nc(Cc3ccccc3)[nH]c2c1 2323725305 CUPDHURJLDXPOZ-UHFFFAOYSA-N 433.309 4.680 50 10 IJGE C[C@@H](C(O)=C(C#N)c1nc(-c2c[nH]c3ccccc23)cs1)N1C(=O)c2ccccc2C1=O 2331346614 FPBRFBVTFLOQAA-ZDUSSCGKSA-N 440.484 4.769 50 10 IJGE O=C(Nc1ccc(CBr)c(F)c1)c1cccc(I)c1 2341920180 OWVXATKBGFKLTJ-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CCCC[C@@]3(NC(=O)OC(C)(C)C)C2)C1 2345004349 JKZVVCRQWXTMAL-IIBYNOLFSA-N 429.443 4.957 50 10 IJGE FC(F)(F)[C@@H]1C[C@@H](Br)CCN1Cc1ncc(Br)cc1Cl 2361429918 QROKXFAMQNEEIW-CPCISQLKSA-N 436.497 4.788 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C[C@](C)(CBr)C(C)(C)C)C2(CCOCC2)C1 2380203945 VRVGGLRCUFBMDL-UZLBHIALSA-N 447.458 4.582 50 10 IJGE C/C(=N\NC(=O)COc1ccc(C(C)(C)C)cc1Br)c1cccc([N+](=O)[O-])c1 12403455 WTFZVJKRLZHRDU-LPYMAVHISA-N 448.317 4.574 50 10 IJGE Cc1cccc(COc2cccc(/C=N/NC(=O)CSc3nc4ccccc4[nH]3)c2)c1 32520547 ZWYHMKQZFHFHLK-AFUMVMLFSA-N 430.533 4.693 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)N1CCC(Cc3ccccc3)CC1)[C@H](Br)C2=O 39752993 NPBUGTHCTPFBBA-YSZBQJHXSA-N 432.402 4.627 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(C)c1/C=N/NC(=O)[C@H](C)SCc1ccccc1 59153559 LVKPTJYJHBCAJH-PYGAFPFSSA-N 441.000 4.974 50 10 IJGE COc1ccc(OC)c([C@H](Br)c2csc(I)c2)c1 124406498 JNIVVNPIUVXCLT-CYBMUJFWSA-N 439.112 4.854 50 10 IJGE CCCCCCCCCOc1ccc(/C=N\NC(=O)c2cccn(C)c2=O)c(Cl)c1 169918754 VSTYEJRDMVFWPJ-UQQQWYQISA-N 431.964 4.932 50 10 IJGE CCCCN1C(=O)C(C#N)=C(C)/C(=C/c2cn(-c3ccccc3)nc2-c2ccccc2)C1=O 214223836 RZIGKISZBZJIMS-KQWNVCNZSA-N 436.515 4.932 50 10 IJGE CC[C@H](N/C=C(/C#N)C(=O)N[C@@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 217171587 DVGWFEJTONCTNB-QBGPYYQXSA-N 447.579 4.908 50 10 IJGE C[C@H](Br)C1CCN(c2ncc(Br)cc2Br)CC1 235468345 IUHBYAMAADTJSK-QMMMGPOBSA-N 426.978 4.606 50 10 IJGE O=C(COc1ccc(F)cc1)NN=Cc1ccc(OC(=O)c2cccc3ccccc23)cc1 254417566 VWRAUKCLKBWOPI-UHFFFAOYSA-N 442.446 4.727 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3cccc(C)c3)n2-c2ccccc2)cc1 254616688 BGKCWHIRCMAREG-UHFFFAOYSA-N 441.560 4.794 50 10 IJGE Cc1ccccc1NCC(=O)NN=Cc1cc([N+](=O)[O-])ccc1N(CC(C)C)CC(C)C 254868583 OOEWPFNYHCEHND-UHFFFAOYSA-N 439.560 4.584 50 10 IJGE C[C@@H](Br)C1CCN(Cc2cc(Cl)ccc2I)CC1 405307852 RMJPSLUPQXKHRN-SNVBAGLBSA-N 442.566 4.940 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccccc1[C@H]1CNCCN1S(=O)(=O)c1ccccc1 616638968 MJZJATDURHVDIE-JOCHJYFZSA-N 446.689 4.544 50 10 IJGE C[C@H]1CC[C@@H](CBr)CN1Cc1cc(Cl)ccc1I 688745358 GYBYZONDDKJOIC-QWRGUYRKSA-N 442.566 4.940 50 10 IJGE COc1cccc(Nc2ccccc2C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)c1 736694220 QUSJFWUFOWVXQL-UHFFFAOYSA-N 440.507 4.665 50 10 IJGE COc1ccccc1Nc1nc2sc(C(=O)NNc3cccc([N+](=O)[O-])c3)cc2s1 749259813 HLQDFJVPFDWNSU-UHFFFAOYSA-N 441.494 4.775 50 10 IJGE COCCn1c(C)cc(/C=C(/C#N)C(=O)NCc2cccc(COc3ccccc3)c2)c1C 917865614 FMKIZEYDTRDKNU-XYGWBWBKSA-N 443.547 4.554 50 10 IJGE CC(=O)Nc1ccc(C=NNC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)cc1 1083888221 YMRJYMGVSIZYNQ-UHFFFAOYSA-N 429.520 4.500 50 10 IJGE C/C(=C\c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(Br)cc1Cl 1360072277 XZGGAEJXARYFKV-CSKARUKUSA-N 428.113 4.620 50 10 IJGE C/C(=C/C(=O)NNC(=O)Nc1ccc(Br)cc1)c1ccc(C(F)(F)F)cc1 1625974275 OTWYHLVHPQWCHX-KHPPLWFESA-N 442.235 4.724 50 10 IJGE Cc1ccc(CNC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccc(C)c2)CCC3)cc1 1772745177 UPRWZIKQLGBVSP-UHFFFAOYSA-N 429.520 4.605 50 10 IJGE CCc1nn(-c2ccc(Br)cc2)c2c1[C@@H](c1sccc1C)C(C#N)=C(N)O2 1865699036 JCJUNVRJXQHUHJ-INIZCTEOSA-N 441.354 4.785 50 10 IJGE Cc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccc(F)cc2)c1 1865710781 IFRQHZDPWTVUQG-QGZVFWFLSA-N 428.389 4.616 50 10 IJGE CCn1cc(/C=C2\Oc3cc(OC(=O)C(Cl)Cl)ccc3C2=O)c2cc(OC)ccc21 1871386518 ZAWOTJXLFFVUES-UWVJOHFNSA-N 446.286 4.995 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CNC1CC1)(CC1CC(Br)C1)C2 1887908054 MVLUGDJDSVBNHX-RLNQZENFSA-N 427.427 4.850 50 10 IJGE O=C(N[C@H]1CC[C@@H](CBr)C1)c1cc(Br)sc1Br 1942368064 OASPATLSFUJWLE-RQJHMYQMSA-N 446.002 4.567 50 10 IJGE BrC[C@H](CC1CC1)NCc1cccc(Br)c1Br 1943882192 FODADLUZYOAROA-NSHDSACASA-N 425.990 4.865 50 10 IJGE CC(C)(C)CN(CCCl)c1ncc(I)cc1Br 2015762995 SGBFPKOXFVKTQT-UHFFFAOYSA-N 431.543 4.540 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCCN1C[C@H](Br)C(F)(F)F 2044701131 GKLSUGOKISPKMK-MCIONIFRSA-N 429.321 4.566 50 10 IJGE O=C(CBr)c1cc(Br)c(OC(F)(F)F)c(C(F)(F)F)c1 2054796398 DWVJUNWDEXDQCF-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE O=C(CBr)c1cc(OC(F)(F)F)cc(C(F)(F)F)c1Br 2054796936 AGZALEWSYKGIBC-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE C[C@H]1OCC[C@@H]1COc1c(Br)cc(Br)cc1CBr 2057465940 VEQMJOAGZTWMGA-RKDXNWHRSA-N 442.973 4.910 50 10 IJGE C[C@@H]1[C@H](C(F)(F)F)N(CC2(CBr)CCCC2)CCN1C(=O)OC(C)(C)C 2115980183 OUGWGLYDARNRRE-ZIAGYGMSSA-N 443.348 4.814 50 10 IJGE C[C@]1(CCOCc2ccccc2)CCN1S(=O)(=O)c1ccc(CCl)cc1Cl 2197756372 VXGDOMKFNVMHNA-HXUWFJFHSA-N 428.381 4.839 50 10 IJGE Fc1ccc2nc(CCl)n(C[C@@]3(Br)CC3(F)F)c2c1Br 2202507234 VKGXGQXKSXLRFB-NSHDSACASA-N 432.465 4.849 50 10 IJGE Cc1cc(C(=O)N2[C@H]3CCC[C@@H](Br)[C@H]2CC3)ccc1I 2207096117 JGMQKRBSHXFLHZ-GZBFAFLISA-N 448.142 4.520 50 10 IJGE Cc1ccc(I)c(C(=O)N[C@H](CBr)CC(C)(C)C)c1 2232158080 JZHLXTUUBPHXGL-NSHDSACASA-N 438.147 4.529 50 10 IJGE CC[C@H]1[C@H](Br)CCN1Cc1cc(Cl)ccc1I 2251035272 FLKYKMQSHTUVPJ-YPMHNXCESA-N 428.539 4.692 50 10 IJGE O=C(Cl)C=Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(I)c1 2293941015 ULPDSXZTMOYICI-UHFFFAOYSA-N 443.624 4.557 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)C=Cc3ccccc3)ccc2[C@H]1c1ccc(F)cc1F 2297718086 DFOGBTCPGTVAAS-XMMPIXPASA-N 430.410 4.802 50 10 IJGE BrC[C@H](NCc1sccc1I)C1CCCCC1 2301073201 GJDXESSWNRIGHC-LBPRGKRZSA-N 428.177 4.786 50 10 IJGE N#CC(=Cc1ccc(OCc2cccc(F)c2)cc1)C(=O)N1CCN(c2ccccc2)CC1 2313565338 SNSCNQQYBBDHHY-UHFFFAOYSA-N 441.506 4.660 50 10 IJGE CCOC(=O)COc1c(Cl)cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)cc1Cl 2313567013 AXAWKEWNZYTTOK-UHFFFAOYSA-N 433.291 4.789 50 10 IJGE C[C@@H](Cl)CCCN(C)C(=O)c1cc(Br)ccc1I 2314575492 NVQXHGBLCNYVHY-SECBINFHSA-N 444.538 4.533 50 10 IJGE CC[C@@H](C)N1C(=O)C(=Cc2ccc(OCc3ccc(C)cc3)c(OC)c2)C(C)=C(C#N)C1=O 2314611564 XHSWDMZBMSMRBQ-GOSISDBHSA-N 444.531 4.973 50 10 IJGE C[C@@H]1CC[C@@H](CBr)CN1Cc1ccc(Cl)c(I)c1 2315551061 LMKNPSMLJDSSOF-PWSUYJOCSA-N 442.566 4.940 50 10 IJGE Clc1ccc(CN2C[C@H]3C[C@H]2CC[C@@H]3Br)c(I)c1 2318528977 KWKJPWAVTNUDTC-RTXFEEFZSA-N 440.550 4.692 50 10 IJGE CCOc1ccc(C(C)=NNC(=O)c2ccc(-c3ccc(OC)c(OC)c3)nc2C)cc1 2321281023 DJHXDTMJCLRKFL-UHFFFAOYSA-N 433.508 4.627 50 10 IJGE COc1cc(C=NNC(=O)Cc2ccc(Cl)cc2)ccc1OCc1ccccc1F 2323351941 ZZIKTKIRYCYDFK-UHFFFAOYSA-N 426.875 4.760 50 10 IJGE CCCOc1c(Cl)cc(C=NNC(=O)c2cc(-c3ccccc3)nc(O)n2)cc1Cl 2323693642 LDUCZULLYKXGFN-UHFFFAOYSA-N 445.306 4.709 50 10 IJGE CC[C@@H](NC=C(C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1ccc2c(c1)CCCC2 2325216876 LQQHYDBZQAUEOC-OAQYLSRUSA-N 434.496 4.569 50 10 IJGE CC(C)C[C@H](CBr)CN=[S@@](C)(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2328519471 SJHQKNVEHKJLPO-TWKFVSLJSA-N 439.460 4.541 50 10 IJGE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1ccc(-c2ccc(C(C)=O)cc2)o1 2328796356 HLXUJJYFYBTRBF-BTYIYWSLSA-N 441.528 4.539 50 10 IJGE C[C@H](CCBr)CCN1C[C@H]2CC(F)(F)CC[C@@]2(NC(=O)OC(C)(C)C)C1 2344056673 DTQJMSBJTXYQFU-IIDMSEBBSA-N 439.385 4.812 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)CCc2ccccc2)cc1Br 14640662 FTWBYFPDKHMNQE-UHFFFAOYSA-N 447.373 4.802 50 10 IJGE Cc1cc(C)cc(Oc2ncnc(NNC(=O)c3cccc4ccccc34)c2[N+](=O)[O-])c1 40582780 MELQHTIRFAZQPP-UHFFFAOYSA-N 429.436 4.704 50 10 IJGE CCc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccc1O)CCC2 40826367 PKBCGRVUQVNLKP-ZXVVBBHZSA-N 431.492 4.579 50 10 IJGE Cc1ccc(Sc2ccc(/C=C(\C#N)C3=NN(c4ccccc4)[C@@H](N)[C@H]3C#N)o2)cc1 59137925 UGDYPXUFXOKCTA-BPGOTMFJSA-N 425.517 4.947 50 10 IJGE COCCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(-c3ccc(Cl)cc3Cl)o2)C1=O 101335695 RZZBIDUQVBJDBM-GZTJUZNOSA-N 445.302 4.882 50 10 IJGE COc1ccc(N/C=C(/C#N)c2nc(-c3cc4ccccc4oc3=O)cs2)cc1OC 102897130 ONYZWKXULUQQSY-QINSGFPZSA-N 431.473 4.910 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@@H]1Cl)c1cc(Br)c(Br)s1 137615491 UGTRSIJUGNRNAL-JQWIXIFHSA-N 435.568 4.908 50 10 IJGE CCN(C[C@@](C)(CI)OCCCC1CC1)C(=O)OC(C)(C)C 711532982 IDAVGJDLIYCSPT-QGZVFWFLSA-N 425.351 4.644 50 10 IJGE Cc1ccc(F)c(NC(=S)NNC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)c1 732681721 IZSKQTZVUHQDTN-UHFFFAOYSA-N 431.439 4.836 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N[C@H](Cc2nccn2C)c2ccccc2)c(C)n1CCC(C)C 744351232 YHZVYQHTPQALRG-HZRUTDPJSA-N 443.595 4.892 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)c1C 779206640 QHIKWUUZJZOSJY-UHFFFAOYSA-N 446.942 4.973 50 10 IJGE CC(C)Oc1cc(Br)cc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1 799750805 HMGZYGYSLTVTBK-UHFFFAOYSA-N 442.235 4.884 50 10 IJGE CC(=O)N(C)c1ccc(CNC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(C)cc3)c2C)cc1 1532492140 JGWLQYLCQMVQPD-IWIPYMOSSA-N 440.547 4.609 50 10 IJGE CCCCOc1ccc(C=NNC(=O)COc2cc(Cl)ccc2Cl)cc1OC 1772754063 BOFHWDALQXINRH-UHFFFAOYSA-N 425.312 4.710 50 10 IJGE CCOc1cc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3CC)ccc1OCc1ccccc1C 1865702966 JQTMDXCRBNJHGF-DEOSSOPVSA-N 444.535 4.716 50 10 IJGE CC[C@@H]1CC[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)CN1C(=O)OC(C)(C)C 1880755236 ORFMABSNMKNPHI-RRFJBIMHSA-N 435.403 4.700 50 10 IJGE CC(C)[C@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1sccc1Br 1915261742 KXENDIZMTOPQEP-HNNXBMFYSA-N 436.824 4.965 50 10 IJGE CC1(C)CC(COC2(CI)CCN(C(=O)OC(C)(C)C)CC2)C1 1989576418 WKVCHJJUGISTJY-UHFFFAOYSA-N 437.362 4.644 50 10 IJGE CN(Cc1cc(Br)ccc1Br)C1CC(CBr)C1 2018085625 REJWLQXTRSZRLS-UHFFFAOYSA-N 425.990 4.817 50 10 IJGE C[C@H](CBr)CCCNC(=O)c1c(Br)cccc1Br 2033096740 ZJMOFBNODOOONT-VIFPVBQESA-N 441.989 4.753 50 10 IJGE CC[C@H](CCCCl)NC(=O)c1cc(I)ccc1Br 2036511011 QEERCASNKZMXRP-SNVBAGLBSA-N 444.538 4.581 50 10 IJGE CC(C)N(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C[C@@H](Br)C(F)(F)F 2044698761 FIDBCPAIWFVBSD-ZIAGYGMSSA-N 431.337 4.812 50 10 IJGE Fc1cccc(F)c1Cn1nc(CCl)c(I)c1C(F)(F)F 2079210849 BZXDDYCLCBBAIO-UHFFFAOYSA-N 436.549 4.572 50 10 IJGE CN(Cc1cccc(NC(=O)[C@H](Br)C2CCCC2)c1)C(=O)OC(C)(C)C 2110721230 HFHUNTHMZOEPSB-QGZVFWFLSA-N 425.367 4.946 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)[C@H](Br)C2CCCC2)CC12CCC2 2176868238 JYILDGBPOCOWTF-NVXWUHKLSA-N 443.426 4.626 50 10 IJGE Cc1c(Cl)cc(CN2C[C@H](CCBr)O[C@H](C)C2)cc1Br 2179379842 CCRXTZGZSFFAMA-MFKMUULPSA-N 425.592 4.785 50 10 IJGE ClCc1nc2cc(Br)cnc2n1C[C@]12CC[C@H]1CN(Cc1ccccc1)C2 2201230064 MALWEPHMZGJDNM-HRAATJIYSA-N 445.792 4.845 50 10 IJGE C[C@]1([C@@H](Br)c2cc(Br)c(Br)cc2F)COCCO1 2218602497 FXUNIPMIFSCJRI-NWDGAFQWSA-N 446.936 4.592 50 10 IJGE Cc1ccc(I)c(C(=O)N2CC[C@H](Br)CC23CCC3)c1 2240924785 NDDVBBLTNMQWAA-LBPRGKRZSA-N 448.142 4.522 50 10 IJGE CC[C@H]1[C@@H](CBr)CCN1C(=O)c1cc(Br)c(F)cc1Cl 2285958889 RRHHDZLSIXRBMQ-OQPBUACISA-N 427.539 4.877 50 10 IJGE CC[C@]1(C)[C@@H](Br)CCN1c1ncc(Br)cc1Br 2299988218 UAOVYLVYUMDXML-CMPLNLGQSA-N 426.978 4.749 50 10 IJGE CC(C)CCOc1ccc(C(=O)NNC(=O)COc2ccc(-c3ccccc3)cc2)cc1 14021882 FDNOITLONAYXLD-UHFFFAOYSA-N 432.520 4.619 50 10 IJGE N#C/C(=C/c1ccccc1OCc1ccc(F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1O 35124590 ALRWVYWPCRCQBT-BOPFTXTBSA-N 433.395 4.564 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4cccc(C)c4)ccc32)cc1 38649214 FKZMJPXHLSHVHR-RUZDIDTESA-N 426.472 4.506 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(OC)cc4)ccc32)cc1 38676793 NZBGXYLZBYDIFD-XMMPIXPASA-N 426.472 4.695 50 10 IJGE CCOc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(F)cc1)CCC2 40811864 JFEOVDFQZIVORJ-TURZUDJPSA-N 449.482 4.849 50 10 IJGE Cc1c(C(=O)N2CCCC2)oc2c1/C(=N/NC(=O)c1ccc(Cl)cc1Cl)CCC2 40813703 XQLDCZZVFVKXBP-LFVJCYFKSA-N 434.323 4.601 50 10 IJGE COc1ccc(/C=N/NC(=O)COc2ccc(-c3ccccc3)cc2Br)cc1 40910469 IATYDYWQIGWGJS-ZVHZXABRSA-N 439.309 4.654 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)/C=C\c4ccccc4)ccc32)c1 205659978 HQNUVXDWHKDHMD-VETRKHTQSA-N 438.483 4.922 50 10 IJGE CC1(C)[C@H]2CC[C@]1(C)C(=NNC(=O)c1ccccc1OCC(=O)Nc1ccccc1F)C2 254738682 JQQARAYVABICFB-IVCQMTBJSA-N 437.515 4.775 50 10 IJGE ClCc1cc2cc(I)c(I)cc2s1 306607949 IQLVBIONRSPDBC-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)c1C 743462564 JSOCEPZATHFBBS-ZWKOTPCHSA-N 428.323 4.709 50 10 IJGE Cc1ccc(S[C@@H](C(=O)NNc2ccc(S(C)(=O)=O)cc2)c2ccccc2)c(C)c1 748147032 KCMAWUCFTWLSLZ-JOCHJYFZSA-N 440.590 4.684 50 10 IJGE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NNc1ccc(OC(F)(F)F)cc1 761596673 WSTUIZUHVZMJFQ-UHFFFAOYSA-N 447.442 4.510 50 10 IJGE CCCOc1c(Cl)cc(C=NNC(=O)c2ccccc2Br)cc1OC 916540480 ZKFWAPAOUPZOKV-UHFFFAOYSA-N 425.710 4.664 50 10 IJGE CCOc1ccc(-n2c(C)cc(C=NNC(=O)C(=O)Nc3ccc(C(C)C)cc3)c2C)cc1 1084020162 QZUIYESVXDXKSL-UHFFFAOYSA-N 446.551 4.705 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1 1290128889 JWJGHIIIMMECPT-HNNXBMFYSA-N 447.560 4.894 50 10 IJGE C#C[C@H](CO)NC(=O)c1cccc(O[Si](C(C)C)(C(C)C)C(C)C)c1OC(F)(F)F 1636624085 WQVMDJRSTYPVRF-MRXNPFEDSA-N 445.554 4.863 50 10 IJGE CCc1ccccc1NC(=O)COc1cccnc1NC(=O)Nc1ccc(SC#N)cc1 1858830353 MTEBNJPIICFKMR-UHFFFAOYSA-N 447.520 4.879 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2cccc(Cl)c2)cc1 1865695107 KEPSPYFOVBKFKI-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE COc1cc(C(=O)N(Cc2ccccc2)C(C)(C)CBr)cc(OC)c1OC 1915766165 WAXLKHBLFMVZSG-UHFFFAOYSA-N 436.346 4.528 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@]23CCC[C@@H](CI)O3)C1 1918346848 NZJDOOKFNPRUBB-QGTPRVQTSA-N 435.346 4.540 50 10 IJGE O=C(N[C@@H](CCBr)C1CC1)c1cc(Br)c(Br)s1 1942802661 FGYGTJBASKCOPN-QMMMGPOBSA-N 446.002 4.567 50 10 IJGE CN(C[C@H](Br)C1CC1)C(=O)c1csc(Br)c1Br 1945190612 QDXHAQQCFULDJR-QMMMGPOBSA-N 446.002 4.519 50 10 IJGE Cl[C@H](c1cc(I)cc2c1OCC2)[C@H]1C[C@@H](Br)C1 2020175871 QFOXKCORBJSSKS-SBMIAAHKSA-N 427.507 4.680 50 10 IJGE COC[C@H](C)OC[C@@H](Br)Cc1c(Br)cccc1Br 2038123958 NNGANZYNVDRZNS-UWVGGRQHSA-N 444.989 4.569 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN(C[C@H](CBr)C2CCC2)C1 2106787293 YOTOJZRMPYNTQL-CEXWTWQISA-N 429.443 4.909 50 10 IJGE ClCc1nc2cncc(Br)c2n1CCc1sccc1Br 2151785174 VTESCTAKCCQUIJ-UHFFFAOYSA-N 435.572 4.999 50 10 IJGE FC(F)(F)OCC1CN(c2c(CBr)ccc(Br)c2Cl)C1 2156324977 YWYCEBIWAYNYKX-UHFFFAOYSA-N 437.481 4.970 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1C[C@]2(CCCCN2C(=O)c2ccc(CBr)cc2)C1 2162878990 NXFHQWZBNVFPSU-UEDWGHLCSA-N 437.378 4.634 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CCC([C@@H](F)CCl)CC1 2163246246 PPNFITOQKNDNEZ-LBPRGKRZSA-N 427.539 4.641 50 10 IJGE CC(C)CN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2167030588 CTECFFVGNHWKQK-ROUUACIJSA-N 445.442 4.824 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)c(Br)c2F)C[C@@H](CCBr)O1 2179383369 SNLCMUWILOPMQA-MWLCHTKSSA-N 429.555 4.616 50 10 IJGE BrCC1(CN2CC[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)CCCCCC1 2185497218 OXODOBMXACLULM-YADHBBJMSA-N 435.450 4.697 50 10 IJGE COCC12CC([C@@H](Br)c3cc(Br)c(Cl)cc3F)(CO1)C2 2206081831 JJMNFYZHLVBMAR-HSBZDZAISA-N 428.523 4.873 50 10 IJGE COc1ccc(C(=O)N(CCCBr)Cc2ccccc2)c(Br)c1 2212712528 QXUROSZCCDAQJZ-UHFFFAOYSA-N 441.163 4.885 50 10 IJGE Cc1sc(C(=O)N2CC[C@H](CBr)C(F)(F)C2)c(Br)c1C 2237629851 NVRLSCSGYGBDPY-SECBINFHSA-N 431.140 4.620 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC2(CCC(Br)CC2)C1 2264502160 UAGRCYHTJAYBFO-UHFFFAOYSA-N 427.589 4.944 50 10 IJGE CC(C)(C)OC(=O)NCc1cccc2c1N(CC1(CBr)CC(F)C1)CCC2 2280359912 QBOYTXAUBNHTCW-UHFFFAOYSA-N 441.385 4.977 50 10 IJGE COc1ccnc(N(C)[C@@H]2C[C@@H]3C[C@@H](OCc4ccccc4)C[C@@H]32)c1CBr 2281103771 SCIZSCMHJYXPHP-HLNWXESRSA-N 431.374 4.805 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)cc1 2294168265 AITNMHLYUTWNNM-UHFFFAOYSA-N 443.503 4.825 50 10 IJGE COc1cc(Br)cc(C=C(C#N)C(=O)Nc2ccc(C)c(Cl)c2)c1OC 2313553049 AKAATFKNFQOOQI-UHFFFAOYSA-N 435.705 4.974 50 10 IJGE N#CC(=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 2313670790 WUYOAOQUNSLKPP-UHFFFAOYSA-N 438.783 4.962 50 10 IJGE Cc1ccccc1NC(=O)C(C#N)=Cc1c(Oc2ccccc2)nc2c(C)cccn2c1=O 2314533497 RKWZINWZRRUTKF-UHFFFAOYSA-N 436.471 4.649 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)C=Cc2ccccc2OCCC)cc1 2314789646 RWLMGFLGYFMJJD-UHFFFAOYSA-N 432.520 4.917 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN(Cc2ccc(Cl)c(I)c2)C1 2315550806 IRCPKPMOCHAPCA-PWSUYJOCSA-N 442.566 4.798 50 10 IJGE COc1ccc(OCC2(CBr)CC(C)(C)C2)cc1I 2345008594 RAOCDOWWIWMPHF-UHFFFAOYSA-N 439.131 4.880 50 10 IJGE CC(C)(C)c1cc(CCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2O)cc(C(C)(C)C)c1O 3112009 JCCLEYGNGCKGJM-AFUMVMLFSA-N 441.528 4.684 50 10 IJGE O=C(NNc1ncnc(Nc2ccc(/N=N/c3ccccc3)cc2)c1[N+](=O)[O-])c1ccco1 40645910 YJZOVSAQDWWEKN-OCEACIFDSA-N 444.411 4.894 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2ccc(Cl)cc2C)c(OCC)c1 40867319 QHQHPYTXHGETHS-GZTJUZNOSA-N 443.883 4.502 50 10 IJGE CCCOc1ccccc1/C=C(\C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1Br 40948948 GLRDWEPKTZBCJP-GXDHUFHOSA-N 430.258 4.692 50 10 IJGE COCCn1c(C)cc(/C=C(/C#N)C(=O)OCc2csc(-c3ccc(C)cc3)n2)c1C 97654773 CSPWCFVSRULLRZ-MTJSOVHGSA-N 435.549 4.834 50 10 IJGE O=C(N/N=C\c1cc(Br)c(O)c(Br)c1)Nc1ccc(Cl)cc1 169940233 WSHJUGSLHCAQEM-WSVATBPTSA-N 447.514 4.726 50 10 IJGE C[C@H]1CCN(C(=O)c2cc(Br)c(Br)s2)[C@H]1CBr 227178022 SQTDOBWPLOZDSV-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE BrC[C@@H]1CCCN(c2ncc(Br)cc2Br)CC1 378821027 FFRMTXMNVAUTDN-SECBINFHSA-N 426.978 4.608 50 10 IJGE Cc1ccc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CI)cc1 382710622 HAXPYIGQDNGGMF-OALUTQOASA-N 435.305 4.782 50 10 IJGE Cc1cc(S(=O)(=O)N2CCCC[C@H]2C[C@@H](C)Br)sc1Br 383529303 ALMMOQVHDSYTKG-MNOVXSKESA-N 445.242 4.536 50 10 IJGE ClCCc1nc2ccncc2n1CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 705866229 YIFKKVZCUVEEJF-UHFFFAOYSA-N 446.982 4.684 50 10 IJGE CC(C)c1nc(C#N)c(NNC(=O)[C@H](Oc2ccc(F)c(Cl)c2)c2ccccc2)o1 730532438 GPIAZZGDBOHRBU-GOSISDBHSA-N 428.851 4.726 50 10 IJGE Cc1ccc(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)c(Sc2ccccc2)n1 768134049 GVEJIFSITRLPMH-UHFFFAOYSA-N 442.548 4.767 50 10 IJGE C=Cc1ccc(C(=O)NNC(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)cc1 1609507142 GFVMDOSMCLAGCR-UHFFFAOYSA-N 428.517 4.573 50 10 IJGE CCOC(=O)c1c(NC(=O)NN=Cc2c(F)cccc2Cl)sc2c1CC[C@H](C)C2 1772753073 CRHOUMWPZOOICV-NSHDSACASA-N 437.924 4.998 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2Cc1ccc(C)cc1 1865691161 LAIRHEOEEUVRRU-XMMPIXPASA-N 440.547 4.975 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2)[C@@H]1c1ccc([N+](=O)[O-])cc1 1865712744 GQFJXTPYBARCPB-JOCHJYFZSA-N 449.470 4.725 50 10 IJGE CCOc1ccc(/C=C/C(=O)NNC(=O)c2ccc(-c3ccc(C)c(C)c3)nc2C)cc1 1865756361 UFGKIHCLDBUCPG-OQLLNIDSSA-N 429.520 4.547 50 10 IJGE CCc1ccc(NC(=O)OC(C)(C)C)c(C(=O)N(C)CC2CC(Br)C2)c1 1887829990 QMIRQGSRIMESMN-UHFFFAOYSA-N 425.367 4.842 50 10 IJGE O=C(c1c(Cl)cc(Br)c(F)c1Br)[C@@H]1C[C@@H]1Br 1900377021 RDNWSSYTKVZBIF-DMTCNVIQSA-N 435.312 4.970 50 10 IJGE C[C@H](c1ccncc1Br)[C@@H](Cl)c1cc(I)sn1 2007643151 HNLQLOQUVHBQMC-KSBSHMNSSA-N 443.535 4.989 50 10 IJGE Cc1sc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)[C@H](C)C1CC1 2009640029 LAPYUOZNAZYINW-CYBMUJFWSA-N 428.417 4.941 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OCC[C@]23CCC[C@@H]2C3)CC1 2011684861 IOUKTDSNIBEOBY-QAPCUYQASA-N 449.373 4.788 50 10 IJGE C[C@@]1(CCBr)CCN1Cc1ccc(Br)cc1Br 2025221469 CHFUCRYLYSVWSZ-CYBMUJFWSA-N 425.990 4.961 50 10 IJGE Clc1ccc(I)c(CN2CC3(CC3)C[C@H]2CBr)c1 2037830678 IEJQXLGXHRUOOT-LBPRGKRZSA-N 440.550 4.694 50 10 IJGE FC1(F)C[C@H](CBr)N(Cc2cc(Br)ccc2Br)C1 2054716396 CFINGOVJDYGXEO-SNVBAGLBSA-N 447.943 4.816 50 10 IJGE CCC[C@@H](Cl)c1cn(-c2cc(I)ccc2Br)nn1 2057422511 VARBXRGCXTXTCV-SNVBAGLBSA-N 440.510 4.714 50 10 IJGE F[C@H]1CCO[C@@H]1COc1c(Br)cc(CBr)cc1Br 2058657255 XRMGIIKQHPYGJB-WDEREUQCSA-N 446.936 4.612 50 10 IJGE C[C@H](CCBr)CCN1CC[C@H](C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)C1 2106784950 MGLONUUWGYATDE-KFWWJZLASA-N 445.364 4.823 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCC([C@H](F)CCl)CC1 2106949846 IEBRHHPLTASUTB-SECBINFHSA-N 433.568 4.702 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](CN(C[C@H](CBr)CC2CC2)C2CC2)C1 2112869920 XZADFSMDOJGTTK-MSOLQXFVSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CCc2cc(NC(=O)[C@@H](Br)C3CCCC3)ccc2C1 2167033355 QUYBNPHWFGGCRJ-SFHVURJKSA-N 437.378 4.872 50 10 IJGE CN(Cc1ccc(Br)c(F)c1F)[C@H](CCBr)C(F)(F)F 2178524968 UGWAQSGOKSZNMD-SECBINFHSA-N 425.033 4.875 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1C1CCN(C[C@@H](CBr)C2CCC2)CC1 2185503942 VYNRFYBQHYUGRJ-MRXNPFEDSA-N 441.414 4.747 50 10 IJGE C[C@H](Cl)[C@H](Nc1ncc(C(F)(F)F)cc1I)C(F)(F)F 2195317622 JBWUPRDMNFDACY-FFWSUHOLSA-N 432.533 4.675 50 10 IJGE BrC[C@@H]1C[C@@H]2CCCC[C@@H]2N1C[C@@H]1CC1(Br)Br 2217338225 YYDKWYSELVQDMD-BJDJZHNGSA-N 430.022 4.520 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@@H](CCBr)C1 2307334168 NGBCYBAKXRJNGX-SNVBAGLBSA-N 428.539 4.552 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)[C@H]2[C@H]3COCC[C@H]32)c1 2313495710 OVIPCZRMKQZRID-XJFOESAGSA-N 438.985 4.800 50 10 IJGE CCOc1c(Cl)cc(C=C(C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1Cl 2313566971 FMKWOBRCHFOKEY-UHFFFAOYSA-N 430.335 4.648 50 10 IJGE Clc1ccc(C[C@]2(CBr)C[C@]23CCOC3)c(I)c1 2318528325 DMSZMGKQBKUVAD-UONOGXRCSA-N 441.534 4.679 50 10 IJGE Cl[C@@H]1CCN(Cc2ccc(I)c(Br)c2)[C@@H]2CC[C@H]12 2325210325 XBDHHWMVJJIKLD-MPKXVKKWSA-N 440.550 4.645 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@H](Br)C12CCC2 2327403686 DGMJLYNWXJUKGJ-ZDUSSCGKSA-N 440.550 4.837 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccccc1C(F)(F)F 2343415997 KKDSHWGKSOBSGZ-HNNXBMFYSA-N 430.264 4.806 50 10 IJGE C[C@H]1CCCN(C(=O)c2ccc(Cl)cc2I)[C@@H]1CCCl 2365593188 SNYCBVXOYVHZMF-IINYFYTJSA-N 426.125 4.814 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)Nc3ccc(C)cc3OC)o2)cc1 33362468 BVRLTJZNGJYTCO-RGEXLXHISA-N 430.460 4.986 50 10 IJGE COc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3ccccc3C)c(C)c21 40813198 JOAQFGXBCNJLCH-ZXVVBBHZSA-N 431.492 4.628 50 10 IJGE CC(=O)c1cc2c(cc1N/C=C(/C#N)c1nc(-c3cccc([N+](=O)[O-])c3)cs1)OCO2 102421414 BCIYGAKXEKWCDB-ZROIWOOFSA-N 434.433 4.626 50 10 IJGE O=S(=O)(Nc1ccc(Cl)cc1Br)c1ccc(CBr)cc1 125861649 FSZDYIZMSPUCQZ-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE CCSc1ccc(Cl)cc1CC(=O)N/N=C\c1cc(Cl)c(O)c(Cl)c1O 169922424 PQSTUBSOIVSVAQ-WNFQYIGGSA-N 433.744 4.863 50 10 IJGE COc1ccc(Cc2nc3cc(C(=O)N/N=C\c4cccc(Cl)c4)ccc3[nH]2)cc1OC 169925498 QCVSULSTXOGXCR-WGARJPEWSA-N 448.910 4.588 50 10 IJGE CCN(CC)c1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4O)nc3c2)cc1 169926406 RPFGJRCNWHAJOV-WGOQTCKBSA-N 427.508 4.546 50 10 IJGE CN(CCCCCBr)C(=O)c1cc(Br)c(Br)s1 227142570 BOCBFBMCGQKCQM-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE CC[C@@H](C)c1ccc(OCC(=O)NN=Cc2cccc(OC(=O)/C=C\c3ccco3)c2)cc1 254462032 CQICXCDVBKVFRO-LNKOAZGNSA-N 446.503 4.941 50 10 IJGE CC[C@@H](Br)[C@H](C)NC(=O)c1cc(Br)cc(Br)c1 386848775 ZAEAOOFOCUALJI-WRWORJQWSA-N 427.962 4.503 50 10 IJGE ClCc1nc2cc(I)ccc2n1-c1cnn(Cc2ccccc2)c1 389691228 KHKLCOFYJSCVOI-UHFFFAOYSA-N 448.695 4.614 50 10 IJGE COc1ccc(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)c2cccnc12 733138074 DDTNHASESUOYGC-CYVLTUHYSA-N 448.486 4.566 50 10 IJGE CC(C)c1ccc([C@@H](NC(=O)NNC(=O)COCc2ccccc2)c2cccs2)cc1 738496992 IFOVIYNMKVZWQK-HSZRJFAPSA-N 437.565 4.508 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)/C=C(\c2ccc(Cl)cc2)C(F)(F)F)c1C 771015880 KYUPTYNSZCPMGI-LFIBNONCSA-N 447.848 4.898 50 10 IJGE CCOCCOCc1cccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1C 799403521 LRFVJHDEINNBFE-UHFFFAOYSA-N 436.434 4.587 50 10 IJGE N#CCOc1c(Cl)cc(/C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1Cl 1084404319 XPTAAAFQUMFMDI-CXUHLZMHSA-N 439.302 4.643 50 10 IJGE CC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)c1C(C)C 1538725486 SDQATIRXWSNEIZ-INIZCTEOSA-N 443.613 4.936 50 10 IJGE CC(C)c1ccc(NNC(=O)CCSCc2nc(O)c3c4c(sc3n2)CCC4)cc1 1636645632 SZMCEGMNBOWQBQ-UHFFFAOYSA-N 442.610 4.776 50 10 IJGE Cc1ccc(Cl)cc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccn1)CCC2 1772746413 CAFOMRFZTKBOBA-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE COc1cc(C=NNC(=O)COc2cccc(C(C)C)c2)ccc1OCCc1ccccc1 1772753423 DNZJHSVNMRBRRU-UHFFFAOYSA-N 446.547 4.969 50 10 IJGE CCc1nn(Cc2ccccc2F)c2c1[C@@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865704721 CKLGEUICFUEJCG-QFIPXVFZSA-N 432.499 4.638 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706303 SPKPTUIDNWWJON-HXUWFJFHSA-N 449.898 4.664 50 10 IJGE N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OCc2ccc(Cl)cc2Cl)cc1 1873793235 DYDIWJUYFFUNNE-VATWTLTGSA-N 442.346 4.593 50 10 IJGE CCn1nc(C)c(Br)c1CN(Cc1ccccc1)[C@H](C)CBr 1914372040 CWDNIBHGVRCUFH-CYBMUJFWSA-N 429.200 4.760 50 10 IJGE COc1cc(OC)c(C(=O)N(Cc2ccccc2)C(C)(C)CBr)cc1OC 1915765948 RPUTUXSTCYMALM-UHFFFAOYSA-N 436.346 4.528 50 10 IJGE C[C@H](c1ccncc1Br)[C@H](Br)c1cn(C)c(Br)n1 1924055076 DSDXCXNEZPSJKT-HQJQHLMTSA-N 437.961 4.580 50 10 IJGE CC(C)C[C@H](Br)CNC(=O)c1csc(Br)c1Br 1945183315 CCRAWMJDVSSRBK-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE CC(C)[C@H](CI)NCc1ccc(Cl)c(Br)c1F 2001884529 SWNCJZWLIWTWHC-JTQLQIEISA-N 434.518 4.791 50 10 IJGE Brc1ccc(Br)c(CN2CCCC[C@H](Br)C2)c1 2006497569 VYBYNPNIKMGKSW-LBPRGKRZSA-N 425.990 4.961 50 10 IJGE C[C@@H]1CCN(Cc2cc(Br)ccc2Br)C[C@@H]1Br 2006503569 PUWZRSLUMJVFPO-RNCFNFMXSA-N 425.990 4.817 50 10 IJGE C[C@@H](Br)CN(C(=O)c1c(Br)cccc1Br)C1CC1 2033089315 RQRVKMBYGBQHLZ-MRVPVSSYSA-N 439.973 4.600 50 10 IJGE C[C@@]12CC[C@@](CBr)(C1)N(c1ncc(Br)cc1Br)C2 2078773703 WSLAOQGSXWSXEQ-OLZOCXBDSA-N 438.989 4.751 50 10 IJGE C[C@@H]1CN(C[C@@H](CBr)c2ccccc2)C[C@]1(C)CNC(=O)OC(C)(C)C 2106784572 JPPQCVCXPXQQND-BLIXFSHQSA-N 425.411 4.648 50 10 IJGE COc1cc(CBr)cc(Br)c1OCC(F)(F)C(F)(F)F 2145887809 WWRYAURRANPYMN-UHFFFAOYSA-N 427.989 4.929 50 10 IJGE CC(C)(C)OC(=O)NCCCN(CC1(CBr)CCOCC1)c1ccccc1 2163060884 CUDZWZNUCDOBKW-UHFFFAOYSA-N 441.410 4.600 50 10 IJGE CC(C)N(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)[C@@H](Br)C1CCCC1 2167031229 HWHBUGXAYOYZSU-AEFFLSMTSA-N 445.442 4.824 50 10 IJGE CCCC(CBr)(CCC)CN1CCOCCC12CN(C(=O)OC(C)(C)C)C2 2167622759 SNQCTFLBMOMFRY-UHFFFAOYSA-N 447.458 4.680 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@@H]1Br)c1cc(Br)c(Cl)s1 2172565361 UEJDKWYMQGUCLA-JOYOIKCWSA-N 435.568 4.955 50 10 IJGE BrCc1cc(Br)c(OCC[C@@H]2CCO2)c(Br)c1 2253130844 VRKWSADIMDKIBD-VIFPVBQESA-N 428.946 4.664 50 10 IJGE Cc1nc(C2CCN(C(=O)[C@@H](Cl)C(C)C)CC2)ncc1C(=O)Nc1ccc(Cl)cc1 2296578454 VARIFEMCBFGWRY-IBGZPJMESA-N 449.382 4.660 50 10 IJGE C[C@@H]1OCC[C@@]1(CBr)Cc1ccc(Cl)cc1I 2302315234 HHNZHIIFJVEKOI-ZANVPECISA-N 429.523 4.677 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCc2ccccc2)ccc1OC(=O)c1cccc(Cl)c1 2314737227 SLHYPFLGHRFYKO-UHFFFAOYSA-N 446.890 4.791 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)C[C@H]1CCC[C@@H]1Br 2315551291 PDAWWMSQVKAPDG-NEPJUHHUSA-N 442.566 4.940 50 10 IJGE CCCOc1cc(C=NNC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)ccc1OC 2323608769 NKCFSFIRRZGPAY-UHFFFAOYSA-N 426.542 4.625 50 10 IJGE COc1cc(C=C(C#N)n2cnc3ccccc32)ccc1OCC(=O)Nc1ccc(C)cc1 2331032772 CNQBQSICPWXYNN-UHFFFAOYSA-N 438.487 4.893 50 10 IJGE Cc1ccc(C(C)(C)C)cc1SCC(=O)NNC(=O)c1ccc(Br)cc1 33600295 IDSAKEYTAZBIGJ-UHFFFAOYSA-N 435.387 4.608 50 10 IJGE Cc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4ccc(F)cc4F)c(C)c32)c1 40811414 IPFHVBMFKNBADJ-TURZUDJPSA-N 437.446 4.897 50 10 IJGE Cc1cc(Cl)ccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccn1)CCC2 40814274 KBGGPMWEFGQRAD-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE COc1cc(/C=N/NC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)cc([N+](=O)[O-])c1OC(C)C 169889319 BAVQUOCLMFSFNI-WEODJQIISA-N 443.544 4.837 50 10 IJGE Cc1ccccc1COc1ccc(C=NNC(=O)CSc2nc3ccccc3o2)cc1 252621463 MYYZOKVRACCLNJ-UHFFFAOYSA-N 431.517 4.958 50 10 IJGE COc1ccc(C=NNC(=O)c2ccccc2Br)cc1OCc1ccccc1 254568397 BEIWRDPLIJZBBF-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE COc1cc(Cl)c([C@H](Cl)c2cnn(C)c2I)cc1Cl 379220678 SQYPSSSUSCXIHY-NSHDSACASA-N 431.488 4.668 50 10 IJGE O=S(=O)(CCCCCl)N(Cc1ccccc1)C[C@@H](O)c1ccccc1C(F)(F)F 780840170 ROYODWKLMYWXDU-LJQANCHMSA-N 449.922 4.590 50 10 IJGE COc1ccccc1CN(CCO)S(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1 782979174 HYXAYDBVNXWTNC-UHFFFAOYSA-N 447.447 4.536 50 10 IJGE C#CC[C@H](CCOC)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc3ccccc23)c1C 1438147447 LSDHNWHBCJDONM-YVJFHRMNSA-N 425.532 4.699 50 10 IJGE Cc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)N3c4ccccc4C[C@@H]3C)c(C)c21 1772744291 VLQAVMHUYZUAAL-KRWDZBQOSA-N 441.531 4.958 50 10 IJGE COc1cccc(O[C@H](C)C(=O)NN=Cc2ccc(OCc3ccccc3C)c(OC)c2)c1 1772755856 HDTXGQQVKUSGRN-LJQANCHMSA-N 448.519 4.509 50 10 IJGE CC[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1880757031 WEQGIGPVAGMLJH-QLFBSQMISA-N 435.403 4.558 50 10 IJGE O=C(N[C@H](CCSC[C@H]1C[C@@H]1Cl)C(=O)O)OCC1c2ccccc2-c2ccccc21 1883551938 LCHJKTXRJOLIKT-PUCZYUMASA-N 445.968 4.729 50 10 IJGE CN(C[C@H](CBr)CC1CC1)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 1890234029 MRRNOJYCAPOIPR-PKOBYXMFSA-N 425.411 4.995 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2C[C@@H]3C[C@@H]3CO2)s1 1900925236 XRQKIMVUFMBLRH-CVUIIHQFSA-N 433.536 4.867 50 10 IJGE CN(C[C@](C)(CBr)C(C)(C)C)[C@@H]1CCN(C(=O)OCc2ccccc2)C1 1904845250 PRUUTOISPRHSSB-NQIIRXRSSA-N 425.411 4.777 50 10 IJGE CC(C)N(C)C[C@@H](Br)Cc1c(Br)cccc1Br 1949896595 LQFYXVJLLKJYOX-JTQLQIEISA-N 428.006 4.858 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCC3(CC2)CC[C@](C)(CI)O3)C1 1950142077 YOVIDPUNETZGAW-LMDPOFIKSA-N 449.373 4.931 50 10 IJGE CC[C@@H]1CN(C(=O)OCc2ccccc2)[C@H](CC)CN1C(=O)CCCCBr 1999432082 YREMTLYKPOXNQY-RTBURBONSA-N 439.394 4.590 50 10 IJGE BrC[C@@H]1CN(Cc2ccc(Br)cc2Br)CC12CC2 2031403430 QNXFYHSPQPPKMT-LLVKDONJSA-N 438.001 4.819 50 10 IJGE C[C@H]1C[C@H](Br)CCN1C(=O)c1cccc(Br)c1Br 2031477190 KEWSTGSMDWROOC-DTWKUNHWSA-N 439.973 4.600 50 10 IJGE CC(C)N(C[C@H](C)Br)C(=O)c1c(Br)cccc1Br 2033088967 NUNKLVHQAFBENR-VIFPVBQESA-N 441.989 4.846 50 10 IJGE Brc1cccc(Br)c1C[C@H]1CN(C2CC2)C[C@H]1Br 2039251072 OBAUIHLUUKNTAH-LKFCYVNXSA-N 438.001 4.612 50 10 IJGE COCCn1c(S[C@@H](C)C(=O)C(C#N)=C2Nc3ccccc3S2)nc2ccccc21 2041454763 VJXUAVNUIXYSLX-AWEZNQCLSA-N 436.562 4.685 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CCCC[C@H](Br)C1 2050109093 WQLRQUNVLHMWRJ-JTQLQIEISA-N 439.973 4.601 50 10 IJGE O=S(=O)(c1occc1CBr)N(Cc1ccccc1)CC1CCCCC1 2059286986 RRDIVYYPQSJIJA-UHFFFAOYSA-N 426.376 4.946 50 10 IJGE CSCC[C@H](Cl)CCNC(=O)c1ccc(Br)cc1Br 2090381755 IBTXYVZKWAZGDD-SNVBAGLBSA-N 429.605 4.692 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@@H]2CC[C@H](Cl)C[C@H]2C1 2093941790 CGMSJIGVAJJYCE-CIUDSAMLSA-N 427.589 4.753 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CC2(CBr)CCCCC2)C[C@H]1C(F)(F)F 2106783007 VYUDKSFCQYTOOA-ZIAGYGMSSA-N 443.348 4.719 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H](NC(=O)[C@@H](Br)C1CCCC1)C1CCCCC1 2110721780 IPBVEGHJZVBBFH-SJORKVTESA-N 431.415 4.530 50 10 IJGE CCC(CC)N(CCBr)S(=O)(=O)c1c(C)sc(C)c1Br 2143915351 RWTVFMQQRRMZAJ-UHFFFAOYSA-N 447.258 4.702 50 10 IJGE Cc1cnc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)c(CBr)c1 2159669439 DASMPWXNPCIQHW-YJMBLLCNSA-N 426.402 4.632 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@@H]1Br)c1cc(Br)c(Cl)s1 2172565360 UEJDKWYMQGUCLA-CABZTGNLSA-N 435.568 4.955 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@]12CCCC[C@H]1N(C(=O)OC(C)(C)C)CCC2 2196908446 XNCUVYRKTWJXTN-LHUKNYEISA-N 443.426 4.578 50 10 IJGE Cc1cc([C@H](Br)c2ccc3nc(O)oc3c2)ccc1I 2207105500 USVBTXIHJLDSAH-AWEZNQCLSA-N 444.066 4.931 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)[C@@H]2CCS(=O)(=O)C2)c(C)c1Br 2227350178 VTRWQLFONXCIMS-RNCFNFMXSA-N 430.589 4.543 50 10 IJGE CC(C)(C)OC(=O)N1[C@H](CNC(=O)[C@@H](Br)C2CCCC2)C[C@@H]2CCCC[C@H]21 2240968528 RHCOGNIATMOWMG-FJIDUMEYSA-N 443.426 4.625 50 10 IJGE C[C@@H]1OCC[C@H]1[C@H](Br)Cc1cc(Br)cc(Br)c1 2252836616 DULUYPRROUIHJF-ZEGGKSINSA-N 426.974 4.943 50 10 IJGE CCCCc1ccc([C@@H](Br)c2cnn(C)c2I)s1 2253421609 CXWDXRNDZTWKGM-LBPRGKRZSA-N 439.160 4.913 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2CCCN(C[C@@H](CBr)c3ccccc3)[C@H]2C1 2290276771 UMZVTPBGBULGMD-ZCNNSNEGSA-N 437.422 4.887 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)N(C)C)c(Br)cc1OCc1cccc(C)c1 2313568228 PWOJNFOTLHEADP-UHFFFAOYSA-N 443.341 4.730 50 10 IJGE Cc1ccc2nc(-c3ccc(NC=C(C#N)C(=O)N4C[C@H](C)O[C@H](C)C4)cc3)sc2c1 2318455276 QEULCJZEPLBXKE-CALCHBBNSA-N 432.549 4.727 50 10 IJGE COc1ccc(CCN[C@H](CCCl)COCc2ccccc2)c(Br)c1 2320520068 DHTNIQHIBHFILS-GOSISDBHSA-N 426.782 4.804 50 10 IJGE CC(C)[C@H]1C[C@H](Br)CN1Cc1cc(Cl)ccc1I 2321506977 FBUZEEVHNMTZHN-SMDDNHRTSA-N 442.566 4.938 50 10 IJGE C[C@H](Br)CC1C[C@@H]2CC[C@H](C1)N2c1ccc(I)cn1 2341259106 YZDGVGMYPDYASU-CRMUJIHISA-N 435.147 4.607 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@H]1CCC[C@H](C(F)(F)F)C1 2343416440 QCAQKYUXQBNMKO-ULQDDVLXSA-N 436.312 4.842 50 10 IJGE CCOc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2F)CCC3)cc1 40812471 ASHYKSBMZNVLCP-VFCFBJKWSA-N 449.482 4.849 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)Nc3cc([N+](=O)[O-])ccc3C)o2)cc1 103138530 QESCJCNUBFGGLW-PDGQHHTCSA-N 445.431 4.886 50 10 IJGE COc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)cc1 205645267 XQKQWRWDERWRKR-NZVBECTDSA-N 442.446 4.671 50 10 IJGE Cc1cc(Br)ccc1N/C=C(/C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 217234732 WINGOIDJHZRAFS-LUAWRHEFSA-N 435.665 4.777 50 10 IJGE COc1ccc(C=NNC(=O)c2[nH]c3ccc([N+](=O)[O-])cc3c2-c2ccccc2)c(OC)c1 254304236 FITVZLUEZMSNTM-UHFFFAOYSA-N 444.447 4.524 50 10 IJGE CCCCOc1ccc(C=NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1 263625793 OOJKQWMNLMGWNE-UHFFFAOYSA-N 432.520 4.974 50 10 IJGE CC[C@H](O[C@](C)(CI)CNC(=O)OC(C)(C)C)c1ccccc1 403282394 OTEQQTXAEBYROY-MAUKXSAKSA-N 433.330 4.873 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)n3ccc(=NCC(F)(F)F)cc3)c2C)cc1 764944889 BFSOUKZYLHTZFL-MOSHPQCFSA-N 438.453 4.914 50 10 IJGE CCCOc1c(Cl)cc(/C=C(/C#N)C(=O)NCc2ccc([N+](=O)[O-])cc2)cc1OCC 787149258 OKIDGXAIZXOZRZ-YVLHZVERSA-N 443.887 4.659 50 10 IJGE CC[C@@H](Cc1ccccc1Br)C(=O)NNc1nc2ccccc2[nH]c1=S 1167430336 BVFCFSZTNFMYDU-LBPRGKRZSA-N 431.359 4.767 50 10 IJGE C#C[C@@H](NC(=O)NNC(=O)c1cc(-c2ccc(C)cc2)nc2ccccc12)c1ccccc1 1478895566 FQIUQDLLEQBUQV-HSZRJFAPSA-N 434.499 4.529 50 10 IJGE CC(=O)NN(CC(F)(F)F)C(=S)Nc1c(Cl)cc(OC(F)(F)F)cc1Cl 1615893437 YYUVKSXKLQIMEY-UHFFFAOYSA-N 444.184 4.504 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)Cc2ccccc2)CCC3)cc1C 1772749705 YBQZVOMAVFEICI-UHFFFAOYSA-N 429.520 4.856 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc3ccccc23)[C@@H]1c1ccncc1 1865701754 DQXULSIBJQZOBZ-GOSISDBHSA-N 433.393 4.657 50 10 IJGE CCCOc1cccc(/C=N\NC(=O)c2ccc(-c3ccc(OC)c(OC)c3)nc2C)c1 1865760846 RLEQCQLNAFNYTQ-QQXSKIMKSA-N 433.508 4.627 50 10 IJGE C[C@@H]1C[C@@H]1N(CCBr)Cc1cc(Br)ccc1Br 2006509096 YJFCYAMPMFPJRU-RNCFNFMXSA-N 425.990 4.817 50 10 IJGE C[C@H]1[C@H](Br)CCCN1C(=O)c1c(Br)cccc1Br 2033086129 IYDQDXRHVAHTJZ-DTWKUNHWSA-N 439.973 4.600 50 10 IJGE CC(C)[C@@H](Br)[C@H](C)NC(=O)c1cccc(Br)c1Br 2041302461 DAUBWEUMPFSPDO-GZMMTYOYSA-N 441.989 4.749 50 10 IJGE O=C(CBr)c1cc(C(F)(F)F)c(C(F)F)cc1I 2060394942 YZTQTBSRVJVCCL-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE C=CCC[C@H](CBr)NC(=O)c1cccc(Br)c1Br 2075345065 YCEZKYKQEGLJCO-SECBINFHSA-N 439.973 4.671 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)C1CCC(NC(=O)OC(C)(C)C)CC1 2106788486 PUGBWGIYBVFWGK-LMDPOFIKSA-N 425.411 4.933 50 10 IJGE CS(=O)(=O)C1([C@@H](Br)c2cc(Cl)c(Br)cc2F)CCC1 2110396497 GXTSYAMREGNWDZ-NSHDSACASA-N 434.552 4.645 50 10 IJGE Clc1cccc(CBr)c1N1CC[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2129050438 DGVJHUSIRJJOJQ-WOJBJXKFSA-N 435.793 4.715 50 10 IJGE CCC[C@@]1(CNC(=O)N2CCC(Br)CC2)CCCCN1C(=O)OC(C)(C)C 2162495352 SSNNFYHGUYGPJR-FQEVSTJZSA-N 446.430 4.515 50 10 IJGE COc1cc(F)c(Cl)cc1[C@H](Br)c1c(Br)c(C)nn1C 2207377553 IZOLOQWWWWHJGE-LBPRGKRZSA-N 426.511 4.776 50 10 IJGE Cc1ccc([C@@H](Br)c2ccc3c(c2)CC(=O)N3)cc1I 2232834057 QWBXFBSGIZDWIC-INIZCTEOSA-N 442.094 4.579 50 10 IJGE C[C@@H]1CN(Cc2cc(I)ccc2Cl)CC[C@H]1Br 2307335022 XZQCJFPHIZSFEA-BXKDBHETSA-N 428.539 4.550 50 10 IJGE Clc1ccc(CN[C@@H](CBr)C2CCCC2)cc1I 2315550557 FSMQGGKHAGUPES-AWEZNQCLSA-N 442.566 4.988 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)C(C#N)=CNc1cc([N+](=O)[O-])ccc1Cl 2325306978 XDKTXQOLCLSVDD-UHFFFAOYSA-N 442.859 4.663 50 10 IJGE COc1cc(C=C(C#N)c2ccccc2[N+](=O)[O-])ccc1OCC(=O)Nc1ccccc1 2331066188 XDPDTSVVNKMSOQ-UHFFFAOYSA-N 429.432 4.685 50 10 IJGE Cc1nn(-c2ccccc2)c(C)c1/C=N/NC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 59155287 LDDLJRVJIQXFTR-ZWGXDWAISA-N 431.323 4.714 50 10 IJGE Cc1ccc(-n2nc(C)c(/C=N/NC(=O)CSCc3ccc(Cl)cc3)c2C)cc1 59167364 ZLZVJXDGQXKZLS-WYMPLXKRSA-N 426.973 4.834 50 10 IJGE O=C(NN=Cc1ccc(Sc2cccc3ncccc23)c([N+](=O)[O-])c1)c1cccc(O)c1 252599900 DMJOXJJZJREPCQ-UHFFFAOYSA-N 444.472 4.764 50 10 IJGE CN(C(=O)c1cc(Br)ccc1Br)[C@@H]1CCC[C@@H]1Br 709269743 YLJLGIWXDBZCRK-NWDGAFQWSA-N 439.973 4.600 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)c1C 736696614 JEHJWKFTVPMIJF-UHFFFAOYSA-N 427.295 4.700 50 10 IJGE Cc1cc(NC(=O)/C(C#N)=C\c2cc(C)n(C[C@@H]3CCCO3)c2C)n(-c2ccccc2C)n1 788051389 KLNDHXZXNRWSQY-SINAZASISA-N 443.551 4.632 50 10 IJGE CC(F)(F)c1ccc(CNC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cc1 817462184 HVMHTNVNTNKHTD-ZHZULCJRSA-N 445.473 4.799 50 10 IJGE C[C@H](Cc1ccccc1Cl)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 918581960 BSONEENIELSZRS-ISPGYRLHSA-N 443.938 4.772 50 10 IJGE O=C(NN=C(CSc1nc2ccccc2[nH]1)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 1083892585 DTZSKQXPXVSPLJ-UHFFFAOYSA-N 449.467 4.537 50 10 IJGE COc1ccc(Cl)cc1-n1c(C)cc(C=NNC(=O)CC[C@H](O)c2ccccc2)c1C 1084244780 ROECMROWHBBQCY-QFIPXVFZSA-N 439.943 4.720 50 10 IJGE Cc1ccc(C)c(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(O)cc2)CCC3)c1 1772744451 DOWWEDRYWCZPOO-UHFFFAOYSA-N 431.492 4.633 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1cc(C)ccc1C 1865690946 FQYOTKFNKHHEFE-DEOSSOPVSA-N 440.547 4.894 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC12CCC([C@H](CBr)NC(=O)OC(C)(C)C)CC2 1882086481 BYNTVTULGGYWAK-FEDUSRTKSA-N 447.414 4.748 50 10 IJGE O=C(c1ncc(Br)cc1Cl)N(CCBr)Cc1ccccc1 1884591221 SZMJONJMCKZNRF-UHFFFAOYSA-N 432.543 4.535 50 10 IJGE CN(CC(C)(C)CI)[C@@H]1C[C@@H]2C[C@H](OCc3ccccc3)C[C@@H]21 1904649636 WIGPJQVCVONPEV-CADBVGFASA-N 427.370 4.763 50 10 IJGE N#C[C@H]1CN(c2cccc(Br)c2CBr)CCN1Cc1ccccc1 1914889926 GXZJJSCQMWBCBL-INIZCTEOSA-N 449.190 4.558 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1cc(C(F)(F)F)ccc1F 1916354721 LCZBUVWEIKXJNW-OAHLLOKOSA-N 448.254 4.897 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@@]2(CCC[C@@H]2Cl)C1 1918918067 XCZAYEXQMLASNA-ZANVPECISA-N 427.589 4.897 50 10 IJGE CN(Cc1ccc(Br)cc1Br)C[C@@H](Br)C1CC1 1943850208 REWNBPXSIFSCJH-CYBMUJFWSA-N 425.990 4.817 50 10 IJGE CC(C)CN(CCBr)Cc1cc(Cl)ccc1I 1948633230 APOZSCSHGBBYGC-UHFFFAOYSA-N 430.555 4.798 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](OC2CC3(CCCCC3)C2)C1 1989967983 PKSVQMAAIXWSPV-LSDHHAIUSA-N 435.346 4.539 50 10 IJGE C[C@@H]1C[C@H]1N(CCBr)Cc1c(Br)cccc1Br 2002028814 GFQXYEOGDWDHNZ-NOZJJQNGSA-N 425.990 4.817 50 10 IJGE Cc1c(Br)sc([C@H](Br)[C@]2(C)COCCO2)c1Br 2021898319 XSGNABHENBQRAE-ONGXEEELSA-N 449.002 4.823 50 10 IJGE CCC[C@@H](Br)CCNC(=O)c1cc(Cl)ccc1I 2029922236 KLKNDHPKVKPJOA-SECBINFHSA-N 444.538 4.628 50 10 IJGE CCOCCCO[C@](C)(CI)c1ccccc1Br 2031753956 FOLWJUOAVPQUMM-CQSZACIVSA-N 427.120 4.543 50 10 IJGE O=C(NC[C@@H]1CCCN(C[C@@H](CBr)c2ccccc2)C1)OCc1ccccc1 2044697860 XFPDDTJUCCLNHH-RBBKRZOGSA-N 445.401 4.804 50 10 IJGE CC(C)[C@@H](Cl)c1cn(-c2cc(I)ccc2Br)nn1 2057426207 BOMDNZZFTNXUBW-GFCCVEGCSA-N 440.510 4.570 50 10 IJGE C=CCC[C@@H](CBr)NC(=O)c1cc(Br)ccc1Br 2075328764 JFDAYRCXOIQOIT-JTQLQIEISA-N 439.973 4.671 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@H](CN(C)C(=O)OC(C)(C)C)C1 2106783021 WCVXMUNHLCYJFP-QGZVFWFLSA-N 435.447 4.536 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(CC3(CBr)CCCCC3)C[C@@H]2C1 2141250577 UFRMZKVETFFMMD-FGTMMUONSA-N 429.443 4.957 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCNC(=O)[C@@H](Br)C1CCCC1)c1ccccc1 2167049216 VSZWFIWCTSEHBM-MSOLQXFVSA-N 439.394 4.712 50 10 IJGE C[C@@H](CCCCCBr)NS(=O)(=O)c1ccc(Br)cc1Cl 2174530931 WBLSLDWXNUDJAC-JTQLQIEISA-N 447.620 4.725 50 10 IJGE O=C(c1ccc(I)cc1)N1CCCC12CCC(Br)CC2 2202251570 YUFMGCPEXKUDRT-UHFFFAOYSA-N 448.142 4.604 50 10 IJGE COC[C@@H]1C[C@@H]1[C@@H](Br)Cc1cc(Br)cc(Br)c1 2252830727 HTRDTUZITSPVHC-XDTLVQLUSA-N 426.974 4.800 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C[C@H](C)O[C@H]2C)cc1I 2257373259 LZXFYQULCYYOLE-CITXGKJTSA-N 425.104 4.549 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@H](C(F)(F)CBr)C1 2264509616 LSGFUVLARJAIQO-LURJTMIESA-N 437.531 4.656 50 10 IJGE CCN(CC1(CBr)CC(F)C1)[C@@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2265637970 HOLXGSFCGBWRQG-NZEHOUKNSA-N 435.422 4.905 50 10 IJGE CCn1nc(C)c(CBr)c1N1CCC[C@]2(CCN(Cc3ccccc3)C2)C1 2281295166 CPOSPMGBEVBHAS-JOCHJYFZSA-N 431.422 4.599 50 10 IJGE COc1ccc([C@@H](Br)C2(S(C)(=O)=O)CCC2)c(Br)c1Cl 2283557414 CLOTVTRSMLYAJO-GFCCVEGCSA-N 446.588 4.514 50 10 IJGE N#CC(=Cc1cn(-c2ccccc2)nc1-c1ccncc1)S(=O)(=O)c1ccc(Cl)cc1 2296722555 JCBBLYXYTTVNJQ-UHFFFAOYSA-N 446.919 4.926 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1 2304517658 RMISDVBPBTXXSV-LJQANCHMSA-N 437.422 4.826 50 10 IJGE ClCc1ccc(OCc2cc(I)ccc2Br)cn1 2319164228 CWSJPAAZCKLIIZ-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE Cc1sc(NC(=O)C(C#N)=Cc2ccccc2)nc1-c1ccc2c(c1)CCC(=O)N2C 2320934110 PSAWUXUSAURNAM-UHFFFAOYSA-N 428.517 4.573 50 10 IJGE Clc1ccc(CN2C[C@H]3CC[C@H]2[C@H](Br)C3)c(I)c1 2325461189 YFJBHMQAUZZASK-BHYNMZESSA-N 440.550 4.692 50 10 IJGE CC(C)N1C[C@@H](C(O)=C(C#N)c2nc(-c3cccc(Br)c3)cs2)CC1=O 2331278926 SNJZBQIUXRTFLY-ZDUSSCGKSA-N 432.343 4.622 50 10 IJGE Cc1ccc(-c2csc(C(C#N)=C(O)[C@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1C 2331382202 JYLKOAKNOUFXBA-HNNXBMFYSA-N 429.501 4.904 50 10 IJGE Cc1scc(C(=O)N(C)C2(CBr)CCSCC2)c1Br 2343573070 IHWSCLKHGXKKPV-UHFFFAOYSA-N 427.227 4.552 50 10 IJGE Clc1cc(Br)c(CN2C[C@@H](Br)C[C@]3(CCCO3)C2)s1 2345957453 BNBFCSZMPALHOH-TVQRCGJNSA-N 429.605 4.682 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(O[C@@H]2CCOc3ccc(F)cc32)CC1 2364533344 NZXAGXCCBGFHJS-QGZVFWFLSA-N 444.341 4.831 50 10 IJGE CC(C)[C@H](Br)C(C)(C)CN(C)S(=O)(=O)c1cscc1Br 2365907534 HZOPJVVXHNZMJI-LBPRGKRZSA-N 447.258 4.577 50 10 IJGE CCCCOc1ccc(C(=O)NNC(=O)c2ccc(NC(=O)c3ccccc3C)cc2)cc1 14029913 AGFWQXWFZCUOKX-UHFFFAOYSA-N 445.519 4.501 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccs4)ccc32)cc1OC 38659529 PBBGSBYBAJTFOU-JOCHJYFZSA-N 448.500 4.593 50 10 IJGE CCCCCOc1ccccc1C(=O)N/N=C/c1c(C)nn(-c2ccc([N+](=O)[O-])cc2)c1C 59156377 LAFCJIAKJRRKOW-PCLIKHOPSA-N 449.511 4.730 50 10 IJGE O=C(Cc1cccc2ccccc12)N/N=C1\C(=O)N(C/C=C/c2ccccc2)c2ccccc21 59159807 BLATVEQBPIWGLY-FJILKAEUSA-N 445.522 4.963 50 10 IJGE Cc1cc(-c2nc(CCl)cs2)ccc1Cn1cc(I)cn1 166066665 SCJUZQNPTUEGBZ-UHFFFAOYSA-N 429.714 4.707 50 10 IJGE COc1ccc(Br)cc1/C=N\NC(=O)c1ccc2[nH]c3c(c2c1)C[C@@H](C)CC3 169891186 UIJAKDXNQNWBCC-RTNLCPHNSA-N 440.341 4.828 50 10 IJGE COc1ccc(-c2n[nH]cc2C=NNC(=O)c2ccc(-c3ccccc3)cc2)cc1OC 254498151 OHMAODVRLCRWIG-UHFFFAOYSA-N 426.476 4.525 50 10 IJGE ClCc1nc2cc(Br)cnc2n1C[C@@H]1CCCN(Cc2ccccc2)C1 382144456 GEQLKPCUJSOGGL-MRXNPFEDSA-N 433.781 4.845 50 10 IJGE C[C@H](Br)C[C@H](C)CNC(=O)c1ccc(Br)cc1Br 397836222 MQHFWAJVGLRWES-IUCAKERBSA-N 441.989 4.751 50 10 IJGE CN([C@H](CBr)C(C)(C)C)S(=O)(=O)c1c(Cl)cccc1Br 689228599 DGKLQIGLGRQKHP-LLVKDONJSA-N 447.620 4.533 50 10 IJGE Clc1cc(Br)c(OCCCO[C@@H]2CCOC2)c(CBr)c1 708073144 LFMKPSJONVPKDI-GFCCVEGCSA-N 428.548 4.572 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)Nc2ccc3c[nH]nc3c2)c(-c2ccc(Cl)cc2)n1 727723037 CUUHPGMKQJJURG-LICLKQGHSA-N 441.882 4.539 50 10 IJGE Cc1cc(NC(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)n(-c2ccccc2C)n1 788051390 KLNDHXZXNRWSQY-XUKJQLKWSA-N 443.551 4.632 50 10 IJGE CC(C)(C)Cc1nc(-c2cccc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c2)no1 799746305 GEOXTFQFJDECIH-UHFFFAOYSA-N 443.429 4.973 50 10 IJGE O=C(NN=C(c1ccccc1)c1ccccc1)c1cc(O)nc2c(Br)cccc12 1290579306 GCDVQDDKUKXTGM-UHFFFAOYSA-N 446.304 4.885 50 10 IJGE C=CC[C@H]1CCCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)C1 1469920957 QRGWSUUOHLXIKL-HJHGFDQJSA-N 433.943 4.839 50 10 IJGE C=CCN(CCOC)C(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1525143484 AUZZHTJZFVGNKC-CPNJWEJPSA-N 431.458 4.681 50 10 IJGE C=CCN(CCOC)C(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1543595053 AGUMYYAKFYGVET-PDGQHHTCSA-N 432.351 4.969 50 10 IJGE CCOc1ccc(CC(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)cc1 1860391754 SOJQGAZUHSFUDR-UHFFFAOYSA-N 430.529 4.971 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(CC3(CBr)CCC3)CC2)C1 1879207220 ZWJCTLRSDLJYCC-GOSISDBHSA-N 429.443 4.911 50 10 IJGE C[C@H](CCBr)N(C)C(=O)c1csc(Br)c1Br 1917093093 HSLUVDKFAPQMKY-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE C[C@@H](c1ccncc1Br)[C@@H](Br)c1cn(C)c(Br)n1 1924055078 DSDXCXNEZPSJKT-WRWORJQWSA-N 437.961 4.580 50 10 IJGE C[C@]1(CBr)CCN(C(=O)c2csc(Br)c2Br)C1 1945186123 BSMSMWARUWOBSO-LLVKDONJSA-N 446.002 4.520 50 10 IJGE O=C(NC1CC(CCBr)C1)c1ccc(Br)cc1Br 2030032771 JIZUVPQSIITTQT-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE CC(C)N1C[C@H](Cc2cc(Br)ccc2Br)[C@@H](Br)C1 2054720266 WNEBCRSYEZVJIM-FZMZJTMJSA-N 440.017 4.858 50 10 IJGE Clc1nc(Cl)n([C@@H]2CN(Cc3ccccc3)[C@]3(CCOC3)C2)c1CBr 2055098571 SUPQQSDZDJOCAX-KBXCAEBGSA-N 445.188 4.691 50 10 IJGE O=C(CBr)c1cc(C(F)F)cc(C(F)(F)F)c1I 2060394397 ILUMONLPLAMKLD-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE Brc1cccc(Br)c1CN1CC[C@H](Br)[C@H]2CC[C@@H]21 2069996689 OIXIQOWSAGMFCH-IIMNLJJBSA-N 438.001 4.959 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCCC2(CCC2)[C@H]1NC(=O)CCCCBr 2106299202 VXCZMVXIQCKMGX-RDJZCZTQSA-N 431.415 4.532 50 10 IJGE C[C@@H](N(Cc1ccccc1)S(=O)(=O)N1CCC(CCBr)CC1)C(C)(C)C 2123371582 ZUGOTQADVNLTLQ-QGZVFWFLSA-N 445.467 4.665 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCCC2)[C@H](C(F)(F)F)C1 2130132564 KPODKWLOABDODC-AWEZNQCLSA-N 443.348 4.815 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@H](Br)c2sc(Cl)cc2Br)C1 2137234597 BUFWUUUHJZEVSL-BPTDKIDVSA-N 448.629 4.815 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2CCN(C[C@H](CBr)c3ccccc3)CC[C@H]2C1 2163065187 YDZFEIDKXWPIOK-UFYCRDLUSA-N 437.422 4.744 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCCC[C@@H]1CN(C[C@H](CBr)c1ccccc1)C2 2169634116 OOQLNCGOWPUPJG-JQVVWYNYSA-N 437.422 4.934 50 10 IJGE Cc1sc(C(=O)N(C)[C@@H](CCBr)C(F)(F)F)c(Br)c1C 2237629898 OJCZAVBFRQCEJP-QMMMGPOBSA-N 437.119 4.915 50 10 IJGE C[C@@]1(CBr)C=CCCN1Cc1cc(Cl)ccc1I 2253521619 XTKITRIUAIHHMO-AWEZNQCLSA-N 440.550 4.860 50 10 IJGE C[C@H](Br)CN(CC(C)(C)C)C(=O)c1ccccc1I 2272459372 HALBZYSEQKTJDF-NSHDSACASA-N 438.147 4.563 50 10 IJGE CC1(C)C[C@H](Cl)C[C@H](NC(=O)c2ccc(Cl)c(I)c2)C1 2283661211 GFOSPJVTEOFJOW-MNOVXSKESA-N 426.125 4.861 50 10 IJGE C[C@@H]1CC[C@@H](CBr)N(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285960283 UJMDLTRKCBQDQY-BDAKNGLRSA-N 427.539 4.877 50 10 IJGE COc1ccc(-c2csc(C(C#N)=CNc3ccc(F)cc3[N+](=O)[O-])n2)cc1OC 2296790051 KZYCZYXYWFGMRZ-UHFFFAOYSA-N 426.429 4.851 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)C[C@H](Cl)C1CC1 2306218739 DIKUOGZFBKHKQY-LBPRGKRZSA-N 428.539 4.503 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCN(CCCCBr)[C@@H](C(F)(F)F)C1 2315835034 TXQZSYPZXSZKSI-ZIAGYGMSSA-N 431.337 4.719 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)C=Cc1cccs1 2321143544 JWYZFEDZSZIGLG-UHFFFAOYSA-N 432.332 4.900 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NN=Cc2ccc(-c3ccccc3Cl)o2)C1 2321721603 RJYUHGJXYJBSRA-OAHLLOKOSA-N 431.920 4.697 50 10 IJGE Cl[C@@H]1C[C@H]2CC[C@H]1CN2Cc1ccc(I)c(Br)c1 2325212249 CYLPRZBVPCFMJK-DMDPSCGWSA-N 440.550 4.645 50 10 IJGE Cc1ccc([C@H](C(=O)NC2CCCCC2)N(CCc2ccccc2)C(=O)CCl)cc1 4672253 AARGQCWCSZUQJV-XMMPIXPASA-N 426.988 4.795 50 10 IJGE Cc1ccc2nc(N(/N=C/c3coc4ccccc4c3=O)C(=O)c3ccco3)sc2c1 9628955 BPZWCYMMPRAUCR-WYMPLXKRSA-N 429.457 4.985 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2F)cc1 38651979 UDNDRSAFAZULJD-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccco2)CCC3)cc1Cl 40814426 WEEAJVBNCFVHEH-PCLIKHOPSA-N 425.872 4.866 50 10 IJGE O=C(CNc1cccc(N2CCCC2=O)c1)N/N=C\c1c2ccccc2cc2ccccc12 59507439 HTDZWXSKNQPTGO-RHANQZHGSA-N 436.515 4.682 50 10 IJGE CCOC(=O)[C@@H]1[C@H](c2cccs2)C(C#N)=C(SCc2ccc(Cl)cc2)N[C@@]1(C)O 96563463 NYJQMNSVNRMIKW-WFXMLNOXSA-N 448.997 4.645 50 10 IJGE N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)NNC(=O)c2cccc3cccnc23)c1 735037360 HUMRDTDCMLHIEO-UHFFFAOYSA-N 442.862 4.627 50 10 IJGE C[C@@H](NC(=O)NNC(=O)COc1ccccc1F)c1ccccc1-c1ccc(Cl)cc1 740024798 AFYCBZKUIIBBHJ-OAHLLOKOSA-N 441.890 4.617 50 10 IJGE C#CCn1ccc(CN(CCOC)C(=O)Nc2cccc(S(F)(F)(F)(F)F)c2)n1 788668961 LGXRGNGJYFLLRV-UHFFFAOYSA-N 438.422 4.854 50 10 IJGE COc1cccc(/C(C)=C\C(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)c1 804211551 PVBQZMYREFTIHF-KAMYIIQDSA-N 428.414 4.718 50 10 IJGE Cc1ccc(C(=O)NN=C2C(=O)N(Cc3ccccc3Cl)c3ccccc32)cc1Cl 1083999886 XPNAWJVILUJWFQ-UHFFFAOYSA-N 438.314 4.983 50 10 IJGE COc1ccc(COc2ccc(C=NNC(=O)CNc3cccc4ccccc34)o2)cc1 1084120381 DBAKCAUTCWGHOC-UHFFFAOYSA-N 429.476 4.583 50 10 IJGE C=C(C)[C@H](CC(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1)OCC 1124293711 BZLYEQPYLCRVAS-FQEVSTJZSA-N 432.973 4.765 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)[C@H](Sc2ccc(F)cc2)c2ccccc2)c1 1154050248 HJIIVQPFUMGZGV-OAQYLSRUSA-N 435.549 4.658 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNc2ccccc2OC(F)(F)F)s1 1155063500 NKGLFAPMRZBGSV-UHFFFAOYSA-N 437.896 4.881 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@@H](OCC2CCCC2)c2ccccc2)c1C 1472514502 NDQVNVIMAHIYHJ-QFIPXVFZSA-N 431.540 4.547 50 10 IJGE C/C(=C\C(=O)NNc1c(Br)cccc1Br)c1ccc(F)cc1 1568130999 OAFZVKLZFRTXGL-MDZDMXLPSA-N 428.099 4.897 50 10 IJGE CCCCCN1C(=O)C(=NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2C)c2cc(C)ccc21 1772720102 CGAUEPWWTWYLIW-QGZVFWFLSA-N 441.959 4.781 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2)[C@@H]1c1ccc(Cl)cc1 1865682969 BZXUFSPTGVUTDO-MRXNPFEDSA-N 430.817 4.822 50 10 IJGE CC[C@@](C)(NC(=O)c1cc(C)n(-c2cccc(C)c2)n1)C(=O)Nc1ccc(SC#N)cc1 1866847882 UIHYEKWPZCOWMJ-XMMPIXPASA-N 447.564 4.600 50 10 IJGE C[C@H](/C(O)=C(\C#N)c1nc(-c2ccccc2Cl)cs1)N1C(=O)c2ccccc2C1=O 1872746467 JIJDYTUOWCGQGP-QCJHYCHESA-N 435.892 4.941 50 10 IJGE CCC[C@@H]1C[C@H]1CO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1897635445 OEIWAAXXSZAOAK-RVKKMQEKSA-N 437.362 4.644 50 10 IJGE Cc1cc(F)cc(C)c1S(=O)(=O)N(Cc1ccccc1)[C@@H](C)CCBr 1915094170 DTRHXNVDMSUJFW-INIZCTEOSA-N 428.367 4.807 50 10 IJGE CC1([C@H](CBr)NCc2c(Br)cccc2Br)CC1 1945370268 ZBQYPRNBYTYQBB-LBPRGKRZSA-N 425.990 4.865 50 10 IJGE C[C@@H]1C[C@H](CBr)CN1C(=O)c1cc(Br)c(Br)s1 1950507823 INPOYPNANZQMSP-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@H](CI)O2)C[C@H]1C1CC1 1990238802 GTDNOYDBPHDUCD-RVKKMQEKSA-N 435.346 4.539 50 10 IJGE CC(C)[C@@H](Br)CN(C)C(=O)c1cc(Br)cc(Br)c1 2048729819 GAFAUHWMCHUHSO-LBPRGKRZSA-N 441.989 4.703 50 10 IJGE CC[C@H](C)[C@H](CI)NCc1ccc(Br)c(F)c1F 2081255856 RRXMLSONUCJZGR-KWQFWETISA-N 432.090 4.667 50 10 IJGE CSCC[C@@H](Cl)CCNC(=O)c1cc(Br)cc(Br)c1 2090381437 FHZZADRHMLHMFR-LBPRGKRZSA-N 429.605 4.692 50 10 IJGE ClCCc1nc2c(Br)cccc2n1[C@]12C[C@H]1CN(Cc1ccccc1)C2 2099679098 NWLYRYGHJIWQFA-KKSFZXQISA-N 430.777 4.811 50 10 IJGE CC(C)(C)OC(=O)NCC1(CNC(=O)[C@@H](Br)C2CCCC2)CCCCC1 2110715584 OLIUNEXGUXHLIL-INIZCTEOSA-N 431.415 4.532 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@H](CCl)C12CCC2 2133822356 UJYWITKXZVGRAX-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE CC(C)(C)C[C@@H](CCl)CNC(=O)c1ccc(I)c(Cl)c1 2156325631 FXSOBSLZYXYNNN-JTQLQIEISA-N 428.141 4.966 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)[C@@H]1CCN(C(=O)OC(C)(C)C)CC12CC2 2185893403 NAESYWDQNWRWPZ-RTBURBONSA-N 437.422 4.887 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Cl)C2 2190671248 QXOTZWVJYQGPAK-OQCKYNKVSA-N 425.523 4.534 50 10 IJGE COc1cc(F)c([C@H](Cl)c2c(Br)c(C)nn2C)cc1Br 2202902553 RXMUFYMBWFVWEK-LBPRGKRZSA-N 426.511 4.729 50 10 IJGE Cc1ccc(C(=O)N2CC[C@@H](Br)CC23CCC3)cc1I 2232830968 OTPAEYRMIMFKPJ-CYBMUJFWSA-N 448.142 4.522 50 10 IJGE CO[C@@H]1CC([C@@H](Br)Cc2ccc(Br)cc2Cl)C[C@H]1OC 2237443319 INZPGAIWBBCWQU-NWANDNLSSA-N 426.576 4.849 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2CCCSC(F)F 2279135452 PUEVTDZGBOYPBD-UHFFFAOYSA-N 434.652 4.865 50 10 IJGE O=C(c1ccc(Cl)c(I)c1)N1CCC(CCCCl)CC1 2283659973 AZUKWCPGFZZOOL-UHFFFAOYSA-N 426.125 4.816 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@H](Br)CC12CC2 2285834991 HKJGYTWTDYNKBY-QMMMGPOBSA-N 425.523 4.774 50 10 IJGE ClCCCSCCNCc1ccc(I)c(Br)c1 2306219178 JFUGQRVCKDLPCI-UHFFFAOYSA-N 448.595 4.505 50 10 IJGE CC1=C(C#N)C(=O)N(CCc2ccccc2)C(=O)C1=CNc1c(Cl)cccc1Cl 2314579168 LJQJTZNQOIDXIA-UHFFFAOYSA-N 426.303 4.741 50 10 IJGE CCCCCCCOc1ccc(C=C2C(=O)N(C[C@@H]3CCCO3)C(=O)C(C#N)=C2C)cc1 2314617762 AFNGADLKZWDVLB-QFIPXVFZSA-N 436.552 4.807 50 10 IJGE Brc1ccc(CN2C[C@H]3CC[C@H]2C[C@H]3Br)c(Br)c1 2315481567 WQXZYEKNTKOOSL-SCDSUCTJSA-N 438.001 4.959 50 10 IJGE N#CC(=CN(CCO)Cc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1 2318463254 ZOMBQGFWGXMKDE-UHFFFAOYSA-N 429.545 4.678 50 10 IJGE CCCOc1ccc(-c2csc(C(C#N)=C(O)CN3C(=O)c4ccccc4C3=O)n2)cc1 2331318485 QSGUOCXMVPJYIX-UHFFFAOYSA-N 445.500 4.688 50 10 IJGE CC[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CN1CC1(CBr)CC(C)(C)C1 2345009464 DWCUKJCUEJZORF-YESZJQIVSA-N 429.443 4.765 50 10 IJGE FC(F)(F)c1ccc(CBr)c(N2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)n1 2369843943 YMVBFTWOONXFLD-CALCHBBNSA-N 440.307 4.849 50 10 IJGE CC[C@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)COc1cccc2ccccc12 10683590 VWCLHBSXQZYSGW-GCJKJVERSA-N 434.536 4.737 50 10 IJGE O=C([C@@H](Cl)c1ccccc1)N1CCC2(CC1)SCC(=O)N2c1ccc(Cl)cc1 34924419 XQTSJYXPSTZKEU-IBGZPJMESA-N 435.376 4.719 50 10 IJGE O=C1COc2ccc([C@H](Br)c3cc(Br)ccc3Cl)cc2N1 40288728 FLYPRZNNFWMLKE-HNNXBMFYSA-N 431.511 4.918 50 10 IJGE Cc1c(C(=O)Oc2ccc3ccccc3c2)oc2c1/C(=N/NC(=O)c1ccccn1)CCC2 40814263 QAYBYJNUZUIWJE-VFCFBJKWSA-N 439.471 4.826 50 10 IJGE CCOc1cc(/C=N/NC(=O)CC[C@@H](O)c2ccccc2)ccc1OCc1ccccc1 58887356 BKVODXRRQGEUTK-MORQCWLFSA-N 432.520 4.628 50 10 IJGE ClCCOCCOc1c(Br)cc(Br)cc1Br 110869443 FWBCQMHYMLHCAL-UHFFFAOYSA-N 437.353 4.608 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1Br)c1cc(Br)c(Br)s1 122898633 KKLKHICNKNHMPV-XPUUQOCRSA-N 446.002 4.709 50 10 IJGE CC(C)(CCBr)NC(=O)c1cc(Br)cc(Br)c1 232519967 NMLHCZJBQLSMNL-UHFFFAOYSA-N 427.962 4.505 50 10 IJGE COc1ccc(S(=O)(=O)N(Cc2ccccc2)Cc2ccccc2)c(CCCl)c1 309586543 ZZXLMADMSNVIKD-UHFFFAOYSA-N 429.969 4.868 50 10 IJGE Cc1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CCl)cc1I 382702426 PKJFIBOOAWTCCL-UONOGXRCSA-N 435.733 4.789 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccc([C@@H]2CCc3ccccc3N2S(N)(=O)=O)cc1 616596666 WQDLYXZIHWSZIF-NRFANRHFSA-N 432.662 4.906 50 10 IJGE CC[C@H](O[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1)C1CCC1 719658314 UFZDGUUHXFTUTN-MAUKXSAKSA-N 437.362 4.786 50 10 IJGE O=C(N[C@@H](CCCl)C1CCCC1)c1cc(Cl)ccc1I 725045128 VHBBBMKDZJOBCX-AWEZNQCLSA-N 426.125 4.862 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])cc1Br)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 741442629 MMTAIRGNPUFWAW-NWDGAFQWSA-N 446.175 4.965 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@H](Cc2nccn2C)c2ccccc2)c(C)n1CC(C)C 744376266 WIGGYMOQEQVAAF-AKKXDVJXSA-N 429.568 4.502 50 10 IJGE O=C(NNc1cc(Cl)cc(Cl)c1)C(=O)Nc1nc2c3c(ccc2s1)CCCC3 792440669 BSOKQEQOSGXXGK-UHFFFAOYSA-N 435.336 4.564 50 10 IJGE CC(C)(C)OC(=O)NCc1cccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1 799401059 MDBBWVAFMWCJKJ-UHFFFAOYSA-N 449.433 4.750 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc(-c3cccnc3)nc3ccccc23)c(C(F)(F)F)c1 799749472 HLCORSANYLCURS-UHFFFAOYSA-N 433.393 4.944 50 10 IJGE C[C@H](Cc1ccccc1Cl)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 918581939 BSONEENIELSZRS-AFDUHFSSSA-N 443.938 4.772 50 10 IJGE C=CC[C@H]1CCCC[C@H]1NC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1 1687035979 FKQCOUBMFGWYHD-PGRDOPGGSA-N 441.959 4.998 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(C)cc2)cc1OCC 1865687957 DZMHGRASUDIKKN-XMMPIXPASA-N 444.535 4.895 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccccc2)cc1OC 1865697210 PQKNLDFWQXUKHE-DEOSSOPVSA-N 444.535 4.646 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc3ccccc23)[C@H]1c1ccncc1 1865701755 DQXULSIBJQZOBZ-SFHVURJKSA-N 433.393 4.657 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)CCC(=O)c3ccc(Cl)cc3)c(C)n2)cc1C 1865756334 SHADZCWRHYJHKQ-UHFFFAOYSA-N 449.938 4.751 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1sncc1Br 1915738522 DBEYPXJQYVLBLT-UHFFFAOYSA-N 432.181 4.722 50 10 IJGE Cc1cc(Br)sc1[C@H](Br)c1cn(C)c(Br)n1 1939448908 DBEKNNKGWIVGFI-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(c2ccccc2)CCN(C[C@H](CBr)C2CCC2)C1 1966413744 DEOZSRREHWLFGF-PGRDOPGGSA-N 437.422 4.924 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ncc(Br)cc1F 1979831119 LVEGPUQNZLRGOW-CYBMUJFWSA-N 444.142 4.799 50 10 IJGE C[C@@]1([C@H](Br)c2cc(Br)sc2Br)COCCO1 1992639927 YQQAQYIJISOQIY-SCZZXKLOSA-N 434.975 4.515 50 10 IJGE C[C@H]1C[C@@H](CBr)CCN1c1ncc(Br)cc1Br 2004847901 WFTHFWUFBVJOGT-IUCAKERBSA-N 426.978 4.606 50 10 IJGE O=C(N[C@H](CBr)CC1CC1)c1c(Br)cccc1Br 2033091827 WAUGJVADQDUMFA-VIFPVBQESA-N 439.973 4.505 50 10 IJGE CCCC(CBr)(CCC)CN=[S@](C)(=O)C1CN(C(=O)OC(C)(C)C)C1 2044697213 SHEDOTAOCTUNFX-RUZDIDTESA-N 439.460 4.685 50 10 IJGE CCC[C@@H](Br)c1cn(-c2cc(Cl)ccc2I)nn1 2057429889 UELLBASZLXLIRD-SECBINFHSA-N 440.510 4.761 50 10 IJGE CCc1nc(Br)c(Br)n1Cc1ccc(CBr)cc1 2062787655 IBSIUMMBSDVYAR-UHFFFAOYSA-N 436.973 4.914 50 10 IJGE CC[C@H](Cl)[C@@H](CC)NC(=O)c1ccc(Br)cc1I 2086152267 ZFDSVPJYRMDKDD-CMPLNLGQSA-N 444.538 4.580 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](C(C)(C)C)CN(C[C@H](Br)C(F)(F)F)C1 2108377573 SPLYYQYWCMPPSH-IHRRRGAJSA-N 445.364 4.821 50 10 IJGE ClCCc1nc2cncc(Br)c2n1Cc1cscc1Br 2154093668 RBPUFPJWGNMDOM-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CCN(C(=O)c1ccc(CBr)cc1)[C@@H]1CCC[C@H]1CNC(=O)OC(C)(C)C 2162915153 JJYRACZAFCYKBP-ZWKOTPCHSA-N 439.394 4.737 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]2CC[C@H](C1)N2C[C@@H](CBr)c1ccccc1 2163063027 OCYAALMBQCSBHF-RSPOEFSDSA-N 437.422 4.933 50 10 IJGE CC(C)(C)OC(=O)NCC(C)(C)C1CCN(C(=O)[C@@H](Br)C2CCCC2)CC1 2167033784 OZWBISCVGNXMHD-KRWDZBQOSA-N 445.442 4.730 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@]2(F)CCC[C@]2(CBr)C1 2176641185 SAECQLNAIZSIRZ-QWHCGFSZSA-N 445.579 4.893 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)ccc2n1C[C@@H]1COCCN1Cc1ccccc1 2194650109 QAWZYXLPUJGHTQ-CRAIPNDOSA-N 448.792 5.000 50 10 IJGE BrC[C@@H]1C[C@@H]2CCCC[C@H]2N1C[C@H]1CC1(Br)Br 2217338228 YYDKWYSELVQDMD-WHOHXGKFSA-N 430.022 4.520 50 10 IJGE CCN(C[C@@](C)(CI)OC[C@@H]1CCC1(C)C)C(=O)OC(C)(C)C 2243126526 JYEFIORPJBXXAG-KBXCAEBGSA-N 439.378 4.890 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H](Br)[C@H]2CC3)c(I)c1 2318544782 BITYWEJIXFEVNQ-OUCADQQQSA-N 440.550 4.835 50 10 IJGE CCc1nn(CC)c(CN[C@@H](CCCl)COCc2ccccc2)c1Br 2320520339 GJPXCOWETBYBRP-INIZCTEOSA-N 428.802 4.532 50 10 IJGE CC(=NNC(=O)c1ccc(-c2ccc(Cl)cc2Cl)nc1C)c1ccc(O)c(O)c1 2321276069 QIDOYYIAOXDCDE-UHFFFAOYSA-N 430.291 4.929 50 10 IJGE N#CC(=CN1CCN(c2ccccc2F)CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1 2325141496 MAKJUUHXSVSMRI-UHFFFAOYSA-N 442.494 4.786 50 10 IJGE ClC1C[C@@H]2CC[C@H](C1)N2Cc1ccc(I)c(Br)c1 2325221770 IARDVKRAIMDXFO-YOGCLGLASA-N 440.550 4.788 50 10 IJGE CC(=O)Nc1ccc(CC(O)=C(C#N)c2nc(-c3ccc4c(c3)OCCO4)cs2)cc1 2331329788 HUDPFVKSLSPRSA-UHFFFAOYSA-N 433.489 4.575 50 10 IJGE CC(C)CCOc1ccc(C(=O)NNC(=O)c2ccccc2Cl)cc1Br 14645612 LNLPAOLMLGPFFI-UHFFFAOYSA-N 439.737 4.602 50 10 IJGE COc1ccccc1/C(C#N)=C\c1cccc(OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1 31902752 GPPLTFAUCWPVBM-MFOYZWKCSA-N 445.387 4.795 50 10 IJGE Cc1ccc2nc(Nc3ncnc(NNC(=O)c4cccc5ccccc45)c3N)sc2c1 40783574 XVVYNBGMBPWBDD-UHFFFAOYSA-N 441.520 4.631 50 10 IJGE CCN(C(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(OC)cc1)CCC2)c1ccccc1 40813884 PXOOFWLDFNYSAW-SZXQPVLSSA-N 445.519 4.734 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCCc2ccccc2)ccc1OCCc1ccccc1 40889446 PDDQKMNISXONKX-MOHJPFBDSA-N 426.516 4.583 50 10 IJGE C[C@@]12CC[C@@H]3c4ccc(O)cc4CC[C@@H]3[C@@H]1CC/C2=N\NC(=O)c1ccc([N+](=O)[O-])cc1 59502060 KEQULFQWPVKPAT-HYXZUXOASA-N 433.508 4.943 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Cl)c3c(F)cccc3Br)cc2[nH]1 161208802 ZVSUZHRGWAOIFK-CYBMUJFWSA-N 434.490 4.849 50 10 IJGE CN(C)c1ccc(C=NNC(=O)Cc2csc(Nc3cccc(C(F)(F)F)c3)n2)cc1 252626751 REXNHMYDDYSSLJ-UHFFFAOYSA-N 447.486 4.664 50 10 IJGE CCn1c(C)nc2cc(C(=O)NN=Cc3sc(Nc4ccccc4)nc3Cl)ccc21 254754061 BMTACQCCAAJMOL-UHFFFAOYSA-N 438.944 4.982 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)c1C 302891454 GRZJDSQZRZFGIO-SYERDGIWSA-N 435.524 4.900 50 10 IJGE Cc1cc([C@@H](Br)c2cnn(C)c2I)sc1Cl 379197004 GENZYRMGCBLRFV-QMMMGPOBSA-N 431.524 4.532 50 10 IJGE CO[C@]1(CC(CBr)(CBr)c2cccc(Cl)c2)CCOC1 692461446 GLFJDKWMUKGUOW-HNNXBMFYSA-N 426.576 4.563 50 10 IJGE O=C1Cc2cc([C@H](Br)c3occc3Br)c(Br)cc2N1 696528353 NDOANPWLMXNXEI-LBPRGKRZSA-N 449.924 4.784 50 10 IJGE O=C(NNc1ccc(OCC(F)(F)F)cc1)c1ccc(-c2cccc(Cl)c2)nc1O 1545924751 NWNIHBCUWTUVBU-UHFFFAOYSA-N 437.805 4.806 50 10 IJGE C=CC(C)(C)CCNC(=O)NNC(=O)c1ccc(COc2ccc3ccccc3c2)cc1 1637227766 BYFDFJVTTIZLID-UHFFFAOYSA-N 431.536 4.965 50 10 IJGE CCN(C(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc(F)cc1)CCC2)c1ccccc1 1772745030 OYVWRQDVOPHWRS-UHFFFAOYSA-N 433.483 4.864 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc3ccccc23)[C@H]1c1cccc(O)c1 1865681160 GNEFOQUOOZMTTC-IBGZPJMESA-N 448.404 4.968 50 10 IJGE CCCc1nn(-c2cccc3ccccc23)c2c1[C@H](c1ccc(O)cc1O)C(C#N)=C(N)O2 1865681284 JLDNMZKNRDJLBG-HSZRJFAPSA-N 438.487 4.607 50 10 IJGE Cc1ccc(C)c(Cn2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2cccc(Br)c2)c1 1865683888 KLLUARDXTOYXLB-NRFANRHFSA-N 449.352 4.837 50 10 IJGE COc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(Cl)c(Cl)c2)c1 1865711610 COXGGJDILZBWHJ-IBGZPJMESA-N 427.291 4.714 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)/C=C/c3cccc(OC(C)C)c3)c(C)n2)cc1 1865758875 WJEDWMAQNCNVTD-LFIBNONCSA-N 443.547 4.881 50 10 IJGE N#C/C(=C\c1ccc(Cl)cc1)C(=O)Nc1ccc(I)cc1F 1866127798 GXKZLGAGWPFOSW-YRNVUSSQSA-N 426.616 4.629 50 10 IJGE CC(C)C[C@H](CBr)CN1CCC(CNC(=O)OCc2ccccc2)CC1 1905524385 LPXJVUOLMWEIPC-HXUWFJFHSA-N 425.411 4.682 50 10 IJGE C[C@H]1CCN(Cc2ccc(Br)cc2Br)C[C@H]1Br 1943851829 TWJYGIRAXKRUMB-TVQRCGJNSA-N 425.990 4.817 50 10 IJGE CN(C(=O)c1csc(Br)c1Br)[C@@H]1CCC[C@H]1Br 1945186467 HZUCKNGTFFBNNM-HTQZYQBOSA-N 446.002 4.661 50 10 IJGE CC[C@H](Cl)C(=O)Nc1cc(Br)c(Br)c(Br)c1 1976933358 OLLMLHRJUSDWAC-QMMMGPOBSA-N 434.353 4.930 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CCCC[C@H](Br)C1 2050108587 QUDOUJBGQKRHJL-JTQLQIEISA-N 439.973 4.601 50 10 IJGE CC(C)(CCl)[C@H]1CCCN1c1ncc(I)cc1Br 2069536060 PFQQXWWLZLAUQS-LLVKDONJSA-N 443.554 4.683 50 10 IJGE CN(C(=O)OC(C)(C)C)C1CCC(N(C)C(=O)[C@H](Br)C2CCCC2)CC1 2110715565 OGDNCNDRSBBEHQ-OFLPRAFFSA-N 431.415 4.577 50 10 IJGE CN(Cc1ccccc1)[C@@H]1CCCCN(c2nc3sccn3c2CBr)C1 2112859561 SYDKQDDJGHHUGC-QGZVFWFLSA-N 433.419 4.782 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1Cc1ncc(Br)s1 2151781015 WRXGMNQMRWSJDT-LURJTMIESA-N 436.560 4.761 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@@H]1CCCCN1CCCCCCBr 2223278387 LPWLWHFJWHZEHX-HNNXBMFYSA-N 427.374 4.956 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1CCC[S@](C)=O 2234059632 JUORIODICOXGTH-FHZGZLOMSA-N 442.604 4.630 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1[C@@H]1COC[C@H]1F 2234067400 OAXHMQNFHOVKKB-PNLAZUSQSA-N 426.511 4.771 50 10 IJGE CC(C)(C)OC(=O)NCCCN(CCCCI)Cc1ccccc1 2241522685 LCFVRWLMOFJHBJ-UHFFFAOYSA-N 446.373 4.619 50 10 IJGE COc1cc(F)c(CBr)c(N2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)c1 2283392412 RTALCYZNBKGMKM-HDICACEKSA-N 433.365 4.973 50 10 IJGE C[C@]1(CBr)CCCN1Cc1ccc(Cl)c(I)c1 2300239588 ACHRMZKZAZATKT-CYBMUJFWSA-N 428.539 4.694 50 10 IJGE CC(C)(CI)CN1CC[C@@H](NC(=O)OC(C)(C)C)c2ccccc21 2306819543 VRWYEUDVWYAHTQ-OAHLLOKOSA-N 444.357 4.924 50 10 IJGE Cc1ccc(NC(=O)C(C#N)=Cc2cc(Br)cc(Br)c2O)cc1 2313518564 JHTALYALUZLMPW-UHFFFAOYSA-N 436.103 4.771 50 10 IJGE CCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2326917341 OPCUADYXTRPFGG-PBHICJAKSA-N 425.358 4.518 50 10 IJGE CC(C)C[C@H](CBr)CN=[S@](C)(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2328519472 SJHQKNVEHKJLPO-WHEFHEQHSA-N 439.460 4.541 50 10 IJGE CCCCCOc1ccc(C=NNC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1OC 2328822743 LWQOPDVUEZMFAH-IBGZPJMESA-N 449.592 4.654 50 10 IJGE N#CC(=Cc1cccc(Br)c1)C(=O)NCCc1nc(-c2ccccc2)cs1 2329694710 ZCRAFRJWRXSJTI-UHFFFAOYSA-N 438.350 4.838 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@H](NC(=O)OC(C)(C)C)C(F)(F)CC2)C1 2345005437 YNVCYMXNNZVAFA-AWEZNQCLSA-N 439.385 4.812 50 10 IJGE Cn1cc(I)c(CC(CCl)(CCl)c2ccccc2Cl)n1 2367621002 HYPGVRJYBAINOI-UHFFFAOYSA-N 443.543 4.636 50 10 IJGE Cc1cccc(C)c1NC(=O)/C(C#N)=C\c1ccc(Sc2nccn2C)c([N+](=O)[O-])c1 33422223 MUVVYCVFUGOXKJ-BOPFTXTBSA-N 433.493 4.642 50 10 IJGE CCCOc1ccc(/C=C\C(=O)Oc2ccc(/C=C(\C#N)C(=O)OCC)cc2OC)cc1 33629503 KGKOWXGTTJAMNL-DSIZLIJGSA-N 435.476 4.573 50 10 IJGE CC1=C(C#N)C(=O)N(CC(C)C)C(=O)/C1=C\c1ccc(-c2ccc(Br)cc2)o1 38605641 WMRHOXJJWOKTRF-ZDLGFXPLSA-N 439.309 4.957 50 10 IJGE COc1cccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2C)CCC3)c1 40811479 AIEXGGWQBAUGRG-NHFJDJAPSA-N 431.492 4.628 50 10 IJGE COc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2C)CCC3)cc1 40811542 WLYGFSZHHGZSRT-NHFJDJAPSA-N 431.492 4.628 50 10 IJGE CCN(C(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccc1O)CCC2)c1cccc(C)c1 40826497 MVKRARCHYANVJT-NHFJDJAPSA-N 445.519 4.739 50 10 IJGE CC[C@H](C)NC(=O)c1oc2c(c1C)/C(=N/NC(=O)Cc1coc3c(C)c(C)ccc13)CCC2 40826574 MVXWTYDXUPHUSK-GQIVLKDASA-N 449.551 4.879 50 10 IJGE O=C(COc1ccc(-c2ccccc2)cc1Br)N/N=C/c1ccc(F)cc1 40902689 WRNRIKCJTSUHMN-ZMOGYAJESA-N 427.273 4.784 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)CCc2ccc(Cl)cc2)c(OCC)c1 40995343 ZMVKRTBQIFXLPW-QGOAFFKASA-N 427.884 4.747 50 10 IJGE CCC[C@@H](Oc1ccc(Cl)cc1)C(=O)NN=Cc1cc(Br)ccc1O 252600564 DSLJOXWSUWDKAV-QGZVFWFLSA-N 425.710 4.506 50 10 IJGE Cc1ccc(-n2c(SCC(=O)NN=Cc3ccccc3F)nnc2-c2ccccc2)cc1 254518877 FMQNNHYOSISAPW-UHFFFAOYSA-N 445.523 4.624 50 10 IJGE COc1ccc(C(C)=NNC(=O)COc2ccc3ccccc3c2Br)cc1 725396846 WPLRPACZFRNPIX-UHFFFAOYSA-N 427.298 4.530 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)c2cccnc12 726933133 BOCLNDSVGPGXFG-HKWRFOASSA-N 432.487 4.866 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])c2ncccc12)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 770136817 UUMRSJOWMZKFAE-NRFANRHFSA-N 445.397 4.503 50 10 IJGE CC(C)(C)c1ncc(COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)s1 774532562 HQBAIOVAHIKHJM-LDADJPATSA-N 445.548 4.868 50 10 IJGE CCCc1occc1C(=O)NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1 798353273 DMYJQSOAFUEJSH-UHFFFAOYSA-N 426.538 4.945 50 10 IJGE N#Cc1cccc(COc2cccc(C=NNC(=O)c3ccccc3Br)c2)c1 915933501 YDTPOXBODCQBGU-UHFFFAOYSA-N 434.293 4.664 50 10 IJGE CCC[C@@H](C)c1ccc(OCC(=O)NN=Cc2cc(Br)ccc2OC)cc1 1083958279 ORSCHMGSQRPVKW-OAHLLOKOSA-N 433.346 4.890 50 10 IJGE C=CCOc1c(Br)cc(C=NNC(=O)c2cc3ccccc3o2)cc1OCC 1084096008 DFASRVJSAFDAGE-UHFFFAOYSA-N 443.297 4.923 50 10 IJGE O=C(NN=C1C(=O)N(C(c2ccccc2)c2ccccc2)c2ccccc21)c1ccccc1 1084537479 MINFCVMPOVGCQC-UHFFFAOYSA-N 431.495 4.957 50 10 IJGE C#CC[C@@H](CCOC)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc3ccccc23)c1C 1438147440 LSDHNWHBCJDONM-ICBIFTLVSA-N 425.532 4.699 50 10 IJGE C/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl 1524625796 XAATVCCEKXTTLP-ACCUITESSA-N 425.287 4.542 50 10 IJGE C=C(C)CN(Cc1ccc(CO)o1)C(=O)/C(C#N)=C\c1cc(C)n(-c2ccccc2F)c1C 1556558204 PGBUREXGEOKVJL-MTJSOVHGSA-N 447.510 4.830 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)c3cc4ccccc4cc3O)cc2)cc1 1558900597 YMTPIZVVFGSQDW-UHFFFAOYSA-N 440.455 4.615 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNc2ncccc2C(=O)OC(C)(C)C)cc1 1648594571 NUOMEVNYPUHYSB-UHFFFAOYSA-N 446.507 4.740 50 10 IJGE Cc1cc(OC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccnc2)CCC3)ccc1Cl 1772746408 BYADMOJFLCRSIZ-UHFFFAOYSA-N 437.883 4.634 50 10 IJGE Cc1sc(NC(=O)/C(C#N)=C/c2ccccc2)nc1-c1ccc2c(c1)CCC(=O)N2C 1859513688 PSAWUXUSAURNAM-XDHOZWIPSA-N 428.517 4.573 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 1865682093 FVPNCLYLQHUBNE-SFHVURJKSA-N 429.282 4.904 50 10 IJGE Cc1ccc(O)c([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(Cl)c(Cl)c2)c1 1865685903 OEIWDTGWWPNXNT-FQEVSTJZSA-N 441.318 4.779 50 10 IJGE C[C@H]([C@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1)[C@@H](CBr)NC(=O)OC(C)(C)C 1884034202 GLUDYOZOFOXJDC-LVQVYYBASA-N 449.430 4.994 50 10 IJGE Cn1nc(CN(CCCBr)Cc2ccccc2)c(Br)c1Cl 1914628561 VTOMWIHXAOFNOY-UHFFFAOYSA-N 435.591 4.623 50 10 IJGE Brc1cccc([C@H](CI)O[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1 1917453381 MIDPWRSDKJKCFZ-YZAHQLQUSA-N 433.127 4.986 50 10 IJGE C[C@@H]1OCC[C@@]1(CBr)Cc1ccc(Br)cc1Br 1943843259 IBDQAOHCVKIUQI-ZANVPECISA-N 426.974 4.944 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@@H]2CC[C@H]3CC[C@@H]2C3)C1 1947121236 RLGDHLKHQCFEJR-NNFUDEMPSA-N 449.373 4.786 50 10 IJGE O=S(=O)(c1ccc(CBr)c(Cl)c1)N(Cc1ccccc1)C1CCC1 2009621432 FZLLEIPUUCGGMO-UHFFFAOYSA-N 428.779 4.978 50 10 IJGE CCC[C@H](CBr)CN1CC[C@H](C(F)(F)F)[C@H](NC(=O)OC(C)(C)C)C1 2044695250 BQYJYYPQCMBHKN-HZSPNIEDSA-N 431.337 4.575 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[S@](=O)(=NCCCCCCCCCBr)C1 2044700205 PODMSVFBHAQTLD-PUAOIOHZSA-N 439.460 4.877 50 10 IJGE Fc1ccc2nc(CCl)n(Cc3nccn3Cc3ccccc3)c2c1Br 2090024129 VCONGCWYKIKCJW-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@@H](Br)[C@@H]1CCCCS1(=O)=O 2137644667 ZIGHWSFNISNRKX-QWHCGFSZSA-N 430.589 4.814 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)cnc2n1CCc1nccn1Cc1ccccc1 2146217978 SMMYBZLTYMKFPU-CQSZACIVSA-N 444.764 4.981 50 10 IJGE Cn1nc([C@H](Cl)c2cc3c(cc2Br)OCC3)c(Br)c1Cl 2167042869 QUEDPKMGLBTYNX-LLVKDONJSA-N 440.950 4.862 50 10 IJGE CN(C(=O)c1cc(Cl)ccc1I)C1CCC(CCl)CC1 2171093643 GJVDITLXWISQIX-UHFFFAOYSA-N 426.125 4.814 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1c([N+](=O)[O-])ccc(F)c1Cl 2227433045 HJZOVHRITUZRTA-UHFFFAOYSA-N 425.935 4.705 50 10 IJGE O=S1(=O)CCC[C@H]1[C@H](Br)c1cc2sc(Br)cc2s1 2263560381 PZMFJFCOQINVHI-GXSJLCMTSA-N 430.208 4.739 50 10 IJGE Cc1ccc(C=C(C#N)C(=O)Nc2ncc(Cc3ccc(Br)cc3)s2)o1 2296672260 GKLKSPOXWHJHTC-UHFFFAOYSA-N 428.311 4.944 50 10 IJGE CCN(CC)c1ccc(C=C(C#N)C(=O)Nc2sc3c(c2C(=O)OC)CCCC3)cc1 2296690777 FZRRUAJSHNOUJP-UHFFFAOYSA-N 437.565 4.805 50 10 IJGE N#CC(=CNc1ccccc1F)c1nc(-c2cc3cc([N+](=O)[O-])ccc3oc2=O)cs1 2296800825 YCCAOTSYHXGAIZ-UHFFFAOYSA-N 434.408 4.940 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Cl)cc2I)C[C@H]1CBr 2318539438 MBFLMGVTGZIJSZ-ZYHUDNBSSA-N 442.566 4.798 50 10 IJGE Clc1ccc(CN2CC[C@@H](Br)C3(CC3)C2)c(I)c1 2318558099 RDMWXMAXAGWHSH-CYBMUJFWSA-N 440.550 4.694 50 10 IJGE N#CC(=CNCc1ccc(Br)cc1)C(=O)NC(c1ccccc1)c1ccccc1 2324837594 AAKYDYVXMATECF-UHFFFAOYSA-N 446.348 4.852 50 10 IJGE C[C@@H]1C[C@H](Br)CCN(Cc2cc(I)ccc2Cl)C1 2327387876 CHTGAUXOAJKMFJ-ZYHUDNBSSA-N 442.566 4.940 50 10 IJGE COc1cc(C)c(-c2csc(C(C#N)=C(O)[C@@H]3CC(=O)N(C(C)(C)C)C3)n2)cc1C 2331402765 OCGOONLRYWAPPS-OAHLLOKOSA-N 425.554 4.875 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CO[C@]3(C)C[C@H]2C3)cc1I 2337698260 SCOSUPAKLAPCAC-FIXIBIHLSA-N 437.115 4.551 50 10 IJGE C=CC[C@H](Br)[C@H]1CCN1C(=O)c1cc(Br)c(F)cc1Cl 2360965871 ZKSXJBFQSVAWKX-TVQRCGJNSA-N 425.523 4.796 50 10 IJGE CCCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccs2)cc1 38656405 NSSYMPKQMLPGBX-QFIPXVFZSA-N 432.501 4.974 50 10 IJGE O=C(CCCc1c(-c2ccccn2)[nH]c2ccc(Cl)cc12)NNC(=O)Cc1ccccc1 39852764 MNGDBBFKXITKTJ-UHFFFAOYSA-N 446.938 4.596 50 10 IJGE O=C(NNc1ncnc(Oc2ccc3ccccc3c2)c1[N+](=O)[O-])c1ccc(Cl)cc1 40586649 WPBUXIHTCRMYJU-UHFFFAOYSA-N 435.827 4.741 50 10 IJGE O=S(=O)(c1c(Cl)cc(Br)cc1Cl)N1[C@H]2CC[C@@H]1CC(Cl)C2 111391016 NTWLKPQRWUHXJG-PBINXNQUSA-N 433.582 4.679 50 10 IJGE CCC(CC)(CBr)Cn1cc(Br)cc(Br)c1=O 128483378 WRKKJZMXYOPHPP-UHFFFAOYSA-N 429.978 4.575 50 10 IJGE CC[C@@](C)(CBr)NC(=O)c1ccc(Br)cc1Br 233946006 SOXBYXNIFJCWOC-LBPRGKRZSA-N 427.962 4.505 50 10 IJGE CC(C[C@H]1C(C#N)=C(N(C)C)N(c2ccc([N+](=O)[O-])cc2)c2c1n(C)c1ccccc21)=NO 254825292 WANQCCZFLAKNDW-IBGZPJMESA-N 444.495 4.859 50 10 IJGE Cc1nn(CCCCl)c(C)c1S(=O)(=O)N(Cc1ccccc1)Cc1ccccc1 380899574 NUODFDCFURGMLH-UHFFFAOYSA-N 431.989 4.520 50 10 IJGE Cc1ccc([N+](=O)[O-])c([C@H]2CN(Cc3ccccc3)C[C@H]2CI)c1 725388268 KZECZYDFOKUHAI-AEFFLSMTSA-N 436.293 4.554 50 10 IJGE Cc1cc(C)c2nc(C3CC3)cc(C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)c2c1 752806086 MCSYWBUPJGWUPT-UHFFFAOYSA-N 438.535 4.955 50 10 IJGE CN1C(=C(C#N)C(=O)CCc2nc(-c3ccc4sccc4c3)no2)N(C)c2ccccc21 762067541 CZSQJZANVURSEV-UHFFFAOYSA-N 441.516 4.774 50 10 IJGE COc1ccc(OC)c(CCNS(=O)(=O)c2cccc(S(F)(F)(F)(F)F)c2)c1 777907740 ALSNMZFHHLHFLN-UHFFFAOYSA-N 447.447 4.882 50 10 IJGE Cc1onc(-c2ccc(Cl)cc2Cl)c1C(=O)NNC(=O)c1cn(C)c2ccccc12 797797889 KVSAZTKMWIFOTF-UHFFFAOYSA-N 443.290 4.523 50 10 IJGE Cn1nccc1[C@@H]1CCCCN1C(=O)C(=O)Nc1ccc(S(F)(F)(F)(F)F)cc1 799274333 PQVPTBNPCJGTAH-HNNXBMFYSA-N 438.422 4.770 50 10 IJGE Cc1ccc(-n2nc(C)c(C=NNC(=O)c3cccc(Br)c3)c2C)c(C)c1 1084111933 WROCDISQLRKLOB-UHFFFAOYSA-N 425.330 4.632 50 10 IJGE C=CCN(c1ccc(C(=O)NN=C(C)c2ccc(C)cc2)cc1)S(=O)(=O)c1ccccc1 1084489188 ZPHXYWWWEKXEOB-UHFFFAOYSA-N 447.560 4.530 50 10 IJGE CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NNc1ccc(Cl)c(Br)c1 1156736057 GQIFIVGBUKQHLD-SFHVURJKSA-N 434.721 4.510 50 10 IJGE Cc1cccc(NNC(=O)[C@H](C)SCc2nc(O)c3c(C)c(C)sc3n2)c1Cl 1158108276 KWXVADSHQGTXLF-LBPRGKRZSA-N 436.990 4.741 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc3ccc(C(F)(F)F)cc3nc2O)cc1C(F)(F)F 1545923454 UCXAGOJANBSERQ-UHFFFAOYSA-N 440.303 4.607 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)cc1OCC 1865687032 HUUZVTZNLPYRKF-DEOSSOPVSA-N 444.535 4.977 50 10 IJGE Cc1ccc(COc2ccc([C@@H]3C(C#N)=C(N)Oc4c3c(C)nn4CC(C)C)cc2)cc1 1865694205 VQOBHPXOJGEPPA-XMMPIXPASA-N 428.536 4.953 50 10 IJGE COCCc1nc(Nc2ccc(SC#N)cc2)cc(N2CCO[C@H](c3ccccc3)C2)n1 1868253451 HYGXTLCRMCAXOD-NRFANRHFSA-N 447.564 4.560 50 10 IJGE CC(C)(C)OC(=O)NCC1CCC([C@@H](CBr)NC(=O)OC(C)(C)C)CC1 1880762176 TVOGTOFWNWLOTP-YMAMQOFZSA-N 435.403 4.606 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc(Br)cc1 1902777655 NWWKZGMEHAVTAD-QGZVFWFLSA-N 441.163 4.549 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@@H](O[C@H]2CCC3(CCCC3)C2)C1 1902886350 SFMJKHLZLGRUMF-KKUMJFAQSA-N 435.346 4.539 50 10 IJGE COCC(C)(C)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)cc(CCl)c1F 1915483189 BKFKJEYUKVPCMF-UHFFFAOYSA-N 434.360 4.834 50 10 IJGE CS(=O)(=O)c1ccc(N(Cc2ccccc2)C2(CBr)CCC2)c(F)c1 1915762030 CFMIWEUUJIARPS-UHFFFAOYSA-N 426.351 4.553 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)c1ncc(Br)cc1Cl 1916346764 DVEKLASIPPYULR-AWEZNQCLSA-N 448.586 4.914 50 10 IJGE Brc1ccc(Br)c(C[C@@H]2CCOCC[C@H]2Br)c1 2006499065 HWGYORZNZLLSPA-TVQRCGJNSA-N 426.974 4.944 50 10 IJGE C[P@]1(=O)C[C@@H](Br)[C@H](Cc2ccc(I)c(Cl)c2)C1 2026559708 CPQUKMUPJVLUEA-VHCOLVSPSA-N 447.478 4.873 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@@H]1CCN(Cc2ccccc2)C1 2096785650 ZBYZKWIPLIYGOW-MRXNPFEDSA-N 433.781 4.731 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]12CC[S@](=O)(=NCC1(CBr)CCCC1)C2 2106788323 ORSWQJCOGVIPSG-AFMDSPMNSA-N 449.455 4.583 50 10 IJGE CS(=O)(=O)C1([C@@H](Br)c2cc(C3CC3)c(Br)s2)CCC1 2110377446 FFMVXPJYBHWOQL-NSHDSACASA-N 428.211 4.791 50 10 IJGE CCCC(=O)[C@@H](Br)Cc1ccc(C(F)(F)F)cc1I 2139266262 HZVSUZDOATWPCE-JTQLQIEISA-N 449.048 4.985 50 10 IJGE Cc1cnc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)c(CBr)c1 2159669441 DASMPWXNPCIQHW-ZDFPQIBNSA-N 426.402 4.632 50 10 IJGE Cc1c(Cl)cc(CN2C[C@@H](CBr)OCC2(C)C)cc1Br 2167523509 IEYXDYFEBPYEJF-GFCCVEGCSA-N 425.592 4.785 50 10 IJGE CN(C[C@@H]1CCCCN1Cc1ccccc1)c1cc([N+](=O)[O-])ccc1CBr 2176906976 RIKMTZVMOCRIGY-FQEVSTJZSA-N 432.362 4.981 50 10 IJGE CN(CC1CC(Br)C1)C(=O)C(C)(C)c1ccc(NC(=O)OC(C)(C)C)cc1 2196908650 YTYAYFUNJZCXFJ-UHFFFAOYSA-N 439.394 4.943 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2CCC[C@H](C1)[C@@]21CC[C@](C)(CI)O1 2249370458 VCNYSHGQBLHFEA-LKKZHYCFSA-N 449.373 4.833 50 10 IJGE CCN(CCCCBr)C(=O)c1ccc(Cl)c(I)c1 2256394092 XKWHIAYDNOAYTI-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE Cc1c(Br)sc([C@H](Cl)[C@H]2C[C@H](S(C)(=O)=O)C2)c1Br 2257536891 ZEAAXLWHIVFVIX-ZXFLCMHBSA-N 436.618 4.685 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@@H](Br)c1c(Br)cnn1C 2264367176 RNXFJWJPZCIXKS-LLVKDONJSA-N 428.939 4.982 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C[C@@]23CCCOC3)cc1I 2269547773 DRKLWIYNSFCWKT-TUKIKUTGSA-N 437.115 4.553 50 10 IJGE COc1cccc(N(C)Cc2ccc(I)cc2)c1CBr 2280335536 MSWHGURSQTVAEP-UHFFFAOYSA-N 446.126 4.831 50 10 IJGE N#CC(=CNc1ccc(O)c(C(=O)O)c1)c1nc(-c2ccc(Br)cc2)cs1 2297510257 ZFBGPIZFYIBJNP-UHFFFAOYSA-N 442.294 4.953 50 10 IJGE CC1(C)CCCN(Cc2sccc2I)[C@H]1CBr 2301073195 GHAOZGOLFWMBNN-LBPRGKRZSA-N 428.177 4.738 50 10 IJGE CCN(CCCCBr)C(=O)c1ccc(Cl)cc1I 2317775068 UILBRIBZNZFJFG-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE CCOC(=O)c1ccc(CNC=C(C#N)C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1 2325141616 NFFVSIGJEGNZHR-UHFFFAOYSA-N 441.487 4.791 50 10 IJGE CC(C)[C@@H]1[C@H](Cl)CCN1Cc1ccc(I)c(Br)c1 2325210071 VBKPYQXIKBEIDX-TZMCWYRMSA-N 442.566 4.891 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)[C@@H](CCl)CC1CC1 2325210763 BISCPTFLVOBELF-GFCCVEGCSA-N 442.566 4.893 50 10 IJGE ClCc1cncc(OCc2ccc(I)c(Br)c2)c1 2325377604 YZQIYFUCTYCKFS-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE COc1cc(F)c([C@H](Cl)c2c(Br)c(Br)nn2C)c(F)c1 2364063803 LZABPVNBEFRAPT-JTQLQIEISA-N 430.474 4.560 50 10 IJGE Cc1nsc(Br)c1C(=O)N(C)CC[C@H](Br)c1cccs1 2366244049 ZPDFUFMRWPMWFE-VIFPVBQESA-N 438.210 4.874 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccc(Cl)cc2C)ccc1OCc1ccccc1 13966777 IHHAUIUWPBWYGR-VULFUBBASA-N 438.911 4.765 50 10 IJGE CCOC(=O)/C(C#N)=C1\SC=C(c2ccccc2)C(C#N)=C(N)N1c1ccc(C)cc1 34853162 BWTAZUUSWGIWGQ-ATJXCDBQSA-N 428.517 4.581 50 10 IJGE CCOc1cc(/C=C2/C(=O)N(CC)C(=O)C(C#N)=C2C)ccc1OCc1ccc(C)cc1 38603336 KEQRZZDGBKRKTB-FYJGNVAPSA-N 430.504 4.585 50 10 IJGE Cc1ccc2[nH]c(-c3ccccn3)c(CCCC(=O)NNC(=O)c3ccccc3Cl)c2c1 39852558 BVVIMXNBETVCDC-UHFFFAOYSA-N 446.938 4.976 50 10 IJGE Cc1cc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccn2)CCC3)ccc1Cl 40814358 SRVRFIQTHHDHRN-YZSQISJMSA-N 437.883 4.634 50 10 IJGE CCc1ccc(N(C(=O)/C(C#N)=C/c2ccccc2OC)S(=O)(=O)c2ccccc2)cc1 40977760 GFQCMPPULIHCBT-HEHNFIMWSA-N 446.528 4.587 50 10 IJGE CC1=C(C#N)C(=O)N([C@H](C)c2ccccc2)C(=O)/C1=C/Nc1ccc(Br)cc1 101232597 VXZNAFIPCBDSAV-OOWUWCJESA-N 436.309 4.715 50 10 IJGE COc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)/C=C\c4ccc(C)cc4)ccc32)c1 205641539 NERVJLNDTKMNAS-ZHKVRBCESA-N 438.483 4.841 50 10 IJGE C=CCOc1ccc2ccccc2c1C=NNC(=O)COc1ccc(CC=C)cc1OC 252608350 HJPQIVYHPNCHBC-UHFFFAOYSA-N 430.504 4.671 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=NNC(=O)c3ccccc3-n3cccc3)o2)cc1 254836601 ZODLLMOBDRXQPP-UHFFFAOYSA-N 427.460 4.678 50 10 IJGE O=C(CSc1nnc(SCc2ccccc2)s1)NN=C/C=C\c1ccccc1 263622279 SLEGIGLFCOOTKS-TVDPLKMHSA-N 426.592 4.738 50 10 IJGE C[C@@H](Br)C[C@H]1CCCCN1C(=O)c1sccc1I 311059284 JMVICAQQJSAOOQ-NXEZZACHSA-N 442.160 4.521 50 10 IJGE CN(Cc1ccccc1)CC1CCN(c2nc3ccccn3c2CBr)CC1 717579963 NXBGZHCFRYNKEG-UHFFFAOYSA-N 427.390 4.578 50 10 IJGE C[C@@H](Br)[C@@H]1CCN(Cc2cc(Cl)ccc2I)C1 719749177 UZFHSLYGYKKARK-NXEZZACHSA-N 428.539 4.550 50 10 IJGE C[C@H]1CCCC[C@H]1OC1(CI)CCN(C(=O)OC(C)(C)C)CC1 725343866 BZPJXCKWMUSDIM-LSDHHAIUSA-N 437.362 4.786 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2cc(O)nc3ccccc23)c(C)n1-c1ccccc1F 754317344 GUEBMUATTRGVNI-UNOMPAQXSA-N 440.478 4.710 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])c2ncccc12)c1cnn(-c2ncccc2Cl)c1C(F)F 770126311 OWCYOOUQNXTWTK-UHFFFAOYSA-N 445.769 4.534 50 10 IJGE CC(C)(C(=O)NNc1cccc(F)c1F)[C@@H](O)c1ccc(OCc2ccccc2)cc1 778931848 GECZXHLBRAHJFG-QFIPXVFZSA-N 426.463 4.747 50 10 IJGE CC(C)[C@H](NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1)C(F)(F)F 787702832 GGFCHZPYVDRSLI-XATQLNLPSA-N 449.864 4.727 50 10 IJGE C[C@@H](Br)CN(Cc1cc(Cl)ccc1I)C1CC1 821945284 QSXLLFCMXBOWGS-SECBINFHSA-N 428.539 4.692 50 10 IJGE CC(CC(=O)NCc1ccc(Cl)cc1)=NNC(=O)Cc1ccc(-c2ccccc2)cc1 1084127266 OPCSRKXKASFCCR-UHFFFAOYSA-N 433.939 4.748 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Br)cc2)c1C)C(C)(C)C 1460801693 MDOWPAVKQBEMGM-UHWDDTASSA-N 438.369 4.928 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2c(-c3c(Cl)cccc3Cl)noc2C)c1 1644011712 MZEVVAYHKNSNFG-UHFFFAOYSA-N 445.331 4.570 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccccc2Oc2cccc(C)c2)cc1 1665492417 NNKNKJPUALBHCX-GOSISDBHSA-N 447.491 4.610 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2Cl)CCC3)nc1 1772743946 LVQIXINYXHEBMF-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccccc2)c1 1865690204 LFVPVZYKDPENAE-GOSISDBHSA-N 440.425 4.567 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)CCCOc3cccc(C)c3)c(C)n2)cc1 1865758484 CKPZEZRGHOPNTB-UHFFFAOYSA-N 431.536 4.548 50 10 IJGE N#C/C(=C\c1cc(Br)cc(Br)c1O)c1nc(O)c2ccccc2n1 1872726982 XJBXOQONMZZDLA-BJMVGYQFSA-N 447.086 4.630 50 10 IJGE C[C@@H](C1CCC(NC(=O)OC(C)(C)C)CC1)[C@H](CBr)NC(=O)OC(C)(C)C 1882086960 GLUDYOZOFOXJDC-LBDPXKHJSA-N 449.430 4.994 50 10 IJGE O=C(c1cc(Br)sn1)N(Cc1ccccc1)[C@H](CBr)C1CC1 1909915446 UMHBJNUGHNCGJF-CQSZACIVSA-N 444.192 4.722 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1ccc(F)c(C(F)(F)F)c1 1916355091 PQJNATWHXBSNPW-OAHLLOKOSA-N 448.254 4.897 50 10 IJGE C[C@H](c1ccncc1Br)[C@@H](Br)c1cn(C)c(Br)n1 1924055077 DSDXCXNEZPSJKT-RDDDGLTNSA-N 437.961 4.580 50 10 IJGE C[C@H]1CO[C@@](CBr)(Cc2c(Br)cccc2Br)C1 1945328214 ZUPKTDPCKNBPBE-NOZJJQNGSA-N 426.974 4.944 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1cc(Br)ccc1F 2010825487 LRVAXNHVHNAKFG-UHFFFAOYSA-N 439.416 4.584 50 10 IJGE C[C@H](Br)[C@H]1CCCN1C(=O)c1csc(Br)c1Br 2018118002 WCMQEPFWOCKSAM-POYBYMJQSA-N 446.002 4.661 50 10 IJGE Brc1ccc(CN2CC[C@@H](Br)C3(CC3)C2)c(Br)c1 2032265480 BFEYSHATNOEPGB-CYBMUJFWSA-N 438.001 4.961 50 10 IJGE CCCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C[C@@H](Br)C(F)(F)F 2044704197 APTLIHAHKIXKHK-ZIAGYGMSSA-N 431.337 4.814 50 10 IJGE O=C(CBr)c1cc(I)c(C(F)F)cc1C(F)(F)F 2060394506 LDGSMEPGMTUUKS-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE Cc1c([C@@H](Br)Cc2cccc(Br)c2)c(Br)nn1C 2067855527 SVKPSMIVPBDNAX-NSHDSACASA-N 436.973 4.932 50 10 IJGE O=C(N[C@H]1C[C@H](CCBr)C1)c1ccc(Br)cc1Br 2078353706 JIZUVPQSIITTQT-CZMCAQCFSA-N 439.973 4.505 50 10 IJGE CC[C@@H](C)[C@H](CBr)NC(=O)c1cc(Br)ccc1Br 2081239491 SUFHBTFZCIJLGP-PELKAZGASA-N 441.989 4.751 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@@H]1[C@H]2C[C@@H]3[C@H]1[C@@H]3C2 2134581738 JNXUHLJRJVSLGQ-YXURMMROSA-N 431.111 4.564 50 10 IJGE Cc1cc(Br)c(C)c([C@@H](Cl)[C@@H]2CCCS2(=O)=O)c1Br 2136380483 UYNUFLLEUCPUAT-GWCFXTLKSA-N 430.589 4.686 50 10 IJGE O=C(c1cccc(Br)c1Cl)N1CC[C@H](Br)C(F)(F)CC1 2150018346 ILCTWPACJHIVBW-JTQLQIEISA-N 431.502 4.737 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](OC)C[C@]1(C)CNC(=O)OC(C)(C)C 2163062714 MNJLHZZNSPFYEC-FXAWDEMLSA-N 449.474 4.972 50 10 IJGE CCn1cc([C@@H](Br)c2cc(Cl)c(F)cc2OC)nc1Br 2207359589 IRPUNVHPLGYSPJ-LBPRGKRZSA-N 426.511 4.951 50 10 IJGE CS(=O)(=O)C[C@H](Br)c1c(Br)cc(Cl)c(Cl)c1Cl 2212843021 BBUDCTQOGHRODW-YFKPBYRVSA-N 445.387 4.890 50 10 IJGE CCN(CC1(CBr)CC(F)C1)[C@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2265637972 HOLXGSFCGBWRQG-YJBCQJRQSA-N 435.422 4.905 50 10 IJGE CC(C)CN(C[C@@H](C)Br)S(=O)(=O)c1ccc(Br)cc1Cl 2288024304 PVRUAHNEMIGUFO-SNVBAGLBSA-N 447.620 4.533 50 10 IJGE COc1ccc(Cl)cc1NC(=O)COC(=O)C(C#N)=Cc1cc(C)n(CC(C)C)c1C 2297363958 KECIKRRKXZGVGS-UHFFFAOYSA-N 443.931 4.512 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@H]1Cc1ccc(Cl)cc1I 2302316004 QDZJQZWRVBXJBO-GBIKHYSHSA-N 429.523 4.676 50 10 IJGE C[C@H]1C[C@H](Br)CN(Cc2ccc(Cl)cc2I)C1 2302326537 QCHHYVFWQAHTFM-ONGXEEELSA-N 428.539 4.550 50 10 IJGE ClCCN(Cc1ccc(I)c(Br)c1)C1CCC1 2306216575 HQDRTQKWPXAESX-UHFFFAOYSA-N 428.539 4.647 50 10 IJGE CN(Cc1cc(I)ccc1Cl)CC1CC(Br)C1 2307328529 OECKIACEEGCMSI-UHFFFAOYSA-N 428.539 4.550 50 10 IJGE Clc1cc(CN2[C@H]3CC[C@@H]2C[C@H]3CBr)ccc1I 2312130718 FUPATEVZXUMENC-WDMOLILDSA-N 440.550 4.692 50 10 IJGE COc1c(Br)cc(C)c([C@H](Br)[C@@H]2C[C@H]2OC)c1Br 2317411161 RXHBLHAUFMJJNK-BCMRRPTOSA-N 442.973 5.000 50 10 IJGE C[C@@H](Br)C1CCN(Cc2ccc(Cl)cc2I)CC1 2318527847 YQPRZFOXJWJTKW-SNVBAGLBSA-N 442.566 4.940 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)[C@@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1C 2331259061 FUJSQJAIUGODSE-CQSZACIVSA-N 445.500 4.605 50 10 IJGE CS(=O)(=O)Nc1ccc(C(O)=C(C#N)c2nc(-c3ccccc3Cl)cs2)cc1 2331265841 GUGYSUCVOVYGHU-UHFFFAOYSA-N 431.926 4.785 50 10 IJGE Cn1cc(C(=O)NNC(=O)c2oc3ccccc3c2COc2ccccc2)c2ccccc21 10736382 GVISULWAGSSRBZ-UHFFFAOYSA-N 439.471 4.578 50 10 IJGE O=[N+]([O-])c1cc(Cl)cc(Br)c1OC[C@@H](Br)C(F)(F)F 96834982 SCMGLTVBBCKGMN-SSDOTTSWSA-N 427.398 4.715 50 10 IJGE O=C(N/N=C/c1c(Cl)ccc(Cl)c1Cl)c1cc(-c2cccs2)nc(O)n1 169923836 MTUIHJBTLQUGGD-IFRROFPPSA-N 427.700 4.635 50 10 IJGE COc1cc(C=NNC(=O)COc2ccc(Cl)cc2)ccc1OCc1ccccc1F 252629613 UJZRIWLIEPWVPR-UHFFFAOYSA-N 442.874 4.596 50 10 IJGE CCn1c(SCC(=O)NN=C(C)c2cccs2)nnc1-c1ccc(C(C)(C)C)cc1 254572756 UBHRETLNAWJGIU-UHFFFAOYSA-N 441.626 4.957 50 10 IJGE O=C(Cn1cc(C=NNC(=O)c2cc3ccccc3o2)c2ccccc21)Nc1ccccc1 254772008 UGHAJCHLIOJIKY-UHFFFAOYSA-N 436.471 4.790 50 10 IJGE Cc1cc(Br)c(C(=O)N(CCBr)CC(F)(F)F)cc1Cl 380477076 KERYHVACCZKDGV-UHFFFAOYSA-N 437.481 4.810 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@@H]1C(C)(C)[C@@]21CCC[C@H](CI)O1 686236018 GMRUYJCMOIJXDX-DEXNDLTESA-N 449.373 4.785 50 10 IJGE CC(C)N(Cc1cc(Cl)ccc1I)C[C@H](C)Br 691366210 QBGRYDSQFIOAHG-JTQLQIEISA-N 430.555 4.938 50 10 IJGE C#C[C@@H]1CCCCN1C(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Br)cc2)c1C 1134915943 QQHJBIHASHIUMU-CKNGIZQFSA-N 436.353 4.778 50 10 IJGE Cn1cc(C(=O)Nc2ccc(Br)cc2CO[Si](C)(C)C(C)(C)C)nc1O 1526903462 KGFCRZWRAGUMHN-UHFFFAOYSA-N 440.414 4.662 50 10 IJGE Cc1ccc(-c2nc(Nc3ccc(SC#N)cc3)cc(N3CCC[C@@H](CO)C3)n2)cc1 1868321124 WATNSYVJMXZABB-GOSISDBHSA-N 431.565 4.978 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1c(C)cc(F)cc1C 1915078497 QVQRXUQEBUBNQS-KRWDZBQOSA-N 428.367 4.807 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1ccc2ccccc2c1O 1916355722 XYKUKUFUTQBXGQ-SFHVURJKSA-N 428.326 4.598 50 10 IJGE Brc1cc([C@H](Br)Cc2ncccc2Br)ns1 1983294707 JARJEHHBYDCHED-SSDOTTSWSA-N 426.959 4.742 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1Cc2ccccc2N(C[C@@H](Br)C(F)(F)F)C1 2106783717 CCIZRRGJNGKJPC-IUODEOHRSA-N 437.300 4.516 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@@H]2C[C@@H](Br)CC[C@H]21 2115927847 GLZNMCATBLZYIO-KHQFGBGNSA-N 427.589 4.942 50 10 IJGE COc1cc(CBr)ccc1S(=O)(=O)N(Cc1ccccc1)[C@@H](C)C1CC1 2123271204 QNBBAPVPTBYQPR-HNNXBMFYSA-N 438.387 4.580 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@@H](CCl)C12CCC2 2133828015 OKOPUMXZIZSKCX-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE Cc1sc(Br)cc1C(=O)NC[C@]1(F)CC[C@@H](CBr)CC1 2178580585 DSGOTMBVJFDVAW-WJONMLJTSA-N 427.177 4.842 50 10 IJGE N#Cc1cc(CBr)ccc1N1CCN(Cc2ccccc2)C[C@H]1C(F)(F)F 2186710995 HIOKIWIMENUADJ-IBGZPJMESA-N 438.291 4.706 50 10 IJGE CC(C)(C)OC(=O)NCCC[C@H]1CCCCN1CCCCCI 2211186589 ADCZJFRFPSCULU-MRXNPFEDSA-N 438.394 4.751 50 10 IJGE Cc1c(F)ccc([C@H](Br)c2cc(I)sn2)c1F 2216948601 ROIKBNHDWQOIFQ-JTQLQIEISA-N 430.055 4.819 50 10 IJGE Fc1ccccc1[C@H](CI)O[C@@H]1CCN(Cc2ccccc2)C1 2244772387 YZAUEYXAHVYYSZ-APWZRJJASA-N 425.285 4.593 50 10 IJGE O=C(NCC1CCN(CCCCCCCBr)CC1)OCc1ccccc1 2245878214 BYFQLELCKOHARO-UHFFFAOYSA-N 425.411 4.970 50 10 IJGE CC(C)(C)OC(=O)N1CCC([S@](C)(=O)=NCCCCCCCBr)CC1 2263164289 GBVYYYLLBBKIDP-VWLOTQADSA-N 439.460 4.829 50 10 IJGE CS(=O)(=O)[C@H]1C[C@H]([C@@H](Br)c2csc3c(Br)cccc23)C1 2285291072 NLMVWDNIEUKBFV-JRKPZEMJSA-N 438.206 4.923 50 10 IJGE BrC[C@H]1Cc2ccccc2CN1Cc1ccc(I)cc1 2296471193 FXMOIZFBAMBWCI-QGZVFWFLSA-N 442.138 4.613 50 10 IJGE Clc1ccc(CN2C[C@H]3CC[C@@]2(CBr)C3)cc1I 2315553211 OZXLDPYJMJXQTJ-FZMZJTMJSA-N 440.550 4.694 50 10 IJGE COCc1ccc(CO[C@@]2(CBr)CCCN(C(=O)OC(C)(C)C)C2)s1 2319550047 ULQJFAGTSFDTKA-GOSISDBHSA-N 434.396 4.576 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc3[nH]c(=N)sc3c2)cc(Cl)c1OCC(C)C 2323597694 MDUBWSNSQZRIIQ-UHFFFAOYSA-N 446.960 4.560 50 10 IJGE CCCN1C[C@@H](Br)[C@H](Cc2cc(I)ccc2Cl)C1 2327407590 SNYJNVLJCLDGJE-DGCLKSJQSA-N 442.566 4.592 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CCC2CCN(CCOCCBr)CC2)CC1 2361103411 WPQADURCXPQZQK-UHFFFAOYSA-N 447.458 4.537 50 10 IJGE CCOC(=O)C1=C(c2ccc(OC)cc2)OC(N)=C(C#N)[C@@H]1c1ccc(Cl)cc1Cl 35576438 RSCJGKZEHYYPPN-SFHVURJKSA-N 445.302 4.784 50 10 IJGE CCCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccco4)ccc32)c1 38685133 CIGGFFXRIDFLIB-QHCPKHFHSA-N 430.460 4.896 50 10 IJGE CCc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccc1OC)CCC2 40813148 DGSKDZNPBBHTSG-VFCFBJKWSA-N 445.519 4.882 50 10 IJGE O=C(Nc1cccc(CCCBr)c1)c1ccccc1I 139443308 ASMXTZRFGGYUDR-UHFFFAOYSA-N 444.110 4.871 50 10 IJGE COc1c(Br)cc(/C=N\NC(=O)c2ccccc2Cl)cc1Br 169886122 DJSQAUPFLIHATR-UWVJOHFNSA-N 446.526 4.638 50 10 IJGE COC(C)(C)CCO[C@H](CI)c1cccc(Br)c1 234694736 IOIJKYHCVXAQKW-CYBMUJFWSA-N 427.120 4.757 50 10 IJGE FC(F)Oc1cc(C(F)(F)F)c(I)cc1CBr 575723257 NXUUKBJGWHXKMI-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE CN(C(=O)c1ccc(Br)cc1Br)C(C)(C)CCBr 688397080 BNKLYDZQVJRNHT-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE O=C(NC1(CBr)CCCC1)c1scc(Br)c1Br 705398679 HBAKUHKQSSXJJP-UHFFFAOYSA-N 446.002 4.711 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1CC[C@@H]2CC[C@H](C1)N2Cc1ccccc1 717413447 UCNOASVICBNKKR-JKSUJKDBSA-N 436.375 4.795 50 10 IJGE CCCOc1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CI)cc1 725401826 WGJJLMMERJTPAA-NVXWUHKLSA-N 445.341 4.861 50 10 IJGE COc1ccccc1Nc1nc2sc(C(=O)NNc3ncccc3Cl)cc2s1 734245706 GDBUSQUGZGGJCL-UHFFFAOYSA-N 431.930 4.915 50 10 IJGE Cc1ccc2c(c1)N(C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1)CC2 746818160 AJFNUAJTLCAGJQ-ZHZULCJRSA-N 441.922 4.922 50 10 IJGE CCOC(=O)C(=NNc1ccc(Cl)cc1)C(C)=NNC(=O)Nc1ccc(Cl)cc1 1088736990 PYDADFWRIJDKAN-UHFFFAOYSA-N 436.299 4.522 50 10 IJGE C=CCOc1cn(-c2ccccc2)nc1C(=O)NNc1ccc(Cl)cc1Br 1301454620 BSBDISXWHQHAKB-UHFFFAOYSA-N 447.720 4.610 50 10 IJGE CC(=O)c1cc(C(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)ccc1C 1350258519 BBLICPSVICOIQZ-UHFFFAOYSA-N 436.895 4.505 50 10 IJGE O=C(CCCCOc1ccc(Br)cc1)NNc1nc2ccccc2[nH]c1=S 1629912512 XUZHAOZTPRFXNZ-UHFFFAOYSA-N 447.358 4.747 50 10 IJGE CCc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)COc1ccccc1)CCC2 1772749512 MFQIRXWKYACIHF-UHFFFAOYSA-N 445.519 4.638 50 10 IJGE CCCc1nn(Cc2ccc(C)cc2)c2c1[C@@H](c1cccc(OCC)c1)C(C#N)=C(N)O2 1865690057 HTTMIRYSAVUKLX-QHCPKHFHSA-N 428.536 4.809 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3CC(C)C)cc1OC 1865696229 YPNRZBLTCVWFLP-QFIPXVFZSA-N 444.535 4.832 50 10 IJGE CC[C@H](NC(=O)[C@H](Cc1ccccn1)c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1866697768 VYNLMZODTGSWIN-PKTZIBPZSA-N 444.560 4.515 50 10 IJGE O=C(c1ccc(Cl)cc1I)N(CCCl)Cc1ccccc1 1888900044 MOTYTNRKBPUIDZ-UHFFFAOYSA-N 434.104 4.826 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@]1(F)CN(CC1(CBr)CCCCC1)C2 1893716213 HGTIQYWWDJDLFB-PMACEKPBSA-N 433.406 4.803 50 10 IJGE O=S(=O)(c1ccccc1N(Cc1ccccc1)[C@@H](CBr)C1CC1)C(F)F 1915189540 QYTWBZIMYAINCW-KRWDZBQOSA-N 444.341 4.863 50 10 IJGE O=S(=O)(c1cc(Br)cs1)N(Cc1ccccc1)[C@H](CCl)C1CC1 1915211146 VBAPUYUHAOYLRW-OAHLLOKOSA-N 434.808 4.719 50 10 IJGE C[C@@H](CCBr)N(C)C(=O)c1cc(Br)c(Br)s1 1917083795 GNYRCHOEYUAIKD-LURJTMIESA-N 433.991 4.519 50 10 IJGE CC1([C@H](CBr)NCc2ccc(Br)cc2Br)CC1 1945367810 GCMORZOVBVGUCE-LBPRGKRZSA-N 425.990 4.865 50 10 IJGE O=S(=O)([C@H]1C[C@H](OCc2ccccc2)C1)N(Cc1ccccc1)C1(CCl)CCC1 1958927873 GAGONQVLLIXXBK-HZCBDIJESA-N 434.001 4.728 50 10 IJGE O=Cc1cc(Br)c(OC[C@H]2C[C@H](Br)C2)c(Br)c1 2020216453 QHNZMWCLORIAPF-KYZUINATSA-N 426.930 4.576 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1Cc1ccc(I)c(Cl)c1 2026564474 UCTMFOFJFVPYPY-MWLCHTKSSA-N 428.539 4.692 50 10 IJGE CC[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)C[C@H]1C(F)(F)F 2058048461 DWBHFDQSJAUIGZ-MJBXVCDLSA-N 431.337 4.670 50 10 IJGE Cc1nn(C)c(Br)c1[C@@H](Br)c1ccc(F)c(Br)c1 2065885239 BGOPXYLRCJEHMA-NSHDSACASA-N 440.936 4.877 50 10 IJGE Cc1sc(Br)cc1C(=O)N(C)C1(CBr)CCSCC1 2114718635 IGXGLFZZGJEKHX-UHFFFAOYSA-N 427.227 4.552 50 10 IJGE Cc1c(Cl)cc(C(=O)NC2CC([C@H](F)CBr)C2)cc1Br 2199058471 OFRSNUQIRGPURF-QDPIBXHXSA-N 427.539 4.652 50 10 IJGE Cc1cc(C(=O)N2CC[C@H](Br)CC23CCC3)ccc1I 2207109177 UAOPWZYBXPCCBC-ZDUSSCGKSA-N 448.142 4.522 50 10 IJGE C[C@H](Cl)c1nc2cncc(Cl)c2n1C[C@@H]1CC1(Br)Br 2224802180 CMHXGKPMZNAUMQ-BQBZGAKWSA-N 427.955 4.891 50 10 IJGE Cc1ccc(I)c(C(=O)NCC(C)(C)CCCBr)c1 2232165536 MPZVNBDTKDMNPW-UHFFFAOYSA-N 438.147 4.531 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC[C@@H]2CCC23CCC3)C1 2247331178 ZXAZVBSVAWNOCY-HNAYVOBHSA-N 449.373 4.788 50 10 IJGE COc1ccc([C@H](Cl)c2csnc2Br)cc1I 2248883588 UGKRWAGGSPGNQH-JTQLQIEISA-N 444.519 4.847 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2CC(C)(C)CO2)cc1I 2257354092 JQRFIDSNDGQKRN-CHWSQXEVSA-N 425.104 4.551 50 10 IJGE COc1ccc([C@H](Br)[C@]2(C)CCCCO2)cc1I 2257364850 MBRBOBUCGHDPBH-KBPBESRZSA-N 425.104 4.695 50 10 IJGE O=C(N[C@@H]1CCC[C@H]1CCBr)c1cc(Br)c(F)cc1Cl 2285959752 VGSQABGLTVHBFQ-ISVAXAHUSA-N 427.539 4.925 50 10 IJGE CSc1ccc(C=C2CNCC3=C2OC(N)=C(C#N)[C@@H]3c2ccc(SC)cc2)cc1 2297504874 HFJDDCKHGKRXBV-QFIPXVFZSA-N 433.602 4.879 50 10 IJGE N#CC(=Cc1ccc(-c2ccc(C(=O)O)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 2314490151 YFUBOQHAZQTEPI-UHFFFAOYSA-N 437.795 4.752 50 10 IJGE Clc1cc(CN2CCC3CC2(CBr)C3)ccc1I 2314890595 GSUSIWAYEXWYIX-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE CCN(C[C@](C)(CBr)OC[C@H]1C[C@H]2[C@@H](C1)C2(F)F)C(=O)OC(C)(C)C 2320844580 FSNRJDNRNMGJKP-ZJOBFFGXSA-N 426.342 4.705 50 10 IJGE C[C@]12CN(Cc3ccc(I)c(Br)c3)C[C@]1(CCl)C2 2325226069 LRKNFBOAFQDZRR-UONOGXRCSA-N 440.550 4.505 50 10 IJGE CCCCCCOc1ccc(/C=N/NC(=O)[C@H](C)Oc2cccc(OC)c2)cc1OC 40960737 KOYDDUGFTSLIRJ-WLXKGNRNSA-N 428.529 4.581 50 10 IJGE O=S(=O)(N[C@H]1CCCCC[C@@H]1Cl)c1c(Cl)cc(Br)cc1Cl 136223069 DJERWOMGBVSEJW-CABZTGNLSA-N 435.598 4.974 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@@H](CCBr)C1 232456733 IDOYESUVUXEFDS-SSDOTTSWSA-N 446.002 4.520 50 10 IJGE O=C(NN=C[C@H]1CC=CCC1)c1ccc(CN2c3cccc4cccc(c34)S2(=O)=O)cc1 254703936 XNCVPDMKJWUVKF-SFHVURJKSA-N 445.544 4.621 50 10 IJGE ClCc1ccc2cc(I)sc2c1I 306627923 ZSPCUMXBBSPKJO-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE O=C1CCc2cc([C@H](Br)c3sccc3I)ccc2N1 311684304 JSSGYDCRTZNSLT-ZDUSSCGKSA-N 448.123 4.722 50 10 IJGE CN([C@@H](CBr)C(C)(C)C)S(=O)(=O)c1ccc(Cl)c(Br)c1 689233586 WKVNOTQYKLMBPE-LBPRGKRZSA-N 447.620 4.533 50 10 IJGE CC(C)[C@@H]1CN(c2ccc([N+](=O)[O-])c(CBr)c2)CCN1Cc1ccccc1 704739843 OKAOAXAQNAJYON-NRFANRHFSA-N 432.362 4.837 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1Cc1cnc(Br)s1 718873898 NOSROMCBDPTMBT-LURJTMIESA-N 436.560 4.761 50 10 IJGE CN(CC1CCN(Cc2ccccc2)CC1)c1nc2sccn2c1CBr 720016849 MQFDETGRRCLUND-UHFFFAOYSA-N 433.419 4.639 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)N[C@@H](c1cccc2ccccc12)C(F)(F)F 776007166 ALHMIQLWYGCNIT-FQEVSTJZSA-N 438.409 4.636 50 10 IJGE CC(C)c1nnc2n1CCN(S(=O)(=O)c1cccc(S(F)(F)(F)(F)F)c1)[C@H]2C 784043087 UBPNEMWNNMHCEK-NSHDSACASA-N 446.467 4.824 50 10 IJGE COc1cccc(C=NNC(=O)c2ccc(CN3CCC(Cc4ccccc4)CC3)cc2)c1 1084633214 JNSNGWMXXGODTK-UHFFFAOYSA-N 441.575 4.914 50 10 IJGE CC(=O)CC(C)(C)CC(=O)NNC(=O)c1cc(-c2ccccc2Cl)nc2ccccc12 1306181620 JYAHNVIDENCBHN-UHFFFAOYSA-N 437.927 4.712 50 10 IJGE CN(C)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccc2)cc1 1865683011 CUSLRGCOZWCSKA-QHCPKHFHSA-N 433.515 4.823 50 10 IJGE CCc1nn(-c2cccc(Cl)c2)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865698764 CDZMVLODUYQMED-NRFANRHFSA-N 429.911 4.798 50 10 IJGE N#C/C(=C\c1ccccc1)C(=O)Nc1nnc(COc2ccc(Cl)cc2Cl)s1 1873693975 UNULLYYLORNLAI-MDWZMJQESA-N 431.304 4.970 50 10 IJGE C[C@H](CC(=O)NC[C@H]1C[C@H](Br)C1)c1ccc(NC(=O)OC(C)(C)C)cc1 1887783539 GFWSISWEUYWEGR-IIAWOOMASA-N 425.367 4.817 50 10 IJGE Brc1cccc([C@@H](CI)O[C@H]2COC3(CCC3)C2)c1 1889722799 QATHZMCDRNBSSU-ZIAGYGMSSA-N 437.115 4.653 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)C(=O)c1cc(Br)ccc1O 1914606980 FIRYCDHHGXYOFR-GFCCVEGCSA-N 427.136 4.581 50 10 IJGE O=C(c1cc(F)c(F)cc1[N+](=O)[O-])N(Cc1ccccc1)[C@H](CBr)C1CC1 1915265970 SQZIMAYLSZCCSD-GOSISDBHSA-N 439.256 4.689 50 10 IJGE C[C@H](c1ccncc1Br)[C@@H](Br)c1cc(Br)n(C)n1 1924063907 XJZUGBVQCMPBBF-JMCQJSRRSA-N 437.961 4.580 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1C(=O)c1csc(Br)c1Br 2018120082 WCMQEPFWOCKSAM-XPUUQOCRSA-N 446.002 4.661 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1C(=O)c1cc(Br)c(Br)s1 2018122769 BASOYSWSNXWEHH-XPUUQOCRSA-N 446.002 4.661 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)c1csc(Br)c1Br 2020197736 DESDGVPYAFEMPJ-LJGSYFOKSA-N 446.002 4.519 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(C[C@@]13CCCOC3)C[C@]2(CBr)C(F)(F)F 2083265408 XUKBARQHWQQHPY-ARFHVFGLSA-N 428.289 4.510 50 10 IJGE O=C(c1sccc1I)N1CCCC[C@@H]1CCCBr 2085689113 XFXKCXGYFBRMHK-SNVBAGLBSA-N 442.160 4.523 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@H](C)[C@@H](NC(=O)C(F)(F)F)[C@@H]1C 2106781014 DPEVQDHCVKLEQT-SOUVJXGZSA-N 429.365 4.745 50 10 IJGE ClCc1ccc(Br)c(N2CC[C@H]3CCN(Cc4ccccc4)C[C@@H]3C2)n1 2120532277 SIQWZUCQVHIPJH-QZTJIDSGSA-N 434.809 4.931 50 10 IJGE Cc1c(Br)cnc2c1nc([C@H](C)Cl)n2CC1CN(Cc2ccccc2)C1 2128499376 YKZBDQWTSCDADD-AWEZNQCLSA-N 433.781 4.934 50 10 IJGE CC(C)(CBr)CN1C[C@H](c2ccccc2)[C@H](CNC(=O)OC(C)(C)C)C1 2129068441 QSPIRYBIWUHCCK-QZTJIDSGSA-N 425.411 4.648 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2ccc(CBr)cc2)C12CCCC2 2162490659 STRYEZSFWAKEER-KRWDZBQOSA-N 437.378 4.634 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(C)CN(C[C@@H](CBr)c3ccccc3)C[C@]2(C)C1 2163060061 ZBAYZFROZZFFBT-QIJUGHKUSA-N 437.422 4.744 50 10 IJGE O=S(=O)(c1cc(Cl)sc1Cl)N(CCBr)Cc1cccs1 2171101636 KPMQHOXZRQVWHS-UHFFFAOYSA-N 435.217 4.702 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)c2ccccc2)[C@H](CC(F)F)C1 2183407159 GRXJTOHRKLUBBK-DLBZAZTESA-N 447.364 4.742 50 10 IJGE C[C@@H](Cl)c1nc2cccc(Br)c2n1C[C@@H]1COCCN1Cc1ccccc1 2194649712 OFKGPYJPRZYZIW-NVXWUHKLSA-N 448.792 5.000 50 10 IJGE Cc1cc(Br)c([C@@H](Br)[C@@H]2CCS(=O)(=O)C2)c(C)c1Cl 2224317819 QZNMHPPAMIPGML-SKDRFNHKSA-N 430.589 4.590 50 10 IJGE C[C@@H]1C[C@@H](Br)[C@@H](C)N(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282971418 CEUYPDHOEQJFRS-NQMVMOMDSA-N 427.539 4.876 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC2(CCOCC2)N(CCCCCCCBr)C1 2294698377 HZHHROYJBMXVIU-GOSISDBHSA-N 447.458 4.870 50 10 IJGE COc1cc(NC=C(C#N)c2nc(-c3ccc4c(c3)OCO4)cs2)c(C(C)=O)cc1OC 2295948552 IZTNPNOJSAEBQM-UHFFFAOYSA-N 449.488 4.735 50 10 IJGE C[C@H]1C[C@@H](CBr)CN1Cc1ccc(Cl)c(I)c1 2300239999 GSHMPFZTHBTPSU-ONGXEEELSA-N 428.539 4.550 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)cc2I)C[C@H]1Br 2302337345 WUHJLDKQWIKDJR-GFCCVEGCSA-N 428.539 4.550 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)c(I)c2)C[C@H]1CBr 2315551256 ORJYEYJKDUVMLJ-LLVKDONJSA-N 442.566 4.798 50 10 IJGE CC1(C)COC[C@]1(CBr)Cc1ccc(Cl)c(I)c1 2315556005 XMMAJBNKCBEFBJ-CQSZACIVSA-N 443.550 4.925 50 10 IJGE C[C@@H]1[C@H](Br)CCN(Cc2ccc(I)c(Cl)c2)[C@@H]1C 2321326627 RLRGQJCSMFRDCP-HOSYDEDBSA-N 442.566 4.938 50 10 IJGE ClCC[C@H]1CCCN(Cc2ccc(I)c(Br)c2)C1 2325224608 YAPVJJZSUKKKTG-LLVKDONJSA-N 442.566 4.895 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C[C@@](C)(CBr)C(C)(C)C)CC(F)(F)C1 2327080856 QSEVDSOMLSIWRS-CXAGYDPISA-N 427.374 4.668 50 10 IJGE C[C@@H]1CN(Cc2cc(I)ccc2Cl)C[C@@]1(C)CBr 2327398374 CUYJRPMNZMPESJ-QMTHXVAHSA-N 442.566 4.798 50 10 IJGE COc1cccc(-c2csc(C(C#N)=C(O)c3cc(OC)c(OC)cc3[N+](=O)[O-])n2)c1 2331248978 MCICIRLGUFDADI-UHFFFAOYSA-N 439.449 4.694 50 10 IJGE COc1cc(OC)c(OC)cc1C=C(C#N)c1nc(-c2ccc3c(c2)OCCO3)cs1 2331452081 FKRKDILADSYHTO-UHFFFAOYSA-N 436.489 4.671 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc2cc(O)ccc2c1 2369677377 LVIMWEZVJSPVDC-HXUWFJFHSA-N 428.326 4.646 50 10 IJGE CC1(C)CC(CBr)(CN2CCN(C(=O)C(F)(F)F)C3(CCCCC3)C2)C1 2371144580 AKQGAXBMNVLDRZ-UHFFFAOYSA-N 439.360 4.597 50 10 IJGE COc1ccc(CN(C(=O)CCl)[C@@H](C(=O)NC2CCCCC2)c2ccccc2F)cc1 3033938 CYPIVPAJONUEFY-HSZRJFAPSA-N 446.950 4.592 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)NNC(=O)COc2ccccc2Cl)c(C(C)(C)C)c1 14661738 HQLINBDZMWZECL-UHFFFAOYSA-N 446.975 4.540 50 10 IJGE Cc1ccc(Sc2ccc(/C=C(\C#N)C3=NN(c4ccccc4)[C@H](N)[C@@H]3C#N)o2)cc1 59137918 UGDYPXUFXOKCTA-KLLTYKNHSA-N 425.517 4.947 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Cl)Cc3ccc(Br)cc3)cc2[nH]1 109884018 GLTQKMQKQKZDEH-LBPRGKRZSA-N 430.527 4.904 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N1CCCC[C@H]1C[C@@H](C)Br 312939720 HPDCDBCEPDGCFL-KOLCDFICSA-N 445.242 4.536 50 10 IJGE Clc1cccc(C(CBr)(CBr)CO[C@H]2CCCOC2)c1 394474281 VHOPIYXHLJZTNG-AWEZNQCLSA-N 426.576 4.563 50 10 IJGE BrCC(CBr)(C[C@H]1CCOC1)c1ccc(Br)cc1 400530298 HMHNISYPCFNEEQ-LLVKDONJSA-N 441.001 4.903 50 10 IJGE Clc1ccc(I)c(CN[C@@H](CBr)C2CCC2)c1 717646936 BPBQWPRYKPLJQE-ZDUSSCGKSA-N 428.539 4.598 50 10 IJGE Cc1cc(C=NNC(=O)[C@@H]2COc3ccccc3O2)c(C)n1-c1ccc(Cl)cc1Cl 725431632 WXCPMGCAIGKPLB-NRFANRHFSA-N 444.318 4.691 50 10 IJGE Cc1cc(C)c(CNC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Cl)cc3)c2C)c(O)n1 728203042 PUBBVCKPVQVURW-YBFXNURJSA-N 434.927 4.688 50 10 IJGE CCOc1ccc(NC(=O)NN=Cc2cccn2-c2ccc(Br)cc2)cc1 1084388537 NRUYAJFXOUGXRI-UHFFFAOYSA-N 427.302 4.794 50 10 IJGE O=[N+]([O-])c1cccc(-n2nc(-c3ccc(I)cc3)cc2CCl)c1 1614817676 ZNCQEOBSNUSQFY-UHFFFAOYSA-N 439.640 4.791 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2ccc(Br)cc2C)cc1)[C@@H]1C[C@H]1C 1625067205 YSSOOWUPSLWPPP-BFUOFWGJSA-N 431.334 4.667 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)s1 1628361617 QSFJHPTZMXMPDZ-UHFFFAOYSA-N 438.018 4.597 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2O)CCC3)c(C)c1 1772752057 STPIRMMDNCHFMR-UHFFFAOYSA-N 431.492 4.633 50 10 IJGE Cc1cc(=O)c(C(=O)Nc2ccc(SC#N)cc2)nn1-c1ccc(Cl)cc1Cl 1859616834 JLMWVTOCVAHREQ-UHFFFAOYSA-N 431.304 4.673 50 10 IJGE Cc1ccc(Cn2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2cccc(O)c2)cc1 1865681292 JOVOOHWXYALRSW-HSZRJFAPSA-N 434.499 4.831 50 10 IJGE CCOC(=O)c1c(-c2ccc(Cl)cc2)csc1NC(=O)CI 1865947558 KDBFTBOSVBNHCP-UHFFFAOYSA-N 449.697 4.619 50 10 IJGE COc1ccc([C@@H](CC(=O)N[C@@H](C)C(=O)Nc2ccc(SC#N)cc2)C(C)C)cc1C 1866763089 YWHWCKBEQBCQPD-UWJYYQICSA-N 439.581 4.850 50 10 IJGE CC(C)[C@@H]1[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C 1881095385 SYUGTMSYAMLDOU-RRFJBIMHSA-N 435.403 4.556 50 10 IJGE O=C(N[C@H](CCl)[C@H]1CC=CCC1)c1cc(Br)sc1Br 1885066660 CTWUHTAYYSVJDT-WCBMZHEXSA-N 427.589 4.967 50 10 IJGE CN(CCN(Cc1ccccc1)S(=O)(=O)c1ccc(CCl)s1)Cc1ccccc1 1931969347 QRBFHSSHYBRAHQ-UHFFFAOYSA-N 449.041 4.810 50 10 IJGE O=C(N[C@@H]1CC[C@H](CBr)C1)c1csc(Br)c1Br 1945189757 ZDMOCNPKJLZXAF-NKWVEPMBSA-N 446.002 4.567 50 10 IJGE Cc1ccc(Br)c(C(=O)N(Cc2ccccc2)[C@H](C)CBr)n1 1961081926 FMPILIIEZNJACI-CYBMUJFWSA-N 426.152 4.578 50 10 IJGE O=C(CBr)c1cc(OC(F)(F)F)c(Br)cc1C(F)(F)F 2054795775 DOJUTINVTRAQIT-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE ClCc1ccc(Br)cc1N1CCCN(Cc2ccccc2)CCOCC1 2088628675 QKSHWZZFFICDBR-UHFFFAOYSA-N 437.809 4.917 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1cc(Cl)ccc1Br 2090386082 WEQSKRZMLAQXOM-SECBINFHSA-N 429.605 4.739 50 10 IJGE Cc1cc2nc(CCl)n(C[C@@H]3COCCN3Cc3ccccc3)c2cc1Br 2194650898 VBIFYRDGOKIBLY-QGZVFWFLSA-N 448.792 4.747 50 10 IJGE CC[C@@H](N)Cc1cc(Cl)cc(Br)c1OCC1CC(Br)C1 2196937900 MJRXZYMFDDKESM-QEIKUCIBSA-N 425.592 4.935 50 10 IJGE CC1CCC(CBr)(OCCOCCOCCOCc2ccccc2)CC1 2227780806 RZPSAFPBVHCKNS-UHFFFAOYSA-N 429.395 4.597 50 10 IJGE CC[C@@H]1[C@@H](CBr)CCN1C(=O)c1cc(F)c(Br)cc1Cl 2282978012 HZWBQYOTLUZQSZ-AMIZOPFISA-N 427.539 4.877 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Br)[C@]12COC[C@H]1C2(F)F 2295366301 YSYGWCSDXCFOQD-USWWRNFRSA-N 432.486 4.829 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Cl)cc2I)C[C@@H]1Br 2302325127 DMRCMPIIVIZKGE-SKDRFNHKSA-N 428.539 4.550 50 10 IJGE COc1c(C(=O)N[C@@H](CCBr)COCc2ccccc2)csc1Cl 2303539212 NALABKZQWYBQNK-ZDUSSCGKSA-N 432.767 4.510 50 10 IJGE ClC1C[C@@H]2CN(Cc3ccc(I)c(Br)c3)C[C@H]2C1 2325207984 FESQRYYGNRTOJZ-GHMZBOCLSA-N 440.550 4.503 50 10 IJGE ClC[C@H]1CN(Cc2ccc(I)c(Br)c2)CC12CC2 2325208587 XEFPMCCNROUSAO-NSHDSACASA-N 440.550 4.505 50 10 IJGE C[C@]12CN(Cc3cc(I)ccc3Cl)C[C@]1(CBr)C2 2327401906 TUEMFSRGBGSDFO-UONOGXRCSA-N 440.550 4.552 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@@H]2CC[C@H](Br)[C@H]1C2 2333996279 JSXVTJCSKWCFMF-OYNCUSHFSA-N 427.589 4.942 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@H](NC(=O)OC(C)(C)C)C3(CCC3)C2)C1 2345008226 MEAPHDZHTJPZPM-INIZCTEOSA-N 429.443 4.957 50 10 IJGE CC[C@H](C)c1ccccc1OCC(=O)NNC(=O)c1ccc(OCc2ccccc2)cc1 14027814 BINHDCRWGKWYAL-IBGZPJMESA-N 432.520 4.619 50 10 IJGE Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2ccccc2OCc2ccccc2)c1 14030794 OZJXNWUPHMOLEM-UHFFFAOYSA-N 432.520 4.537 50 10 IJGE N#C/C(=C\c1c[nH]nc1-c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(Cl)cc(Cl)c1 35518562 WSKDMIKPIWJYBE-UUILKARUSA-N 428.235 4.837 50 10 IJGE CCOC(=O)c1c(NC(=O)N/N=C/c2ccc(C(C)(C)C)cc2)sc(C(C)=O)c1C 40858713 DVWQAZDNEMUVTD-FSJBWODESA-N 429.542 4.889 50 10 IJGE Cc1c(CCBr)cc(-c2ccc(S(C)(=O)=O)cc2)n1-c1ccc(F)cc1 138774833 YANYXOWXOHJDOI-UHFFFAOYSA-N 436.346 4.933 50 10 IJGE CCCCCOc1ccc(/C=N\NC(=O)c2ccc3nc(N)sc3c2)cc1OCC 169916799 HIVCHRQMTIAVII-OYKKKHCWSA-N 426.542 4.610 50 10 IJGE CCCCCCOc1ccc(/C=N/NC(=O)c2cc(-c3ccccc3)nc(O)n2)cc1OC 169923375 ISGDMGMVDRJZSP-YZSQISJMSA-N 448.523 4.581 50 10 IJGE CC(C)(C)C[C@H](Br)CNS(=O)(=O)c1ccc(Br)cc1Cl 226267069 NBDUZBOJNJXFDC-JTQLQIEISA-N 447.620 4.581 50 10 IJGE CCCCOc1ccc(C(=O)NN=Cc2ccc(OC(=O)c3ccc(OC)cc3)cc2)cc1 254593717 NWCYJLHGIDPHSL-UHFFFAOYSA-N 446.503 4.857 50 10 IJGE ClCc1c(I)sc2ccc(I)cc12 307491576 HTVGXSYWPQGSIC-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE C[C@H]1CCCN(c2ncc(Br)cc2Br)[C@H]1CCBr 700290422 DMRWQVLRZLZBCP-CABZTGNLSA-N 441.005 4.997 50 10 IJGE Cc1cccc2c1[C@@H](OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)CCO2 814033069 HBWSTVGEZKALBO-WNPPMXKSSA-N 438.487 4.746 50 10 IJGE Cc1sc2nc(CS[C@H](C)C(=O)NNc3ccc(F)cc3Cl)nc(O)c2c1C 1472216514 OLJBSZAJNUHJNC-SNVBAGLBSA-N 440.953 4.571 50 10 IJGE CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C[C@@H](CBr)C3CC3)C2)CC1 1559992747 HMBSOFPBSHXCLK-RTBURBONSA-N 429.443 4.767 50 10 IJGE CCOc1cc([C@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)ccc1OC 1614687758 CUZXRDWDRFVMQC-RTBURBONSA-N 448.357 4.841 50 10 IJGE CCOc1cc([C@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)ccc1O 1614707134 YUOSZTDDEDPSGZ-QZTJIDSGSA-N 434.330 4.538 50 10 IJGE COc1cc(C=NNC(=O)COc2ccc(C(C)C)cc2)ccc1OCc1ccccc1 1772752781 AMYYAPNWWKGPIV-UHFFFAOYSA-N 432.520 4.927 50 10 IJGE Cc1ccc(C)c(OCC(=O)Nc2cc(C(=O)Nc3ccc(SC#N)cc3)ccn2)c1 1860511876 VCVXASUUVFAELI-UHFFFAOYSA-N 432.505 4.541 50 10 IJGE CCc1nn(-c2ccc(Br)cc2)c2c1[C@H](c1sccc1C)C(C#N)=C(N)O2 1865699037 JCJUNVRJXQHUHJ-MRXNPFEDSA-N 441.354 4.785 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)NNC(=O)c1cc(Cl)cc(Cl)c1 1865757209 RHXCVZVIDQSBPJ-UHFFFAOYSA-N 436.245 4.717 50 10 IJGE CCc1nc(-c2ccc(OC)c(OC)c2)ccc1C(=O)Oc1ccc([N+](=O)[O-])cc1F 1865787860 LLQNQQKSENBHRD-UHFFFAOYSA-N 426.400 4.595 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C[C@@H]2Br)c(OC)c1Br 1910111763 MAPZTKLXILMFIT-WEDXCCLWSA-N 428.946 4.686 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1c(F)ccc([N+](=O)[O-])c1F 1915091010 RTFFWQKDXNPANR-GFCCVEGCSA-N 427.245 4.689 50 10 IJGE O=C(c1ccccc1I)N(Cc1ccccc1)[C@H](CCl)C1CC1 1915207455 IFGJSYXENMYXGR-GOSISDBHSA-N 439.724 4.951 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCC3(CC[C@@H](CI)O3)CC2)C1 1939410357 KOWQJMGUOSFWMV-NNGSBXSVSA-N 435.346 4.540 50 10 IJGE CCN(CCCCBr)C(=O)c1cc(Br)sc1Br 1996952936 DYTRZBCPXSRKQI-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE BrC[C@H]1CN(Cc2ccc(Br)cc2Br)CC12CC2 2031403431 QNXFYHSPQPPKMT-NSHDSACASA-N 438.001 4.819 50 10 IJGE CCCN(CCCBr)C(=O)c1cc(Br)ccc1Br 2032095031 MMJNUYGAGRFQJH-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE O=C1Cc2cc([C@H](Br)C3(Br)CCC3)c(Br)cc2N1 2049229025 KJFANYGJNTYYGI-LBPRGKRZSA-N 437.957 4.697 50 10 IJGE COc1cc(Br)c(C(=O)N(CCCCl)Cc2ccccc2)cc1OC 2068782639 LFWLIDQIZUFFRG-UHFFFAOYSA-N 426.738 4.738 50 10 IJGE C[C@@H]1CC[C@H](C[C@H](Br)c2cc(I)cc3c2OCC3)O1 2104815144 YVRLCVAGBQTZEA-IUPBHXKESA-N 437.115 4.620 50 10 IJGE CS(=O)(=O)C1([C@@H](Br)c2scc(C(F)(F)F)c2Br)CC1 2111593229 LPQYFCYFARPANS-QMMMGPOBSA-N 442.116 4.543 50 10 IJGE CCN(CC)[C@@H](C)CO[C@H](CI)c1cccc(Br)c1 2119217494 HMQCRVBYPXOTPV-SWLSCSKDSA-N 440.163 4.672 50 10 IJGE CC(C)[C@H](CBr)CN1CCC[C@@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2129043062 LKDPWCABKFYLOR-HUUCEWRRSA-N 429.403 4.603 50 10 IJGE Fc1ccc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)c(CBr)c1 2130158655 BUUXFDOWKKQFMF-SFHVURJKSA-N 431.271 4.974 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@H]1[C@H]2C[C@@H]3[C@H]1[C@@H]3C2 2134581736 JNXUHLJRJVSLGQ-YEXBOVADSA-N 431.111 4.564 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)c2ccc(CBr)cc2)n1 2138369918 XRIBBGUBMGBTNR-LLVKDONJSA-N 440.363 4.876 50 10 IJGE CC(C)[C@@H]1CCCCN1S(=O)(=O)c1cc(CBr)sc1Br 2179775702 NNIPETAMJWABJV-NSHDSACASA-N 445.242 4.605 50 10 IJGE CC(C)(C)[C@H]1[C@@H](Cl)CCN1C(=O)c1ccc(I)c(Cl)c1 2185112936 GBBJPUXADIONGQ-GXFFZTMASA-N 426.125 4.813 50 10 IJGE Cc1cc(C(=O)N2CC[C@@H](Br)CC23CCC3)ccc1I 2207109176 UAOPWZYBXPCCBC-CYBMUJFWSA-N 448.142 4.522 50 10 IJGE Clc1ccc(CN2CCC(OCCCBr)CC2)c(Br)c1 2207518912 GZJZXMMINOPZQY-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE C[C@@H](CCCCBr)NC(=O)c1ccc(Cl)c(I)c1 2256389799 MQKNKVLXFKQYRQ-VIFPVBQESA-N 444.538 4.628 50 10 IJGE Clc1ccc(CN[C@@H](CBr)CC2CC2)c(I)c1 2302326009 LWEIQFNDBKFZSO-GFCCVEGCSA-N 428.539 4.598 50 10 IJGE Brc1cccc(CN2CC[C@@H](Br)[C@H]3CC[C@H]32)c1Br 2310810540 SUBTVUVWIDRIJW-NQBHXWOUSA-N 438.001 4.959 50 10 IJGE CCN[C@@H](c1c(F)cc(Br)c(F)c1Br)[C@@H]1C[C@@H]1Br 2313257933 SPCQWMZLVIHLAO-ZWBHMBAVSA-N 447.943 4.924 50 10 IJGE C=CCc1cc(C=C(C#N)C(=O)N(C)C)cc(Br)c1OCc1cccc(F)c1 2313567006 ATLHSLOAAPZUKP-UHFFFAOYSA-N 443.316 4.891 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)C=Cc3ccccc3)cc2)cc1 2313613954 NZMGACZNBYDZPB-UHFFFAOYSA-N 441.531 4.711 50 10 IJGE CCN(C[C@](C)(CBr)OCc1ccc(COC)s1)C(=O)OC(C)(C)C 2319542803 VOKUGQAWRIUPMQ-SFHVURJKSA-N 436.412 4.822 50 10 IJGE COc1ccc(CC(=O)Oc2ccc(C=C(C#N)c3ccccc3OC)cc2)cc1OC 2320507179 AZTAUKVETFJSMW-UHFFFAOYSA-N 429.472 4.925 50 10 IJGE CCCOc1ccc(C=CC(=O)NNC(=O)c2ccc(-c3ccc(C)c(C)c3)nc2C)cc1 2321103697 GWICYBPPZNAHIV-UHFFFAOYSA-N 443.547 4.937 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)cc1Br 2323149430 XFRQEBVBWFXNBB-UHFFFAOYSA-N 426.314 4.582 50 10 IJGE Fc1ccc(C(F)F)c(CO[C@H](CCl)[C@@H](I)CCl)c1 2338247947 AZFKVDRPYPOUKG-WDEREUQCSA-N 427.031 4.930 50 10 IJGE Cn1cc(I)c(C[C@H]2CCCc3ccccc3[C@@H]2Br)n1 2367611722 RDPKIVBQZSTVBR-MLGOLLRUSA-N 445.142 4.656 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(O[C@@H]2CCCCC23CCOCC3)CC1 2368371616 LSQXMSPUMPGGKM-QGZVFWFLSA-N 446.426 4.907 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2ccc(OC(F)F)cc2)sc2c1CCCC2 3353923 HIQZOLZBGCPQHF-SDNWHVSQSA-N 446.475 4.951 50 10 IJGE Cc1c(C(=O)N2CCCC[C@H]2C)oc2c1/C(=N/NC(=O)c1ccc3ccccc3n1)CCC2 40825703 SZJVKIPQKABCPH-YFBUSDHTSA-N 444.535 4.621 50 10 IJGE O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)N/N=C/c1ccc(Cl)cc1Cl 59507163 QXUFEQBEZDRROK-FBCYGCLPSA-N 441.321 4.754 50 10 IJGE CO[C@@H]1CCC[C@@H](O[C@@H](CI)c2ccccc2Br)C1 162373195 SMCBBEKNHLOQGJ-JMSVASOKSA-N 439.131 4.899 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC(=O)/C(C#N)=C\Nc1ccc(Cl)cc1C(F)(F)F 217231128 FFCXYLRETXPREW-KTKRTIGZSA-N 440.765 4.734 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OCc1ccccc1Cl 231311469 BRBGFWPUVGRCKW-MRXNPFEDSA-N 439.721 4.575 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCCC[C@@H]1CBr 232460046 KPXVVMWYSNVTFB-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE CCCCN(CCCl)C(=O)c1cc(I)ccc1Br 232988952 KKLIRZMYNWWJOO-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE CCCCCCCCCC(=O)NCC(=O)NN=Cc1ccc(OCc2ccccc2)cc1 254490567 XRSXHUHORDXFTN-UHFFFAOYSA-N 437.584 4.973 50 10 IJGE CC(=NNC(=O)CSc1nnc(SCc2ccc(C)cc2)s1)c1ccc(F)cc1 254825710 OUWXQFCFWBYQSF-UHFFFAOYSA-N 446.598 4.910 50 10 IJGE CCCCOc1ccc(C(C)=NNC(=O)[C@@]2(C)CC2(Br)Br)cc1 254841716 UGFLLUOFEYGXHH-MRXNPFEDSA-N 446.183 4.602 50 10 IJGE C[C@@H](NC(=O)c1cc(Br)c(Br)s1)C1(CBr)CC1 710152918 OKMYAZFUHYOMIS-ZCFIWIBFSA-N 446.002 4.567 50 10 IJGE CCCc1c(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cnn1-c1cc(C)ccn1 799412037 NNCYOOLBJUAUHD-UHFFFAOYSA-N 443.433 4.567 50 10 IJGE COc1ccc([N+](=O)[O-])cc1-n1c(C)cc(C=NNC(=O)c2cc3ccccc3o2)c1C 1084252475 NJGYUWBHCINXCS-UHFFFAOYSA-N 432.436 4.521 50 10 IJGE O=C(NNc1cc(Br)ccc1F)c1ccc(-c2cccc(Cl)c2)nc1O 1179823182 BLSHLQJXEUZVKQ-UHFFFAOYSA-N 436.668 4.766 50 10 IJGE C=C(C)C[C@@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc3ccccc23)c1C)C(=O)OC 1535097235 AESMHMVKRNQWGP-WLGHQHAYSA-N 441.531 4.778 50 10 IJGE C#CCC1(C(=O)NNc2nc3ccccc3c(=O)n2-c2ccc(C(C)C)cc2)CCCCC1 1543607907 JPMNSZKTPICHIQ-UHFFFAOYSA-N 442.563 4.926 50 10 IJGE C/C(=C/C(=O)NNc1c(Br)cccc1Br)c1cccc(F)c1 1626143258 CEAHUEMAUNWJAD-NTMALXAHSA-N 428.099 4.897 50 10 IJGE C#CCCCC(=O)NNC(=O)/C(=C/c1cccc(OCc2ccccc2)c1)c1cccs1 1635718583 MLZQAFPGFNWWHT-PTGBLXJZSA-N 444.556 4.819 50 10 IJGE Cc1ccc(C)c(Cn2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2cccc(Br)c2)c1 1865683889 KLLUARDXTOYXLB-OAQYLSRUSA-N 449.352 4.837 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2Cc1ccccc1 1865691726 ZNZKUZZGQBMFFI-HSZRJFAPSA-N 426.520 4.667 50 10 IJGE CCCOc1c(OC)cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1ccccc1 1865694206 VSSMIBVCOSMHDU-JOCHJYFZSA-N 444.535 4.509 50 10 IJGE CCc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865700414 SLBDWNFYOQZDKA-NRFANRHFSA-N 429.911 4.847 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2Cl)cc1 1865712997 NYHFIICZYDKQRJ-MRXNPFEDSA-N 446.816 4.771 50 10 IJGE CC(C)(C)c1csc(/C(C#N)=C(\O)c2ccc3c(c2)C(=O)N(Cc2ccco2)C3=O)n1 1872748787 NNGCFPIJXJJMKQ-ZPHPHTNESA-N 433.489 4.780 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1ccc2c(c1)CCC2 1915295448 KLKPEMASFJQABN-NRFANRHFSA-N 436.415 4.786 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CCl)c1Cl)N(Cc1ccccc1)[C@@H]1CCOC1 1915469688 FBMVECSXOQSEID-MRXNPFEDSA-N 434.772 4.712 50 10 IJGE CC(C)CCN(CCBr)c1ncc(Br)cc1Br 1924493334 RILZKGKVLDMILD-UHFFFAOYSA-N 428.994 4.854 50 10 IJGE CC(C)(C)OC(=O)N1CCCC12CCC1(CC[C@H](CI)O1)CC2 1979984333 QGHIVLMZWVBETI-RWBZWWBESA-N 435.346 4.683 50 10 IJGE CN(C(=O)c1c(Br)cccc1Br)[C@H]1CCC[C@@H]1Br 2033088316 GYKXYQLAIJFBGH-KWQFWETISA-N 439.973 4.600 50 10 IJGE CC(C)CN(CCBr)C(=O)c1c(Br)cccc1Br 2036709668 XITDRPSFBOVIRY-UHFFFAOYSA-N 441.989 4.705 50 10 IJGE Clc1ccc(I)c(CN2CC[C@]23C[C@@H](CBr)C3)c1 2061796055 GTZAYYHDZWWYSP-YPFXGUDJSA-N 440.550 4.694 50 10 IJGE FC(F)(F)c1c(I)c(CCl)nn1-c1ccnc(C2CC2)c1 2078890493 SBGZELBJKFTLDZ-UHFFFAOYSA-N 427.595 4.507 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@H](Cl)C(F)(F)CC1 2093616433 FIMIVAVEDSZEHP-ZETCQYMHSA-N 437.531 4.752 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2C[C@@H]1CCCN1Cc1ccccc1 2128499589 YURVQBWVAXZSHD-INIZCTEOSA-N 433.781 4.906 50 10 IJGE Cn1cc(Br)c(-n2c(CCl)nc3cc(Br)c(Cl)cc32)n1 2159876883 ZZQWYQHQBGVWDQ-UHFFFAOYSA-N 438.938 4.676 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](CCNC(=O)c2ccc(CBr)cc2)CC1 2162490119 QLFVHFJFEQPLLT-INIZCTEOSA-N 439.394 4.739 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](NC(=O)OC(C)(C)C)C[C@@]12CCOC2 2163061696 HQWXLFJLCJWZFR-LAUBAEHRSA-N 447.458 4.726 50 10 IJGE CCC1(CC)CCCN1S(=O)(=O)c1cc(CBr)sc1Br 2179792392 FNJUIOIHYZUDPW-UHFFFAOYSA-N 445.242 4.749 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2C[C@H]1CCN(Cc2ccccc2)C1 2184942360 RPVGZPGWTZYTBQ-KRWDZBQOSA-N 447.808 4.806 50 10 IJGE O=C(c1ccc(Br)c(Cl)c1)N1CC[C@@H](C(F)(F)CBr)C1 2197763403 NTOSBFVEQMDZMF-SECBINFHSA-N 431.502 4.595 50 10 IJGE COC(=O)[C@@]1(CCl)C[C@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 2230922121 SZNXTPCJMSKXCC-UWJYYQICSA-N 442.028 4.570 50 10 IJGE COc1ccc([C@H](Br)C[C@@H]2CC(C)(C)CO2)cc1I 2269557323 UFEMUXNSOJQAAY-VXGBXAGGSA-N 439.131 4.941 50 10 IJGE CC1(C)[C@@H](Br)CC[C@H]1NC(=O)c1cc(F)c(Br)cc1Cl 2282971889 ITDQYJFLQBBMBC-NWDGAFQWSA-N 427.539 4.924 50 10 IJGE C=CC[C@@]1(CBr)CCCN1C(=O)c1ccc(C)c(I)c1 2287757209 FASHIIDAKXEIAK-INIZCTEOSA-N 448.142 4.545 50 10 IJGE COc1cc(C=C(C#N)C(N)=O)cc(Br)c1OCc1cccc2ccccc12 2297452663 BIKRNKJTQVCBHI-UHFFFAOYSA-N 437.293 4.582 50 10 IJGE BrCC[C@@H]1CCCN(Cc2sccc2I)CC1 2301076292 JWHQGDQEJGCBKN-NSHDSACASA-N 428.177 4.740 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1Cc1ccc(Cl)cc1I 2302325362 GTWUJEBYBLXQFQ-ONGXEEELSA-N 428.539 4.692 50 10 IJGE C[C@@H](CCCBr)CNCc1cc(I)ccc1Cl 2307329078 VVRODMNVPADPKY-JTQLQIEISA-N 430.555 4.845 50 10 IJGE CC1([C@H](CBr)NCc2cc(I)ccc2Cl)CC1 2307332491 PNPBJLLEUSBVOD-LBPRGKRZSA-N 428.539 4.598 50 10 IJGE COc1cc(C=C(C#N)C(=O)NC(C)C)ccc1OC(=O)C=Cc1ccc(C(C)C)cc1 2314740302 GTSPNMLJSXMCGN-UHFFFAOYSA-N 432.520 4.869 50 10 IJGE C[C@@]1(CCBr)CCN(Cc2ccc(Cl)c(I)c2)C1 2315549549 SZGNHSBQVKXTJQ-CQSZACIVSA-N 442.566 4.942 50 10 IJGE Cn1cnc(Br)c1[C@@H](Br)c1cc(F)c(Br)cc1F 2315598588 CMSAGPXRJZYKJI-VIFPVBQESA-N 444.899 4.708 50 10 IJGE COc1ccc(CCO[C@H](CCl)[C@@H](Br)CCl)c(Br)c1 2339258309 SIQAKDKYFICKNQ-QWHCGFSZSA-N 434.983 4.627 50 10 IJGE CCC[C@H]1CN(C(=O)c2ccc(Cl)cc2I)C[C@H]1CCl 2365589784 ZHEAPMYDCQWAAM-WDEREUQCSA-N 426.125 4.672 50 10 IJGE CCCOc1ccc(/C=C(\C#N)C(=O)Nc2sc(C(C)=O)c(C)c2C(=O)OCC)cc1 33346572 SIRMULHNGBGEGU-SFQUDFHCSA-N 440.521 4.770 50 10 IJGE Cc1cc(C)cc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccs2)c1 38656521 LSSRBTUEHIVMOI-QHCPKHFHSA-N 432.501 4.568 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4cccc(C)c4)ccc32)cc1 38677127 IWAMJKZNYQLMRD-AREMUKBSSA-N 440.499 4.760 50 10 IJGE CCn1c(SCCCC(=O)N/N=C/c2ccc(Br)cc2)nc2ccccc21 58989574 NRTDVPRNOFHTLJ-HYARGMPZSA-N 445.386 4.841 50 10 IJGE Cc1ccc(C(=O)NNC(=O)c2oc3c(c2C)/C(=N\Nc2ccccc2)CC(C)(C)C3)cc1 101109069 PNQOPNZXMMHOIK-RRAHZORUSA-N 444.535 4.760 50 10 IJGE COCCc1ccc([C@H](Br)c2cccc(I)c2)cc1 104022918 ZZGNIRIVMOOSHJ-INIZCTEOSA-N 431.111 4.964 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C\c2ccc(OCC)c(OC)c2)cc1 207108712 HOLAPKBRACNSKU-POVPUTRVSA-N 448.519 4.536 50 10 IJGE CC(C)N(CCCBr)C(=O)c1cc(Cl)ccc1I 232649451 BSRHORNQWQMGBV-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE C[C@H](Br)c1ccccc1NC(=O)c1cc(I)ccc1O 235412034 WEMAYDIETYHELP-VIFPVBQESA-N 446.082 4.705 50 10 IJGE CCn1c(SCC(=O)NN=C/C=C\c2ccco2)nnc1-c1ccc(C(C)(C)C)cc1 254850375 YCOARULTPCXJPJ-BHUASXCVSA-N 437.569 4.763 50 10 IJGE C[C@H]1CC(O[C@](C)(CI)CNC(=O)OC(C)(C)C)C[C@H](C)C1 299983889 YCUQZFYPUPFWLH-PBFPGSCMSA-N 425.351 4.546 50 10 IJGE FC(F)Oc1c(I)ccc(CBr)c1Br 575682652 XHUBHQXQJGEAMV-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2CC[C@@H](c3cccc(F)c3)C2)c(-c2ccccc2)n1 729444690 BDVKSNBVSFCWGU-NBOCOGBRSA-N 439.494 4.526 50 10 IJGE CCc1cccc(CC)c1NC(=O)/C(C#N)=C/c1ccc(OC)c(O)c1Br 761011866 PXVZMCNDGCIEAW-LFIBNONCSA-N 429.314 4.834 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc3ccccc3cc2OC(F)F)c1C 762254980 UTNZNJQKTAVNOP-UHFFFAOYSA-N 435.434 4.667 50 10 IJGE Cc1ccc(Cl)cc1NC(=O)C(=O)NN=Cc1cc(C)n(-c2cccc(Cl)c2)c1C 1083996559 ZXKUYIPDXXNNEY-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE O=C(CSCc1ccc(Cl)cc1)NN=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 1084198022 URKMKGMUZNIIDN-UHFFFAOYSA-N 429.885 4.892 50 10 IJGE CN1/C(=C(/C#N)C(=O)CSc2nc3c(n2-c2ccccc2)CCCC3)Nc2ccccc21 1086959960 CTVXDKCZHMLXCZ-MOHJPFBDSA-N 441.560 4.709 50 10 IJGE C=COc1ccc(NC(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)cc1 1206180846 NSUBWAVWJMHQAT-UHFFFAOYSA-N 437.883 4.908 50 10 IJGE C=CC[C@H](Cc1ccccc1)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 1642542233 VXDBFDWPNRMNTK-UWFGVWCKSA-N 435.531 4.674 50 10 IJGE Cc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 1865682335 MGTXDOZTAJQNKT-SFHVURJKSA-N 429.282 4.904 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)Cc1ccc(F)cc1 1865759760 QOVSBIPLIXFWDW-UHFFFAOYSA-N 432.282 4.507 50 10 IJGE CCOc1ccc(-c2csc(/C(C#N)=C(\O)CCN3C(=O)c4ccccc4C3=O)n2)cc1 1872747399 ASUTWSCVAUPOOV-VZCXRCSSSA-N 445.500 4.688 50 10 IJGE CC1(C)CN(Cc2ccc(Br)cc2Br)C[C@@H]1Br 1943860174 VQJQUMPXTKCCOO-LBPRGKRZSA-N 425.990 4.817 50 10 IJGE CC(C)n1c(CBr)nnc1-c1c(Br)cccc1Br 2033093680 IGKQRHZNSULJFJ-UHFFFAOYSA-N 437.961 4.946 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc([S@](C)(=O)=NC[C@H](CBr)C2CC2)c1 2044693321 JXCRYNNXZYSUHF-SXBQZSJRSA-N 431.396 4.911 50 10 IJGE Clc1cc(CN2C[C@H]3C[C@H](Br)C[C@H]2C3)ccc1I 2086652552 QEERLAQZESCVNM-SDDRHHMPSA-N 440.550 4.692 50 10 IJGE C[C@@H]1CN(C[C@@H](CBr)c2ccccc2)C[C@H]1CCNC(=O)OC(C)(C)C 2106788175 NNKGCMSPEYGWPP-BHIYHBOVSA-N 425.411 4.648 50 10 IJGE CC1(C)CO[C@H](COc2c(Br)cc(Cl)cc2CBr)CO1 2176669693 HSOLDMJUKZMRFZ-LLVKDONJSA-N 428.548 4.570 50 10 IJGE O=C(c1cc(Cl)cc(Br)c1)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Br)C2 2190680560 XBVKJQWLRIDICS-CYDGBPFRSA-N 425.523 4.581 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CCCCCI)Cc2ccccc21 2214695944 JGBOSUYIETUIOR-QGZVFWFLSA-N 444.357 4.673 50 10 IJGE CCOc1cc(CBr)ccc1OC[C@@H]1CC1(Br)Br 2218000662 VHKRUWZVYVTWDA-JTQLQIEISA-N 442.973 4.865 50 10 IJGE Fc1cc(F)c(CBr)c(N2CCCN(Cc3ccccc3)CCOCC2)c1 2235794859 UAXHLQNGQSWUQX-UHFFFAOYSA-N 439.344 4.589 50 10 IJGE Cc1ccc(I)c(C(=O)N2C3CCC2([C@H](C)Br)CC3)c1 2240921933 CPRMADFYYPWFKA-FZWSLVFFSA-N 448.142 4.520 50 10 IJGE CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)CC1(CBr)CC(F)C1 2241370516 PUEVVBNKNSROJJ-UHFFFAOYSA-N 443.401 4.917 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@H]2C[C@@]23CCOC3)c1 2263526176 QBQOCELACKYOMI-HZSPNIEDSA-N 438.985 4.944 50 10 IJGE CCCOc1c(OC)cc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)cc1OC 2323149311 IADPAECWPJVHEW-UHFFFAOYSA-N 435.524 4.617 50 10 IJGE Cc1cc(I)ccc1NC=C(C#N)C(=O)Nc1ccc(Cl)cc1 2325424547 YAXCGPBPDSAIGW-UHFFFAOYSA-N 437.668 4.711 50 10 IJGE Cc1cccc2c1N(C[C@]1(CBr)CC1(F)F)CCN2C(=O)OC(C)(C)C 2352965779 XTNMFYVBDIBJGE-GOSISDBHSA-N 431.321 4.977 50 10 IJGE COc1cc(F)c([C@H](Cl)c2c(Br)nc(C)n2C)cc1Br 2362441122 IGOASFCBWIQDFM-NSHDSACASA-N 426.511 4.729 50 10 IJGE CC(C)[C@@H]1CN(c2c(CBr)c(C(F)F)nn2C)CCN1Cc1ccccc1 2365275587 VRWUPEBGNWXMDV-KRWDZBQOSA-N 441.364 4.599 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cccc(C(F)(F)F)c1F 2369431848 WVDNETCXJIHNSZ-CQSZACIVSA-N 448.254 4.945 50 10 IJGE COc1cccc(/C=C(/C#N)C(=O)Nc2ccccc2C(=O)O)c1OCc1ccc(F)cc1 33739228 ABSLGYABRCLSOA-AQTBWJFISA-N 446.434 4.657 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(Cl)cc4)ccc32)cc1 38649166 JVWZBSGWGRQSTK-XMMPIXPASA-N 446.890 4.851 50 10 IJGE CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccc(C)cc3)ccc21 38650426 LBFAMBHZKNCXSS-DEOSSOPVSA-N 426.472 4.831 50 10 IJGE Cc1nn(Cc2ccccc2)c(C)c1/C=N/NC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 59152034 SAYSAPAGRKWFSB-YEEYNWEUSA-N 445.350 4.773 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2ccccc2OC)sc2c1CC[C@@H](CC)C2 209406329 VGABVXACWBFVRZ-WIZMWCRPSA-N 438.549 4.994 50 10 IJGE CCc1occc1[C@@H](Br)c1cc(I)cc2c1OCC2 311621521 SSJKVRPYFRUAAU-CQSZACIVSA-N 433.083 4.866 50 10 IJGE COC(C)(C)COc1c(Br)cc(CBr)cc1Br 379275689 ZEYPDQXRXZRWNN-UHFFFAOYSA-N 430.962 4.910 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CI)[C@H](c2ccc(Cl)s2)C1 394734200 RSWITXXPCVWLDS-NXEZZACHSA-N 427.735 4.787 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@@H]1Cl)c1scc(Br)c1Br 705419635 ORLRPIIJKOTBTM-CMPLNLGQSA-N 435.568 4.908 50 10 IJGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NC(C1CCCC1)C1CCCC1 735512715 PMPKRAVTHADAJU-UHFFFAOYSA-N 426.586 4.812 50 10 IJGE Cc1cccc(C2=CCN(C(=O)/C(C#N)=C/c3cn(CCC#N)nc3-c3ccccc3)CC2)c1 771258266 GZUDLSYZGKMFDX-XIEYBQDHSA-N 447.542 4.995 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2cnc(Cl)c(Br)c2)c(C(F)(F)F)c1 799412391 XIAGKNKJFKEBFL-UHFFFAOYSA-N 434.603 4.537 50 10 IJGE COc1cc(/C=C\C(=O)Cl)cc(I)c1OCc1ccccc1C 1081475934 SIZLCWAWDHSXNA-FPLPWBNLSA-N 442.680 4.966 50 10 IJGE COc1ccccc1OCC(=O)NN=Cc1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1084179762 KLZQNJCKQGLYTO-UHFFFAOYSA-N 446.334 4.939 50 10 IJGE Cc1sc(-n2c(C)cc(C=NNC(=O)CC[C@H](O)c3ccccc3)c2C)c(C#N)c1C 1084467338 WEVJZUOCIHAGHU-QFIPXVFZSA-N 434.565 4.608 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)[C@H]2CCCC[C@@H]2c2nc3ccccc3s2)c1 1303280412 HUSZWXQXJOEASO-ROUUACIJSA-N 434.590 4.569 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2cnc(-c3ccccc3)s2)c(C)n1C[C@H]1CCCO1 1318996313 DFDMDFNXEMUYNX-BYUJNSPJSA-N 446.576 4.631 50 10 IJGE C=CCOc1ccc(Br)cc1NC(=O)NNc1cc(Cl)ccc1[N+](=O)[O-] 1562929319 PXFCMUHDMAXGPL-UHFFFAOYSA-N 441.669 4.724 50 10 IJGE C/C(=C\C(=O)NNc1cc([N+](=O)[O-])ccc1Br)c1ccc(C(F)(F)F)cc1 1611304602 USQDVZVTTWMVPK-CSKARUKUSA-N 444.207 4.923 50 10 IJGE CCCCCCOc1ccc([C@H]2CN(C(C)=O)C[C@@H]2CI)cc1 1614613636 ANFSMNPFVMKKKV-PKOBYXMFSA-N 429.342 4.643 50 10 IJGE C#CCOc1ccc(CNC(=O)NNc2c(Cl)cc(Br)cc2Cl)cc1 1682742167 CXFSRSHCDAJTHC-UHFFFAOYSA-N 443.128 4.594 50 10 IJGE CCCCCCOc1ccc(C=NNC(=O)CSc2nc3ccccc3[nH]2)cc1OC 1772760450 NOODEPTYIQGVCI-UHFFFAOYSA-N 440.569 4.773 50 10 IJGE N#CSc1ccc(NC(=O)c2cccc(NC(=O)c3ccc(-n4cccc4)cc3)n2)cc1 1860563891 OGJDNJKECOCSBD-UHFFFAOYSA-N 439.500 4.950 50 10 IJGE CCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccccc1O)C(C#N)=C(N)O2 1865708618 ZILPHOVLNJEOBB-IBGZPJMESA-N 441.318 4.724 50 10 IJGE CCOC(=O)c1c(-c2ccc(C)cc2C)csc1NC(=O)CI 1865947907 ZGYMJTXDMSWIEM-UHFFFAOYSA-N 443.306 4.582 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)CCCN3C(=O)c4ccccc4C3=O)n2)cc1 1872745994 MTJKDPPBYOXUAH-VZCXRCSSSA-N 445.500 4.688 50 10 IJGE CS(=O)(=O)Nc1ccc(/C(O)=C(\C#N)c2nc(-c3ccc(Cl)s3)cs2)cc1 1872758041 ITOVEPMVMQZPTD-VBKFSLOCSA-N 437.955 4.846 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)C(=O)c1ccc(I)c(O)c1 1915115325 VDQHIGQDHBXXIS-OAHLLOKOSA-N 443.712 4.657 50 10 IJGE C[C@H](CS(=O)(=O)N(Cc1ccccc1)[C@@H](CBr)C1CC1)c1ccccc1 1915171231 CTWUTORIPFDLIJ-UTKZUKDTSA-N 436.415 4.796 50 10 IJGE Cc1c(Br)sc([C@@H](Cl)[C@@H]2CCCS(=O)(=O)C2)c1Br 1922912350 MJDBMHWMFALOLV-APPZFPTMSA-N 436.618 4.686 50 10 IJGE O=S1(=O)CCC[C@H]1[C@@H](Br)c1c(Cl)sc(Br)c1Cl 1925619145 YDUFVKMGFHJSPW-UJURSFKZSA-N 443.009 4.831 50 10 IJGE Fc1c(CNCCCCCI)ccc(Cl)c1Br 2001884067 QDNLLTXEQMNVMQ-UHFFFAOYSA-N 434.518 4.937 50 10 IJGE CC[C@H](CCCBr)NC(=O)c1ccc(Br)cc1Br 2036514273 SKDBFXYRRRNOQY-SNVBAGLBSA-N 441.989 4.895 50 10 IJGE C[C@@H](C[S@](C)(=O)=NCC1(CBr)CCCCCC1)NC(=O)OC(C)(C)C 2044699431 KYXIOESLMPKTQO-MQNRADLISA-N 439.460 4.733 50 10 IJGE Cc1c(Br)ccc([C@H](Br)[C@@]2(C)COCCO2)c1Br 2083319180 WJAJOUYPBKDAMF-QWHCGFSZSA-N 442.973 4.762 50 10 IJGE CC(C)[C@H](CBr)CN(C1CC1)[C@H](CCNC(=O)OC(C)(C)C)C(F)(F)F 2106788302 ONHRJESCGAKGGL-UKRRQHHQSA-N 445.364 4.964 50 10 IJGE CC[C@]1(NC(=O)OC(C)(C)C)CCCN(C[C@@H](CBr)c2ccccc2)C1 2106788320 ORQSSHOTKRWOOJ-NQIIRXRSSA-N 425.411 4.934 50 10 IJGE CN(Cc1ccc(NC(=O)[C@H](Br)C2CCCC2)cc1)C(=O)OC(C)(C)C 2110722153 JRPGRVFDSGEWLB-QGZVFWFLSA-N 425.367 4.946 50 10 IJGE C[C@@]1(C2CC2)CN(c2nc3sccn3c2CBr)CCN1Cc1ccccc1 2151088771 HGPPTIZICZSGQM-NRFANRHFSA-N 445.430 4.782 50 10 IJGE CN(C(=O)c1ccc(I)c(Cl)c1)[C@@H](CCCl)C(F)(F)F 2178514281 AWUGKJFDYOOSDG-JTQLQIEISA-N 440.030 4.576 50 10 IJGE C[C@@H](Cl)c1nc2ccc(Br)cc2n1C[C@H]1COCCN1Cc1ccccc1 2194650398 RNSNEDHQHGFHEG-QAPCUYQASA-N 448.792 5.000 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OCCCCC(F)F)C1 2212213341 HAQMJJCUJXFMBP-INIZCTEOSA-N 447.304 4.643 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)C[C@H]2CCOC2)c1 2252840559 YRTCDZHDWDZQMD-MWLCHTKSSA-N 426.974 4.944 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@H]2[C@@H](Br)CCC[C@H]2C1 2264506384 IHGWPSMTAGMHHY-YIZRAAEISA-N 427.589 4.800 50 10 IJGE C[C@]1(CNC(=O)c2cc(Br)c(F)cc2Cl)CCC[C@@H]1Br 2286883701 QMRKCCQQJFUJFX-GXTWGEPZSA-N 427.539 4.925 50 10 IJGE CC(C)(CBr)CCNCc1ccc(Cl)cc1I 2302337422 XKOSWMQPBZGUDL-UHFFFAOYSA-N 430.555 4.845 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)nc2C)ccc1O 2321248590 JUKTVVBQYKLDBY-UHFFFAOYSA-N 430.291 4.842 50 10 IJGE C[C@@H]1CCCN(C[C@]2(CBr)CC2(F)F)[C@@H]1CCCNC(=O)OC(C)(C)C 2351886101 UATYCCRTQMMPJZ-IIDMSEBBSA-N 439.385 4.812 50 10 IJGE CC(C)(C)[C@](C)(CBr)CS(=O)(=O)Cc1ccc(Br)cc1 2380201825 DVRGRMQBXPLBFA-OAHLLOKOSA-N 426.214 4.811 50 10 IJGE CCc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccs2)cc1 38656585 MUGHIIMQAANKCP-HSZRJFAPSA-N 432.501 4.513 50 10 IJGE C[C@H](c1nccs1)n1c(CCCl)nc2cc(I)c(F)cc21 97409366 GASSWGBURHVLEX-MRVPVSSYSA-N 435.693 4.627 50 10 IJGE COc1ccc(OC)c([C@H](Br)c2ccc(I)cc2)c1 109842586 MWGIBGAFGKDURP-OAHLLOKOSA-N 433.083 4.793 50 10 IJGE O=C(Nc1cccc(CCCBr)c1)c1cccc(I)c1 139432196 QQWFJLZFXMEADC-UHFFFAOYSA-N 444.110 4.871 50 10 IJGE C=CCOc1ccc(/C=C2\C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)cc1OCC 214382297 UHFCCXNSNBMNLB-HMAPJEAMSA-N 442.515 4.751 50 10 IJGE Cc1ccccc1C=NNC(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 254503822 FZUBFQQQMUVXPE-UHFFFAOYSA-N 436.309 4.774 50 10 IJGE CC[C@@H](NC(=O)c1cc(Br)sc1Br)[C@H](C)Br 386959729 YVVJDVGXMINKPX-CAHLUQPWSA-N 433.991 4.565 50 10 IJGE O=C(CBr)c1cc(OC(F)(F)F)c(OC(F)F)cc1Br 575684656 HITYGERAPKXKBJ-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE Cc1cccc([C@H]2CN(Cc3ccccc3)C[C@H]2CI)c1[N+](=O)[O-] 725427259 JOIAJLUHFWJDSS-AEFFLSMTSA-N 436.293 4.554 50 10 IJGE O=C(NCc1ccc(COCc2ccccc2)cc1)NNc1ccc(OC(F)F)cc1 726705340 HPGQTICYYSAMIS-UHFFFAOYSA-N 427.451 4.831 50 10 IJGE Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)NNC(=O)c1cccc2cccnc12 736656983 NGADHPTYUMTYBM-HXUWFJFHSA-N 430.533 4.533 50 10 IJGE Cc1cncc(/C=C\C(=O)NNc2ccc(S(=O)(=O)c3ccc(C(C)C)cc3)cc2)c1 772015169 OMJWQFNQMHZITB-PQMHYQBVSA-N 435.549 4.503 50 10 IJGE CC(C)(C)c1ccc(C(=O)NN=Cc2ncc(Br)cc2Br)cc1 783806757 OBPNBCFILUUYDZ-UHFFFAOYSA-N 439.151 4.668 50 10 IJGE CC(=NNC(=O)c1ccc(CSc2nncn2C)cc1)[C@H]1C[C@@H]1c1ccccc1Cl 920360762 VARZKNCIHAHWSR-RTBURBONSA-N 439.972 4.670 50 10 IJGE Cc1cc(/C=C(\C#N)c2nnc(-c3cccc4cccnc34)o2)c(C)n1C[C@H]1CCCO1 1345866149 BGUFHXCWSKKYKX-NNVROAHOSA-N 425.492 4.946 50 10 IJGE COc1ccc(C=NNC(=O)[C@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1Br 1772752877 PSKNHMSAGNIVDV-ZDUSSCGKSA-N 439.737 4.646 50 10 IJGE CCCc1nn(CC)c2c1[C@@H](c1ccc(OCc3ccccc3C)cc1)C(C#N)=C(N)O2 1865702735 CYBHVPTVLLYSIW-QHCPKHFHSA-N 428.536 4.961 50 10 IJGE Brc1ccccc1[C@@H](CI)O[C@@H]1COC2(CCC2)C1 1889723591 UAKVVYQXRRJQSP-SMDDNHRTSA-N 437.115 4.653 50 10 IJGE CN(C[C@H](CBr)CC1CC1)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 1890234026 MRRNOJYCAPOIPR-HKUYNNGSSA-N 425.411 4.995 50 10 IJGE C[C@@H]1CN(Cc2cccc(Br)c2Br)C[C@@H]1CBr 1943881543 BSSQDLLZXONMSV-KOLCDFICSA-N 425.990 4.674 50 10 IJGE O=C(N[C@H]1CC[C@H](CBr)C1)c1csc(Br)c1Br 1945189756 ZDMOCNPKJLZXAF-BQBZGAKWSA-N 446.002 4.567 50 10 IJGE CC(C)[C@H](CCl)N(Cc1ccccc1)S(=O)(=O)C1CC(OCc2ccccc2)C1 1958927925 GQJXZEABLDLRNJ-VNXZQDSDSA-N 436.017 4.830 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3CC[C@@]3(CBr)C2)c1 2078145546 FFFBFEMNMWCIDR-BXUZGUMPSA-N 440.550 4.552 50 10 IJGE O=[N+]([O-])c1c(CBr)nn(Cc2ccc(OCC3CC3)cc2)c1C(F)(F)F 2079257890 CTIZYJUVFBFLJB-UHFFFAOYSA-N 434.212 4.542 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CC2(CBr)CCCC2)C[C@H]1C(F)(F)F 2106784128 GGPNROBYGBDZCD-UONOGXRCSA-N 443.348 4.577 50 10 IJGE ClCc1nc(N2[C@H]3CCC[C@H]2CN(Cc2ccccc2)CC3)ncc1Br 2110299746 UYYYEPQPTLXVFT-IRXDYDNUSA-N 435.797 4.611 50 10 IJGE O=C(NC[C@]12CCC[C@@]1(CCl)C2)c1cc(Br)sc1Br 2142941675 XKAYSWDOUZHAGE-QWHCGFSZSA-N 427.589 4.802 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@H]1CCCN(C[C@@H](CBr)C(C)(C)C)C1 2185505348 ZLXNKCCOPZLIJS-LSDHHAIUSA-N 443.430 4.993 50 10 IJGE ClCc1nc2cc(Br)cnc2n1C[C@@]12CC[C@@H]1CN(Cc1ccccc1)C2 2201230065 MALWEPHMZGJDNM-IERDGZPVSA-N 445.792 4.845 50 10 IJGE C[C@]1(C2CC2)CN(CCCCCI)CCN1Cc1ccccc1 2211186940 RFBCLFFEAZTGBA-HXUWFJFHSA-N 426.386 4.578 50 10 IJGE Cc1ccc(C(=O)N2C3CCC2([C@@H](C)Br)CC3)cc1I 2232844405 WURFXPUZPBDANJ-FFKNIBCLSA-N 448.142 4.520 50 10 IJGE Cc1c(Br)csc1C(=O)NC[C@@]1(CBr)C[C@@H]1C(F)(F)F 2234514005 HDLKOEXBSVOUDS-KWQFWETISA-N 435.103 4.512 50 10 IJGE CN(C[C@H]1CCC[C@@H]1Br)C(=O)c1cc(F)c(Br)cc1Cl 2282979346 YZCVZWAFGBXACJ-SCZZXKLOSA-N 427.539 4.877 50 10 IJGE O=C(NCC[C@@H]1CCCC[C@H]1Cl)c1ccc(Cl)c(I)c1 2283671081 WXNHXQKFTZGYIX-CMPLNLGQSA-N 426.125 4.862 50 10 IJGE O=C(NN=Cc1cccc(Cl)c1Cl)C(=Cc1cccs1)NC(=O)c1ccccc1 2293968629 KPQGMHHFZPEXFI-UHFFFAOYSA-N 444.343 4.976 50 10 IJGE C[C@@]1(CCCl)CCN1Cc1ccc(I)c(Br)c1 2306220604 ZJIYDMDPRIWOKX-CYBMUJFWSA-N 428.539 4.647 50 10 IJGE C[C@]1(CBr)CCCN1Cc1cc(I)ccc1Cl 2307329943 ICPQYMFNCPHUPV-CYBMUJFWSA-N 428.539 4.694 50 10 IJGE COc1cccc(C=CC(=O)Nc2cccc(C(=O)Nc3ccc(SC#N)cc3)n2)c1 2321010157 DFQUZRUMBQPWIY-UHFFFAOYSA-N 430.489 4.568 50 10 IJGE ClC[C@H]1C[C@H]2CC[C@H]1N2Cc1ccc(I)c(Br)c1 2325217221 BWLYUSDRDHOPBL-JTNHKYCSSA-N 440.550 4.645 50 10 IJGE CC[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](CC)CN1C[C@@]1(CBr)CC1(F)F 2326918557 AOZVQFAQQQWRSE-CPUCHLNUSA-N 425.358 4.517 50 10 IJGE C[C@H]1C[C@H](CBr)CCN1Cc1cc(I)ccc1Cl 2327401058 LXNTVYFJRKUQFE-WDEREUQCSA-N 442.566 4.940 50 10 IJGE CC1(C)COC[C@H]1CO[C@@H](CI)c1ccc(Br)cc1 2339010394 KUVFVPAQSBPECK-JSGCOSHPSA-N 439.131 4.614 50 10 IJGE Cn1c(/C(C#N)=C/c2sc(N3CCOCC3)nc2-c2ccccc2)nc2ccccc21 9630914 XKYSBZKFYFSFAV-OBGWFSINSA-N 427.533 4.598 50 10 IJGE O=C(CSc1nc2ccccc2[nH]1)N/N=C/c1ccc(OCc2ccccc2F)cc1 32520601 ZJEOKZHUASMLQP-DHRITJCHSA-N 434.496 4.523 50 10 IJGE Cc1c(Br)cc(NCC(=O)N/N=C2/CCCC[C@H]2C)cc1Br 32929273 ONZQALYADVSITK-FBBHVMPDSA-N 431.172 4.614 50 10 IJGE C=CCOc1ccc(/C=C2/C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)cc1OCC 38608459 UHFCCXNSNBMNLB-HYARGMPZSA-N 442.515 4.751 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCC[C@@H](Br)CC1 383367167 XLDOLOBIBIOSPS-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE O=[N+]([O-])c1ccccc1C[C@H](Br)c1sccc1I 386582488 HSPROSCIKIRQSA-VIFPVBQESA-N 438.084 4.940 50 10 IJGE O=C(NC1(CCBr)CCCCC1)c1sccc1I 687328867 FLCYWKYTQFRIPO-UHFFFAOYSA-N 442.160 4.570 50 10 IJGE Cc1ccc(OCc2ccc(C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)o2)c(C)c1 736693482 ILMSITMPAZQIME-UHFFFAOYSA-N 443.507 4.701 50 10 IJGE O=C(NN=Cc1ccccc1OCc1ccccc1Cl)C(=O)Nc1cccc(Cl)c1 1083950875 DIJCONCFTBUENO-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cc(Br)cc(C(F)(F)F)c1 1453767934 FDWDOKSCRVKRET-UHFFFAOYSA-N 443.248 4.831 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2sc(-c3ccco3)nc2-c2ccccc2)c1 1637295225 ROEPXKNELVDUDS-UHFFFAOYSA-N 444.541 4.683 50 10 IJGE C=CCOc1ccc(Br)cc1NC(=O)NNc1ccnc(C(F)(F)F)c1 1672214639 WETTXWUHRYHUPE-UHFFFAOYSA-N 431.212 4.576 50 10 IJGE COc1cc(C=NNC(=O)COc2cc(C)cc(C)c2)ccc1OCc1ccccc1C 1772754478 WMDZOJQLWGNARC-UHFFFAOYSA-N 432.520 4.729 50 10 IJGE CCCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@H]2c1cccc(OCC)c1 1865690547 UOFUUFKXUIHEOX-OAQYLSRUSA-N 430.508 4.586 50 10 IJGE Cn1cc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccn2)c2ccccc21 1865699296 PUUFXNOLANOKLO-HSZRJFAPSA-N 444.498 4.644 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@H]1c1cccc(F)c1 1865711026 OGXQEPVHFCVEMI-INIZCTEOSA-N 448.807 4.961 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)/C=C/c1ccccc1 1865759126 JRVYWYBXJIQBFU-KPKJPENVSA-N 426.303 4.838 50 10 IJGE CC(C)(C)Oc1cccc(CCNC(=O)/C(C#N)=C/c2ccc(Br)cc2)c1 1866128636 CTHUUZFMTDIFLC-QGOAFFKASA-N 427.342 4.892 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCCCC[C@@H]1NC(=O)OC(C)(C)C 1880761480 NTZAQNKGUKUECK-QLFBSQMISA-N 435.403 4.748 50 10 IJGE CC1(C)C[C@@H](Br)CN1C(=O)c1cc(Br)c(Br)s1 1949216409 RXBDQGCWNLKPRZ-ZCFIWIBFSA-N 446.002 4.661 50 10 IJGE BrC[C@H]1CSCCN1Cc1cc(Br)ccc1Br 2006497501 VGBPMCIYBGOBFM-NSHDSACASA-N 444.030 4.524 50 10 IJGE CC1(C)OC[C@@H](Cc2ccc(I)c(Cl)c2)[C@H]1Br 2026566280 IXGQWNQKICROBA-BXKDBHETSA-N 429.523 4.676 50 10 IJGE Cc1c([C@H](Br)c2ccc(F)c(Br)c2)nn(C)c1Br 2049257642 FGOSGSRSXLUSBY-SNVBAGLBSA-N 440.936 4.877 50 10 IJGE CC[C@@H](Br)c1cn(Cc2cc(Br)ccc2Br)nn1 2054711083 AYDJDTFWCSEHFX-SNVBAGLBSA-N 437.961 4.697 50 10 IJGE FCCC1([C@H](Br)c2cc(I)cc3c2OCC3)CC1 2074482245 YZFYGQULSGNHRX-CYBMUJFWSA-N 425.079 4.802 50 10 IJGE C=CC[C@H](CBr)CNC(=O)c1cccc(Br)c1Br 2082046528 JXDNGRDXPDQGTR-SECBINFHSA-N 439.973 4.529 50 10 IJGE CC1(C)CN(Cc2ccccc2)CCN(c2nc3ccccn3c2CBr)C1 2150467655 FJIJLFHSPUCGQX-UHFFFAOYSA-N 427.390 4.578 50 10 IJGE Cc1csc(C(=O)N2C[C@@]3(CBr)CCC[C@]3(F)C2)c1Br 2176637687 WHNKPDOWRGEJPB-KBPBESRZSA-N 425.161 4.548 50 10 IJGE CC(C)CC[C@@H](C)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2186024805 JNFVDQSKLIWKPV-SNVBAGLBSA-N 447.258 4.851 50 10 IJGE O=C(c1cnc(C(F)(F)F)s1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 2260729213 CLLQPWNUYFWMON-ZDUSSCGKSA-N 433.293 4.978 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]([S@@](C)(=O)=NCCCCCCCBr)C1 2263163860 APTSZDWFPMNPJK-PUAOIOHZSA-N 439.460 4.829 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CC(F)C2)C2(CCCCC2)C1 2265633712 YVKDLYLMDYGPMV-UHFFFAOYSA-N 433.406 4.755 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1-n1c(C)cc(C=C(C#N)C(=O)N2CCc3ccccc3C2)c1C 2295181758 BRGNSCAFRMHRKP-UHFFFAOYSA-N 440.503 4.803 50 10 IJGE CCC[C@H]1CN(Cc2sccc2I)C[C@H]1CBr 2301079534 VHEHPNYKURAWLC-WDEREUQCSA-N 428.177 4.596 50 10 IJGE Cc1c(C=C(C#N)C(=O)NC[C@H]2CCCO2)c2ccccc2n1Cc1ccccc1Cl 2313609465 JBSXUPSATMPARC-HXUWFJFHSA-N 433.939 4.854 50 10 IJGE BrC[C@]12CCC[C@H](CN(Cc3sccc3I)C1)C2 2316755524 UJBXTZOIKPLFBB-SMDDNHRTSA-N 440.188 4.740 50 10 IJGE Cc1c(CCl)c(Oc2cc(Br)cc(I)c2)nn1C 2316759080 JSTNRPHTOIMWQP-UHFFFAOYSA-N 441.494 4.627 50 10 IJGE BrC1CCC2(CC1)CCN(Cc1sccc1I)C2 2316763321 AIQLOFSSCLZHHH-UHFFFAOYSA-N 440.188 4.882 50 10 IJGE CC1(C)C[C@@H](CBr)CN1Cc1ccc(Cl)cc1I 2318541143 SNPJWZLFYYSFRG-JTQLQIEISA-N 442.566 4.940 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)C=Cc3cccc(OC(C)C)c3)c(C)n2)cc1 2321124215 JFXXPKQKAUTKFY-UHFFFAOYSA-N 429.520 4.627 50 10 IJGE C[C@H]1CCCN(Cc2ccc(I)c(Br)c2)[C@@H]1CCl 2325224056 SQKGOAGKKIYWKD-IINYFYTJSA-N 442.566 4.893 50 10 IJGE CCOCc1cc(Br)c([C@@H](Cl)c2c(Br)ncn2C)s1 2337317667 QZGZYWRPGHZHMC-VIFPVBQESA-N 428.577 4.871 50 10 IJGE O=C(NC[C@H]1CCCC[C@@H]1CCl)c1ccc(Cl)cc1I 2365588570 LDNZQPLLUYVGRD-GHMZBOCLSA-N 426.125 4.720 50 10 IJGE Cc1c(Br)csc1C(=O)N1CCC[C@@H](Br)[C@@H]1C(F)(F)F 2370259861 BKIYNZAHPWKZQZ-GMSGAONNSA-N 435.103 4.749 50 10 IJGE COc1cccc(C=NNC(=O)c2ccc(OCc3cccc(Br)c3)cc2)c1 8672709 JUMHVOJOUVEUKB-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE aggregator CCCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccs2)c1 38656547 HRJIXAWTFPGMIL-JOCHJYFZSA-N 432.501 4.974 50 10 IJGE O=C(Nc1ccc(F)cc1I)c1ccc(CBr)cc1 228147337 LCZGNCFGJGQGLY-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE CC(/C=C(/C#N)C(=O)Nc1ccc(C(=O)N(C)C)cc1)=C\c1cccc(C(F)(F)F)c1 806571395 UROAHFUVQAFCMI-YGPCBGHTSA-N 427.426 4.899 50 10 IJGE Cc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3ccc(Br)cc3)cc2)cc1 1081098226 FOEVMWDTXPXUIF-UHFFFAOYSA-N 437.293 4.741 50 10 IJGE CCOc1ccc(-c2csc(/C(C#N)=C(\O)[C@@H]3CC(=O)N(C(C)C)C3)n2)c(OCC)c1 1872755414 LWIPFKJCWCXHGF-VGLIXDPASA-N 441.553 4.657 50 10 IJGE CCn1cc([C@H](Br)Cc2ccncc2Br)nc1Br 1924070609 MCJOJSWQLHEOIT-SECBINFHSA-N 437.961 4.502 50 10 IJGE BrCC[C@H](NCc1ccc(Br)cc1Br)C1CC1 1943842711 HIEPBZRWCIQSIX-ZDUSSCGKSA-N 425.990 4.865 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1Cc1c(Br)cccc1Br 1945328307 ATZSMXUSFBYLIA-ZJUUUORDSA-N 425.990 4.959 50 10 IJGE Cc1cc(C(F)(F)F)ccc1C[C@H](Br)CN1C(=O)c2ccccc2C1=O 1994838781 ZFUZPMAVCDTGSE-AWEZNQCLSA-N 426.232 4.616 50 10 IJGE C=CC[C@H](CBr)CNC(=O)c1cc(Br)sc1Br 2023522051 YFFDDWYQTFDRCY-SSDOTTSWSA-N 446.002 4.590 50 10 IJGE O=C(N[C@H]1CC[C@@H](CBr)C1)c1cc(Br)ccc1Br 2029535588 NTDNDXHVGUIROH-SCZZXKLOSA-N 439.973 4.505 50 10 IJGE CCN(C(=O)c1cccc(Br)c1Br)C(C)(C)CBr 2031482928 YPZLCWQMEIBRDL-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE FC(F)C1CC(O[C@H](CI)c2ccc(Br)cc2)C1 2035654751 OZNZIGONVSDOLT-QEWOUOOISA-N 431.058 4.986 50 10 IJGE C[C@@H]1CO[C@H](COc2c(Br)cc(Br)cc2CBr)C1 2047588864 CIXMZUQDKOFRLN-KWQFWETISA-N 442.973 4.910 50 10 IJGE C[C@@H]1CCc2c1c(CBr)nn2Cc1cc(F)ccc1I 2080702492 FCQBMIATNDWNLV-SECBINFHSA-N 449.105 4.620 50 10 IJGE Clc1cc(C[C@]2(CBr)C[C@]23CCOC3)ccc1I 2086651617 JRGUJFADHIGCTG-UONOGXRCSA-N 441.534 4.679 50 10 IJGE C[C@@H]1C[C@H](C(F)(F)F)N(CC2(CBr)CCC2)CCN1C(=O)OC(C)(C)C 2121770472 HVFHNMSYOTWRAX-ZIAGYGMSSA-N 443.348 4.814 50 10 IJGE COCCCCN(Cc1ccccc1)S(=O)(=O)c1ccc(CBr)cc1C 2123201450 XAOZBTDUYMTWCO-UHFFFAOYSA-N 440.403 4.507 50 10 IJGE C[C@H](c1nscc1Br)N(C)c1nc(CCl)ccc1Br 2130018704 LNZLUELOFJGTSQ-SSDOTTSWSA-N 425.577 4.999 50 10 IJGE Brc1ccc([C@@H](CI)OC[C@@H]2[C@H]3C[C@@H]4[C@H]2[C@@H]4C3)cc1 2134537922 KAVAGYWYUXTZBU-ZSDZXBNGSA-N 433.127 4.844 50 10 IJGE O=C(NCC[C@H]1CCCC[C@@H]1Cl)c1cc(Cl)ccc1I 2179638744 RVJOYGLBLHWYJU-MFKMUULPSA-N 426.125 4.862 50 10 IJGE O=C(NC[C@@]1(CBr)C[C@@H]1C(F)(F)F)c1cccc(OCc2ccccc2)c1 2192581190 OZMLNRVIPJQNSE-HKUYNNGSSA-N 442.275 4.959 50 10 IJGE Cc1cc(Br)c([C@H](Cl)[C@H]2CCCS(=O)(=O)C2)c(C)c1Br 2235609005 AOOPMDRXYLWHGU-IINYFYTJSA-N 444.616 4.933 50 10 IJGE Brc1ccc(OCCCCI)c(Br)c1 2241510296 IPBSQIRTRXSVDV-UHFFFAOYSA-N 433.909 4.806 50 10 IJGE Fc1ccc([C@H](CI)O[C@H]2CCN(Cc3ccccc3)C2)cc1 2244771416 LYLOIEAXECLVRO-OALUTQOASA-N 425.285 4.593 50 10 IJGE C[C@@H](Br)[C@H]1CCCN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282978933 SSKTWNSABAYLIR-BDAKNGLRSA-N 427.539 4.877 50 10 IJGE CC(F)(F)C[C@@H](CBr)NC(=O)c1cc(Br)c(F)cc1Cl 2285956573 HUSMGWXIANEMDL-LURJTMIESA-N 437.481 4.780 50 10 IJGE CC1CCN(C(=O)C(C#N)=C2S[C@H](Cc3ccc(F)cc3)C(=O)N2c2ccccc2)CC1 2296557841 HZNQHBATLYLXQQ-JOCHJYFZSA-N 449.551 4.510 50 10 IJGE C=CCc1cc(C=C(C#N)c2ccc(Br)cc2)cc(OC)c1OCC(=O)O 2313565045 ODAZCZWBERQPKX-UHFFFAOYSA-N 428.282 4.714 50 10 IJGE C[C@@H](Cl)CCCN(C)C(=O)c1ccc(I)c(Br)c1 2314480677 LVALPFRSLPHAOO-SECBINFHSA-N 444.538 4.533 50 10 IJGE Cl[C@H]1C[C@H]2C[C@H]1C[C@H]2NCc1ccc(I)c(Br)c1 2325227130 XGUNBOJZCMPMPQ-HEQLZXTPSA-N 440.550 4.549 50 10 IJGE CC(C)[C@@H]1[C@H](Br)CCN1Cc1cc(I)ccc1Cl 2327407709 UQUIJPZTDUZAHE-TZMCWYRMSA-N 442.566 4.938 50 10 IJGE ClCc1nc(OCc2ccc(Cl)cc2I)ncc1Cl 2340099952 DRJOBAGINISHOS-UHFFFAOYSA-N 429.472 4.706 50 10 IJGE O=C(N[C@H]1C[C@H](CBr)C12CCC2)c1cc(Br)c(Cl)s1 2351615745 VCMACFIZVZXGAP-XCBNKYQSSA-N 427.589 4.848 50 10 IJGE Clc1nccc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)c1CBr 2370824610 LCKOKICTIHSVCQ-LMCOJAPRSA-N 446.820 4.977 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1 9874454 MCTGXALYZVQMRM-IPMKNSEASA-N 434.536 4.736 50 10 IJGE N#C/C(=C/c1ccc(-c2cc(Cl)ccc2Cl)o1)C(=O)NNC(=O)c1ccccc1 33763826 LKLXEDOPWFKDHN-UVTDQMKNSA-N 426.259 4.622 50 10 IJGE COc1cc(/C=C(\C#N)c2nc3ccccc3s2)ccc1OCC(=O)Nc1nccs1 35520018 ITPHJMPXCKMTFB-XNTDXEJSSA-N 448.529 4.843 50 10 IJGE Cc1c(C(=O)N(C)c2ccccc2)oc2c1/C(=N/NC(=O)c1cccc(Cl)c1)CCC2 40813329 QBBJPGHVHPCETD-LGUFXXKBSA-N 435.911 4.988 50 10 IJGE COC(=O)/C(C#N)=C/c1cccc(OC(=O)CCCOc2ccc(Cl)cc2Cl)c1 40934960 NGKSVDQOXSZQAD-XNTDXEJSSA-N 434.275 4.838 50 10 IJGE CCC1CCC(=NNC(=O)CN(c2ccc(C)cc2C)S(=O)(=O)c2ccccc2)CC1 59372419 DYGYWJZEEDTGED-UHFFFAOYSA-N 441.597 4.571 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccccc2)C(=O)/C1=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1 101335074 OTRJAPGSMYKMDZ-FYJGNVAPSA-N 439.427 4.647 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)ccc1OC(=O)c1ccc(C)c(C)c1 206394745 NVVMUPYUIOIIDS-UCQKPKSFSA-N 440.499 4.755 50 10 IJGE CCCc1cc(=O)oc2cc(O[C@@H](C)C(=O)NN=Cc3c(Cl)cccc3Cl)ccc12 254739380 CSZXCJDXOWLCJS-ZDUSSCGKSA-N 447.318 4.970 50 10 IJGE Cc1ccc(C(=O)Oc2ccc3ccccc3c2C=NNC(=O)COc2ccccc2)cc1 254815936 MPWMRZDLSKGOCL-UHFFFAOYSA-N 438.483 4.897 50 10 IJGE Oc1ccc([C@@H]2CN(Cc3ccccc3)C[C@@H]2CI)cc1Cl 382687054 GGLZHAWAZMUHFO-HOTGVXAUSA-N 427.713 4.696 50 10 IJGE CC[C@H](NC(=O)c1cc(Br)sc1Br)[C@H](C)Br 386959730 YVVJDVGXMINKPX-FSPLSTOPSA-N 433.991 4.565 50 10 IJGE CC1(C)CN(Cc2cc(Cl)ccc2I)CC[C@H]1Br 405311853 UMNYOEVJHJNNBW-CYBMUJFWSA-N 442.566 4.940 50 10 IJGE Cc1cc(Br)c([C@H](Br)c2nn(C)cc2Br)s1 693098896 DBBKFCDSXNKVBL-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)NC3(C(F)(F)F)CCOCC3)c2C)c1 776967102 ASTVCWAJWLVNNL-CPNJWEJPSA-N 431.458 4.537 50 10 IJGE C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NN=C(c1ccccc1)c1ccccc1 1141361470 NVTIRTLKHWYYLX-LJQANCHMSA-N 427.932 4.591 50 10 IJGE CC(=O)N1CCc2c(NC(=O)/C(C#N)=C\c3cc(C)n(-c4cccc(C)c4)c3C)cccc21 1459312541 KXOXZHJGFUYYTR-JCMHNJIXSA-N 438.531 4.857 50 10 IJGE C=C(CNC(=O)NNC(=O)c1cc(-c2ccc(C)cc2)nc2ccccc12)c1ccccc1 1673395090 FHTRFPBQOZKPFN-UHFFFAOYSA-N 436.515 4.868 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@H]1CCCC[C@H]1N(C)CC(C)(C)CI 1904651856 UYFRKTFNAWRTDI-CABCVRRESA-N 438.394 4.558 50 10 IJGE CC(C)(C)OC(=O)NC1CCC([C@@]2(C)CCC[C@H](CI)O2)CC1 1935996593 BAOHDOCTKBLTHA-PPPKJHQXSA-N 437.362 4.833 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCC[C@H](CI)O2)CCC12CCC2 1983724626 KTDLLRUQHWDDSS-KDOFPFPSSA-N 435.346 4.683 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CC[C@](C)(CI)O2)C12CCC2 1991817460 GFODWXQVXNVGEK-AEFFLSMTSA-N 435.346 4.683 50 10 IJGE Cc1cc(F)cc(C)c1[C@@H](Br)c1cc(I)sn1 2007645835 UKSTXYVIQBMCSE-LBPRGKRZSA-N 426.092 4.988 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1C(=O)c1c(Br)cccc1Br 2033086128 IYDQDXRHVAHTJZ-BDAKNGLRSA-N 439.973 4.600 50 10 IJGE FC1(F)CC(CO[C@H](CI)c2ccccc2Br)C1 2035118066 CSPPXKJOPAMIRG-GFCCVEGCSA-N 431.058 4.987 50 10 IJGE C[C@H]([C@H](Br)c1cc(I)cc2c1OCC2)C(F)(F)F 2059188615 HWUZDFSETBZYCD-LDWIPMOCSA-N 435.021 4.861 50 10 IJGE Fc1ccc(C(F)(F)F)nc1-n1nc(CBr)c(Cl)c1C(F)(F)F 2078914620 SHDPGZCHHQNDTL-UHFFFAOYSA-N 426.517 4.992 50 10 IJGE C[C@H]1CN(C[C@H](CBr)c2ccccc2)C(C)(C)CN1C(=O)OC(C)(C)C 2106786376 USIJPYPNWIVTKT-WMZOPIPTSA-N 425.411 4.885 50 10 IJGE C[C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CN1CC1(CBr)CCCCCC1 2106787498 ZIIBZOARZZZJIQ-KURKYZTESA-N 429.443 4.909 50 10 IJGE C[C@@H]1OC2(C)CC1([C@@H](Br)c1cc(I)cc3c1OCC3)C2 2156697111 BIZGIMMDWALZIY-ZVNHYRIYSA-N 449.126 4.620 50 10 IJGE Cn1nc([C@H](Br)c2cc(F)c(F)c(F)c2F)c(Br)c1Cl 2167042069 LLSORDLRLXGWSP-RXMQYKEDSA-N 436.428 4.877 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1cc(Cl)cc(Cl)c1O 2174531189 XYQZTAXBYLBVLL-SECBINFHSA-N 430.113 4.813 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCI)c2ccccc2C1 2214704723 ITGBJJXYZLDMPJ-UHFFFAOYSA-N 444.357 4.849 50 10 IJGE BrC[C@H]1C[C@@H]2CCCC[C@@H]2N1C[C@@H]1CC1(Br)Br 2298231395 YYDKWYSELVQDMD-YFKTTZPYSA-N 430.022 4.520 50 10 IJGE BrC[C@@H]1[C@H]2CN(Cc3ccc(Br)cc3Br)CC[C@@H]12 2311905333 YWSMVHCGQUWWMS-AVGNSLFASA-N 438.001 4.674 50 10 IJGE CCN(CC)C[C@H](Br)CCc1ccc(Cl)cc1I 2318532348 XJLMSWUUSPXFCJ-GFCCVEGCSA-N 444.582 4.983 50 10 IJGE Cc1cccc(C)c1N1C(=O)c2ccc(NC(=O)C(C#N)=Cc3cccc(F)c3)cc2C1=O 2329672288 IXRDKBHSAKRIRA-UHFFFAOYSA-N 439.446 4.789 50 10 IJGE COc1c(C)cc(C(=O)N(C)C[C@H](Br)COCc2ccccc2)cc1Cl 2337637056 XTTWMJKNBVIIQU-KRWDZBQOSA-N 440.765 4.709 50 10 IJGE ClCc1c(Cl)ncnc1OCc1ccc(Cl)cc1I 2340109624 HKIZYNNTXNYDJV-UHFFFAOYSA-N 429.472 4.706 50 10 IJGE Clc1cc(Br)c(CN2C[C@H](Br)C3(CCOCC3)C2)s1 2345951493 FVDHCTLKWRXQPL-NSHDSACASA-N 429.605 4.540 50 10 IJGE COc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(Cl)cc2)c1 38651290 PFXJMWUOEDRAKQ-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)COc3cccc(Cl)c3)ccc2[C@@H]1c1cccs1 38656692 YFXWNMRQZDNAEJ-NRFANRHFSA-N 438.892 4.604 50 10 IJGE Cc1ccc(Nc2ncnc(NNC(=O)c3cccc4ccccc34)c2[N+](=O)[O-])c(C)c1 40621186 HEMNKZRAABRJBO-UHFFFAOYSA-N 428.452 4.655 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C\c1c[nH]nc1-c1ccc(Br)cc1)c1ccc(F)cc1 96993737 CZRAEMMJAVSIDG-ATTDUZETSA-N 439.288 4.763 50 10 IJGE CC(C)(CCCBr)CNS(=O)(=O)c1ccc(Br)cc1Cl 227946902 HFKGPISESODYLI-UHFFFAOYSA-N 447.620 4.582 50 10 IJGE Cc1cc(C=NNC(=O)c2ccc([N+](=O)[O-])cc2)c(C)n1-c1ccccc1Br 254368081 YWKZILGGRUUWSV-UHFFFAOYSA-N 441.285 4.529 50 10 IJGE O=C(Oc1ccc(C=NNC(=O)C2CCCCC2)cc1)c1ccccc1Br 254821185 UTYUHCWXTMIWKQ-UHFFFAOYSA-N 429.314 4.699 50 10 IJGE C[C@@H](Br)CN(C(=O)c1cc(Br)cc(Br)c1)C1CC1 691364613 JOXRKJXUJQVSOL-MRVPVSSYSA-N 439.973 4.600 50 10 IJGE Clc1ccc(I)c(C[C@@H](CBr)C2CCOCC2)c1 696852924 MMJGKBGKTFNMQI-LBPRGKRZSA-N 443.550 4.925 50 10 IJGE Cn1c(Cl)cnc1COc1c(Br)cc(Br)cc1CCl 700197885 KXDKTKPXMZLQHZ-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)c1C 736694280 UVYIRGNXQRQHAI-UHFFFAOYSA-N 448.914 4.540 50 10 IJGE CCCCc1ccc(C(=O)CCC(=O)NNc2nc(-c3cccnc3)nc(C)c2C)cc1 736695104 RXWBZSWHRGRWRQ-UHFFFAOYSA-N 431.540 4.604 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N2CCn3c(C(C)C)nnc3[C@H]2C)c(C)n1C1CCCCC1 784698000 FWFFTUXSDGOLAI-BWCLHNGZSA-N 434.588 4.835 50 10 IJGE CC(C)c1noc2nc(C3CC3)cc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c12 799748958 GNEFTKLQMBQMKX-UHFFFAOYSA-N 429.402 4.871 50 10 IJGE BrC[C@@H](CN1CCN(Cc2cccc(OCc3ccccc3)c2)CC1)C1CC1 1655284218 QPSQFQCXUPHEHU-QHCPKHFHSA-N 443.429 4.804 50 10 IJGE C#CC[C@@H](NC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1ccccc1 1670716245 KVDSGFDJQIEERU-HSZRJFAPSA-N 447.922 4.628 50 10 IJGE Cc1c(C(=O)N(C)c2ccccc2)oc2c1C(=NNC(=O)c1cccc(Cl)c1)CCC2 1772746126 QBBJPGHVHPCETD-UHFFFAOYSA-N 435.911 4.988 50 10 IJGE COc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(Cl)c(Cl)c2)cc1 1865685870 NXHPNQCFHXWEKV-IBGZPJMESA-N 427.291 4.714 50 10 IJGE Cc1ccc(-n2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2cc(Cl)ccc2O)cc1 1865689180 LZQJLLUVJUOXLG-INIZCTEOSA-N 446.816 4.777 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccc(OC)cc1)nn2CC 1865702944 IYUYGAAOVXCMJX-NRFANRHFSA-N 430.508 4.586 50 10 IJGE COc1ccc(-c2ccc(C(=O)N/N=C\c3ccc(Cl)cc3F)c(C)n2)cc1OC 1865762645 UJESWILASPIOIB-ROTLSHHCSA-N 427.863 4.631 50 10 IJGE CCC[C@H](NC(=O)c1nc(CC(C)C)n2ccccc12)C(=O)Nc1ccc(SC#N)cc1 1866863947 GOWWNPOPFNDIET-IBGZPJMESA-N 449.580 4.643 50 10 IJGE COc1c(C)cc(Cl)cc1-c1csc(/C(C#N)=C(\O)[C@H]2CC(=O)N(C(C)C)C2)n1 1872756774 AAIYLZYIGHADKL-LAVFMPCWSA-N 431.945 4.830 50 10 IJGE O=C(N[C@H](CCl)[C@@H]1CC=CCC1)c1csc(Br)c1Br 1885065444 UDRAHLSLBHXJMV-PSASIEDQSA-N 427.589 4.967 50 10 IJGE O=C(c1ccc(Br)cn1)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915314800 SSWYUBBKJXAKJJ-QGZVFWFLSA-N 438.163 4.660 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)C(=O)c1cc(Br)ccc1Cl 1916355686 XONVEEMWIJQOJM-OAHLLOKOSA-N 431.157 4.999 50 10 IJGE CC(C)(C)OC(=O)N1CC2(CCC3(CCC[C@@H](CI)O3)CC2)C1 1923328220 XYMAGOKPIAULEN-AWEZNQCLSA-N 435.346 4.540 50 10 IJGE C[C@H](Br)C[C@@H](C)CNC(=O)c1csc(Br)c1Br 1945186805 NKYQXMBTHCFZCS-RQJHMYQMSA-N 448.018 4.813 50 10 IJGE Cc1cc(Br)c([C@@H](Br)c2cn(C)nc2Br)s1 1981648776 SRLCREWNTXHALJ-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE C[C@@]1(CBr)CCN(Cc2cc(Br)ccc2Br)C1 2006507978 NLFJJESGMQNGMQ-ZDUSSCGKSA-N 425.990 4.819 50 10 IJGE C[C@H](Br)C[C@H](C)CNC(=O)c1c(Br)cccc1Br 2033089482 UCFIWJITOCQWBN-IUCAKERBSA-N 441.989 4.751 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H]3CC[C@H](C2)C3Br)c1 2048825995 YLIYPOCMPHZRSA-XFLKPENQSA-N 440.550 4.550 50 10 IJGE CCOc1c(Br)cc(CNC2CC(Br)C2)cc1Br 2063151338 OEDBUNFUKPMGRD-UHFFFAOYSA-N 441.989 4.626 50 10 IJGE Brc1cc2c(cc1[C@H](Br)[C@H]1C[C@@H]1Br)OCCCO2 2076174834 XQSFLEITDXWPIM-DXVIDONBSA-N 440.957 4.830 50 10 IJGE C[C@@H]1C[C@H](Br)CCN(Cc2ccc(I)c(Cl)c2)C1 2086652306 OLYMQZPQEKQFLV-ZYHUDNBSSA-N 442.566 4.940 50 10 IJGE ClCCc1nc2cncc(Br)c2n1[C@@H]1CCCN(Cc2ccccc2)C1 2095445944 OFQZJCHDGAZLFM-MRXNPFEDSA-N 433.781 4.812 50 10 IJGE C[C@]1(C(F)F)C[C@H]1[C@@H](Br)c1cc(I)cc2c1OCC2 2120824405 KBRQBUPPZFBHAA-MJVIPROJSA-N 443.069 4.953 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@H](Br)[C@@H]1CCCS(=O)(=O)C1 2137655360 LTMSBUORCPEWDW-NOZJJQNGSA-N 430.589 4.672 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CC[C@H](CCl)C(F)(F)C1 2146382517 IHUHITRJIBTTED-MRVPVSSYSA-N 431.502 4.548 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)[C@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2162915118 JDWLGMJQPVJDDT-MSOLQXFVSA-N 439.394 4.737 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1cccc(OC(F)(F)F)c1 2181746911 LJZHGKXMVGJEGV-UHFFFAOYSA-N 426.526 4.581 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@H]1CCCN(CC2(CBr)CCCC2)C1 2185503743 VHKUGBGZBBPXMW-HNNXBMFYSA-N 441.414 4.891 50 10 IJGE C[C@]1(CCOCc2ccccc2)CCN1S(=O)(=O)c1ccc(Cl)c(CCl)c1 2197756829 XYPZVAWMWHTTOG-HXUWFJFHSA-N 428.381 4.839 50 10 IJGE N[C@@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@@H](Br)C1 2250746814 DLTFQLCQBXFKMG-QWMRMABFSA-N 433.916 4.663 50 10 IJGE CCO[C@@H]1C[C@@H]1[C@@H](Br)Cc1cc(Br)cc(Br)c1 2252837341 OAVMJGQZSWJZCA-FRRDWIJNSA-N 426.974 4.943 50 10 IJGE CS(=O)(=O)[C@H]1C[C@H]([C@H](Br)c2cc3sc(Br)cc3s2)C1 2278096231 IYFLPERGBBOVCS-WSFZALMZSA-N 444.235 4.985 50 10 IJGE C[C@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@@]1(C)CBr 2285844975 UBHNSIGDSPXTST-RMLUDKJBSA-N 427.539 4.735 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ncc(Cc3ccc(Cl)cc3)s2)ccc1O 2293038646 QUVVZMVXALPESA-UHFFFAOYSA-N 425.897 4.647 50 10 IJGE Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C=C(C#N)C(=O)NCc1ccccc1 2297388047 QPYOVURUFPARGY-UHFFFAOYSA-N 425.319 4.770 50 10 IJGE C[C@H]1CCN(Cc2ccc(Cl)c(I)c2)[C@@H]1CBr 2300238634 NFLGGKCUEDNVQC-TVQRCGJNSA-N 428.539 4.550 50 10 IJGE BrC[C@@H]1[C@@H]2CC[C@@H](C2)N1Cc1cc(Br)ccc1Br 2310105570 OHLOEUCHIOUNIH-LJWDBELGSA-N 438.001 4.959 50 10 IJGE C[C@@H]1CCC[C@](CBr)(Cc2nn(C)cc2I)CC1 2319152679 VPDDBDZPIHTMEE-BXUZGUMPSA-N 425.152 4.549 50 10 IJGE CCCCc1ccc(NC(=O)C(C#N)=CNCCc2ccccc2Br)cc1 2324474022 BNDOBZDXIJOXJB-UHFFFAOYSA-N 426.358 4.970 50 10 IJGE COc1c(C)cc(C)cc1-c1csc(C(C#N)=C(O)[C@H]2CC(=O)N(C(C)(C)C)C2)n1 2331373195 KZTCFHQMCFGPLN-HNNXBMFYSA-N 425.554 4.875 50 10 IJGE O=C(NC1CCCC1)[C@@H](c1ccc(F)cc1)N(Cc1ccccc1Cl)C(=O)CCl 3039515 BGIXQYSEPGOYSU-OAQYLSRUSA-N 437.342 4.847 50 10 IJGE C=CCOc1ccccc1C(=O)NNC(=O)[C@@H](CC)Oc1ccc(-c2ccccc2)cc1 14768929 AVPUDLTXGRFSJJ-HSZRJFAPSA-N 430.504 4.537 50 10 IJGE CCOC(=O)c1c(NC(=O)[C@@H](C)Cl)c(-c2ccc(OC)cc2)cn1Cc1ccccc1 23431517 OPISVIBROHPMBL-MRXNPFEDSA-N 440.927 4.955 50 10 IJGE CCOc1cc(/C=C2/C(=O)N(C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1Cl 38603034 BMUHGPIFESETTG-WOJGMQOQSA-N 436.895 4.540 50 10 IJGE CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3cccc(OC)c3)ccc21 38650437 XCDKKPKYPZGQAO-XMMPIXPASA-N 442.471 4.531 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4)ccc32)cc1 38650583 KRJIMCNVRKUGFK-XMMPIXPASA-N 426.472 4.913 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)CCCOc2cccc(C)c2)c(OCC)c1 103767789 ROWLQJXTMDOIAX-HKWRFOASSA-N 437.492 4.628 50 10 IJGE CC(C)(C)[C@H](CCCl)NS(=O)(=O)c1cc(Br)ccc1Br 231184001 KWUKIXKNJUAPBE-LBPRGKRZSA-N 447.620 4.534 50 10 IJGE CC(=NNC(=O)/C(=C\C(C)=C/c1ccccc1)NC(=O)c1ccccc1)c1ccccc1O 252610351 IAVPMFYZZSHZEZ-CQICBGTGSA-N 439.515 4.650 50 10 IJGE O=C(CNc1cccc(C(F)(F)F)c1)NN=Cc1cccc(OCc2ccccc2)c1 254318084 NBXAQBBBUIISLQ-UHFFFAOYSA-N 427.426 4.847 50 10 IJGE C/C(C=NNC(=O)CCCCC(=O)NN=C/C(C)=C\c1ccccc1)=C/c1ccccc1 254747127 RTQBUBOGZYYOFB-SRQGZVFYSA-N 430.552 4.958 50 10 IJGE O=S(=O)(Nc1ccccc1OCc1ccccc1)c1ccc(CBr)cc1 312031302 XTIPUEZXQFKWDI-UHFFFAOYSA-N 432.339 4.961 50 10 IJGE Cc1ccc(NC(=O)NNC(=O)NCc2ccc(-c3csc(C)n3)s2)c(Cl)c1 745357331 RTUAWXUSJVZCAU-UHFFFAOYSA-N 435.962 4.678 50 10 IJGE COc1ccc(-n2c(C)cc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c2C)cc1 799754608 PXIXBXMBVORVQX-UHFFFAOYSA-N 428.414 4.750 50 10 IJGE CCOc1c(Br)cc(C=NNC(=O)COc2ccc(C(C)C)cc2)cc1OC 1772753822 KRTNZOOJRRLYJY-UHFFFAOYSA-N 449.345 4.509 50 10 IJGE COc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccc(Cl)cc2)c1 1865712018 NSTBLFFRHIDZEH-INIZCTEOSA-N 446.816 4.771 50 10 IJGE CCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccc(OC)cc1)C(C#N)=C(N)O2 1865712621 CVTQLIZFJLUMKG-LJQANCHMSA-N 441.318 4.968 50 10 IJGE Cc1sc(Br)cc1[C@H](Br)c1cn(C)nc1Br 1981647889 FRGJANNSFJSPMU-VIFPVBQESA-N 428.975 4.799 50 10 IJGE BrCC1(Cc2cc(Br)ccc2Br)CCOCC1 2006498684 FVLWYTRIPGIOIH-UHFFFAOYSA-N 426.974 4.946 50 10 IJGE COc1cc([C@H](Br)[C@H]2C[C@@H]2Br)c(OC)cc1Br 2020149450 CVQNDCNLQSRMTP-DCUMQYTISA-N 428.946 4.686 50 10 IJGE CCC[C@H](CBr)CN1CC[C@@H](C(F)(F)F)[C@H](NC(=O)OC(C)(C)C)C1 2044695252 BQYJYYPQCMBHKN-MGPQQGTHSA-N 431.337 4.575 50 10 IJGE Brc1ccc(Br)c(CN2C[C@@H]3CC[C@H](Br)[C@H]3C2)c1 2054715846 ZMRNBMFDAFSOSV-WFBYXXMGSA-N 438.001 4.817 50 10 IJGE CC[C@@H](Cl)[C@@H](CC)NC(=O)c1ccc(Br)cc1I 2086152270 ZFDSVPJYRMDKDD-ZYHUDNBSSA-N 444.538 4.580 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)C[C@@H]1CCC[C@@H]1Br 2086653427 XYHYYJITNYKGFR-RYUDHWBXSA-N 442.566 4.940 50 10 IJGE Cn1nc(COc2ccc(CCl)cc2Br)c(Br)c1Cl 2096688616 NVZPCNPCCAFMHV-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE O=S1(=O)CCC[C@H]([C@H](Br)c2cc(Br)c(Cl)cc2F)C1 2097823901 KQHIYUAEDIECNU-MADCSZMMSA-N 434.552 4.502 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@@H](NC(=O)[C@@H](Br)C2CCCC2)C1 2110716186 VDDICGPZCSULMP-UAGQMJEPSA-N 431.415 4.530 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@@H]2C[C@H](Br)CC[C@H]21 2115927852 GLZNMCATBLZYIO-NQMVMOMDSA-N 427.589 4.942 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)[C@@H](CCCl)C(F)(F)F 2142943579 NDOROFBRTYVHNR-NSHDSACASA-N 426.047 4.936 50 10 IJGE CCCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2167031429 IOODMMREARUVKN-MSOLQXFVSA-N 445.442 4.968 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](CN(C(=O)[C@@H](Br)C2CCCC2)C2CC2)C1 2167033418 RACQLPPRUOBECR-QAPCUYQASA-N 443.426 4.578 50 10 IJGE O=C1COc2ccc([C@@H](Br)c3cc(Br)c(Cl)s3)cc2N1 2172569025 IUKIWOBUCMAISR-GFCCVEGCSA-N 437.540 4.979 50 10 IJGE ClCc1ccc(Br)c(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)n1 2177043964 JQQFTKAOBJVFSQ-RBAQFSTRSA-N 446.820 4.930 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@H](CBr)C2CC2)C[C@@H]1c1ccccc1 2185528325 HBLILFWUYYNPPS-XUVXKRRUSA-N 437.422 4.648 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2OCCN(CCCCCCCCCBr)[C@H]2C1 2185534913 XLRFJXDPNZOTBF-OALUTQOASA-N 447.458 4.822 50 10 IJGE CC(C)[C@H](Cl)c1cn(-c2ccc(Br)cc2I)nn1 2223626184 GXMSRTRDPWZNEN-LBPRGKRZSA-N 440.510 4.570 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)Cc1ccc(C(F)(F)F)cc1Cl 2243963014 UOLWPSUUMKHYSS-LBPRGKRZSA-N 446.650 4.961 50 10 IJGE CC[C@H](Br)[C@H](CC)NC(=O)c1ccc(Cl)c(I)c1 2256386511 BZNZQMBUZDOVQX-CABZTGNLSA-N 444.538 4.627 50 10 IJGE COC[C@@]1(C)C[C@@]1(CBr)Cc1cc(Cl)ccc1I 2257075770 UYCXXYXHKCGUDX-ZIAGYGMSSA-N 443.550 4.925 50 10 IJGE C[C@H]1[C@@H](Br)C[C@@H](C)CN1C(=O)c1cc(F)c(Br)cc1Cl 2282971419 CEUYPDHOEQJFRS-WEDXCCLWSA-N 427.539 4.876 50 10 IJGE O=C(NC[C@@H](CBr)C1CCC1)c1cc(Br)c(F)cc1Cl 2285846670 QQIGASBFPPRIMD-SECBINFHSA-N 427.539 4.783 50 10 IJGE C[C@H]1CCN(Cc2cc(I)ccc2Cl)[C@H]1CBr 2307324123 IOKPQFJSJLHHCY-ZANVPECISA-N 428.539 4.550 50 10 IJGE Clc1ccc(CN2C[C@H]3C[C@H]2CC[C@@H]3Br)cc1I 2315552290 CHOHZGQKDMEZNF-UTUOFQBUSA-N 440.550 4.692 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC=C(C#N)C(=O)Nc1ccc(Oc2ccccc2)cc1 2325129951 LVTAGMCKJIOFAC-UHFFFAOYSA-N 430.420 4.854 50 10 IJGE ClCC[C@@H]1CCC[C@@H]1NCc1ccc(I)c(Br)c1 2325207169 OOBRSQLJMMCWEH-FZMZJTMJSA-N 442.566 4.941 50 10 IJGE ClC1CCC(CNCc2ccc(I)c(Br)c2)CC1 2325207914 SISKEIVRVQQKJK-UHFFFAOYSA-N 442.566 4.941 50 10 IJGE CC(C)(C)OC(=O)Nc1cnn2c1N(C[C@@](C)(CBr)C(C)(C)C)CCC2 2352107782 QMKNAMSZMZJZGA-LJQANCHMSA-N 429.403 4.888 50 10 IJGE C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 14031620 UPTFNBXZHYWZLB-ZIAGYGMSSA-N 447.318 4.529 50 10 IJGE CCCCOc1ccc(/C=C(/C#N)C(=O)Nc2sc3c(c2C(N)=O)CC[C@H](C)C3)cc1 35253608 LPYWLVSRMUSQDE-SUCHYCSPSA-N 437.565 4.696 50 10 IJGE CCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccc(F)cc1 38653163 QLCGZPKRRDDOCH-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE COCCc1ccc([C@@H](Br)c2cccc(I)c2)cc1 104022925 ZZGNIRIVMOOSHJ-MRXNPFEDSA-N 431.111 4.964 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)CCCOc2ccc(CC)cc2)cc1 207143973 HAQXVIZIELSIDT-PYCFMQQDSA-N 434.536 4.837 50 10 IJGE COCCCOCCC(CBr)(CBr)c1cccc(Cl)c1 232239970 AMNOMZWHQOWWFR-UHFFFAOYSA-N 428.592 4.811 50 10 IJGE CC(C)(C)[C@H](CBr)NC(=O)c1ccc(Br)cc1Br 393955804 ILGLGNDYPVDOJT-NSHDSACASA-N 441.989 4.751 50 10 IJGE C[C@@H](Br)CN(C(=O)c1ccc(Br)cc1Br)C1CC1 691365091 MCZWTTPQWDBZPT-MRVPVSSYSA-N 439.973 4.600 50 10 IJGE COC1CC(COc2c(Br)cc(CBr)cc2Br)C1 703887886 FEIGGDYUFROMEQ-UHFFFAOYSA-N 442.973 4.910 50 10 IJGE Cn1cc(C[C@@H](CBr)c2ccccc2Br)c(Br)n1 714085767 QSALKPHIEMIBMP-VIFPVBQESA-N 436.973 4.666 50 10 IJGE Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)NNC(=O)c1ccc(Cl)cc1 729616171 IKTCTXRUUXMDNZ-LBPRGKRZSA-N 432.908 4.616 50 10 IJGE CC(C)(CNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)c1cccc(F)c1 735658216 DFZGGLDTSWPBIX-XSFVSMFZSA-N 441.510 4.604 50 10 IJGE COc1cc(NC(=O)OC(C)(C)C)c(Cl)cc1C(=O)NNc1cccc(F)c1F 743724234 DDXLEAORIUAVIW-UHFFFAOYSA-N 427.835 4.731 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N2CCc3n[nH]cc3C2)c(C)n1-c1cccc(Cl)c1Cl 743901335 HSLJSZPYTWXCRM-CXUHLZMHSA-N 440.334 4.616 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc(-n3c(C)ccc3-c3ccccc3)cc2)cc1O 1084312764 SKJMFEZXYODONY-UHFFFAOYSA-N 425.488 4.931 50 10 IJGE O=C(NN=Cc1ccc(-c2ccc(Cl)c(Cl)c2)o1)C(=O)Nc1cccc(Cl)c1 1084312927 ZCUGVINOKJHHEH-UHFFFAOYSA-N 436.682 4.996 50 10 IJGE C#C[C@@H]1CCCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1631298889 SKTRGADECFAYPB-RXWSAZGZSA-N 436.353 4.635 50 10 IJGE C[C@H](CC(=O)NNc1nc2ccccc2[nH]c1=S)c1ccc(F)c(Br)c1 1646017025 DUTJHXUSSLLFQH-SNVBAGLBSA-N 435.322 4.831 50 10 IJGE Cc1ccc(Cl)cc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1cccnc1)CCC2 1772745698 IIEAZSNHIILSQI-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE Cc1c(C(=O)Nc2nc3ccccc3s2)oc2c1C(=NNC(=O)c1ccco1)CCC2 1772746619 DUCFIYKSSQJTQC-UHFFFAOYSA-N 434.477 4.513 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3CC(C)C)cc1OC 1865696226 YPNRZBLTCVWFLP-JOCHJYFZSA-N 444.535 4.832 50 10 IJGE O=C(NNC(=S)c1cccc(Cl)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 1865845205 AWJBONYHTOMGJL-UHFFFAOYSA-N 426.769 4.988 50 10 IJGE CCCc1nc(Nc2ccc(SC#N)cc2)cc(N2CCO[C@@H](c3ccncc3)C2)n1 1868389233 TUPQRTSLHALUPB-HXUWFJFHSA-N 432.553 4.719 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C(F)(F)F 1892594545 YMPJTBHIFJGUIS-XQQFMLRXSA-N 430.895 4.697 50 10 IJGE Cc1cnc2c(S(=O)(=O)N(Cc3ccccc3)[C@H](C)CBr)cccc2c1 1914346993 BWHKXRFJOCJDND-MRXNPFEDSA-N 433.371 4.518 50 10 IJGE C[C@@H](c1ccncc1Br)[C@H](Br)c1cnn(C)c1Br 1924047842 QJXPZELZOBGFQU-CPCISQLKSA-N 437.961 4.580 50 10 IJGE CC(C)[C@@](C)(CBr)NC(=O)c1csc(Br)c1Br 1945186083 AZSSFUZWEVMPGU-LLVKDONJSA-N 448.018 4.813 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@@H]2CCC[C@@H](Cl)[C@H]2C1 2094583769 LOMRWTKBUAVRTD-OYNCUSHFSA-N 427.589 4.753 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H](N(CC1(CBr)CCC1)C1CC1)C(F)(F)F 2106788949 UUFGEZBHBFXILB-AWEZNQCLSA-N 443.348 4.862 50 10 IJGE Cn1ncc(Cl)c1COc1c(Br)cc(Br)cc1CCl 2111948772 PQIDJELAXTVDNL-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE C[C@]1(COc2c(Br)cc(Br)cc2CCl)CSCCO1 2136557319 ZABZBUBDEUPZNE-ZDUSSCGKSA-N 430.589 4.851 50 10 IJGE CC(C)(C)OC(=O)NCC1(CNC(=O)c2ccc(CBr)cc2)CCCCC1 2162493854 BAQXLILLVCNYPS-UHFFFAOYSA-N 439.394 4.787 50 10 IJGE CC(C)N(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)c1ccc(CBr)cc1 2162912539 XBUBQJZNTDETGQ-SFHVURJKSA-N 439.394 4.832 50 10 IJGE CN(C(=O)c1ccc(Cl)c(Br)c1)C1(CBr)CCSCC1 2171181312 DAMHCSXDMUPRKW-UHFFFAOYSA-N 441.616 4.835 50 10 IJGE C[C@@H](Cl)CCCN(C)Cc1ccc(I)c(Br)c1 2306230690 ADJYBSAPTQQONN-SNVBAGLBSA-N 430.555 4.893 50 10 IJGE N#CC(=Cc1c[nH]nc1-c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(Cl)cc(Cl)c1 2314489999 WSKDMIKPIWJYBE-UHFFFAOYSA-N 428.235 4.837 50 10 IJGE O=C(NN=Cc1c(C(=O)O)[nH]c2ccc(Cl)cc12)c1ccc2[nH]c3c(c2c1)CCCC3 2321672282 AXWDTJDKFVWRNL-UHFFFAOYSA-N 434.883 4.644 50 10 IJGE CCOc1cc(C=NNC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)cc([N+](=O)[O-])c1OCC 2323138617 WFRTVDRJNSLASZ-MDQWUCQQSA-N 443.544 4.839 50 10 IJGE CC[C@@H]1CN(Cc2ccc(I)c(Br)c2)C[C@H]1CCl 2325213379 UANAXHJMJKSJIA-VXGBXAGGSA-N 442.566 4.751 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2sc3c(c2C(N)=O)CC[C@H](C(C)(C)C)C3)cc1 2329622483 SNWLXSGPOSGQBW-INIZCTEOSA-N 437.565 4.552 50 10 IJGE N#Cc1cc(CBr)ccc1OCc1cccc(I)c1 2341793047 PMLXKWUVWKEQKL-UHFFFAOYSA-N 428.067 4.637 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@@H]1C[C@@H]2CBr 2359286278 SNYCUBXSGZLNGL-RBDZCENOSA-N 425.523 4.630 50 10 IJGE CC1(C)C[C@H](Cl)CCN(C(=O)c2ccc(Cl)cc2I)C1 2365585515 BRJHUJCTDMDSAW-LLVKDONJSA-N 426.125 4.814 50 10 IJGE CC[C@H](Oc1ccc2ccccc2c1Br)C(=O)N/N=C/c1ccccc1OC 20572894 OFHKZAGLJBOVJD-MAKCPWPFSA-N 441.325 4.919 50 10 IJGE ClC[C@@H](I)[C@H](CCl)OCc1ccc(Br)cc1 158539722 ARSJONRFLKEQKM-MNOVXSKESA-N 437.930 4.616 50 10 IJGE CC(=NNC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@H]2C)cc1)c1ccc(Cl)s1 254288354 DSXACJQJAYZSOK-GASCZTMLSA-N 447.988 4.724 50 10 IJGE Cl[C@H](c1ccoc1Br)c1cc(I)cc2c1OCC2 381115568 WGAONBOBZPZESH-LLVKDONJSA-N 439.474 4.910 50 10 IJGE Cc1ccsc1[C@@H]1CN(C(=O)OCc2ccccc2)C[C@@H]1CI 394745643 ZZVIBZWGJIRFHP-JKSUJKDBSA-N 441.334 4.844 50 10 IJGE Brc1ccccc1[C@@H](CI)OCCOCC1CCC1 400699404 LVCREWOGQYUTCF-OAHLLOKOSA-N 439.131 4.759 50 10 IJGE C[C@H]1C[C@H](Br)CN(C(=O)c2cc(Br)c(Br)s2)C1 401884269 DPULGXTZYWNBKB-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE O=S(=O)(CCCCCl)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 788062678 NOSYNUSRKZMAFX-UHFFFAOYSA-N 426.325 4.836 50 10 IJGE Cc1ccc(NC(=O)NN=C2c3ccccc3C[C@H]2NC(=O)c2cccc(Cl)c2)cc1 1088700339 GPPBZHZJXXFSGA-OAQYLSRUSA-N 432.911 4.529 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2ccc(-c3cc(O)n[nH]3)cc2)c(C)n1-c1ccccc1F 1540729002 DVKKUXFNRGGMRE-UNOMPAQXSA-N 441.466 4.875 50 10 IJGE CCCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@@H]2c1cccc(OCC)c1 1865690546 UOFUUFKXUIHEOX-NRFANRHFSA-N 430.508 4.586 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccc(OC)cc1)nn2CCC 1865690792 BEYZWWOERUPDSV-JOCHJYFZSA-N 442.519 4.752 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)C(=O)Cc1ccc(Br)cc1 1914608010 OALDLFVAOZRSJG-CQSZACIVSA-N 425.164 4.804 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1cnn(-c2ccccc2)c1 1915273504 MDFJNVLACSTHJH-NRFANRHFSA-N 426.358 4.934 50 10 IJGE CC[C@H](Br)C(=O)Nc1ccc(Cl)c(I)c1Cl 1937733459 IBHSAJDEBMOMPM-YFKPBYRVSA-N 436.902 4.710 50 10 IJGE C[C@H]1CC[C@H](Br)CN1Cc1ccc(Br)cc1Br 1943860916 ZNZLZCNEOVRLTP-CABZTGNLSA-N 425.990 4.959 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@H]1Cc1cc(Br)ccc1Br 2007127205 CVIZFQSHBGPERX-SUZMYJTESA-N 426.974 4.943 50 10 IJGE C[C@H]1C[C@@H](CBr)CCN1Cc1ccc(I)c(Cl)c1 2086655555 OPRDITZKLDGTGO-QWRGUYRKSA-N 442.566 4.940 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC2(CC[C@@H]1CCl)CC2 2097886576 BPDCEOXXAQVSPY-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE COc1cc(CCl)cc(Br)c1OCc1cnsc1Br 2119236979 IVAPAGDTJRVOSN-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE Br[C@@H]1CC[C@@H]2CCN(Cc3ccc(I)cc3)C[C@H]2C1 2139246756 BLAOYMLCRIAQHS-RBSFLKMASA-N 434.159 4.677 50 10 IJGE CCCN(CC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)[C@@H](Br)C1CCCC1 2167032608 NKTCGNBWFUGZBQ-SFHVURJKSA-N 445.442 4.826 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@@H](CBr)c2cscn2)cc1Cl 2175668817 JIOWDLYSHUOQMI-NSHDSACASA-N 438.572 4.733 50 10 IJGE CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)N2CCCCCI 2211185560 KIWJCHBPMCMDNT-MQVJKMGUSA-N 436.378 4.502 50 10 IJGE Cc1ccc(I)c(C(=O)N[C@H](C)CCCCCBr)c1 2232167290 TTYVFUJBTRTISZ-GFCCVEGCSA-N 438.147 4.673 50 10 IJGE Cn1nc(Br)c([C@@H](Cl)c2cc3sc(Br)cc3s2)n1 2263556997 ZCWSOJUPDVAQFK-QMMMGPOBSA-N 427.574 4.945 50 10 IJGE O=C(NC[C@@H]1CCCC[C@H]1Br)c1cc(F)c(Br)cc1Cl 2282972774 UDXVYGTVVJPIGZ-WCBMZHEXSA-N 427.539 4.925 50 10 IJGE C[C@H]1CN(CCCCCCCCCBr)CC2(CN(C(=O)OC(C)(C)C)C2)O1 2288581183 ZWJQCIZIUVCTFJ-SFHVURJKSA-N 447.458 4.822 50 10 IJGE CC(=O)c1cc2c(cc1NC=C(C#N)c1nc(-c3ccc([N+](=O)[O-])cc3)cs1)OCO2 2295956304 ZDIXYMLJAGFZAB-UHFFFAOYSA-N 434.433 4.626 50 10 IJGE O=S1(=O)CC[C@H]1[C@H](Br)c1c(F)cc(Cl)c(Br)c1Cl 2313742363 FYTNEYZMMATPDR-RCOVLWMOSA-N 440.943 4.518 50 10 IJGE CCCN1C[C@@H](Br)[C@@H](Cc2ccc(Cl)c(I)c2)C1 2315548559 IIMLQPMNCQZRQI-NWDGAFQWSA-N 442.566 4.592 50 10 IJGE C[C@H]1C[C@@H](Br)[C@H](C)CN1Cc1ccc(Cl)cc1I 2318557840 OXDIJHNSAVKFTR-GBIKHYSHSA-N 442.566 4.938 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2ccc3nc(Cc4ccc(OC)cc4)[nH]c3c2)cc1 2323720548 HJURCGSILYHKGC-UHFFFAOYSA-N 442.519 4.715 50 10 IJGE FC1(F)C[C@]1(CBr)Cn1ccc2cc(I)ccc21 2326886483 HVIKUXPONULHDK-LBPRGKRZSA-N 426.042 4.666 50 10 IJGE CC(C)(C)OC(=O)NCCCN(C[C@@]1(CBr)CC1(F)F)c1ccccc1 2351888696 YBARPBLMYRRLLS-SFHVURJKSA-N 433.337 4.828 50 10 IJGE COc1ccc(CCCCO[C@H](CCl)[C@H](I)CCl)cc1 2370109839 CQZGPSUQERFXSR-HUUCEWRRSA-N 431.141 4.684 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1Br)c1cc(Br)ccc1Br 161220930 JMJYKIKQLNEJAF-NEPJUHHUSA-N 439.973 4.648 50 10 IJGE Nc1nc2ccc(C(=O)N/N=C\c3cccc(OCc4ccc(Cl)cc4)c3)cc2s1 169916710 VNYUWLDPDQQAFZ-ROTLSHHCSA-N 436.924 4.875 50 10 IJGE ClCc1ccc2sc(I)cc2c1I 306815494 BLHTYEBSGDSFDA-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE C[C@@H]1CCN(Cc2cc(Cl)ccc2I)[C@H]1CBr 405329384 FPNKRXWWMFRMAV-RNCFNFMXSA-N 428.539 4.550 50 10 IJGE CC(C)c1cnc(COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)s1 783484783 BPIVAZQABLQYET-WOJGMQOQSA-N 431.521 4.694 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)c1cccc(Cl)c1 1523453793 WIDFTDWCKNDFAH-DTQAZKPQSA-N 438.886 4.923 50 10 IJGE CC(=O)CCc1ccc(OCc2cccc(C(=O)NNc3nc4ccncc4s3)c2)cc1 1587039256 SNOAPZLSJBMBEW-UHFFFAOYSA-N 446.532 4.549 50 10 IJGE CC(C)Oc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2-c1ccccn1 1865705152 NMHJSFVNZDAFOR-HSZRJFAPSA-N 449.514 4.940 50 10 IJGE COc1ccc(OC)c(C/C(O)=C(\C#N)c2nc(-c3ccc(OC)c(OC)c3)cs2)c1 1872745483 OXMJIEYGNWEDCU-ZPHPHTNESA-N 438.505 4.880 50 10 IJGE BrCC[C@@H]1CCCN1Cc1cc(Br)ccc1Br 2006504247 XSYQQWPUJSLWHJ-LBPRGKRZSA-N 425.990 4.961 50 10 IJGE CC[C@@H](C)[C@H](Br)CNC(=O)c1c(Br)cccc1Br 2033090828 JTPDQFZMZUPLEQ-LDYMZIIASA-N 441.989 4.751 50 10 IJGE C[C@@H](c1nscc1Br)N(C)c1ncc(CCl)cc1Br 2130018440 IRCGDWDORZFDEJ-ZETCQYMHSA-N 425.577 4.999 50 10 IJGE CC(C)CN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2167030589 CTECFFVGNHWKQK-ZWKOTPCHSA-N 445.442 4.824 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1CN(CC1CC1)C(=O)[C@@H](Br)C1CCCC1 2167033141 PTXCIZUDSOUKRF-ROUUACIJSA-N 443.426 4.578 50 10 IJGE COc1ccc([C@@H](Cl)c2sncc2Br)cc1I 2248889750 PGJGGXMOEJHSEL-SNVBAGLBSA-N 444.519 4.847 50 10 IJGE CC[C@H](NC(=O)c1ccc(Cl)c(I)c1)[C@H](Br)CC 2256386517 BZNZQMBUZDOVQX-SKDRFNHKSA-N 444.538 4.627 50 10 IJGE O=S1(=O)CCC[C@@H]1[C@H](Cl)c1ccc(OCc2ccccc2)cc1Br 2299534086 ZWKSZACDBTWOJG-QZTJIDSGSA-N 429.763 4.885 50 10 IJGE Clc1ccc(COc2ncc(CBr)s2)c(I)c1 2301821060 SUFUNNLWSPPJJF-UHFFFAOYSA-N 444.519 4.875 50 10 IJGE Cl[C@H]1CCC[C@@H](NCc2ccc(I)c(Br)c2)C1 2306223121 AUBGWXCYEIFJDD-WDEREUQCSA-N 428.539 4.693 50 10 IJGE CC(C)(CI)CN1CCc2cc(NC(=O)OC(C)(C)C)ccc2C1 2306817146 XJFGBXPLFVYWRA-UHFFFAOYSA-N 444.357 4.853 50 10 IJGE CC(C)[C@H](CBr)N(C)C(=O)c1ccc(Br)cc1Br 2318854480 MQVRWQNFYUJVKW-LBPRGKRZSA-N 441.989 4.703 50 10 IJGE CCCN(CC(C)(C)CNC(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2326915592 RJZHETAXUMPBGM-KRWDZBQOSA-N 427.374 4.670 50 10 IJGE CC1(C)CC(CBr)(CN2[C@H](CNC(=O)OC(C)(C)C)C[C@@H]3CCC[C@@H]32)C1 2345010521 MGDVSLBNKIRCOG-ULQDDVLXSA-N 429.443 4.955 50 10 IJGE COc1ccc(/C=N/NC(=O)c2[nH]c3ccc([N+](=O)[O-])cc3c2-c2ccccc2)c(OC)c1 27520390 FITVZLUEZMSNTM-AFUMVMLFSA-N 444.447 4.524 50 10 IJGE COc1cc(/C=C(\C#N)c2nc3ccc(C)cc3[nH]2)ccc1OCC(=O)Nc1ccccc1 33497802 TXUZCDIBLDUXDQ-CPNJWEJPSA-N 438.487 4.962 50 10 IJGE COc1cc(/C=C(\C#N)c2nc3ccccc3[nH]2)ccc1OCc1cccc(C(=O)O)c1 33936152 HWMRMLKNUHAEBP-YBFXNURJSA-N 425.444 4.913 50 10 IJGE COc1ccccc1NC(=S)NNC(=O)c1ccc(-c2ccc(Cl)cc2Cl)o1 39892601 QJOISHAZZXQJPC-UHFFFAOYSA-N 436.320 4.893 50 10 IJGE Cc1cc(C)cc(Oc2ncnc(NNC(=O)C(c3ccccc3)c3ccccc3)c2N)c1 40681542 XWSQQNGNQOTXOG-UHFFFAOYSA-N 439.519 4.743 50 10 IJGE CCN(CC)c1ccc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccccc4)nc3c2)cc1 169925698 RUSQFZOTIVEIPK-IMRQLAEWSA-N 425.536 4.764 50 10 IJGE O=C(NC1CCC(Br)CC1)c1cc(Br)cc(Br)c1 232461955 LSOHCFBSPAIJTA-UHFFFAOYSA-N 439.973 4.648 50 10 IJGE C/C(C=NNC(=O)CSc1nnc(-c2ccccc2)n1C)=C/c1ccc(C(C)C)cc1 254738986 PYWLXCFKMPMBFS-OSLRKFFBSA-N 433.581 4.903 50 10 IJGE C[C@@H](Br)C[C@H]1CCCN1c1ncc(Br)cc1Br 304587593 RPGRCOFSYHAZLY-PSASIEDQSA-N 426.978 4.749 50 10 IJGE O=C(N[C@H](Cc1ccc(CCl)cc1)C(=O)O)OCC1c2ccccc2-c2ccccc21 309708517 IWWNAIKJCKHJQU-HSZRJFAPSA-N 435.907 4.960 50 10 IJGE FC(F)c1cc(I)cc(Br)c1CBr 575685841 NBERTZVKFIELOZ-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccc([C@@H]2CN(S(=O)(=O)c3ccccc3)CCN2)cc1 616604746 ZGZNFPJKAQLOCG-QFIPXVFZSA-N 446.689 4.544 50 10 IJGE Clc1cc(CBr)ccc1N1CC[C@]2(CN(Cc3ccccc3)CCO2)C1 717593353 ODRLHAMFDGIKAH-NRFANRHFSA-N 435.793 4.716 50 10 IJGE CC[C@](C)(CCCl)NC(=O)c1ccc(I)c(Br)c1 721606907 XTVXVZSSBJUABO-CYBMUJFWSA-N 444.538 4.581 50 10 IJGE Cc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)c2cnn(-c3ccccc3)c2)cc1 733077401 WWYGURVZZFSMAJ-UHFFFAOYSA-N 446.514 4.797 50 10 IJGE COc1cccc(NC(=O)CSc2ccccc2C(=O)NNc2cc(C)ccc2F)c1 748785100 BJSFQSVKYFRVSV-UHFFFAOYSA-N 439.512 4.630 50 10 IJGE CCc1c(C)nn(-c2cccc(C(=O)NNc3ccc(C#N)c(C(F)(F)F)c3)c2)c1C 767084202 LSCOKSLZDTXYOT-UHFFFAOYSA-N 427.430 4.699 50 10 IJGE CCC(C)(C)OCc1ccccc1NC(=O)NNC(=O)c1ccc(Br)cc1 1321040957 XSFLZSZMBXBONM-UHFFFAOYSA-N 434.334 4.621 50 10 IJGE CC(=O)CCc1ccc(O[C@@H](C)C(=O)NNc2cc(Cl)ccc2Br)cc1 1637798400 SMEZHENMHXNPEQ-ZDUSSCGKSA-N 439.737 4.535 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CC(C)C)c1 1865690279 NHEMLHLBWWVUEY-QFIPXVFZSA-N 444.535 4.832 50 10 IJGE CCCc1nn(Cc2ccccc2F)c2c1[C@@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865700222 NIPMTONTTABNGV-JOCHJYFZSA-N 427.483 4.722 50 10 IJGE CCCC[C@@H](NC(=O)c1nc(C2CC2)n2ccccc12)C(=O)Nc1ccc(SC#N)cc1 1866859533 JJHNOODTJUFKRG-LJQANCHMSA-N 447.564 4.712 50 10 IJGE CC[C@](C)(NC(=O)c1nc(CC(C)C)n2ccccc12)C(=O)Nc1ccc(SC#N)cc1 1866869419 MOZFUTDZPSNNDO-DEOSSOPVSA-N 449.580 4.643 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H](CCC(=O)NC[C@H]1C[C@@H](Br)C1)C(C)(C)C 1887795112 XLCMQLSYKMWMEA-OAGGEKHMSA-N 433.431 4.633 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cccc(C(F)(F)F)c1 1914636237 AUYXXPVCNVIBDG-CYBMUJFWSA-N 436.293 4.680 50 10 IJGE CC[C@@H](CCBr)CNC(=O)c1cccc(Br)c1Br 2031487304 SPYAFSWZHLWAFH-VIFPVBQESA-N 441.989 4.753 50 10 IJGE Brc1cccc(Br)c1CN1CC[C@H](Br)C2(CC2)C1 2033086397 LMNPVNPKVNYELW-ZDUSSCGKSA-N 438.001 4.961 50 10 IJGE Cc1cc(Br)c(CCl)c(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@H]32)c1 2173452557 GEIAQGCFVVYLRB-YADHBBJMSA-N 449.820 4.976 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1sc(C)c(C)c1Br 2221820991 VQNHEQFFKTXDBM-XVKPBYJWSA-N 444.176 4.707 50 10 IJGE F[C@@]1(COc2c(Br)cc(CBr)cc2Br)CCOC1 2222395304 NMICVUIQVIMHDM-LBPRGKRZSA-N 446.936 4.614 50 10 IJGE Cc1ccc(I)c([C@H](Br)c2ncn3ccsc23)c1 2224056516 YIIGXHANJUDFNW-NSHDSACASA-N 433.112 4.793 50 10 IJGE CCC(CC)[C@H](Br)CNC(=O)c1ccc(C)c(I)c1 2224618499 KVPJXUSARLARRZ-CYBMUJFWSA-N 438.147 4.529 50 10 IJGE O=S(=O)(Nc1ccc(Cl)cc1CBr)c1cc(Br)cs1 2231000643 CORLCNDBUHEIFA-UHFFFAOYSA-N 445.585 4.860 50 10 IJGE C[C@H](c1csnn1)n1c(CCl)nc2cc(Br)c(Br)cc21 2234077042 YMZGZEVLPRSKRB-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE C=CC[C@@]1(CBr)CCCCN1C[C@@H]1CC1(Br)Br 2250407546 WNEOFGRVWYPBKL-RYUDHWBXSA-N 430.022 4.688 50 10 IJGE BrCc1cc(Br)c(OCc2ncco2)c(Br)c1 2251310834 MXFKRFCGBBMQRQ-UHFFFAOYSA-N 425.902 4.674 50 10 IJGE Cc1nn(C)c(Oc2cc(I)ccc2Cl)c1CBr 2259929586 AMUKPIQVDVZOAW-UHFFFAOYSA-N 441.494 4.674 50 10 IJGE O=S1(=O)CCC([C@H](Br)c2cc3sc(Br)cc3s2)CC1 2278112001 NBKFESAZTFXBEX-LBPRGKRZSA-N 444.235 4.986 50 10 IJGE COC(=O)c1cc(NC=C(C#N)c2nc(-c3ccc(C)c(C)c3)cs2)cc(C(=O)OC)c1 2296764728 FPFNZJPZKOCJBO-UHFFFAOYSA-N 447.516 4.977 50 10 IJGE COc1cc(CBr)ccc1OCc1sccc1I 2316754606 KEUZIDPCOXKYKH-UHFFFAOYSA-N 439.112 4.835 50 10 IJGE COCc1ccc(CO[C@]2(CBr)CCCN(C(=O)OC(C)(C)C)C2)s1 2319550050 ULQJFAGTSFDTKA-SFHVURJKSA-N 434.396 4.576 50 10 IJGE CCOc1cc(C=NNC(=O)Cc2ccc(O)cc2)ccc1OCc1ccccc1Cl 2323341057 RWLNJJWGBZSCGG-UHFFFAOYSA-N 438.911 4.716 50 10 IJGE COc1cc2nc(C(C#N)=Cc3ccc(OCc4ccccc4)cc3)nc(O)c2cc1OC 2331039453 FNBPYGOLVDACMJ-UHFFFAOYSA-N 439.471 4.996 50 10 IJGE C[C@H](Oc1cccc(Cl)c1)C(=O)N[C@H](CCBr)COCc1ccccc1 2343705192 FJNPDRSSGYCHFV-MAUKXSAKSA-N 440.765 4.594 50 10 IJGE CN(C)c1ccnc(N2CCCC[C@H](N(C)Cc3ccccc3)C2)c1CBr 2377480994 OSCUQEAHATXDDK-IBGZPJMESA-N 431.422 4.533 50 10 IJGE O=C(NNC(=O)C(c1ccccc1)c1ccccc1)c1ccccc1OCc1ccccc1 14030759 DWIPVILKLRBXEV-UHFFFAOYSA-N 436.511 4.859 50 10 IJGE Cc1ccccc1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccc(Cl)cc1 38651317 HPMUBUKKKHPNIG-XMMPIXPASA-N 446.890 4.851 50 10 IJGE C[C@H](Oc1ccc(F)cc1)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccccc1F 38652086 QPUXZJUMBALCMO-LFVRLGFBSA-N 448.425 4.556 50 10 IJGE CC(C)(CCl)C(=O)NC1CCN(C(=O)CCCOc2ccc(C(C)(C)C)cc2)CC1 169895858 XXPPFCLSZKRVBK-UHFFFAOYSA-N 437.024 4.515 50 10 IJGE N#C/C(=C/NCCc1ccc(Br)cc1)C(=O)Nc1ccc(Cl)c(Cl)c1 217006946 LSOJPWJKFDKJNR-QBFSEMIESA-N 439.140 4.934 50 10 IJGE Cc1cc(I)ccc1N/C=C(/C#N)C(=O)Nc1cccc(C)c1C 217244402 LDEVAMBXLCCKHF-PTNGSMBKSA-N 431.277 4.675 50 10 IJGE CC[C@@H](Br)CCNC(=O)c1cc(Br)c(Br)s1 219005406 UFDFWTSGVPVADW-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE CC[C@@H]1CCCC[C@H]1O[C@@](C)(CI)CNC(=O)OC(C)(C)C 231311151 LGSLTZSJOZMFRC-CPUCHLNUSA-N 425.351 4.690 50 10 IJGE C[C@@H]1CC(O[C@H](CI)c2cccc(Br)c2)C[C@@H](C)O1 231320061 KCMDHBIQMFYPCF-UEKVPHQBSA-N 439.131 4.898 50 10 IJGE Nc1cc([C@H]2CN(Cc3ccccc3)C[C@H]2CI)ccc1Cl 382710513 GYAUUSMNOKRUQV-HZPDHXFCSA-N 426.729 4.573 50 10 IJGE CO[C@@H](CO[C@@](C)(CI)c1ccccc1Br)C(C)C 389316792 RZJFCRBMSOXUEK-GJZGRUSLSA-N 441.147 4.787 50 10 IJGE COCCn1c(C)cc(/C=C(/C#N)C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c1C 739595180 GDYSYRCGHOFSFS-XKZIYDEJSA-N 444.560 4.575 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)O[C@H]2CCOc3cc(F)ccc32)c(-c2ccccc2)n1 766305997 GEZCJCVEQIPDBG-CHMLTUNVSA-N 442.450 4.577 50 10 IJGE C[C@@H](Oc1ccccc1Cc1ccccc1)C(=O)NNc1nc2ccccc2[nH]c1=S 1640943523 RLMHDWLPTLLHKM-MRXNPFEDSA-N 430.533 4.794 50 10 IJGE C=C(C)CCNC(=O)NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1 1672887893 ONHAGHVCCRZCKQ-UHFFFAOYSA-N 429.520 4.843 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)/C=C/c1ccc(F)cc1 1865758984 CCVCBQDZLCRLIU-NYYWCZLTSA-N 444.293 4.977 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc(-c3ccc(Cl)cc3Cl)nc2C)ccc1O 1865760856 SCTVIJOBYBISCP-MYKKPKGFSA-N 430.291 4.842 50 10 IJGE CCC[C@H](CBr)CN(OCc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 1881877959 DEBWAXSHWPDZOP-GOSISDBHSA-N 441.410 4.851 50 10 IJGE C[C@H](CC(=O)N(C)C[C@@H]1C[C@H]1Br)c1ccc(NC(=O)OC(C)(C)C)cc1 1887829865 OYYBWYZIWMKNAN-UKPHBRMFSA-N 425.367 4.769 50 10 IJGE Clc1cc(I)c([C@@H](Br)C23COCC(C2)C3)s1 1901022400 BBLYASRTRRAFMC-SIDNPXFCSA-N 433.536 4.869 50 10 IJGE Cc1nn(C)c(CN(Cc2ccccc2)C(C)(C)CBr)c1Br 1915759342 BMNAWHPSUOEYAR-UHFFFAOYSA-N 429.200 4.667 50 10 IJGE CCC(=O)[C@@H](Br)Cc1ccc(Cl)c(I)c1Cl 1937733269 BZDQXGRDBSXKGD-ZETCQYMHSA-N 435.914 4.883 50 10 IJGE CCc1sc(Br)cc1[C@H](Cl)c1cnn(C)c1I 1943035817 GBHYQYQJFLIPEI-JTQLQIEISA-N 445.551 4.739 50 10 IJGE C[C@H]1[C@H](Br)CCCN1Cc1c(Br)cccc1Br 1945333842 VTDPYMMOUTXBRN-GXSJLCMTSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(OCc2ccccc2)C(=O)c2ccc(CCl)cc2)C1 1982827422 YHQMSYQDCPVVTF-UHFFFAOYSA-N 430.932 4.619 50 10 IJGE CC1(COc2c(Br)cc(Br)cc2CBr)COC1 2021401631 AEOOCDIDIJNVKC-UHFFFAOYSA-N 428.946 4.522 50 10 IJGE Oc1nc2cc([C@@H](Br)C3(Br)CCC3)c(Br)cc2[nH]1 2049230418 UHHVAEQLOGPXLP-SNVBAGLBSA-N 438.945 4.785 50 10 IJGE FC(F)Oc1ccc(I)c(CBr)c1OC(F)(F)F 2060220118 NYRLNZBTHKCJJM-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1ccc(Cl)cc1Br 2081235060 ATRXWCZYADUYRH-QPUJVOFHSA-N 444.538 4.682 50 10 IJGE C[C@H]1CC[C@@H](CBr)CN1Cc1ccc(I)c(Cl)c1 2086662698 WTROMBPZCPPNDX-JQWIXIFHSA-N 442.566 4.940 50 10 IJGE CN(c1ccc([N+](=O)[O-])cc1CBr)[C@H]1CN(Cc2ccccc2)C(C)(C)C1 2154826028 AGARCHIQRUDQNU-LJQANCHMSA-N 432.362 4.979 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@H]1CCCC[C@H]1N(C)C(=O)c1ccc(CBr)cc1 2203609226 JNODMMIPNNRXSM-MSOLQXFVSA-N 439.394 4.832 50 10 IJGE C[C@@]1([C@H](Br)c2cc(Br)c(Br)cc2F)COCCO1 2218602495 FXUNIPMIFSCJRI-NEPJUHHUSA-N 446.936 4.592 50 10 IJGE CC[C@](C)(CCBr)NC(=O)c1ccc(Cl)c(I)c1 2256385742 AKWXIMXBZACSBQ-CYBMUJFWSA-N 444.538 4.628 50 10 IJGE Cc1c(Br)ccc([C@H](Cl)C2CC(S(C)(=O)=O)C2)c1Br 2269881916 YQHPPHQWPSMLFF-KJHLLKJSSA-N 430.589 4.623 50 10 IJGE CC(C)(C)C1(O[C@H](CI)c2cccc(Br)c2)COC1 2272907052 AHYVEVOXAHRFSF-CYBMUJFWSA-N 439.131 4.757 50 10 IJGE COc1ccc(N(C)Cc2ccc(I)cc2)c(CBr)c1 2280335855 OJAQUQJIUBKLHO-UHFFFAOYSA-N 446.126 4.831 50 10 IJGE CCOC(=O)c1ccc(-n2c(C)cc(C=C(C#N)C(=O)Nc3ccc(F)cc3)c2C)cc1 2294168578 SXEJNOHGDMIHIF-UHFFFAOYSA-N 431.467 4.956 50 10 IJGE O=C(NN=Cc1c(O)c(Br)cc2ccccc12)c1ccccc1Br 2297672211 RQAPQEPGQPXNEB-UHFFFAOYSA-N 448.114 4.834 50 10 IJGE Clc1ccc(CN2C[C@H](Br)CCC23CC3)cc1I 2315550058 ZECIKQVAIVAFBH-LLVKDONJSA-N 440.550 4.837 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4)[nH]c3c2)c(OCC)c1 2323744817 HEYISFTULPYWCL-UHFFFAOYSA-N 428.492 4.791 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CC(F)(F)CN1C[C@@](C)(CBr)C(C)(C)C 2327075391 GOSHZTLDOKJQSV-SUMWQHHRSA-N 427.374 4.668 50 10 IJGE COc1cc(Cl)c(C)cc1-c1csc(C(C#N)=C(O)[C@H]2CC(=O)N(C(C)C)C2)n1 2331390428 KSFQYNPKFNJPIU-ZDUSSCGKSA-N 431.945 4.830 50 10 IJGE Cc1cnccc1CO[C@H](CI)c1cccc(Br)c1 2340137393 FJVWUKPEGIREIQ-OAHLLOKOSA-N 432.099 4.845 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3CCC[C@@H](NC(=O)OC(C)(C)C)[C@H]3C2)C1 2345010086 JKJJDWNBDTYSGS-YESZJQIVSA-N 429.443 4.813 50 10 IJGE Clc1cc(Br)c(CN2C[C@@H]3CC[C@H](CBr)O[C@H]3C2)s1 2345961954 PYACHAFBZYIQAT-NGZCFLSTSA-N 429.605 4.538 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN(C[C@]2(CBr)CC2(F)F)C1 2351886688 CLWRLQLZCWIWAB-IIDMSEBBSA-N 437.369 4.518 50 10 IJGE Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2ccccc2OCCc2ccccc2)c1 10509202 GEZREGNCMNKBRK-UHFFFAOYSA-N 446.547 4.580 50 10 IJGE CCOC(=O)C1=C(c2ccc(OC)cc2)OC(N)=C(C#N)[C@H]1c1c(Cl)cccc1Cl 35576446 MWMJYZDMBDLOMI-KRWDZBQOSA-N 445.302 4.784 50 10 IJGE COc1ccc(NC(=O)N/N=C/c2cc(C)n(-c3ccc(C(=O)O)c(Cl)c3)c2C)cc1 59679068 BFRNHWSPBHIHDP-WYMPLXKRSA-N 440.887 4.610 50 10 IJGE Cc1cccc(N2CCN(C(=O)[C@H](Br)Cc3ccccc3Cl)CC2)c1C 96574357 QVDBWOMHDVSRRC-GOSISDBHSA-N 435.793 4.612 50 10 IJGE C[C@H](CBr)CCCNC(=O)c1cc(Br)sc1Br 228280508 IOCGPMICLYCFEH-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE C[C@@]1(CBr)CCN(C(=O)c2cc(Br)c(Br)s2)C1 381399949 UZQGIVLMQTUKPW-NSHDSACASA-N 446.002 4.520 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@H](c2ccc(Br)c(F)c2)C1 382702508 PSRWPHABJLKSKN-NEPJUHHUSA-N 437.147 4.934 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CI)[C@@H](c2ccc(Cl)s2)C1 394734207 RSWITXXPCVWLDS-UWVGGRQHSA-N 427.735 4.787 50 10 IJGE COc1ccc(CNC(=O)Nc2ccc(C(=O)Nc3ccc(SC#N)cc3)cc2)cc1 586612935 BINYMBPFRMDHFI-UHFFFAOYSA-N 432.505 4.842 50 10 IJGE O=S1(=O)CCCC[C@@H]1CC(CBr)(CBr)C1CCCCC1 696843870 IPYZMTFEHCNJPP-CQSZACIVSA-N 430.246 4.700 50 10 IJGE Cc1ccc([N+](=O)[O-])c([C@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)c1 725405153 HOJNCBDLQGGCPZ-AEFFLSMTSA-N 433.302 4.650 50 10 IJGE Cc1cc(C(=O)NNc2cccc(Br)c2)ccc1NC(=O)c1cccs1 759658464 GDEVZHMAYUHVPZ-UHFFFAOYSA-N 430.327 4.828 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2ccc(OCc3ccccn3)cc2)c(C)n1CC(C)C 917755800 HFPZTSMTBFSAOI-OYKKKHCWSA-N 442.563 4.958 50 10 IJGE Cc1cc(C)c(OCC(=O)NN=Cc2c(C)nn(Cc3ccccc3Cl)c2C)c(C)c1 1084399734 RGQFLDPMLXFBMU-UHFFFAOYSA-N 438.959 4.656 50 10 IJGE Cc1ccc(OCC(=O)NN=Cc2c(C)nn(Cc3ccccc3Cl)c2C)cc1Cl 1084530834 YSTYGNZNYMQYPA-UHFFFAOYSA-N 445.350 4.693 50 10 IJGE C/C(=C/C(=O)NNC(=O)CSc1ccc(Cl)cc1)c1ccccc1C(F)(F)F 1135577418 PKOYZKNWLPJLNL-BENRWUELSA-N 428.863 4.702 50 10 IJGE C=C(C)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCCCSC#N 1617907958 QTUUQYGBTSKRLF-QHCPKHFHSA-N 449.576 4.580 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cccc(Oc3ccccc3C)c2)cc1 1627770428 GXWFWIQUIPCVCR-GOSISDBHSA-N 447.491 4.610 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1csc(Nc2cc(F)cc(F)c2)n1 1646017624 OVXUMYQZAYIGMQ-UHFFFAOYSA-N 430.465 4.528 50 10 IJGE O=C(O)c1c(Cl)c(Cl)c(Cl)c(Cl)c1C(=O)N(CCCl)CCCl 1866302201 KMIIZTBMIKLZTP-UHFFFAOYSA-N 427.926 4.918 50 10 IJGE COc1ccc(Cl)cc1N1C[C@H](/C(O)=C(\C#N)c2nc(C(C)(C)C)cs2)CC1=O 1872748938 TVCVEALVPCFDEN-NODXGKJPSA-N 431.945 4.948 50 10 IJGE C[C@@H](Br)[C@@H]1CCN(Cc2c(Br)cccc2Br)C1 1945329812 PDLWXLWDPOPOEE-NXEZZACHSA-N 425.990 4.817 50 10 IJGE Br[C@H](c1csc(I)c1)c1ncn2ccsc12 1994412969 DJOIQGSUXJMTBV-MRVPVSSYSA-N 425.114 4.546 50 10 IJGE O=C(N[C@H]1C[C@H](CCBr)C1)c1cc(Br)sc1Br 2021778544 BRMJAPJHHAHJCZ-LJGSYFOKSA-N 446.002 4.567 50 10 IJGE CCCN(CCCBr)C(=O)c1ccc(Br)cc1Br 2032094474 JFHXEEFNNMQTBE-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE CC[C@H](COC)O[C@@](C)(CI)c1ccccc1Br 2033504629 NLTJAMLJHDOVTP-RISCZKNCSA-N 427.120 4.541 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)C(C)(C)C)[C@H](C(F)(F)F)C1 2066604213 SRWQPOXWISECEI-OLZOCXBDSA-N 431.337 4.527 50 10 IJGE Clc1cc(C[C@@]2(CBr)C[C@]23CCOC3)ccc1I 2086651615 JRGUJFADHIGCTG-KBPBESRZSA-N 441.534 4.679 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@H]2[C@@H](Cl)CCC[C@H]2C1 2094588914 VSUDVRKYMGSWOV-XKSSXDPKSA-N 427.589 4.753 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCCC2)C[C@H]1C(F)(F)F 2130168916 KLTIWVROCOAVBJ-AWEZNQCLSA-N 443.348 4.815 50 10 IJGE CC[C@@H]1CC[C@H]([C@H](Br)c2cc(I)cc3c2OCC3)O1 2136704936 BPYCWLKWAILPJM-MRVWCRGKSA-N 437.115 4.620 50 10 IJGE CCc1sc(Br)cc1[C@H](Br)c1ccc(S(C)(=O)=O)cc1 2146828964 UKIUZLGOQSEZEH-CQSZACIVSA-N 438.206 4.961 50 10 IJGE CN(C)CCCN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(CCl)c1Cl 2152203331 MBTSQAJNIKYMLJ-UHFFFAOYSA-N 449.831 4.875 50 10 IJGE C[C@@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)N1CCC(CCCl)CC1 2166879323 BEMHMKFTMSLIFC-KRWDZBQOSA-N 427.035 4.897 50 10 IJGE Cc1c(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)ccnc1CBr 2205626211 QEHOYLKVTNHNSJ-UGTOYMOASA-N 426.402 4.632 50 10 IJGE O=C(NC[C@@H]1CCCN(CCCCCCCBr)C1)OCc1ccccc1 2245878760 JYFLDNVGSVWDSN-FQEVSTJZSA-N 425.411 4.970 50 10 IJGE O=C(c1cccc(Cl)c1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Br)C2 2283142357 JDDXYLMQHYZERX-VXPJTOPCSA-N 425.523 4.581 50 10 IJGE CCC[C@H]1CN(C(=O)c2ccc(Cl)c(I)c2)C[C@@H]1CCl 2283652328 SVTPFRAJBHKYBP-RYUDHWBXSA-N 426.125 4.672 50 10 IJGE CC(=O)Nc1ccc(Oc2cc(C)nc(C3CCN(C(=O)[C@H](Cl)C(C)C)CC3)n2)cc1 2296578525 XAKMKKKRIVKXPQ-OAQYLSRUSA-N 444.963 4.505 50 10 IJGE CC1(C)[C@@H](NCc2ccc(I)c(Br)c2)C[C@H]1Cl 2306216931 LIGXDCGTZHIVFP-NEPJUHHUSA-N 428.539 4.549 50 10 IJGE ClCc1cccc(OCc2cc(I)ccc2Br)n1 2318983324 WARIUEDQEIHYPB-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE CCC[C@@H]1CC[C@H](Br)[C@H](Cc2nn(C)cc2I)C1 2319222460 CYBZFPJBJVJPRU-WOPDTQHZSA-N 425.152 4.547 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Br)c2)C[C@@H]1CCl 2325217797 IDNYZIKNHYKIPB-NSHDSACASA-N 442.566 4.751 50 10 IJGE COCCOc1ccc(C=C(C#N)C(=O)Nc2nc3cc(Cl)c(OC)cc3s2)cc1 2331123854 FKFDGUFIUWBCJG-UHFFFAOYSA-N 443.912 4.529 50 10 IJGE CC(C)C[C@H](CBr)CN1CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2353821910 GUWPVROXWYVSGP-KFWWJZLASA-N 445.364 4.964 50 10 IJGE N#C/C(=C/c1cc(Cl)ccc1OCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(O)cc1 33715280 JJDXAKAKOVOLIH-WQRHYEAKSA-N 448.862 4.868 50 10 IJGE Cc1cc(Cl)ccc1Nc1ncnc(NNC(=O)c2ccccc2Cl)c1[N+](=O)[O-] 40590607 NEENCECVIRSANL-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE CN(Cc1ccccc1Cl)S(=O)(=O)c1cc(CCl)sc1Br 91271086 JLOLQUYPNPSJNE-UHFFFAOYSA-N 429.188 4.724 50 10 IJGE N#C/C(=C/Nc1ccc(F)cc1)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 216492599 SGGZEINISFSVCL-ATJXCDBQSA-N 440.522 4.579 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCC[C@H]1CCBr 304570215 OZYGNVBGMZXGEH-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2cc(Br)ccc2F)[C@@H](CBr)C1 382696383 VPLRNTMYLKDETK-GWCFXTLKSA-N 437.147 4.934 50 10 IJGE CC(C)(C)N(CCCBr)S(=O)(=O)c1c(Cl)cccc1Br 690996662 NSCCKMDSYXKTLH-UHFFFAOYSA-N 447.620 4.677 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCC[C@@H](Br)CC1 705426882 PFFPAWPKCRCOCJ-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE O=C(NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl)[C@H]1C[C@@H]1c1c(F)cccc1F 734861857 BEJSQPGCTKGHJU-UWVGGRQHSA-N 449.832 4.758 50 10 IJGE COc1ccccc1-c1ccc([C@H](C)NC(=O)NNC(=O)c2cccc3cccnc23)cc1 743575668 WASYJRCIYZMMKN-KRWDZBQOSA-N 440.503 4.616 50 10 IJGE Cc1sc2nc(CS[C@H](C)C(=O)NNc3cccc(Cl)c3C)nc(O)c2c1C 748532730 IUFUJSBZUSTHEC-GFCCVEGCSA-N 436.990 4.741 50 10 IJGE CC(C)(C)c1ncc(COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)s1 774532563 HQBAIOVAHIKHJM-PDGQHHTCSA-N 445.548 4.868 50 10 IJGE C#C[C@@H]1CCCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1631298888 SKTRGADECFAYPB-JZQBQCRLSA-N 436.353 4.635 50 10 IJGE COc1cc(C=NNC(=O)COc2cc(C)ccc2C)ccc1OCc1ccc(C)cc1 1772754261 FXYUTMCXPCBRIN-UHFFFAOYSA-N 432.520 4.729 50 10 IJGE COc1cc2c(cc1OC)[C@@H](c1cccc(F)c1)N(C(=O)/C(C#N)=C/c1ccccc1)CC2 1868112948 GJCHHFIJSFBNPA-FOBLUYJRSA-N 442.490 4.924 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1ccc(F)cc1Br 2010825732 PNVRZUMTZVSVTO-UHFFFAOYSA-N 439.416 4.584 50 10 IJGE CC(C)[C@H]1[C@H](Br)CCN1c1ncc(Br)cc1Br 2011341941 QGDCOKISYBSLPH-KOLCDFICSA-N 426.978 4.605 50 10 IJGE CC(C)(C)C[C@H](CCl)Nc1ncc(I)cc1Br 2015758206 DWUATZQLYDUECO-SECBINFHSA-N 431.543 4.904 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1C(=O)c1cc(Br)sc1Br 2018122708 ADOIUOIDROCOHE-XPUUQOCRSA-N 446.002 4.661 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NCc1ccc(I)c(Cl)c1 2026565563 CDWVQTGXEAVOKU-KOLCDFICSA-N 430.555 4.986 50 10 IJGE CCN1CCC[C@@H]([C@@H](Br)c2cscc2OCc2ccccc2)S1(=O)=O 2038676930 LDNUXGNNBZRFCL-ROUUACIJSA-N 444.416 4.577 50 10 IJGE BrC[C@@H]1C[C@H]2CN(Cc3cccc(Br)c3Br)C[C@H]12 2053982115 KKOBDCRZKIFNKX-SDDRHHMPSA-N 438.001 4.674 50 10 IJGE CCn1cc(S(=O)(=O)N(Cc2ccccc2)CC(C)(C)C)cc1CBr 2059266994 KTBAJVWSVKHBAM-UHFFFAOYSA-N 427.408 4.640 50 10 IJGE FC(F)c1ccc(I)c(I)c1CCl 2060237304 ISPGRCNKYWMDGU-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1cccc(Br)c1Cl 2081237493 YDGRBGJBGJYOCS-LDYMZIIASA-N 444.538 4.682 50 10 IJGE ClC[C@@H]1CCC2(CCC2)N1c1ncc(I)cc1Br 2084957006 ISJBXAKIKMRUTI-JTQLQIEISA-N 441.538 4.579 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@@H]2C[C@@H](Cl)CC[C@@H]21 2087666440 CBMSRTQSYNZESJ-WEDXCCLWSA-N 427.589 4.895 50 10 IJGE COCC(C)(C)N(Cc1ccccc1)S(=O)(=O)c1ccc(C)c(CBr)c1 2123200636 KSAHLMRWVMAZCD-UHFFFAOYSA-N 440.403 4.506 50 10 IJGE Clc1cccc(C(CBr)(CBr)COC[C@H]2CCCO2)c1 2149035741 MNXXFBQXMJTDEP-CQSZACIVSA-N 426.576 4.563 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1N(CCCCCI)CCCC1(C)C 2211195444 WZYLAWHEVBNSKA-OAHLLOKOSA-N 438.394 4.607 50 10 IJGE Cl[C@H](c1cocc1Br)c1cc(I)cc2c1OCC2 2258099767 UWIINFDPTOVLOO-LBPRGKRZSA-N 439.474 4.910 50 10 IJGE C[C@@H]1CCCN(C(=O)c2cc(Br)c(F)cc2Cl)[C@H]1CBr 2285960160 TVSXBISDVVIQLD-OQPBUACISA-N 427.539 4.877 50 10 IJGE CC(C)CN(CCBr)Cc1cc(I)ccc1Cl 2307332894 VQDHXUKINRDKCA-UHFFFAOYSA-N 430.555 4.798 50 10 IJGE COc1ccc(CCN(C)C[C@@H](Cl)COCc2ccccc2)c(Br)c1 2317220673 OQXLQLSXSIMUMM-GOSISDBHSA-N 426.782 4.756 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)C[C@@H]1CCC[C@@H]1Cl 2325224884 ZZVJLDWIBPLNAM-AAEUAGOBSA-N 442.566 4.893 50 10 IJGE Cc1scc(C(=O)N2C[C@@]3(CBr)CCC[C@]3(F)C2)c1Br 2369603287 KCKZWMIFAIJMIN-KBPBESRZSA-N 425.161 4.548 50 10 IJGE CCOc1cc(/C=N/NC(=O)c2ccc(-c3ccccc3)cc2)cc(Br)c1O 20175526 ISBCTWRDODTVDO-ZVHZXABRSA-N 439.309 4.984 50 10 IJGE CCOc1ccc(Br)cc1/C=N/NC(=O)[C@H](C)Oc1ccc2ccccc2c1 20177048 VUTNBURGIXNQAK-BGHCKBSUSA-N 441.325 4.919 50 10 IJGE COc1ccc([C@@H](Br)c2ccccc2I)cc1OC 40279304 YMEDZWSYOUXOIY-OAHLLOKOSA-N 433.083 4.793 50 10 IJGE C#CCOc1ccc(/C=N/NC(=O)[C@H](C)c2ccc(CC(C)C)cc2)cc1Br 59146974 LASFMARCWQNLCZ-SCELWYEFSA-N 441.369 4.913 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)NCc2ccco2)ccc1OC(=O)/C=C/c1ccccc1 206681446 AGHMINXCIRTTDA-COYSUQGBSA-N 442.471 4.520 50 10 IJGE N#C/C(=C/c1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1)C(=O)NCc1ccccc1 208233527 DLLHMQQVJDGBEA-QWSHFYNQSA-N 428.332 4.782 50 10 IJGE O=C(NN=Cc1ccccc1Cl)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1 254398215 JFBOSSDZPPGNDU-UHFFFAOYSA-N 448.331 4.558 50 10 IJGE Oc1ccc(Br)c([C@H]2CN(Cc3ccccc3)C[C@H]2CBr)c1 382681067 BATZFQIYUFOEGO-PBHICJAKSA-N 425.164 4.765 50 10 IJGE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NNc1ccc(C(F)(F)F)cc1 747589814 PJBLKFNLLUIMGZ-UHFFFAOYSA-N 431.443 4.630 50 10 IJGE O=C(CSc1nnc(-c2ccco2)n1C1CCCCC1)NNc1c(F)cccc1F 768118852 ATHRNUVZJRVBCA-UHFFFAOYSA-N 433.484 4.557 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2CCC(c3ccccc3)CC2)c(-c2ccccc2)n1 914467610 CJORWDLKXXAICW-MOHJPFBDSA-N 435.531 4.777 50 10 IJGE CCOc1ccc(NC(=O)NN=Cc2ccccc2OCc2ccc(C(=O)O)cc2)cc1 1083940026 HINAYMSKUSWNNX-UHFFFAOYSA-N 433.464 4.518 50 10 IJGE COC(=O)c1ccc(C)c(-n2c(C)cc(C=NNC(=O)c3cc4ccccc4o3)c2C)c1 1084088338 LRDGUBRQKGQAGX-UHFFFAOYSA-N 429.476 4.699 50 10 IJGE C=C(C)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCC(Cl)Cl 1556511562 CLPNQTAOSREYHG-FQEVSTJZSA-N 447.362 4.780 50 10 IJGE C#CC[C@H](CCOC)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1623648921 HAUDEWRLWRZKPF-VOMPUTFMSA-N 444.362 4.853 50 10 IJGE C=CC[C@@]1(C(=O)NNc2nc3ccc(Cl)cc3s2)CCCN1C(=O)OC(C)(C)C 1642296164 FYACUUAFZSNQDI-FQEVSTJZSA-N 436.965 4.739 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccccc2-c2ccc(C)s2)cc1 1679852643 WOBRCJUEHYMMDD-INIZCTEOSA-N 437.521 4.546 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1ccc(Br)c(O)c1 1915131810 AKUDSHBCLGKDQG-ZDUSSCGKSA-N 441.163 4.971 50 10 IJGE Cc1nc(N(C)C[C@@H](Br)COCc2ccccc2)ccc1Br 1916348521 OTJSYAOXQCHBJP-OAHLLOKOSA-N 428.168 4.569 50 10 IJGE BrCCN(Cc1ccc(Br)cc1Br)C1CCC1 1943848800 OSQLAVBQKNZBMK-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE Brc1ccc(C[C@H]2CCOCC[C@@H]2Br)c(Br)c1 2001023412 PEKVTYVOYRGQGN-PWSUYJOCSA-N 426.974 4.944 50 10 IJGE Cc1cc(-n2nc(CCl)c(I)c2C(F)(F)F)c(C)cc1O 2079209880 CHPJHQROXLHFFD-UHFFFAOYSA-N 430.595 4.557 50 10 IJGE CC(=O)[C@@H](Br)[C@@H](C)c1ccc(C(F)(F)F)cc1I 2083649905 NHYBMOGTFIJWLF-KGFZYKRKSA-N 435.021 4.766 50 10 IJGE CCC(=O)[C@@H](Br)Cc1ccc(C(F)(F)F)cc1I 2083650870 XBXPXIVSBGCOSR-VIFPVBQESA-N 435.021 4.595 50 10 IJGE C[C@H]1CCCN(Cc2ccc(I)c(Cl)c2)[C@@H]1CBr 2086661490 MXFIZDDQIBCFEB-IINYFYTJSA-N 442.566 4.940 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@@H]2C[C@H](Cl)CC[C@H]21 2087663185 HVZZYQREJPNWBP-NQMVMOMDSA-N 427.589 4.895 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CNC(=O)CCCCBr)CCCC[C@H]12 2108946798 LQNYYUGGZCKHCV-OXJNMPFZSA-N 431.415 4.628 50 10 IJGE Clc1cccc(CBr)c1N1CC[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 2129050435 DGVJHUSIRJJOJQ-PMACEKPBSA-N 435.793 4.715 50 10 IJGE Brc1ccc([C@@H](Br)[C@@H]2CCn3ncnc3C2)c(Br)c1 2138874467 WNFDRFCNOZNGDM-OQPBUACISA-N 449.972 4.502 50 10 IJGE Fc1cccc(C(CBr)(CBr)CCS[C@@H]2CCOC2)c1 2149124254 QYQXWRZNKSJNJC-CQSZACIVSA-N 426.189 4.766 50 10 IJGE O=C(c1ccc(Br)c(Cl)c1)N1CCC([C@@H](F)CBr)CC1 2163247943 ZYBIEOZDZBQZKT-ZDUSSCGKSA-N 427.539 4.688 50 10 IJGE C[C@@H]1CCCCCCN1S(=O)(=O)c1cc(CBr)sc1Br 2179792881 LTAIGDUPQWQZBM-SNVBAGLBSA-N 445.242 4.749 50 10 IJGE C[C@H]1[C@H](C)CC[C@H](CNC(=O)OC(C)(C)C)N1CCCCCI 2211188874 GYEYMQOFFXKQEW-OWCLPIDISA-N 438.394 4.605 50 10 IJGE CC1(CO[C@@](C)(CBr)CNC(=O)OC(C)(C)C)CC2(CC(F)(F)C2)C1 2222928845 ZISCLMVPMWIQSA-INIZCTEOSA-N 426.342 4.897 50 10 IJGE CCCCN(CCCCI)C[C@H]1CCCN1C(=O)OC(C)(C)C 2243585616 DJTQBYZTDZKUFR-MRXNPFEDSA-N 438.394 4.703 50 10 IJGE COc1ccc([C@@H](Br)c2cscc2OC)cc1I 2257370964 VXZFGBJKXYQMNV-CYBMUJFWSA-N 439.112 4.854 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1C1CCN(CC2(CBr)CC(F)C2)CC1 2265639282 RIEBQAHKTKBTPW-GNZRSQJKSA-N 433.406 4.611 50 10 IJGE O=C(NC[C@H]1CCCC[C@@H]1CCl)c1ccc(Cl)c(I)c1 2283655075 GLDAZJWKUGUOSB-VXGBXAGGSA-N 426.125 4.720 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N(C[C@H](C)Br)C(C)(C)C)c1Br 2288078568 MYNRRLJPWPANKY-QMMMGPOBSA-N 447.258 4.700 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2cccc(C(=O)O)c2)ccc1OCc1ccc(C)cc1 2295459750 UMASFEDIHMXBAY-UHFFFAOYSA-N 442.471 4.827 50 10 IJGE CC(=O)c1cccc(NC(=O)C(C#N)=Cc2c[nH]nc2-c2ccc(Br)cc2)c1 2295672631 FGPPIVNCVXEWRD-UHFFFAOYSA-N 435.281 4.587 50 10 IJGE Cc1onc(-c2ccccc2)c1C(=O)NN=Cc1ccc(OC(=O)C=Cc2ccco2)cc1 2297456350 MBAVPOCZVRHVMN-UHFFFAOYSA-N 441.443 4.626 50 10 IJGE C[C@H]1CC[C@H](Cl)CN1Cc1ccc(I)c(Br)c1 2306219630 OJKUGCQFTDYUJF-ONGXEEELSA-N 428.539 4.645 50 10 IJGE Brc1cccc(Br)c1CN1CC[C@@H](Br)[C@H]2CC[C@H]21 2310810275 OIXIQOWSAGMFCH-OWYVNGRQSA-N 438.001 4.959 50 10 IJGE FC1(F)CC[C@@H]1CO[C@@H](CI)c1cccc(Br)c1 2313727042 RXHFZTARXVOXJU-PWSUYJOCSA-N 431.058 4.987 50 10 IJGE CC1(C)COC[C@]1(CBr)Cc1ccc(I)c(Cl)c1 2314642724 GQBVXFQEQPSWLM-CQSZACIVSA-N 443.550 4.925 50 10 IJGE COc1c(Br)cc(C)c(C(=O)C2CC(Br)C2)c1Br 2317408074 MCWCBXHKPVWFAV-UHFFFAOYSA-N 440.957 4.885 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4O)[nH]c3c2)cc1Cl 2323739731 JNGDUVZDWYYPBF-UHFFFAOYSA-N 434.883 4.752 50 10 IJGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)/C=C/c1cccc(C(F)(F)F)c1 15469606 YACZYUQFEKQMSX-ZHACJKMWSA-N 431.439 4.612 50 10 IJGE Nc1c(NNC(=O)c2cccc3ccccc23)ncnc1Nc1cccc(C(F)(F)F)c1 40781942 RHWCEYKPLWNNCE-UHFFFAOYSA-N 438.413 4.731 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1Br)c1cc(Br)cc(Br)c1 232486495 IIULIMXBGJAWFJ-NEPJUHHUSA-N 439.973 4.648 50 10 IJGE CCCOc1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)NN=Cc2ccccc2F)cc1 254705070 MTCCMWWZFNYQNP-UQKCPXHGSA-N 445.494 4.536 50 10 IJGE COc1cc(C=NNC(=O)CSCc2ccccc2C)ccc1OCc1ccccc1 254762291 OMALFUHHHWTNHU-UHFFFAOYSA-N 434.561 4.966 50 10 IJGE CC(=O)[C@@H](Br)[C@@H](C)c1cc(Br)ccc1I 300899881 KHASSOBOJBMQOV-KGFZYKRKSA-N 445.920 4.510 50 10 IJGE CCN(C[C@](C)(CBr)OC(C(F)(F)F)C(F)(F)F)C(=O)OC(C)(C)C 305755277 FIPSFEZRTPEKDX-LBPRGKRZSA-N 446.226 4.907 50 10 IJGE Brc1cccc([C@H](CI)OCCOCC2CCC2)c1 400690934 HKBBWZCARCRRNL-HNNXBMFYSA-N 439.131 4.759 50 10 IJGE CN(C(=O)c1scc(Br)c1Br)[C@@H]1CCC[C@H]1Br 709228349 OGYKKGKTTIPRFC-HTRCEHHLSA-N 446.002 4.661 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N(C)[C@H](C)Cc2ccc(Cl)cc2)c(C)n1C[C@H]1CCCO1 736516469 GHKDFPPEXUHRKZ-WYXNPHKISA-N 439.987 4.934 50 10 IJGE C=CCn1cc2ccc(NC(=O)/C(C#N)=C\c3cn(CCC#N)nc3-c3ccccc3)cc2n1 1635708693 YEAMJVUIVCVODY-STZFKDTASA-N 447.502 4.545 50 10 IJGE COc1cc2nc(CN3CCCC[C@H]3CO[Si](C)(C)C(C)(C)C)nc(O)c2cc1OC 1643642178 HLOMDAZMKRFSEP-INIZCTEOSA-N 447.652 4.729 50 10 IJGE BrC[C@H](CN1CC[C@H](Cc2cccc(I)c2)C1)C1CC1 1645784588 YJAMVMGXCXKOEU-GDBMZVCRSA-N 448.186 4.577 50 10 IJGE O=C(COc1cccc(Br)c1)NN=Cc1ccc(OCc2ccccc2)cc1 1772754730 RRNRBHNJMIXQGY-UHFFFAOYSA-N 439.309 4.557 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@@H]1c1cccs1 1865698250 OIJRDMNGGHQYBK-AWEZNQCLSA-N 436.846 4.883 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)c1cccc(Br)c1 1865755458 ZLKZXHZMPUZBJC-UHFFFAOYSA-N 444.716 4.548 50 10 IJGE C[C@H](CC[C@@H](Br)CN1C(=O)c2ccccc2C1=O)COCc1ccccc1 1880124770 PWYQURSRFHFUTE-SJLPKXTDSA-N 430.342 4.679 50 10 IJGE Cc1ncc(Br)c(N(Cc2ccccc2)[C@@H](CBr)C(C)C)n1 1915323215 QTWGEBSYLUMFDC-INIZCTEOSA-N 427.184 4.974 50 10 IJGE C[C@H]1C[C@@H](Br)CN(Cc2cc(Br)ccc2Br)C1 2006497155 QJYUCIKZJWERBG-JOYOIKCWSA-N 425.990 4.817 50 10 IJGE CCN(C(=O)c1c(Br)cccc1Br)C(C)(C)CBr 2033089726 WVZHUSBSPXUBER-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE Brc1ccc(Br)c(CN2C[C@@H]3CC[C@@H](Br)[C@H]3C2)c1 2054715844 ZMRNBMFDAFSOSV-DUFXMDAXSA-N 438.001 4.817 50 10 IJGE BrC[C@@H]1CCN(c2ncc(Br)cc2Br)C12CCC2 2070107293 TYCSXNVQOFITEJ-VIFPVBQESA-N 438.989 4.751 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Cl)c2cc(Cl)ccc2I)c1 2093077826 WSKNTBQZPBRAJH-LBPRGKRZSA-N 447.146 4.738 50 10 IJGE COc1ccc([C@H](Br)Cc2ccccc2I)cc1OC 2143868525 PFKHAANVZUGTNP-CYBMUJFWSA-N 447.110 4.987 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N(CCBr)CC(C)(C)C)c1Br 2143916750 XZCKCGKDUFVRFX-UHFFFAOYSA-N 447.258 4.559 50 10 IJGE CC1(C)CO[C@@H](COc2c(Br)cc(Cl)cc2CBr)CO1 2176669694 HSOLDMJUKZMRFZ-NSHDSACASA-N 428.548 4.570 50 10 IJGE CC(C)(C)[C@@H]1[C@@H](Cl)CCN1C(=O)c1cc(Cl)ccc1I 2185112375 AZRUBZUHTQBBIE-AAEUAGOBSA-N 426.125 4.813 50 10 IJGE Cc1sc(C(=O)N[C@@H](C)CCCCCI)cc1Br 2218966671 ZQIXEEJNLGYDKF-VIFPVBQESA-N 444.176 4.933 50 10 IJGE C[C@@H]1C[C@H](Br)[C@@H](C)N(Cc2cc(Cl)ccc2I)C1 2220346360 YNTIKWMUSNMOHT-BREBYQMCSA-N 442.566 4.938 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@H](CBr)C2CCC2)[C@@H](C(F)(F)F)C1 2266310594 QRPKYRVZWKAWNO-RBSFLKMASA-N 443.348 4.718 50 10 IJGE CCOc1ccccc1-c1cc(C(=O)NN=CC(Br)=Cc2ccccc2)n[nH]1 2297304786 IXZOLRVUWTZDBD-UHFFFAOYSA-N 439.313 4.627 50 10 IJGE CCc1ccc(Oc2nc3ccccn3c(=O)c2C=C(C#N)c2nc3ccccc3[nH]2)cc1 2297497835 QZHQLAZSFWBCSS-UHFFFAOYSA-N 433.471 4.990 50 10 IJGE CC1=NN(c2cccc3ccccc23)C(=O)C1=CNC(=O)Nc1ccc(SC#N)cc1 2297511673 XPTKGGTUDSEIRV-UHFFFAOYSA-N 427.489 4.841 50 10 IJGE O=S1(=O)CC[C@H]([C@H](Cl)c2cc(Br)ccc2OCc2ccccc2)C1 2299504318 MHRHHYCYUGFZEQ-KSSFIOAISA-N 429.763 4.743 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](O)C1CC(Br)C1 2301511157 CFGPTMKCKVGBTD-FOEZSWGGSA-N 430.937 4.866 50 10 IJGE CC(C)[C@H](Br)C(C)(C)CN(C)C[C@H]1CC1(Br)Br 2301978953 RZWDLAASJWQQIP-MNOVXSKESA-N 434.054 4.870 50 10 IJGE N#CC(=Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(=O)Nc1cccc([N+](=O)[O-])c1 2314572220 WFTYBYQKJTYRMM-UHFFFAOYSA-N 438.783 4.962 50 10 IJGE Cc1c(F)ccc(C(=O)N(C)C[C@H](Br)COCc2ccccc2)c1Cl 2316780452 QNSOJNOVWWMRAW-HNNXBMFYSA-N 428.729 4.840 50 10 IJGE COc1cc(C=NNC(=O)c2cc3ccccc3n2C)ccc1OCc1ccc(C)cc1 2323732927 IQGYDYDJBUECEE-UHFFFAOYSA-N 427.504 4.838 50 10 IJGE COc1ccc(Cl)cc1-c1csc(C(C#N)=C(O)CNC(=O)c2ccccc2)n1 2331411736 HCHULPQZNRPURO-UHFFFAOYSA-N 425.897 4.695 50 10 IJGE C[C@H](Cl)c1ccccc1NS(=O)(=O)CCCCCCN1C(=O)c2ccccc2C1=O 2364195018 LYKBYYYKKKWJEH-INIZCTEOSA-N 448.972 4.585 50 10 IJGE C[C@H](Cl)CN(C(=O)c1ccc(Cl)cc1I)C1CCCC1 2368844156 HZNCUKUTXYFNFQ-JTQLQIEISA-N 426.125 4.957 50 10 IJGE Cc1occc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3ccc(Cl)cc3)c(C)c21 40823540 VWOFKJQJCRFYFJ-KOEQRZSOSA-N 425.872 4.866 50 10 IJGE CC(C)c1ccccc1OCC(=O)Oc1ccc(/C=C(\C#N)C(=O)NCc2ccco2)cc1 40934733 UPNDKTFRRQDUEK-XSFVSMFZSA-N 444.487 4.611 50 10 IJGE CC(C)(C)c1ccc(OCCCC(=O)N/N=C/c2cccc(O)c2)c(Br)c1 40951425 KQWDQGWLUFHWCP-OEAKJJBVSA-N 433.346 4.762 50 10 IJGE Cc1ccccc1NC(=O)C(=O)N/N=C/c1c(OCc2ccccc2)ccc2ccccc12 59378916 UTRPCRTVXFEJJJ-OGLMXYFKSA-N 437.499 4.816 50 10 IJGE CCCCCCOc1ccc(/C=N\NC(=O)Cc2ccc3nc(N)sc3c2)cc1OC 169917286 BKWWGETXSYSZSP-MYYYXRDXSA-N 440.569 4.539 50 10 IJGE COc1cc(Br)c(C=NNC(=O)c2ccc(Cl)c(Cl)c2)cc1OC 252622918 OFUMESWCBWPTEK-UHFFFAOYSA-N 432.101 4.537 50 10 IJGE CC(C)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NN=Cc1ccccc1C(F)(F)F 254658475 PCXGUJYHADAUMQ-LZGZYFLISA-N 449.517 4.513 50 10 IJGE C=CC[C@@]1(C(=O)OC)C[C@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 688653177 DWWQFLFXOGTKEW-CVDCTZTESA-N 433.621 4.907 50 10 IJGE CC[C@H](C)c1ccc([C@H](NC(=O)NNC(=O)c2ccc(OC)cc2OC)C(C)C)cc1 730021028 GMOCITROQKTEGF-KSFYIVLOSA-N 427.545 4.559 50 10 IJGE O=C(NCc1ccccc1COc1ccccc1Cl)NNC(=O)c1ccc(Cl)cc1 745851749 UQVVRQVFZJOGAP-UHFFFAOYSA-N 444.318 4.717 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2C[C@@H]3CCCC[C@H]3C2)c(-c2ccc(Cl)cc2)n1 750139894 IQFBYJKCONNJEL-VIEQMYLGSA-N 433.943 4.673 50 10 IJGE C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccccc1Cc1ccccc1 1165357848 ZJBRLCFFHJIMDE-HXUWFJFHSA-N 429.948 4.756 50 10 IJGE CCCOc1nc2ccccc2cc1/C=C/C(=O)NNc1nc2ccccc2[nH]c1=S 1453768655 JQPHVEZIWVRKDC-VAWYXSNFSA-N 431.521 4.786 50 10 IJGE CC(=O)CCc1ccc(OCc2cccc(C(=O)NC[C@@]3(C)C[C@H]3Br)c2)cc1 1533793623 GVRWQHBFAJPZSR-FYYLOGMGSA-N 444.369 4.691 50 10 IJGE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)CSc1ccc(Cl)cc1 1538914920 OMAYLADORAXDNA-BENRWUELSA-N 444.862 4.582 50 10 IJGE Cc1ccc2[nH]c(C(=O)NNc3nc4ccccc4[nH]c3=S)cc2c1Br 1646016994 CJMQFWIUZMKDBY-UHFFFAOYSA-N 428.315 4.602 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1c(Cl)cccc1Br 1882086204 ZQFUGZSYPHYUQG-SECBINFHSA-N 427.564 4.933 50 10 IJGE Clc1cc(I)c([C@H](Br)C23COCC(C2)C3)s1 1901022399 BBLYASRTRRAFMC-JEWWZCJESA-N 433.536 4.869 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cccc2cnccc12 1915078412 PWWCJOGURXVTHA-GOSISDBHSA-N 433.371 4.599 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@@H]1CN(c1nc(Cl)c(CBr)s1)C2 1949582909 DGKUNVVJFUCGFS-KDOFPFPSSA-N 426.811 4.650 50 10 IJGE C[C@H]1C[C@H](CBr)CCN1c1ncc(Br)cc1Br 2004847900 WFTHFWUFBVJOGT-DTWKUNHWSA-N 426.978 4.606 50 10 IJGE C=CC[C@](C)(CCl)CNc1ncc(I)cc1Br 2023509955 WEJFGCUXJNKOSW-GFCCVEGCSA-N 429.527 4.682 50 10 IJGE O=C(N[C@H]1CC[C@H](CBr)C1)c1ccc(Br)cc1Br 2029531654 AHMSEIRKDHSPGF-WPRPVWTQSA-N 439.973 4.505 50 10 IJGE C[C@H](Br)C[C@H](C)CNC(=O)c1cccc(Br)c1Br 2031477791 NVUQHAYURJJOLA-IUCAKERBSA-N 441.989 4.751 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CCCC[C@@H]1CBr 2031486372 MPLBKXJZUDITSO-SECBINFHSA-N 439.973 4.601 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@H](CBr)C(C)(C)C)CCC1(F)F 2044695861 HNQUNCYLHRYZNU-ZIAGYGMSSA-N 427.374 4.668 50 10 IJGE CN(Cc1ccccc1)C1(Cn2c(Cl)nc(Cl)c2CBr)CCOCC1 2055098703 VDKJYNPBJWNXKL-UHFFFAOYSA-N 447.204 4.766 50 10 IJGE CC1(CBr)CC(NC(=O)c2cc(Br)ccc2Br)C1 2055632716 GJFFBUVTHKGPOR-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE Fc1cc(CBr)cc(F)c1N1CCN(Cc2ccccc2)CC(F)(F)C1 2093155137 IUGAZLAJHUTFDP-UHFFFAOYSA-N 431.271 4.817 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@@H]2CCC[C@@H](Cl)[C@H]2C1 2094588912 VSUDVRKYMGSWOV-OYNCUSHFSA-N 427.589 4.753 50 10 IJGE CCN(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)c1ccc(CBr)cc1 2162910993 CQBNOLBIUSWDPO-QGZVFWFLSA-N 439.394 4.691 50 10 IJGE Cc1nn(C)c([C@H](Cl)c2c(Br)cc(F)c(F)c2F)c1Br 2192375607 QNTYWHNNFIWMDN-SECBINFHSA-N 432.465 4.999 50 10 IJGE CS(=O)(=O)c1cccc([C@@H](Cl)c2ccc(Br)cc2Br)c1 2203682756 JFCGCTYPVKNRPH-CQSZACIVSA-N 438.568 4.943 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCN(CCCCI)c2ccccc21 2248240552 GKVSCILEHRVFCG-HNNXBMFYSA-N 444.357 4.720 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@H](Br)[C@@H]2CC[C@H]21 2282990864 XTXXMDROSCBPGS-DXVIDONBSA-N 425.523 4.630 50 10 IJGE C[C@@]1(CNC(=O)c2cc(F)c(Br)cc2Cl)CCC[C@H]1Br 2286879677 JEOLXTSIXURXGN-OCCSQVGLSA-N 427.539 4.925 50 10 IJGE CCOC(=O)C(C#N)=C1S[C@H](Cc2ccc(Cl)cc2)C(=O)N1c1ccc(C)cc1 2293039219 QCLWHINDQOVTGA-LJQANCHMSA-N 426.925 4.638 50 10 IJGE CC(C)(C)[C@H](CBr)NCc1ccc(Cl)cc1I 2302315165 GLXLBFWKADYEEJ-LBPRGKRZSA-N 430.555 4.844 50 10 IJGE Cc1ccc(OCCCC(=O)Oc2ccc(C=C(C#N)C(=O)NCc3ccco3)cc2)cc1 2314760664 VMUNLEHQVUCSGY-UHFFFAOYSA-N 444.487 4.576 50 10 IJGE COc1c(Br)cc(C)c([C@@H](O)[C@H]2C[C@@H](Br)C2)c1Br 2317433888 USCQJUSIQDQCSQ-SXMVTHIZSA-N 442.973 4.736 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)cc2I)C[C@H](C)C1Br 2318537946 LCLIQUHJLFNXBQ-UWVGGRQHSA-N 442.566 4.796 50 10 IJGE C[C@@H]1CN(Cc2cc(I)ccc2Cl)CC[C@@H]1CBr 2327402340 WBTNIRUTAPOIAH-GHMZBOCLSA-N 442.566 4.798 50 10 IJGE CC[C@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)C(c1ccccc1)c1ccccc1 9872001 PANFEYSVUJELBP-PMACEKPBSA-N 430.548 4.947 50 10 IJGE COc1ccc(CCNC(=O)/C(C#N)=C/c2ccc(-c3cccc(Cl)c3)o2)cc1OC 20258991 ITTDYYGAXVTATJ-NBVRZTHBSA-N 436.895 4.883 50 10 IJGE CCc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(C)cc2)cc1 38649277 FJIOCOQZAHADIK-SANMLTNESA-N 440.499 4.760 50 10 IJGE C=CCOc1ccccc1/C=N/NC(=O)COc1ccc(C(C)(C)C)cc1Br 100437352 PSAKSUYQXQPGPA-ZVHZXABRSA-N 445.357 4.841 50 10 IJGE CN(c1ncc(Br)cc1Br)[C@@H]1CCCC[C@H]1Br 252924158 KVBUUFLXPFGINV-MWLCHTKSSA-N 426.978 4.749 50 10 IJGE COc1ccc2ccccc2c1C=NNC(=O)C(=O)Nc1ccc(Oc2ccccc2)cc1 254816062 KUQAXEMGOIXWNW-UHFFFAOYSA-N 439.471 4.730 50 10 IJGE C[C@@H]1C[C@H](O[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2I)CC(C)(C)C1 299976519 CYWJNCPXJSGFOO-LXTVHRRPSA-N 437.362 4.641 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)O[C@H]1CCCc2ccccc21 303741351 LERCXQWWWNOFCV-LPHOPBHVSA-N 445.341 4.799 50 10 IJGE Clc1ccc(C(CBr)(CBr)CCN2CCSCC2)cc1 706365226 SKWFJRCLCUHCBX-UHFFFAOYSA-N 441.660 4.807 50 10 IJGE CCOc1cc(Br)ccc1[C@H](O)P(=O)(c1ccccc1)c1ccccc1 1088727089 LIJXCGPEUNIJIR-OAQYLSRUSA-N 431.266 4.853 50 10 IJGE C=CC[C@@]1(C(=O)NNc2ccc(Br)c(C)c2)CCCN1C(=O)OC(C)(C)C 1446486534 KCXGVRBJSVAGSW-FQEVSTJZSA-N 438.366 4.546 50 10 IJGE Cc1nc(-c2cc(Cl)ccc2Cl)sc1C(=O)NNc1nc(O)c2ccccc2n1 1654399172 BZRJZTHFBPISSJ-UHFFFAOYSA-N 446.319 4.831 50 10 IJGE C=C(C)COc1cccc(NC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)c1 1668204128 XVHIZDNZOOPUPT-UHFFFAOYSA-N 442.475 4.916 50 10 IJGE CCCc1nn(C)c2c1[C@@H](c1ccc(OCc3ccccc3Cl)cc1)C(C#N)=C(N)O2 1865704590 ZJAZZGGZCKCJRF-NRFANRHFSA-N 434.927 4.823 50 10 IJGE Cc1nsc(Br)c1C(=O)N(Cc1ccccc1)[C@H](C)CBr 1914196605 YPIIKQHTVFMZLR-SNVBAGLBSA-N 432.181 4.640 50 10 IJGE COc1cc(Br)ccc1C(=O)N(Cc1ccccc1)C[C@H](C)Br 1914608910 CNNJSFNPCNCKHB-ZDUSSCGKSA-N 441.163 4.884 50 10 IJGE CC1(C)C[C@H](N(Cc2ccccc2)S(=O)(=O)c2ccc(Cl)c(CCl)c2)CO1 1915480546 JMMRDEUSJXZSCI-KRWDZBQOSA-N 428.381 4.837 50 10 IJGE C[C@@H](Br)[C@H]1CCN(Cc2ccc(Br)cc2Br)C1 1943846802 MEEJJFJDEYRKLP-ZJUUUORDSA-N 425.990 4.817 50 10 IJGE BrC[C@@H](CC1CC1)NCc1cccc(Br)c1Br 1943882191 FODADLUZYOAROA-LLVKDONJSA-N 425.990 4.865 50 10 IJGE CC[C@H]1CN(Cc2cccc(Br)c2Br)C[C@@H]1Br 1943885545 WSXPHAIGBBXYNR-CABZTGNLSA-N 425.990 4.817 50 10 IJGE CC1(C)OC[C@H](Cc2c(Br)cccc2Br)[C@H]1Br 1945330434 LEHHXRSWYOUPJC-QPUJVOFHSA-N 426.974 4.943 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(Br)cc1)[C@@H](F)CBr 1951578147 VHJJOQPSOWWTCM-STQMWFEESA-N 425.136 4.618 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCN(C[C@H](CBr)C3CCC3)CC2)CC1 1966327599 YGQXVICPAUSBQB-SFHVURJKSA-N 429.443 4.911 50 10 IJGE BrC[C@@H]1[C@H]2CCN(Cc3ccc(Br)cc3Br)C[C@@H]21 2032221274 YWSMVHCGQUWWMS-UPJWGTAASA-N 438.001 4.674 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H](Br)C2(CCC2)C1 2046462713 SALIQUNDRGUBJB-ZDUSSCGKSA-N 438.001 4.961 50 10 IJGE CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(OC)c(CBr)c1 2059312647 NVXVXPYNGNHWJL-HNNXBMFYSA-N 426.376 4.580 50 10 IJGE CC(C)(C)OC(=O)N1CC[S@](=O)(=NC[C@H](CBr)C(C)(C)C)C(C)(C)C1 2069025072 HPHCXFANCNGRBN-HWRSSNJWSA-N 439.460 4.541 50 10 IJGE CCCN1C[C@@H](Br)[C@@H](Cc2ccc(I)c(Cl)c2)C1 2086651232 GMGJPDFAVFFBFF-NWDGAFQWSA-N 442.566 4.592 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@@H]1CCCN(C(=O)CCCCBr)C1 2106770896 CYXPNALOOVKYSD-IAGOWNOFSA-N 431.415 4.580 50 10 IJGE CN(C(=O)c1cc(Br)sc1Br)[C@@H](CCCl)C(F)(F)F 2121994182 FIADFRKHEJYRRJ-LURJTMIESA-N 443.510 4.905 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@@H]1CCCN(CC2(CBr)CCC2)C1 2129044033 PFTHLHNMNSKNNE-CQSZACIVSA-N 427.387 4.501 50 10 IJGE CCc1nn(C[C@H](CBr)c2ccccc2)c(CC)c1I 2150312161 REYHJMMTQAVUAB-ZDUSSCGKSA-N 447.158 4.791 50 10 IJGE CCC[C@@H]1CN(C(=O)c2ccc(I)c(Cl)c2)C[C@@H]1CCl 2205698766 SQUVYYUNGYAGKO-NEPJUHHUSA-N 426.125 4.672 50 10 IJGE Br[C@@H]1CC[C@@H]2CCCN(C[C@H]3CC3(Br)Br)[C@H]2C1 2213090379 FGXZEGDEHZEFQA-QCNOEVLYSA-N 430.022 4.520 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1C(=O)c1scc(Br)c1Br 2251004838 SNWIMIXQLXDEOA-HTRCEHHLSA-N 446.002 4.661 50 10 IJGE O=C(c1scc(Br)c1Cl)N1[C@H](CBr)C[C@@H]2CCC[C@@H]21 2264505429 YSOIHRJSRJQHKC-NRPADANISA-N 427.589 4.942 50 10 IJGE CC1CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)CC[C@H]2C(F)(F)F)C1 2265304824 UVJSMSPFOSRNCR-UUCFBXCCSA-N 443.348 4.671 50 10 IJGE COc1ccc([C@@H](Br)C[C@H]2CCCOCC2)cc1I 2269545033 LHNOESDXTWNGQN-AAEUAGOBSA-N 439.131 4.943 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2ncc(Cc3cccc(Cl)c3)s2)cc1OC 2293039048 YIDLYRRUHZRTAL-UHFFFAOYSA-N 439.924 4.950 50 10 IJGE CCCOc1c(Br)cc(C=C(C#N)C(=O)Nc2ccc(OC)cc2)cc1OC 2293672068 ZUPNRHJZRRUECC-UHFFFAOYSA-N 445.313 4.801 50 10 IJGE N#CC(=CNc1ccc(C(N)=O)cc1)c1nc(-c2cc3cc(Cl)ccc3oc2=O)cs1 2296798444 VHKSIAHVVAPFHR-UHFFFAOYSA-N 448.891 4.645 50 10 IJGE COc1ccc2nc(C(C#N)=Cc3ccccc3OCC(=O)Nc3ccc(C)cc3)[nH]c2c1 2297372850 JUCAHZZKFMHEKL-UHFFFAOYSA-N 438.487 4.962 50 10 IJGE COC(=O)C(C#N)=Cc1cc(Br)c(OCc2ccc(Cl)cc2)c(OC)c1 2297576537 KOXFVGQLPPUKRA-UHFFFAOYSA-N 436.689 4.770 50 10 IJGE CC1(C)C[C@H](Br)CN1Cc1ccc(Cl)c(I)c1 2300239878 FCOQMJFOGVFPTG-JTQLQIEISA-N 428.539 4.692 50 10 IJGE CC[C@@H](C)[C@H](CBr)NCc1ccc(Cl)cc1I 2302329693 UYVFZIOPEWHCJA-RNCFNFMXSA-N 430.555 4.844 50 10 IJGE COc1c(Br)cc(C)c([C@H](O)[C@H]2C[C@@H](Br)C2)c1Br 2317433887 USCQJUSIQDQCSQ-RGNHYFCHSA-N 442.973 4.736 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H](C3)[C@H]2CBr)c(I)c1 2318537974 GWQQHBFQYLNNQP-DUFXMDAXSA-N 440.550 4.692 50 10 IJGE O=C(NN=Cc1c(Cl)ccc(Cl)c1Cl)c1cccn(Cc2ccccc2)c1=O 2323647256 WFVSSGOZWROMGG-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE COc1ccc(Cc2nc3ccc(C(=O)NN=Cc4ccc(Cl)cc4)cc3[nH]2)cc1OC 2323720486 BUZCFDGUSABCTA-UHFFFAOYSA-N 448.910 4.588 50 10 IJGE CCCOc1cccc(C=NNC(=O)c2ccc3nc(Cc4ccc(OC)cc4)[nH]c3c2)c1 2323720604 NDHKBZQFARBKRH-UHFFFAOYSA-N 442.519 4.715 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)C(C#N)=CNc1ccc(Cl)c(C(F)(F)F)c1 2324433876 AIXMVZWCMZTWHY-UHFFFAOYSA-N 437.805 4.994 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)C(C#N)=CNc1ccccc1Br 2325075875 GXTWFRDIGVGUEU-HNNXBMFYSA-N 428.330 4.853 50 10 IJGE ClC[C@H]1CCCC[C@H]1NCc1ccc(I)c(Br)c1 2325210659 AJHIEDFRANAHFA-BXUZGUMPSA-N 442.566 4.941 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H](Br)CC2(CC2)C1 2327406406 TUDZSDUFXOYNLJ-NSHDSACASA-N 440.550 4.694 50 10 IJGE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1cccc(Oc2ccccc2)c1 2328818818 CNTMJZAOOBXROJ-UWJYYQICSA-N 425.529 4.868 50 10 IJGE COc1ccc(-c2csc(C(C#N)=Cc3ccc4c(c3)OCCO4)n2)c(OC)c1OC 2331492839 UWQHYDYBDLHPEX-UHFFFAOYSA-N 436.489 4.671 50 10 IJGE C[C@@H]1CCCN(C[C@]2(CBr)CC2(F)F)[C@H]1CCCNC(=O)OC(C)(C)C 2351886103 UATYCCRTQMMPJZ-RVKKMQEKSA-N 439.385 4.812 50 10 IJGE Cc1sc(C(=O)N2CC[C@H](Br)C[C@H]2C(F)(F)F)cc1Br 2361463696 BPTBVQGNXPOPIA-XVKPBYJWSA-N 435.103 4.749 50 10 IJGE CC(C)[C@@H](Cl)C(C)(C)NC(=O)Cc1cc(Br)cc(Br)c1 2365948118 KABJYWYZLAIKOY-CQSZACIVSA-N 425.592 4.912 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1Cl)c1ccc(NC(=O)C2CCCCC2)cc1 12487856 RUUAWFNESHUTMP-UHFFFAOYSA-N 434.323 4.587 50 10 IJGE CC(C)Cc1ccc([C@@H](C)C(=O)NNC(=O)c2ccc(NC(=O)C3CCCCC3)cc2)cc1 66199311 ZMYDNWPGEVBWHD-LJQANCHMSA-N 449.595 4.969 50 10 IJGE CCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C\c2ccc(OCCC)cc2)c(OC)c1 98027937 FANSOMOVIIKYIZ-MWXRSDQMSA-N 448.519 4.536 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NCCc2ccccc2)ccc1OCc1ccccc1C 137046885 SOHJKSLRYCWMCI-LFVJCYFKSA-N 426.516 4.849 50 10 IJGE N#C/C(=C/Nc1ccc(Oc2ccccc2)cc1)C(=O)N1CCN(Cc2ccccc2)CC1 217257137 CBZIGVHSVBTITF-ATJXCDBQSA-N 438.531 4.643 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](O[C@H]2CCCc3ccccc32)C1 303741194 JAMLKWUCFSKNJN-YESZJQIVSA-N 443.325 4.504 50 10 IJGE O=C(OCc1ccccc1)N1C[C@@H](CI)[C@@H](c2cccc(F)c2)C1 382737611 XXSPAZHQRBHNGR-SJLPKXTDSA-N 439.268 4.613 50 10 IJGE COc1cc(CBr)cc(Br)c1OCCOCc1ccccc1 390742620 NCMOBCAMIOSVNX-UHFFFAOYSA-N 430.136 4.948 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1ccccc1[C@H]1CCc2ccccc2N1S(N)(=O)=O 616593328 HGBJSSXGFVKICJ-JOCHJYFZSA-N 446.689 4.948 50 10 IJGE ClCCc1nc2cccc(Br)c2n1[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 700134854 DSYPTXQRCHJRTE-IGOJGBNBSA-N 430.777 4.883 50 10 IJGE Cc1cccc2c1CCN2C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 746387168 FXXQHBWZEBENGF-RGEXLXHISA-N 441.922 4.922 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCCCCO[C@@H]2CCC[C@H](C)C2)c1C 767150165 MWVYKCWKCVBKEC-LAUBAEHRSA-N 425.577 4.754 50 10 IJGE C#Cc1cccc(N(Cc2ccccc2)C(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)c1 1125843005 VMNZHJGQEOORMG-ITYLOYPMSA-N 437.543 4.873 50 10 IJGE CCc1nn(CC)c2c1[C@H](c1ccc(OCc3ccc(C)cc3)c(OC)c1)C(C#N)=C(N)O2 1865694846 CYDJHZIBSBSBEY-HSZRJFAPSA-N 444.535 4.580 50 10 IJGE C[C@@H](/C(O)=C(\C#N)c1nc(-c2ccccc2Cl)cs1)N1C(=O)c2ccccc2C1=O 1872746466 JIJDYTUOWCGQGP-GQDWROFLSA-N 435.892 4.941 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)CCc1ccc(Cl)cc1Cl 1905341498 AVHDRWXCCBQCHB-LBPRGKRZSA-N 427.125 4.986 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1ccc2c(c1)CCCC2 1915089283 WYJFWCHPAUGOTP-FQEVSTJZSA-N 436.415 4.930 50 10 IJGE C[C@@H]1CC[C@](CCl)(Nc2ncc(I)cc2Br)C1 2018683094 MTEZTWIHIGVGFS-PELKAZGASA-N 429.527 4.658 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H]3CC[C@H](Br)[C@H]3C2)c1 2027640887 BYPGQTGSLFPVAN-XDTLVQLUSA-N 440.550 4.550 50 10 IJGE CC[C@@H](CCCBr)NC(=O)c1ccc(Br)cc1Br 2036514272 SKDBFXYRRRNOQY-JTQLQIEISA-N 441.989 4.895 50 10 IJGE N#CC(=Cc1ccsc1)S(=O)(=O)c1cc(Br)ccc1Br 2040966949 UAGPOQXDCULAMR-UHFFFAOYSA-N 433.146 4.611 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C(F)(F)F)N(C[C@@H](CBr)C(C)(C)C)CC1 2106783804 CRWJKJYFUVDHNI-ZIAGYGMSSA-N 445.364 4.917 50 10 IJGE CC(C)[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)C[C@H]1C(F)(F)F 2121769735 AFZRZXVZHBTBTN-ZNMIVQPWSA-N 445.364 4.916 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]32 2134557600 JNXUHLJRJVSLGQ-ZIDQASMASA-N 431.111 4.564 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Br)c2n1Cc1cnc(Br)s1 2151780773 TVVLAVCREKYWLH-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE CC1(C)CC(CCl)(CNC(=O)c2ccc(I)c(Cl)c2)C1 2158309125 LCLNDRYUOAWAHQ-UHFFFAOYSA-N 426.125 4.720 50 10 IJGE C[C@H](Cl)c1nc2cccc(Br)c2n1C[C@@H]1COCCN1Cc1ccccc1 2194649711 OFKGPYJPRZYZIW-DOTOQJQBSA-N 448.792 5.000 50 10 IJGE ClCc1nc2cncc(Br)c2n1C[C@@]12CC[C@@H]1CN(Cc1ccccc1)C2 2201228589 JOBSCLICQLQACS-IERDGZPVSA-N 445.792 4.845 50 10 IJGE CC(C)[S@](=O)(=NCCCCCCBr)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2223291907 WLXIAESUZHRNGT-PUAOIOHZSA-N 439.460 4.828 50 10 IJGE COC1(CO[C@H](CI)c2cccc(Br)c2)CCC1 2254979757 VXFRVKSFRJTCGH-CYBMUJFWSA-N 425.104 4.511 50 10 IJGE COc1ccc(C=CC(=O)Oc2cccc(C=NNC(=O)c3ccccc3Cl)c2)cc1 2294737277 AGDGLUVIZMNNPD-UHFFFAOYSA-N 434.879 4.731 50 10 IJGE CC(C)(C)C[C@H](CCl)NC(=O)Cc1cc(Br)cc(Br)c1 2295316387 XPUPXFAXOSLLPJ-CYBMUJFWSA-N 425.592 4.914 50 10 IJGE CC1(C)[C@H](Br)CCN1Cc1ccc(Cl)cc1I 2302315984 QAMDDDCKIUMRBY-GFCCVEGCSA-N 428.539 4.692 50 10 IJGE Clc1ccc(CN2CCC(CCBr)CC2)cc1I 2315550944 JYPBQMFWAIDEIL-UHFFFAOYSA-N 442.566 4.942 50 10 IJGE COc1ccc2c(c1)c(C=NNC(=O)c1ccc(-c3ccc(C)c(C)c3)nc1C)cn2C 2321230036 MWRLNZJHUGFRJW-UHFFFAOYSA-N 426.520 4.938 50 10 IJGE COc1ccc(/C=N/NC(=O)CSc2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1 39372246 SKAHFCPNHSDFIT-WGOQTCKBSA-N 442.544 4.995 50 10 IJGE CCN(CC)c1c(/C=N/NC(=O)C23CC4CC(CC(C4)C2)C3)c(C)nn1-c1ccccc1 253566358 IVNZKOIYQLEFBA-WPWMEQJKSA-N 433.600 4.693 50 10 IJGE Cc1cccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)COc2ccc(C)c(C)c2)c1 254752494 VQGVIMJJDLAWIF-UHFFFAOYSA-N 438.531 4.994 50 10 IJGE O=C(CNc1ccc2ccccc2c1)NN=Cc1ccc(OC(=O)c2cccs2)cc1 254866044 WMHSNQQLWZRAAW-UHFFFAOYSA-N 429.501 4.683 50 10 IJGE O=C(NNc1cccc2cnccc12)c1cc(Oc2cccc(Br)c2)ccn1 748775676 CMVPQBODNONDID-UHFFFAOYSA-N 435.281 4.942 50 10 IJGE CC1(C)[C@H]2CC[C@@]1(C)[C@H](Oc1ccccc1C=NNC(=O)c1nnc(O)c3ccccc13)C2 794470229 FJSNPTYFFHJXEL-GYDRKIPBSA-N 444.535 4.693 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=S)Nc3cc(C)ccc3F)cc2)cc1 1633763876 QGVGGSNWCQFKKJ-UHFFFAOYSA-N 437.496 4.760 50 10 IJGE Cc1cc(Nc2ccc3c(c2)CCCC3)c(C(=O)NNc2c(F)cc(F)cc2F)c(O)n1 1648263851 NMQUNHIHIYPPIW-UHFFFAOYSA-N 442.441 4.892 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2c(C)cccc2Br)cc1)[C@@H]1C[C@H]1C 1662058832 MSDSSUIYSHZUGD-FZKQIMNGSA-N 431.334 4.667 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(F)cc2)[C@H]1c1ccccc1Cl 1865686521 XFCYRUYESZMUDN-INIZCTEOSA-N 448.807 4.961 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@@H](c1cccc(OC)c1)C(C#N)=C(N)O2 1865711657 DXMNHEHFODECSM-QHCPKHFHSA-N 428.536 4.728 50 10 IJGE CCN(CC)Cc1ccc(/C=N\NC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)cc1 1865761883 AJSBASREVOHZEQ-MBTHVWNTSA-N 436.506 4.941 50 10 IJGE CC[C@H]1C[C@H]1CCOC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1902773303 HMSPAGAFQULRMM-LSDHHAIUSA-N 437.362 4.644 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1snc(Cl)c1Cl 1902777986 OKOXHJOTZXGDPF-NSHDSACASA-N 438.174 4.550 50 10 IJGE CC(C)(C)OC(=O)NC1CCC([C@]2(C)CCC[C@@H](CI)O2)CC1 1935996591 BAOHDOCTKBLTHA-GULCKSEBSA-N 437.362 4.833 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@@]23CCC[C@@H](CI)O3)C1 1950281063 NNSWIOITOQUADZ-KFKAGJAMSA-N 449.373 4.931 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC[C@H]2C[C@H]3CC[C@H]2C3)C1 1997929610 MGJUTUZILHAWSG-YIOZNXECSA-N 449.373 4.644 50 10 IJGE CCC(CC)(CBr)CN=[S@](C)(=O)C1CC(CNC(=O)OC(C)(C)C)C1 2072485609 HSIUYWMPGBCMRS-JXCLUFJWSA-N 439.460 4.589 50 10 IJGE Clc1cc(CN2CC3(CC3)C[C@H]2CBr)ccc1I 2086657378 DUORUOYIWSWIGF-NSHDSACASA-N 440.550 4.694 50 10 IJGE CC(C)[C@@H](Br)C(=O)Nc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CCC2 2106303893 ZFOMKTAYMPRBIE-QGZVFWFLSA-N 425.367 4.728 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]23CCC[C@@]2(CN(C[C@@H](CBr)C(C)(C)C)C3)C1 2106780902 COOVRUORVKGZKK-MAODMQOUSA-N 429.443 4.767 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@H]2CCCCN(C[C@@H](CBr)CC3CC3)C2)C1 2112862126 ALYSOJNUSMAKAK-MSOLQXFVSA-N 429.443 4.767 50 10 IJGE Cc1c(Br)ccc([C@H](Cl)[C@@H]2CCCS(=O)(=O)C2)c1Br 2138873141 WMJUJEBXOKNGFC-NOZJJQNGSA-N 430.589 4.625 50 10 IJGE C[C@]1(CCl)CC(F)(F)CN1C(=O)c1cc(Br)ccc1Br 2159054492 MLWZUXZYPOLOJP-GFCCVEGCSA-N 431.502 4.690 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@H](CCBr)C(F)(F)F)cc1Br 2167385556 OZDLZLNNIKWNGW-SNVBAGLBSA-N 437.481 4.857 50 10 IJGE CN(Cc1ccccc1)[C@@H]1CCCCN(c2ccc([N+](=O)[O-])cc2CBr)C1 2169168446 UJDDIZYYYMTQQJ-HXUWFJFHSA-N 432.362 4.981 50 10 IJGE CN(C[C@@H]1CCCCN1Cc1ccccc1)c1ccc(CBr)c([N+](=O)[O-])c1 2188571486 GDRDGAWWBIRDJL-FQEVSTJZSA-N 432.362 4.981 50 10 IJGE O=C(NC[C@@]1(CBr)C[C@@H]1C(F)(F)F)c1ccc(OCc2ccccc2)cc1 2192579977 LIZRPOWLFMYTIB-HKUYNNGSSA-N 442.275 4.959 50 10 IJGE CCCCCCCN(C)S(=O)(=O)c1cc(CBr)sc1Br 2196738741 XIDDVLCSYIMEQQ-UHFFFAOYSA-N 447.258 4.996 50 10 IJGE C[C@@]1(CCOCc2ccccc2)CCN1S(=O)(=O)c1ccc(CCl)c(Cl)c1 2197754625 QGTBFCOZXJLMTN-FQEVSTJZSA-N 428.381 4.839 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1ncccc1[C@H](F)C(F)(F)F 2199311311 SXTVTRYLOATKND-LBPRGKRZSA-N 429.505 4.973 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1sc(Cl)cc1Br 2242100863 UMCXMZUTUBNMHT-SSDOTTSWSA-N 433.593 4.995 50 10 IJGE COCC1(C[C@H](Br)c2ccc(OC)c(I)c2)CC1 2257369906 PDACLNCJYWFXIX-NSHDSACASA-N 425.104 4.553 50 10 IJGE O=C(NCC1(CCl)CC(F)(F)C1)c1cccc(Br)c1Br 2281651814 VQUZNOSNAFFPMI-UHFFFAOYSA-N 431.502 4.596 50 10 IJGE O=C(NC[C@H](Br)CC(F)(F)F)c1cc(Br)c(F)cc1Cl 2285958918 SAVFRPIHHHFNPY-RXMQYKEDSA-N 441.444 4.687 50 10 IJGE CC(C)[C@@H](CCl)CNCc1ccc(I)c(Br)c1 2306220092 TWQFZKLHVYROSL-NSHDSACASA-N 430.555 4.654 50 10 IJGE Cc1nn(-c2cc(Cl)c(F)cc2CBr)c(C)c1I 2315561389 XXRLBNGWLPPTGK-UHFFFAOYSA-N 443.485 4.781 50 10 IJGE CC[C@H](Br)[C@H](CC)NC(=O)c1ccc(Cl)cc1I 2317771905 VYSPFMUNCSLQGD-JQWIXIFHSA-N 444.538 4.627 50 10 IJGE COc1cc(-c2csc(C(C#N)=C(O)[C@@H]3CC(=O)N(C(C)C)C3)n2)c(OC)cc1Cl 2331376945 NFDKCPRUUKYDFO-GFCCVEGCSA-N 447.944 4.530 50 10 IJGE COc1ccc(OC)c(-c2csc(C(C#N)=Cc3cc(OC)c(OC)c(OC)c3)n2)c1 2331450530 VAVUPVQSQPGPSI-UHFFFAOYSA-N 438.505 4.917 50 10 IJGE CCc1cc(Br)c([C@@H](Br)[C@]23CCC[C@H]2CS(=O)(=O)C3)s1 2357952061 MOIRTONFJHDVJC-FZZIBODNSA-N 442.238 4.724 50 10 IJGE COc1ccc([C@@H](CBr)OCc2cccc(I)c2)cc1 2367344120 MQLOVRBJIRQFAE-MRXNPFEDSA-N 447.110 4.953 50 10 IJGE O=C(NC1CCCC1)[C@@H](c1ccc(F)cc1)N(Cc1ccc(Cl)cc1)C(=O)CCl 3039536 HWGFOAIWZDHWRR-OAQYLSRUSA-N 437.342 4.847 50 10 IJGE CCCCCOc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1 14029480 KOADDIALMXQTRE-CQSZACIVSA-N 439.339 4.791 50 10 IJGE COc1ccc(/C(C)=N\NC(=O)CCCSc2nc3ccccc3s2)c(OC)c1 59519486 DLVYSBIGZSQHBU-UCQKPKSFSA-N 429.567 4.726 50 10 IJGE CC1(C)C[C@H](N=C=O)C[C@@](C)(CNC(=O)NC[C@@]2(c3ccc(F)cc3F)CC2(C)C)C1 170290753 KVOAOFVALQDWEF-PKKBDPGCSA-N 433.543 4.853 50 10 IJGE CC(C)[C@@H](CCBr)NC(=O)c1cc(Br)sc1Br 231122326 XTGVONKXZRDKAZ-MRVPVSSYSA-N 448.018 4.813 50 10 IJGE ClCc1ccc(I)c2sc(I)cc12 307123476 OOQWUJVVHNTPJG-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE O=C(N[C@H](CCl)C1CCCCC1)c1ccc(I)c(Cl)c1 386233858 KFSWGNJEOQVDPN-CQSZACIVSA-N 426.125 4.862 50 10 IJGE O=C(c1cc(Cl)ccc1Br)N1CCC(F)(F)[C@@H](CBr)C1 403952942 HIAWMYUCZFDQJK-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)c1cccc(S(=O)(=O)Cc2ccccc2)c1 730743686 TZBWMILXEHPILD-UHFFFAOYSA-N 437.473 4.516 50 10 IJGE Cc1ccc(F)c(NC(=S)NNC(=O)[C@@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)c1 732576992 IESQSNXYRKNRBJ-NHCUHLMSSA-N 449.551 4.834 50 10 IJGE C/C(=C/C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)c1ccccc1C(F)(F)F 742057011 GYEACUHQTGZBRG-XFXZXTDPSA-N 445.363 4.658 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NCc2cccc(C(F)(F)F)c2)c(-c2ccccc2)n1 914460595 GNQWXKWPVIYVGS-UYRXBGFRSA-N 449.436 4.706 50 10 IJGE Cc1ccc(C(=O)Nc2ccc(C(=O)NN=Cc3ccc(Br)cc3)cc2)cc1 1084599808 NZKVDJWGLINCDP-UHFFFAOYSA-N 436.309 4.774 50 10 IJGE CC(=O)CCc1ccc(OCCC(=O)N2CCC[C@@H](O[Si](C)(C)C(C)(C)C)C2)cc1 1129683765 QVXVJQHXLOFDFL-JOCHJYFZSA-N 433.665 4.990 50 10 IJGE C=C(C)[C@H](NC(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C)c1ccc(F)c(F)c1 1469854859 VRXZVZDIUKRHHW-QFIPXVFZSA-N 438.478 4.634 50 10 IJGE CCCNC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc(-c3ccccc3)cc1)CCC2 1772746056 AIIHWVGGLFEPBF-UHFFFAOYSA-N 429.520 4.865 50 10 IJGE Cc1cc(C)cc(NC(=O)c2oc3c(c2C)C(=NNC(=O)Cc2ccccc2)CCC3)c1 1772748648 MNUXYDYQKFDFPJ-UHFFFAOYSA-N 429.520 4.856 50 10 IJGE N#CSc1ccc(NC(=O)c2ccnc(NC(=O)CCCOc3ccccc3)c2)cc1 1860508641 ZLNLXLYMXWVQRE-UHFFFAOYSA-N 432.505 4.705 50 10 IJGE CCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1cccc(O)c1)C(C#N)=C(N)O2 1865681528 PVWGTZAAPAFSTN-IBGZPJMESA-N 441.318 4.724 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CCC)nn3CC(C)C)cc1OC 1865697166 OKVLXZYPMGRWMT-JOCHJYFZSA-N 438.572 4.897 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@H]1c1cccc(F)c1 1865710950 MEYXPKWIQWXJNR-INIZCTEOSA-N 448.807 4.961 50 10 IJGE CCOc1ccc(CCNC(=O)/C(C#N)=C/c2ccc(Br)cc2)cc1OCC 1866128336 LJHYKWCQRYMASG-QGOAFFKASA-N 443.341 4.512 50 10 IJGE Cc1cccc(C)c1N1C(=O)c2ccc(NC(=O)/C(C#N)=C/c3cccc(F)c3)cc2C1=O 1866131209 IXRDKBHSAKRIRA-WOJGMQOQSA-N 439.446 4.789 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1[C@@H](CBr)NC(=O)OC(C)(C)C 1880760798 JCYSGKREHMCBQD-JFIYKMOQSA-N 425.411 4.679 50 10 IJGE CCC[C@]1(C(=O)N(C)CC2CC(Br)C2)CCCCN1C(=O)OC(C)(C)C 1887828818 BAGDIHBZEJZRRJ-ALLBUHFWSA-N 431.415 4.578 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OC1CC2(C1)CC1(CCC1)C2 2025072078 UBOUUQMMEWBYTP-QGZVFWFLSA-N 449.373 4.834 50 10 IJGE C[C@H]1[C@H](Br)CCCN1Cc1ccc(I)c(Cl)c1 2026566327 JHSWWCPKNDYCMK-GXSJLCMTSA-N 428.539 4.692 50 10 IJGE CCC[C@](C)(CBr)NC(=O)c1cc(Cl)ccc1I 2029944886 LJXTYTLQSHNODG-CYBMUJFWSA-N 444.538 4.628 50 10 IJGE CCC[C@@H](Br)CCNC(=O)c1cccc(Br)c1Br 2031482194 PNDKQHDHYNMIOX-SECBINFHSA-N 441.989 4.895 50 10 IJGE Clc1ccc(I)c(CN2[C@H]3CC[C@H]2[C@H](CBr)C3)c1 2039483237 RGBDXNHZQHLZEL-WFBYXXMGSA-N 440.550 4.692 50 10 IJGE C[C@@H](NC(=O)c1cscc1OCc1ccccc1)c1nnc(CBr)s1 2072477763 UGCUNZWJQXKKRL-LLVKDONJSA-N 438.372 4.565 50 10 IJGE CCN(C(=O)OC(C)(C)C)[C@@H]1CCCN(C[C@H](CBr)c2ccccc2)C1 2106781365 HDXZEUJZOKTFKV-RBUKOAKNSA-N 425.411 4.887 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](C)CC[C@H]1CNC(=O)C(F)(F)F 2106784712 KREKQSZWKCQAGY-GJZGRUSLSA-N 429.365 4.747 50 10 IJGE C[C@H]1CN(C[C@@H](CBr)c2ccccc2)C[C@@H](C)CN1C(=O)OC(C)(C)C 2106786910 HCEVZFPOISWKEQ-ZIFCJYIRSA-N 425.411 4.742 50 10 IJGE FC[C@]12C[C@](COc3c(Br)cc(Br)cc3CCl)(CO1)C2 2202753118 AQPBEMWJKWXHJT-OKILXGFUSA-N 428.523 4.848 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)[C@]12C[C@H](CO1)C2 2213489410 LPDSLINXKIDJPH-HQDFOZKBSA-N 428.921 4.966 50 10 IJGE C[C@H](Cl)c1nc2cc(I)ccc2n1C1CSCCSC1 2237060827 HGWDSSNJPKQHOF-VIFPVBQESA-N 438.787 4.962 50 10 IJGE Cc1nc(-c2ccc(I)c(F)c2)nc(C)c1CCCBr 2237096374 UYXKWRXDYHCLGF-UHFFFAOYSA-N 449.105 4.832 50 10 IJGE CCCN(C[C@@H](C)Br)C(=O)c1ccc(I)c(Cl)c1 2259758533 VUFOAKWZHZQEKL-SECBINFHSA-N 444.538 4.580 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@H](Br)[C@H]1C[C@H](S(C)(=O)=O)C1 2269776401 NULBWHAAYBKYOS-JRKPZEMJSA-N 430.589 4.670 50 10 IJGE COc1ccc(-c2nn(Cc3ccccc3)cc2C=C(C#N)C(=O)NC2CCCC2)cc1 2295672685 QWJKHFXEMQTGIW-UHFFFAOYSA-N 426.520 4.573 50 10 IJGE CC(C)(C)[C@@H](CCl)NCc1ccc(I)c(Br)c1 2306219338 LADQNTAUIYGSLW-GFCCVEGCSA-N 430.555 4.797 50 10 IJGE COCCCN1C(=O)C(=Cc2ccc(-c3cc(Cl)ccc3Cl)o2)C(C)=C(C#N)C1=O 2314617759 AFGXVNJYVXQDOP-UHFFFAOYSA-N 445.302 4.882 50 10 IJGE N#CC(=C(O)C=Cc1cccc([N+](=O)[O-])c1)c1nc(-c2ccc3c(c2)OCCO3)cs1 2331331046 QWLHDSQZJNMNMH-UHFFFAOYSA-N 433.445 4.996 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CCC[C@](NC(=O)OC(C)(C)C)(C3)C2)C1 2345010164 KKCIRIBLVVPKTE-KKSFZXQISA-N 429.443 4.957 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCCCN2C[C@]2(CBr)CC2(F)F)CC1 2351891480 HHYOAQOSFFJJME-QGZVFWFLSA-N 437.369 4.662 50 10 IJGE O=C(NC[C@H]1CCCC[C@@H](Cl)C1)c1ccc(Cl)cc1I 2365597260 FBQXHBVWTAMWOW-WDEREUQCSA-N 426.125 4.862 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)[C@]1(C(=O)O)CCC(C)(C)C[C@@H]1OCc1ccccc1 2379102708 QPUWQBALYRUTLC-ZVVDCOBXSA-N 438.406 4.711 50 10 IJGE O=C(N/N=C/c1ccc(Br)s1)c1ccc(NC(=O)C2CCCCC2)cc1 12487418 PJOYDLLTYKKWQP-CIAFOILYSA-N 434.359 4.793 50 10 IJGE O=C(CCC(=O)Nc1cc(C(F)(F)F)ccc1Cl)N/N=C\c1ccccc1Cl 27497924 SPOYSFVKCSIFRN-VROXFSQNSA-N 432.229 4.881 50 10 IJGE Cc1cccc(NC(=O)COc2ccc(/C=C(\C#N)c3nc(O)c4ccccc4n3)cc2)c1 34988282 ZXYSROAXKVHFIO-XMHGGMMESA-N 436.471 4.726 50 10 IJGE COC(=O)c1c(-c2ccccc2)csc1NC(=O)/C(C#N)=C/c1ccc(OC)c(OC)c1 40858882 FZAWZELRWIYSHK-GZTJUZNOSA-N 448.500 4.765 50 10 IJGE Cc1ccc(-c2ccc(/C=N/NC(=O)CC[C@H](O)c3ccccc3)o2)c(Br)c1 58886831 MZUNPSFAMXXKQA-PGLVWIQMSA-N 441.325 4.981 50 10 IJGE N#C/C(=C/N1CCN(c2cccc(Cl)c2)CC1)C(=O)Nc1cc(Cl)ccc1Cl 217135574 RBGVRKBOMCWJQH-YPKPFQOOSA-N 435.742 4.815 50 10 IJGE O=C(NN=Cc1ccc(OC(F)F)cc1)c1ccc(COc2ccc([N+](=O)[O-])cc2)cc1 254399897 WZHKZLPIOFEQFB-UHFFFAOYSA-N 441.390 4.539 50 10 IJGE COc1ccc(C(C)=NNC(=O)c2cc(-c3ccc(-c4ccccc4)cc3)n[nH]2)cc1OC 254701103 RNJBYSZTWFUUEV-UHFFFAOYSA-N 440.503 4.915 50 10 IJGE CC1(C)C[C@H](Br)CCN(c2ncc(Br)cc2Br)C1 395429307 FBXVGSWOUCGGJN-SECBINFHSA-N 441.005 4.997 50 10 IJGE Clc1ccc(I)c(CN2CCC[C@H]2CCBr)c1 405351681 VCDSKQKTLIHEAX-LBPRGKRZSA-N 428.539 4.694 50 10 IJGE FC(F)Oc1ccc(CBr)c(C(F)(F)F)c1I 575723514 PXFAGWXKSRBOEV-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC2CCCCCC2)C1 685992980 ZCWJADVYMUEQKE-GOSISDBHSA-N 437.362 4.931 50 10 IJGE CCO[C@@H](CO[C@@H](CI)c1cccc(Br)c1)C1CC1 703468110 CALJHLMQQRILRR-GJZGRUSLSA-N 439.131 4.757 50 10 IJGE CC[C@@H](C[C@H](C)Br)NC(=O)c1cc(Br)cc(Br)c1 716939959 PTUGREDXRGOOHQ-UFBFGSQYSA-N 441.989 4.894 50 10 IJGE O=C(Nc1ccc(S(F)(F)(F)(F)F)cc1)C(=O)N1CCN(c2ccccc2)CC1 772929258 QEQBEOIMYPAOIO-UHFFFAOYSA-N 435.418 4.631 50 10 IJGE CCc1cccc(CC)c1NC(=O)/C(C#N)=C\c1cccc(I)c1 789127569 OCHGSGNHQANGTN-BOPFTXTBSA-N 430.289 4.962 50 10 IJGE COc1ccc(C(C)=NNC(=O)CSCc2ccc(Cl)cc2)cc1Br 1083943330 XCIGHQUXYNCKFA-UHFFFAOYSA-N 441.778 4.885 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)COc2ccc(C(C)C)cc2Br)cc1 1084084750 XCSHJSFFACMJQH-UHFFFAOYSA-N 446.389 4.948 50 10 IJGE C=CCOc1ccccc1CNC(=O)NNc1cc(C(F)(F)F)ccc1Br 1221986573 JQRWAMFFBPBTNI-UHFFFAOYSA-N 444.251 4.859 50 10 IJGE O=C(NNC(=O)c1sc2cc(F)ccc2c1Cl)c1ccc(-c2ccccc2)nc1O 1306353822 GYKBOQAVASYIPI-UHFFFAOYSA-N 441.871 4.536 50 10 IJGE CC(=O)c1cc(NC(=O)NNc2cccc(OC(F)F)c2Br)ccc1F 1661625997 DLEHBRLDIFCORJ-UHFFFAOYSA-N 432.196 4.541 50 10 IJGE CC(=O)c1cc(NC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)ccc1F 1677406380 MQOJAMPVSDUBRF-CQSZACIVSA-N 431.533 4.707 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(C)cc2)cc1OCC 1865688828 CADIVPPVYVQXIQ-DEOSSOPVSA-N 444.535 4.564 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CC)nn2-c1ccccc1Cl 1865691085 IUIWXYMHFFTUMQ-OAQYLSRUSA-N 432.911 4.871 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(F)cc2)cc1 1865693624 XKDNEOGYDUPFJR-QHCPKHFHSA-N 432.499 4.776 50 10 IJGE COc1ccc(-c2nn(CC(C)C)c3c2[C@H](c2c[nH]c4ccccc24)C(C#N)=C(N)O3)cc1 1865699853 DVOXGVGJYNEGLV-QFIPXVFZSA-N 439.519 4.914 50 10 IJGE Cc1nc(C2CCN(c3cc(Nc4ccc(SC#N)cc4)nc(C(C)C)n3)CC2)nn1C 1868231747 QRMYAPLNIOSYAE-UHFFFAOYSA-N 448.600 4.738 50 10 IJGE Clc1cc(I)c([C@H](Br)C2CC3(COC3)C2)s1 1900923655 DJMMCQWXJDQGCT-SECBINFHSA-N 433.536 4.869 50 10 IJGE CN(CC(C)(C)CI)[C@@H]1C[C@@H]2C[C@@H](OCc3ccccc3)C[C@@H]21 1904649641 WIGPJQVCVONPEV-ZSYWTGECSA-N 427.370 4.763 50 10 IJGE O=C(c1sncc1Br)N(Cc1ccccc1)C1(CBr)CCC1 1915755783 RGEJAHOAMWHRQF-UHFFFAOYSA-N 444.192 4.866 50 10 IJGE O=C(N[C@H](CCl)CC1CCCC1)c1cc(Cl)ccc1I 1926738675 ZUBWCRBIGAHWKE-LBPRGKRZSA-N 426.125 4.862 50 10 IJGE O=C(CCCCl)Nc1cc(Br)c(Br)c(Br)c1 1938594986 XDHWWFJJNIPJIE-UHFFFAOYSA-N 434.353 4.932 50 10 IJGE CN(Cc1c(Br)cccc1Br)C[C@H](Br)C1CC1 1945323944 UWNPBFKUOYFMTP-ZDUSSCGKSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@@](C)(CI)O2)[C@@H]1C(C)(C)C 1987727471 NJCTUSFVHJYWTR-DOPJRALCSA-N 437.362 4.785 50 10 IJGE CC(C)[C@H](Br)[C@@H](C)NC(=O)c1cc(Br)sc1Br 1997050944 SEYNMVROECZHMU-MUWHJKNJSA-N 448.018 4.811 50 10 IJGE Fc1cc(Br)cc(N2CCC(=CBr)C2)c1CBr 2004774966 DQAKCWBTGCFNAI-UHFFFAOYSA-N 427.937 4.972 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1Cc1cc(Br)ccc1Br 2018104517 HYDKIZVOCKAIQU-ZANVPECISA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC[C@@H]1C[C@@H]1c1ccccc1 2022691448 RCVXRKPLHAOUMR-FCEWJHQRSA-N 445.341 4.525 50 10 IJGE BrC[C@@]12CC[C@@H](CN1Cc1ccc(Br)cc1Br)C2 2031401735 CDDQKODBNQCSHP-YGRLFVJLSA-N 438.001 4.961 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CC2(CBr)CCCC2)C[C@@H]1C(F)(F)F 2106784127 GGPNROBYGBDZCD-KGLIPLIRSA-N 443.348 4.577 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](OC)C[C@@H]1CNC(=O)OC(C)(C)C 2106787423 IWJPPMUBZUOVAW-SJORKVTESA-N 435.447 4.582 50 10 IJGE CC[C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CN1CC1(CBr)CCCCC1 2106789566 ZHVSBBYSKXKFAV-RCCFBDPRSA-N 429.443 4.909 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1[C@H]2CC[C@@H]1C[C@@H](CBr)C2 2128152278 RAFBUFSHBZNMJZ-PSVAKVPMSA-N 427.589 4.942 50 10 IJGE O=S(=O)(CCC(CBr)(CBr)C1CCC1)C1CCCCC1 2145938648 NKBAGMIXMNOHJV-UHFFFAOYSA-N 430.246 4.700 50 10 IJGE CC(C)(CBr)c1cn(Cc2ccc(Cl)c(Br)c2F)nn1 2166827779 VHUIKHPIJQKZRG-UHFFFAOYSA-N 425.527 4.554 50 10 IJGE Cc1cc(Br)c(CCl)c(N2CC[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1 2185517136 XAWKNRZAJBSMEB-FGZHOGPDSA-N 449.820 4.976 50 10 IJGE O=C(NC[C@]12CCC[C@@H]1CCN2Cc1ccccc1)c1ccc(CBr)cc1 2197370470 QSKHWXXYIBNLBJ-FYYLOGMGSA-N 427.386 4.756 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Br)[C@]12COC[C@@H]1C2(F)F 2202999822 RPAAAVVQTOAOLF-DLOVCJGASA-N 432.486 4.829 50 10 IJGE O=C(N[C@H]1CCC[C@H](CBr)C1)c1cc(F)c(Br)cc1Cl 2282983549 QQJUHJPHMPFBKK-IUCAKERBSA-N 427.539 4.925 50 10 IJGE COc1cc2ncnc(N(Cc3ccccc3)C(C)(C)CBr)c2cc1OC 2294686993 DLMIYIIVCYTKME-UHFFFAOYSA-N 430.346 4.827 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)cc2I)CC[C@H]1Br 2302315129 GAOJLZKCGDJRRA-BXKDBHETSA-N 428.539 4.550 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Br)c2)CC[C@@H]1Cl 2306217346 OVSFNWYKNARNDX-CABZTGNLSA-N 428.539 4.503 50 10 IJGE C[C@@H]1CCN(Cc2ccc(I)c(Br)c2)[C@H]1CCl 2306222255 ROJRWGWSFCUBMF-RNCFNFMXSA-N 428.539 4.503 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2C[C@H]2C(F)(F)F)cc1I 2313039160 HUJMBIBYOABKKU-SOCHQFKDSA-N 435.021 4.934 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2cc(Cl)ccc2C)cc(Br)c1OC 2313671080 BJRFSWDDXXJJBF-UHFFFAOYSA-N 435.705 4.974 50 10 IJGE CCCCN1C(=O)C(=Cc2ccc(OCc3ccc(C)cc3)c(OC)c2)C(C)=C(C#N)C1=O 2314611643 YLMXGASWDXZPLS-UHFFFAOYSA-N 444.531 4.975 50 10 IJGE C[C@@H](Br)[C@H]1CCCN(Cc2ccc(Cl)c(I)c2)C1 2315551478 RIYNGMFCEPXCMP-PWSUYJOCSA-N 442.566 4.940 50 10 IJGE COc1ccc(Cc2nc3ccc(C(=O)NN=Cc4c(C)[nH]c5ccccc45)cc3[nH]2)cc1 2323720859 MREKZRORJMUBRH-UHFFFAOYSA-N 437.503 4.716 50 10 IJGE CCOC(=O)c1ccc(NC=C(C#N)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1 2325382744 MWORFOLOZAPREP-UHFFFAOYSA-N 437.805 4.994 50 10 IJGE CC(C)(C)[C@](C)(CBr)CS(=O)(=O)Cc1ccccc1Br 2380202717 LXPRLJRWSVQCBE-OAHLLOKOSA-N 426.214 4.811 50 10 IJGE COc1nc(COc2c(F)cc(Br)cc2CBr)sc1C 2381661313 ZBOFYTPRIUVNFH-UHFFFAOYSA-N 425.117 4.836 50 10 IJGE CC[C@H](C)c1ccc(OCC(=O)NNC(=O)[C@@H](C)Oc2ccccc2[C@@H](C)CC)cc1 9873877 RCXUKSVJHCWPPQ-GBESFXJTSA-N 426.557 4.707 50 10 IJGE CC(C)CCOc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)cc1 14665964 MYMDREGRBFEKDX-SFHVURJKSA-N 426.557 4.638 50 10 IJGE CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OCc3c(C)noc3C)cc2)cc1 32534585 RROCPUFVWHYXKF-DEDYPNTBSA-N 445.475 4.593 50 10 IJGE Cc1ccc2c(O)nc(/C(C#N)=C\c3ccccc3OCC(=O)Nc3ccccc3)nc2c1 35519819 CNCGZUJFBJVIPL-RGEXLXHISA-N 436.471 4.726 50 10 IJGE Cn1c(/C(C#N)=C\c2c(Oc3ccc(F)cc3)nc3ccccn3c2=O)nc2ccccc21 35549739 RWFPMMUXLTTYKV-PEZBUJJGSA-N 437.434 4.577 50 10 IJGE CCCCN(CC(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C)cc1)C(=O)[C@H](C)Cl 35691485 MTORLWPHAQKOKR-KRWDZBQOSA-N 432.996 4.673 50 10 IJGE Cc1cc(Oc2ncnc(NNC(=O)c3ccc(Cl)cc3)c2[N+](=O)[O-])cc(C)c1Cl 40657825 QIACCPQVSSZFIN-UHFFFAOYSA-N 448.266 4.858 50 10 IJGE COc1ccc(Cl)cc1-n1c(C)cc(/C=N\NC(=O)CC[C@@H](O)c2ccccc2)c1C 58890558 ROECMROWHBBQCY-XLBQOGMNSA-N 439.943 4.720 50 10 IJGE O=S(=O)(Nc1cccc(CCCBr)c1)c1ccccc1Br 139455905 NYKJBZATSLBDKE-UHFFFAOYSA-N 433.165 4.577 50 10 IJGE COc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2F)cc1 205644958 HTTQVIVUOUHWBQ-FJJUSPRBSA-N 442.446 4.671 50 10 IJGE CN(CCCCCCl)C(=O)c1cc(I)ccc1Br 234290521 AHFRCBZPYSUSEO-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE CN1CCOc2ccc(NS(=O)(=O)c3ccc(S(F)(F)(F)(F)F)cc3)cc21 782933326 HHWPWHCMVBCWTF-UHFFFAOYSA-N 430.420 4.973 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccccc2OC[C@H]2CCCCO2)c(C(F)(F)F)c1 799390914 FLLLUDBQJYFXLM-OAHLLOKOSA-N 434.418 4.674 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)Nc3cc4oc(O)nc4cc3F)c2C)cc1 1629000672 KRVRASYFFZTRHS-CXUHLZMHSA-N 446.438 4.634 50 10 IJGE COc1cc(C(=O)NNc2nc3ccccc3[nH]c2=S)cc(Cl)c1OCC(C)C 1646013697 RQMVKUWGYUIBTG-UHFFFAOYSA-N 432.933 4.746 50 10 IJGE Cc1c(C(=O)N2CCCCCC2)oc2c1C(=NNC(=O)c1ccccc1Cl)CCC2 1772744610 YKIUALLZIIXXTC-UHFFFAOYSA-N 427.932 4.728 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(F)cc2)[C@H]1c1cccc(Cl)c1 1865682948 BMJFGPWNVPQHEA-INIZCTEOSA-N 448.807 4.961 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccn2)[C@H]1c1c(F)cccc1Cl 1865685738 MFYRHZWQERUJLP-LJQANCHMSA-N 443.869 4.945 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CC)cc1 1865689705 CRNVJOQMPOMTPY-QFIPXVFZSA-N 444.535 4.976 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865709868 IZBMVFJMTHGTHM-FQEVSTJZSA-N 449.898 4.664 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1(C)C 1881088355 GGQAAGDOEQVKEX-UONOGXRCSA-N 435.403 4.700 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CCC[C@@H](CI)O2)C12CCC2 1991821664 SROLOEFCGUGCDQ-KSSFIOAISA-N 435.346 4.683 50 10 IJGE O=C(N[C@@H]1CCC[C@H](Br)C1)c1cccc(Br)c1Br 2031478816 TZEWZOUQKSEKQR-DTWKUNHWSA-N 439.973 4.648 50 10 IJGE CC1(C)C[C@H](Br)CN1C(=O)c1cc(Br)cc(Br)c1 2037329918 XCWLHIHSABLPDM-NSHDSACASA-N 439.973 4.600 50 10 IJGE Brc1ccc(CN2CC[C@@H](Br)[C@@H]2C2CC2)c(Br)c1 2067015099 FUFNCDSMCOWPJO-OCCSQVGLSA-N 438.001 4.959 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)c1cc(Cl)cc(NC(=O)OC(C)(C)C)c1 2076207733 FUGYVSZFVIPQPB-AULYBMBSSA-N 431.758 4.933 50 10 IJGE CCOc1cc(CBr)cc(Br)c1OC[C@H]1C[C@@H]1Br 2076263760 ZJWGJPCFUAKSGV-ZJUUUORDSA-N 442.973 4.905 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@@H](CCl)C(F)(F)C1 2090184475 QONKVKWEUGMJMH-LURJTMIESA-N 437.531 4.609 50 10 IJGE CN(Cc1ccccc1)C1(Cn2c(CCl)nc3cncc(Br)c32)CCC1 2095449464 HLMKZCDJETVPFA-UHFFFAOYSA-N 433.781 4.987 50 10 IJGE Fc1cc(Br)c2nc(CCl)n([C@]34C[C@@H]3CN(Cc3ccccc3)C4)c2c1 2099678028 FLXUPRSULGAOSP-VLIAUNLRSA-N 434.740 4.908 50 10 IJGE O=C(NC[C@]12CCC[C@@]1(CBr)C2)c1cc(Br)c(Cl)s1 2142949502 KHRLEAMAKLPWJM-QWHCGFSZSA-N 427.589 4.849 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@]12C[C@@H]1CN(Cc1ccccc1)C2 2155872534 JWIKGTZHSLESFV-IERDGZPVSA-N 445.792 4.515 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCN(C[C@@H](CBr)c3ccccc3)CC2)C1 2163057617 CTEJXOAPFOYHSN-LJQANCHMSA-N 437.422 4.888 50 10 IJGE Cc1cc2nc(CCl)n(C[C@H]3COCCN3Cc3ccccc3)c2cc1Br 2194650896 VBIFYRDGOKIBLY-KRWDZBQOSA-N 448.792 4.747 50 10 IJGE Cc1sc(C(=O)N2CC[C@H](CBr)C(F)(F)C2)c(C)c1Br 2234477253 DTTRRKMUZUDIMR-SECBINFHSA-N 431.140 4.620 50 10 IJGE COc1ccc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)c(CBr)c1 2235953747 FRMBGUQBNGTSSF-LJQANCHMSA-N 443.307 4.843 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)Nc1ccccc1CCBr 2238841942 RUEUYHNDWDEGSM-UHFFFAOYSA-N 439.194 4.557 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@@]2(F)CCC[C@@]2(CBr)C1 2279176820 XTDIEIXQHWWQSD-OLZOCXBDSA-N 445.579 4.893 50 10 IJGE O=C1NCCc2ccc([C@H](Br)c3scc(Br)c3Cl)cc21 2279286850 GMHOQNHKJLVGGS-NSHDSACASA-N 435.568 4.934 50 10 IJGE C[C@H](Cl)C[C@@H]1CCCCN1C(=O)c1ccc(Cl)c(I)c1 2283652247 RSQFFNGVHBESQP-JQWIXIFHSA-N 426.125 4.957 50 10 IJGE CC1([C@H](CCl)NCc2ccc(I)c(Br)c2)CC1 2306223073 ACDDDYCLPFVJSM-LBPRGKRZSA-N 428.539 4.551 50 10 IJGE COc1cc(Cl)c([C@@H](Br)c2c(Br)ncn2C)cc1Cl 2337272028 DBUSVNYQGSBYGY-SNVBAGLBSA-N 428.939 4.982 50 10 IJGE COc1ccc(CCO[C@@H](CCl)[C@@H](Br)CCl)c(Br)c1 2339258310 SIQAKDKYFICKNQ-STQMWFEESA-N 434.983 4.627 50 10 IJGE O=C(N[C@H](CCl)c1ccsc1)c1ccc(Cl)cc1I 2340052037 KJBLIZVDCSZPMP-GFCCVEGCSA-N 426.106 4.716 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@H]1CCCN(C[C@H](CBr)c2ccccc2)CC1 2340134868 LGXPALFXWCJXQH-OALUTQOASA-N 425.411 4.887 50 10 IJGE Cc1cccn2c(=O)c(/C=C(/C#N)c3nc4ccccc4n3C)c(Oc3ccccc3)nc12 33429213 KOHGWXZATSGULB-SDXDJHTJSA-N 433.471 4.746 50 10 IJGE Cc1ccc2c(c1)/C(=N\NC(=O)[C@H](C)Oc1ccc(Cl)cc1C)C(=O)N2CCC(C)C 33959339 HAEWBBSGLMVXCT-KQMYFLNBSA-N 441.959 4.637 50 10 IJGE COc1ccc(C)cc1N1C(=O)CS[C@H]1c1ccc(NC(=O)C(C)(C)CCl)cc1 35910161 SPPQYWCHOVTROZ-FQEVSTJZSA-N 432.973 4.986 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C\c2c(Oc3ccccc3)nc3ccccn3c2=O)cc1C 39858494 NHAHSXHYLXZRPC-CYVLTUHYSA-N 436.471 4.649 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2F)CCC3)cc1 40812528 YSIINXKHPBGRJS-NHFJDJAPSA-N 434.467 4.979 50 10 IJGE Cc1cc(Cl)ccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1cccnc1)CCC2 40814123 XAZPXPJWEGMWSK-OVVQPSECSA-N 436.899 4.668 50 10 IJGE CCOc1cc(/C=C2\C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(C)cc1 214253102 RZUFARYHROEHSF-XKZIYDEJSA-N 444.531 4.973 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C\Nc2ccc(I)cc2)cc1Cl 217021028 NUKFBLCANVSPOQ-BENRWUELSA-N 437.668 4.711 50 10 IJGE BrCc1cc(Br)c(OCc2cnsn2)c(Br)c1 399801668 WDEFAQKUNZXKAI-UHFFFAOYSA-N 442.958 4.537 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCCC[C@H]1CBr 705397012 BQNRDCTVXSOAPG-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE Cc1ccc([N+](=O)[O-])c([C@H]2CN(Cc3ccccc3)C[C@@H]2CI)c1 725388271 KZECZYDFOKUHAI-WMZOPIPTSA-N 436.293 4.554 50 10 IJGE CC[C@@H](Oc1ccccc1C(C)C)C(=O)NNC(=S)Nc1ccc(OC(C)C)cc1 730036864 RTAXXEFISYKLIS-HXUWFJFHSA-N 429.586 4.772 50 10 IJGE Cc1ccc([C@@H](C)CNC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1 739049885 SAZWDBFLXHIZAU-IBGZPJMESA-N 438.531 4.958 50 10 IJGE C#CCN(CC#C)C(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Cl)c(C(F)(F)F)c2)c1C 1456730892 CHCUWWIHQPUGBK-LDADJPATSA-N 443.856 4.768 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNc3cc(Cl)nc4c3c(C)nn4C)cc2)cc1 1587925968 ZKMPBEPHOPQKFR-UHFFFAOYSA-N 449.898 4.682 50 10 IJGE CC(=O)c1ccc(CNC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(Cl)c3)c2C)nc1C 1631889666 OYEKEDCKGRHCIJ-RGVLZGJSSA-N 446.938 4.877 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2cc(C(F)(F)F)ccc2N(C)CCCC)c1 1633773343 AOXLOMVOJSEWMV-UHFFFAOYSA-N 448.514 4.554 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNc2ccc(Br)nc2)cc1 1648549458 CVYBMBBXUGLLTQ-UHFFFAOYSA-N 425.286 4.547 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccoc1C)CCC2 1772749828 SMYPYCJHJGKGEG-UHFFFAOYSA-N 435.480 4.529 50 10 IJGE COc1ccc(OC)c(C=NNC(=O)CSc2nc(-c3ccc(Cl)cc3)cs2)c1 1772754950 BWZAPLNLFFVFAT-UHFFFAOYSA-N 447.969 4.723 50 10 IJGE C[C@@H](Br)C(=O)c1ccc(I)c(SC(F)(F)F)c1 1848425829 FRTFZPFTOQGPMK-RXMQYKEDSA-N 439.034 4.869 50 10 IJGE CCc1nn(CC)c2c1[C@H](c1ccccc1OCc1ccccc1Cl)C(C#N)=C(N)O2 1865703293 SNGQFHHWJMDUAV-OAQYLSRUSA-N 434.927 4.916 50 10 IJGE Cc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccc(F)cc1)C(C#N)=C(N)O2 1865708296 SSZGNKTYMLYWAS-IBGZPJMESA-N 429.282 4.904 50 10 IJGE CC(C)(C)OC(=O)N1CCCN(C[C@H](CBr)c2ccccc2)C(C)(C)C1 1879295849 KQXSGTKYJIQAMA-SFHVURJKSA-N 425.411 4.887 50 10 IJGE C[C@@H](c1cccs1)N(Cc1ccccc1)Cc1ccc(C(=O)NN)cc1Br 1915381542 JBZIHTCIDSGGTG-HNNXBMFYSA-N 444.398 4.878 50 10 IJGE COc1ccc(CC(=O)N(Cc2ccccc2)C2(CBr)CCC2)cc1OC 1915749420 KCFXBXWUGDTYAI-UHFFFAOYSA-N 432.358 4.593 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]2(CCC[C@H](CI)O2)C12CCCCC2 1989552952 QLGIUJYKPDFTHU-KDOFPFPSSA-N 435.346 4.683 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CC[C@H](CI)O2)C12CCCC2 1994328390 TWSJNLIARTVSJR-KDOFPFPSSA-N 435.346 4.683 50 10 IJGE CCc1nc(Br)c(Br)n1C[C@@H](CBr)CC1CC1 2003365962 FFFKHWWMQIHLRF-SECBINFHSA-N 428.994 4.782 50 10 IJGE O=C(N[C@@H]1CC[C@@H](CBr)C1)c1cc(Br)cc(Br)c1 2029536100 PFHSBETYXBWJTK-PRHODGIISA-N 439.973 4.505 50 10 IJGE CC(C)[C@@H](Br)CCNC(=O)c1cc(Br)cc(Br)c1 2029916957 MWTRMYPAJOFXBM-LBPRGKRZSA-N 441.989 4.751 50 10 IJGE Cn1cc([C@@H](Br)c2cc(F)c(Br)cc2F)c(Br)n1 2052973212 ZPFXWKZANLRGSG-JTQLQIEISA-N 444.899 4.708 50 10 IJGE Cc1c(Br)ccc([C@H](Br)[C@@H]2OCCO[C@H]2C)c1Br 2083320546 KNOQFPRKQAASQE-AQUOVQTQSA-N 442.973 4.760 50 10 IJGE Clc1cc(CN2CC[C@H](CBr)C23CC3)ccc1I 2086655414 NKPONSNXDLDVJA-LLVKDONJSA-N 440.550 4.694 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)[C@H]1CCCCN(C(=O)OC(C)(C)C)C1 2112846758 JSVKGJQMNKZDPD-MOPGFXCFSA-N 425.411 4.887 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)C1(C(F)(F)F)CCCCC1 2116579041 WTOCAHTWZSLDHV-INIZCTEOSA-N 436.312 4.938 50 10 IJGE COc1cc(Cl)c([C@@H](Br)c2c(Cl)cnn2C)cc1Br 2137644296 CVHYRVMEYXIGGH-LLVKDONJSA-N 428.939 4.982 50 10 IJGE ClCCc1nc2cncc(Br)c2n1CC[C@@H]1CCN(Cc2ccccc2)C1 2151778256 LAMIOVUWDLQJHJ-KRWDZBQOSA-N 447.808 4.887 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2C[C@@]1(Cl)CC1(F)F 2205570147 FANJKROTMORUMJ-NSHDSACASA-N 435.014 4.535 50 10 IJGE CN(CCCCCI)[C@@H]1C[C@@H]2C[C@H](OCc3ccccc3)C[C@H]21 2211185116 PDZIYSRHOPWTDI-VNTMZGSJSA-N 427.370 4.907 50 10 IJGE Cc1sc(C(=O)NC2(CCBr)CCSCC2)c(C)c1Br 2234479664 KAVFKYDNRPMSBQ-UHFFFAOYSA-N 441.254 4.908 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC[C@H](CI)O2)C[C@H]2CCCC[C@@H]21 2242741018 QIYIKIPVQLAEOV-BSXFFOKHSA-N 435.346 4.539 50 10 IJGE C[C@@H]1C[C@@H]([C@@H](Br)Cc2cc(Br)cc(Br)c2)CO1 2252834151 GVNHUQLIPHKEBR-JQEORGNBSA-N 426.974 4.943 50 10 IJGE CN(Cc1ccc(CBr)cc1)Cc1ccccc1I 2265616407 FSSMFTNAUGACAZ-UHFFFAOYSA-N 430.127 4.818 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@]2(F)CCC[C@@]2(CBr)C1 2279176819 XTDIEIXQHWWQSD-CHWSQXEVSA-N 445.579 4.893 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CCC(OCCCBr)CC1 2279180358 FPYYKAOJWHLGHN-UHFFFAOYSA-N 445.604 4.570 50 10 IJGE COC(=O)c1ccc(C(=O)OC)c(NC=C(C#N)c2nc(-c3ccc(C)c(C)c3)cs2)c1 2295948590 RCRCUFKYVFIBMI-UHFFFAOYSA-N 447.516 4.977 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@H]2CCCC[C@@H]3C[C@H]23)C1 2302878308 NZXLAHCKYVTIQQ-DRMAHVMPSA-N 449.373 4.786 50 10 IJGE C[C@H](c1ccncc1F)[C@@H](Br)c1cc(I)sn1 2304297463 GVNAQZKSMYSXTA-KSBSHMNSSA-N 427.080 4.522 50 10 IJGE ClCCCC1(NCc2ccc(I)c(Br)c2)CC1 2306221500 IRGKNWYAIXRBGA-UHFFFAOYSA-N 428.539 4.695 50 10 IJGE CC[C@H](C)[C@H](CCl)NCc1ccc(I)c(Br)c1 2306225906 DWXQMDFGLDFMTL-ZANVPECISA-N 430.555 4.797 50 10 IJGE C[C@H]1C[C@@H](CCl)CN1Cc1ccc(I)c(Br)c1 2306227290 MHQAIGJWKLZEKC-ONGXEEELSA-N 428.539 4.503 50 10 IJGE C=CCc1cc(C=C(C#N)C(=O)N(C)C)cc(Br)c1OCc1ccccc1F 2313567213 DHNMHMBNMATISU-UHFFFAOYSA-N 443.316 4.891 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)N(C)C)cc(Br)c1OCc1cccc(C)c1 2313567636 JJVFUAIZJKAQDZ-UHFFFAOYSA-N 443.341 4.730 50 10 IJGE CCCO[C@@H]1[C@H](Br)C[C@H]1Oc1cc(Br)cc(Br)c1 2316829344 PHMQHQOSLDAXHO-JHJVBQTASA-N 442.973 4.921 50 10 IJGE C[C@@H]1C[C@H](Br)CCN(Cc2ccc(Cl)cc2I)C1 2318513938 YDEUGYXMEXLAAD-ZYHUDNBSSA-N 442.566 4.940 50 10 IJGE CCCOc1c(OC)cc(C=NNC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)cc1OC 2323138671 CCIMSONRFGMXMB-VJMWJIOOSA-N 428.573 4.939 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4Cl)[nH]c3c2)cc1OC 2323744081 UYSGJWYATVXWCH-UHFFFAOYSA-N 434.883 4.664 50 10 IJGE C[C@@]1(CBr)C=CCCN1Cc1cc(I)ccc1Cl 2327409830 SKJRJWHHIJKCHO-AWEZNQCLSA-N 440.550 4.860 50 10 IJGE CCCc1sc(Br)cc1[C@H](Br)[C@H]1CCCS(=O)(=O)C1 2338024622 WNQDXYQMRGDBDC-TVQRCGJNSA-N 430.227 4.724 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@H]3CN(C(=O)OC(C)(C)C)CC[C@@H]32)C1 2345005630 BGEVHJWUADJWGD-IRXDYDNUSA-N 429.443 4.909 50 10 IJGE N#C/C(=C/c1ccc(OCc2ccc(Cl)cc2Cl)c(Br)c1)C(N)=O 1410785 KJACUYUFGCFDRU-XGICHPGQSA-N 426.097 4.727 50 10 IJGE CCOc1ccccc1-c1cc(C(=O)N/N=C/C(Br)=C/c2ccccc2)[nH]n1 27527961 IXZOLRVUWTZDBD-VMHJBKSWSA-N 439.313 4.627 50 10 IJGE COc1cc(/C=C(/C#N)c2nc(-c3cc4ccccc4oc3=O)cs2)ccc1OC(C)=O 34387159 ULKVYICOEAOICS-MFOYZWKCSA-N 444.468 4.915 50 10 IJGE CCc1ccccc1Nc1ncnc(NNC(=O)c2cccc3ccccc23)c1[N+](=O)[O-] 40587120 XWUXDGIMTSTZDI-UHFFFAOYSA-N 428.452 4.601 50 10 IJGE CCOc1ccc(NC(=O)[C@H](C)Sc2nc3ccc(NC(=O)CCl)cc3s2)cc1 59422293 MJIJFPOMYXGDGF-LBPRGKRZSA-N 449.985 4.992 50 10 IJGE CCOc1ccc(/C=C2\C(=O)N([C@H](C)c3ccccc3)C(=O)C(C#N)=C2C)cc1OCC 214343100 PWFNEKQMDYEJSF-MKYLKIGJSA-N 430.504 4.837 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\Nc1ccc(Cl)c(C(F)(F)F)c1 217155188 AIXMVZWCMZTWHY-QXMHVHEDSA-N 437.805 4.994 50 10 IJGE CC(C)(C)CCO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 231317874 OZQUHDLRAYEJPW-QGZVFWFLSA-N 425.351 4.644 50 10 IJGE O=C(NN=Cc1ccc(Br)s1)c1cc2cc(Br)ccc2o1 252625064 QCBMVOXAOLZJEG-UHFFFAOYSA-N 428.105 4.783 50 10 IJGE C[C@H](Br)[C@H]1CCCCN1c1ncc(Br)cc1Br 688877413 ZSPGQSJICNSECX-GZMMTYOYSA-N 426.978 4.749 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1C(=O)c1scc(Br)c1Br 705425009 JGBGGUPCYIGPFV-BQBZGAKWSA-N 446.002 4.661 50 10 IJGE CC(C)c1csc([C@@H](C#N)C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)n1 747197368 FNZPBODRAAKNTB-OBXYEHHASA-N 440.532 4.827 50 10 IJGE CN(C(=O)c1ccc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1)c1ccccc1 799747612 CTBPFRRKMNQMEJ-UHFFFAOYSA-N 438.409 4.611 50 10 IJGE CC(=O)Nc1cc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(F)cc3)c2C)ccc1F 875189157 GFDNGEQRPFMRIO-WQRHYEAKSA-N 434.446 4.876 50 10 IJGE O=C(NN=C(CSc1nc2ccccc2o1)c1ccc([N+](=O)[O-])cc1)c1ccccc1 1084024311 OXOFZRUXTUFCFW-UHFFFAOYSA-N 432.461 4.662 50 10 IJGE CCc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865700547 WWOKWDRPHNIJPW-OAQYLSRUSA-N 429.911 4.847 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@H](c1cccc(OC)c1)C(C#N)=C(N)O2 1865711656 DXMNHEHFODECSM-HSZRJFAPSA-N 428.536 4.728 50 10 IJGE COc1cccc(-c2csc(/C(C#N)=C(\O)[C@H]3CC(=O)N(Cc4ccccc4)C3)n2)c1 1872744564 YOZZOKQSMSAYMQ-FGLUDEAJSA-N 431.517 4.660 50 10 IJGE Cc1ccnc(CN(C)C[C@@H](Br)COCc2ccccc2)c1Br 1926833404 IKFCNINCRYDCHJ-MRXNPFEDSA-N 442.195 4.565 50 10 IJGE CN(Cc1ccc(Br)cc1Br)[C@H]1CCC[C@H]1Br 1943859022 LXCFZMXYPMBYLP-YPMHNXCESA-N 425.990 4.959 50 10 IJGE CC(C)(C)[C@H](CBr)CN1CC=CCC12CN(C(=O)OCc1ccccc1)C2 2026495274 RVFPWRJVVSTQRC-LJQANCHMSA-N 435.406 4.697 50 10 IJGE Cl[C@@H](CNc1ncc(I)cc1Br)c1ccccc1 2069525746 LCBSKZBDXSOOPW-LBPRGKRZSA-N 437.506 4.841 50 10 IJGE O=C(OCc1ccccc1)N1CC2(CC=CCN2CC2(CBr)CCCCC2)C1 2086547395 VPYBKTKHRBGBJS-UHFFFAOYSA-N 447.417 4.985 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1cccc(Br)c1Cl 2090388975 XXZTWIITVHMPBX-SECBINFHSA-N 429.605 4.739 50 10 IJGE CCC(CC)(CBr)CN(CCOC)C[C@H]1CCCN1C(=O)OC(C)(C)C 2106783423 ZXTBAJOEFNMUBJ-QGZVFWFLSA-N 435.447 4.536 50 10 IJGE CCC1(NC(=O)OC(C)(C)C)CCN(C[C@H](CBr)c2ccccc2)CC1 2106785824 RBGQJSXUBOELTN-SFHVURJKSA-N 425.411 4.934 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](CN(CC3(CBr)CCCCCC3)C2)C1 2106786173 STJHYFMKHYGHRV-ROUUACIJSA-N 429.443 4.911 50 10 IJGE Fc1cccc(N2CCC[C@@]3(CN(Cc4ccccc4)CCO3)C2)c1CBr 2151739776 OQSAQLPMBLTMDX-JOCHJYFZSA-N 433.365 4.592 50 10 IJGE CCCC(CBr)(CCC)CN1CCC[C@H]2CC[C@]21CNC(=O)C(F)(F)F 2163059277 RSTGNSCYRHKLHX-YJBOKZPZSA-N 441.376 4.891 50 10 IJGE CCN(C(=O)[C@H](Br)C1CCCC1)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2167032509 MXWWIJZUNCMJSM-UJJTZGENSA-N 443.426 4.719 50 10 IJGE Clc1cccc(CC23COC(CI)(C2)C3)c1Br 2216273739 ZUJKWDCHZQDMMI-UHFFFAOYSA-N 427.507 4.629 50 10 IJGE CC(C)(C)OC(=O)NCCCN1CCN(CCCCCCCCCBr)CC1 2234447855 NUNXOTWCYAGIEM-UHFFFAOYSA-N 448.490 4.644 50 10 IJGE COC(=O)c1cc(C(C)C)sc1NC(=O)C(C#N)=Cc1c(F)c(F)c(F)c(F)c1F 2295669998 WQMFYYRFRSMYKF-UHFFFAOYSA-N 444.381 4.899 50 10 IJGE Cc1ccc(CBr)cc1NC(=O)c1cccc(F)c1I 2296109654 OXQLADNUXABCTL-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE CCC(CC)(CCl)NCc1ccc(I)c(Br)c1 2306220562 YTDOCSLHKDNPLA-UHFFFAOYSA-N 430.555 4.941 50 10 IJGE O=S1(=O)CC[C@@H]1[C@H](Br)c1c(F)cc(Cl)c(Br)c1Cl 2313742362 FYTNEYZMMATPDR-MUWHJKNJSA-N 440.943 4.518 50 10 IJGE C[C@@H](Br)CCCN(C)C(=O)c1ccc(Br)cc1Br 2314467867 YUAOVIKANKKVOI-SECBINFHSA-N 441.989 4.847 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCc2ccccc2)ccc1OC(=O)c1ccc(C)c(C)c1 2314737132 NVVMUPYUIOIIDS-UHFFFAOYSA-N 440.499 4.755 50 10 IJGE Clc1ccc(C[C@@]2(CBr)C[C@]23CCOC3)cc1I 2315554317 DGIXSKRMAANWTR-KBPBESRZSA-N 441.534 4.679 50 10 IJGE COc1ccc(Br)cc1C=NNC(=O)c1ccc2nc(-c3ccccc3)[nH]c2c1 2323744674 XSIGOVRDGZJJFU-UHFFFAOYSA-N 449.308 4.765 50 10 IJGE COc1ccc(CC(O)=C(C#N)c2nc(-c3ccc(OC)c(OC)c3)cs2)cc1OC 2331241435 IWIJMCACSPLMLE-UHFFFAOYSA-N 438.505 4.880 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCN(CC2CC(Br)C2)[C@@H](C(F)(F)F)C1 2337544379 BGHUALQPXGHHBK-VXGQWTEUSA-N 443.348 4.718 50 10 IJGE Cc1ccc(I)c(C(=O)NC(C)(C)[C@@H](Br)C(C)C)c1 2340406847 PWUMRVOIBCQLJZ-ZDUSSCGKSA-N 438.147 4.528 50 10 IJGE CC1(C)CC(CBr)(CN2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)C1 2345008821 UYFOZXOMIONZNU-QGZVFWFLSA-N 433.356 4.936 50 10 IJGE Cc1scc(C(=O)NC[C@@]2(CBr)C[C@H]2C(F)(F)F)c1Br 2369609014 URXLQGWMEIUWQS-KCJUWKMLSA-N 435.103 4.512 50 10 IJGE CC(C)(C)[C@@](C)(CBr)CN1CCN(C(=O)C(F)(F)F)C2(CCCCC2)C1 2380162970 BTFGVWOKKFVFEI-KRWDZBQOSA-N 441.376 4.843 50 10 IJGE Cc1cc2c(c(=O)n1Cc1ccccc1)[C@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 2204608 FAUUZGNNRDGVOS-HXUWFJFHSA-N 438.314 4.730 50 10 IJGE C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)/C=C/c1cccc2ccccc12 12578386 FHTAAYZPVAKHHC-BRADTZPFSA-N 429.303 4.775 50 10 IJGE C=CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(C)cc2)cc1 38649231 ZAAVITPCMILIJE-VWLOTQADSA-N 438.483 4.997 50 10 IJGE CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccc(C)cc3)ccc21 38650425 LBFAMBHZKNCXSS-XMMPIXPASA-N 426.472 4.831 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc([N+](=O)[O-])cc4)ccc32)cc1 38677022 VOKMOKWHBBBVFZ-HSZRJFAPSA-N 441.443 4.595 50 10 IJGE CCOc1ccc2ccccc2c1/C=N/NC(=O)COc1cccc(Br)c1 40912179 UMUUJHHQYFYGHT-YDZHTSKRSA-N 427.298 4.530 50 10 IJGE O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)N/N=C/c1cccc(Cl)c1Cl 58989655 PXRNQKCONPGEGP-FBCYGCLPSA-N 441.321 4.754 50 10 IJGE C=CCn1c(CNc2cccc3ccccc23)nnc1SCC(=O)N/N=C(\C)CCC 59914979 LJNBPRZKFLEILG-KOEQRZSOSA-N 436.585 4.614 50 10 IJGE N#CCS/C(Nc1cccc(C(F)(F)F)c1)=C(/C#N)C(=O)c1ccc2c(c1)OCO2 106652034 PXNWXOWHSZCYLI-CYVLTUHYSA-N 431.395 4.721 50 10 IJGE O=C(NN=Cc1ccc(OC(=O)c2ccco2)cc1)c1ccc(COc2ccccc2)cc1 252642755 ZPMSBRPPIHTECM-UHFFFAOYSA-N 440.455 4.842 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2ccc(NC(=O)c3ccccc3C)cc2)cc1 254556235 JCSHXBQATXWPCB-UHFFFAOYSA-N 428.536 4.857 50 10 IJGE O=C(NN=Cc1cccc(Br)c1)c1cccc(NC(=O)c2ccc(F)cc2)c1 254706435 UYAGJZSXCMJRDN-UHFFFAOYSA-N 440.272 4.604 50 10 IJGE Oc1cc([C@@H]2CN(Cc3ccccc3)C[C@@H]2CBr)ccc1Br 382676586 TZYRQJAGRHEFIY-HOTGVXAUSA-N 425.164 4.765 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1cccc([C@@H]2CCN(S(N)(=O)=O)c3ccccc32)c1 616675312 BMJGQAYHQCMVJU-IBGZPJMESA-N 432.662 4.754 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N(CCBr)CC1CC1 688369889 WKOIWTICWASRLV-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE ClCCc1nc2cccc(Br)c2n1Cc1cnn(Cc2ccccc2)c1 697712717 SDOWWZOXWCGCJO-UHFFFAOYSA-N 429.749 4.873 50 10 IJGE CC(=O)N(C)c1ccccc1NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccccc2C)c1C 735640372 XHAGZUHXBIDHGS-PXLXIMEGSA-N 426.520 4.931 50 10 IJGE CCCn1c(C)cc(/C=C(/C#N)C(=O)Oc2ccc(OCc3nc(CC)no3)cc2)c1C 741625604 OFKHLTBUHJJESO-UYRXBGFRSA-N 434.496 4.552 50 10 IJGE CC(=NNC(=O)c1ccc(CSc2nncn2C)cc1)c1cc(Cl)cc(Cl)c1 755878519 BHEOXQGCNFNKAF-UHFFFAOYSA-N 434.352 4.568 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)NN=Cc2cccc(F)c2F)c(Br)c1 1084454679 DCFIAWAHICAJFF-UHFFFAOYSA-N 425.273 4.554 50 10 IJGE Cc1cccc(NNC(=O)CCc2nc(O)c3c4c(sc3n2)C[C@H](C)CC4)c1Cl 1636650673 JRMWLFYNHSRAAO-LLVKDONJSA-N 430.961 4.559 50 10 IJGE COc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)Nc3ccc(C)c(C)c3)c(C)c21 1772746537 XCIITNBDGXODHJ-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE CCCc1nn(-c2ccccn2)c2c1[C@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 1865685126 DKRYVPPRVSXLAS-GOSISDBHSA-N 426.307 4.745 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3CC(C)C)cc1 1865690740 ZZBZSFZJIMQQJD-KRWDZBQOSA-N 434.462 4.955 50 10 IJGE COc1ccc2c(c1)c(/C=N\NC(=O)c1ccc(-c3ccc(F)c(F)c3)nc1C)cn2C 1865762044 KGVXLQDTZBKMNX-PPDIBHTLSA-N 434.446 4.599 50 10 IJGE CC[C@@H](NC(=O)[C@H](Cc1ccncc1)c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1866708599 WFHMPOQPMBULSE-DHIUTWEWSA-N 444.560 4.515 50 10 IJGE CCC[C@@H](NC(=O)C[C@@H](C)c1cccc(OC)c1)C(=O)Nc1ccc(SC#N)cc1 1867113357 NRPRKBDOUZXVJC-IIBYNOLFSA-N 425.554 4.686 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](I)[C@H](OCC2CCCCCCC2)C1 1902602514 PJHYLGKKHZGQDJ-HZPDHXFCSA-N 437.362 4.786 50 10 IJGE C[C@H](Br)C[C@@H](C)NC(=O)c1csc(Br)c1Br 1937737545 KLUPNKZWGGXMPP-NTSWFWBYSA-N 433.991 4.565 50 10 IJGE Cc1nn(-c2cccc(Cl)c2CBr)c(C)c1I 1945162774 VUTTVWGMVYZUKO-UHFFFAOYSA-N 425.495 4.642 50 10 IJGE Cc1ccc(Br)c(C(=O)N(Cc2ccccc2)[C@@H](C)CCBr)n1 1980428184 AHWJQMAXCNCGBX-AWEZNQCLSA-N 440.179 4.968 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1C(=O)c1c(Br)cccc1Br 2033086131 IYDQDXRHVAHTJZ-RKDXNWHRSA-N 439.973 4.600 50 10 IJGE BrC[C@H]1CC2(CC2)CN1Cc1cccc(Br)c1Br 2037826118 XFJMCEAPZBFEQM-LLVKDONJSA-N 438.001 4.961 50 10 IJGE Cl[C@@H]1CCC12CC(CNc1ncc(I)cc1Br)C2 2074781029 FCBXKPJMOFOZJY-UHLWVNKISA-N 441.538 4.658 50 10 IJGE O=C(NC[C@H]1C[C@@H](Cl)C12CCC2)c1csc(Br)c1Br 2115610680 SWZAYIXUPGJXRB-VXNVDRBHSA-N 427.589 4.801 50 10 IJGE O=C(c1cccc(OCc2ccccc2)c1)N1C[C@]2(F)CCC[C@@]2(CBr)C1 2176642200 XHUNEAVMWJKWGN-FGZHOGPDSA-N 432.333 4.995 50 10 IJGE C[C@H](CC1CCN(C(=O)[C@@H](Br)C2CCCC2)CC1)N(C)C(=O)OC(C)(C)C 2203636461 BAOMZIKYHCBZAE-QAPCUYQASA-N 445.442 4.824 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OCCCCC(F)F)CC1 2212215800 ZWXTWHFMTHXOEH-UHFFFAOYSA-N 447.304 4.643 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(OC[C@H]2CC(F)(F)C23CCC3)C1 2266115900 WOZKIRJBUGFLMY-RHSMWYFYSA-N 438.353 4.993 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@@H](C2)[C@H]1CBr 2282967273 NZXGBMHDVCAZIF-UVPNAGLESA-N 425.523 4.630 50 10 IJGE CC1(C)[C@H](CBr)CCN1C(=O)c1cc(Br)c(F)cc1Cl 2285967647 XNDUPJRLSCUIDD-QMMMGPOBSA-N 427.539 4.877 50 10 IJGE CC(C)[C@@](C)(CCl)NCc1ccc(I)c(Br)c1 2306221720 LFPOUINXADAOEP-CYBMUJFWSA-N 430.555 4.797 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1Cc1cc(I)ccc1Cl 2307328225 KJJKDGITJJKUTF-KOLCDFICSA-N 428.539 4.692 50 10 IJGE CC1=C(C#N)C(=O)N(C[C@H]2CCCO2)C(=O)C1=CNc1ccc(N=Nc2ccccc2)cc1 2314578746 AANCYKFPSMORQE-OAQYLSRUSA-N 441.491 4.786 50 10 IJGE FC(F)(CBr)C(F)(F)CNCc1sc(Cl)cc1Br 2322461460 TYYLTFJLGUEDDU-UHFFFAOYSA-N 433.490 4.919 50 10 IJGE Cc1cc(I)ccc1NC(=O)C(C#N)=CNc1cccc(Cl)c1 2325406158 HKKXACOBWRVNOK-UHFFFAOYSA-N 437.668 4.711 50 10 IJGE Brc1ccc(CN2C[C@H]3CC[C@H]2[C@H](Br)C3)c(Br)c1 2325465224 FZTHLBKCHHDIIS-FZZIBODNSA-N 438.001 4.959 50 10 IJGE CC(C)N(C[C@H]1CCCN(C[C@]2(CBr)CC2(F)F)C1)C(=O)OC(C)(C)C 2351889117 OPPOJEBHYZAMHU-MAUKXSAKSA-N 439.385 4.764 50 10 IJGE O=C(Cc1ccc(C(F)(F)F)cc1)N[C@H](CCBr)COCc1ccccc1 2369430578 FSQVZYRWFHNABA-GOSISDBHSA-N 444.291 4.735 50 10 IJGE COc1ccccc1C(=O)NNc1nc(-c2ccccc2)c2cc(Br)ccc2n1 1512573 ZLGCXSCWGFBIFZ-UHFFFAOYSA-N 449.308 4.825 50 10 IJGE COc1ccc(/C(C)=N\NC(=O)COc2ccc(C(C)C)cc2Br)c(OC)c1 33423038 UJFNYAZYUCJWMB-UCQKPKSFSA-N 449.345 4.509 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccncc2)ccc1OCc1ccc(Cl)cc1Cl 35362495 SFGXUOBBLGLUNT-ROTLSHHCSA-N 430.291 4.740 50 10 IJGE Cc1cc(Oc2cc(N3CCN(C(=O)C(C)(C)CCl)[C@@H](C)C3)ncn2)ccc1Cl 37356491 YNBLYGMZUZEBCR-HNNXBMFYSA-N 437.371 4.533 50 10 IJGE CCOc1ccccc1NC(=O)N/N=C/c1cccn1-c1ccc(Br)cc1 59248465 GDUDCXFOAYUBNY-HYARGMPZSA-N 427.302 4.794 50 10 IJGE Cc1c(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)c2ccccc2n1Cc1ccccc1Cl 59396272 JBSXUPSATMPARC-UMSHPIDHSA-N 433.939 4.854 50 10 IJGE COc1c(/N=C/c2ccccc2O)cccc1P(=O)(c1ccccc1)c1ccccc1 100290846 ZPUODFLYJBETPJ-ZXVVBBHZSA-N 427.440 4.791 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C3\C(=O)N([C@@H](C)CC)C(=O)C(C#N)=C3C)o2)cc1 214263940 ISWGCTDWMRYHAF-HYTQYMIGSA-N 432.476 4.514 50 10 IJGE C=CCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccc(C)cc3)c(OCC)c2)C1=O 214356396 YBKHYWTURJJCRB-HMAPJEAMSA-N 442.515 4.751 50 10 IJGE CC[C@@H](Br)CCNC(=O)c1cc(Br)sc1Br 233853338 IRXUNVGRNPZMGZ-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE COc1ccccc1OCC(=O)NN=Cc1c(C)n(Cc2ccccc2)c2ccccc12 254415057 LNPBZPMZIFTQLV-UHFFFAOYSA-N 427.504 4.536 50 10 IJGE Cl[C@H](c1cc(I)cc2c1OCC2)c1occc1Br 696514271 QCHFSCMOFZUEHU-LLVKDONJSA-N 439.474 4.910 50 10 IJGE Clc1cc(Br)c(OCCOC[C@H]2CCCO2)c(CBr)c1 708055353 CYOJLCXJTLEPRR-GFCCVEGCSA-N 428.548 4.572 50 10 IJGE Cc1ccc([C@H](C)CNC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1 739049905 SAZWDBFLXHIZAU-LJQANCHMSA-N 438.531 4.958 50 10 IJGE CCc1nn(-c2ccc(C)cc2)c2c1[C@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865702010 KPJAIHSIPNLXDJ-HSZRJFAPSA-N 427.552 4.808 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1cccc(F)c1 1865702618 CCOAQWBYLOGASR-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE COc1cc(/C=C(\C#N)c2nc(-c3ccc4c(c3)OCCO4)cs2)cc(OC)c1OC 1872791961 ZKENOPSJHFIDSF-LZYBPNLTSA-N 436.489 4.671 50 10 IJGE C[C@@H](c1cc(Br)ccc1F)[C@@H](CBr)NC(=O)OC(C)(C)C 1885098290 XMVBMBNWKYPSIK-TVQRCGJNSA-N 425.136 4.980 50 10 IJGE C[C@H]1CCN(Cc2ccc(Br)cc2Br)[C@H]1CBr 1943842651 HEUUQVJRRTUGCM-ZANVPECISA-N 425.990 4.817 50 10 IJGE O=C(N[C@@H]1CCC[C@@H](Br)C1)c1csc(Br)c1Br 1945187603 YLLPZNNQOMLIRX-RNFRBKRXSA-N 446.002 4.709 50 10 IJGE O=C(c1csc(Br)c1Br)N(CCBr)CC1CC1 1945188723 AJTXZHGSKIKTKL-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE C[C@@H](CCCCBr)NCc1ccc(I)c(Cl)c1 2026564621 VHLUADZIYUOIGF-JTQLQIEISA-N 430.555 4.988 50 10 IJGE Brc1ccc(CN2C[C@H]3C[C@H]2CC[C@@H]3Br)c(Br)c1 2031403835 UFODGMVPZLGSTP-RTXFEEFZSA-N 438.001 4.959 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]2(C[C@@]2(CBr)C(F)(F)F)C[C@@]12CCCOC2 2083265411 XUKBARQHWQQHPY-XHSDSOJGSA-N 428.289 4.510 50 10 IJGE ClCCc1nc2ccc(Br)cc2n1[C@@]12C[C@H]1CN(Cc1ccccc1)C2 2099679083 NRDZSEVNBIMTLU-HRAATJIYSA-N 430.777 4.811 50 10 IJGE CON(CC1(CBr)CCCCCC1)C1CCN(C(=O)OC(C)(C)C)CC1 2115847769 NOTLMWAUDGBIAY-UHFFFAOYSA-N 433.431 4.985 50 10 IJGE Cc1cc(C(=O)N[C@H](CCBr)C(C)(C)C)ccc1I 2142106341 JIPCWCZIKQCKOW-CYBMUJFWSA-N 438.147 4.529 50 10 IJGE O=C(NC[C@@]12CCC[C@]1(CCl)C2)c1cc(Br)sc1Br 2142941674 XKAYSWDOUZHAGE-OLZOCXBDSA-N 427.589 4.802 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@@]12C[C@H]1CN(Cc1ccccc1)C2 2155872533 JWIKGTZHSLESFV-HRAATJIYSA-N 445.792 4.515 50 10 IJGE CN(C[C@@H]1CCCN(Cc2ccccc2)C1)c1cc([N+](=O)[O-])ccc1CBr 2176906247 HZQBXYPLICJHLA-SFHVURJKSA-N 432.362 4.838 50 10 IJGE COc1ccc([C@H](Br)CC[C@@H]2CCCO2)cc1I 2257370142 ZSGYEXSEWSJUMQ-NWDGAFQWSA-N 425.104 4.695 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1Cc1ccc(Cl)c(I)c1 2300238555 MFQBZVNXNGOEAH-GWCFXTLKSA-N 428.539 4.692 50 10 IJGE C[C@H]1C[C@H]1N(CCBr)Cc1ccc(Cl)c(I)c1 2300242106 GTRIWODMGLMVDC-TVQRCGJNSA-N 428.539 4.550 50 10 IJGE CC(C)[C@@H](CBr)N(C)C(=O)c1csc(Br)c1Br 2302551707 QRSIFORWVVMESY-MRVPVSSYSA-N 448.018 4.765 50 10 IJGE CCOc1c(Br)cc(C=NNC(=O)c2ccc(C)cc2)cc1Br 2323076135 XPRLOKRIEFXFRV-UHFFFAOYSA-N 440.135 4.683 50 10 IJGE CCOc1ccc(NC=C(C#N)C(=O)Nc2ccc(Br)cc2)cc1OCC 2324055459 XBQQVSLECBGPJL-UHFFFAOYSA-N 430.302 4.705 50 10 IJGE COC(=O)c1ccc(CNC=C(C#N)C(=O)Nc2ccccc2Sc2ccccc2)cc1 2325339717 SUBDFLQYRAWLTR-UHFFFAOYSA-N 443.528 4.760 50 10 IJGE CC1(C)CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)C[C@@]2(C)C2CC2)C1 2345019786 VTUQNZPXGXBLIF-FQEVSTJZSA-N 429.443 4.909 50 10 IJGE FC(F)(F)[C@]1(CCl)CCN(Cc2ccc(Cl)c(I)c2)C1 2362378239 HBNLLENVLINSEU-LBPRGKRZSA-N 438.058 4.938 50 10 IJGE Cc1scc(C(=O)N2CCC[C@H](Br)[C@H]2C(F)(F)F)c1Br 2370255050 QNFVQTGDDINLIG-WPRPVWTQSA-N 435.103 4.749 50 10 IJGE Cc1c(/C=C(\C#N)c2nnc3n2CCCCC3)c2ccccn2c1C(=O)c1ccc(F)cc1 9597173 ZCEDZHSPGITWIL-XDJHFCHBSA-N 439.494 5.000 50 10 IJGE COc1ccc(OC)c([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc(Cl)c(Cl)c4)c32)c1 10013817 JKTPOKNQTOIGLR-QGZVFWFLSA-N 443.290 4.619 50 10 IJGE CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3cccc(C)c3)ccc21 38650428 RCPXBYLQKDJCBB-DEOSSOPVSA-N 426.472 4.831 50 10 IJGE COc1ccc(NC(=S)NNC(=O)c2ccc(-c3cc(Cl)ccc3Cl)o2)cc1 39892590 OHAHYZCCQARFJG-UHFFFAOYSA-N 436.320 4.893 50 10 IJGE CCOc1c(Br)cc(/C=N/NC(=O)COc2cccc(C(C)C)c2)cc1OC 40888807 OOSWEVHHDVKHDO-FSJBWODESA-N 449.345 4.509 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CCCC[C@@H]1CBr 161194771 FIFGZLPUMLVLDJ-SNVBAGLBSA-N 439.973 4.601 50 10 IJGE CCOc1c(Cl)cc(/C=N\NC(=O)Cc2cc(Cl)ccc2SC)cc1OC 169922837 FUJIDXZASLYUMP-JJFYIABZSA-N 427.353 4.815 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C\NCc1ccccc1Br)C12CC3CC(CC(C3)C1)C2 217058545 VXKSNTFHYSBZDG-UDPGWIFPSA-N 442.401 4.667 50 10 IJGE O=C(N[C@H]1CCC[C@@H]1CBr)c1ccc(Br)cc1Br 231558824 PTRCBDTUAAFXJM-PELKAZGASA-N 439.973 4.505 50 10 IJGE Cc1ccc(NC(=O)CCC(=O)NN=Cc2cccc(OCc3ccccc3)c2)c(C)c1 257354658 ZBXXSYQWANSXGP-UHFFFAOYSA-N 429.520 4.751 50 10 IJGE C[C@@]1(c2ccc(I)cc2)CCC[C@H](CI)O1 394499458 ORRGXQHZERSXDM-OLZOCXBDSA-N 442.078 4.511 50 10 IJGE O=C(NC1(CCCl)CCSCC1)c1cc(Br)sc1Br 719721517 YGYLOXYASMVBSD-UHFFFAOYSA-N 447.645 4.898 50 10 IJGE Cc1ncsc1COC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 776381773 BWUFPVPYBWMKKG-SXGWCWSVSA-N 437.912 4.532 50 10 IJGE Cc1ccc(C)c(NC(=O)CCC(=O)NN=Cc2ccc(OCc3ccccc3)cc2)c1 1084051146 SHLJATGOOGAXEM-UHFFFAOYSA-N 429.520 4.751 50 10 IJGE CCOc1cc(C(=O)NN=Cc2ccc(Cl)c(Cl)c2)cc(OCC)c1OCC 1084101153 RWYOIHZZHHKBIC-UHFFFAOYSA-N 425.312 4.953 50 10 IJGE O=C(NN=Cc1ccc(Oc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1)c1ccncc1 1084247895 WMRGYTZNLKXPJI-UHFFFAOYSA-N 430.342 4.565 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2ccc(Cl)c(Br)c2)cc1)C1CC1 1466733378 YAFFHVLZIYARPP-UHFFFAOYSA-N 437.725 4.766 50 10 IJGE CCCOc1ccc(CC(=O)NNc2nc3ccccc3[nH]c2=S)cc1OCCC 1470319516 LBRUJQVTGGKMRL-UHFFFAOYSA-N 426.542 4.556 50 10 IJGE Cc1cc(OC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccncc2)CCC3)ccc1Cl 1772745899 NNTNAFISXVTXTN-UHFFFAOYSA-N 437.883 4.634 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccn2)[C@H]1c1ccccc1Cl 1865686456 WDWYUYVLEAXFEH-FQEVSTJZSA-N 425.879 4.806 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCN(C(=O)OC(C)(C)C)C2(CCC2)C1 1882567126 PBGAZOHXZWGXSQ-LSDHHAIUSA-N 447.414 4.844 50 10 IJGE O=S(=O)(c1ccc(Br)cc1)N(Cc1ccccc1)[C@@H](CCl)C1CC1 1915218068 WRIJJPWRLOHYFW-SFHVURJKSA-N 428.779 4.657 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)C(C)(C)CBr)c(OC)c1OC 1915765536 LQJIDSFAPLLSBN-UHFFFAOYSA-N 436.346 4.528 50 10 IJGE Brc1cccc(CNCCCCI)c1Br 1929579951 JBSXQZFCSBVZJA-UHFFFAOYSA-N 446.952 4.516 50 10 IJGE C[C@@H]1OCCO[C@@H]1[C@@H](Br)c1cc(Br)c(Br)s1 1935559738 RZCGAFWUBMKJAJ-HQLVHBAOSA-N 434.975 4.513 50 10 IJGE C[C@@]12CN(Cc3cc(Cl)ccc3I)C[C@]1(CBr)C2 2046801304 GPOQZZYHUMDTJE-ZIAGYGMSSA-N 440.550 4.552 50 10 IJGE Cc1c([C@H](Br)Cc2ccc(Br)cc2)nn(C)c1Br 2049255489 JMIXQRJXEDYZEL-LLVKDONJSA-N 436.973 4.932 50 10 IJGE ClC1CC2(C1)CC(CNc1ncc(I)cc1Br)C2 2069537665 MLGGQYIVNCLASC-UHFFFAOYSA-N 441.538 4.658 50 10 IJGE BrC[C@H]1CCN(Cc2cc(Br)ccc2Br)C12CC2 2070147285 RRBOSISRAYXKPC-LLVKDONJSA-N 438.001 4.961 50 10 IJGE CC(C)[C@H](CBr)CN1CC[C@H](C(F)(F)F)C[C@@H]1CNC(=O)OC(C)(C)C 2107584931 NYTWBLDNRSSMGB-QLFBSQMISA-N 445.364 4.821 50 10 IJGE C[C@H]1[C@H](C(F)(F)F)N(CC2(CBr)CCCC2)CCN1C(=O)OC(C)(C)C 2115980182 OUGWGLYDARNRRE-UONOGXRCSA-N 443.348 4.814 50 10 IJGE O=C(NCC[C@@H]1CN(CC2(CBr)CCCC2)c2ccccc21)C(F)(F)F 2163061953 JFDGNGKNFQUXQU-CQSZACIVSA-N 433.312 4.614 50 10 IJGE ClCCOCC1CCN(Cc2c(Br)cccc2Br)CC1 2167401658 KPNFHRAYFVFMIS-UHFFFAOYSA-N 425.592 4.679 50 10 IJGE Cc1c(Cl)cc(CN2CCC[C@H](OCCBr)C2)cc1Br 2170212892 DQGALXCFUFGYSP-ZDUSSCGKSA-N 425.592 4.787 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CC[S@@](=O)(=NCCCCCCBr)C1(C)C 2223292811 ZYVMCAHRJFOJPC-BZQUYTCOSA-N 439.460 4.733 50 10 IJGE Cc1ccc(I)c([C@@H](Br)c2ccc3nc(O)oc3c2)c1 2241002168 TYWAYORHLJXCTJ-AWEZNQCLSA-N 444.066 4.931 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC[C@](C)(CI)O2)C[C@@H]2CCCC[C@H]21 2246604630 ZETSDKIUZBWJGK-SFUIVIKGSA-N 449.373 4.929 50 10 IJGE Cc1cccc(-n2c(C)cc(C=C(C#N)C(=O)N3CCN(c4ccccc4)CC3)c2C)c1C 2294175277 RALDFEOZBNDJEG-UHFFFAOYSA-N 438.575 4.967 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@@H]2CCCC[C@H]3C[C@H]32)CC1 2302876315 RWRYBCLCFKEFCP-ARFHVFGLSA-N 449.373 4.786 50 10 IJGE CCCCN(CCCl)Cc1ccc(I)c(Br)c1 2306221164 FCNHMABOXWHEKA-UHFFFAOYSA-N 430.555 4.895 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Br)C1[C@H]2COC[C@H]12 2317420281 NBKGETAOAXXVAW-HFJPGXAFSA-N 442.948 4.988 50 10 IJGE C[C@@H](NC(=O)C(C#N)=CNc1ccc(Br)cc1)C12CC3CC(CC(C3)C1)C2 2324895276 QQWDLEVBDRKKOI-XSXQVXRUSA-N 428.374 4.990 50 10 IJGE CC(C)(CI)COc1c(Cl)cc(Br)cc1[N+](=O)[O-] 2326704124 JBMORKNFVBCGEA-UHFFFAOYSA-N 448.482 4.851 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H](Br)CC2(CC2)C1 2327406403 TUDZSDUFXOYNLJ-LLVKDONJSA-N 440.550 4.694 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)CCc3nc4ccccc4[nH]c3=O)n2)cc1C 2331259882 NQNKGBGLKPGGEN-UHFFFAOYSA-N 444.516 4.789 50 10 IJGE FC(F)(CBr)C(F)(F)CNCc1cc(Cl)ccc1Br 2336534264 NBCQRUWCOPEBIA-UHFFFAOYSA-N 427.461 4.858 50 10 IJGE Cc1ccc(-c2n[nH]c(=S)n2CCC(=O)NN=C(c2ccccc2)c2ccccc2)cc1 10130314 CRWXDHBYHUDQNF-UHFFFAOYSA-N 441.560 4.875 50 10 IJGE Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=C(/C#N)c2nn(-c3ccccc3)c(N)c2C#N)o1 33411125 WBNHGCSVKGEIHA-WJDWOHSUSA-N 436.431 4.867 50 10 IJGE Nc1c(NNC(=O)c2ccccc2Cl)ncnc1NN(c1ccccc1)c1ccccc1 40777852 ZDXAPRXHOUJZRO-UHFFFAOYSA-N 445.914 4.634 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NC(C)C)ccc1OC(=O)/C=C/c1ccc(C(C)C)cc1 40884559 GTSPNMLJSXMCGN-CAAGMPDOSA-N 432.520 4.869 50 10 IJGE O=C(COc1ccccc1Br)N/N=C/c1ccc(OCc2ccccc2)cc1 40910588 XFRIOGQKKOTJBW-ZVHZXABRSA-N 439.309 4.557 50 10 IJGE Cc1ccc(C)c(OCCCC(C)(C)C(=O)NNC(=O)[C@H](C)Oc2ccc(C)c(C)c2)c1 66201487 ZZYLXHQEGXLHCP-NRFANRHFSA-N 440.584 4.720 50 10 IJGE CC1=C(C#N)C(=O)N(C2CCCC2)C(=O)/C1=C/c1ccc(OCc2ccccc2F)cc1 101338790 GRGCANSDNQRDKH-HYARGMPZSA-N 430.479 4.940 50 10 IJGE O=C1Cc2cc([C@H](Br)c3coc(Br)c3)c(Br)cc2N1 393532831 CWIVOSLAOOYOLG-CYBMUJFWSA-N 449.924 4.784 50 10 IJGE C[C@@H](Br)C[C@@H](C)CNC(=O)c1ccc(Br)cc1Br 397836224 MQHFWAJVGLRWES-RKDXNWHRSA-N 441.989 4.751 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2CC[C@]3(CCC[C@H](CI)O3)[C@H]1C2 721763089 SNUUCJRAYQEFJU-ATNYBXOESA-N 435.346 4.539 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2ccc(-c3nc[nH]n3)cc2)c(C)n1-c1ccc(F)cc1 732158950 AQKPWDMSYKHUGN-XDHOZWIPSA-N 426.455 4.564 50 10 IJGE COc1ccccc1Nc1nc2sc(C(=O)NNc3cc(Cl)ccn3)cc2s1 778453396 VTUAXBWPNUYOQL-UHFFFAOYSA-N 431.930 4.915 50 10 IJGE CC(C)COc1cn(-c2ccccc2)nc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799750841 LFXCNZDCYMGBER-UHFFFAOYSA-N 443.429 4.554 50 10 IJGE CCCc1c(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cnn1Cc1ccccc1 799753134 PDVDYMOSYHADIQ-UHFFFAOYSA-N 427.430 4.531 50 10 IJGE CN(Cc1ccccc1F)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 818032033 HUSDXVBLLHXDMV-CPNJWEJPSA-N 447.901 4.822 50 10 IJGE COc1cc(C=NNC(=O)COc2ccc(Cl)cc2)ccc1OCc1ccc(F)cc1 1084187028 HWLUBJMHUOGXJM-UHFFFAOYSA-N 442.874 4.596 50 10 IJGE C#CCOc1ccc(C=NNC(=O)c2cc3cc(Br)ccc3o2)cc1CC=C 1084613153 NCFBVVKJWACBOL-UHFFFAOYSA-N 437.293 4.700 50 10 IJGE CC(=O)C(C)(C)CCC(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 1463701262 ROHWBQARACLHKX-UHFFFAOYSA-N 432.973 4.789 50 10 IJGE Cc1cccc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)c1[N+](=O)[O-] 1614629146 GMTXNCUQXMYLNV-FUHWJXTLSA-N 433.302 4.650 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1csc(Cc2ccc(Cl)cc2)n1 1640943608 VZKCBNUYRNEXGY-UHFFFAOYSA-N 427.942 4.750 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2F)[C@@H]1c1ccc(Cl)cc1 1865683519 LQDSJJDSSJVMSW-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE COc1ccc(-c2nn(Cc3ccccc3)c3c2[C@H](c2cccs2)C(C#N)=C(N)O3)cc1 1865698242 OCQXLLNRMWXASA-NRFANRHFSA-N 440.528 4.887 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCC(C)(C)N(C(=O)OC(C)(C)C)C1 1880762846 YYZUIHNZJKQFMN-UONOGXRCSA-N 435.403 4.700 50 10 IJGE CN(C)CC(C)(C)CO[C@@H](CI)c1cccc(Br)c1 1899009845 INOHYXPXUAQBPI-AWEZNQCLSA-N 440.163 4.530 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC2(CCC2)[C@]12CC[C@](C)(CI)O2 1924954453 GHVJZAHGBTXEDV-YJLNNSPDSA-N 449.373 4.834 50 10 IJGE Cc1ccc(Br)cc1CNCCSSCCNC(=O)OC(C)(C)C 2010829571 XWUSURLQUQKSEX-UHFFFAOYSA-N 435.453 4.753 50 10 IJGE CN(Cc1c(Br)cccc1Br)C1CC(CBr)C1 2018086393 CEWCKFMGSOQRRH-UHFFFAOYSA-N 425.990 4.817 50 10 IJGE CC(C)(C)[C@@H](CBr)CN1CC=CCC12CN(C(=O)OCc1ccccc1)C2 2026495273 RVFPWRJVVSTQRC-IBGZPJMESA-N 435.406 4.697 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CC[C@H](CBr)C(F)(F)C1 2038683871 KPGXGDZZNVJXIK-CQSZACIVSA-N 430.314 4.819 50 10 IJGE FC(F)Oc1cc(CBr)cc(I)c1OC(F)(F)F 2060220573 YQKGMRCOWUMUTI-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE Brc1cccc(CN2CC[C@H](Br)[C@@H]3CC[C@@H]32)c1Br 2069997352 SUBTVUVWIDRIJW-GVXVVHGQSA-N 438.001 4.959 50 10 IJGE CCN1CCC[C@@H]([C@@H](Br)c2ccccc2OCc2ccccc2)S1(=O)=O 2089514389 KQJWGZRUZBDRNK-PMACEKPBSA-N 438.387 4.516 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Br)c2ccc(F)cc2Br)c1 2093074681 OOLDDMJHNCXNIO-LBPRGKRZSA-N 428.142 4.538 50 10 IJGE CO[C@H]1C[C@H](CNC(=O)OC(C)(C)C)N(CCCCCCCCCBr)C1 2106787616 JIMPOULOHNBECE-MSOLQXFVSA-N 435.447 4.726 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CC[C@@H]1CN(CC1(CBr)CCCCCC1)C2 2136690952 FTHDTAXNCUEGDP-DYESRHJHSA-N 429.443 4.959 50 10 IJGE O=C(N[C@H]1C[C@H]2CC[C@H]1[C@H](Cl)C2)c1cc(Br)sc1Br 2139718511 IZMLLGPRBABDSL-MFDQJXRNSA-N 427.589 4.799 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1CCc1nccn1Cc1ccccc1 2151788579 JEPHQHSAXXQEJO-AWEZNQCLSA-N 444.764 4.981 50 10 IJGE Clc1ccc(C(CBr)(CBr)C[C@H]2COCCCO2)cc1 2154016234 YWLOZPLFRQQRJD-AWEZNQCLSA-N 426.576 4.563 50 10 IJGE CC(C)(C)OC(=O)Nc1cc(F)cc(CNC(=O)c2ccc(CBr)cc2)c1 2162485946 GIALOUJNJURJET-UHFFFAOYSA-N 437.309 4.998 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]2CC[C@H](C1)N2C[C@@H](CBr)c1ccccc1 2163058843 OCYAALMBQCSBHF-AFYVEPGGSA-N 437.422 4.933 50 10 IJGE Cc1ccc(I)c([C@@H](Br)c2ccc3c(c2)CC(=O)N3)c1 2241000320 GXQNQCYMTFGWNA-INIZCTEOSA-N 442.094 4.579 50 10 IJGE CN[C@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@@H]1Br 2250747370 LFVFLXPKQJPXLK-ANYMCVJYSA-N 433.916 4.534 50 10 IJGE CC1(C)[C@H](CBr)CCN1C(=O)c1cc(F)c(Br)cc1Cl 2282967437 OTRWBPRIERFPOI-QMMMGPOBSA-N 427.539 4.877 50 10 IJGE Clc1ccc(CN2CC[C@H](CCBr)C2)cc1I 2300238837 PUACTRMEZIQLDX-JTQLQIEISA-N 428.539 4.552 50 10 IJGE CC[C@H](C)N(CCBr)Cc1ccc(Cl)cc1I 2302315443 JIHMSYGORDPRKE-JTQLQIEISA-N 430.555 4.940 50 10 IJGE ClCC[C@H]1CCN(Cc2ccc(I)c(Br)c2)C1 2306222429 UJRLVFLFBUQPGM-JTQLQIEISA-N 428.539 4.505 50 10 IJGE CCO[C@@H]1[C@H](Br)C[C@H]1Oc1cc(Cl)c(C)cc1I 2314953544 LQWIOVMCDQCOEB-BZHVJNSISA-N 445.522 4.573 50 10 IJGE COc1cccc(-c2ccc(C(=O)NN=Cc3ccc(Br)cc3F)c(C)n2)c1 2321240785 HCVVYDGHWXBATE-UHFFFAOYSA-N 442.288 4.731 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2Cl)cc([N+](=O)[O-])c1OCc1ccccc1 2323078654 IEOUHFPGDZNRLZ-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE COc1cc(NC=C(C#N)C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)c(OC)cc1Cl 2325118562 MLWIFTPHSSWOHK-HNNXBMFYSA-N 439.943 4.933 50 10 IJGE N#CC(=CN1CCN(Cc2ccccc2)CC1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 2325382882 VQUSWMVOKOTMDB-UHFFFAOYSA-N 448.876 4.523 50 10 IJGE FC(F)(F)c1cccc(CO[C@H](CCl)[C@H](I)CCl)c1 2353210946 OLTPSQLTNRCYJW-GHMZBOCLSA-N 427.031 4.872 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=S)NC(=O)CCC2CCCCC2)cc1 14029350 LUFRGUZSQGINDI-UHFFFAOYSA-N 433.618 4.642 50 10 IJGE CCCCOc1ccc(/C=C2/C(=O)N(Cc3ccc(F)cc3)C(=O)C(C#N)=C2C)cc1OC 38608699 ZVBGSHXYMOFOGQ-FYJGNVAPSA-N 448.494 4.806 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(C)c1/C=N/NC(=O)c1cc2ccccc2cc1O 59156356 CSTCSJAKAUVXPL-LGJNPRDNSA-N 432.911 4.824 50 10 IJGE C=CCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccccc3Cl)c(OC)c2)C1=O 101230882 WWXISDBOONKZCC-XDHOZWIPSA-N 448.906 4.706 50 10 IJGE CN(CC(=O)/C(C#N)=C1\NC(c2ccc(Br)cc2)=CS1)C1CCCCC1 102967846 IUTJHCQFMFFGSA-LVZFUZTISA-N 432.387 4.653 50 10 IJGE O=C(c1ccc([N+](=O)[O-])o1)[C@@H](Br)[C@H](Br)c1ccc(Cl)cc1 106866681 SCPVKHUTGFKSOJ-NEPJUHHUSA-N 437.471 4.924 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCC(CBr)CC1 232478202 FTORKJSQXMGXOJ-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE Cc1ccc(OCC(=O)NN=Cc2ccc(OC(=O)c3cccc4ccccc34)cc2)cc1 254533257 QBCQHMWOVNTVIY-UHFFFAOYSA-N 438.483 4.897 50 10 IJGE COc1ccccc1C=NNC(=O)CSc1nc2ccccc2n1Cc1ccc(C)cc1 254567782 ZPYKDZDPKMLAHS-UHFFFAOYSA-N 444.560 4.644 50 10 IJGE CCOc1ccc2ccccc2c1C=NNC(=O)CSc1nnc(-c2ccccc2)s1 256028527 SLONHLXTTROBAS-UHFFFAOYSA-N 448.573 4.999 50 10 IJGE Clc1ccc(I)c(C[C@]2(CBr)CCCOC2)c1 405541920 SSDNQLIANBGRSA-ZDUSSCGKSA-N 429.523 4.679 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccccc1[C@H]1CN(S(=O)(=O)c2ccccc2)CCN1 616604099 URFUHEMJYORAER-JOCHJYFZSA-N 446.689 4.544 50 10 IJGE Clc1ccc(C(CBr)(CBr)CCO[C@H]2CCOC2)cc1 724984217 HFQRFMZDDLBBTF-AWEZNQCLSA-N 426.576 4.563 50 10 IJGE COCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2ccc(-c3cccc(OC)c3)cc2)c1C 741992807 MKQSMJCHDAPWJK-MFKUBSTISA-N 443.547 4.650 50 10 IJGE CC(=NNC(=O)c1ccc(COc2ccccc2)o1)c1c(C)nn(-c2ccccc2)c1C 746489020 PKACFVZVEHMYTG-UHFFFAOYSA-N 428.492 4.815 50 10 IJGE O=C(NNc1ccc(Br)cc1F)c1cnc(-c2ccc(F)c(F)c2)s1 780658103 XSLNZJAYEGANDU-UHFFFAOYSA-N 428.233 4.747 50 10 IJGE O=C(NNc1ccc(Cl)nc1)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 784869925 SSNXAJXNINXMNO-UHFFFAOYSA-N 435.698 4.791 50 10 IJGE COc1cc(NNC(=O)Nc2cnn(-c3cccc(C(F)(F)F)c3)c2)ccc1Cl 788605867 RXXHYVVHDDUXLS-UHFFFAOYSA-N 425.798 4.702 50 10 IJGE CC(=O)CCc1ccc(O[C@H](C)C(=O)N2CCC[C@@H](O[Si](C)(C)C(C)(C)C)C2)cc1 1275314395 KRKBVWLBHPIFDW-DENIHFKCSA-N 433.665 4.988 50 10 IJGE CC(=O)CCc1ccc(O[C@@H](C)C(=O)NNc2ccc(Cl)cc2Br)cc1 1633950363 PKMPGCCOKIBUJX-ZDUSSCGKSA-N 439.737 4.535 50 10 IJGE C=C(CBr)CN(Cc1ccccc1)C[C@H](O)c1cccc(OC(F)F)c1 1654210591 PXROOXBPIQWRGE-IBGZPJMESA-N 426.301 4.775 50 10 IJGE CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1C 1669449847 CAARLPVSYXSXRG-UHFFFAOYSA-N 438.487 4.879 50 10 IJGE C=CCn1cc2ccc(NC(=O)NNC(=O)c3ccc(-c4ccc(F)cc4)s3)cc2n1 1680704305 QPUQSTCGOKFSAM-UHFFFAOYSA-N 435.484 4.556 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@H]2C)oc2c1C(=NNC(=O)c1ccccc1F)CCC2 1772744159 QYKIAARNTFHUIW-OAHLLOKOSA-N 445.494 4.789 50 10 IJGE Cc1cccc(C)c1NC(=O)COc1cccnc1NC(=O)Nc1ccc(SC#N)cc1 1858828605 VHQQYWWHBXUQHD-UHFFFAOYSA-N 447.520 4.933 50 10 IJGE CCC[C@H](NC(=O)[C@H](c1ccc(OC)cc1)C(C)C)C(=O)Nc1ccc(SC#N)cc1 1866981851 YZKHKPSNNKPEGN-VXKWHMMOSA-N 439.581 4.932 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC[C@@H]1CC[C@H]1C(C)(C)C 1902716555 UIPQDQRWHPXXDJ-IYOUNJFTSA-N 439.378 4.794 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)C(=O)Cc1ccc(Br)cc1F 1914227161 IXQWDNJUKYTLIU-ZDUSSCGKSA-N 443.154 4.943 50 10 IJGE CC(C)(CCl)N(Cc1ccccc1)C(=O)c1cc(I)ccc1O 1915788055 KMLNXIFLBFJPPD-UHFFFAOYSA-N 443.712 4.657 50 10 IJGE C[C@@H](Br)c1cn(-c2ccc(Cl)c(I)c2Cl)nn1 1945187746 BEFNLNKTTJMQMC-RXMQYKEDSA-N 446.901 4.635 50 10 IJGE O=S(=O)(c1ccc(Cl)c(CBr)c1)N(Cc1ccccc1)CC1CC1 2009621683 IVQFGHUDPVUOJH-UHFFFAOYSA-N 428.779 4.836 50 10 IJGE CC[C@H](Br)c1cn(Cc2cccc(Br)c2Br)nn1 2031481866 MJHNQNICADTXDA-VIFPVBQESA-N 437.961 4.697 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)C[C@@H]1CCC[C@H]1Br 2086653426 XYHYYJITNYKGFR-NWDGAFQWSA-N 442.566 4.940 50 10 IJGE Clc1cc(CN[C@@H](CBr)C2CCCC2)ccc1I 2086658073 KEZFJDVSPRPCGW-AWEZNQCLSA-N 442.566 4.988 50 10 IJGE O=S1(=O)CCC([C@@H](Br)c2cc(Cl)c(Br)cc2F)CC1 2089857373 LDOJIDDKDSRNRW-GFCCVEGCSA-N 434.552 4.502 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCCCCN(C[C@H](CBr)c2ccccc2)C1 2106784152 GOGAWZWGYQICLX-OALUTQOASA-N 425.411 4.934 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1cc(F)ccc1Br 2117896086 XRQWEMGWPCBSJJ-JTQLQIEISA-N 442.110 4.702 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@H]1CCCCN1C[C@H](CBr)C1CCC1 2128719418 FCLCXFSOVAOODS-JKSUJKDBSA-N 439.385 4.812 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@@H]1C2C[C@@H]3C1[C@@H]3C2 2134569787 JNXUHLJRJVSLGQ-ODCVKMHSSA-N 431.111 4.564 50 10 IJGE CC(C)[C@H]1CN(C(=O)OC(C)(C)C)CCCN1C(=O)c1ccc(CBr)cc1 2162870921 GTOXSEBJVMDZAY-GOSISDBHSA-N 439.394 4.689 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1C1CCN(C(=O)[C@H](Br)C2CCCC2)CC1 2167034463 RXMIDRKDPWJQSP-ZWKOTPCHSA-N 443.426 4.578 50 10 IJGE CP(C)(=O)CCCn1c(CCl)nc2cc(I)c(F)cc21 2177188347 WEFPNEUSVUMQNV-UHFFFAOYSA-N 428.613 4.532 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1ccc(Cl)c2cccnc12 2181746781 KBJGYACLIULCBR-UHFFFAOYSA-N 428.023 4.884 50 10 IJGE C[C@]1(CBr)CC(F)(F)CN1C(=O)c1scc(Br)c1Cl 2264515708 SZSLJTFQGIEXRN-SNVBAGLBSA-N 437.531 4.799 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2C[C@H]1CCN1Cc1ccccc1 2270567009 YDAOLTPPQNNDOH-OAHLLOKOSA-N 434.765 4.821 50 10 IJGE O=C(NC[C@H]1CCC[C@H](CCl)C1)c1ccc(Cl)c(I)c1 2283658619 XQNTVXYTLFUEPG-QWRGUYRKSA-N 426.125 4.720 50 10 IJGE O=C(N[C@H]1C[C@H]2C[C@H]1C[C@@H]2Br)c1cc(Br)c(F)cc1Cl 2285846738 RNXRPZWAXXDHIE-ICKFKABQSA-N 425.523 4.533 50 10 IJGE CCOc1cccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3cccc(C(=O)O)c3)c2C)c1 2293188515 VCIITSXRFYNLJR-UHFFFAOYSA-N 429.476 4.737 50 10 IJGE COC(=O)c1cc(OC)c(OC)cc1NC=C(C#N)c1nc(-c2ccc(C)cc2)cs1 2295934414 TYFQMPGBHAFBQZ-UHFFFAOYSA-N 435.505 4.899 50 10 IJGE N#CC(=Cc1c[nH]c2ccc(OCc3ccccc3)cc12)C(=O)Nc1ccc(C(=O)O)cc1 2296964426 VOGDKLMWGQWLPS-UHFFFAOYSA-N 437.455 4.991 50 10 IJGE CC(C)c1cccc(CO[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2I)c1 2303761754 GXXWBWKMBGIANK-IAGOWNOFSA-N 445.341 4.750 50 10 IJGE CC[C@H]1[C@@H](Cl)CCN1Cc1ccc(I)c(Br)c1 2306232754 YKJIOVLGCGTUKW-AAEUAGOBSA-N 428.539 4.645 50 10 IJGE Clc1ccc(CC[C@@H](Br)CN2CCCC2)cc1I 2315550004 YKOIEQIHHDPECF-GFCCVEGCSA-N 442.566 4.737 50 10 IJGE C[C@H]1C[C@@H](CBr)CN(Cc2ccc(Cl)cc2I)C1 2318540165 QKHGSNJYESXTBR-QWRGUYRKSA-N 442.566 4.798 50 10 IJGE Brc1ccc([C@@H](CI)OC[C@H]2O[C@H]3CC[C@H]2C3)cc1 2352572417 GEZZTYTXNBMFAY-SPWCGHHHSA-N 437.115 4.509 50 10 IJGE BrCc1ccc(N2C[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)cc1C1CC1 2364567958 HUKKGLSCIPLMKD-GOTSBHOMSA-N 427.386 4.549 50 10 IJGE Cc1cccc(OCC(=O)NN=Cc2ccc(OC(=O)c3ccccc3Cl)cc2)c1C 9196039 SZWZWACMASPJLK-UHFFFAOYSA-N 436.895 4.705 50 10 IJGE Cc1ccc(C)c(NC(=O)CCC(=O)N/N=C/c2cccc(OCc3ccccc3)c2)c1 12577288 QIKZNQPJGIMJHW-WPWMEQJKSA-N 429.520 4.751 50 10 IJGE C[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)COc1ccc2ccccc2c1 14038587 YPNSTQYMZGRRPZ-LJQANCHMSA-N 440.499 4.501 50 10 IJGE Cc1ccc(OCCOc2ccccc2/C=C(/C#N)C(=O)NCc2ccccc2)cc1C 33602994 PKTLZLWWFZUFFU-ULJHMMPZSA-N 426.516 4.985 50 10 IJGE Cc1c(C(=O)Oc2cccc3cccnc23)oc2c1/C(=N/NC(=O)c1ccccc1)CCC2 40804292 QIGFDNMOMZIAAJ-TURZUDJPSA-N 439.471 4.826 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccc([N+](=O)[O-])c2)CCC3)cc1 40813060 WPQCTEMZWJPIJR-LGUFXXKBSA-N 446.463 4.527 50 10 IJGE COc1ccc([C@@H](Br)c2csc(I)c2)cc1F 123463385 LOCKBRVJWAJWEY-GFCCVEGCSA-N 427.076 4.985 50 10 IJGE Cc1c(Cl)cccc1NC(=O)/C(C#N)=C\Nc1ccc(I)cc1 217094874 FSILQAFGBRZSDO-BENRWUELSA-N 437.668 4.711 50 10 IJGE COc1cccc(C=NNC(=O)c2cccc([N+](=O)[O-])c2)c1OCc1cccc(Cl)c1 252639047 YHZJZJZURXFDIN-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE C[C@H]1C[C@H](O[C@H](CI)c2ccccc2Br)C[C@@H](C)O1 253137110 TWLLMFGTHBPAND-NWJSVONSSA-N 439.131 4.898 50 10 IJGE Cc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)c2c(C)nc3cc(C)ccn23)cc1 254699736 WTJJZBGMMRUVKF-UHFFFAOYSA-N 448.530 4.876 50 10 IJGE C[C@@H](CCCCBr)NC(=O)c1cc(Br)c(Br)s1 398449332 SVEIYNJRLSZCPW-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE Clc1cc(CBr)ccc1N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21 404143980 GZPMCDLQORLUCV-LEWJYISDSA-N 435.793 4.715 50 10 IJGE ClCc1ccc(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@H]32)cc1Br 404208343 VJRBOZYRWCJAGY-RTWAWAEBSA-N 435.793 4.668 50 10 IJGE BrCc1cc(Br)cc(Br)c1O[C@H]1CCSC1 405384893 KPRJUKDNSAJTPY-VIFPVBQESA-N 430.987 4.991 50 10 IJGE FC(F)(F)c1c(Br)cc(I)cc1CBr 575696807 XESPFJVBWFWIRX-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE O=C(CSc1nnc(-c2ccco2)n1C1CCCCC1)NNc1ccc(F)cc1F 767964324 SQSUZWTZGQHPHB-UHFFFAOYSA-N 433.484 4.557 50 10 IJGE CN(CCCCc1ccccc1)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 918618934 GVKNILYSHBNPBL-CLCOLTQESA-N 437.547 4.852 50 10 IJGE O=C(NN=C1C(=O)N(Cc2c(Cl)cccc2Cl)c2ccccc21)c1cccs1 1084351147 APVQAYMWZVMTHD-UHFFFAOYSA-N 430.316 4.736 50 10 IJGE CCc1nn(-c2ccc(Cl)cc2)c2c1[C@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689344 QBGSGWAULCZUIT-GOSISDBHSA-N 427.291 4.665 50 10 IJGE CC(C)(C)OC(=O)N1CCCN(C[C@@H](CBr)c2ccccc2)C(C)(C)C1 1879295848 KQXSGTKYJIQAMA-GOSISDBHSA-N 425.411 4.887 50 10 IJGE C[C@@H]1[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 1882087939 NGMLOKVVBLHXRC-IBEHDNSVSA-N 447.414 4.699 50 10 IJGE CCOc1c(C(=O)N(Cc2ccccc2)C[C@@H](Br)CC)cccc1[N+](=O)[O-] 1915098192 DAMABOWJXKXCME-INIZCTEOSA-N 435.318 4.809 50 10 IJGE C[C@@H](CCCBr)CNC(=O)c1csc(Br)c1Br 1945190525 ONRHDENLLYISKM-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE C[C@@H]1CN(Cc2c(Br)cccc2Br)CC[C@@H]1Br 1945333217 MYHHRYYXLMLRDI-KOLCDFICSA-N 425.990 4.817 50 10 IJGE CCN(C[C@@](C)(CI)O[C@H]1CC[C@H]2C[C@@H]1C2)C(=O)OC(C)(C)C 1992237252 GECLQWOQRQVTTH-JTOWHCCKSA-N 437.362 4.642 50 10 IJGE C[C@H]1CCN(Cc2cc(Br)ccc2Br)C[C@@H]1Br 2006503571 PUWZRSLUMJVFPO-ZANVPECISA-N 425.990 4.817 50 10 IJGE Cc1sc(Br)c([C@H](Cl)c2cnn(C)c2I)c1C 2024020947 PIGOHZDPUKXMSM-SECBINFHSA-N 445.551 4.794 50 10 IJGE Cc1ccc(CO[C@@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)cc1 2024641618 CESKBFRXMCDHJT-LJQANCHMSA-N 445.341 4.716 50 10 IJGE O=C(NCCCCCCBr)c1c(Br)cccc1Br 2033092850 DITMZVFVGWMZIG-UHFFFAOYSA-N 441.989 4.897 50 10 IJGE O=C(N[C@H]1CCC[C@H]1CBr)c1c(Br)cccc1Br 2033096907 ZRADXYIKRYGNJS-KWQFWETISA-N 439.973 4.505 50 10 IJGE C[C@@H]1C[C@H](Br)CCN(Cc2cc(Cl)ccc2I)C1 2041568470 XWJOWIMJPPXAKK-ZYHUDNBSSA-N 442.566 4.940 50 10 IJGE CC[C@H](Br)CN(CC)C(=O)c1ccc(Br)cc1Br 2044551466 URVDEAULRNXHHP-VIFPVBQESA-N 441.989 4.847 50 10 IJGE CC(C)[C@H](Br)c1cn(-c2cc(I)ccc2Cl)nn1 2057430355 ZNCQZSCEUCRYRT-LBPRGKRZSA-N 440.510 4.617 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Cl)c1cn(C)c(Br)n1 2138243461 UMMBUAQPYJALTN-JTQLQIEISA-N 428.939 4.935 50 10 IJGE CN(CC[C@H]1CCCCN1C(=O)c1ccc(CBr)cc1)C(=O)OC(C)(C)C 2162916887 WCWAYGUAUDOONW-GOSISDBHSA-N 439.394 4.833 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CCN(C[C@@H](CBr)c3ccccc3)C2)C1 2163061714 HSTNLNNSLWXTQV-DENIHFKCSA-N 437.422 4.888 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CCCN2C[C@H](CBr)c2ccccc2)C1 2163062146 JYNWFMNDOZVIPK-HSALFYBXSA-N 437.422 4.887 50 10 IJGE CC1(C)CCC(S(=O)(=O)N(Cc2ccccc2)[C@@H](CBr)C2CC2)CC1 2223526119 WUQMRQHCDAHHAQ-IBGZPJMESA-N 428.436 4.961 50 10 IJGE Cc1cc(Cl)cc(C(=O)N(C)C[C@H]2C[C@@H]2Br)c1NC(=O)OC(C)(C)C 2223980526 DJNZTLUDLLMTAW-RISCZKNCSA-N 431.758 4.851 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1[C@H]2CC[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C2 2241742118 VSTCTWNVWWBEOZ-CWVYHPPDSA-N 447.414 4.604 50 10 IJGE CC1CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]2C(F)(F)F)C1 2265307681 JHXYSBWUZZVTIN-DLOXAQCQSA-N 443.348 4.670 50 10 IJGE O=C(c1ccncc1C(F)(F)F)N(Cc1ccccc1)[C@H](CBr)C1CC1 2265497274 DHCBPQHCLAEOMS-QGZVFWFLSA-N 427.264 4.916 50 10 IJGE CCOc1c(I)cc(C=C(C#N)c2nc3ccccc3[nH]2)cc1OC 2295157395 YJFNTXAFCGXTGR-UHFFFAOYSA-N 445.260 4.639 50 10 IJGE C[C@H](CCCBr)CNCc1ccc(Cl)c(I)c1 2300238421 KQYYDQYRSYGDTF-SNVBAGLBSA-N 430.555 4.845 50 10 IJGE CN(Cc1sccc1I)[C@H]1CCCCC[C@@H]1Br 2301068286 JYQHENGUKJHHAQ-JQWIXIFHSA-N 428.177 4.881 50 10 IJGE CN[C@@H](c1c(C)cc(Br)c(F)c1Br)[C@@H]1C[C@@H]1Br 2301505920 TZTXUORLCRDFMJ-KEHGIVTQSA-N 429.953 4.703 50 10 IJGE COC(=O)c1ccc(N(C(=O)C(C#N)=Cc2ccccc2)C2CCCCC2)c([N+](=O)[O-])c1 2320820506 SARHDIVFGIVBMJ-UHFFFAOYSA-N 433.464 4.654 50 10 IJGE ClC[C@]1(Cc2ccc(I)c(Br)c2)C[C@@]12CCOC2 2325221074 KYWHIDZTMDFJSG-KGLIPLIRSA-N 441.534 4.632 50 10 IJGE CCCc1sc(Br)cc1[C@@H](Br)[C@H]1CCCS(=O)(=O)C1 2338024623 WNQDXYQMRGDBDC-ZANVPECISA-N 430.227 4.724 50 10 IJGE COc1ccc(CCO[C@H](CCl)[C@H](Br)CCl)c(Br)c1 2339258307 SIQAKDKYFICKNQ-CHWSQXEVSA-N 434.983 4.627 50 10 IJGE FC(F)(F)[C@@]1(CCl)CCN(Cc2ccc(Cl)c(I)c2)C1 2362378237 HBNLLENVLINSEU-GFCCVEGCSA-N 438.058 4.938 50 10 IJGE FC(F)(F)c1ccc(CBr)c(N2C[C@@H]3CCN(Cc4ccccc4)[C@H]3C2)n1 2369845488 UOTRNALTACWOHL-IRXDYDNUSA-N 440.307 4.706 50 10 IJGE COc1ccc([C@H](C(=O)NC2CCCCC2)N(C(=O)CCl)c2ccc(C)cc2)cc1 3035301 CZIXLHOOLIYHDR-HSZRJFAPSA-N 428.960 4.766 50 10 IJGE aggregator O=C(NNC(=S)NC(=O)c1ccc(Cl)cc1Cl)c1ccc(-c2ccccc2)cc1 12501404 GWUHHIXCOZIBEN-UHFFFAOYSA-N 444.343 4.610 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)NNC(=O)Cc2ccc(Cl)cc2)c(C(C)(C)C)c1 14661773 GMYRMRXEDWOZHX-UHFFFAOYSA-N 430.976 4.704 50 10 IJGE COc1ccc(CC(=O)Oc2ccc(/C=C(/C#N)c3ccc(OC)c(OC)c3)cc2)cc1 31900979 NBSUUWSIWCHFRI-STZFKDTASA-N 429.472 4.925 50 10 IJGE Cc1cccn2c(=O)c(/C=C(\C#N)c3nc4ccccc4[nH]3)c(Oc3ccc(F)cc3)nc12 33584000 MZBLAEDIIKYKAO-DTQAZKPQSA-N 437.434 4.875 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4)ccc32)cc1OC 38659425 SOUQDRUVRZTDML-XMMPIXPASA-N 442.471 4.531 50 10 IJGE Nc1c(NNC(=O)c2cccc3ccccc23)ncnc1Sc1cccc2cccnc12 40793402 CGOWBWNDEGHWHU-UHFFFAOYSA-N 438.516 4.668 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)NCc2ccco2)cc1COc1ccc2c(c1)CCC2 96438815 QNXPHNKONKAUKV-MTJSOVHGSA-N 428.488 4.579 50 10 IJGE CC1=C(C#N)C(=O)N(CCc2ccccc2)C(=O)/C1=C/Nc1cc(Cl)ccc1Cl 101232863 FSFLJNJSRPWPLT-QGOAFFKASA-N 426.303 4.741 50 10 IJGE Cc1ccc(C(CBr)(CBr)Cc2c(C)nn(C)c2Cl)cc1 167849103 VIJRNHMPGOHQHL-UHFFFAOYSA-N 434.603 4.961 50 10 IJGE O=C(NN=Cc1cc(Br)c2ccccc2c1O)c1sc2ccccc2c1O 254382483 CJJFYIFSTQTMLV-UHFFFAOYSA-N 441.306 4.992 50 10 IJGE C[C@@]1(c2ccc(I)cc2)CCC[C@@H](CI)O1 394499466 ORRGXQHZERSXDM-STQMWFEESA-N 442.078 4.511 50 10 IJGE FC(F)c1cc(Br)cc(I)c1CBr 575686566 PFEGSMWUHNGJJI-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE CC[C@H](Br)[C@@H](CC)NC(=O)c1scc(Br)c1Br 705438337 LSZUGILNOSKDNF-POYBYMJQSA-N 448.018 4.955 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1)N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 729620944 XVCILMKKWLJIKP-QGZVFWFLSA-N 444.919 4.624 50 10 IJGE COc1ccccc1-c1ccc([C@@H](C)NC(=O)NNC(=O)c2cccc3cccnc23)cc1 743575669 WASYJRCIYZMMKN-QGZVFWFLSA-N 440.503 4.616 50 10 IJGE O=C(NNc1cccc(F)c1F)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F 743724808 VGKZHMGARWHEBA-UHFFFAOYSA-N 444.278 4.604 50 10 IJGE CC(C)(C#N)c1ccccc1COC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 767975311 BTQLGXVNIKLOAT-JCMHNJIXSA-N 449.514 4.915 50 10 IJGE C/C(=C/C(=O)NNC(=O)CSc1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1 1618713956 NNNFCQXBVUGGKM-BENRWUELSA-N 428.863 4.702 50 10 IJGE CCN(CC)C(=O)c1cc(C)ccc1NC(=O)/C(C#N)=C/c1ccc(Br)cc1 1866128658 DUKGWTSXZHAWNG-GHRIWEEISA-N 440.341 4.785 50 10 IJGE COc1ccccc1-c1csc(/C(C#N)=C(\O)[C@H]2CC(=O)N(Cc3ccccc3)C2)n1 1872747119 OBEFMMCBGRRWSA-VSGPLIKPSA-N 431.517 4.660 50 10 IJGE CCN(C[C@@](C)(CBr)O[C@@H]1COC2(CCCCC2)C1)C(=O)OC(C)(C)C 1879029294 KAPMDGJAKNWSSH-QFBILLFUSA-N 434.415 4.905 50 10 IJGE CCc1nc(Br)c(Br)n1CC1(CBr)CCCC1 1940509473 XNWQOHGITGZJLB-UHFFFAOYSA-N 428.994 4.926 50 10 IJGE C[C@@H]1CN(Cc2cccc(Br)c2Br)CC[C@@H]1Br 1943881445 QYEYUKDANHDIMY-KOLCDFICSA-N 425.990 4.817 50 10 IJGE Fc1cccc(C[C@@H](Br)c2cc(I)sn2)c1F 2007642460 BSFYCPBHJKZNQK-SSDOTTSWSA-N 430.055 4.705 50 10 IJGE O=C(N[C@H]1CC[C@@H](CBr)C1)c1c(Br)cccc1Br 2033091273 OYFCYVDNKOTMNP-BDAKNGLRSA-N 439.973 4.505 50 10 IJGE Clc1ccc(I)c(C[C@]2(CBr)C[C@]23CCOC3)c1 2039014788 GOOJZDNRAMCKSY-UONOGXRCSA-N 441.534 4.679 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H](Br)C3(CCC3)C2)c1 2046457968 MEVHULROVXUPHZ-CYBMUJFWSA-N 440.550 4.694 50 10 IJGE Brc1ccc(CN2C[C@@H]3CC[C@H](C2)C3Br)c(Br)c1 2048820562 JHCTZXXLQJCDSR-BVUQATHDSA-N 438.001 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C[C@@H](Br)C(F)(F)F)C2)CC1 2106785149 ARRYQZVFDAORSL-HUUCEWRRSA-N 443.348 4.671 50 10 IJGE CC1(C)CN(C[C@@H](CBr)c2ccccc2)CCN(C(=O)OC(C)(C)C)C1 2106788875 UFFJUVGRHJLUMA-GOSISDBHSA-N 425.411 4.744 50 10 IJGE Cc1cc(Br)c(C)c([C@H](Cl)[C@H]2CCCS2(=O)=O)c1Br 2136380486 UYNUFLLEUCPUAT-ZWNOBZJWSA-N 430.589 4.686 50 10 IJGE ClCc1nc(N2CCC[C@]3(CCCN(Cc4ccccc4)C3)C2)ncc1Br 2163326323 VKTUEKGHIYFIPT-NRFANRHFSA-N 449.824 4.861 50 10 IJGE Cn1nc([C@H](Br)c2c(F)c(F)cc(F)c2F)c(Br)c1Cl 2167042049 LIAKXTMZFQOENT-ZCFIWIBFSA-N 436.428 4.877 50 10 IJGE Cn1nc([C@@H](Br)c2cc(F)c(F)c(F)c2F)c(Br)c1Cl 2167042070 LLSORDLRLXGWSP-YFKPBYRVSA-N 436.428 4.877 50 10 IJGE O=C(c1ccc(I)c(Cl)c1)N(CCCl)Cc1ccsc1 2171093351 ASMJUYXJZOIPSY-UHFFFAOYSA-N 440.133 4.887 50 10 IJGE ClC[C@@H](CC1CCOCC1)NCc1ccc(Br)cc1Br 2195480024 VGLHSOVDMNQILF-CQSZACIVSA-N 425.592 4.725 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Br)C1(S(C)(=O)=O)CCC1 2295365191 NBZDEKMISWDJPJ-GFCCVEGCSA-N 446.588 4.514 50 10 IJGE N#CC(=Cc1cn(CCOc2ccccc2F)c2ccccc12)C(=O)NCc1ccco1 2297504614 VUVLHEIVDTTZPV-UHFFFAOYSA-N 429.451 4.676 50 10 IJGE C[C@@H]1OCC[C@@]1(CBr)Cc1cc(I)ccc1Cl 2307274159 JZZRDPGBIXWART-ZANVPECISA-N 429.523 4.677 50 10 IJGE CCCOc1ccc(C=CC(=O)NNC(=O)c2ccc(-c3ccc(CC)cc3)nc2C)cc1 2321139541 ZWBLCKILLYMZNW-UHFFFAOYSA-N 443.547 4.883 50 10 IJGE CC(C)(C)c1csc(C(C#N)=C(O)c2ccc3c(c2)C(=O)N(Cc2ccco2)C3=O)n1 2331307384 NNGCFPIJXJJMKQ-UHFFFAOYSA-N 433.489 4.780 50 10 IJGE CC(C)(C)OC(=O)NC1(C2CCN(C[C@]3(CBr)CC3(F)F)CC2)CCC1 2351887080 IZVWCJLKDAPSOU-QGZVFWFLSA-N 437.369 4.566 50 10 IJGE FC(F)(F)[C@]1(CCl)CCN(Cc2ccc(Cl)cc2I)C1 2366726008 PDAOWLZPACEPNQ-LBPRGKRZSA-N 438.058 4.938 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCc2ccccc2N(C[C@]2(CBr)CC2(F)F)C1 2379985836 LMFGJUBIVXKWKE-HNAYVOBHSA-N 445.348 4.753 50 10 IJGE N#C/C(=C/c1cn[nH]c1-c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(C(F)(F)F)c1 35516553 OBOQAYDHHWKOPQ-QPEQYQDCSA-N 427.342 4.549 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1S[C@@H](C)C(=O)N/N=C(\C)CC(C)C 59915707 BBBBZQWOHRLHRW-WTJYETQFSA-N 449.024 4.748 50 10 IJGE O=C1NCCc2ccc([C@H](Br)c3cc(Br)ccc3Cl)cc21 70545614 SUCDRBXOHZZCIZ-HNNXBMFYSA-N 429.539 4.873 50 10 IJGE O=S(=O)(c1cc(Cl)c(Br)s1)N(CCCl)Cc1ccccc1 148397311 PNHSPTGCFWWDNW-UHFFFAOYSA-N 429.188 4.594 50 10 IJGE CC(=O)N(/C=C(/C#N)C(=O)Nc1ccccc1Sc1ccccc1)c1cccc(N)c1 217243709 WKXFDHJHEMRIDL-VLGSPTGOSA-N 428.517 4.819 50 10 IJGE CC[C@](C)(CCCl)NC(=O)c1cc(I)ccc1Br 228564886 XSNHMPMIXIHLDA-CYBMUJFWSA-N 444.538 4.581 50 10 IJGE CO[C@@H](C)CC(CBr)(CBr)c1ccccc1Br 228630595 SCGXRYSVTBMCQY-JTQLQIEISA-N 428.990 4.902 50 10 IJGE Fc1ccc(I)cc1[C@@H]1CN(Cc2ccccc2)C[C@@H]1CCl 382733971 VZMGPBSLTNNRCJ-WMLDXEAASA-N 429.704 4.885 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCC(F)(F)[C@H](CCl)C1 705440209 VXKCNYODKMGSIK-ZCFIWIBFSA-N 437.531 4.609 50 10 IJGE O=C(NNc1ccc(Br)cc1F)c1cc2c(Br)cccc2[nH]1 748203730 JUSAMLFLFMXPRV-UHFFFAOYSA-N 427.071 4.589 50 10 IJGE CC(=NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2)c1ccc([S@](=N)(=O)O)cc1 916356332 RZYIGUOZUOHJTR-INIZCTEOSA-N 433.599 4.932 50 10 IJGE COc1ccc(C(C)=NNC(=O)CSCc2cc(C)cc(C)c2)cc1Br 1084245827 RTHDVQVXSWDHKY-UHFFFAOYSA-N 435.387 4.848 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2)[C@@H]1c1c(F)cccc1Cl 1865686718 ZQZRWWBSXJEGKG-HNNXBMFYSA-N 448.807 4.961 50 10 IJGE Cc1ccsc1[C@@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2Cc1ccc(F)cc1 1865698859 DYHULKCRQJDXSO-CQSZACIVSA-N 434.418 4.677 50 10 IJGE CCCn1nc(C)c2c1OC(N)=C(C#N)[C@@H]2c1cccc(OC)c1OCc1cccc(C)c1 1865704861 GJMIEMJWUQJKRI-QHCPKHFHSA-N 444.535 4.716 50 10 IJGE COc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2-c1ccc(Cl)c(Cl)c1 1865709794 GYFNDIZCOFJVGQ-IBGZPJMESA-N 427.291 4.714 50 10 IJGE CCCOc1ccc(/C=C/C(=O)NNC(=O)c2ccc(-c3ccc(C)c(C)c3)nc2C)cc1 1865756108 GWICYBPPZNAHIV-OQLLNIDSSA-N 443.547 4.937 50 10 IJGE CC(C)(C)OC(=O)NCCCCc1ccc(NC(=O)C2CC(Br)C2)cc1 1887729959 DPUTXVMWYDGZDA-UHFFFAOYSA-N 425.367 4.646 50 10 IJGE Fc1cc(Br)c2nc(CCl)n(Cc3nccn3Cc3ccccc3)c2c1 1912677051 JTPOYVIRURQSHO-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE CCCCOCCOCCOCCN(Cc1ccccc1)C[C@@H](Br)CC 1915128165 VUOGWHMNIPTALC-NRFANRHFSA-N 430.427 4.512 50 10 IJGE Cc1cc(C)c(S(=O)(=O)N(Cc2ccccc2)[C@@H](CBr)C2CC2)c(C)c1 1915185619 CLTQELOHZLTWFY-FQEVSTJZSA-N 436.415 4.976 50 10 IJGE O=C(c1ccoc1Br)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915314247 RBVRERPYUUYJOP-HNNXBMFYSA-N 427.136 4.858 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CCC(CI)CC1 1939527796 OSVFGRHUJBVPJE-UHFFFAOYSA-N 441.334 4.614 50 10 IJGE CC1CC(CBr)(NC(=O)c2csc(Br)c2Br)C1 1999817786 WUVNSHCRAOXZHY-UHFFFAOYSA-N 446.002 4.567 50 10 IJGE CN(NC(=CC#N)NC(=O)Nc1ccc(Cl)cc1)c1ncc(C(F)(F)F)cc1Cl 2038963792 LSQDSRGVYWWZIM-UHFFFAOYSA-N 445.232 4.535 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Br)c2c(F)cccc2Br)c1 2093075400 WLFMKBRWJVBSLW-GFCCVEGCSA-N 428.142 4.538 50 10 IJGE COc1ccc([C@H](Br)c2nn(C)c(Cl)c2Br)cc1Cl 2110723558 OGYUEOFHFUCDEL-VIFPVBQESA-N 428.939 4.982 50 10 IJGE CCCN(C(=O)c1ccc(CBr)cc1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2162914249 CYQMZHKFPIBQJA-SFHVURJKSA-N 439.394 4.833 50 10 IJGE CCCCN([C@H](C)CC)S(=O)(=O)c1cc(CBr)oc1Br 2179774456 FSJCTTJAPZUYSN-SNVBAGLBSA-N 431.190 4.526 50 10 IJGE CO[C@H]1CC[C@H]1COc1c(Br)cc(CBr)cc1Br 2220576034 KXAWEHIOTIPEPM-CABZTGNLSA-N 442.973 4.910 50 10 IJGE Cc1ccc([C@@H](Br)c2ccc3nc(O)oc3c2)cc1I 2232832721 GDRPTLYWFDDHQG-CQSZACIVSA-N 444.066 4.931 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(Cc2ccccc2)CC2(CBr)CC(F)C2)C1 2241369612 AFLYFHAMMVSZQU-UHFFFAOYSA-N 441.385 4.621 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)Nc1cccc(CBr)c1C 2283637589 RQXOHTPFLKZELO-UHFFFAOYSA-N 439.194 4.823 50 10 IJGE Cc1ccc(NC(=O)[C@H](OC(=O)C(C#N)=Cc2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 2297400541 LSMCOTFKLUNHAD-HSZRJFAPSA-N 441.443 4.733 50 10 IJGE Clc1ccc(I)cc1CN1CCCC[C@@H]1CBr 2307333461 CUQPDEPDYSGLAV-GFCCVEGCSA-N 428.539 4.694 50 10 IJGE CCCOc1ccccc1C=CC(=O)Oc1ccc(C=C(C#N)C(=O)NC(C)C)cc1OC 2314774560 OOTALMXIZHJSCQ-UHFFFAOYSA-N 448.519 4.534 50 10 IJGE Cn1cnc(Br)c1[C@H](Br)c1ccc(F)c(Br)c1F 2315594750 YPOMAMGYALWSDN-SSDOTTSWSA-N 444.899 4.708 50 10 IJGE C[C@@H]1CC[C@H](CBr)CN1Cc1ccc(Cl)cc1I 2318529931 WVZQVBYWBBFMPZ-GHMZBOCLSA-N 442.566 4.940 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(Cc2cc(Cl)ccc2I)[C@@H]1C 2321330047 LQCJYLDNCWFYIE-CWSCBRNRSA-N 442.566 4.938 50 10 IJGE CC1(C)[C@H](Cl)C[C@H]1CNCc1ccc(I)c(Br)c1 2325218120 LNBVTGFISHWDII-GXFFZTMASA-N 442.566 4.797 50 10 IJGE COc1ccc(OCCNC=C(C#N)C(=O)NC2CCCCCCCCCCC2)cc1 2325481542 IVGALCDXCLFSNE-UHFFFAOYSA-N 427.589 4.861 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H]2C[C@H](C[C@@H]2Br)C1 2327390048 OSNPGNKWHMPOQB-NRUUGDAUSA-N 440.550 4.550 50 10 IJGE C[C@@H](CBr)CC1CN(Cc2cc(I)ccc2Cl)C1 2327396528 DKQJBJWCLAAPNU-SNVBAGLBSA-N 442.566 4.798 50 10 IJGE C[C@@H]1C[C@@H](Br)[C@@H](C)N(Cc2cc(I)ccc2Cl)C1 2327396712 GUHJPOVGCFQQRG-GIPNMCIBSA-N 442.566 4.938 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H](Br)C2(CCC2)C1 2327402562 XSKFXEMMEJKEBL-CYBMUJFWSA-N 440.550 4.694 50 10 IJGE CCn1nc(Br)nc1C[C@H](Br)c1ccccc1Br 2328446628 CISYUITUAMROHA-JTQLQIEISA-N 437.961 4.502 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1 2328520350 DJVROPFAVCHMKN-UONOGXRCSA-N 431.337 4.527 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@H]1CC[C@H](C(F)(F)F)CC1 2343412455 QCHGIQPNSRVSRU-BRWVUGGUSA-N 436.312 4.842 50 10 IJGE Cc1ccnc(CO[C@H](CI)c2ccccc2Br)c1 2343569623 MFCVCQYVTNIQKB-OAHLLOKOSA-N 432.099 4.845 50 10 IJGE Clc1cc(Br)c(CN2CCO[C@@H]3C[C@@H](CBr)C[C@H]32)s1 2345956438 AIUDXXPSNCVGLT-JMJZKYOTSA-N 429.605 4.538 50 10 IJGE CC(C)CO[C@H]1[C@@H](OCc2cc(I)ccc2Cl)C[C@H]1Cl 2380343033 OWBMMHKZDWFKQE-QLFBSQMISA-N 429.125 4.882 50 10 IJGE COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)Cc3ccc(Cl)cc3)ccc21 38650092 CTIFKIYVGNMXNN-DEOSSOPVSA-N 446.890 4.715 50 10 IJGE Cc1cc(Br)c([C@H](Cl)[C@@H]2CCCCS2(=O)=O)cc1Br 169105426 VSQLLOCAVFAPGZ-STQMWFEESA-N 430.589 4.767 50 10 IJGE CCCCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(-c3ccc(C(=O)OCC)cc3)o2)C1=O 214235960 RYFGIQWFIOGYCZ-QNGOZBTKSA-N 446.503 4.906 50 10 IJGE N#C/C(=C/NC1CCCCCC1)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 216503979 FCGLZDGFUPMXBL-LVWGJNHUSA-N 442.607 4.640 50 10 IJGE CC[C@H](CCBr)NC(=O)c1cc(Br)sc1Br 234007535 LRBJYVFFIOGDET-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE COc1ccc(CC(=O)Nc2cccc(C(C)=NNC(=O)c3ccc(Cl)s3)c2)cc1 252626036 QUVVYGAPGQHBOI-UHFFFAOYSA-N 441.940 4.745 50 10 IJGE CCCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)Cc3ccccc3)cc2)cc1 254735497 HUSLTTIANQUKGU-UHFFFAOYSA-N 430.504 4.778 50 10 IJGE CCc1ccc(OCCCOc2ccc(C=NNC(=O)c3ccccc3)cc2OC)cc1 254739280 ZSSOVDFDOPBRBB-UHFFFAOYSA-N 432.520 4.869 50 10 IJGE CCCCSc1ccc(C(=O)NNc2nc(-c3ccncc3)no2)cc1C(F)(F)F 760869757 OACYYHCPSLWTAY-UHFFFAOYSA-N 437.447 4.800 50 10 IJGE N#Cc1cc(Cl)nc(NNC(=O)c2cc(-c3ccc(F)cc3)nc3onc(C4CC4)c23)c1 768711512 PNQBRPJIUFAWTD-UHFFFAOYSA-N 448.845 4.583 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CCn4c(C(C)C)nnc4[C@H]3C)c2C)cc1 784697869 FAKLJQFZKHXVLZ-IDCRMVTHSA-N 442.567 4.628 50 10 IJGE O=C(Cl)/C=C\c1ccc(OCc2ccc([N+](=O)[O-])cc2)c(I)c1 1081475945 ULPDSXZTMOYICI-YWEYNIOJSA-N 443.624 4.557 50 10 IJGE COc1ccc(C(=O)NN=Cc2c(Br)c(C)n(-c3ccccc3)c2C)cc1 1083939448 YXDUEFMHPOSTCE-UHFFFAOYSA-N 426.314 4.629 50 10 IJGE Cc1cc(C=NNC(=O)c2cc3ccccc3o2)c(C)n1-c1cc(C(=O)O)ccc1Cl 1084275526 KQVSREDVBVICQX-UHFFFAOYSA-N 435.867 4.956 50 10 IJGE C=C[C@H](CC(=O)NNC(=O)c1ccc(COc2ccc(OCC)cc2)cc1)c1ccccc1 1264174770 NDUJJVCYRFGXGB-OAQYLSRUSA-N 444.531 4.785 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2cccc3nc(O)[nH]c23)c(C)n1-c1cccc(Cl)c1 1298765634 WJDFKBLPVZXQDG-MHWRWJLKSA-N 431.883 4.875 50 10 IJGE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)c1ccc(Cl)cc1Cl 1440355472 PEPYUYNLEIOHTF-NTMALXAHSA-N 433.213 4.757 50 10 IJGE C/C(=C/C(=O)NNc1ccc([N+](=O)[O-])cc1Br)c1ccc(C(F)(F)F)cc1 1467359934 HBOSZSBVPCDRRL-NTMALXAHSA-N 444.207 4.923 50 10 IJGE C#CCN(C(=O)/C(C#N)=C/c1cc(C)n([C@H](C)COC)c1C)[C@H]1CCCc2ccccc21 1617567226 UWWLKOKVOJYIBW-LUOGIXEYSA-N 429.564 4.759 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cc(Cl)c(F)cc1Br 1646018212 YXSLIIKZFSCDRI-UHFFFAOYSA-N 427.686 4.604 50 10 IJGE O=C(Nc1ncccc1OCCOc1ccc(Cl)cc1)Oc1ccc([N+](=O)[O-])cc1 1858691158 PSALXJZFIHHQQP-UHFFFAOYSA-N 429.816 4.712 50 10 IJGE CSCC[C@H](/C(O)=C(\C#N)c1nc(C(C)(C)C)cs1)N1C(=O)c2ccccc2C1=O 1872748945 UDYZCHJAUGRWBX-BJYOTHFNSA-N 441.578 4.651 50 10 IJGE C[C@@H](c1ccncc1Br)[C@@H](Br)c1ccsc1S(C)(=O)=O 1924062671 HHVDUEPVPOVCBW-QPUJVOFHSA-N 439.194 4.549 50 10 IJGE CC1(C)OC[C@H](Cc2ccc(Br)cc2Br)[C@@H]1Br 1943859984 UEQSWCRKXCPWAY-CABZTGNLSA-N 426.974 4.943 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@@]23CCC[C@H](CI)O3)C1 1950281061 NNSWIOITOQUADZ-ATZDWAIDSA-N 449.373 4.931 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(Br)cc1)[C@@H](Br)CF 1952042498 NHWBCXCIKRXQHK-STQMWFEESA-N 425.136 4.618 50 10 IJGE CC(C)(C)[C@H](CBr)CN1CCC(CNC(=O)OCc2ccccc2)CC1 1977959859 AYZFPYCSLCBESM-LJQANCHMSA-N 425.411 4.682 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1ccc(Br)s1 2006106125 YYIORVNWSNCORC-VIFPVBQESA-N 430.149 4.624 50 10 IJGE CCC[C@@H](Cl)CCNC(=O)c1cc(Br)ccc1I 2029923388 PODURYFFZVDKRF-SNVBAGLBSA-N 444.538 4.581 50 10 IJGE CC(C)(C)[C@@H](Br)CNC(=O)c1cccc(Br)c1Br 2031480278 UCQMHZTYVBLAFB-JTQLQIEISA-N 441.989 4.751 50 10 IJGE CC[C@H](Cl)C(=O)N(CCCNC(=O)OC(C)(C)C)c1cccc(Br)c1 2044693308 JPHOATFRBPOHLO-HNNXBMFYSA-N 433.774 4.714 50 10 IJGE C[C@@H]1C[C@@H](O[C@@H](CI)c2ccc(Br)cc2)CCO1 2084724854 KKDBWCBDVCGCMY-SWHYSGLUSA-N 425.104 4.509 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@@H](CBr)c2ccccc2)CC12CCC2 2163059445 SZYYKGOAPVAJAM-RTBURBONSA-N 437.422 4.792 50 10 IJGE Cc1cc(C(=O)N2C[C@@]3(F)CCC[C@@]3(CBr)C2)sc1Br 2176631313 YARSXAMYEPLOAB-KGLIPLIRSA-N 425.161 4.548 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ncc(Br)cc2Cl)C[C@H]1CBr 2183590803 QQSHIYVIJIHSHQ-VXNVDRBHSA-N 436.497 4.503 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@@H]1CCN2C[C@H](CBr)c1ccccc1 2197355196 GINOMPLIYMCOBC-NNMXDRDESA-N 437.422 4.934 50 10 IJGE FC1(F)[C@@H]2[C@@H](O[C@@H](CI)c3ccccc3Br)CC[C@H]21 2230421600 RWLXKDHHXQQTCH-IXOXFDKPSA-N 443.069 4.986 50 10 IJGE Cc1c(Br)sc([C@H](Cl)C2CC(S(C)(=O)=O)C2)c1Br 2257543384 ZEAAXLWHIVFVIX-QXUHLLMWSA-N 436.618 4.685 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@@H]2CC[C@H](Br)C[C@H]2C1 2264503118 CIMVVBUVZFYWEX-CIUDSAMLSA-N 427.589 4.800 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282977527 CXJDJEDVPSJWJQ-BDAKNGLRSA-N 427.539 4.877 50 10 IJGE C[C@H](Br)CN(C(C)(C)C)S(=O)(=O)c1ccc(Cl)c(Br)c1 2288076900 ZQHPFPNDJHECIN-VIFPVBQESA-N 447.620 4.675 50 10 IJGE Cc1sc(C(=O)N2CCC(CBr)(C(F)F)CC2)cc1Br 2289939377 SBRGEDAMXKMFFX-UHFFFAOYSA-N 431.140 4.701 50 10 IJGE CN(C)c1ccc(C=C(C#N)C(=O)OCc2csc(COc3ccc(F)cc3)n2)cc1 2297434891 YAEHUXBRCKMTAG-UHFFFAOYSA-N 437.496 4.578 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@H]2C[C@@H]3CC[C@H]2C3)CC1 2298751510 MQBZJHLDDCTMJW-OWCLPIDISA-N 449.373 4.644 50 10 IJGE COc1cc(OC)c([C@@H](Br)[C@@H]2C[C@H]2Br)cc1Br 2298803487 POXXVJRTSXOOMH-GFJAWQGPSA-N 428.946 4.686 50 10 IJGE CCCN1C(=O)C(=Cc2ccc(OCc3ccc(C)cc3)c(OC)c2)C(C)=C(C#N)C1=O 2314611513 WDEQMZBDQTVENL-UHFFFAOYSA-N 430.504 4.585 50 10 IJGE CCCOc1ccccc1C=C(C#N)C(=O)Nc1sc2c(c1C(=O)OC)CC[C@H](C)C2 2314774244 ZVJQKPGLVNVDCW-HNNXBMFYSA-N 438.549 4.994 50 10 IJGE Clc1ccc(CN2C[C@@H](CBr)C3(CC3)C2)cc1I 2315553496 SZJZJMKJJYGUJX-LLVKDONJSA-N 440.550 4.552 50 10 IJGE CC[C@H](NC(=O)c1ccc(Cl)cc1I)[C@H](Br)CC 2317771906 VYSPFMUNCSLQGD-PWSUYJOCSA-N 444.538 4.627 50 10 IJGE Cc1ccc2nc(-c3ccc(NC=C(C#N)C(=O)N[C@H](CC(C)C)C(=O)O)cc3)sc2c1 2325022133 PAQHDDDETCSJOM-HXUWFJFHSA-N 448.548 4.707 50 10 IJGE C[C@H](NC(=O)C(C#N)=CNCc1ccccc1Br)c1ccc2c(c1)CCCC2 2325119041 TUCJEDJUYMMKAL-INIZCTEOSA-N 438.369 4.702 50 10 IJGE C[C@H]1CCN(Cc2ccc(I)c(Br)c2)C[C@H]1CCl 2325223359 OTQMEWKCPBMHTP-CMPLNLGQSA-N 442.566 4.751 50 10 IJGE CCC[C@@H](NC(=O)C=C(CC)c1ccc(OC)cc1)C(=O)Nc1ccc(SC#N)cc1 2329548380 OTHODYGKDMIJBB-JOCHJYFZSA-N 437.565 4.985 50 10 IJGE FC(F)(F)[C@@H]1C[C@@]1(CCl)CNCc1cc(I)ccc1Cl 2380513316 SMKNUMYLSRWPLO-VXGBXAGGSA-N 438.058 4.842 50 10 IJGE CCC(C)(C)c1ccc(OCC(=O)NNC(=O)c2ccccc2OCc2ccccc2)cc1 8905766 NXHCTUZMUQZETM-UHFFFAOYSA-N 446.547 4.793 50 10 IJGE CC[C@H](C)c1ccc(OCC(=O)NNC(=O)c2ccccc2OCCc2ccccc2)cc1 10509329 JTYOJIRGENKIDN-FQEVSTJZSA-N 446.547 4.662 50 10 IJGE Cc1cc(I)ccc1N/C=C(/C#N)C(=O)Nc1cccc(Cl)c1 217254634 MUZPZUTWLGBNPH-BENRWUELSA-N 437.668 4.711 50 10 IJGE O=[N+]([O-])c1cc(CBr)ccc1Oc1ccccc1I 218229568 STKNJASDCVZFEH-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1Br)c1cc(Br)sc1Br 232486503 JBQQBYDCNBRPEZ-SFYZADRCSA-N 446.002 4.709 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2cc(-c3ccc4ccccc4c3)n[nH]2)c(O)c1 263631825 YIBMRCJUYUJQFX-UHFFFAOYSA-N 427.508 4.546 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)Nc1cccc(CCBr)c1 313162550 OBILZDGYCAKACB-UHFFFAOYSA-N 439.194 4.557 50 10 IJGE Cc1ccc([C@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CI)s1 382723988 PCJYJGUYAHIUJS-HOTGVXAUSA-N 441.334 4.844 50 10 IJGE Cc1cccc(-n2c(C)c(Br)c(C=NNC(=O)c3ccccc3O)c2C)c1 725427456 HCBYGDXWQKJGQW-UHFFFAOYSA-N 426.314 4.635 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@H](C)Cc2ccc(Cl)cc2Cl)c1C 736691956 VQDHCDJFDXRZGM-GFCCVEGCSA-N 430.339 4.784 50 10 IJGE Cc1coc(-c2cccc(NC(=O)/C(C#N)=C\c3cn(CCC#N)nc3-c3ccccc3)c2)n1 758877143 BWOGPUOZDWKZAK-BKUYFWCQSA-N 448.486 4.973 50 10 IJGE O=C(NNc1ccc(F)cc1)C(=O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1 778697510 NYQISIPYKBLTLC-UHFFFAOYSA-N 433.361 4.719 50 10 IJGE Cc1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c(OC[C@H]2CCCO2)c1 799391534 QDCHBNCCTUNKNY-OAHLLOKOSA-N 434.418 4.592 50 10 IJGE C[C@@H](Cc1ccccc1Cl)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 918581957 BSONEENIELSZRS-CQHJRZBDSA-N 443.938 4.772 50 10 IJGE O=C(Cn1nnc2ccccc21)NN=C(Cc1ccccc1)c1ccc(-c2ccccc2)cc1 1084004197 PNSFHJDAMNXDMP-UHFFFAOYSA-N 445.526 4.862 50 10 IJGE C#CCCCC(=O)NNC(=O)Nc1ccc(Br)cc1Oc1ccc(C)cc1 1663599990 LYMJSCZFIOFQAD-UHFFFAOYSA-N 430.302 4.506 50 10 IJGE CC[C@@H](Br)C(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3CC)c(C)s1 1859525301 LIIQIZLDRTYLQU-CQSZACIVSA-N 436.375 4.530 50 10 IJGE COc1ccc(-c2nn(-c3ccccn3)c3c2[C@@H](c2sccc2C)C(C#N)=C(N)O3)cc1 1865698866 FFJCBUJGZMHTCC-IBGZPJMESA-N 441.516 4.531 50 10 IJGE COc1ccc(OC)c(C/C(O)=C(\C#N)c2nc(-c3ccc(OC)cc3OC)cs2)c1 1872755339 IRUXVRXNFLYPMO-ZZEZOPTASA-N 438.505 4.880 50 10 IJGE CC(C)(CI)CN1[C@H]2CCC[C@H]1CN(Cc1ccccc1)CC2 1904654177 UUCHIEMTOFLQIA-OALUTQOASA-N 426.386 4.577 50 10 IJGE O=C(c1ccncc1Br)N(Cc1ccccc1)C1(CBr)CCC1 1915755419 ADKQQOKHBQNIKR-UHFFFAOYSA-N 438.163 4.804 50 10 IJGE CC1(C)C[C@H](Br)CN1Cc1cc(Br)ccc1Br 2006503264 MEZVKNTZFVHZIT-NSHDSACASA-N 425.990 4.959 50 10 IJGE C[C@H]1CCO[C@H]1COc1c(Br)cc(Br)cc1CBr 2034995995 QTCVYCQOQOLTBS-UFBFGSQYSA-N 442.973 4.910 50 10 IJGE CCC[C@H](Br)c1cn(-c2ccc(Cl)cc2I)nn1 2057427029 LXCQWDMLRWTMBX-VIFPVBQESA-N 440.510 4.761 50 10 IJGE O=S(=O)(c1cc(CBr)ccc1F)N(Cc1ccccc1)C1CCCC1 2059265415 VNAVBQDDARRLRW-UHFFFAOYSA-N 426.351 4.854 50 10 IJGE C[C@]1(NC(=O)c2cc(Br)cc(Br)c2)CCC[C@H]1Br 2062572912 FIJUKDSUBRDZIV-YPMHNXCESA-N 439.973 4.648 50 10 IJGE Fc1cc(F)c(-n2nc(CCl)c(I)c2C(F)(F)F)c(F)c1 2079209960 FHIXDRUGFWKROP-UHFFFAOYSA-N 440.512 4.652 50 10 IJGE CSCC[C@H](Cl)CCNC(=O)c1cccc(Br)c1Br 2092335779 QNTTZOPENQUOOM-SECBINFHSA-N 429.605 4.692 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)C[C@H]1CCCCN1C(=O)OC(C)(C)C 2106786973 WRUSNVMEMAZHHS-RTBURBONSA-N 425.411 4.887 50 10 IJGE COc1cc(NC(=O)[C@H](Br)C2CCCC2)ccc1NC(=O)OC(C)(C)C 2110721795 IRCICDBKHOCEGU-MRXNPFEDSA-N 427.339 4.934 50 10 IJGE C[C@H](CCBr)CCN1CCC[C@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2129042647 JSIMLGGIKOCERZ-CABCVRRESA-N 429.403 4.747 50 10 IJGE CN(C(=O)c1cccc(Br)c1Br)C1(CCl)CCSCC1 2171184109 RPUAFMOZITWVQH-UHFFFAOYSA-N 441.616 4.788 50 10 IJGE CS(=O)(=O)C1([C@@H](Cl)c2cc(Br)c(Br)cc2F)CCC1 2225635573 WGVVHBXLRXWCRW-NSHDSACASA-N 434.552 4.598 50 10 IJGE COc1ccc([C@H](Br)c2c(F)cccc2I)s1 2247987878 NRTZQXNNVXJXCN-LBPRGKRZSA-N 427.076 4.985 50 10 IJGE BrCCCCC1CCN(C[C@@H]2CC2(Br)Br)CC1 2248098334 PDQZULBSVVJUNT-LBPRGKRZSA-N 432.038 4.770 50 10 IJGE CO[C@@H]1C[C@@H]1[C@H](Br)c1c(F)cc(Br)c(F)c1Br 2250745350 KNNSQSXLHQOBLJ-QTLDAMRXSA-N 434.900 4.961 50 10 IJGE COc1ccc(CCNC(=O)C(C#N)=Cc2ccc(-c3ccccc3Cl)o2)cc1OC 2295672292 JKLACRATAUGFOI-UHFFFAOYSA-N 436.895 4.883 50 10 IJGE O=C(NN=Cc1cccc(Br)c1)c1cccc(NC(=O)c2ccccc2F)c1 2297635493 ANOPMUQNLGQWNJ-UHFFFAOYSA-N 440.272 4.604 50 10 IJGE CC[C@H](Br)[C@@H]1CCCCN1Cc1sccc1I 2301072126 VJXFBYOQNNKJDA-JQWIXIFHSA-N 428.177 4.881 50 10 IJGE C[C@H]1C[C@@H]1N(CCCl)Cc1ccc(I)c(Br)c1 2306225112 UZRTZWYVUPEUSM-ZANVPECISA-N 428.539 4.503 50 10 IJGE CC[C@@H]1CN(Cc2cc(I)ccc2Cl)C[C@H]1Br 2307328685 PXAHKUMXELBCQE-BXKDBHETSA-N 428.539 4.550 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2cccc([N+](=O)[O-])c2)sc2c1CC[C@H](C)C2 2314571791 MAWXBNSRRRVNLD-ZDUSSCGKSA-N 439.493 4.503 50 10 IJGE C[C@H]1CC[C@@H](CBr)CN1Cc1ccc(Cl)c(I)c1 2315551060 LMKNPSMLJDSSOF-JQWIXIFHSA-N 442.566 4.940 50 10 IJGE CCCN(C[C@]1(CBr)CC1(F)F)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2326918529 AEICGJDQWJKPAB-RHSMWYFYSA-N 425.358 4.518 50 10 IJGE CCCOc1ccc(-c2csc(C(C#N)=C(O)COCCOC)n2)cc1OCCC 2331293760 ZNCYHWMSSZHFGM-UHFFFAOYSA-N 432.542 4.843 50 10 IJGE Cc1cc(-c2csc(C(C#N)=C(O)c3ccc(NS(C)(=O)=O)cc3)n2)ccc1F 2331320443 OFRSZAPXSYHJTB-UHFFFAOYSA-N 429.498 4.579 50 10 IJGE CCCN(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@@]1(CBr)CC1(F)F 2351892360 ODQGRJZWKPKWSW-QAPCUYQASA-N 439.385 4.766 50 10 IJGE CC1(C)C[C@@H](Cl)CCN(C(=O)c2ccc(Cl)cc2I)C1 2365585516 BRJHUJCTDMDSAW-NSHDSACASA-N 426.125 4.814 50 10 IJGE CCc1ccc(OCC(=O)N/N=C/c2ccc(Cl)cc2Cl)c(Br)c1 13977544 IGQODPSJRBVGHR-ZVBGSRNCSA-N 430.129 4.847 50 10 IJGE C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)c1ccc(OCc2ccccc2)cc1 14665986 XDZAIGXHNJBHTG-LJQANCHMSA-N 446.547 4.792 50 10 IJGE N#C/C(=C/c1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 35484930 JSPYZDJMDVDTHO-RGEXLXHISA-N 435.443 4.993 50 10 IJGE CCCOC(=O)c1oc2c(c1C)/C(=N/NC(=O)Cc1coc3cc(C)cc(C)c13)CCC2 40827043 FPJAZGREHRUZID-NLRVBDNBSA-N 436.508 4.917 50 10 IJGE CCCCc1ccc(NC(=O)/C(C#N)=C\NCCc2ccccc2Br)cc1 217171269 BNDOBZDXIJOXJB-MNDPQUGUSA-N 426.358 4.970 50 10 IJGE BrCc1c(Oc2ccc(I)cc2)nc2ccccn12 218201723 MAKSKNDRGOCYHC-UHFFFAOYSA-N 429.055 4.626 50 10 IJGE CCC(CC)(CCl)CNS(=O)(=O)c1cc(Br)ccc1Br 230258213 RTMMVCYEPMIYMO-UHFFFAOYSA-N 447.620 4.535 50 10 IJGE O=C(NN=Cc1ccc(OCc2ccccc2)cc1)C(O)(c1ccccc1)c1ccccc1 254429201 CGFBCEWAIVWBBV-UHFFFAOYSA-N 436.511 4.652 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OCC1CCCCCC1 300888162 OARVIAIMKFWPHQ-QGZVFWFLSA-N 425.351 4.692 50 10 IJGE Nc1ccc(Cl)c([C@@H]2CN(Cc3ccccc3)C[C@@H]2CI)c1 382696509 SFBRBWKAFIRAND-WMLDXEAASA-N 426.729 4.573 50 10 IJGE Cc1c(CCl)cc(Cl)cc1S(=O)(=O)N1CC[C@H](COCc2ccccc2)C1 383695052 BINLPJFNPQZICU-KRWDZBQOSA-N 428.381 4.615 50 10 IJGE CC1(C)C[C@@H](Cl)CCN(C(=O)c2cc(Cl)ccc2I)C1 395367003 ZUGYVQNTQICAOX-NSHDSACASA-N 426.125 4.814 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N(CCCBr)C1CC1 404221796 LNRZDUBJCNNBEN-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE CC(C)C[C@H](Br)CNC(=O)c1scc(Br)c1Br 705400644 NMVYNWBRPJZHQU-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE O=C(NC1(CCBr)CCSCC1)c1ccc(Cl)cc1Br 719664181 COXJXUYRJAAWIW-UHFFFAOYSA-N 441.616 4.883 50 10 IJGE CCS[C@@H]1CC[C@H](N(C)C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)C1 742908416 AYHNZJINOYGQME-ISHKIFBASA-N 433.581 4.503 50 10 IJGE Cc1nc2ccccn2c1C(=O)NN=Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 918707592 BXFFCAMOXHRRKU-UHFFFAOYSA-N 429.427 4.549 50 10 IJGE CCOc1cc(OCC)c([C@@H](O)P(=O)(c2ccccc2)c2ccccc2)cc1OCC 1088693709 VWALWEVMDFVAEU-VWLOTQADSA-N 440.476 4.888 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNc2cc(Cl)nc3ncccc23)s1 1644378691 NZBYJDNUODMPSX-UHFFFAOYSA-N 440.381 4.579 50 10 IJGE CCc1nn(-c2ccc(Br)cc2)c2c1[C@H](c1ccc(F)cc1)C(C#N)=C(N)O2 1865708441 WYBKJQRPDLKGEX-GOSISDBHSA-N 439.288 4.554 50 10 IJGE Cc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865709462 CEWVNLNRDJSZLD-SFHVURJKSA-N 442.262 4.614 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1ccc(Br)cc1 1866128827 OGKSZGOTWUCAKT-DTQAZKPQSA-N 427.298 4.952 50 10 IJGE N#C/C(=C\c1cccc(Cl)c1)C(=O)NC[C@@H](c1c(F)cccc1Cl)N1CCCC1 1866130009 WEWCLZRDIALLEK-PRDNPTHXSA-N 432.326 4.993 50 10 IJGE COc1c(C)cc(C)cc1-c1csc(/C(C#N)=C(\O)[C@H]2CC(=O)N(C(C)(C)C)C2)n1 1872754832 KZTCFHQMCFGPLN-IENXAOORSA-N 425.554 4.875 50 10 IJGE O=C(N[C@@H](CCl)[C@H]1CC=CCC1)c1cc(Br)sc1Br 1885066661 CTWUHTAYYSVJDT-WPRPVWTQSA-N 427.589 4.967 50 10 IJGE Cc1cc(Br)sc1[C@@H](Br)c1cn(C)c(Br)n1 1939448909 DBEKNNKGWIVGFI-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE CN(C(=O)c1csc(I)c1)C1(CBr)CCCCC1 2050803404 PCBSLPLLUMTPMA-UHFFFAOYSA-N 442.160 4.523 50 10 IJGE CC[C@@H](Cl)[C@@H]1CCCCN1c1ncc(I)cc1Br 2069530439 XDJJMJVVMUTLKO-NEPJUHHUSA-N 443.554 4.825 50 10 IJGE O=C(NCC1CC2(CC(Cl)C2)C1)c1cc(Br)sc1Br 2108261883 VQHAVZONRCPHHU-UHFFFAOYSA-N 427.589 4.801 50 10 IJGE CN(CC[C@@H]1CCCCN1C(=O)c1ccc(CBr)cc1)C(=O)OC(C)(C)C 2162916888 WCWAYGUAUDOONW-SFHVURJKSA-N 439.394 4.833 50 10 IJGE CC(C)N(C[C@H]1CCCN(CC2(CBr)CCOCC2)C1)C(=O)OC(C)(C)C 2163058682 MPSGCDVSYNFVKN-SFHVURJKSA-N 447.458 4.536 50 10 IJGE O=C(NC1CCC2(CCC[C@H](CI)O2)CC1)OCc1ccccc1 2241898409 CPFNAQJZJBMLOC-TVRKMHQQSA-N 443.325 4.598 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@H]1[C@H]2OCC[C@@H]21 2259994928 NAMSQMASLSWLRX-MCUHUUPVSA-N 446.911 4.961 50 10 IJGE C=CC[C@](C)(CBr)CNC(=O)c1cc(Br)c(F)cc1Cl 2285836855 GWIYGRZNSNTZCF-CQSZACIVSA-N 427.539 4.949 50 10 IJGE CCO[C@]1(COc2c(Br)cc(CCl)cc2Br)CCOC1 2287072553 YTXVENBMPHJMKJ-CQSZACIVSA-N 428.548 4.525 50 10 IJGE Clc1ccc(CNCCCCCCBr)cc1I 2300239187 VAJMJQAOZSAWFA-UHFFFAOYSA-N 430.555 4.990 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)[C@@H]1CCC[C@@H]1Cl 2306224832 UBHNVWHQVCTXRK-WCQYABFASA-N 428.539 4.645 50 10 IJGE CN(Cc1cc(I)ccc1Cl)C1(CBr)CCC1 2307332969 WLCQSBSOPOPMIJ-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE CC1=C(C#N)C(=O)N(C[C@@H]2CCCO2)C(=O)C1=CNc1ccc(N=Nc2ccccc2)cc1 2314578745 AANCYKFPSMORQE-NRFANRHFSA-N 441.491 4.786 50 10 IJGE COc1cc(C=C2C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 2314617029 PHXQCTDSBJYYFA-UHFFFAOYSA-N 444.531 4.831 50 10 IJGE COc1cc(C=NNC(=O)c2cccnc2)ccc1OCc1ccc(Cl)c(Cl)c1 2323126222 GORRHYZWZVJGGU-UHFFFAOYSA-N 430.291 4.740 50 10 IJGE COc1cccc(C=C(C#N)c2nc(-c3ccc(OC)c(OC)c3OC)cs2)c1OC 2331492802 QQPBBWLGSMTKHN-UHFFFAOYSA-N 438.505 4.917 50 10 IJGE COc1ccc([C@@H](Br)[C@]23C[C@H](C[C@@H](C)O2)C3)cc1I 2342811736 UOGAYOLPCKPSHU-IDMWTJEOSA-N 437.115 4.693 50 10 IJGE BrCc1ccc(N2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)cc1C1CC1 2364537201 HUKKGLSCIPLMKD-PKTZIBPZSA-N 427.386 4.549 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@](C)(CBr)C(C)(C)C)[C@@]2(CCCOC2)C1 2380168323 MBRVCBGCXZECLQ-NDXORKPFSA-N 447.458 4.582 50 10 IJGE N#C/C(=C\c1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1)C(=O)NCc1ccccc1 21270107 DLLHMQQVJDGBEA-KAPURRDVSA-N 428.332 4.782 50 10 IJGE Cc1cccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(Cl)cc2)c1 38651349 UVNMMUVUGGHDQN-XMMPIXPASA-N 446.890 4.851 50 10 IJGE C=CCOc1cc(Br)c(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)cc1OC 59335405 AIIRPQIPGORMJL-YBEGLDIGSA-N 427.298 4.877 50 10 IJGE CC(C)(C)OCCO[C@](C)(CI)c1ccccc1Br 162574522 GWRFWIAVZYLISS-OAHLLOKOSA-N 441.147 4.931 50 10 IJGE O=C(N[C@@H](CBr)Cc1ccccc1)c1cccc(Br)c1Cl 228459288 ZLSHDVQUFAADDM-GFCCVEGCSA-N 431.555 4.839 50 10 IJGE O=C(N[C@@H]1CCC[C@H]1CBr)c1ccc(Br)cc1Br 231558843 PTRCBDTUAAFXJM-QPUJVOFHSA-N 439.973 4.505 50 10 IJGE COc1ccc(OCC(=O)NN=Cc2cc(C)n(-c3ccc(Cl)cc3Cl)c2C)cc1 252636697 XKYRKUYJZLZFPE-UHFFFAOYSA-N 446.334 4.939 50 10 IJGE O=C(CSc1ccc(C=NNC(=O)c2ccccc2)o1)Nc1ccc2ccccc2c1 254383854 NEALGMHFRFCZTE-UHFFFAOYSA-N 429.501 4.928 50 10 IJGE ClCc1ccc2scc(I)c2c1I 307523067 DBBGDLMATVWFMN-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CN(CCCCBr)C(=O)c1scc(Br)c1Br 705425652 LTFQFHOVTGMCST-UHFFFAOYSA-N 433.991 4.520 50 10 IJGE CC[C@@H](C[C@H](C)Cl)NS(=O)(=O)c1cc(Br)c(C)cc1Br 716891057 JLRAMPAOUMRKGZ-UWVGGRQHSA-N 447.620 4.594 50 10 IJGE Cc1ccc2oc(CN(Cc3ccco3)C(=O)NNC(=O)CCOc3ccccc3)cc2c1 740047255 YZKGTKLZFBRMIV-UHFFFAOYSA-N 447.491 4.546 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F 776012212 FQWSKPVPFKAPHO-ZDUSSCGKSA-N 429.267 4.635 50 10 IJGE Cc1ccc(-c2ccccc2)n1-c1ccc(C(=O)NN=Cc2ccc(O)c([N+](=O)[O-])c2)cc1 1084576604 BWAMQJFIFJGKRC-UHFFFAOYSA-N 440.459 4.830 50 10 IJGE O=C(NNc1cc(Br)ccc1F)c1cc2cccc(C(F)(F)F)c2nc1O 1602957712 WQJYWRKJUNWDQJ-UHFFFAOYSA-N 444.182 4.618 50 10 IJGE Cc1c(C(=O)Nc2ccc(Cl)cc2)oc2c1C(=NNC(=O)Cc1ccccc1)CCC2 1772749323 TXRBCZHFTAKMTQ-UHFFFAOYSA-N 435.911 4.893 50 10 IJGE CCCn1nc(C)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(OCc2ccc(C)cc2)c(OC)c1 1865695170 LTKVJPZZNCSNEQ-DEOSSOPVSA-N 444.535 4.716 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCC[C@H](CI)O2)[C@@H]2CCCC[C@H]21 1984438287 BKAJCQLHBOTHIY-ATNYBXOESA-N 435.346 4.539 50 10 IJGE Cn1cc([C@H](Br)c2ccc(F)c(Br)c2)c(Br)n1 2005274454 LOSGBBORYZWRBJ-SNVBAGLBSA-N 426.909 4.569 50 10 IJGE BrCCN(Cc1cc(Br)ccc1Br)CC1CC1 2006500429 OABNQRMNRBXYAV-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE CC[C@@H](C)[C@H](Br)CNC(=O)c1ccc(Br)cc1Br 2029977464 MGGYMEONUATTSW-PRHODGIISA-N 441.989 4.751 50 10 IJGE BrC[C@]12CCC[C@H]1CN(c1ncc(Br)cc1Br)C2 2041465952 ZVXPXOPHSVNZGI-ZANVPECISA-N 438.989 4.608 50 10 IJGE CC(C)(C)OC(=O)N1CCCCN(CC2(CBr)CCC2)CC(F)(F)C1 2046339319 LOQIJTTXFAUZJQ-UHFFFAOYSA-N 425.358 4.520 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1cc(Br)ccc1Br 2081239493 SUFHBTFZCIJLGP-QPUJVOFHSA-N 441.989 4.751 50 10 IJGE CCC(CC)(CNC(=O)OC(C)(C)C)N(C)C(=O)c1ccc(CBr)cc1 2106600948 TUBRLXMKSLEPKJ-UHFFFAOYSA-N 427.383 4.737 50 10 IJGE CC(C)N(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)[C@@H](Br)C1CCCC1 2167031232 HWHBUGXAYOYZSU-WMZOPIPTSA-N 445.442 4.824 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CCCN(C(=O)[C@H](Br)C3CCCC3)C2)C1 2167034523 XDCANFZFEXNHCN-DYESRHJHSA-N 443.426 4.580 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]21 2185533276 MONSMHKFLOIMBN-MSOLQXFVSA-N 447.458 4.678 50 10 IJGE CCC(CC)N(CCBr)C(=O)c1ccc(C)c(I)c1 2224618061 DCXRAXPCLMOYJL-UHFFFAOYSA-N 438.147 4.625 50 10 IJGE COc1cccc(-c2nn(-c3ccc(F)cc3)cc2C=C(C#N)C(=O)Nc2nccs2)c1 2297382351 PROVMNWVEXLJKE-UHFFFAOYSA-N 445.479 4.689 50 10 IJGE BrC1C[C@@H]2CCC[C@H](C1)N2Cc1sccc1I 2301076181 ITXDBUBIOLMZMN-FGWVZKOKSA-N 426.161 4.633 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCc2ccco2)ccc1OC(=O)c1ccc(C(C)C)cc1 2314808164 JXDQOAQUPPHQMI-UHFFFAOYSA-N 444.487 4.854 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2CC[C@H]1C[C@@H]2Br 2315499360 WCOCVFRMOJCBRC-BFVZDQMLSA-N 438.001 4.959 50 10 IJGE Clc1ccc(CN2C[C@H](Br)CC23CCC3)c(I)c1 2318536472 ADPHQNYTAWNWLT-LLVKDONJSA-N 440.550 4.837 50 10 IJGE CC(C)COc1c(Cl)cc(C=NNC(=O)c2ccc3[nH]c(=N)sc3c2)cc1Cl 2323601789 VDGJRIHZTHQXDL-UHFFFAOYSA-N 437.352 4.814 50 10 IJGE CC(C)C[C@H](CBr)CN=[S@@](C)(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2328519470 SJHQKNVEHKJLPO-RKPUJPDHSA-N 439.460 4.541 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)cc1 38677969 WNVYKRXQZPTOQY-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE N#C/C(=C/c1cc(Br)c(O)c(Br)c1O)c1nc2ccccc2[nH]1 50551957 LBAAAJBGYHICCV-UITAMQMPSA-N 435.075 4.563 50 10 IJGE Fc1ccc(-c2nc(CCl)cs2)cc1Cn1cc(I)cn1 96714911 NNVSHGJUEKPPSQ-UHFFFAOYSA-N 433.677 4.537 50 10 IJGE N#CC1=NN(c2ccccc2)[C@H](c2ccccc2)C2=C1OC(N)=C(C#N)[C@H]2c1ccccc1 168467404 OOIRBZKJFJFCKO-ILBGXUMGSA-N 429.483 4.889 50 10 IJGE COc1cc(/C=N\NC(=O)Cc2ccc(N)cc2)ccc1OCc1ccc(C(C)(C)C)cc1 169900493 LTSDXZQOKOXEDK-RHANQZHGSA-N 445.563 4.847 50 10 IJGE CN1CCc2nc(N/C=C(/C#N)C(=O)NC3CCCCCCCCCCC3)sc2C1 217259973 QDRWXKRMZXANIF-VLGSPTGOSA-N 429.634 4.740 50 10 IJGE CC[C@@](C)(CCBr)NC(=O)c1cc(Br)ccc1Br 228571918 SCISZCCQTQEORV-ZDUSSCGKSA-N 441.989 4.895 50 10 IJGE CC(C)CCCOC1(CI)CCN(C(=O)OC(C)(C)C)CC1 231313687 UYSKYBYMDPGQGF-UHFFFAOYSA-N 425.351 4.644 50 10 IJGE CCOc1ccccc1OCC(=O)NN=Cc1ccc(-c2cccc(C(F)(F)F)c2)o1 254822277 AKLVORPIGMLFDG-UHFFFAOYSA-N 432.398 4.893 50 10 IJGE COc1ccc(CCNC(=O)Nc2cccc(C(=O)Nc3ccc(SC#N)cc3)c2)cc1 586624215 PXAOPNHNMAUQHY-UHFFFAOYSA-N 446.532 4.885 50 10 IJGE C=CCCC[C@@H](NC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1)c1ccccc1 1471198929 CBWVFFAFQNSQBL-GOSISDBHSA-N 441.475 4.704 50 10 IJGE COc1ccc(CC(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)cc1OC 1860391469 IOCCEQVQZFLQGW-UHFFFAOYSA-N 446.528 4.589 50 10 IJGE CCCc1nn(-c2ccccc2Cl)c2c1[C@@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865683370 KFIBSSNDLIGBET-NRFANRHFSA-N 433.943 4.762 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2c(F)cccc2Cl)c1 1865689758 DZBREFCTTNIRMJ-NRFANRHFSA-N 438.890 4.649 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CCC)nn3-c2ccccn2)cc1 1865693345 VCBOIERUMKHCRM-JOCHJYFZSA-N 429.524 4.617 50 10 IJGE CCCc1nn(-c2ccccc2)c2c1[C@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865702368 UHWKGSAWXFRANM-HSZRJFAPSA-N 427.552 4.889 50 10 IJGE CCOC(=O)c1cnn(-c2ccc(C)cc2)c1NC(=O)/C(C#N)=C/c1cccc(Cl)c1 1866130804 NPJFNQPYAUDBNZ-GZTJUZNOSA-N 434.883 4.557 50 10 IJGE C[C@@H](C(=O)NC(C)(C)C(=O)Nc1ccc(SC#N)cc1)c1ccc(Br)cc1 1866942857 ULKVHOUGDNCPOE-CYBMUJFWSA-N 446.370 4.659 50 10 IJGE C[C@@H](c1ccc(F)cc1Br)[C@H](CBr)NC(=O)OC(C)(C)C 1885095656 CPUPHWLPTCEMSQ-ZANVPECISA-N 425.136 4.980 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1cncc(Br)c1 1915773630 ILCGPLXKNCUVCK-UHFFFAOYSA-N 426.152 4.660 50 10 IJGE O=C(NC1(C(F)(F)F)CCC(Br)CC1)c1cscc1Br 1924734155 YKOCXNAHDNAHIE-UHFFFAOYSA-N 435.103 4.879 50 10 IJGE Brc1cccc(Br)c1CN1CCC[C@@H](Br)CC1 1945333681 TYEJLVLPYBRWIN-SNVBAGLBSA-N 425.990 4.961 50 10 IJGE CC1(C)OCCO[C@@H]1[C@H](Br)c1cc(Br)sc1Br 2013744701 OGEKLESEQJBWTC-RKDXNWHRSA-N 449.002 4.903 50 10 IJGE C[C@@H]1CC[C@@](CCl)(Nc2ncc(I)cc2Br)C1 2018683095 MTEZTWIHIGVGFS-PRHODGIISA-N 429.527 4.658 50 10 IJGE CC(C)[C@@H](Cl)c1cn(-c2ccc(I)c(Br)c2)nn1 2057426679 HTWOCQCZPBWFBL-GFCCVEGCSA-N 440.510 4.570 50 10 IJGE FC(F)c1cc(CCl)cc(I)c1I 2060235892 NHGBDACVTWIRQX-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1ccc(Br)cc1Cl 2081235314 DPVQUBDOYLXXES-PRHODGIISA-N 444.538 4.682 50 10 IJGE CCC[C@@H](CBr)CN=[S@@](=O)(CCNC(=O)OC(C)(C)C)c1ccccc1 2107397843 WXEDOQCPLLCNGB-YHAMSUFESA-N 447.439 4.849 50 10 IJGE CCN(C(=O)c1ccc(CBr)cc1)[C@@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C 2162915149 JJYRACZAFCYKBP-QZTJIDSGSA-N 439.394 4.737 50 10 IJGE CCc1sc(Br)cc1[C@H](Br)[C@@]12CCC[C@@H]1CS(=O)(=O)C2 2201881639 PRBNJAMGZWVLMP-BIGNPOOSSA-N 442.238 4.724 50 10 IJGE COCCO[C@@H]1[C@H](Br)C[C@H]1Oc1c(Cl)cc(Br)cc1Cl 2203012662 UPQKTOISOLOMQE-GGZOMVNGSA-N 448.966 4.702 50 10 IJGE CCc1nn(-c2ccc(OC)cc2CBr)c(CC)c1I 2235971950 ICAFVUNVNCMZJV-UHFFFAOYSA-N 449.130 4.505 50 10 IJGE CC(C)(C)OC(=O)NCCCC[S@](C)(=O)=NCCCCCCCBr 2252613281 RLJICSFQHCTCFN-DEOSSOPVSA-N 427.449 4.735 50 10 IJGE CC1CCN(C(=O)C(C#N)=C2S[C@@H](Cc3ccc(F)cc3)C(=O)N2c2ccccc2)CC1 2296557842 HZNQHBATLYLXQQ-QFIPXVFZSA-N 449.551 4.510 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@@H](Br)[C@H]1[C@@H]2CCO[C@@H]21 2313272378 NAMSQMASLSWLRX-UIMPLEPHSA-N 446.911 4.961 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Cl)c(I)c2)C[C@@H]1CBr 2315551337 PNOVDJFVBBOGGV-PWSUYJOCSA-N 442.566 4.798 50 10 IJGE C[C@H]1C[C@H](Br)[C@H](C)CN1Cc1ccc(Cl)c(I)c1 2315552326 CSDXDQCUWYWFNR-SCVCMEIPSA-N 442.566 4.938 50 10 IJGE COc1ccc(CC(=O)Oc2cccc(C=C(C#N)c3ccc(OC)c(OC)c3)c2)cc1 2320511517 ZYWPVGVDUDABJI-UHFFFAOYSA-N 429.472 4.925 50 10 IJGE CC1(C)C[C@@H](CBr)CN1Cc1cc(I)ccc1Cl 2327405644 DQBBSNZRMAHCKA-JTQLQIEISA-N 442.566 4.940 50 10 IJGE ClCc1nc(OCc2cc(Br)cc(Br)c2)ncc1Cl 2337101696 LUZHRRWQXUMARX-UHFFFAOYSA-N 426.923 4.973 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@](C)(CBr)C(C)(C)C)C[C@H]1C(F)(F)F 2352071516 HSNINTRTXGWNRS-SUMWQHHRSA-N 445.364 4.917 50 10 IJGE CN(C)c1ccnc(N2CCCC[C@@H](N(C)Cc3ccccc3)C2)c1CBr 2377480995 OSCUQEAHATXDDK-LJQANCHMSA-N 431.422 4.533 50 10 IJGE CC(C)C(=O)Nc1ccc(C(=O)NNC(=O)N2c3ccccc3Sc3ccccc32)cc1 13988938 GANNRUOYEMTPOX-UHFFFAOYSA-N 446.532 4.938 50 10 IJGE CCc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)cc1 38678275 CFOUNFFRMPOBQW-RUZDIDTESA-N 444.462 4.591 50 10 IJGE Cc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)N4c5ccccc5C[C@@H]4C)c(C)c32)cc1 40804557 GORWIEYORMIFTF-ZCZMWGMNSA-N 441.531 4.958 50 10 IJGE Cc1ccc(C)c(OCCCC(C)(C)C(=O)NNC(=O)COc2ccc(Cl)cc2C)c1 66201418 KXVMOGDGPCYTEW-UHFFFAOYSA-N 446.975 4.677 50 10 IJGE Cc1cccc(N2CCN(C(=O)[C@@H](Br)Cc3ccccc3Cl)CC2)c1C 96574358 QVDBWOMHDVSRRC-SFHVURJKSA-N 435.793 4.612 50 10 IJGE Brc1cccc([C@@H](CI)OC[C@H]2CCCCO2)c1 161965779 IOYSQNLTBJJTES-ZIAGYGMSSA-N 425.104 4.511 50 10 IJGE C[C@H]1CCC[C@](CCl)(NC(=O)c2cc(Cl)ccc2I)C1 235631452 POAJXRIDRIZFPK-BONVTDFDSA-N 426.125 4.862 50 10 IJGE CCOc1cccc(-c2cc(C(=O)NN=C/C(Br)=C/c3ccccc3)[nH]n2)c1 254701044 PNQMXFDWCSLROR-CIBUDKDISA-N 439.313 4.627 50 10 IJGE CC(=NNC(=O)c1ccco1)c1cccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2C)c1 254746001 ZGHVSTULTOWMPM-MRXNPFEDSA-N 439.899 4.801 50 10 IJGE O=C(Cn1c2ccccc2c(=O)c2ccccc21)NN=Cc1ccc(-c2ccc(F)cc2)o1 254906159 QDPFUBLPEMRSGD-UHFFFAOYSA-N 439.446 4.704 50 10 IJGE O=[N+]([O-])c1ccc(C[C@@H](Br)c2sccc2I)cc1 311225501 PMHSQJIAGOGTTM-SNVBAGLBSA-N 438.084 4.940 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCC[C@H](Br)CC1 383367169 XLDOLOBIBIOSPS-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE COc1cc(COc2c(Br)cc(CCl)cc2Br)sn1 401037586 IBFMVUKSZAWWPU-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE CCOc1ccc(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)Nc2c(C(C)=O)oc3ccccc23)cc1 744569581 FNSIMMPZBWBLFX-HZGBGQKMSA-N 446.459 4.511 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)OCc2nc(C(C)(C)C)cs2)c(C)n1C[C@@H]1CCCO1 756353581 UXUWWDNFDZYHSU-VBIXMBBUSA-N 427.570 4.688 50 10 IJGE CCOc1ccc(NC(=S)NNC(=O)C(Cc2ccccc2)Cc2ccccc2)cc1 799098490 LFFIEVPIGIVJET-UHFFFAOYSA-N 433.577 4.505 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2ccccc2OCc2cccc(C)c2)cc1 1083984122 XHQKQEHYJPQRSE-RUZDIDTESA-N 446.547 4.937 50 10 IJGE O=C(CC[C@H](O)c1ccccc1)NN=Cc1cn(Cc2ccc(F)cc2)c2ccccc12 1084180371 AUJNVJCPJQGHAR-VWLOTQADSA-N 429.495 4.793 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1SCC(=O)NN=C(C)CCCC 1084221573 VKFURNPDHWYGIU-UHFFFAOYSA-N 434.997 4.504 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cc(OCC(F)(F)F)c2ccccc2n1 1453774000 UQUQGZXNWITUAK-UHFFFAOYSA-N 445.426 4.539 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1)C(C)(C)C 1587242877 DDBRBWZQTPLSOD-ICFOKQHNSA-N 441.531 4.754 50 10 IJGE CC(C)(C)[C@H]1CCc2sc(C(=O)NNC(=O)c3ccc(-c4ccccc4)nc3O)cc2C1 1628467454 WIWXSUJXVGEZQN-KRWDZBQOSA-N 449.576 4.742 50 10 IJGE C=CCOc1ccc(Br)cc1NC(=O)NNC(=O)c1cccc2ccccc12 1670845730 SPOMWCLGSCPWLU-UHFFFAOYSA-N 440.297 4.634 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)N[C@H](CC(C)C)C(=O)Nc2ccc3ccccc3c2)cc1 1866126712 JIABUPGQWYFYJH-WNRWPCNTSA-N 441.531 4.925 50 10 IJGE CC(C)(C)OC(=O)NCCCCCC(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 1873795617 TVZRCXPKZBXZGM-OVVQPSECSA-N 439.556 4.801 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C[C@H]2Br)c(OC)c1Br 1910111761 MAPZTKLXILMFIT-MRTMQBJTSA-N 428.946 4.686 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1ccc(Br)c(O)c1 1915738889 UGASDIRRNUUNHR-UHFFFAOYSA-N 441.163 4.971 50 10 IJGE CC[C@@H](Br)CCNC(=O)c1cccc(Br)c1Br 1943886875 LDSCAOBIRGHMGT-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE C[C@H]1C[C@H](CBr)CN1Cc1cc(Cl)ccc1I 1950510332 LZAJMRSQEQYRJQ-VHSXEESVSA-N 428.539 4.550 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(O)c(Br)c1 1980635031 NLNIRAJJFUYBKF-OAHLLOKOSA-N 441.163 4.971 50 10 IJGE C[C@@H](NC(=O)c1ccc(Br)cc1Br)C(C)(C)CBr 2030084751 XKRHESVSYLAQEK-MRVPVSSYSA-N 441.989 4.751 50 10 IJGE Clc1ccc(I)c(CN2CC3(CC(CBr)C3)C2)c1 2066490483 IZSRUTNXLCNLAT-UHFFFAOYSA-N 440.550 4.552 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@@H]2CCC[C@]2(CBr)C1 2115939481 DWLJLYYSMQDWKA-SDBXPKJASA-N 427.589 4.801 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)c2ccc(CBr)cc2)n1 2138369919 XRIBBGUBMGBTNR-NSHDSACASA-N 440.363 4.876 50 10 IJGE O=C(c1cc(Cl)ccc1I)N1CCC[C@@H](CCCl)CC1 2149732307 APYALGOSIZQSBJ-NSHDSACASA-N 426.125 4.816 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@](CNC(=O)[C@H](Br)C2CCCC2)(C(C)(C)C)C1 2167031945 KOMVEXWQEHYNBT-IERDGZPVSA-N 445.442 4.730 50 10 IJGE Cc1cc(C(=O)NC[C@]2(CBr)C[C@H]2C(F)(F)F)c(Br)s1 2192582206 ACWLKYNREXPJFX-LDYMZIIASA-N 435.103 4.512 50 10 IJGE ClC[C@@H](CC1CCOCC1)NCc1cccc(Br)c1Br 2195479125 OADHTSKUDYQJCX-CYBMUJFWSA-N 425.592 4.725 50 10 IJGE O=C(c1cc(Cl)cc(Br)c1)N1CC[C@@H](C(F)(F)CBr)C1 2197764944 YCEXDUKEXKFOJC-SECBINFHSA-N 431.502 4.595 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@H]2COCCO2)c(C)c1Br 2220147544 IUDFZUIJBWUPLD-ZWNOBZJWSA-N 442.973 4.680 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1cc(C)c(Br)c(C)c1 2227416707 GRVOGNGSFIRSFW-TVQRCGJNSA-N 438.147 4.645 50 10 IJGE Cc1cc(C(=O)N2C[C@H](Br)CC23CCCC3)ccc1I 2241042284 ZCXYTGGTQBCGGP-CYBMUJFWSA-N 448.142 4.522 50 10 IJGE Cc1cc(F)c(Br)cc1[C@@H](Br)c1cc(S(C)(=O)=O)cs1 2285939833 RWWRNHZFRXXXSY-CYBMUJFWSA-N 442.169 4.846 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2[C@@]12C[C@@H]1CN(Cc1ccccc1)C2 2286081311 QYRUXNXBNDPJFU-QVKFZJNVSA-N 446.776 4.777 50 10 IJGE COc1ccc(Br)c2c1nc(CCCl)n2-c1cnn(Cc2ccccc2)c1 2286088966 XYYOGIIQVYUMNO-UHFFFAOYSA-N 445.748 4.823 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC[C@@H]2C[C@@H]3CC[C@H]2C3)C1 2298751491 MGJUTUZILHAWSG-DRMAHVMPSA-N 449.373 4.644 50 10 IJGE CC[C@@H](Br)c1nnc(-c2ccc(Cl)cc2I)o1 2301791275 BXZZEXYUNVPCTA-MRVPVSSYSA-N 427.467 4.841 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2cccc(Cl)c2)cc(Br)c1OC(C)=O 2313631758 VDLQLBJVTXXETA-UHFFFAOYSA-N 449.688 4.582 50 10 IJGE CCc1ccc(N2C(=O)[C@@H](Cc3ccc(C(C)C)cc3)SC2=C(C#N)C(=O)NC)cc1 2314592916 DOKQAWUAZFGGMU-JOCHJYFZSA-N 433.577 4.545 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)[C@@H]3CC[C@H]32)c(I)c1 2318524253 LYJLRIZEFTZIQM-SGMGOOAPSA-N 440.550 4.692 50 10 IJGE CCN1C(=O)CCc2cc(-c3csc(NC(=O)C(C#N)=Cc4ccccc4)n3)ccc21 2320934130 WHZYDCBHZKLFBE-UHFFFAOYSA-N 428.517 4.655 50 10 IJGE C[C@@H](Cl)[C@H]1CCCN(Cc2ccc(I)c(Br)c2)C1 2325214132 NNUSJNXLNFOHBX-PWSUYJOCSA-N 442.566 4.893 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@H](Br)[C@@H]2CC[C@@H]21 2327406904 NCSLFPMEUMHIPP-OBJOEFQTSA-N 440.550 4.692 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@@H]2CC[C@@H](Br)[C@H]1C2 2330967811 ZWWURSYFBDMXMT-QXFUBDJGSA-N 427.589 4.942 50 10 IJGE BrC[C@]12CCC[C@H](CN(Cc3ccc(I)cc3)C1)C2 2332621876 GNTCFRZYHMPKAZ-GOEBONIOSA-N 434.159 4.678 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Cl)c1c(Br)ncn1C 2337274468 IHBXEKWGLUEHRO-VIFPVBQESA-N 428.939 4.935 50 10 IJGE CC(C)CO[C@@H]1[C@@H](Cl)C[C@H]1OCc1ccc(Cl)cc1I 2365647026 GEIKBYVLAGFLBR-NWANDNLSSA-N 429.125 4.882 50 10 IJGE Cc1cc(C(=O)N2CCC[C@H](Br)[C@@H]2C(F)(F)F)sc1Br 2370241067 JNSIUNUGOKAHCG-IONNQARKSA-N 435.103 4.749 50 10 IJGE CCOC(=O)[C@@H]1[C@@H](c2cccs2)C(C#N)=C(SCc2ccc(Cl)cc2)N[C@@]1(C)O 19943533 NYJQMNSVNRMIKW-LQWHRVPQSA-N 448.997 4.645 50 10 IJGE COc1ccc(/C(C#N)=C\c2cccc(OC(=O)c3ccc4c(c3)OCO4)c2)cc1OC 31902931 JLIINDITTVFQKM-GRSHGNNSSA-N 429.428 4.716 50 10 IJGE O=C(CSc1nc2ccccc2[nH]1)N/N=C/c1ccccc1OCc1ccc(F)cc1 32520583 CSQHNUAPQIZQIU-DHRITJCHSA-N 434.496 4.523 50 10 IJGE CCc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(F)c2)cc1 38678279 CFOUNFFRMPOBQW-VWLOTQADSA-N 444.462 4.591 50 10 IJGE N#CC1=C(N)N2C(=C(C#N)[C@@H]1c1ccc(-c3ccccc3[N+](=O)[O-])o1)Sc1ccccc12 39794225 AFSZJIFXQKSICY-OAQYLSRUSA-N 439.456 4.993 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)CCCOc2ccc(C)cc2C)cc1 40990683 QOBZTQWOLWYODZ-OQKWZONESA-N 434.536 4.891 50 10 IJGE Cc1cc(C)nc(Sc2ccc(/C=C(/C#N)C(=O)Nc3ccccc3)cc2[N+](=O)[O-])n1 59219850 FMNZNBWLZDBGRW-BOPFTXTBSA-N 431.477 4.699 50 10 IJGE CN(Cc1ccc(Cl)s1)S(=O)(=O)c1ccc(CCl)cc1Br 91269867 DTODVJWWOZMQQO-UHFFFAOYSA-N 429.188 4.724 50 10 IJGE N#C/C(C(=O)Nc1ccc(F)cc1)=C1\S[C@H](Cc2ccccc2)C(=O)N1c1ccccc1 102694466 WFBDMLGIYWDYGW-FNBPXTNNSA-N 443.503 4.891 50 10 IJGE CC[C@@H](CSC)n1c(CCCl)nc2cc(I)c(F)cc21 133470930 JYAUEQCVCXFNSE-VIFPVBQESA-N 426.726 4.875 50 10 IJGE O=C(NN=Cc1c(OC(=O)c2ccccc2)ccc2ccccc12)c1ccc2c(c1)OCO2 254396771 DYGQIKUMSIALRO-UHFFFAOYSA-N 438.439 4.552 50 10 IJGE CCN(CC)C(=S)SCC(=NNC(=O)CSCc1ccccc1)c1ccccc1 254505805 UHXCJUFVYYYBGN-UHFFFAOYSA-N 445.679 4.800 50 10 IJGE O=S(=O)(c1ccc(Cl)c(CCl)c1Cl)N1CCCN(Cc2ccccc2)CC1 323923707 NJABTVDXTUKURO-UHFFFAOYSA-N 447.815 4.629 50 10 IJGE O=C(CBr)c1cc(OC(F)F)c(Br)c(OC(F)(F)F)c1 575680257 KOVLIQYPWBBRAU-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE Cn1ncc([C@H](Br)c2ccc(F)c(Br)c2F)c1Br 700971889 DFZPSDCWYGYQDN-MRVPVSSYSA-N 444.899 4.708 50 10 IJGE O=C(Nc1ccc(N2CCCC2)nc1)C(=O)Nc1cccc(S(F)(F)(F)(F)F)c1 765731129 YGDZLXMQCNUNFD-UHFFFAOYSA-N 436.406 4.916 50 10 IJGE Cc1ccc(C23C[C@H]4C[C@@H](CC(NC(=O)NN=Cc5ccc([N+](=O)[O-])cc5)(C4)C2)C3)cc1 1081167924 QXPQFXKSXUZSOR-JSZXIJHASA-N 432.524 4.827 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc(C)cc2)ccc1OC(=O)/C=C/c1ccccc1 1084502032 GIWROVZCMJJBIL-IRDOPXLVSA-N 428.488 4.776 50 10 IJGE O=C(NNc1ccccc1Cc1ccccc1)c1ccc2nc(O)n(CC(F)(F)F)c2c1 1469847304 UMPUGIWESRAWQB-UHFFFAOYSA-N 440.425 4.652 50 10 IJGE N#C/C(=C\c1ccc(Cl)cc1)C(=O)NC[C@@H](c1c(F)cccc1Cl)N1CCCC1 1866127827 HUVUWLXFZUHWKD-GRFAERAESA-N 432.326 4.993 50 10 IJGE CC(C)[C@@H]1[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C 1881095386 SYUGTMSYAMLDOU-SOUVJXGZSA-N 435.403 4.556 50 10 IJGE Cc1c(Br)c(CN(Cc2ccccc2)[C@H](C)CCBr)nn1C 1915082870 MJWODHHFQFIILC-CYBMUJFWSA-N 429.200 4.667 50 10 IJGE O=S(=O)(c1cccc2cccnc12)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915186467 LPSIUIQXCGVHND-IBGZPJMESA-N 445.382 4.599 50 10 IJGE Brc1ccccc1[C@H](CI)O[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21 1917452888 ILZHNYBOVDSZAP-UYMCQWGUSA-N 433.127 4.986 50 10 IJGE O=C(NCCCN(Cc1ccccc1)Cc1ccccc1)N1CCC(Br)CC1 1955785773 QNPOGANOOXLNPX-UHFFFAOYSA-N 444.417 4.648 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Cl)c2)[C@@H]1CBr 2026564554 UUAPGQSPKUCQJN-GFCCVEGCSA-N 428.539 4.550 50 10 IJGE C[C@H](CCBr)CCNC(=O)c1c(Br)cccc1Br 2033088456 IMYHHAPNYZQIDM-SECBINFHSA-N 441.989 4.753 50 10 IJGE CCCC(CBr)(CCC)CN=[S@]1(=O)CC[C@H](NC(=O)OC(C)(C)C)C1 2044700065 PHQGKHYXCTWQKG-MQNRADLISA-N 439.460 4.733 50 10 IJGE CC1CC(CBr)(NC(=O)c2cc(Br)cc(Br)c2)C1 2045118077 MIILIBHHPJMWGZ-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1ccc(Cl)cc1Br 2081235059 ATRXWCZYADUYRH-PRHODGIISA-N 444.538 4.682 50 10 IJGE CS(=O)(=O)c1csc([C@@H](Cl)c2ccc(I)c(Cl)c2)c1 2093077183 PHLNNOFZJBNQRE-LBPRGKRZSA-N 447.146 4.738 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CCCCCCCCCBr)CCCO1 2106784834 LNBQCBMCCPPFMJ-SFHVURJKSA-N 435.447 4.728 50 10 IJGE CCCC1(NC(=O)OC(C)(C)C)CCN(C(=O)[C@@H](Br)C2CCCC2)CC1 2110716532 YFJVLSNEQQOOHP-INIZCTEOSA-N 431.415 4.626 50 10 IJGE Br[C@H]1CN(Cc2ccc(I)cc2)CC12CCCCC2 2117742771 KBVWXPBEMAQYIC-HNNXBMFYSA-N 434.159 4.821 50 10 IJGE COc1ccc(S(=O)(=O)N(Cc2ccccc2)CC(C)(C)C)cc1CBr 2123269841 LBOMOIFCHMTNNB-UHFFFAOYSA-N 440.403 4.827 50 10 IJGE Cc1sc(Br)c(C(=O)N2CC[C@@H](Br)C(F)(F)CC2)c1C 2157250685 GGKMHZLVTONLEM-SECBINFHSA-N 431.140 4.762 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@H](OC)C[C@@H]1CNC(=O)OC(C)(C)C 2163060293 AOOVJLYMIUDKGM-MSOLQXFVSA-N 449.474 4.972 50 10 IJGE CO[C@@]1(CBr)CCCN(Cc2ccc(Cl)c(Br)c2F)C1 2166823377 FDYSVQHIQMPRGE-CQSZACIVSA-N 429.555 4.618 50 10 IJGE O=C(c1cccc(OCc2ccccc2)c1)N1CCC(COCCBr)CC1 2167391003 KUNVYBIKGDVVIW-UHFFFAOYSA-N 432.358 4.529 50 10 IJGE CCCc1nc(CC(CBr)(CBr)C2CCOCC2)cs1 2169854564 UCWFZIYVZORULB-UHFFFAOYSA-N 425.230 4.841 50 10 IJGE CO[C@H]1C[C@H](Oc2c(Br)cc(CCl)cc2Br)C[C@H]1OC 2187178025 QPWGXOSFVRZWTC-CGJHYDBRSA-N 428.548 4.522 50 10 IJGE ClC[C@@H](CC1CCOCC1)NCc1c(Br)cccc1Br 2195502499 XSYBPLPVBJJSMA-GFCCVEGCSA-N 425.592 4.725 50 10 IJGE Cc1sc([C@H](Br)[C@]23CCC[C@@H]2CS(=O)(=O)C3)c(C)c1Br 2201882917 QTONSBQCEUFFMI-SWHYSGLUSA-N 442.238 4.778 50 10 IJGE CCN[C@H](Cc1cc(Br)cc(Br)c1)[C@@H]1C[C@H]1Br 2252833811 ZETWPHLJUMJUKF-JHJVBQTASA-N 425.990 4.516 50 10 IJGE COc1ccc([C@H](Br)C2C[C@@H]3CC[C@H](C2)O3)cc1I 2269533538 FUKZHWOIOAJRRK-YEWTVFCHSA-N 437.115 4.693 50 10 IJGE COc1ccc([C@H](Br)c2ccc(OC)c(I)c2)cc1 2269552882 NOOBAHUUIJHILX-HNNXBMFYSA-N 433.083 4.793 50 10 IJGE C=CC[C@@]1(CBr)CCCCN1C(=O)c1cccc(I)c1 2287793000 PUCWGQGYAACDJA-INIZCTEOSA-N 448.142 4.627 50 10 IJGE C[C@H]1C[C@H](CBr)CN1Cc1cc(I)ccc1Cl 2307322848 SXLZZOYSRWEGGS-VHSXEESVSA-N 428.539 4.550 50 10 IJGE C[C@@H]([C@@H](Br)c1c(F)cc(Cl)c(Br)c1Cl)S(C)(=O)=O 2313742929 IGFUBBMJAOPQKU-RNHFCUEFSA-N 442.959 4.764 50 10 IJGE CC[C@@H](C)N(CCBr)C(=O)c1ccc(Cl)cc1I 2317765637 HAJYWYRQMQZFFP-SECBINFHSA-N 444.538 4.580 50 10 IJGE Cc1sc2nc(SCC(=O)C(C#N)=C3Nc4ccccc4S3)nc(O)c2c1C 2320729544 FUDPVXGPZMJQGX-UHFFFAOYSA-N 426.548 4.628 50 10 IJGE N#CC(=CNc1cc([N+](=O)[O-])ccc1Cl)C(=O)NC(c1ccccc1)c1ccccc1 2324825751 YMYKQTHJVMJATI-UHFFFAOYSA-N 432.867 4.973 50 10 IJGE C[C@@H](CCl)CC1CN(Cc2ccc(I)c(Br)c2)C1 2325211731 KSOUVCZWOFJLEV-SNVBAGLBSA-N 442.566 4.751 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)C(C#N)=CNc1ccccc1Br 2325309824 DRJXKLFKEJUUHX-UHFFFAOYSA-N 442.313 4.864 50 10 IJGE C[C@@H]1CN(Cc2cc(I)ccc2Cl)C[C@]1(C)CBr 2327398375 CUYJRPMNZMPESJ-YGRLFVJLSA-N 442.566 4.798 50 10 IJGE COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)C(C#N)=Cc1ccc(C)cc1 2329631799 MGLMQCXJVNWPCG-UHFFFAOYSA-N 441.487 4.810 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@]12CCC[C@@H](CN(C[C@]3(CBr)CC3(F)F)C1)C2 2351885273 HSWMQASPWRITLO-ZTFGCOKTSA-N 437.369 4.518 50 10 IJGE Fc1c(Br)cc(Cl)c([C@H](Cl)[C@@H]2CO[C@@H]3COC[C@H]32)c1Br 2362230962 CGCKSJGRCGDCIN-ZVANUSFQSA-N 448.941 4.945 50 10 IJGE Cc1cc(Br)c(C(=O)N2CCC[C@@H](Br)[C@@H]2C(F)(F)F)s1 2370262501 WOFXBGKCYMFIKD-GMSGAONNSA-N 435.103 4.749 50 10 IJGE CC[C@H](C)Oc1cccc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)c1 10661743 IENLJGXOVPRFMG-AWEZNQCLSA-N 439.339 4.791 50 10 IJGE CCCOc1ccccc1C(=O)NNC(=O)[C@H](CC)Oc1ccc(-c2ccccc2)cc1 14768947 BOFXVLMKIHLKRR-QHCPKHFHSA-N 432.520 4.761 50 10 IJGE COc1cc(/C=C(/C#N)c2nc3ccccc3[nH]2)ccc1OCC(=O)Nc1cccc(F)c1 50568353 MYIGVRLXNJLMMN-BOPFTXTBSA-N 442.450 4.792 50 10 IJGE COc1ccc([C@H](C(=O)NC2CCCCC2)N(C(=O)CCl)c2ccc(F)cc2)cc1 97914339 ALRIEJMXQBBEDJ-JOCHJYFZSA-N 432.923 4.596 50 10 IJGE CSc1ccc(Cl)cc1CC(=O)N/N=C\c1ccc(OC(=O)c2ccccc2)cc1 169922849 VOLMSKBYPQTFLA-MYYYXRDXSA-N 438.936 4.974 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CBr)OCc1ccccc1Br 231319553 PZOALGZEZYEEOK-MRXNPFEDSA-N 437.172 4.644 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3ccc(O)cc3)n2C2CCCCC2)cc1 254485752 CZHLYJNRLOIDEN-UHFFFAOYSA-N 449.580 4.707 50 10 IJGE O=C(N[C@@H](CCl)Cc1ccccc1)c1scc(Br)c1Br 705418901 MLMVGQJYVRSJSB-SNVBAGLBSA-N 437.584 4.853 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1C(=O)c1scc(Br)c1Br 705440494 AWTRGDCAUTXZIS-RNFRBKRXSA-N 446.002 4.661 50 10 IJGE Cc1cccc(COc2cccc(C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)c2)c1 736693562 MACXRROMEJBAEG-UHFFFAOYSA-N 439.519 4.800 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2Cl)c1C 736694129 OWLAAPYBKGEDKJ-SJORKVTESA-N 428.323 4.709 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NCc2ccc3sccc3c2)c(-c2ccccc2)n1 752948676 ADVOTLQTSDYTMJ-STZFKDTASA-N 437.528 4.902 50 10 IJGE CCC(C)=NNC(=O)COc1ccc2cc(Br)ccc2c1Br 1084605675 UDBMORSRYCNUTL-UHFFFAOYSA-N 428.124 4.646 50 10 IJGE CC(=O)c1cc(NC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)ccc1C 1673137354 DVIWJBJBXJPDLD-INIZCTEOSA-N 427.570 4.877 50 10 IJGE Cc1c(C(=O)NCCc2ccccc2)oc2c1C(=NNC(=O)c1ccccc1Cl)CCC2 1772744552 WTEGHHMQBZZFCC-UHFFFAOYSA-N 449.938 4.684 50 10 IJGE C[C@@H](Br)C(=O)c1ccc(SC(F)(F)F)c(I)c1 1848425897 PAWQVUQEXUNVER-RXMQYKEDSA-N 439.034 4.869 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1cccc(OC)c1)C(C#N)=C(N)O2 1865711964 MJNYHQIWVKIQFC-FQEVSTJZSA-N 438.890 4.513 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)N(C)C[C@H]2C[C@@H](Br)C2)cc1 1887828883 BTAABNPUOJPLIH-GRDNDAEWSA-N 425.367 4.518 50 10 IJGE O=S(=O)(c1ccccc1Br)N(Cc1ccccc1)[C@H](CCl)C1CC1 1915216796 KGKVNXHNKQIXMB-QGZVFWFLSA-N 428.779 4.657 50 10 IJGE O=C(c1ncccc1Br)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915311329 DTUTUDVDCLGVPQ-MRXNPFEDSA-N 438.163 4.660 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)Cc1ccc2ccccc2c1 1916348452 OBZJYCQODJNNRY-JOCHJYFZSA-N 426.354 4.821 50 10 IJGE C[C@@H]1CC[C@H](O[C@](C)(CI)CNC(=O)OC(C)(C)C)[C@H](C)C1 1932262663 XHINTQMTUNXDMU-VWPFQQQWSA-N 425.351 4.546 50 10 IJGE BrCCN(Cc1cccc(Br)c1Br)C1CCC1 1943882078 UOTFIYVUNAQDGT-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1F 2008322344 SHNVZKIJNUUGJS-CQSZACIVSA-N 434.758 4.844 50 10 IJGE F[C@@H]1CC[C@H]([C@@H](Br)c2cc(I)cc3c2OCC3)C1 2032983175 DNQLSQNZXULSLL-IYYTYJHQSA-N 425.079 4.800 50 10 IJGE CC(C)[C@H](CBr)CN1CCC[C@H](N(CC(F)F)C(=O)OC(C)(C)C)C1 2044698299 AUPHPBKNTNBKBF-CABCVRRESA-N 427.374 4.620 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Cl)c2)CC[C@@H]1Br 2086657833 IOJXDPDFPBLABS-ZDUSSCGKSA-N 442.566 4.940 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2[C@@]12C[C@H]1CN(Cc1ccccc1)C2 2099677869 CWAHLRKKAPJYJA-VBKZILBWSA-N 434.740 4.908 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CC2(CBr)CCCCC2)CC12CCC2 2106781702 KIURKKQBTNOARN-KRWDZBQOSA-N 429.443 4.959 50 10 IJGE CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C[C@@H](Br)C(F)(F)F)C2)CC1 2106785151 ARRYQZVFDAORSL-LSDHHAIUSA-N 443.348 4.671 50 10 IJGE CC[C@]1(CNC(=O)[C@H](Br)C2CCCC2)CCCCN1C(=O)OC(C)(C)C 2110723811 OWLDNGHYFKWHAS-OXQOHEQNSA-N 431.415 4.626 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1C1CCN(C[C@H](CBr)CC2CC2)CC1 2112868199 HATOYQYVFVOVFT-PKOBYXMFSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCCN1C(=O)[C@@H](Br)C1CCCC1 2167031580 JCMBXNNZOHULSO-KURKYZTESA-N 443.426 4.721 50 10 IJGE CC[C@@H]1CC[C@H](N(C)S(=O)(=O)c2cc(CBr)sc2Br)C1 2206136240 IBRFWABVGUHISD-ZJUUUORDSA-N 445.242 4.605 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@@H]1CCCCN1C(=O)c1ccc(CBr)cc1 2208161524 DHCJRWILYOBQIT-KRWDZBQOSA-N 439.394 4.880 50 10 IJGE Cc1cc(Br)c([C@@H](Br)[C@H]2CCS(=O)(=O)C2)c(C)c1Cl 2224317817 QZNMHPPAMIPGML-CABZTGNLSA-N 430.589 4.590 50 10 IJGE CS(=O)(=O)C1([C@H](Cl)c2cc(Br)c(Br)cc2F)CCC1 2225635572 WGVVHBXLRXWCRW-LLVKDONJSA-N 434.552 4.598 50 10 IJGE COc1cccc(C=C(C#N)c2ccc([N+](=O)[O-])cc2)c1OCc1cccc(C(=O)O)c1 2297368549 QRCUKVSJXAVOSE-UHFFFAOYSA-N 430.416 4.945 50 10 IJGE Clc1ccc(CN2CCCC[C@@H]2CBr)c(I)c1 2302315009 DQFMGXXRUIUMBD-GFCCVEGCSA-N 428.539 4.694 50 10 IJGE CN(Cc1ccc(Cl)cc1I)CC1CC(Br)C1 2302325544 IITQFRHCYCSZFK-UHFFFAOYSA-N 428.539 4.550 50 10 IJGE C=CCC[C@H](CCl)NCc1ccc(I)c(Br)c1 2306216142 CFFKMMDOKHVCEI-LLVKDONJSA-N 428.539 4.717 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1Cc1cc(I)ccc1Cl 2307325695 CUXYIVOXAKIUAA-BXKDBHETSA-N 428.539 4.692 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc(OC)c1OC 2314571303 CYBAZHLGUVKZDZ-UHFFFAOYSA-N 440.805 4.930 50 10 IJGE CCCCCCCOc1ccc(C=C2C(=O)N(C[C@H]3CCCO3)C(=O)C(C#N)=C2C)cc1 2314617761 AFNGADLKZWDVLB-JOCHJYFZSA-N 436.552 4.807 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)cc2I)CC[C@H]1CBr 2318556792 DTBJFJGMSLVYCP-QWRGUYRKSA-N 442.566 4.798 50 10 IJGE Cc1c(Cl)cccc1NC(=O)C(C#N)=CNc1ccc(I)cc1 2324331538 FSILQAFGBRZSDO-UHFFFAOYSA-N 437.668 4.711 50 10 IJGE CC[C@@H](NC(=O)C(C#N)=CN1CCN(c2ccccc2F)CC1)c1ccc2c(c1)CCCC2 2325092638 COMZEHRVBMDZEH-RUZDIDTESA-N 446.570 4.501 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(Cc2cc(I)ccc2Cl)[C@@H]1C 2327409347 NFPYAWOBPGXGAV-CWSCBRNRSA-N 442.566 4.938 50 10 IJGE CCCCCOc1ccc(/C=N/NC(=O)CSc2nc3ccccc3[nH]2)cc1OCC 32520567 VVQSRHXOSHYUCD-BUVRLJJBSA-N 440.569 4.773 50 10 IJGE CC[C@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)N/N=C/c1cccc(Oc2ccccc2)c1 96557030 LHTDVZYQGDZNQS-WTWNSAIRSA-N 429.520 4.774 50 10 IJGE CCCOc1c(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccccc4)nc3c2)cccc1OC 169925714 STPPTGZAGWYEMG-PKAZHMFMSA-N 442.519 4.715 50 10 IJGE C/C(C=NNC(=O)CSc1nnc(-c2ccccc2)n1C)=C\c1ccc(C(C)C)cc1 254738988 PYWLXCFKMPMBFS-PKTFGXERSA-N 433.581 4.903 50 10 IJGE CC[C@@H](NC(=O)c1cc(Br)c(Br)s1)[C@@H](C)Br 395706514 OHVGGBFPKZXDTG-IYSWYEEDSA-N 433.991 4.565 50 10 IJGE O=C(N[C@H]1CCC[C@H](Br)C1)c1cc(Br)cc(Br)c1 694505950 MJJIVRHYXYXBDE-CABZTGNLSA-N 439.973 4.648 50 10 IJGE Cc1ccc2nc(CCl)n(CC3(N(Cc4ccccc4)Cc4ccccc4)COC3)c2n1 705864015 IGMFXCFZOIUBSL-UHFFFAOYSA-N 446.982 4.950 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2ccc(-c3nc[nH]n3)cc2)c(C)n1-c1ccc(F)cc1 732158949 AQKPWDMSYKHUGN-UNOMPAQXSA-N 426.455 4.564 50 10 IJGE C[C@H]1C[C@H](C)CC[C@@H]1NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 733113890 HIFUKWCPAUMOOU-YLODGXIDSA-N 435.959 4.965 50 10 IJGE CC(C)(C)OC(=O)c1ccc(/C=C(/C#N)C(=O)Nc2nc(-c3ccncc3)cs2)cc1 764888533 RBIGUGSQCQDJOS-PDGQHHTCSA-N 432.505 4.706 50 10 IJGE N#C/C(=C\c1ncc(-c2ccccc2)s1)C(=O)Nc1nc(-c2ccc(O)c(O)c2)cs1 770564971 DDIBZIUHQMBJFX-OQLLNIDSSA-N 446.513 4.890 50 10 IJGE O=C(NS(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1)C1CCC(F)(F)CC1 783464933 KTOLHSAOLMNQKP-UHFFFAOYSA-N 429.379 4.974 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CCn4c(C(C)C)nnc4[C@@H]3C)c2C)cc1 784697866 FAKLJQFZKHXVLZ-ALFKQNEGSA-N 442.567 4.628 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)COc1ccc(C)c(C)c1)c1ccc(C(F)(F)F)cc1 1670827368 WOYLNENPZQVWLZ-FQEVSTJZSA-N 449.473 4.739 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccc(OC)c2)CCC3)cc1 1772747134 LINITDPGDDITNN-UHFFFAOYSA-N 446.503 4.849 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1cncc(Br)c1 1915126768 PBKMKMFGYNWIFV-HNNXBMFYSA-N 426.152 4.660 50 10 IJGE Brc1cccc([C@H](CI)O[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1 1917453379 MIDPWRSDKJKCFZ-QKRFXLAJSA-N 433.127 4.986 50 10 IJGE CC[C@H](NC(=O)c1csc(Br)c1Br)[C@H](C)Br 1937736917 BOCYIXMWEDQGAF-FSPLSTOPSA-N 433.991 4.565 50 10 IJGE CCC(CC)(CBr)NC(=O)c1csc(Br)c1Br 1945189730 YOAUDWIGQUTMKF-UHFFFAOYSA-N 448.018 4.957 50 10 IJGE C[C@@H]1C[C@@H]1N(CCBr)C(=O)c1csc(Br)c1Br 2002026024 IDELYSVBJLKJDC-SVRRBLITSA-N 446.002 4.519 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1ccccc1OCc1ccccc1 2023033770 KVARUVYCFIFZEP-CRAIPNDOSA-N 437.321 4.845 50 10 IJGE C[C@H](CCBr)CCN1CCN(C(=O)OC(C)(C)C)CC[C@@H]1C(F)(F)F 2044701995 XRYHYCRGLZZVPK-ZIAGYGMSSA-N 431.337 4.671 50 10 IJGE CC(C)(C)OC(=O)N[C@H](C[S@@](C)(=O)=NCC1(CBr)CCC1)C(C)(C)C 2044706530 VBYJQPOLEXXBBJ-DLUDVSRJSA-N 439.460 4.589 50 10 IJGE C[C@]1(CCBr)CCN(Cc2cc(Cl)ccc2I)C1 2068170125 UQMNWQFHTFSVII-AWEZNQCLSA-N 442.566 4.942 50 10 IJGE C[C@]1(F)C[C@H]([C@H](Br)c2cc(I)cc3c2OCC3)C1 2077791650 AEBPHEGTBBOPQL-WFBYXXMGSA-N 425.079 4.800 50 10 IJGE C[C@]1(CCBr)CCN1C(=O)c1cccc(Br)c1Br 2084701098 TYVXGZVSRDIILB-ZDUSSCGKSA-N 439.973 4.601 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(F)c(NS(=O)(=O)CCC(CCl)CCl)c1F 2162592932 ZESKRVIYESLUBD-UHFFFAOYSA-N 447.331 4.537 50 10 IJGE CN(C(=O)c1ccc(I)c(Cl)c1)[C@H]1CCCCC[C@@H]1Cl 2172547478 NZPMHTCECQXPBP-FZMZJTMJSA-N 426.125 4.957 50 10 IJGE CCn1ncc(Br)c1[C@H](Cl)c1cc(Br)c(OC)cc1F 2202902676 UCLDHHCJGFUQKA-GFCCVEGCSA-N 426.511 4.904 50 10 IJGE CC[C@@H]1CCN(CCCCCI)[C@H](CNC(=O)OC(C)(C)C)C1 2211188211 YYMMZOZSRWZETA-CVEARBPZSA-N 438.394 4.607 50 10 IJGE Cc1sc(Br)c(C)c1[C@@H](Br)c1nn(C)nc1Br 2214373851 UTCQNFAORUHQKY-SSDOTTSWSA-N 443.990 4.503 50 10 IJGE C[C@@H]1C[C@H](Br)[C@@H](C)N(c2ncc(Br)cc2Br)C1 2214807603 FDMZOJXFODIOKS-MRTMQBJTSA-N 426.978 4.605 50 10 IJGE Br[C@H]1C[C@@H](OCCOCCOCCOCc2ccccc2)C12CCCCC2 2236088532 IGWHWDYSBCDPOL-LEWJYISDSA-N 441.406 4.739 50 10 IJGE Br[C@H]1CCC2(CCN(Cc3ccc(I)cc3)CC2)C1 2272374933 SZJQLSRKFBGUOI-AWEZNQCLSA-N 434.159 4.821 50 10 IJGE C[C@@](CCl)(NCc1ccc(I)c(Br)c1)C1CC1 2306221283 GEFBCUCCVFUBRJ-ZDUSSCGKSA-N 428.539 4.551 50 10 IJGE FC1(F)CC[C@H]1CO[C@H](CI)c1cccc(Br)c1 2313727040 RXHFZTARXVOXJU-CMPLNLGQSA-N 431.058 4.987 50 10 IJGE N#CC(=Cc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)C(=O)NC[C@H]1CCCO1 2313738406 ATZUATLKZLYPMV-LJQANCHMSA-N 431.319 4.775 50 10 IJGE COc1cc(C=C2C(=O)N(Cc3ccccc3)C(=O)C(C#N)=C2C)ccc1OCCC(C)C 2314610374 GWKIXNYURHEHKF-UHFFFAOYSA-N 444.531 4.913 50 10 IJGE CC[C@@H](CCCBr)NC(=O)c1ccc(Cl)cc1I 2317772736 GQJJWFIKKINFIQ-JTQLQIEISA-N 444.538 4.628 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)cc2I)C[C@H]1CBr 2318541433 TVTSSTJNDQPGAZ-LLVKDONJSA-N 442.566 4.798 50 10 IJGE CCC[C@@H]1CC[C@@H](Br)[C@H](Cc2nn(C)cc2I)C1 2319222457 CYBZFPJBJVJPRU-GRYCIOLGSA-N 425.152 4.547 50 10 IJGE N#CC(C(=O)Cn1cnc2sc(-c3ccccc3)cc2c1=O)=C1Nc2ccccc2S1 2320729564 MUFDSZIUHAGZLC-UHFFFAOYSA-N 442.525 4.647 50 10 IJGE C[C@@H](NC(=O)C(C#N)=CNc1cc([N+](=O)[O-])ccc1Cl)C12CC3CC(CC(C3)C1)C2 2324900420 CHIWXBDOEPKOKS-ZHHULCEESA-N 428.920 4.789 50 10 IJGE CN1CCc2nc(NC=C(C#N)C(=O)Nc3ccccc3Sc3ccccc3)sc2C1 2325339403 OZOLPVZCJLFAAB-UHFFFAOYSA-N 447.589 4.740 50 10 IJGE COc1ccc(C=C(C#N)C(=O)NCC2(c3ccc(Cl)cc3Cl)CC2)cc1OC 2329701088 HFPWPRZEYMUTTG-UHFFFAOYSA-N 431.319 4.766 50 10 IJGE CN(N/C(=C\C#N)NC(=O)Nc1ccc(Cl)cc1)c1ncc(C(F)(F)F)cc1Cl 3134975 LSQDSRGVYWWZIM-NSIKDUERSA-N 445.232 4.535 50 10 IJGE C/C(=N\NC(=O)CNC(=O)C(c1ccccc1)c1ccccc1)c1ccc(C(C)C)cc1 4402263 WAORKBGZDVTAAJ-ZTKZIYFRSA-N 427.548 4.599 50 10 IJGE C/C(N)=C(/C#N)C(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(C)cc1)CC2 25460265 DHTDSQDAYPQERK-JZBDQPIKSA-N 437.499 4.512 50 10 IJGE COc1cccc(/C=C(/C#N)C(=O)Nc2ccc(C(=O)O)cc2)c1OCc1ccc(F)cc1 33422700 CDAFPIWMDVOIAJ-UYRXBGFRSA-N 446.434 4.657 50 10 IJGE Cc1ccc(C(=O)NNc2ncnc(Nc3cc(Cl)ccc3Cl)c2[N+](=O)[O-])cc1 40646572 UPZWFMHFUZNEBA-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE CCOc1ccccc1/C=N/NC(=O)COc1cc(C)c(Cl)c(C)c1Br 40950732 FSVSYLJEJHMTHW-LSHDLFTRSA-N 439.737 4.647 50 10 IJGE Cc1ccc(-n2nc(C)c(/C=N/NC(=O)COc3ccc(Cl)cc3Cl)c2C)c(C)c1 59165537 VUHAPDOEJHDABE-OPEKNORGSA-N 445.350 4.942 50 10 IJGE CC(C)(C)OCCO[C@@H](CI)c1cccc(Br)c1 162577163 JIBMRWRKPZUKQJ-ZDUSSCGKSA-N 427.120 4.757 50 10 IJGE N#C/C(=C/NC[C@H]1COc2ccccc2O1)C(=O)Nc1ccccc1Sc1ccccc1 217243936 XRNSNNVJNZVIJF-VZWFDDOASA-N 443.528 4.613 50 10 IJGE Cc1cc(I)ccc1NC(=S)Nc1ccc(SC#N)cc1 243420497 MTIBOLNQNOIBBL-UHFFFAOYSA-N 425.320 4.982 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CCC[C@H](Br)CC1 378671083 DBBSKONLMWDFPJ-VIFPVBQESA-N 439.973 4.601 50 10 IJGE CC[C@@H](Br)[C@H](C)NC(=O)c1cc(Br)c(Br)s1 395374454 QIPFMVROOYPFTI-NTSWFWBYSA-N 433.991 4.565 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Cn1c(CCl)nc2cc(Br)cnc21 708510690 UVRWHLIDYKJWRK-GDBMZVCRSA-N 433.781 4.701 50 10 IJGE CC(C)C[C@H](NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1cccc(C(F)(F)F)c1 726797619 ODAGDIXLHCOJJI-IBGZPJMESA-N 446.473 4.929 50 10 IJGE CC(=NNC(=O)CCCc1cccs1)c1ccc(OCC(=O)Nc2ccccc2)cc1 732529413 JPHYGTUKCUHOMG-UHFFFAOYSA-N 435.549 4.629 50 10 IJGE O=C(Cc1cccc2ccccc12)NN=C1C(=O)N(Cc2ccccc2F)c2ccccc21 1084218663 VNAIWWXXGGMDNH-UHFFFAOYSA-N 437.474 4.589 50 10 IJGE O=C(NN=Cc1ccc(OCc2ccccc2)cc1)C(=O)Nc1cccc(Cl)c1Cl 1084493073 SDLLUAGIWLHXHY-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE C=CCNC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccccc2F)c1C 1531504997 QXFAISURRWXRKI-HKWRFOASSA-N 442.494 4.695 50 10 IJGE COc1ccc(CC(=O)Oc2cccc(/C=C(\C#N)c3ccccc3OC)c2)cc1OC 1615067234 KYPJEQBEBSUPAF-DEDYPNTBSA-N 429.472 4.925 50 10 IJGE C#Cc1cccc(N(C)C(=O)CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)c1 1627085928 MJVKOUZLIJGTBE-UHFFFAOYSA-N 441.647 4.597 50 10 IJGE C=CCn1c(SCC(=O)NNc2ccc(Cl)c(C)c2)nnc1-c1ccc(Cl)cc1 1634261476 XNJGEFDJZNYDIY-UHFFFAOYSA-N 448.379 4.982 50 10 IJGE Cc1c(C(=O)N2CCCCCC2)oc2c1C(=NNC(=O)c1cccc(Cl)c1)CCC2 1772746471 VTQBCPZZWLGPEL-UHFFFAOYSA-N 427.932 4.728 50 10 IJGE O=C(/C=C/c1cccc(F)c1)N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21 1860823009 URJFKQIBDGGVRS-CPCVUTPYSA-N 433.870 4.560 50 10 IJGE CCCc1nn(Cc2ccccc2)c2c1[C@@H](c1ccc(OCC)c(OC)c1)C(C#N)=C(N)O2 1865694865 DKANZNCCRWESKS-QHCPKHFHSA-N 444.535 4.509 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1 1866365610 KTBNCSMJWVGJFS-LKUDQCMESA-N 437.543 4.536 50 10 IJGE N#C/C(=C(/O)CNC(=O)c1ccc(Cl)cc1)c1nc(-c2ccc(F)c(F)c2)cs1 1872751354 DDWLSKJPDDHNIC-JXAWBTAJSA-N 431.851 4.964 50 10 IJGE ICC1(OCc2cccc(I)c2)CCCC1 1902241006 MOHJCIMGEOHENL-UHFFFAOYSA-N 442.078 4.556 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@H](C)N(C(=O)OCc2ccccc2)[C@@H](C)C1 1905533905 ZHOGIWKHWDFXBC-CMKODMSKSA-N 425.411 4.775 50 10 IJGE C[C@H](CCCCBr)NC(=O)c1csc(Br)c1Br 1945186542 JLBNIYDPOCNMEE-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCCC[C@H](Br)C1 2003410951 WWKPUYODYGUVFC-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1C(=O)c1scc(Br)c1Br 2018124035 VYUOPUACMFUXEG-SVRRBLITSA-N 446.002 4.661 50 10 IJGE BrC[C@@H]1C[C@@H]2CCC[C@H]2N1c1ncc(Br)cc1Br 2046157274 LVOBCBPYPZIUAW-PTOFAABTSA-N 438.989 4.749 50 10 IJGE CC1(C)C[C@@H](Br)CN(Cc2ccc(I)c(Cl)c2)C1 2086657208 CBCIIPDJGKFQHG-LLVKDONJSA-N 442.566 4.940 50 10 IJGE C[C@@H](Br)c1ccccc1NS(=O)(=O)c1cscc1Br 2087628915 HXJPHCAQXNRJTN-MRVPVSSYSA-N 425.167 4.767 50 10 IJGE ClCCCCc1cn(-c2ccc(Cl)c(I)c2Cl)nn1 2116798199 YMUJXUTXGLTPCP-UHFFFAOYSA-N 430.504 4.740 50 10 IJGE CN(C(=O)c1csc(Br)c1Br)[C@@H](CCCl)C(F)(F)F 2121996696 SRGJGPSKJMBYEY-LURJTMIESA-N 443.510 4.905 50 10 IJGE CC(C)(C)OC(=O)NC1(C2CCN(C(=O)[C@H](Br)C3CCCC3)CC2)CCC1 2167030392 BENPDJQBCQYPEV-QGZVFWFLSA-N 443.426 4.626 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1CC[C@H](C(F)(F)CCl)C1 2197765269 AVRXIZMVXMLRGF-QMMMGPOBSA-N 431.502 4.548 50 10 IJGE Cc1nn(C)c(Br)c1[C@H](Cl)c1c(F)cc(F)c(Br)c1F 2236108220 JASARNZRSRNVBW-JTQLQIEISA-N 432.465 4.999 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1 2242382842 LUAMZZPUMTWXFA-YNEHKIRRSA-N 430.895 4.697 50 10 IJGE C=CCC1(CBr)CCN(C[C@H]2CC2(Br)Br)CC1 2250411890 ZOGQJXHUQWKBFV-LLVKDONJSA-N 430.022 4.546 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@H](Br)c1cn(C)nc1Br 2264375293 QNURBAJZBFMNET-NSHDSACASA-N 428.939 4.982 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@H]3CCCN(C(=O)OC(C)(C)C)[C@@H]3C2)C1 2345005083 TZGDZUDFVANYRG-IAGOWNOFSA-N 429.443 4.909 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@@H](C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)C1 2353830107 JQWDGJWTPGHUBP-RBSFLKMASA-N 445.364 4.679 50 10 IJGE CC(C)(C)OC(=O)N1CCOC2(CCN(C[C@](C)(CBr)C(C)(C)C)CC2)C1 2380185769 FPYSPMNPIIRFEO-FQEVSTJZSA-N 447.458 4.536 50 10 IJGE CCOc1ccccc1/C=N/NC(=O)COc1ccc2ccccc2c1Br 12575840 VKQCEEZUUTZAFC-YDZHTSKRSA-N 427.298 4.530 50 10 IJGE COc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(Cl)c4)ccc32)c1 38650226 JMEQVOSTURDEBO-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccco4)ccc32)cc1 38650795 IRDDCISTFNAXLN-HSZRJFAPSA-N 430.460 4.896 50 10 IJGE C=CCOc1ccc(-n2c(C)cc(/C=N\NC(=O)CC[C@H](O)c3ccccc3)c2C)cc1 58890780 NIVFXKFXHSCQGK-MYSISXQJSA-N 431.536 4.623 50 10 IJGE O=C(NC[C@H](c1ccccc1)N1CCCC1)[C@H](Br)Cc1ccccc1Cl 96568399 KBFBQYDRGNTRKT-UYAOXDASSA-N 435.793 4.599 50 10 IJGE CCOc1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCc1cc(C)ccc1C 169879700 OLNFYKANPHCOBG-CVKSISIWSA-N 447.491 4.953 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C\c2ccccc2OCC)c(OCC)c1 206999371 QNARZRCPTVOJFR-NSIHFGEUSA-N 435.476 4.573 50 10 IJGE CCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C/c2ccccc2OCCC)c(OC)c1 207004461 QPQSETPZWGSAEL-GQWRFYPMSA-N 448.519 4.536 50 10 IJGE C[C@@H]1CCC[C@@H](C)N1/C=C(/C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 216498680 IPDGRCWTWVYUKB-UZRVMHOGSA-N 442.607 4.591 50 10 IJGE O=C(CCCCCCC(=O)NN=C/C=C\c1ccccc1)NN=C/C=C\c1ccccc1 254753919 UVOGTJZFSNQHRF-GECYVQOXSA-N 430.552 4.958 50 10 IJGE O=C(Cc1csc(Nc2cccc(C(F)(F)F)c2)n1)NN=Cc1ccc([N+](=O)[O-])cc1 254834353 DYHBLDMWWJFQQX-UHFFFAOYSA-N 449.414 4.507 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N2[C@H]3CC[C@H]2CC(O)C3)c(C)n1-c1cccc2ccccc12 303808250 URQYXYJFHGZJAW-VFRRKDQGSA-N 425.532 4.669 50 10 IJGE C[C@H](Br)CC(C)(C)CNS(=O)(=O)c1c(Cl)cccc1Br 393588413 ZUYNAUPHIQJDBW-VIFPVBQESA-N 447.620 4.581 50 10 IJGE C[C@H]1C[C@H](Br)CCN1C(=O)c1cc(Br)sc1Br 705491826 TXBDHPQIMDVUAA-NKWVEPMBSA-N 446.002 4.661 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H](C)C1CCC1)C(=O)OC(C)(C)C 719774206 FLFADVPGZPNYSR-GUYCJALGSA-N 425.351 4.642 50 10 IJGE Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)NNC(=O)c3ccc(Cl)cc3)s2)cc1 730914494 QJBDRCWAKGXICV-AWEZNQCLSA-N 428.945 4.786 50 10 IJGE CCCOc1ccccc1[C@H](CC(C)C)NC(=O)NNC(=O)c1cccc2cccnc12 746427350 WVHCFBHMGMKOIJ-NRFANRHFSA-N 434.540 4.755 50 10 IJGE Cc1ccc(SCc2cccc(C(=O)NNc3ccc(S(C)(=O)=O)cc3)c2)c(C)c1 748146361 ASCZJQSPEVNLRU-UHFFFAOYSA-N 440.590 4.756 50 10 IJGE O=C(/C=C(/c1ccc(Cl)cc1)C(F)(F)F)NNC(=O)Nc1ccc(OC(F)F)cc1 802045864 ZOYMYULWUMURKA-ZROIWOOFSA-N 449.763 4.740 50 10 IJGE CCOc1ccc(Br)cc1C=NNC(=O)[C@H](C)Oc1ccc2ccccc2c1 1084160063 VUTNBURGIXNQAK-HNNXBMFYSA-N 441.325 4.919 50 10 IJGE Cc1cc(C=NNC(=O)Nc2ccc(F)cc2)c(C)n1-c1ccc(C(=O)O)c(Cl)c1 1084250290 VJZKIMJHAOGCJB-UHFFFAOYSA-N 428.851 4.740 50 10 IJGE C/C(=C\C1CCC(C)CC1)C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1 1544388622 PGRPTQCHEHHLOT-DSSXJFMESA-N 445.607 4.534 50 10 IJGE Cc1ccc(C(=O)NNc2nc3ccccc3[nH]c2=S)cc1NC(=O)c1ccccc1F 1585173366 CDCHAZNHESSUIE-UHFFFAOYSA-N 447.495 4.749 50 10 IJGE CC(=O)c1ccc(CNC(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(Cl)c3)c2C)nc1C 1631889665 OYEKEDCKGRHCIJ-JAIQZWGSSA-N 446.938 4.877 50 10 IJGE C/C(=C/c1cccc(Cl)c1)C(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1 1641058850 XJBXNWKIOZTWQN-LGMDPLHJSA-N 445.906 4.508 50 10 IJGE CCCc1nn(Cc2ccccc2F)c2c1[C@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689341 QATBVOSZXLRGDE-HXUWFJFHSA-N 438.890 4.600 50 10 IJGE C[C@@H](c1ccc(F)cc1Br)[C@@H](CBr)NC(=O)OC(C)(C)C 1885095655 CPUPHWLPTCEMSQ-TVQRCGJNSA-N 425.136 4.980 50 10 IJGE CN(C(=O)c1cc(Br)c(Br)s1)C1(CBr)CCC1 1914990638 CNJFHJFXRMDWOM-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2ncccc12 1915301181 RNOPNSBEVZOHPO-FQEVSTJZSA-N 447.398 4.845 50 10 IJGE CCC[C@H](Br)CCNC(=O)c1cc(Br)sc1Br 1942749322 XKYKSUBOOPXBOH-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE CC[C@@H]1CN(Cc2c(Br)cccc2Br)C[C@H]1Br 1945324144 WFOBAURDAXMIKZ-NOZJJQNGSA-N 425.990 4.817 50 10 IJGE CC[C@H]1CN(CC(C)(C)CBr)[C@H](CC)CN1C(=O)OCc1ccccc1 1977884923 NQMVWTLJMOHTBU-MOPGFXCFSA-N 425.411 4.919 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC[C@@](C)(CI)O2)C12CCCCC2 1989553207 SEPMXSCCPPPNKU-FUHWJXTLSA-N 435.346 4.683 50 10 IJGE Clc1cc(CN2CCC[C@@H](Br)CC2)ccc1I 2026566864 NJRWZAAWDQFFHD-LLVKDONJSA-N 428.539 4.694 50 10 IJGE C[C@H](CCBr)CCN1CCN(C(=O)OC(C)(C)C)[C@H](CC(F)(F)F)C1 2055947364 HAEYLDVBUHTGNG-ZIAGYGMSSA-N 431.337 4.671 50 10 IJGE COCCCCN(Cc1ccccc1)S(=O)(=O)c1cc(CBr)sc1C 2059284098 GUNYOBCVFBATSP-UHFFFAOYSA-N 446.432 4.569 50 10 IJGE C[C@@H](CCl)[C@H]1CCCCN1c1ncc(I)cc1Br 2069529837 SQAUNEBMPXSXDQ-JOYOIKCWSA-N 443.554 4.683 50 10 IJGE Clc1cc(Br)c(OCCS[C@H]2CCOC2)c(CBr)c1 2092690086 RGVFGUPBQCKAFM-NSHDSACASA-N 430.589 4.898 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N(C[C@@H](CBr)c2ccccc2)C1 2106785845 COCZWBYJOVARRS-JENIJYKNSA-N 425.411 4.742 50 10 IJGE CCN(CC)[C@@H](C)CO[C@@H](CI)c1ccc(Br)cc1 2119219572 ROAANOMPGYBNES-WFASDCNBSA-N 440.163 4.672 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C(=O)c2ccc(CBr)cc2)C2(CCCC2)C1 2162874536 WZEUSSJESYSZQF-KRWDZBQOSA-N 437.378 4.634 50 10 IJGE CCCC[C@H](C)N(C)S(=O)(=O)c1ccc(CBr)cc1Br 2179861455 HOFLTRXNOLEUNN-NSHDSACASA-N 427.202 4.543 50 10 IJGE O=[N+]([O-])c1cc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)ccc1CBr 2188576983 KRMZGCXCKRBTIV-NRFANRHFSA-N 430.346 4.592 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@]12CCCC[C@@H]1N(C(=O)OC(C)(C)C)CCC2 2196915340 XNCUVYRKTWJXTN-NYFOENAASA-N 443.426 4.578 50 10 IJGE Clc1ccc(CC23COC(CI)(C2)C3)cc1Br 2216253681 TXGYBEMDZBHHQC-UHFFFAOYSA-N 427.507 4.629 50 10 IJGE Cc1cc(Br)c(C(=O)N(C)C2(CBr)CCSCC2)s1 2229324807 ZVIPYEALCSMINB-UHFFFAOYSA-N 427.227 4.552 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)CC[C@@H]1CBr 2282980197 KOLNCDZWQOSONJ-RKDXNWHRSA-N 427.539 4.735 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](COC)C[C@H]1CNC(=O)OC(C)(C)C 2289502626 GMIGGMUGHGGDLS-ROUUACIJSA-N 449.474 4.830 50 10 IJGE CC(=O)Nc1ccc(Oc2cc(C)nc(C3CCN(C(=O)[C@@H](Cl)C(C)C)CC3)n2)cc1 2296578524 XAKMKKKRIVKXPQ-NRFANRHFSA-N 444.963 4.505 50 10 IJGE Cc1ccc(Oc2nc3ccccn3c(=O)c2C=C(C#N)C(=O)Nc2ccccc2C)cc1 2296719439 RSYWVOLKCMOCPC-UHFFFAOYSA-N 436.471 4.649 50 10 IJGE CC[C@H](Br)c1nnc(-c2ccc(Cl)cc2I)o1 2301791276 BXZZEXYUNVPCTA-QMMMGPOBSA-N 427.467 4.841 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1Cc1ccc(Cl)cc1I 2302316570 XADUHQGSFJQNIK-CABZTGNLSA-N 428.539 4.692 50 10 IJGE Clc1ccc(C[C@@]2(CBr)CCCCO2)c(I)c1 2302329176 PXYPEBVBKXHLKV-CYBMUJFWSA-N 429.523 4.821 50 10 IJGE CC1(C)OC[C@@H](Cc2ccc(Cl)cc2I)[C@@H]1Br 2302335866 JACRVIQDARPHGH-SKDRFNHKSA-N 429.523 4.676 50 10 IJGE COc1cccc(C=NNC(=O)c2cc3ccccc3n2C)c1OCc1cccc(C)c1 2323739322 UQVFKCQENZIYJE-UHFFFAOYSA-N 427.504 4.838 50 10 IJGE Cc1ccc2nc(-c3ccc(NC=C(C#N)C(=O)N[C@@H](CC(C)C)C(=O)O)cc3)sc2c1 2325022132 PAQHDDDETCSJOM-FQEVSTJZSA-N 448.548 4.707 50 10 IJGE C[C@H]1CCN(Cc2ccc(I)c(Br)c2)C[C@@H]1CCl 2325223360 OTQMEWKCPBMHTP-JQWIXIFHSA-N 442.566 4.751 50 10 IJGE CC(C)(C)OC(=O)NC1CCS(=O)(=NC[C@@](C)(CBr)C(C)(C)C)CC1 2327112755 MOEHVOVYMDZEPN-IKNZWMMLSA-N 439.460 4.589 50 10 IJGE N#CC(=Cc1ccc(Cl)cc1)C(=O)NC[C@H](c1c(F)cccc1Cl)N1CCCC1 2329647007 HUVUWLXFZUHWKD-HXUWFJFHSA-N 432.326 4.993 50 10 IJGE Cc1ccc(C(=O)NC(C)(C)[C@@H](Br)C(C)C)cc1I 2340402251 HANBEIGPQJHCTD-ZDUSSCGKSA-N 438.147 4.528 50 10 IJGE CN(C[C@H]1CCCN(Cc2ccccc2)C1)c1c(CBr)c(C(F)F)nn1C 2365275842 ZAQKJGCPPVSWAQ-MRXNPFEDSA-N 441.364 4.601 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCC[C@@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2382173612 FQWHVPVIHOLZAR-JKSUJKDBSA-N 443.430 4.993 50 10 IJGE CC(=O)Oc1ccc(-c2ccc(C=NNC(=O)NC34CC5CC(CC(C5)C3)C4)cc2)cc1 13375926 AXRNVSBOKLSQLD-UHFFFAOYSA-N 431.536 4.881 50 10 IJGE CCCCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccco2)cc1 38657427 YWZTZCQYHGUSNH-HSZRJFAPSA-N 430.460 4.896 50 10 IJGE N#C/C(=C/Nc1ccc(Oc2ccccc2)cc1)C(=O)N1CCN(c2ccc(F)cc2)CC1 217237067 CBIKXPBLDFMXRA-VXPUYCOJSA-N 442.494 4.786 50 10 IJGE CC(=O)[C@H](Br)[C@@H](C)c1cc(I)ccc1Br 300889924 DLYGKXKEFOOPSQ-UPONEAKYSA-N 445.920 4.510 50 10 IJGE FC(F)Oc1c(Br)ccc(CBr)c1I 575682444 QOZJBAFMSSTOSY-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE C[C@@H]1[C@H]2CC[C@@H](C[C@@]13CCC[C@H](CI)O3)N2C(=O)OC(C)(C)C 686237941 UODORMZWPHZNQH-VTWRMFPLSA-N 435.346 4.537 50 10 IJGE O=C(N[C@@H]1CCC[C@H](Br)C1)c1cc(Br)sc1Br 694585368 CPTAXKDTGFKHPI-NKWVEPMBSA-N 446.002 4.709 50 10 IJGE O=C(NCc1ccc(COc2ccccc2)cc1)NNC(=O)c1c(Cl)cccc1Cl 727841522 QHPYCLLMZTYVST-UHFFFAOYSA-N 444.318 4.717 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1ccnc(Oc2ccccc2Cl)c1 756742167 ZZNJVNLKRABIAP-UHFFFAOYSA-N 433.855 4.542 50 10 IJGE O=C(NN=C1CC(c2ccc(F)cc2)C1)c1nc(-c2ccccc2)n(-c2ccccc2)n1 759185933 VCVOCVIPZWMOKJ-UHFFFAOYSA-N 425.467 4.737 50 10 IJGE CCc1cccc(CC)c1NC(=O)/C(C#N)=C\c1ccc(OC)c(O)c1Br 761011878 PXVZMCNDGCIEAW-WJDWOHSUSA-N 429.314 4.834 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2nccc(C(F)F)n2)c(C)n1-c1cccc(Cl)c1 809291522 AUIMSDPGISHYIW-SXGWCWSVSA-N 441.869 4.699 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)Nc2cccc(Br)c2)c(-c2ccccc2)n1 914458188 FNBICBMFFMMDLE-SFQUDFHCSA-N 446.308 4.772 50 10 IJGE N#C/C(=C/c1cn(Cc2ccccc2F)c2ccc(Br)cc12)C(=O)NC1CC1 1084568793 PPFNBTLJSPPUNG-DHDCSXOGSA-N 438.300 4.777 50 10 IJGE O=C(NNC(=O)c1ccc(Br)cc1)/C(=C\c1ccc(F)cc1)c1cccs1 1115817177 VHOGFQMGQIWYBR-ATVHPVEESA-N 445.313 4.652 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C[C@@H](CBr)C3CC3)CC2)C1 1307924882 WOYQDEJYAPLNGL-RTBURBONSA-N 429.443 4.767 50 10 IJGE C=C(C)C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCCCSC#N 1617907954 QTUUQYGBTSKRLF-HSZRJFAPSA-N 449.576 4.580 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc3ccccc23)[C@H]1c1ccc(O)cc1 1865683392 CHMVSQKXQKDTQR-IBGZPJMESA-N 448.404 4.968 50 10 IJGE COc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(Cl)cc2Cl)cc1 1865686512 WTIMPULYSULRRC-IBGZPJMESA-N 427.291 4.714 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)[C@@H]1CCCN(C(=O)OC(C)(C)C)CCC1(F)F 1893342227 NKGMJHFLZZQWEZ-UONOGXRCSA-N 426.932 4.791 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OC(CC1CC1)CC1CC1 1899317298 AHXBUJOXZJIWPP-GOSISDBHSA-N 437.362 4.690 50 10 IJGE FC(F)(C1CC1)[C@H](Br)c1cc(I)cc2c1OCC2 1912533545 FQHWIVAXXYFXFR-GFCCVEGCSA-N 429.042 4.707 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]3(CC[C@@H]21)CC[C@](C)(CI)O3 1935707897 ZDRVODWGSNOAMI-NONVJHHQSA-N 435.346 4.539 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC12CCC1(CC2)CC[C@@](C)(CI)O1 1937359263 AHKOSPLNJYZOHS-WSTOCAFGSA-N 435.346 4.587 50 10 IJGE C[C@@H]1C[C@H]1N(CCBr)Cc1cccc(Br)c1Br 2002027621 VHJIVPKVHRNLDM-BXKDBHETSA-N 425.990 4.817 50 10 IJGE COc1ccc([C@@H](Br)c2cc(I)sn2)cc1Cl 2007643068 CVETWDMPENXTRQ-LLVKDONJSA-N 444.519 4.894 50 10 IJGE O=C(NCCC1(CBr)CC1)c1c(Br)cccc1Br 2033087853 XPTXIBQPDUIBSL-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE Cn1c(C(C#N)=Cc2cc(Br)c(O)c(Br)c2)nc2ccccc21 2041467666 PEDPTMYUCQNIMW-UHFFFAOYSA-N 433.103 4.868 50 10 IJGE C[C@H](CCBr)CCN1CCC[C@H](N(CC(F)F)C(=O)OC(C)(C)C)C1 2044698706 DTVJQJQSLPGATF-CABCVRRESA-N 427.374 4.764 50 10 IJGE COc1ccc(C)c(Cn2nc(CCl)c(I)c2C(F)(F)F)c1 2079211836 BWUHZETWXYWJPI-UHFFFAOYSA-N 444.622 4.611 50 10 IJGE CCN(CC)[C@@H](C)CO[C@H](CI)c1ccccc1Br 2119222329 YCAFGBQHGBUMJR-SWLSCSKDSA-N 440.163 4.672 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CC[C@@H](CCl)C(F)(F)C1 2148753728 SJSOFJPVAOWSTL-QMMMGPOBSA-N 431.502 4.548 50 10 IJGE FC(F)(F)[C@@H]1COCCN1c1c(CBr)ccc(Br)c1Cl 2154373593 NZMWEXMDGJMJNB-VIFPVBQESA-N 437.481 4.765 50 10 IJGE CN(CCC1CCN(C(=O)c2ccc(CBr)cc2)CC1)C(=O)OC(C)(C)C 2162914854 HOFOLLZKOSKTDE-UHFFFAOYSA-N 439.394 4.691 50 10 IJGE CC(C)(C)OC(=O)N1CCCN(C[C@@H](CBr)c2ccccc2)CC(F)(F)C1 2163063141 OMGDLIINGPCBAI-QGZVFWFLSA-N 447.364 4.743 50 10 IJGE C[C@H]1O[C@@]2([C@@H](Br)c3cc(I)cc4c3OCC4)CC[C@H]1C2 2199182271 DDWNYEZFDCIGDR-JUTNTEDWSA-N 449.126 4.620 50 10 IJGE CN(C[C@H](Br)C1CCCCC1)C[C@H]1CC1(Br)Br 2213093870 HQMKAHHDCRYMHN-NEPJUHHUSA-N 432.038 4.768 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@H]1CC2(CCCC2)CCN1C(=O)OC(C)(C)C 2237000484 DFMUNNQMUSCUJB-IXDOHACOSA-N 443.426 4.578 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C[C@H]2C(F)(F)F)cc1I 2257353566 HUJMBIBYOABKKU-XLDPMVHQSA-N 435.021 4.934 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CCCOCC2)cc1I 2257374910 VWFRFSZLCPOBLB-QMTHXVAHSA-N 425.104 4.553 50 10 IJGE Cc1ccc(OCCn2cc(C=C(C#N)C(=O)NC[C@H]3CCCO3)c3ccccc32)cc1C 2293648538 PVIOAMSCDGCXBW-XMMPIXPASA-N 443.547 4.539 50 10 IJGE C[C@H](Br)[C@H]1CCCN1Cc1ccc(Cl)c(I)c1 2300238729 OJYYZBVFAARIMT-TVQRCGJNSA-N 428.539 4.692 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Br)c2)CC[C@H]1Cl 2306217347 OVSFNWYKNARNDX-JOYOIKCWSA-N 428.539 4.503 50 10 IJGE C=CCc1cc(C=C(C#N)C(=O)Nc2ccc(Br)cc2)cc(OCC)c1O 2313565099 RNAVCFOEYGJULE-UHFFFAOYSA-N 427.298 4.828 50 10 IJGE COc1cc([N+](=O)[O-])ccc1-n1c(C)cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)c1C 2313567416 GWHWWEDEJGFVAQ-UHFFFAOYSA-N 430.464 4.865 50 10 IJGE CC1=C(C#N)C(=O)N(C2CCCCC2)C(=O)C1=Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 2314616583 FCOXUCDNDFJBSV-UHFFFAOYSA-N 431.448 4.780 50 10 IJGE COc1ccc2c(c1)c(C=C1Oc3cc(OC(=O)C(Cl)Cl)cc(C)c3C1=O)cn2C 2323758380 HEWTXWROXURNDD-UHFFFAOYSA-N 446.286 4.821 50 10 IJGE ClC[C@H](NCc1ccc(I)c(Br)c1)C1CCCC1 2325215533 ZQPOPLWBANMXTR-AWEZNQCLSA-N 442.566 4.941 50 10 IJGE CS(=O)(=O)Nc1ccc(C(O)=C(C#N)c2nc(-c3c[nH]c4ccccc34)cs2)cc1 2331346703 DMMLKSJDSKCWEI-UHFFFAOYSA-N 436.518 4.613 50 10 IJGE Cc1cc(S(=O)(=O)NCC(C)(C)[C@H](Br)C(C)C)sc1Br 2365994753 LAWMORZLJQHQEW-LLVKDONJSA-N 447.258 4.543 50 10 IJGE CCn1nc(Br)c(COc2c(Cl)cc(Cl)cc2CBr)n1 2379957658 HQCILHPZHAPQLP-UHFFFAOYSA-N 443.954 4.841 50 10 IJGE CC[C@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)COc1ccc(Cl)cc1C 10683230 XBHDUGVJSSMAKI-BEFAXECRSA-N 432.948 4.546 50 10 IJGE CCCOc1ccccc1C(=O)NNC(=O)[C@@H](CC)Oc1ccc(-c2ccccc2)cc1 14768945 BOFXVLMKIHLKRR-HSZRJFAPSA-N 432.520 4.761 50 10 IJGE CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](O)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 211447940 YFXHWMFAYWHGCE-JLLPCOHGSA-N 444.644 4.896 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CBr)OCc1cccc(Br)c1 231319403 AUFWYABRTMMFOM-MRXNPFEDSA-N 437.172 4.644 50 10 IJGE CC[C@H](CCBr)NC(=O)c1ccc(Br)cc1Br 234007963 RZSCEHQOZIHKBY-SECBINFHSA-N 427.962 4.505 50 10 IJGE C[C@H](Br)C(C)(C)NC(=O)c1cc(Br)sc1Br 235455262 LIBNEZBCLVCCSE-YFKPBYRVSA-N 433.991 4.565 50 10 IJGE O=C(CCCC[C@H]1CCSS1)N1CC[C@@H](Oc2ccc(Br)cn2)C1 238880066 PAKFIFACLCZADJ-CABCVRRESA-N 431.421 4.538 50 10 IJGE Cc1ccc(NCC(=O)NN=Cc2cc([N+](=O)[O-])ccc2N(CC(C)C)CC(C)C)cc1 263632310 CMFAFWBIYNTWBB-UHFFFAOYSA-N 439.560 4.584 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(OC[C@@H]2C[C@@H]3CCCC[C@@H]3O2)CC1 380845196 ZLLVWAXURMHKKQ-ULQDDVLXSA-N 432.399 4.515 50 10 IJGE Brc1ccc([C@H](CI)OCCOCC2CCC2)cc1 400708015 PSAGXSKQWHTSKB-HNNXBMFYSA-N 439.131 4.759 50 10 IJGE Clc1ccc(C(CBr)(CBr)CCO[C@@H]2CCOC2)cc1 724984220 HFQRFMZDDLBBTF-CQSZACIVSA-N 426.576 4.563 50 10 IJGE Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)NNC(=O)c1cccc2cccnc12 729616616 SBCBPPNSOBPCHG-CQSZACIVSA-N 449.511 4.511 50 10 IJGE C/C(=C\C(=O)NNc1nc(-c2cccnc2)nc(C)c1C)c1ccc(C(F)(F)F)cc1 736694175 ZYHVEDCFIIPADZ-ACCUITESSA-N 427.430 4.721 50 10 IJGE CC(C)c1c(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cnn1-c1ccc(F)cc1 799749065 LKDYVSWAJTYLBQ-UHFFFAOYSA-N 431.393 4.782 50 10 IJGE O=C(COc1ccc(C=NNC(=O)c2ccc(Cl)cc2)cc1)Nc1ccccc1Cl 1084462075 MEQRWASBEHYCJQ-UHFFFAOYSA-N 442.302 4.775 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccccc2Br)cc(Cl)c1OCC 1084606611 PKUZVPOJOUXHPD-UHFFFAOYSA-N 425.710 4.664 50 10 IJGE C#CC[C@H]1CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1438021303 UZZJTGFTVCQNFX-ACRNLXFHSA-N 436.353 4.635 50 10 IJGE N#CC1=NN(c2ccccc2)[C@H](c2ccccc2)[C@@H]2[C@@H]1OC(N)=C(C#N)[C@H]2c1ccccc1 1616047649 XEYUYBYGHLJCJG-VEYUFSJPSA-N 431.499 4.620 50 10 IJGE N#CSc1ccc(NC(=O)c2cc(CCc3ccccc3)n(-c3ccccn3)n2)cc1 1862326803 LXKQDPPNGHTCIG-UHFFFAOYSA-N 425.517 4.878 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccc(F)cc2)cc1 1865694701 ZLRXTEDJDJPJNT-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE CCN(CC)Cc1ccc(/C=N\NC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)cc1 1865760972 ZMAPYSAMLZBZND-MBTHVWNTSA-N 436.506 4.941 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H](c1ccccc1)[C@@H](CBr)NC(=O)OC(C)(C)C 1883674851 IJMBJRKFNPVOHZ-JKSUJKDBSA-N 443.382 4.583 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@@]1(F)CN(Cc1ccc(CBr)cc1)C2 1893715722 FBQQERTWDHPXDD-UXHICEINSA-N 427.358 4.553 50 10 IJGE CCn1ncc(Br)c1CN(Cc1ccccc1)[C@H](C)CCBr 1915091819 CDTJVGGPXYCIHM-CQSZACIVSA-N 429.200 4.841 50 10 IJGE O=S(=O)(c1ccc(N(Cc2ccccc2)[C@@H](CBr)C2CC2)cc1)C(F)F 1915189435 PRNBISXHIDHVIF-SFHVURJKSA-N 444.341 4.863 50 10 IJGE Cc1nc(N(Cc2ccccc2)C2(CBr)CCC2)ncc1Br 1915765249 GEQRMPXBUHHYPL-UHFFFAOYSA-N 425.168 4.872 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)C(=O)c1c(F)cc(Br)cc1F 1916364108 IDXPZGAVNUATHZ-AWEZNQCLSA-N 432.692 4.624 50 10 IJGE Clc1ncn(-c2ccc(Br)cc2Br)c1CBr 1982517421 WUWZUHRKIRCGDL-UHFFFAOYSA-N 429.337 4.946 50 10 IJGE CC1CC(CBr)(N(C)c2ncc(Br)cc2Br)C1 2000580185 QXKPIJAPFGQFCI-UHFFFAOYSA-N 426.978 4.606 50 10 IJGE CC[C@H](C)[C@H](CBr)NCc1cc(Cl)ccc1I 2023040731 IRSPPFOLIIMJDR-ZANVPECISA-N 430.555 4.844 50 10 IJGE Clc1cc(CN2CCC[C@@H](CBr)C2)ccc1I 2026565159 ZEIMHYOHDQRYAQ-NSHDSACASA-N 428.539 4.552 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)C(C)(C)C)C[C@@H]1C(F)(F)F 2066632823 JWEWQNYNDCPEDB-CHWSQXEVSA-N 431.337 4.527 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@H](CBr)c2ccccc2)C(C)(C)C1 2106784103 FZUZPMZSEJVPOJ-ZWKOTPCHSA-N 425.411 4.933 50 10 IJGE Fc1ccc(I)cc1[C@@H](Br)c1ccc2c(c1)CCO2 2113359219 ZGALKYBPINKXJB-HNNXBMFYSA-N 433.058 4.850 50 10 IJGE Cc1c(CCl)cc(Cl)cc1S(=O)(=O)N(C)C1CC(OCc2ccccc2)C1 2156450593 VXPNXXCVVMHVEI-UHFFFAOYSA-N 428.381 4.756 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@](CNC(=O)[C@@H](Br)C2CCCC2)(C(C)(C)C)C1 2167031949 KOMVEXWQEHYNBT-KKSFZXQISA-N 445.442 4.730 50 10 IJGE O=C(Nc1ccc(CCBr)cc1)c1cc(I)ccc1F 2169661386 FZBAOCAJZZOAJR-UHFFFAOYSA-N 448.073 4.620 50 10 IJGE CN(CC1CCN(Cc2ccccc2)CC1)c1cc([N+](=O)[O-])ccc1CBr 2176906275 IEIWWVLUHCGGJJ-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](Br)[C@H](OCc2ccc(Cl)cc2Cl)C1 2212516492 ODMSPLISTHWROF-TZMCWYRMSA-N 425.150 4.893 50 10 IJGE CCc1nn(C)c(C(=O)N(Cc2ccccc2)[C@@H](CBr)C(C)C)c1Cl 2224042660 UJLOPCYBEYHENP-INIZCTEOSA-N 426.786 4.698 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H](CN(CC2(CBr)CC(F)C2)C2CC2)C1 2265639757 VDCANJQLPZTXAB-LSWWBPAMSA-N 433.406 4.611 50 10 IJGE C[C@@H](Br)CN(CCC(C)(C)C)S(=O)(=O)C1CC(OCc2ccccc2)C1 2272388297 BMRZDQAXFFXJGD-IPJUCJBFSA-N 446.451 4.586 50 10 IJGE CC(C)[C@@H]1[C@H](Br)CCN1Cc1ccc(Cl)c(I)c1 2315549886 XJDCXWLQISLLCQ-BXUZGUMPSA-N 442.566 4.938 50 10 IJGE C[C@@]12CN(Cc3ccc(Cl)cc3I)C[C@]1(CBr)C2 2318557595 MTFFCAWCDQNIBZ-ZIAGYGMSSA-N 440.550 4.552 50 10 IJGE ClCc1cncc(OCc2cc(I)ccc2Br)c1 2319166560 GLDFHHOSFBQAOV-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(Cc2cc(Cl)ccc2I)[C@H]1C 2321330048 LQCJYLDNCWFYIE-KWBADKCTSA-N 442.566 4.938 50 10 IJGE C[C@@]12CN(Cc3ccc(I)c(Br)c3)C[C@]1(CCl)C2 2325226070 LRKNFBOAFQDZRR-ZIAGYGMSSA-N 440.550 4.505 50 10 IJGE CC1(C)CCC(C)(C)[C@@H](Cc2ncc(I)cn2)[C@@H]1Br 2353064496 MNSHASMSJCWNKW-AAEUAGOBSA-N 437.163 4.850 50 10 IJGE CC1CCC([C@@H](CBr)NCc2nn(C)c(Cl)c2Br)CC1 2379755146 LDJBRXCOPRBMIM-VQXHTEKXSA-N 427.612 4.515 50 10 IJGE O=[N+]([O-])c1cc(Br)cc(Cl)c1OC[C@]1(CBr)CC1(F)F 2379906947 ZXDXJXTZRFYZIQ-SNVBAGLBSA-N 435.446 4.810 50 10 IJGE CCOC(=O)/C(C#N)=C\c1c(Oc2ccc(C(C)(C)C)cc2)nc2c(C)cccn2c1=O 33680289 IKBPTWQFGADHHQ-VKAVYKQESA-N 431.492 4.563 50 10 IJGE Cc1occc1C(=O)N/N=C1\CCCc2oc(C(=O)N3c4ccccc4C[C@H]3C)c(C)c21 40823432 XSFFNWMOQYPADY-NIJLOQBOSA-N 431.492 4.551 50 10 IJGE CCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C(\C#N)C(=O)NCc3ccco3)cc2)cc1 40926873 PCPCVOXRJADKQN-SUKHYTALSA-N 442.471 4.520 50 10 IJGE O=S(=O)(c1c(Cl)cc(Br)cc1Cl)N1CCC[C@H]1CCCCl 109648067 BQXUNIZWCKUIMF-SNVBAGLBSA-N 435.598 4.928 50 10 IJGE COc1ccc(-c2cc(C(=O)NN=Cc3ccc(C)c(OC)c3)n(-c3ccccc3)n2)cc1 254396229 KGBSCQOSMQVQGJ-UHFFFAOYSA-N 440.503 4.629 50 10 IJGE COc1ccc(F)cc1[C@H](Br)c1sccc1I 383337169 WRGDCFTUFJRTBP-NSHDSACASA-N 427.076 4.985 50 10 IJGE Cn1ncc([C@@H](Br)c2ccc(Cl)cc2Cl)c1I 393606482 ZPGASGCHZAZHME-JTQLQIEISA-N 445.913 4.816 50 10 IJGE Clc1ccc(CBr)c(N2CC[C@]3(CN(Cc4ccccc4)CCO3)C2)c1 717591035 HQPSQYNWKWDWCU-NRFANRHFSA-N 435.793 4.716 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2CC[C@]3(CC[C@@](C)(CI)O3)[C@H]1C2 721762730 RPBPCLVVQGMRFY-KNCCTNLNSA-N 435.346 4.539 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C[C@@H](C)c2cccc(C(F)(F)F)c2)c1C 738542275 HINGWLAYTPGKAU-CYBMUJFWSA-N 429.446 4.811 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNC(=O)c1ccccc1Br 1135495528 INDMYQNHCWDVHY-MDZDMXLPSA-N 428.113 4.620 50 10 IJGE C[C@@H](Sc1ccc(Br)cc1)C(=O)NNc1nc2ccccc2[nH]c1=S 1585173503 HBJDNHXPZONMNQ-SNVBAGLBSA-N 435.372 4.679 50 10 IJGE COc1cc(-n2cccc2)c(Cl)cc1C(=O)NNc1nc2ccccc2[nH]c1=S 1646012858 DHORVOCOGQBDDO-UHFFFAOYSA-N 425.901 4.502 50 10 IJGE Cc1sc2nc(CS[C@@H](C)C(=O)NNc3cc(Cl)ccc3F)nc(O)c2c1C 1649099367 MDAOVSGTWDLYMN-JTQLQIEISA-N 440.953 4.571 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@@H]1c1cccc(O)c1 1865681391 MBDQXAWUIRJWJO-MRXNPFEDSA-N 446.816 4.527 50 10 IJGE CCCc1nn(Cc2ccccc2F)c2c1[C@@H](c1cccc(OCC)c1)C(C#N)=C(N)O2 1865690111 IWYSNWLEZFQVQM-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE CCCc1nn(-c2cccc(Cl)c2)c2c1[C@@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706206 QEDKAKZTKPHGBK-IBGZPJMESA-N 435.871 4.605 50 10 IJGE O=S(=O)(c1cc(CCl)oc1Br)N(Cc1ccccc1)C1CCCC1 1946829590 OGUYFYGANZNTDI-UHFFFAOYSA-N 432.767 4.914 50 10 IJGE C[C@H]1C[C@H](CBr)CN1C(=O)c1csc(Br)c1Br 1950523251 SOLMSFDQBCDCED-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE Fc1ccccc1[C@H](CI)OCCOCCOCc1ccccc1 2007814767 XPCOUHKHIGDQLB-IBGZPJMESA-N 444.284 4.552 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Cl)cc(C(=O)NC2CC(Br)C2)cc1Cl 2011822807 MTRZCSWVJYRLMO-UHFFFAOYSA-N 438.149 4.996 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)CC(C)(C)CBr 2026565748 DVOIXIBIOPWPGP-UHFFFAOYSA-N 430.555 4.798 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCC2)[C@H](CC(F)F)C1 2063524755 OOCNMFKXMGLKCU-CQSZACIVSA-N 425.358 4.518 50 10 IJGE Brc1ccc(Br)c(CN2C[C@@H]3CC(Br)C[C@H]3C2)c1 2065404233 RTMUOWYFXYLCLG-UWVGGRQHSA-N 438.001 4.817 50 10 IJGE COC[C@@H](C)CCO[C@H](CI)c1cccc(Br)c1 2067237646 NEWSXHSNHXGODG-SMDDNHRTSA-N 427.120 4.614 50 10 IJGE COc1ccc(C)cc1Cn1nc(CCl)c(I)c1C(F)(F)F 2079212101 JQJZAXYYQVWPRW-UHFFFAOYSA-N 444.622 4.611 50 10 IJGE FC(F)(F)c1cc(Br)cc(-n2nc(CBr)c3c2C[C@@H]2C[C@@H]32)n1 2080742928 WZIFRFNZSCOREU-POYBYMJQSA-N 437.057 4.603 50 10 IJGE Cc1nc(Br)c(Br)n1CCCCc1nc(CCl)cs1 2087603585 HDNISYKOWSAYGP-UHFFFAOYSA-N 427.593 4.935 50 10 IJGE Fc1cc2nc(CCl)n([C@]34C[C@H]3CN(Cc3ccccc3)C4)c2cc1Br 2099678580 JQDNOAUTVVMUGW-XOBRGWDASA-N 434.740 4.908 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1 2106784111 GDNQZRZEIAZLPC-RBUKOAKNSA-N 425.411 4.887 50 10 IJGE CCC[C@H](CBr)CN1CCC(c2n[nH]cc2NC(=O)OC(C)(C)C)CC1 2129052814 BAOLYBBBOZUKKB-CQSZACIVSA-N 429.403 4.747 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@H](Cl)c2cc(Br)sc2Br)C1 2137227278 LSWFRBGWIZVEQK-HNBZJPLGSA-N 448.629 4.768 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Br)c1nn(C)cc1Cl 2138256706 YBPYNIWYGUVKFG-JTQLQIEISA-N 428.939 4.982 50 10 IJGE FC(F)(F)c1csc([C@H](Br)[C@@H]2CO[C@@H]3COC[C@@H]32)c1Br 2158066005 CZSAEAQZRZANAI-SQEXRHODSA-N 436.087 4.627 50 10 IJGE C[C@H]1C[C@H](CCNC(=O)OC(C)(C)C)CCN1C(=O)c1ccc(CBr)cc1 2162879271 ONDUHIBYAHJOLX-JKSUJKDBSA-N 439.394 4.737 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CNC(=O)[C@@H](Br)C3CCCC3)CCC[C@H]12 2167033088 PLWMOSNPGRCHEP-FIKGOQFSSA-N 443.426 4.626 50 10 IJGE Cc1sc(Br)cc1C(=O)NCC1(F)CCC(CBr)CC1 2178578918 DSGOTMBVJFDVAW-UHFFFAOYSA-N 427.177 4.842 50 10 IJGE Fc1cc(Br)cc2c1nc(CCCl)n2[C@@]12C[C@H]1CN(Cc1ccccc1)C2 2232924916 WRDLDDHKWLETDT-YCRPNKLZSA-N 448.767 4.950 50 10 IJGE Fc1ccc([C@@H](CBr)OCCOCCOCCOCc2ccccc2)cc1 2236089954 VAXQNJSXMXBTAX-OAQYLSRUSA-N 441.337 4.528 50 10 IJGE CC1(C)[C@H]2CC[C@@H](C2)[C@@]1(CI)O[C@H]1CCN(Cc2ccccc2)C1 2250384995 DZWXRQWHWBSEQY-VNYTWHDVSA-N 439.381 4.907 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCCCN1CC1(CBr)CC(F)C1 2265638166 JPLGGEVSXMLWJC-RXCRORICSA-N 433.406 4.754 50 10 IJGE CC(C)N(CCCCl)Cc1ccc(I)c(Br)c1 2306232438 UTBCTQJIKCCMJG-UHFFFAOYSA-N 430.555 4.893 50 10 IJGE C[C@H](Br)CCCN(C)C(=O)c1cc(Cl)ccc1I 2314466122 PPXZGZUWTXBTLM-VIFPVBQESA-N 444.538 4.580 50 10 IJGE N#CC(=CNc1ccccc1Sc1ccccc1)C(=O)NCc1ccc2c(c1)OCO2 2318468600 OIIVDGUNRJFKPM-UHFFFAOYSA-N 429.501 4.702 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(SCC(C)C)cc2)cc(Br)c1O 2321248443 OOSAWVLUPCSKGD-UHFFFAOYSA-N 437.359 4.675 50 10 IJGE CCN(C[C@@]1(CBr)CC1(F)F)C1CCC(NC(=O)OC(C)(C)C)CC1 2326914225 IIOSGGKKRKADMH-KVULBXGLSA-N 425.358 4.565 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C(C)(C)C)C3)cc1 2329622484 SNWLXSGPOSGQBW-MRXNPFEDSA-N 437.565 4.552 50 10 IJGE O=C(NC[C@H]1CCCC[C@H](Cl)C1)c1ccc(Cl)cc1I 2365597259 FBQXHBVWTAMWOW-QWRGUYRKSA-N 426.125 4.862 50 10 IJGE O=C(NC1CCCC1)[C@H](c1ccc(Cl)cc1)N(Cc1ccc(F)cc1)C(=O)CCl 3039488 BHPDRIDUNMIMCH-NRFANRHFSA-N 437.342 4.847 50 10 IJGE O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)Cc1cccc2ccccc12 12492558 YFTMFJJNNUYNQA-UHFFFAOYSA-N 431.319 4.696 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(Cl)cc2)ccc1OC(=O)c1ccccc1Cl 13838289 JALFDYZVDRBTRK-UHFFFAOYSA-N 443.286 4.985 50 10 IJGE C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)COc1ccccc1-c1ccccc1 14665635 CTXMXOUREYMKMJ-IBGZPJMESA-N 446.547 4.645 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2ccc(OC)c(OC(C)C)c2)sc(C)c1C 39885184 YVDKUFDWBSWMPV-LICLKQGHSA-N 442.537 4.883 50 10 IJGE COc1ccc(/C=N\NC(=O)c2ccc3nc(S)[nH]c3c2)cc1OCc1ccc(C)cc1 169917437 MDPVWJBQLKDRCX-MXAYSNPKSA-N 446.532 4.512 50 10 IJGE CC(C)Oc1ccccc1-c1cc(C(=O)NN=Cc2ccc([N+](=O)[O-])o2)c2ccccc2n1 252624420 PNQDMOVYTDVUII-UHFFFAOYSA-N 444.447 4.954 50 10 IJGE COc1ccc(C)cc1NC(=O)CC(C)=NNC(=O)Cc1ccc(-c2ccccc2)cc1 254760673 AWGJWYOQRXQDHH-UHFFFAOYSA-N 429.520 4.734 50 10 IJGE CC(=NNC(=O)c1ccc(Br)o1)c1ccc(NC(=O)c2cccs2)cc1 254823675 WDUBNZPVSZLQSQ-UHFFFAOYSA-N 432.299 4.510 50 10 IJGE CCc1ccc(-c2cc(C(=O)NN=Cc3ccc(O)c(O)c3)c3cc(C)ccc3n2)cc1 254873403 LHLHQAOZALVQCU-UHFFFAOYSA-N 425.488 4.948 50 10 IJGE CCN(C[C@](C)(CBr)OC[C@@H]1C[C@@H]2CCCC[C@H]2O1)C(=O)OC(C)(C)C 380803940 LCFWSTZHXZUGIB-LJCCNALRSA-N 434.415 4.761 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1Cc1cc(Cl)ccc1I 405325037 BRFQLVLZZUYEJM-SKDRFNHKSA-N 428.539 4.692 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1ccc([C@@H]2CCN(S(N)(=O)=O)c3ccccc32)cc1 616675416 DOLXLHQWRGXOKE-FQEVSTJZSA-N 446.689 4.796 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)c1C 734257440 XZYIOLQMZCYWNV-UHFFFAOYSA-N 447.445 4.983 50 10 IJGE C[C@@H](CCCC(F)(F)F)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 757642851 BUZRWHAJWWKVEN-CQUHBBLWSA-N 429.446 4.608 50 10 IJGE CCc1c(C)nn(-c2cccc(C(=O)NNC(=S)Nc3ccccc3C(C)C)c2)c1C 766555644 LXACEXDOIHQARJ-UHFFFAOYSA-N 435.597 4.806 50 10 IJGE Cc1cncc(/C=C/C(=O)NNc2ccc(S(=O)(=O)c3ccc(C(C)C)cc3)cc2)c1 772015170 OMJWQFNQMHZITB-YIXHJXPBSA-N 435.549 4.503 50 10 IJGE C[C@@H](OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)c1nc2ccccc2o1 781831156 CRLTTYIGJLFDKH-SQFNAUOLSA-N 437.459 4.816 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N2CCn3c(C(C)C)nnc3[C@H]2C)c(C)n1C1CCCCC1 784698001 FWFFTUXSDGOLAI-KNGGAZFVSA-N 434.588 4.835 50 10 IJGE Cc1ccccc1-n1ncc(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)c1C(C)C 792342413 CZMBJWLUYBOKTD-UHFFFAOYSA-N 441.539 4.530 50 10 IJGE CC(C)(C)c1cc(C=NNC(=O)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc(C(C)(C)C)c1 1081098227 FXJDABCNFPNHBV-UHFFFAOYSA-N 440.500 4.791 50 10 IJGE O=C(CCCOc1ccc(Cl)cc1Cl)NN=Cc1ccc(Cl)c([N+](=O)[O-])c1 1084156837 XKFUUWAYKOEKIE-UHFFFAOYSA-N 430.675 4.864 50 10 IJGE Cc1cc(F)ccc1NNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 1319369483 BCHACKSXBVFNRI-SFQUDFHCSA-N 448.889 4.615 50 10 IJGE CCCc1nn(Cc2ccccc2F)c2c1[C@H](c1ccc(OCC)cc1)C(C#N)=C(N)O2 1865694349 UFSCPXSKSRQJJT-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE CCN(CC)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2cc(C)ccc2C)cc1 1865701827 GKVIJRMXJFXYMI-VWLOTQADSA-N 441.579 4.921 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1ccc(F)cc1)C(C#N)=C(N)O2 1865708436 WVGNPJWRLWEQOU-LJQANCHMSA-N 426.854 4.644 50 10 IJGE COc1cccc(-c2nc(Nc3ccc(SC#N)cc3)cc(N3CCO[C@H](C)C3)n2)c1 1868505053 COXXLVFZTGZOJN-MRXNPFEDSA-N 433.537 4.694 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1cc(Br)c(Cl)s1 1880761353 MSFRWDQNTKAEKC-SSDOTTSWSA-N 433.593 4.995 50 10 IJGE O=S(=O)(c1ccc(Cl)c(Cl)c1)N(CCCBr)Cc1ccccc1 1914647841 KICNACJSIRJPDQ-UHFFFAOYSA-N 437.186 4.969 50 10 IJGE CC(C)(C)OC(=O)N[C@H](Cc1ccc(Br)cc1)[C@@H](Br)CF 1952042497 NHWBCXCIKRXQHK-QWHCGFSZSA-N 425.136 4.618 50 10 IJGE CO[C@H]1C[C@@H]1COc1c(Br)cc(Br)cc1CBr 2014582836 LNZGJOWARFCBFW-KCJUWKMLSA-N 428.946 4.520 50 10 IJGE CN(Cc1c(Br)cccc1Br)C1(CCBr)CC1 2015867674 MVHVNLHBHPQRDV-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE O=C(Nc1ccc(Cl)c(I)c1Cl)[C@H]1C[C@H](Br)C1 2020163758 SOZJMBGCAWSVSH-IZLXSQMJSA-N 448.913 4.710 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@@H](OC2CC3(C2)CC2(CCC2)C3)C1 2025070491 BFWJUXUDOZBRBR-GJZGRUSLSA-N 447.357 4.539 50 10 IJGE C[C@@](CI)(OCP(C)(C)=O)c1ccccc1Br 2025379945 LKULBXCHBRDBHW-LBPRGKRZSA-N 431.048 4.696 50 10 IJGE COc1ccc(Br)cc1[C@@H](Br)c1nn(C)c(Cl)c1Cl 2094338961 KTIKHPPRVGWYCF-SECBINFHSA-N 428.939 4.982 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1c([N+](=O)[O-])ccc(Cl)c1F 2125301518 GTVOQOWRNRCZFI-UHFFFAOYSA-N 425.935 4.705 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@H]1CCCC[C@H]1N(C)C(=O)[C@H](Br)C1CCCC1 2138777482 JTKFULLKKWWNJU-BRWVUGGUSA-N 431.415 4.577 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)[C@@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 2162866818 BPRLPUGOLVWETI-QGZVFWFLSA-N 439.394 4.689 50 10 IJGE O=C([C@H](Br)C1CCCC1)N1CCCCN(Cc2ccccc2)CC(F)(F)C1 2167034143 VMXKFIJWXNCKPI-LJQANCHMSA-N 443.376 4.700 50 10 IJGE Cc1cc(C(=O)NC[C@]2(F)CC[C@H](CBr)CC2)sc1Br 2178579624 PCLKADAFQMKTJI-YPFXGUDJSA-N 427.177 4.842 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)c(Br)c2F)C[C@@H](CCBr)O1 2179383367 SNLCMUWILOPMQA-GXSJLCMTSA-N 429.555 4.616 50 10 IJGE O=C(c1ccc(Cl)c(Br)c1)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Br)C2 2190678179 KHKOEFZGAYHZRM-JBSCMGISSA-N 425.523 4.581 50 10 IJGE O=C(N[C@H]1CCCN(C[C@@H](CBr)c2ccccc2)C1)OCc1ccccc1 2253195067 NSEBIJXSQXJURZ-RTWAWAEBSA-N 431.374 4.556 50 10 IJGE Cc1cc(F)c(CBr)c(OCCOCCOCCOCc2ccccc2)c1 2283362265 MPFKYVNARRKJIL-UHFFFAOYSA-N 441.337 4.658 50 10 IJGE C[C@H]1C[C@@H](CBr)CN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285844571 OPECOIJNVRMNFH-IUCAKERBSA-N 427.539 4.735 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)[C@H]1CCC[C@H]1Cl 2306224833 UBHNVWHQVCTXRK-YPMHNXCESA-N 428.539 4.645 50 10 IJGE CC[C@@H](C[C@H](C)Br)NCc1cc(I)ccc1Cl 2307315125 DFZJSJNXLMJRED-CABZTGNLSA-N 430.555 4.986 50 10 IJGE CCOc1cc(Br)c(C=C(C#N)C(=O)N[C@@H](C)c2ccccc2)cc1OC 2313738664 NMEHSHXJXOJACN-AWEZNQCLSA-N 429.314 4.641 50 10 IJGE C[C@H]1C[C@H](CBr)CN(Cc2ccc(Cl)cc2I)C1 2318540166 QKHGSNJYESXTBR-WDEREUQCSA-N 442.566 4.798 50 10 IJGE CCN(C[C@@](C)(CBr)OC[C@@H]1C[C@H]2[C@@H](C1)C2(F)F)C(=O)OC(C)(C)C 2320759188 FSNRJDNRNMGJKP-UMPJEAMMSA-N 426.342 4.705 50 10 IJGE COc1cc(C=NNC(=O)c2cccc(N)c2)ccc1OCc1ccc(C(C)(C)C)cc1 2323211478 DPTLJJQHGUSUAU-UHFFFAOYSA-N 431.536 4.918 50 10 IJGE ClCC1CCC(NCc2ccc(I)c(Br)c2)CC1 2325222460 LFRHHOMFXMGLEF-UHFFFAOYSA-N 442.566 4.941 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CC[C@@H]3C[C@H]2CO3)cc1I 2334463529 LAECCBRCWYEDSK-OXIQGZBJSA-N 437.115 4.551 50 10 IJGE Cc1cc(C(=O)N2CCC[C@H](Br)[C@H]2C(F)(F)F)sc1Br 2370241066 JNSIUNUGOKAHCG-CBAPKCEASA-N 435.103 4.749 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)c2ccc(NC(=O)CCCC)cc2)cc1 14028440 QZWGEXDQLWXTRN-UHFFFAOYSA-N 439.556 4.849 50 10 IJGE CCCCOc1ccc(/C=C2/C(=O)N(CCc3ccccc3)C(=O)C(C#N)=C2C)cc1OC 38607534 ODORMOWMDGLRTB-CJLVFECKSA-N 444.531 4.709 50 10 IJGE CCCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(I)cc2)cc1 40852597 DPVOSTIEOUYWGB-QINSGFPZSA-N 432.261 4.626 50 10 IJGE CCCC[C@@H](CC)CC(CBr)(CBr)[C@H]1CCS(=O)(=O)C1 118875328 VRHAHKUEDKMAGX-KGLIPLIRSA-N 432.262 4.804 50 10 IJGE CCN(/C=C(/C#N)C(=O)Nc1ccc(I)cc1C)c1cccc(C)c1 217254289 ZVFIIQVKJMLMNM-SSZFMOIBSA-N 445.304 4.781 50 10 IJGE O=S(=O)(Nc1cccc(Cl)c1Br)c1ccc(CBr)cc1 236054429 PDXKHOOAZYJASB-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE CC[C@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)NN=Cc1cccc(Oc2ccccc2)c1 252618582 LHTDVZYQGDZNQS-YADARESESA-N 429.520 4.774 50 10 IJGE COc1cc(C=NNC(=O)c2cc3ccccc3cc2O)ccc1OCc1ccccc1 254869803 LJMPDNSPWKMIEC-UHFFFAOYSA-N 426.472 4.897 50 10 IJGE ClCc1cc2ccsc2c(I)c1I 306609038 JVBXPHFREFMHPM-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE C[C@H]1CN(c2ccc([N+](=O)[O-])cc2CBr)[C@H](C)[C@@H](C)N1Cc1ccccc1 404258185 BYONFXINWGIMBX-GVDBMIGSSA-N 432.362 4.977 50 10 IJGE O=C(CBr)c1cc(F)c(SC(F)(F)F)cc1I 575705092 UHUFTJQZRHUYJF-UHFFFAOYSA-N 442.997 4.620 50 10 IJGE Cc1ccnc(NNC(=O)c2ccc(C)c(OCc3csc(Br)c3)c2)c1 755839443 FCCKXIWPDVRXFD-UHFFFAOYSA-N 432.343 4.858 50 10 IJGE N#C/C(=C/c1ncc(-c2ccccc2)s1)C(=O)Nc1nc(-c2ccc(O)c(O)c2)cs1 770564968 DDIBZIUHQMBJFX-DHDCSXOGSA-N 446.513 4.890 50 10 IJGE CC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)cc1Cl 783559931 BDQSRVUMVXYAGN-CYEGBWLXSA-N 425.916 4.686 50 10 IJGE Cc1cc(CSc2ccccc2C(=O)NNc2ccc(C#N)cc2C(F)(F)F)on1 799752077 YUCQDWGUKBFCKO-UHFFFAOYSA-N 432.427 4.923 50 10 IJGE COc1cc(C=NNC(=O)COc2c(C)cccc2C)ccc1OCc1ccccc1C 1772753736 GEMNUOWBTHWBMK-UHFFFAOYSA-N 432.520 4.729 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccc(Cl)cc2)[C@@H]1c1ccncc1 1865700411 SIWFRGXRWZJHFX-OAQYLSRUSA-N 439.906 4.865 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1ccccc1F 1865703143 NYSTVMRXQQRLMQ-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE C[C@H](Br)CCOc1cc(Br)cc(I)c1 1888224986 OLWGRUKPWCBYJT-ZETCQYMHSA-N 433.909 4.606 50 10 IJGE N[C@H](c1c(Cl)cc(Br)c(F)c1Br)[C@H]1C[C@H]1Br 1900373191 TVLUXIIFELNDMY-JISPFJSISA-N 436.344 4.787 50 10 IJGE BrC[C@]1(Cc2cc(Br)ccc2Br)CCCOC1 2006502299 ZOYQYROLERJPDU-CYBMUJFWSA-N 426.974 4.946 50 10 IJGE CCc1nn(C[C@@H](CBr)C(C)(C)C)c(CC)c1I 2032918119 KVFFWCRPSUYUOC-SNVBAGLBSA-N 427.168 4.670 50 10 IJGE CCC(CC)(CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1 2044693245 JANOJUPWXQIPGZ-QWHCGFSZSA-N 431.337 4.575 50 10 IJGE CCC[C@H](CBr)CN=[S@](=O)(C(C)C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2063272927 HDRADNITVXZJIW-TWKFVSLJSA-N 439.460 4.683 50 10 IJGE Cc1nn(C)c(Br)c1[C@H](Br)Cc1ccc(Br)cc1 2065888124 VFUTVTVAMYLBLT-LLVKDONJSA-N 436.973 4.932 50 10 IJGE CC1(C)C[C@@](C)(CCl)CN1c1ncc(I)cc1Br 2078800943 WMRAREVPMPMQBO-ZDUSSCGKSA-N 443.554 4.683 50 10 IJGE Clc1cc(CN2CC[C@H](Br)CC23CC3)ccc1I 2086661153 KUGXTFFVHBRHOM-NSHDSACASA-N 440.550 4.837 50 10 IJGE C[C@@H](CCBr)CCN=[S@](=O)(CCNC(=O)OC(C)(C)C)c1ccccc1 2107394621 MJRUWDAVNONEMZ-QMTYFTJSSA-N 447.439 4.849 50 10 IJGE FC1(F)CCC2(CC1)[C@@H](Br)C[C@H]2OCCOCCOCc1ccccc1 2121105085 MPFHPRHRIBNTBN-ZWKOTPCHSA-N 433.333 4.968 50 10 IJGE C[C@H]1C[C@@H](CCNC(=O)OC(C)(C)C)CCN1C(=O)c1ccc(CBr)cc1 2162879266 ONDUHIBYAHJOLX-HOTGVXAUSA-N 439.394 4.737 50 10 IJGE O=S(=O)(c1cc(CBr)sc1Br)N(C1CCC1)C1CCC1 2179779127 IYNHCYUKXJFONA-UHFFFAOYSA-N 443.226 4.501 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1C1CCN(CC2(CBr)CCCC2)CC1 2185499900 IDFJUUVKZXMPOW-UHFFFAOYSA-N 441.414 4.891 50 10 IJGE COc1cc(F)c([C@H](Cl)c2nn(C)c(Br)c2C)cc1Br 2202901841 IETKDRMBJQYSNO-NSHDSACASA-N 426.511 4.729 50 10 IJGE C[C@H](CC1CCN(CCCCCI)CC1)NC(=O)OC(C)(C)C 2211186070 NJDMUUQVELAKJK-OAHLLOKOSA-N 438.394 4.607 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@]12CCC[C@@H](CN(C[C@@H](CBr)C3CCC3)C1)C2 2226555562 YDKZNQCGEMIZBI-HGHGUNKESA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1 2242382841 LUAMZZPUMTWXFA-XQQFMLRXSA-N 430.895 4.697 50 10 IJGE CC(C)(C)OC(=O)NCC1CC([S@](C)(=O)=NCCCCCCCBr)C1 2263156739 YGNWPQQZAHFMNY-HRTIZWQRSA-N 439.460 4.733 50 10 IJGE C[C@@]1(CNC(=O)c2cc(Br)c(F)cc2Cl)CCC[C@@H]1Br 2286883704 QMRKCCQQJFUJFX-JSGCOSHPSA-N 427.539 4.925 50 10 IJGE Cc1nc(C(=O)N(CCC(C)(C)C)C[C@@H](C)Br)c(Br)s1 2288072732 BZUPATPEBHRPLT-SECBINFHSA-N 426.218 4.876 50 10 IJGE COc1ccc(-c2csc(C(C#N)=CNc3ccc(F)c([N+](=O)[O-])c3)n2)cc1OC 2297477346 OLPBSTOOGDNZID-UHFFFAOYSA-N 426.429 4.851 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=C3C(=O)N(C4CCCC4)C(=O)C(C#N)=C3C)o2)cc1 2314617331 WEGDJQUPXWHXAY-UHFFFAOYSA-N 444.487 4.658 50 10 IJGE N#CC(=CNc1ccc(Cl)cc1C(F)(F)F)C(=O)N1CCN(Cc2ccccc2)CC1 2325449206 NVOAMUOLRGIAFD-UHFFFAOYSA-N 448.876 4.523 50 10 IJGE N#CC(=C(O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1nc(-c2cccs2)cs1 2331327547 RXCQCCYYBYHBDN-UHFFFAOYSA-N 440.506 4.566 50 10 IJGE CO[C@@H](CO[C@]1(CBr)CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1 2336212982 TZBKKXBAJXMGOF-PXNSSMCTSA-N 428.367 4.555 50 10 IJGE C[C@](CI)(OCc1ccccn1)c1ccccc1Br 2340144197 LFCBMUMIWOUAGT-OAHLLOKOSA-N 432.099 4.711 50 10 IJGE Cc1c(CN(Cc2ccccc2)[C@H](CBr)C2CC2)cnn1CC(F)(F)F 2342660834 BCYMVLGTXDRRFL-GOSISDBHSA-N 430.312 4.930 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc(C(F)(F)F)cc1 2343415183 YZLPQJVCCQVUHB-QGZVFWFLSA-N 430.264 4.806 50 10 IJGE FC1(F)C[C@]12C[C@@H]2CO[C@H](CI)c1ccccc1Br 2352505660 BOWCPUHVJBNJGG-WQAKAFBOSA-N 443.069 4.987 50 10 IJGE O=[N+]([O-])c1ccc(CBr)c(OCc2cccc(I)c2)c1 2367526731 LUBQTUQHUVQFER-UHFFFAOYSA-N 448.054 4.673 50 10 IJGE Cn1cc(C(=O)NNC(=O)c2ccc(-c3nc4ccccc4s3)s2)c2ccccc21 26938684 XKVWHNCNULGMNL-UHFFFAOYSA-N 432.530 4.591 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4cccc(C)c4)ccc32)cc1 38677136 IWAMJKZNYQLMRD-SANMLTNESA-N 440.499 4.760 50 10 IJGE C=CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(C)c4)ccc32)c1 40529778 SMBLEJKHRXGRHB-VWLOTQADSA-N 438.483 4.997 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccc(C)cc2C)ccc1OCc1ccccc1C 40911561 QILDOXYWYOOCGM-JFLMPSFJSA-N 432.520 4.729 50 10 IJGE CCOc1ccc(Br)cc1/C=N/NC(=O)COc1cc(C)c(Cl)c(C)c1 40911899 GFRBIFKSRMJBOK-LSHDLFTRSA-N 439.737 4.647 50 10 IJGE COc1ccc(CCCC(=O)N/N=C/c2ccc(OCc3nc4ccccc4[nH]3)cc2)cc1 59501661 ONPOJGVVKFCXOO-WPWMEQJKSA-N 442.519 4.624 50 10 IJGE COc1cc(SC#N)ccc1N/C=C1/C(=O)N(c2ccc(Br)cc2)N=C1C 101124996 OTCLWDGEQSQNEN-MHWRWJLKSA-N 443.326 4.749 50 10 IJGE O=S(=O)(Nc1ccc(CBr)cc1)c1cc(Cl)c(Br)s1 136875463 APKGVDQWLWRZDD-UHFFFAOYSA-N 445.585 4.860 50 10 IJGE C=CCOc1ccc(C(=O)NN=Cc2ccc(OC(=O)/C=C\c3ccccc3)cc2)cc1 254484323 JYPJBQSVSUMOMC-MDZWSVBZSA-N 426.472 4.634 50 10 IJGE Cc1ccc(-n2c(SCC(=O)NN=Cc3cccs3)nnc2-c2ccccc2)cc1 254757283 IMAUFQZPQSKESF-UHFFFAOYSA-N 433.562 4.547 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)O[C@@H]1CCCc2ccccc21 303741349 LERCXQWWWNOFCV-APWZRJJASA-N 445.341 4.799 50 10 IJGE C[C@H](Br)c1cn(-c2c(Br)cc(Cl)cc2Br)nn1 304158688 VNWQDQGXPPHGBJ-YFKPBYRVSA-N 444.352 4.902 50 10 IJGE Cn1ncc([C@@H](Br)c2ccc(C(C)(C)C)s2)c1I 386273699 XTYDZFUSDRJDIK-LLVKDONJSA-N 439.160 4.868 50 10 IJGE Clc1ccc(I)c(CN2CCC[C@H](CCBr)C2)c1 405317500 XFGJWVANTSPVFD-LLVKDONJSA-N 442.566 4.942 50 10 IJGE CN(CC1CCN(Cc2ccccc2)CC1)c1cc(CBr)sc1[N+](=O)[O-] 720017581 WWZRDCRJSHBZAK-UHFFFAOYSA-N 438.391 4.900 50 10 IJGE COc1cccc(-c2nn(-c3ccc(C)cc3)cc2C(=O)NNc2cccc(F)c2F)c1 743721351 DKIANRNNXTZPOR-UHFFFAOYSA-N 434.446 4.891 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])c2ncccc12)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 770136818 UUMRSJOWMZKFAE-OAQYLSRUSA-N 445.397 4.503 50 10 IJGE CC[C@@H]1CCCC1=NNC(=O)COc1c(C)cc(Br)cc1Br 1083994769 OBBZSPMYKYLWLU-LLVKDONJSA-N 432.156 4.581 50 10 IJGE CCOc1cc(C=NNC(=O)CC#N)ccc1OC(=O)c1sc2ccccc2c1Cl 1084197614 COIWLBUMBUSUMO-UHFFFAOYSA-N 441.896 4.536 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2[nH]ccc2-c2c(Cl)cccc2Cl)c1 1455406593 OWSCXVTZONYCHV-UHFFFAOYSA-N 429.332 4.601 50 10 IJGE COc1ccc(C(=O)NNc2ccc(OCCOc3cccc(Cl)c3)cc2)cc1OC 1858080424 CCNKQAWFJBAWLM-UHFFFAOYSA-N 442.899 4.572 50 10 IJGE Cc1cccc(N2C(=O)c3ccc(C(=O)Nc4ccc(SC#N)cc4)cc3C2=O)c1C 1859466965 HQZQANSHQMBPRW-UHFFFAOYSA-N 427.485 4.930 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(F)cc2)[C@@H]1c1ccccc1Cl 1865686522 XFCYRUYESZMUDN-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccc(C)cc2)c1 1865694664 YURHBZBHEWYVHJ-HSZRJFAPSA-N 428.536 4.809 50 10 IJGE CCc1nn(CC)c2c1[C@@H](c1ccccc1OCc1ccc(Cl)cc1)C(C#N)=C(N)O2 1865703528 AJGGSEXQKJZIOT-NRFANRHFSA-N 434.927 4.916 50 10 IJGE CCc1nn(Cc2ccc(C)cc2)c2c1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865705738 DNAUIEWIKGSOFB-FQEVSTJZSA-N 449.898 4.582 50 10 IJGE C[C@H](NC(=O)c1ccc(OCc2ccccc2)cc1)c1nnc(CBr)s1 1877570949 LPMQJMAIVYJORZ-ZDUSSCGKSA-N 432.343 4.503 50 10 IJGE CCN[C@H](c1ccc(Br)c(C)c1Br)[C@@H]1C[C@H]1Br 1911311444 ANFQLDIHMWHNLF-IRUJWGPZSA-N 425.990 4.954 50 10 IJGE CN(Cc1ccsc1Br)C[C@H](Br)COCc1ccccc1 1916370196 QDLFDGBDJRSFKS-HNNXBMFYSA-N 433.209 4.923 50 10 IJGE C[C@@H]1[C@H](CBr)CCN1Cc1cc(Br)ccc1Br 2006507403 HUHGXKXWIABWAI-ZJUUUORDSA-N 425.990 4.817 50 10 IJGE CN(Cc1cccc(Br)c1Br)C[C@H]1C[C@H](Br)C1 2020194788 QFMBITWRIOBVTL-HOMQSWHASA-N 425.990 4.817 50 10 IJGE CC(C)CN(CCBr)C(=O)c1cc(Br)ccc1Br 2036717164 CAPIRXBIHAXLKU-UHFFFAOYSA-N 441.989 4.705 50 10 IJGE C[C@@]12CN(Cc3c(Br)cccc3Br)C[C@]1(CBr)C2 2046802410 NJHQISQWCOHTQZ-ZIAGYGMSSA-N 438.001 4.819 50 10 IJGE CC(C)N1C[C@@H](Br)[C@@H](Cc2cc(Br)ccc2Br)C1 2054720272 WNEBCRSYEZVJIM-SMDDNHRTSA-N 440.017 4.858 50 10 IJGE CC[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](C)C[C@@H]1C(F)(F)F 2058048460 DWBHFDQSJAUIGZ-MGPQQGTHSA-N 431.337 4.670 50 10 IJGE Cc1ccc(S(=O)(=O)N(Cc2ccccc2)CC(F)(F)F)cc1CBr 2059267087 LSSNBQGCVKSOOT-UHFFFAOYSA-N 436.293 4.643 50 10 IJGE CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(CBr)c1F 2059312081 GGUZOLXSSNCCAN-CYBMUJFWSA-N 432.330 4.849 50 10 IJGE O=C(CBr)c1cc(I)c(C(F)(F)F)cc1C(F)F 2060394907 XZHOURVPKKCQAL-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1Br 2073313844 ZHJZPIXWAQSTTA-PELKAZGASA-N 439.973 4.600 50 10 IJGE C[C@@H](Cl)[C@H](NC(=O)c1cc(Br)c(Br)s1)C(F)(F)F 2074737984 NFCFSBNQZAMSRI-CVYQJGLWSA-N 429.483 4.561 50 10 IJGE O=S(=O)(C[C@@H](Br)c1ccc(OCc2ccccc2)cc1)N1CCCCC1 2089397975 MGWQMVFSXMHFMX-HXUWFJFHSA-N 438.387 4.517 50 10 IJGE CC[C@@H]1CC[C@@H](C)N(S(=O)(=O)c2cc(CBr)sc2Br)C1 2179788146 YOPMJMHMOPRVLL-NXEZZACHSA-N 445.242 4.605 50 10 IJGE CC(C)CCN(C1CC1)S(=O)(=O)c1cc(CBr)sc1Br 2179791612 TXNCVQFLMLETKG-UHFFFAOYSA-N 445.242 4.605 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)cnc2n1C[C@]1(Br)CC1(F)F 2202501901 AWFAGTAJKBGKLC-KSBSHMNSSA-N 429.490 4.666 50 10 IJGE Cc1ccc(C(=O)N2CC[C@H](Br)CC23CCC3)cc1I 2232830970 OTPAEYRMIMFKPJ-ZDUSSCGKSA-N 448.142 4.522 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@@H]2C[C@H](Br)CC[C@H]21 2264507574 SCVGPZMGEACUJS-NQMVMOMDSA-N 427.589 4.942 50 10 IJGE COc1ccc([C@@H](Br)C2CC3(CCCO3)C2)cc1I 2269538257 CBHXFQZSRYCHQJ-XGTXGMFGSA-N 437.115 4.695 50 10 IJGE O=C1Cc2cc([C@@H](Br)c3cocc3Br)c(Br)cc2N1 2270464178 NKMRHTFUQYDODK-CYBMUJFWSA-N 449.924 4.784 50 10 IJGE CC1(C)[C@@H](NC(=O)c2cc(F)c(Br)cc2Cl)CC[C@H]1Br 2282971888 ITDQYJFLQBBMBC-NEPJUHHUSA-N 427.539 4.924 50 10 IJGE COc1cc(F)c(CBr)c(N2C[C@@H]3CN(Cc4ccccc4)C[C@]3(C)C2)c1 2283391739 JZFJTEOZOMXDRP-HTAPYJJXSA-N 433.365 4.688 50 10 IJGE COc1ccc(NC(=O)C(C#N)=Cc2ccc(OCc3ccc(C(=O)O)cc3)cc2)cc1 2294156117 QCGYUCABEPBSDF-UHFFFAOYSA-N 428.444 4.518 50 10 IJGE C[C@@H](Br)CCCN(C)C(=O)c1scc(Br)c1Br 2299510428 YGNBGILTTVGGLY-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Br)c2)C[C@@H]1Cl 2306219112 IPVABHFFJKILJZ-LBPRGKRZSA-N 428.539 4.503 50 10 IJGE FC1(F)C[C@@]1(CBr)COc1cc(I)ccc1Cl 2306895654 PSHQFFYXWLONOP-SNVBAGLBSA-N 437.449 4.744 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)Nc2ccc(CC)cc2)c(Br)cc1OC 2313667947 ZMYHKWQNYOMYAM-UHFFFAOYSA-N 429.314 4.964 50 10 IJGE COc1ccc(C(C#N)=Cc2cccc(OC(=O)Cc3ccc(OC)c(OC)c3)c2)cc1 2320511022 JYQMAHIYRWKDNE-UHFFFAOYSA-N 429.472 4.925 50 10 IJGE C[C@H]1CCc2[nH]c3ccc(C(=O)NN=Cc4cc(Br)ccc4O)cc3c2C1 2323163628 SDBBTLYAJIEIFW-LBPRGKRZSA-N 426.314 4.525 50 10 IJGE CN(C)c1ccc([C@@H](C(=O)NC2CCCCC2)N(Cc2cccs2)C(=O)CCl)cc1 3037651 WBMLDOFYSMBTHQ-QFIPXVFZSA-N 448.032 4.572 50 10 IJGE Cc1c(C(=O)NCc2ccco2)oc2c1/C(=N/NC(=O)c1cccc3ccccc13)CCC2 40813587 WMJZXUIYCZMEKA-SGWCAAJKSA-N 441.487 4.735 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2ccc(F)cc2)ccc1OCc1ccc(C(=O)O)cc1 59942374 YVLTXBGSKLXUHO-UNOMPAQXSA-N 446.434 4.657 50 10 IJGE CCC(CC)(CCl)NS(=O)(=O)c1cc(Br)c(C)cc1Br 155822300 HAKFPZHHGPELFU-UHFFFAOYSA-N 447.620 4.596 50 10 IJGE CCOC(=O)[C@@H]1[C@H](c2cccs2)C(C#N)=C(SCc2ccc(Cl)cc2)N[C@]1(C)O 252622577 NYJQMNSVNRMIKW-BBTUJRGHSA-N 448.997 4.645 50 10 IJGE O=S(=O)(CCCCCl)Nc1c(Br)cc(Cl)cc1Br 310581350 WYMBKOROWPVLGP-UHFFFAOYSA-N 439.984 4.626 50 10 IJGE CCC(CC)(CBr)CNS(=O)(=O)c1c(Cl)cccc1Br 394482606 UXNWXPWVLGHGPK-UHFFFAOYSA-N 447.620 4.582 50 10 IJGE O=C(NNc1cccc(F)c1F)c1nn(-c2cccc(Br)c2)c2c1CCCC2 743720439 CKVVBVXHIIFWBN-UHFFFAOYSA-N 447.283 4.549 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)s2)cc1 748161404 KAWIEDFVSAXPEW-UHFFFAOYSA-N 441.361 4.882 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)c2cc(Cl)ccc2Sc2ccccc2)cc1 759971658 TWSKYKQGSWVQDF-UHFFFAOYSA-N 432.954 4.652 50 10 IJGE C[C@](O)(CNC(=O)C(=O)Nc1cccc(S(F)(F)(F)(F)F)c1)C1CCCCC1 792333660 WDFPPBIHCPKBIF-KRWDZBQOSA-N 430.439 4.730 50 10 IJGE Cc1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1C(=O)N(C)C(C)C 799426165 WCGYIGULBSDMHW-UHFFFAOYSA-N 433.434 4.515 50 10 IJGE COc1ccc2nc(C3CC3)cc(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c2c1 799751495 VCRUOJFCNUMVQI-UHFFFAOYSA-N 426.398 4.768 50 10 IJGE CC(=O)c1ccc(Oc2ccc(C(=O)NNC(=S)Nc3cc(C)ccc3C)cc2)cc1 1618571071 JIZIYQPTHKMJFD-UHFFFAOYSA-N 433.533 4.930 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)/C(=C/c2cccc(Cl)c2)c2cccs2)c1 1633769273 PUASFNQIUGIIGE-XMHGGMMESA-N 437.977 4.941 50 10 IJGE CC(C)Oc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2-c1ccccn1 1865705153 NMHJSFVNZDAFOR-QHCPKHFHSA-N 449.514 4.940 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1c(Cl)cccc1Cl 1873795020 NSWANTZZXJSZJE-VQXFCIMOSA-N 436.339 4.580 50 10 IJGE CN(CC(C)(C)CI)[C@H]1CCCC[C@@H]1N(C)C(=O)OC(C)(C)C 1904651857 UYFRKTFNAWRTDI-GJZGRUSLSA-N 438.394 4.558 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@@H](CCl)C2(CCC2)C1 1914476371 ACOCUENROOVANE-MRVPVSSYSA-N 427.589 4.754 50 10 IJGE O=S(=O)(c1cc(CCl)ccc1Br)N(Cc1ccccc1)CC1CC1 1946854955 SAXNMOHZLGADPM-UHFFFAOYSA-N 428.779 4.789 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]3(CC[C@@H](CI)O3)C[C@H]21 1979566490 JXTHQTSGRCEHRL-FSZRXZPDSA-N 435.346 4.539 50 10 IJGE FC1(CBr)CCN(Cc2c(Br)cccc2Br)CC1 2039796110 DJIPKEZHTOBEIO-UHFFFAOYSA-N 443.980 4.911 50 10 IJGE Brc1ccc(CN2CCC3(CC(Br)C3)C2)c(Br)c1 2053755028 OEDOPGRWDNBPAF-UHFFFAOYSA-N 438.001 4.961 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1cc(Cl)ccc1Br 2081235288 DJUITFXSTDDZOA-QPUJVOFHSA-N 444.538 4.682 50 10 IJGE COc1ccc(-c2csc([C@@H](C#N)C(=O)C(C#N)=Cc3ccccc3)n2)c(OC)c1OC 2084349520 WZKNNJMIESMSSA-SFHVURJKSA-N 445.500 4.619 50 10 IJGE Clc1cccc(CN2CCC(COCCBr)CC2)c1Br 2167402283 SUMYNTNIAVVPEK-UHFFFAOYSA-N 425.592 4.726 50 10 IJGE C[C@]1(CCOCc2ccccc2)CCN1S(=O)(=O)c1cc(CCl)ccc1Cl 2197757034 ZTEUNCODXBLRRB-HXUWFJFHSA-N 428.381 4.839 50 10 IJGE Cn1nc(Br)c([C@@H](Cl)c2c(Br)cc(F)c(Cl)c2F)n1 2226973394 YMHGZBRPACZBQV-ZETCQYMHSA-N 435.881 4.600 50 10 IJGE COc1cc(OC)c([C@H](Br)[C@@H]2C[C@@H]2Br)cc1Br 2252870741 POXXVJRTSXOOMH-UTMSNSNXSA-N 428.946 4.686 50 10 IJGE Clc1ccc(I)cc1OCC1(CBr)CCOCC1 2259952744 FUPWAQJJVZAAFB-UHFFFAOYSA-N 445.522 4.515 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@@H](Br)c1cc(Br)n(C)n1 2264366768 LPBRPDUGHYYRTL-GFCCVEGCSA-N 428.939 4.982 50 10 IJGE O=C(NC[C@H]1CCC[C@@H](CCl)C1)c1ccc(Cl)c(I)c1 2283658617 XQNTVXYTLFUEPG-MNOVXSKESA-N 426.125 4.720 50 10 IJGE O=C(CNc1ccc2ccccc2c1)NN=Cc1ccc(OC(=O)C=Cc2ccco2)cc1 2297297372 KVDIIRXMHFUMIU-UHFFFAOYSA-N 439.471 4.614 50 10 IJGE Br[C@H]1CCC[C@H]2CC[C@H]1N2Cc1sccc1I 2301069603 YPYLZKAMQIECMQ-JBLDHEPKSA-N 426.161 4.633 50 10 IJGE Clc1ccc(COc2cc(CBr)ccn2)c(I)c1 2317811010 JRYSCYHBHCXSGT-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE Clc1ccc(CN2CCCC[C@@H](CBr)C2)c(I)c1 2318525657 BBIPWBYCNVEYAH-NSHDSACASA-N 442.566 4.942 50 10 IJGE CCCN1C[C@@H](Br)[C@@H](Cc2ccc(Cl)cc2I)C1 2318558447 VEJRDBPQKYKOHX-WCQYABFASA-N 442.566 4.592 50 10 IJGE C[C@H]1C[C@@H](Cl)CCN(Cc2ccc(I)c(Br)c2)C1 2325223227 WQESIQPSZKYYPA-JQWIXIFHSA-N 442.566 4.893 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@H]2CC(Br)C[C@@H](C2)C1 2338881238 YDBPBEMSGOTACD-HTQZYQBOSA-N 427.589 4.800 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@@]1(F)CN(C[C@@](C)(CBr)C(C)(C)C)C2 2352078126 OIRAZTMCNKNQME-AQNXPRMDSA-N 435.422 4.905 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@](C)(CBr)C(C)(C)C)C2(CCOCC2)C1 2380203942 VRVGGLRCUFBMDL-JXFKEZNVSA-N 447.458 4.582 50 10 IJGE COc1ccc([C@@H](C(=O)NC2CCCCC2)N(Cc2cccs2)C(=O)CCl)cc1 3039738 ANWVTQVDUYAEIV-NRFANRHFSA-N 434.989 4.514 50 10 IJGE CCOc1ccc2ccccc2c1/C=N/NC(=O)CCOc1cccc(Br)c1 3192782 PEZIRURSHZOGGW-BUVRLJJBSA-N 441.325 4.920 50 10 IJGE O=C(N/N=C/c1ccc(-c2cccc(Cl)c2)o1)C(=O)Nc1ccc(Cl)c(Cl)c1 58914633 WSTXCMOZONEAFQ-AUEPDCJTSA-N 436.682 4.996 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1Cc1ccc(Br)s1 98040462 UJURCINFRWMUAC-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CCOC(=O)c1ccc(NC(=O)/C(C#N)=C\c2c(-c3ccccc3)nc3ccccn23)cc1 102925972 LXGQOIRUMYLSAZ-SILNSSARSA-N 436.471 4.724 50 10 IJGE COc1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCc1cccc(Cl)c1 169879813 MHMSOZXLLSYWJK-ZMOGYAJESA-N 439.855 4.600 50 10 IJGE COc1ccc([C@H](C)N/C=C(/C#N)C(=O)NC(c2ccccc2)c2ccccc2)cc1OC 216974212 RTUWNWOMXHTZJU-FGLBZAAHSA-N 441.531 4.668 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1Br)c1ccc(Br)cc1Br 232461197 YGBRMIBNBXNRAB-CMPLNLGQSA-N 439.973 4.648 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCCC[C@H]1CBr 232474701 KPXVVMWYSNVTFB-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE CN(c1ncc(Br)cc1Br)[C@H]1CCCC[C@H]1Br 252924157 KVBUUFLXPFGINV-KOLCDFICSA-N 426.978 4.749 50 10 IJGE O=C(NN=Cc1cn(-c2ccccc2)nc1C(=O)c1ccccc1)c1ccc(Cl)cc1 254583947 VNMRCANVZNVHBP-UHFFFAOYSA-N 428.879 4.521 50 10 IJGE Brc1cnc(N2C[C@H]3C[C@H](Br)CC[C@H]3C2)c(Br)c1 398719436 YDKYUJKLPTWCRF-IVZWLZJFSA-N 438.989 4.606 50 10 IJGE O=C(NCC1(CBr)CCC1)c1cc(Br)cc(Br)c1 717681670 YRJNRYCPEGEZNC-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE CC(C)N(CCCCl)C(=O)c1ccc(I)c(Br)c1 721607367 YOELJBPAVMKOIV-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2cccc(-c3nc[nH]n3)c2)c(C)n1-c1ccccc1F 733980180 NRGNMRCFYKEWTE-YBFXNURJSA-N 426.455 4.564 50 10 IJGE CC(C)(CNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)c1cccc(F)c1 735658217 DFZGGLDTSWPBIX-ZHZULCJRSA-N 441.510 4.604 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)c(C)n1CC(C)C 741605406 KFFHGBLKBSSPFS-WVEXNBMASA-N 438.641 4.929 50 10 IJGE O=C(NNc1cc(Cl)ccc1Cl)c1cc(I)c(F)cc1F 772461074 BQLATEZLZSCUBH-UHFFFAOYSA-N 443.018 4.633 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2ccccc2NCCc2ccc(Cl)cc2)c1 1303280597 LPXMWSNVNMZFFV-UHFFFAOYSA-N 448.979 4.607 50 10 IJGE C=CCCC[C@@H](C(=O)NNc1cc(C(=O)OC)ccc1Br)c1ccccc1 1468499742 BCFHNTVIIARQQU-QGZVFWFLSA-N 431.330 4.819 50 10 IJGE C=CCC[C@@H](NC(=O)NNc1ccc(CC(=O)OC)cc1)c1ccc(C(F)(F)F)cc1 1469490715 FWUZGDICTYDWTQ-LJQANCHMSA-N 435.446 4.755 50 10 IJGE C/C(=C\C1CCC(C)CC1)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1 1544388620 PGRPTQCHEHHLOT-AQMGIUDQSA-N 445.607 4.534 50 10 IJGE C#CCOc1cc(F)ccc1NC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2 1667563437 XUDLBOAUKOWXCH-HNNXBMFYSA-N 443.544 4.517 50 10 IJGE CCCCOc1ccc(C=NNC(=O)COc2ccc(Br)cc2CC)cc1 1772756103 YWUVANFNVVDJDS-UHFFFAOYSA-N 433.346 4.720 50 10 IJGE Cc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865701958 JJJAKBWGJXKFNB-GOSISDBHSA-N 433.245 4.984 50 10 IJGE Cc1cc(F)c(C[C@@H](CBr)NC(=O)OC(C)(C)C)c(Br)c1 1885093233 LOKFOUZOGVVXAQ-JTQLQIEISA-N 425.136 4.727 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)C(=O)c1ccc(I)cc1 1915091410 WZZJAZQOVBXJNH-MRXNPFEDSA-N 427.713 4.951 50 10 IJGE Cc1c(Br)c(CN(Cc2ccccc2)[C@H](CBr)C2CC2)nn1C 1915186525 MCBSWFSIKPMJPU-QGZVFWFLSA-N 441.211 4.667 50 10 IJGE O=S(=O)(c1ccsc1Cl)N(Cc1ccccc1)C1(CBr)CCC1 1915757402 ZQIPWIHPBXOEPV-UHFFFAOYSA-N 434.808 4.910 50 10 IJGE CCN(C[C@](C)(CI)O[C@H](C)CC1CC1)C(=O)OC(C)(C)C 1917441096 CLQINUIVMWEQNR-DYVFJYSZSA-N 425.351 4.642 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1cscc1OCc1ccccc1 1993390808 LDAYWWKDAYIDLM-BBRMVZONSA-N 443.350 4.907 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)Cc1cccc(Cl)c1C(F)(F)F 1994843316 YEHLGDMGKDSQRB-LLVKDONJSA-N 446.650 4.961 50 10 IJGE C[C@H]1C[C@@H]1N(CCBr)Cc1cccc(Br)c1Br 2002027622 VHJIVPKVHRNLDM-CABZTGNLSA-N 425.990 4.817 50 10 IJGE COC[C@H](C)COc1c(Br)cc(CBr)cc1Br 2022005934 NZCPNFWZYRBQOP-QMMMGPOBSA-N 430.962 4.768 50 10 IJGE CCC[C@H](CBr)CN=[S@]1(=O)CC[C@H](CNC(=O)OC(C)(C)C)C1(C)C 2044704297 BMWWOLRVRLWJND-XGZNKIABSA-N 439.460 4.589 50 10 IJGE O=C(CCl)c1cc(OC(F)(F)F)c(I)c(C(F)(F)F)c1 2055117418 PZMMKKIAIZFCBF-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE O=S(=O)(c1ccc(Cl)cc1F)N(Cc1ccccc1)C1(CBr)CCC1 2057407957 LHZUKHPCRBRGDG-UHFFFAOYSA-N 446.769 4.988 50 10 IJGE CC(C)(C)OC(=O)N1CCOC2(CCC3(CC2)C[C@]3(CBr)C(F)(F)F)C1 2138799803 JFPXOQVDTLKNSL-OFLPRAFFSA-N 442.316 4.900 50 10 IJGE CCC[C@@](C)(CCl)NS(=O)(=O)c1cc(Br)c(C)cc1Br 2146580329 PMWBTWKDPNOELP-ZDUSSCGKSA-N 447.620 4.596 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]2CCC[C@H]2N1C[C@H](CBr)c1ccccc1 2164654449 AELCOYANOIHHPM-LWYYNNOASA-N 437.422 4.933 50 10 IJGE O=C(c1cc(Cl)cc(Br)c1)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Br)C2 2190680561 XBVKJQWLRIDICS-QNWHQSFQSA-N 425.523 4.581 50 10 IJGE O=C(c1ccc(OCc2ccccc2)cc1)N1CCC(OCCCBr)CC1 2207531863 NWIAMNJDLMQPDE-UHFFFAOYSA-N 432.358 4.672 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@]12CC[C@](C)(CI)O2 2243452552 LXXYSWSOTVBIJC-BMGDILEWSA-N 437.362 4.642 50 10 IJGE Br[C@@H]1C[C@H]2CCCC[C@H]2N(Cc2ccc(I)cc2)C1 2264828535 ZRHJZYHRCDTVOO-IIAWOOMASA-N 434.159 4.819 50 10 IJGE Cc1ccc(N(C)Cc2cccc(I)c2)c(CBr)n1 2271436233 CSXBCLOWDLYQKE-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2OCCOC2(C)C)c(Br)c1Cl 2283546474 DZUQRHHPYCAAHO-YPMHNXCESA-N 428.548 4.741 50 10 IJGE N#CC(=Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(=O)Nc1ccc(C(=O)O)cc1 2293311813 CNAJZMWDWYUYTK-UHFFFAOYSA-N 437.795 4.752 50 10 IJGE Clc1ccc(I)cc1CNCCCCCCBr 2307323692 CHQOVNPFZBXRNX-UHFFFAOYSA-N 430.555 4.990 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)C23CCC3)c(I)c1 2318530558 BQZARBZNTQEMRY-ZDUSSCGKSA-N 440.550 4.837 50 10 IJGE C[C@H]1[C@H](Cl)C[C@@H](C)CN1Cc1ccc(I)c(Br)c1 2325227848 FABXNCDPWHGFCD-GBIKHYSHSA-N 442.566 4.891 50 10 IJGE N#CC(=CNC[C@@H]1COc2ccccc2O1)C(=O)NC1CCCCCCCCCCC1 2325486026 ZYHBMZODJOQESY-JOCHJYFZSA-N 425.573 4.613 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@H]2CC(Br)C[C@@H](C2)C1 2338796879 WAXQSQGTIPGZLJ-HTQZYQBOSA-N 427.589 4.800 50 10 IJGE O=C(N[C@H]1C[C@H](CBr)C12CCC2)c1scc(Br)c1Cl 2351615014 SIWUPVMKHGCGFY-APPZFPTMSA-N 427.589 4.848 50 10 IJGE O=C(CCCOc1ccc(Cl)cc1Cl)N/N=C/c1cc([N+](=O)[O-])ccc1Cl 12577689 RTQNGEUEXHFWKH-UFFVCSGVSA-N 430.675 4.864 50 10 IJGE CC(C)N1CCC(=NNC(=O)c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2)CC1 14017239 YPWJSSOMWWETQG-UHFFFAOYSA-N 434.584 4.826 50 10 IJGE Cc1ccc(OCCn2cc(/C=C(/C#N)C(=O)NC[C@@H]3CCCO3)c3ccccc32)cc1C 33932572 PVIOAMSCDGCXBW-VNSJDZJPSA-N 443.547 4.539 50 10 IJGE O=C(N/N=C1/C(=O)N(C(c2ccccc2)c2ccccc2)c2ccccc21)c1ccc(O)cc1 59165655 OTSNFFFMMXJKFG-XLVZBRSZSA-N 447.494 4.663 50 10 IJGE CC(C)OC(=O)c1c(NC(=O)/C(C#N)=C\c2ccc([N+](=O)[O-])cc2)sc2c1CCCC2 102957815 ITWQQRUAYREYIU-PTNGSMBKSA-N 439.493 4.646 50 10 IJGE ClCCCc1ncc(-c2cc(Br)ccc2I)o1 236012089 ZAJPTKLOARXVCZ-UHFFFAOYSA-N 426.479 4.880 50 10 IJGE ClCc1cc2sc(I)cc2cc1I 307117772 VJSWXFYQZVBVTD-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CC(C)[C@](C)(CBr)NC(=O)c1ccc(Br)cc1Br 398563637 NBDLILSHBOETGA-ZDUSSCGKSA-N 441.989 4.751 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)NC1(CBr)CCCCCC1 713451245 GETZTYSKSQSRDE-UHFFFAOYSA-N 445.242 4.585 50 10 IJGE Oc1nc2ccc([C@H](Br)c3cccc(F)c3I)cc2o1 721698033 NKNQBPXIRKTZNF-LBPRGKRZSA-N 448.029 4.761 50 10 IJGE C[C@@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1ccc(Oc2ccccc2)cc1 726268644 GGIXSSRPNZEUSH-QGZVFWFLSA-N 426.476 4.732 50 10 IJGE COc1ccc(OC)c(C(C)=NNC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 1081111523 IJKXSVGVRWDMHG-UHFFFAOYSA-N 434.336 4.895 50 10 IJGE Cc1ccc(-c2ccc(C=NNC(=O)c3ccc(Br)cc3)o2)c([N+](=O)[O-])c1 1084059909 VTYOYTDEWGWKQK-UHFFFAOYSA-N 428.242 4.690 50 10 IJGE Cc1ccccc1NC(=O)C(=O)NN=Cc1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1084232404 JUJOMKXJWWZGJI-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2cc(Br)c(C)c(Br)c2)cc1 1084512276 BXQDVNADLMAKSY-UHFFFAOYSA-N 440.135 4.683 50 10 IJGE C=CCC[C@@H](NC(=O)NNc1ccc(C(=O)OC)cc1F)c1ccc(C(F)(F)F)cc1 1564407258 ZTZQBASJOOOJFI-QGZVFWFLSA-N 439.409 4.965 50 10 IJGE CC(=O)c1ccc(C(=O)NNC(=O)c2ccc(COc3ccc(Cl)c(C)c3)cc2)cc1 1587239675 JSNLLGOJJUZNCT-UHFFFAOYSA-N 436.895 4.505 50 10 IJGE CC(=O)N1CCCc2cc(NC(=O)NNc3ccc(Cl)c(C(F)(F)F)c3)ccc21 1623013121 QTRHDBJGNPYCSS-UHFFFAOYSA-N 426.826 4.807 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N(Cc2ccccc2)[C@H](C)CCl)c1Br 1914352235 DMIGUPYTODTJQG-LLVKDONJSA-N 436.824 4.946 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1ccncc1Br 1915262218 OCYMHFZQBORJIN-QGZVFWFLSA-N 440.179 4.906 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1C[C@]1(C)CC[C@@](C)(CI)O1 1979567069 NFDHHZWZTFGRIY-JLSDUUJJSA-N 437.362 4.929 50 10 IJGE CC[C@H](CCBr)CNC(=O)c1cccc(Br)c1Br 2031487303 SPYAFSWZHLWAFH-SECBINFHSA-N 441.989 4.753 50 10 IJGE COCCOC[C@@H](Br)CCc1cccc(Br)c1Br 2038176289 ZULBLELEIBABCM-NSHDSACASA-N 444.989 4.571 50 10 IJGE Cn1ncc(CC(CBr)(CBr)C2CCCC2)c1Br 2053027900 MDVHPCDRSZHLRC-UHFFFAOYSA-N 443.021 4.692 50 10 IJGE Brc1cccc(CN2CC[C@H](Br)[C@@H]2C2CC2)c1Br 2067016706 NHJBFLASAMHFSN-JSGCOSHPSA-N 438.001 4.959 50 10 IJGE CC(C)(C)N(Cc1ccccc1)S(=O)(=O)c1ccc(OCCCBr)cc1 2123247149 PKUDNXIWIYMWOC-UHFFFAOYSA-N 440.403 4.840 50 10 IJGE CC(CBr)(CBr)NC(=O)c1ccc(C(F)(F)F)c(Cl)c1 2146759322 KMOGGDXKDDZXBQ-UHFFFAOYSA-N 437.481 4.637 50 10 IJGE O=C(NCC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(CBr)cc1 2159218220 UTFSODJGKDOSLI-XDNSSPFJSA-N 427.386 4.755 50 10 IJGE CN(c1cc([N+](=O)[O-])ccc1CBr)[C@H]1CN(Cc2ccccc2)C(C)(C)C1 2176909394 UKNMBDIYZKGOBJ-LJQANCHMSA-N 432.362 4.979 50 10 IJGE CC[C@H](C1CCC1)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2179775476 LIHZFVDSVFXJKE-LLVKDONJSA-N 445.242 4.605 50 10 IJGE FC1(F)C[C@@]1(Br)Cn1c(CCCl)nc2cccc(Br)c21 2202505606 MVIAFQIROHYLHF-GFCCVEGCSA-N 428.502 4.753 50 10 IJGE Clc1ccc(Br)c(C[C@]23CO[C@](CI)(C2)C3)c1 2216255662 GGXCKTKTQNRQIF-BETUJISGSA-N 427.507 4.629 50 10 IJGE FC(F)(F)c1ccccc1CO[C@@H](CCl)[C@H](I)CCl 2227755176 SRGJJIQGKAQDMO-MNOVXSKESA-N 427.031 4.872 50 10 IJGE Fc1ccc2nc(CCCl)n(C[C@H]3CC3(Br)Br)c2c1F 2233038210 FVIGMRSXLVHXMR-SSDOTTSWSA-N 428.502 4.602 50 10 IJGE Cc1sc(C(=O)NC2(CCBr)CCSCC2)c(Br)c1C 2237627761 LWQTXHNTRPCQAO-UHFFFAOYSA-N 441.254 4.908 50 10 IJGE COC[C@]1(C)C[C@]1(CBr)Cc1ccc(I)c(Cl)c1 2257085893 QJTQMUITIUZRFV-KBPBESRZSA-N 443.550 4.925 50 10 IJGE CC1(C)CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@H]1CBr 2282983349 PHHMJBSCZNDVQK-MRVPVSSYSA-N 427.539 4.735 50 10 IJGE O=C(NC[C@@H]1CCC[C@H](Br)C1)c1cc(Br)c(F)cc1Cl 2285956923 CCXNOLSZAGDMEU-BDAKNGLRSA-N 427.539 4.925 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)CN(C)C[C@H]1CC1(Br)Br 2301978952 RZWDLAASJWQQIP-GHMZBOCLSA-N 434.054 4.870 50 10 IJGE CC[C@@H](C)[C@H](Cl)CNCc1ccc(I)c(Br)c1 2306226119 YBXPXWKGFOCKPG-BXKDBHETSA-N 430.555 4.797 50 10 IJGE CC(C)[C@@H](Br)C(=O)Nc1nc([C@H](NC(=O)OC(C)(C)C)C(C)C)cs1 2315749216 UWZIHQLOGNGUCZ-CHWSQXEVSA-N 434.400 4.723 50 10 IJGE COc1c(Br)cc(C)c(C(=O)[C@H]2C[C@H](Br)C2)c1Br 2317408076 MCWCBXHKPVWFAV-ZKCHVHJHSA-N 440.957 4.885 50 10 IJGE CC(C)N(C[C@@H](C)Br)C(=O)c1ccc(Cl)cc1I 2317769963 AWTIBDBSEZOCJG-SECBINFHSA-N 444.538 4.579 50 10 IJGE Fc1cc(Cl)c(Br)c(Cl)c1[C@H](Br)[C@@H]1CO[C@H]2COC[C@@H]12 2360416736 BKIQVVPAIGSDQH-LFLRCTCGSA-N 448.941 4.992 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)[C@@H]1CO[C@@H]2COC[C@H]21 2365229148 XBDCTFJNMHRVOG-HVCLTNNCSA-N 428.523 4.600 50 10 IJGE N#C/C(=C\c1ccc(OCc2ccccc2F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1O 12556026 FLZNQBSGSLFHGW-GZTJUZNOSA-N 433.395 4.564 50 10 IJGE C/C(=N/NC(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1)c1ccc2ccccc2c1 13138795 UNECYWUZUSMZTQ-JLPGSUDCSA-N 449.557 4.856 50 10 IJGE CCCOc1ccc(/C=C\C(=O)Oc2ccc(/C=C(/C#N)C(=O)OCC)cc2OC)cc1 33629504 KGKOWXGTTJAMNL-UZNKBILISA-N 435.476 4.573 50 10 IJGE Cc1ccc2c(CC(=O)N/N=C3\CCCc4oc(C(=O)N5CCCC5)c(C)c43)coc2c1C 40826678 PXUQHNSQORWQRV-NHFJDJAPSA-N 447.535 4.586 50 10 IJGE COC(=O)/C(C#N)=C/c1cccc(OC(=O)CCCOc2cc(C)c(Cl)c(C)c2)c1 40935857 MONLTTHMBOXPGJ-LDADJPATSA-N 427.884 4.801 50 10 IJGE COc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4)nc3c2)cc1OC(C)C 169926977 WJYQFSMYOFRHMO-CVKSISIWSA-N 428.492 4.790 50 10 IJGE CC[C@@](C)(CCCl)NC(=O)c1cc(Br)ccc1I 228557670 AIKXNYNJGZVBLS-ZDUSSCGKSA-N 444.538 4.581 50 10 IJGE CCCOc1ccc(C(CC)=NNC(=O)[C@]2(C)CC2(Br)Br)cc1 252616315 JZJCPZOBTUPRMA-INIZCTEOSA-N 446.183 4.602 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)O[C@@H]1CCCc2ccccc21 303741355 LERCXQWWWNOFCV-VQIMIIECSA-N 445.341 4.799 50 10 IJGE C[C@H]1C[C@@H](Br)CN(C(=O)c2cc(Br)sc2Br)C1 401899038 MDEMLMQCNHQOFO-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE Cc1ccc(O[C@H](C)C(=O)NN=Cc2c(O)ccc3ccccc23)c(Br)c1 585656592 RDJGOFUKUFPKJR-CQSZACIVSA-N 427.298 4.534 50 10 IJGE CC1(C)CC[C@H](CCl)N(C(=O)c2ccc(I)c(Cl)c2)C1 701597403 UTRCYUQJOAECID-LLVKDONJSA-N 426.125 4.814 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1 740059164 HJCGPSWNSKVWEU-UHFFFAOYSA-N 432.549 4.728 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=O)Nc3cccc(CCC(F)(F)F)c3)n[nH]2)cc1C 757618592 BUMZSHXNUJLKGD-UHFFFAOYSA-N 445.445 4.655 50 10 IJGE CC(C)(C)OC(=O)NNC(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 765225157 NQKATMVXPZMHRM-UHFFFAOYSA-N 429.864 4.637 50 10 IJGE Cc1ccc(NNC(=O)C(=O)Nc2ccc(Cl)cc2-c2cccc3ccccc23)nc1 789751406 CYERVIZASGXYNE-UHFFFAOYSA-N 430.895 4.945 50 10 IJGE Cc1ccc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1NC(=O)NC(C)(C)C 799754658 RASLQIJBGHHKFC-UHFFFAOYSA-N 433.434 4.562 50 10 IJGE Cc1cc(C=NNC(=O)CC(=O)NC2CCCCC2)c(C)n1-c1cc(Cl)ccc1Cl 1084502053 NDWNZFMGOHOCBI-UHFFFAOYSA-N 449.382 4.690 50 10 IJGE C=CCC[C@H](NC(=O)NNc1ccc(C(=O)OC)c(F)c1)c1ccc(C(F)(F)F)cc1 1680633964 VLLZSTNYRGPZNX-SFHVURJKSA-N 439.409 4.965 50 10 IJGE CCc1nn(CC(C)C)c2c1[C@@H](c1ccc(OC(=O)c3ccccc3)cc1)C(C#N)=C(N)O2 1865704991 JTZQLBDUQSESOS-QFIPXVFZSA-N 442.519 4.539 50 10 IJGE CC(C)C[C@H](CBr)CN1CCC[C@H](CNC(=O)OCc2ccccc2)C1 1905523652 HNVWEQNXLAVTPI-WOJBJXKFSA-N 425.411 4.682 50 10 IJGE Cc1cc2nc(CCl)n(CC3(N(Cc4ccccc4)Cc4ccccc4)COC3)c2cn1 1917641431 VZAGCZIDIGXHSB-UHFFFAOYSA-N 446.982 4.950 50 10 IJGE CC[C@H](C)[C@H](Br)CNC(=O)c1ccc(Br)cc1Br 2029977465 MGGYMEONUATTSW-QPUJVOFHSA-N 441.989 4.751 50 10 IJGE Brc1ccc(CN2C[C@H](Br)[C@H](C3CC3)C2)c(Br)c1 2031403279 PEVLKZWCQZKAIM-JSGCOSHPSA-N 438.001 4.817 50 10 IJGE BrC[C@@H]1C[C@H]2CN(Cc3c(Br)cccc3Br)C[C@H]12 2053980538 HKCQCAJBTUVTJR-GARJFASQSA-N 438.001 4.674 50 10 IJGE COc1c(C)cc([C@@H](Br)c2cc(I)sn2)cc1C 2056488627 XHNSWNBZENKXCF-GFCCVEGCSA-N 438.128 4.857 50 10 IJGE O=S(=O)(c1cccc(CBr)c1)N(CCC(F)(F)F)Cc1ccccc1 2059284749 PEKLORIPDZIGBK-UHFFFAOYSA-N 436.293 4.725 50 10 IJGE C[C@@H]1CCO[C@H]1CO[C@@](C)(CI)c1ccccc1Br 2096130627 XNTKDBYOWHIQCB-UGFHNGPFSA-N 439.131 4.541 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCc2ccccc2N(C[C@H](Br)C(F)(F)F)C1 2106781515 INWWHRCNPURBFF-HIFRSBDPSA-N 437.300 4.658 50 10 IJGE O=C(NC12CCC(CCl)(CC1)C2)c1cc(Br)c(Br)s1 2132808833 PPNHFARIBYLXQH-UHFFFAOYSA-N 427.589 4.945 50 10 IJGE C[C@@]1(CCOCc2ccccc2)CCN1S(=O)(=O)c1cc(CCl)ccc1Cl 2197757033 ZTEUNCODXBLRRB-FQEVSTJZSA-N 428.381 4.839 50 10 IJGE O=S(=O)(Cc1ccccc1Br)N(Cc1ccccc1)C1(CCl)CCC1 2218984035 OEXZDBAVMNOKSP-UHFFFAOYSA-N 442.806 4.943 50 10 IJGE CC[C@H](Br)c1nnc(-c2ccc(Cl)c(I)c2)o1 2248252878 PBAYIZRFNBYUHR-ZETCQYMHSA-N 427.467 4.841 50 10 IJGE O=C(N[C@H]1CCC[C@@H]1CCBr)c1cc(F)c(Br)cc1Cl 2282973998 FMPIUWONJFUBCQ-OQPBUACISA-N 427.539 4.925 50 10 IJGE Cc1ccc([C@@H](C)NC(=O)C(C#N)=Cc2c[nH]nc2-c2ccc(Br)cc2)cc1 2295266178 DRAPYGDIGRDRPI-OAHLLOKOSA-N 435.325 4.932 50 10 IJGE CC1(C)C[C@H](Br)CN1Cc1ccc(Cl)cc1I 2302307407 OSVAMGQBYXRZRR-JTQLQIEISA-N 428.539 4.692 50 10 IJGE CC(C)[C@@H]1C[C@H](Br)CN1c1ncc(Br)cc1Br 2304240421 WVZQMKYZQHLMDE-ONGXEEELSA-N 426.978 4.605 50 10 IJGE Clc1ccc(CN2C[C@@H]3CC[C@@H](Br)[C@H]3C2)cc1I 2315553880 YHFUGLYPNLPBCG-SDDRHHMPSA-N 440.550 4.550 50 10 IJGE C=CC[C@H](Br)[C@@H]1CCN1Cc1ccc(Cl)cc1I 2318537955 GTOWVZCLNCFOQS-JSGCOSHPSA-N 440.550 4.859 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc(C(F)(F)F)s1 2320357159 WZHURAOSFRJUMD-CYBMUJFWSA-N 436.293 4.867 50 10 IJGE COc1ccc(C(C#N)=Cc2cccc(OC(=O)c3cccc([N+](=O)[O-])c3)c2)cc1OC 2320511458 WZOCESGWGAHYDQ-UHFFFAOYSA-N 430.416 4.895 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2CC[C@H]1[C@H](Br)C2 2327409183 KXJYALVJLPBZDF-BHYNMZESSA-N 440.550 4.692 50 10 IJGE Cc1ccc(-c2csc(C(C#N)=C(O)c3ccc(NS(C)(=O)=O)cc3)n2)c(C)c1 2331308929 BSYMVDYFVUIWRV-UHFFFAOYSA-N 425.535 4.748 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)Cc3ccc(NC(C)=O)cc3)n2)c(OC)c1 2331385073 BNOGCHVEQGUEAO-UHFFFAOYSA-N 435.505 4.821 50 10 IJGE Cc1occc1C(=O)N/N=C1\CCCc2oc(C(=O)N3c4ccccc4C[C@@H]3C)c(C)c21 40823430 XSFFNWMOQYPADY-MYPNTVMWSA-N 431.492 4.551 50 10 IJGE CCOc1ccc(Br)cc1/C=N/NC(=O)COc1cc(Cl)ccc1Cl 40911903 FONMXSZMOIKUNU-ZVBGSRNCSA-N 446.128 4.684 50 10 IJGE O=C1[C@H](I)CCCCCCCCC[C@H]1I 100486891 LBWPQSVNTNSWKP-GHMZBOCLSA-N 434.099 4.687 50 10 IJGE C/C(N)=C(/C#N)C(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(C)cc1)CC2 103879108 DHTDSQDAYPQERK-DRQBTYKPSA-N 437.499 4.512 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C\Nc1cccc(Br)c1)C12CC3CC(CC(C3)C1)C2 217049582 VEPOWYNJPYNKGU-IAYYKLOSSA-N 428.374 4.990 50 10 IJGE CC[C@H](Br)CCNC(=O)c1cc(Br)c(Br)s1 219005487 UFDFWTSGVPVADW-LURJTMIESA-N 433.991 4.567 50 10 IJGE CCCCOc1ccc(C(=O)NN=Cc2cccc(OC(=O)c3ccc(OC)cc3)c2)cc1 254816637 KCBXUGNUCMUGHR-UHFFFAOYSA-N 446.503 4.857 50 10 IJGE CC[C@H](Cl)[C@H](CC)NC(=O)c1ccc(I)c(Br)c1 721601173 FIVGPDPOXKIYHJ-JQWIXIFHSA-N 444.538 4.580 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc(OCC3CCCCC3)cc2)c1C 736694675 BGCGTRASXQSTTE-UHFFFAOYSA-N 431.540 4.871 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2C[C@H]3CCCC[C@H]3C2)c(-c2ccc(Cl)cc2)n1 750139895 IQFBYJKCONNJEL-ZXPVFCOSSA-N 433.943 4.673 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc(-c3ccccn3)nc3ccccc23)c(C(F)(F)F)c1 799746686 PCZJRLQEJKYLGF-UHFFFAOYSA-N 433.393 4.944 50 10 IJGE CCCOc1ccc(Br)cc1C=NNC(=O)c1ccccc1Br 916247621 NDGPAUKDJZYEMZ-UHFFFAOYSA-N 440.135 4.764 50 10 IJGE COc1ccc(N2Cc3ccc(C(=O)NN=Cc4c(O)ccc5ccccc45)cc3C2)cc1 1083895085 QNYJDGRUYUOHFF-UHFFFAOYSA-N 437.499 4.838 50 10 IJGE C=CCOc1ccc(Br)cc1NC(=O)NNc1cc(C(F)(F)F)ccn1 1310862600 OPUREWLDQUZXRE-UHFFFAOYSA-N 431.212 4.576 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)[C@H](Oc1ccc(F)c(F)c1)c1ccccc1 1557584557 KAXGYOBTCAGVCJ-LJQANCHMSA-N 438.459 4.834 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)c1nc2ccccc2s1)c1ccc(C(F)(F)F)cc1 1633470469 CPKDERQWTRCGLD-HNNXBMFYSA-N 448.470 4.967 50 10 IJGE CC(=O)c1ccc(NC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)cc1C 1669982409 CJAKYRFJELVNIS-MRXNPFEDSA-N 427.570 4.877 50 10 IJGE CCCOc1ccc(C=NNC(=O)CCCOc2ccc(C)cc2Br)cc1 1772755713 PQYOCFUPJNIOMF-UHFFFAOYSA-N 433.346 4.856 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccccc1Cl 1865703562 BHSLLUSCDFWWIH-JOCHJYFZSA-N 434.927 4.900 50 10 IJGE Cc1nn(-c2ccccc2Cl)c2c1[C@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 1865714583 MWEZZKVJETXUEJ-GOSISDBHSA-N 441.716 4.815 50 10 IJGE Cc1c(Br)c(CN(Cc2ccccc2)[C@@H](C)CCBr)nn1C 1915082871 MJWODHHFQFIILC-ZDUSSCGKSA-N 429.200 4.667 50 10 IJGE CN(C[C@@]1(C(C)(C)C)CCC[C@@H](CI)O1)C(=O)OC(C)(C)C 1929975173 PCISIVFRMKTFOE-SUMWQHHRSA-N 425.351 4.642 50 10 IJGE BrC[C@@]1(Cc2ccc(Br)cc2Br)CCCOC1 1943848091 NXSUWYDZRUJSHC-ZDUSSCGKSA-N 426.974 4.946 50 10 IJGE CC(C)(C)[C@@H](CBr)CN1CCC[C@H](CNC(=O)OCc2ccccc2)C1 1977953680 VKKUOACSVRRYIP-MOPGFXCFSA-N 425.411 4.682 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1C[C@]1(C)CCC[C@H](CI)O1 1979567884 RXORHTWRONTICE-RKVPGOIHSA-N 437.362 4.929 50 10 IJGE CCC[C@@H]1C[C@@H]1CO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1993097194 OEIWAAXXSZAOAK-RKVPGOIHSA-N 437.362 4.644 50 10 IJGE CN(Cc1cc(Br)ccc1Br)[C@@H]1CCC[C@@H]1Br 2006498099 AXIHQQBLYUZXNW-QWHCGFSZSA-N 425.990 4.959 50 10 IJGE BrCC[C@@H](NCc1cc(Br)ccc1Br)C1CC1 2006499266 IUKXMRMYBYAMQC-CYBMUJFWSA-N 425.990 4.865 50 10 IJGE BrCC[C@H](NCc1cc(Br)ccc1Br)C1CC1 2006499267 IUKXMRMYBYAMQC-ZDUSSCGKSA-N 425.990 4.865 50 10 IJGE CN(Cc1ccc(Br)cc1Br)C1CC(CBr)C1 2018086497 FAQAGHNNDLYWKR-UHFFFAOYSA-N 425.990 4.817 50 10 IJGE CCC[C@H](CBr)CN1CCC[C@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2044705210 JMDAWTFBGTZACO-CJNGLKHVSA-N 431.337 4.719 50 10 IJGE FC(F)Oc1cc(CBr)c(OC(F)(F)F)cc1I 2060222099 IVNQEQGMMDVMBV-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE CCCN1CC[C@@H]([C@@H](Br)c2cccc(OCc3ccccc3)c2)S1(=O)=O 2089515988 UQPDUIQEPZUBQY-PMACEKPBSA-N 438.387 4.516 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@@H]2C[C@H](Cl)CC[C@H]21 2093947453 WTQBECOTSTZUCA-NQMVMOMDSA-N 427.589 4.895 50 10 IJGE C[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CN1CC1(CBr)CCCCCC1 2106787497 ZIIBZOARZZZJIQ-FGTMMUONSA-N 429.443 4.909 50 10 IJGE CN(C(=O)OC(C)(C)C)C1CCC2(CCCN2C[C@H](Br)C(F)(F)F)CC1 2111602795 KWBXVGHUDLTAFR-UUCFBXCCSA-N 443.348 4.956 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CCC(F)(F)[C@@H](CBr)C1 2115941695 CRSXABOYXURCMX-LURJTMIESA-N 437.531 4.656 50 10 IJGE O=C(c1cc(C(F)(F)F)ccn1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 2121515509 WCXGIQZJWDSTBH-KRWDZBQOSA-N 427.264 4.916 50 10 IJGE C[C@@H](Cl)c1nc2c(Br)cccc2n1C[C@@H]1COCCN1Cc1ccccc1 2194648518 IRUARCJDTADRCI-NVXWUHKLSA-N 448.792 5.000 50 10 IJGE COc1cc(Br)c([C@H](Br)C2CC(Cl)C2)c(OC)c1OC 2197079667 FUGUMMSHHVYGMV-WZQIAMPNSA-N 428.548 4.928 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)C(=O)Cc1ccc(Br)cc1Cl 2221699504 IWPWJNOWNGMHIY-QGZVFWFLSA-N 445.184 4.928 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCCBr)C[C@@H]1CC(F)(F)F 2223286800 RUDCYHWCTWMIEG-AWEZNQCLSA-N 431.337 4.815 50 10 IJGE CC(C)CN(CCCCI)C[C@H]1CCCN1C(=O)OC(C)(C)C 2243591035 NJZUJOXVFBDCBH-MRXNPFEDSA-N 438.394 4.559 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Cl)c1c(Br)cnn1C 2264356973 SPBMOPPRPKUNES-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE CN(Cc1ccccc1I)c1cccc(F)c1CBr 2265549355 YPZPLSZPXGMYIZ-UHFFFAOYSA-N 434.090 4.962 50 10 IJGE CC(C)c1cc(Br)cc(C(=O)NCCCCCI)c1 2265978837 CLWLTORNHXMQFT-UHFFFAOYSA-N 438.147 4.908 50 10 IJGE O=C(Nc1cccc(CBr)c1)c1c(F)cccc1I 2267696955 LINFVOYSYHGGHA-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE C[C@H](Br)CN(C(C)(C)C)S(=O)(=O)c1ccc(Br)cc1Cl 2288075088 QPETXHWEPPADAT-VIFPVBQESA-N 447.620 4.675 50 10 IJGE CC(C)[C@H](Cl)C(C)(C)Nc1ncc(I)cc1Br 2301981829 OEPWAOUIWLJECW-JTQLQIEISA-N 431.543 4.903 50 10 IJGE CC1(C)C[C@@H](CBr)N(Cc2ccc(Cl)c(I)c2)C1 2315553905 YPPVESWAHHRTKC-NSHDSACASA-N 442.566 4.940 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H]2C[C@H]3CBr)cc1I 2315555815 VUNRNOLKIMUXHB-WDMOLILDSA-N 440.550 4.692 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CCC[C@@]2(CNC(=O)OC(C)(C)C)C3)C1 2345007404 AKLRHHLSRLAHBT-KKSFZXQISA-N 429.443 4.957 50 10 IJGE COc1ccc(CCCC(=O)N[C@H](CCBr)COCc2ccccc2)cc1 2369977667 FRYATMKZUPMIOR-HXUWFJFHSA-N 434.374 4.505 50 10 IJGE CCOc1ccc(Br)cc1C(=O)NNC(=O)c1ccc(-c2ccccc2)cc1 14654863 QKVHMLRRJINDIS-UHFFFAOYSA-N 439.309 4.590 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)CCCOc2cc(C)ccc2C)c(OC)c1 33378243 MQXSMOWFBUBTBF-ZHZULCJRSA-N 437.492 4.547 50 10 IJGE Fc1cc(-c2nc(CCl)cs2)ccc1Cn1cc(I)cn1 96714914 UERFUNANSDCFOX-UHFFFAOYSA-N 433.677 4.537 50 10 IJGE CC1=C(C#N)C(=O)N(CC(C)C)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1ccccc1 101334626 XTJOASDYFKEYHC-OEAKJJBVSA-N 436.515 4.788 50 10 IJGE CC(=O)Oc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4Cl)nc3c2)cc1 169926698 XTPTVWSFNCWLGX-DHRITJCHSA-N 432.867 4.573 50 10 IJGE O=C(Nc1cc(C(F)(F)F)ccc1OCCOCCCl)c1cc(Cl)ccc1O 201352926 VPFIZTOXMVBJMC-UHFFFAOYSA-N 438.229 4.951 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)/C=C\c4ccc(C)cc4)ccc32)cc1 205641784 HVZZNDHFWRXIOK-XHASNHEZSA-N 438.483 4.841 50 10 IJGE CC(=NNC(=O)/C(=C\c1cccs1)NC(=O)c1ccccc1)c1ccc2c(c1)CCCC2 254478778 HDOQQTXZSSNRKG-UQKCPXHGSA-N 443.572 4.938 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1C(=O)c1cc(Br)sc1Br 384540820 LPZPUUJGPMXDCS-HTRCEHHLSA-N 446.002 4.661 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1Cc1ccsc1Br 388541780 XQYGYDGRZCVWDL-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE C[C@@H]1[C@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1cc(Br)c(Br)s1 686184350 CJXOSNOUTPMAOY-KHUVANEUSA-N 427.589 4.894 50 10 IJGE Cc1cc(CBr)cnc1N1C[C@H]2CC[C@H]1[C@@H]1CN(Cc3ccccc3)C[C@H]21 705875536 PEIQTZFFBKXURU-YSFYHYPLSA-N 426.402 4.632 50 10 IJGE Clc1cccc(C(CBr)(CBr)CCN2CCSCC2)c1 706375115 ZXSXUMIMFPAUJB-UHFFFAOYSA-N 441.660 4.807 50 10 IJGE C[C@H](OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)c1ccccc1[N+](=O)[O-] 764596256 HRHMWOWKXAVBDQ-WFVLPUPGSA-N 441.447 4.583 50 10 IJGE COc1ccc([C@@H](C)COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cc1 768822238 GFTYUVCPHRPMRH-UQRWVXEISA-N 440.503 4.726 50 10 IJGE C[C@H](NC(=O)NNc1ccc(C#N)cc1C(F)(F)F)c1nc2ccccc2n1C(F)F 799531028 PBLPYAOIKDTSIZ-JTQLQIEISA-N 438.360 4.709 50 10 IJGE COc1ccc(/C=C(\C)C(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)cc1F 804207647 VEJFKBPTFWETJH-JLHYYAGUSA-N 446.404 4.857 50 10 IJGE Cc1ccc(C23C[C@H]4C[C@@H](CC(NC(=O)NN=Cc5ccccc5[N+](=O)[O-])(C4)C2)C3)cc1 1081167900 LXEOBDLYKJAOCI-WWVRUBFXSA-N 432.524 4.827 50 10 IJGE C=CCNC(=O)c1ccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccccc3F)c2C)cc1 1351101469 BRZTXEGJQJBTCC-QNGOZBTKSA-N 442.494 4.695 50 10 IJGE C#C[C@@H](NC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2)c1ccc(Cl)cc1 1478897125 SRVAOYNKPZWTLU-SJLPKXTDSA-N 444.000 4.871 50 10 IJGE C/C(=C\C(=O)NNC(=O)Nc1ccc(Br)cc1)c1ccc(C(F)(F)F)cc1 1625974277 OTWYHLVHPQWCHX-ZHACJKMWSA-N 442.235 4.724 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cn(-c2ccc(Cl)c(Cl)c2)cn1 1640946928 KRFPCBHRKWSBHJ-UHFFFAOYSA-N 431.308 4.542 50 10 IJGE CC[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](CC)CN1CC(C)(C)CI 1904651434 PMWOVRGYABTUQR-HUUCEWRRSA-N 438.394 4.558 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1Cc1c(Br)cccc1Br 1945321266 GABOGEPGENWRBE-NXEZZACHSA-N 425.990 4.959 50 10 IJGE Brc1ccc(C[C@@H]2CCOCC[C@@H]2Br)c(Br)c1 2001023411 PEKVTYVOYRGQGN-JQWIXIFHSA-N 426.974 4.944 50 10 IJGE ClCc1nc2ncccc2n1CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 2007120634 WEKYQPIYXPTAFS-UHFFFAOYSA-N 432.955 4.642 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc([S@@](C)(=O)=NC[C@@H](Br)C(F)(F)F)cc1 2044703118 QYOCEGNFFPPMOW-XELLLNAOSA-N 445.301 4.816 50 10 IJGE C[C@]1(NC(=O)c2c(Br)cccc2Br)CCC[C@@H]1Br 2062577266 CHHVBSNZKVRGBF-GWCFXTLKSA-N 439.973 4.648 50 10 IJGE Cc1c([C@H](Br)Cc2cccc(Br)c2)c(Br)nn1C 2067855526 SVKPSMIVPBDNAX-LLVKDONJSA-N 436.973 4.932 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]2(C)CN(CC3(CBr)CCCCC3)C[C@]2(C)C1 2106788394 PGZMIOOXWQHKQE-WOJBJXKFSA-N 429.443 4.911 50 10 IJGE CCN(CCCOCc1ccccc1)S(=O)(=O)c1cc(F)c(Cl)c(CCl)c1 2153179506 FQJHSBBFKKLWSZ-UHFFFAOYSA-N 434.360 4.835 50 10 IJGE CC(C)(C)[C@H](CBr)CN1CCCC[C@H]1[C@H]1CCCN(C(=O)C(F)(F)F)C1 2163064851 WNQYLVAQFUCITB-XHSDSOJGSA-N 441.376 4.699 50 10 IJGE C[C@H](c1nscc1Br)n1c(CCl)nc2cc(Br)cnc21 2186646391 KSSCLBZEVUDMLC-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE Cc1cc(Br)c([C@H](Cl)[C@@H]2CCS(=O)(=O)C2)c(C)c1Br 2227350177 VTRWQLFONXCIMS-NOZJJQNGSA-N 430.589 4.543 50 10 IJGE CCn1nc(C)c(CBr)c1N1CCC[C@H]1[C@@H]1CCN(Cc2ccccc2)C1 2281304814 BFXXYNGWRTULNL-CTNGQTDRSA-N 431.422 4.597 50 10 IJGE CC(C)(C)C[C@@H](Cl)CNC(=O)Cc1cc(Br)cc(Br)c1 2295316271 WLGXNTPNBJYSBC-CYBMUJFWSA-N 425.592 4.914 50 10 IJGE CC1(C)[C@@H](Br)CCN1Cc1ccc(Cl)cc1I 2302315985 QAMDDDCKIUMRBY-LBPRGKRZSA-N 428.539 4.692 50 10 IJGE CC1(C)OC[C@@H](Cc2ccc(Cl)cc2I)[C@H]1Br 2302335863 JACRVIQDARPHGH-BXKDBHETSA-N 429.523 4.676 50 10 IJGE C[C@H]1CC[C@@H](Cl)CN1Cc1ccc(I)c(Br)c1 2306219627 OJKUGCQFTDYUJF-GXSJLCMTSA-N 428.539 4.645 50 10 IJGE C=CCc1cc(C=C(C#N)C(=O)N(C)C)cc(Br)c1OCc1ccccc1 2313567228 DQTJKQTWCPJWDN-UHFFFAOYSA-N 425.326 4.752 50 10 IJGE Clc1ccc(CN2C[C@@H]3CC[C@]3(CBr)C2)cc1I 2315548816 LGJZMEXVDVGNOJ-FZMZJTMJSA-N 440.550 4.552 50 10 IJGE CC(C)N(CCCBr)C(=O)c1ccc(Cl)cc1I 2317769176 RIHDUTVRAORAHG-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Br)c2)CC[C@@H]1CCl 2325223200 WMLVMGAQWWHDNG-ZYHUDNBSSA-N 442.566 4.751 50 10 IJGE CN(C[C@H](Br)CCc1cc(I)ccc1Cl)C1CC1 2327407527 RSNGIOMZUCWASU-LLVKDONJSA-N 442.566 4.735 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@]12CCC[C@H](CN(C[C@H](CBr)C3CCC3)C1)C2 2333680216 YDKZNQCGEMIZBI-MDKPJZGXSA-N 429.443 4.909 50 10 IJGE CC[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C)c(C)c1 10153405 BVNMDCCBNMCPOC-NLFFAJNJSA-N 446.547 4.743 50 10 IJGE Cc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc(OCc3ccccc3)cc2)c(C)c1 12574434 DXDDVABGLYFWLU-WPWMEQJKSA-N 429.520 4.751 50 10 IJGE CCc1ccc(OCC(=O)N/N=C/c2cccc(Cl)c2Cl)c(Br)c1 13977541 CKSSREKQLHOBNA-ZVBGSRNCSA-N 430.129 4.847 50 10 IJGE CCn1nc(C)c(/C=C2/CCCC3=C2OC(N)=C(C#N)[C@@H]3c2c(C)nn(CC)c2C)c1C 33249023 MTEOLTPQUYIJGB-KELOHDTKSA-N 432.572 4.682 50 10 IJGE CN(C)c1ccc(N2C(=O)CS[C@H]2c2cccc(NC(=O)C(C)(C)CCl)c2)cc1 35928497 PTAMUMAAUMXEFH-FQEVSTJZSA-N 431.989 4.735 50 10 IJGE COc1ccc(CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2Cl)cc1 38651101 RPBNDYRUFMQVRG-XMMPIXPASA-N 446.890 4.715 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccccc4C)ccc32)cc1 38676963 ZTHRZEZSZKHBGP-SANMLTNESA-N 440.499 4.760 50 10 IJGE Cc1c(C(=O)NNC(=O)CCCCc2ccc(Br)cc2)oc2ccccc12 107921754 FDXSYWHJNPQONW-UHFFFAOYSA-N 429.314 4.678 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@H]1Br)c1cc(Br)ccc1Cl 123834287 DIOSTHVMASKCJU-HIFRSBDPSA-N 429.539 4.893 50 10 IJGE O=C(c1ccc(Br)c(C(F)(F)F)c1)N1CCC(CBr)CC1 124690451 NOCBVHNSIPAKIO-UHFFFAOYSA-N 429.074 4.715 50 10 IJGE CC(C)c1ccc(OCC(=O)Oc2ccc(/C=C(/C#N)C(=O)NCc3ccco3)cc2)cc1 206732879 ORPIOSNMIRVPOH-STZFKDTASA-N 444.487 4.611 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)COc2ccccc2C(C)(C)C)cc1 207139609 XXVNTBMIDHAQEE-SILNSSARSA-N 434.536 4.792 50 10 IJGE O=C(N[C@H]1CCC[C@H]1CBr)c1cc(Br)cc(Br)c1 231548457 JDDLGYWLIDIMCA-UFBFGSQYSA-N 439.973 4.505 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)[C@H](C)Oc2ccc(C)cc2Br)cc1 256017462 NHVXRPOURPKSMG-INIZCTEOSA-N 432.362 4.521 50 10 IJGE C[C@H](CCCBr)CNC(=O)c1cc(Br)cc(Br)c1 384400738 ULLKSCZIOFOTCG-SECBINFHSA-N 441.989 4.753 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccc([C@H]2CN(S(=O)(=O)c3ccccc3)CCN2)cc1 616655721 ZGZNFPJKAQLOCG-JOCHJYFZSA-N 446.689 4.544 50 10 IJGE C[C@@H]1CN(Cc2cc(Cl)ccc2I)C[C@@H](C)C1Br 688069813 DBWNWAVUPLLCCI-NXEZZACHSA-N 442.566 4.796 50 10 IJGE CCN(C[C@@H](C)Br)C(=O)c1cc(Br)sc1Br 691308785 ZYLRJEMUAPBRLI-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE O=C(NCC1(CBr)CCC1)c1ccc(Br)cc1Br 717681614 VXOGZCRUMAQJOY-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE CCOc1ccc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)cc1OC 725446993 MTAMEOVTIYGAPT-MOPGFXCFSA-N 448.357 4.841 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)c(C)n1CC(C)C 741605407 KFFHGBLKBSSPFS-XWTNIDGLSA-N 438.641 4.929 50 10 IJGE Cc1onc(-c2ccc(F)cc2)c1C(=O)NNc1c(F)cc(F)cc1Br 741980822 SUAZRZLXRULJEF-UHFFFAOYSA-N 426.192 4.587 50 10 IJGE N#C[C@H](c1ccccc1)c1ccc(NC(=O)NNC(=O)CCOc2ccccc2)cc1Cl 755946152 XREAUOTWEQQRPV-OAQYLSRUSA-N 448.910 4.617 50 10 IJGE Cc1ccc(CNC(=O)NNC(=O)c2cccc3cccnc23)c(O[C@H](C)CC(C)C)c1 758865138 UNMLGQUQNGBUJW-GOSISDBHSA-N 434.540 4.501 50 10 IJGE C=CC[C@@H](C(=O)NNc1nc2ccccc2c(=O)n1-c1ccc(C)cc1C)c1ccccc1 1146770108 DJJQGJOHNVDZJJ-OAQYLSRUSA-N 438.531 4.806 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@H]1CCCN(C(=O)CCCc2nc(O)c3ccccc3n2)C1 1275315680 TYENXQIMDKJIKK-KRWDZBQOSA-N 429.637 4.671 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N2CCCc3ccnc(O)c32)c(C)n1-c1ccc(Cl)cc1 1617657224 QSDDXIICLRGRHE-UYRXBGFRSA-N 432.911 4.735 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)c1C 1648569856 DFFQIBDCZGAFMK-UHFFFAOYSA-N 446.942 4.973 50 10 IJGE COc1ccc(NNC(=O)c2cccc3nc(O)n(CC(C)(C)C)c23)c(C(F)(F)F)c1 1654610510 VHISMFBHQMKKFG-UHFFFAOYSA-N 436.434 4.572 50 10 IJGE O=C(CSc1nc2ccccc2s1)NN=C(C(=O)c1ccccc1)c1ccccc1 1772760543 CCDMJMGDVBRKDR-UHFFFAOYSA-N 431.542 4.792 50 10 IJGE CCCOc1ccc(-c2csc(NC(=O)CBr)c2C(=O)OCC)cc1 1866000365 IKHIPHYHTMFPEE-UHFFFAOYSA-N 426.332 4.714 50 10 IJGE N#C/C(=C(/O)CCN1C(=O)c2ccccc2C1=O)c1nc(-c2c[nH]c3ccccc23)cs1 1872753207 LWTZNWZRHNXJPR-FXBPSFAMSA-N 440.484 4.770 50 10 IJGE CC(C)[C@@H](CCNC(=O)OC(C)(C)C)CCC(=O)N(C)C[C@H]1C[C@H](Br)C1 1887822419 AZRJJIMFZSVWPH-BRWVUGGUSA-N 433.431 4.586 50 10 IJGE O=C(NCC1CCN(Cc2ccc(CBr)cc2)CC1)OCc1ccccc1 2011640786 KWUGPDHSKPSVRZ-UHFFFAOYSA-N 431.374 4.720 50 10 IJGE CC(C)(C)CN(Cc1ccccc1)S(=O)(=O)c1ccc(CBr)cc1F 2059264545 HECVUCPYTNFCFE-UHFFFAOYSA-N 428.367 4.958 50 10 IJGE CCn1cc(Br)c([C@@H](Br)Cc2ccncc2Br)n1 2060850409 CHFIKIWSVGOBQB-VIFPVBQESA-N 437.961 4.502 50 10 IJGE COc1cc(Cn2nc(CCl)c(I)c2C(F)(F)F)ccc1C 2079212320 PTTXGUYNSMRNKK-UHFFFAOYSA-N 444.622 4.611 50 10 IJGE COc1ccc([C@H](Cl)c2nn(C)c(Cl)c2Br)c(Br)c1 2110722913 LSQWIPIEORTWQP-JTQLQIEISA-N 428.939 4.935 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC2(CC[C@@H]1CBr)CC2 2115926519 UKYIOZIYIIAIJY-MRVPVSSYSA-N 427.589 4.944 50 10 IJGE C[C@@H]1CCCN(CC2(CBr)CCOCC2)[C@@H]1CCCNC(=O)OC(C)(C)C 2163063285 PJXLQMYMLRGGGS-QZTJIDSGSA-N 447.458 4.584 50 10 IJGE CCC[C@]1(CNC(=O)[C@H](Br)C2CCCC2)CCCN(C(=O)OC(C)(C)C)C1 2167048144 OTDPGGYTNJKRNW-DYESRHJHSA-N 445.442 4.874 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2Cc1cc(Cl)ns1 2167208494 VKDDJLZXAMDSCL-UHFFFAOYSA-N 442.084 4.677 50 10 IJGE C[C@H](c1nscc1Br)n1c(CCl)nc2cncc(Br)c21 2186653131 VZALKRKHAMZSFL-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE O=C(N[C@H](CBr)CC1CCOCC1)c1ccc(OCc2ccccc2)cc1 2195481021 DDQYJUDJTCDCBQ-FQEVSTJZSA-N 432.358 4.576 50 10 IJGE Cc1cc(C(=O)Nc2cccc(CCBr)c2)ccc1I 2207108780 QFPHCQBYDQXRHD-UHFFFAOYSA-N 444.110 4.789 50 10 IJGE CCN(c1ncc(Br)cc1Br)[C@@H]1CCC[C@@H]1Br 2212910295 FWYZDHCDFLCCCO-GXSJLCMTSA-N 426.978 4.749 50 10 IJGE Cc1ccc(C(=O)N2C[C@H](Br)CCC23CCC3)cc1I 2232833855 POUYAOSEBFCDDH-CYBMUJFWSA-N 448.142 4.522 50 10 IJGE FC(F)COCCn1c(CCl)nc2cc(Br)c(Br)cc21 2234068220 PXPNEUFORBLKON-UHFFFAOYSA-N 432.490 4.582 50 10 IJGE O=C(Nc1ccccc1CCBr)c1cccc(F)c1I 2239234964 KWIZPWMIOJPTHC-UHFFFAOYSA-N 448.073 4.620 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCc2ccccc2N(CCCCI)C1 2248250691 RCIBZEUEXMUAGE-INIZCTEOSA-N 444.357 4.548 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCC12CC(CBr)C2 2282978393 MNUINUSCTNITRP-UHFFFAOYSA-N 425.523 4.631 50 10 IJGE CN(C(=O)c1ccc(Cl)c(I)c1)C1(CCl)CC(C)(C)C1 2283662526 CKTSMVMPDNWNEG-UHFFFAOYSA-N 426.125 4.814 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccco2)C(=O)C1=Cc1ccc(OCc2ccccc2F)cc1 2314619061 ZEQIPDWAWKFHQM-UHFFFAOYSA-N 442.446 4.790 50 10 IJGE COc1cc(F)c(CN(C)C[C@H](Br)COCc2ccccc2)c(Cl)c1 2317102854 DHAJKRXDEFFAAO-HNNXBMFYSA-N 430.745 4.900 50 10 IJGE CCCCCCOc1c(OC)cc(C=NNC(=O)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] 2318415620 RXUAOSLDIDFGPT-UHFFFAOYSA-N 447.919 4.909 50 10 IJGE COc1ccc(Cc2nc3ccc(C(=O)NN=Cc4cccc(OC(C)C)c4)cc3[nH]2)cc1 2323720841 KXSAZLQFZBNXHQ-UHFFFAOYSA-N 442.519 4.713 50 10 IJGE O=C(Cc1ccc(C(F)(F)F)cc1)N[C@H](CCBr)COCc1ccccc1 2369432642 FSQVZYRWFHNABA-GOSISDBHSA-N 444.291 4.735 50 10 IJGE Cc1cc2c(c(=O)n1Cc1ccccc1)[C@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 2352803 JNPDJAGJDBKBIV-IBGZPJMESA-N 438.314 4.730 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C\c2c(Oc3ccccc3)nc3c(C)cccn3c2=O)cc1 33931680 ZVTRMZAGUQEXPY-CYVLTUHYSA-N 436.471 4.649 50 10 IJGE Cc1cccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)c1C 38652969 YBHBIFYEIUJFFT-RUZDIDTESA-N 444.462 4.645 50 10 IJGE O=C(Cc1cccc2ccccc12)N/N=C1\C(=O)N(Cc2ccccc2F)c2ccccc21 59148492 VNAIWWXXGGMDNH-BXVZCJGGSA-N 437.474 4.589 50 10 IJGE CCc1ccc(-c2csc(/C(C#N)=C/Nc3cc(C(=O)OC)cc(C(=O)OC)c3)n2)cc1 102453108 VEIGPXCHHDRFOZ-CPNJWEJPSA-N 447.516 4.922 50 10 IJGE N#C/C(=C/NC1CCCCCCCCCCC1)C(=O)Nc1ccc(S(=O)(=O)O)cc1 216944674 XPEJLUUEDIBUMH-ZCXUNETKSA-N 433.574 4.542 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C\Nc1ccccc1Br)C12CC3CC(CC(C3)C1)C2 217053704 RDVXKXXMKZACSS-IAYYKLOSSA-N 428.374 4.990 50 10 IJGE O=C1COc2ccc([C@@H](Br)c3cccc(Br)c3Cl)cc2N1 228452681 GCXCJXYZQGIFHG-CQSZACIVSA-N 431.511 4.918 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Cl)c1cnn(C)c1Br 381861881 DOSBCORYHFGSFS-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN(Cc2cc(Cl)ccc2I)C1 405311063 TWZOESHBFIOMKV-MNOVXSKESA-N 442.566 4.798 50 10 IJGE COc1ccc(C(=O)NNC(=O)c2sc3cc(C(C)C)ccc3c2Cl)c(OC)c1 732644664 NNUOVFQJAKKKJA-UHFFFAOYSA-N 432.929 4.770 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N(C)Cc2cnccn2)c(C)n1-c1cc(Cl)ccc1Cl 735483259 QELKFTRQGXUBEJ-RQZCQDPDSA-N 440.334 4.757 50 10 IJGE CC[C@H](C(=O)NNc1nc(-c2cccnc2)nc(C)c1C)c1cccc(C(F)(F)F)c1 752805251 DGEJKBODMYNNBU-SFHVURJKSA-N 429.446 4.811 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)OCc2cccc(Br)c2)c(C)n1C[C@H]1CCCO1 786381757 UPAHBBGERSTFET-XQJRBFNUSA-N 443.341 4.697 50 10 IJGE CCOc1ccc(Br)cc1/C=C(\C#N)C(=O)NCCc1c[nH]c2ccccc12 1084513433 PYZHGPPXQKTYIW-GZTJUZNOSA-N 438.325 4.595 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C)[C@H]1CCCO1 1435967824 WSWAIRCFZDPXID-SFUZSFPNSA-N 442.346 4.605 50 10 IJGE Cc1cccc([C@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)c1[N+](=O)[O-] 1614629145 GMTXNCUQXMYLNV-AEFFLSMTSA-N 433.302 4.650 50 10 IJGE CC(C)CC(=O)NN=C1C(=O)N(Cc2ccc(Cl)cc2)c2ccc(Br)cc21 1772752456 PHWSJXPEOLNOGX-UHFFFAOYSA-N 448.748 4.516 50 10 IJGE CCCn1nc(CC)c2c1OC(N)=C(C#N)[C@H]2c1ccc(OCc2ccc(C)cc2)cc1 1865693842 QYLXXDHWDHNPKY-HSZRJFAPSA-N 428.536 4.961 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2)[C@H]1c1c[nH]c2ccccc12 1865700084 KTGNRJPFMWBOSW-GOSISDBHSA-N 435.409 4.650 50 10 IJGE CC[C@@](C)(NC(=O)C[C@@H](C)c1cccc(OC)c1)C(=O)Nc1ccc(SC#N)cc1 1867109978 GBHMBBYQPGVEJN-WAIKUNEKSA-N 425.554 4.686 50 10 IJGE Brc1cnccc1C[C@H](Br)c1cnsc1Br 1900435485 QBACNSJWALLHTR-QMMMGPOBSA-N 426.959 4.742 50 10 IJGE COc1ncc(Br)c(C)c1CN(CCCBr)Cc1ccccc1 1902484040 KRKZNDBYAAZPOT-UHFFFAOYSA-N 442.195 4.948 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)S(=O)(=O)c1cc(F)ccc1Cl 1915094891 OSTWIJXOYOFZRS-ZDUSSCGKSA-N 434.758 4.844 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1cc(O)cc(Br)c1 1915109830 IVUREFCVUZQWDB-OAHLLOKOSA-N 441.163 4.971 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@@H]2CC[C@H]3CC[C@@H]2C3)CC1 1947120050 HEGKHKYJVNIWRZ-BZUAXINKSA-N 449.373 4.786 50 10 IJGE C[C@@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)C1CC(CBr)C1 2009708599 HZQHVJRCLCJIJM-OOHWJJMZSA-N 428.417 4.815 50 10 IJGE O=C(N[C@@H]1CCC[C@@H](Br)C1)c1cccc(Br)c1Br 2031478818 TZEWZOUQKSEKQR-RKDXNWHRSA-N 439.973 4.648 50 10 IJGE F[C@@]1(CBr)CCCN(Cc2cc(Br)ccc2Br)C1 2054716745 FEWYPFRKZVDBHF-CYBMUJFWSA-N 443.980 4.911 50 10 IJGE O=S1(=O)CCC[C@H]([C@H](Br)c2cc(Cl)c(Br)cc2F)C1 2089859819 FJZAWZQZFSIFEE-MADCSZMMSA-N 434.552 4.502 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1ccc(Br)c(Cl)c1 2090387127 HCFUTARJEBJKDC-SNVBAGLBSA-N 429.605 4.739 50 10 IJGE Brc1ccc([C@@H](CI)OCCOCCC2CC2)cc1 2127762157 BOVFJWHXCGTITG-OAHLLOKOSA-N 439.131 4.759 50 10 IJGE O=C(C1CC1)[C@@H](Br)Cc1ccc(C(F)(F)F)cc1I 2139266734 MURBEOCQCOPRQE-JTQLQIEISA-N 447.032 4.595 50 10 IJGE O=[N+]([O-])c1ccc(N2CCN(Cc3ccccc3)C3(CCC3)C2)c(CBr)c1 2153349309 NLGABSVUNGORJR-UHFFFAOYSA-N 430.346 4.735 50 10 IJGE O=C(c1cccc(OCc2ccccc2)c1)N1C[C@H](CBr)[C@@H](C(F)(F)F)C1 2163357768 FEOWUSJHNKFFLQ-WMZOPIPTSA-N 442.275 4.911 50 10 IJGE CCc1sc(Br)cc1[C@H](Br)[C@]12CCC[C@H]1CS(=O)(=O)C2 2201881640 PRBNJAMGZWVLMP-HERUPUMHSA-N 442.238 4.724 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCCCC12CN(C(=O)OC(C)(C)C)C2 2209328653 UFCODQNACMGEIA-LSDHHAIUSA-N 447.414 4.702 50 10 IJGE COC[C@H](Cl)Cc1sc(Br)c(Br)c1Br 2209974779 AKDGWPZHDLBFSR-SCSAIBSYSA-N 427.383 4.832 50 10 IJGE CC(C)(C)c1nc(-c2ccc(I)cc2)ncc1CBr 2228787631 KNGLHLKRKPMJFM-UHFFFAOYSA-N 431.115 4.941 50 10 IJGE CCCN(C[C@H](C)Cl)C(=O)c1ccc(I)c(Br)c1 2259743781 JPNRFMNIEGHKTR-VIFPVBQESA-N 444.538 4.533 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@@H](CBr)C(F)(F)C1 2264506734 LEDHGBJIWJSBEQ-LURJTMIESA-N 437.531 4.656 50 10 IJGE Cc1ccccc1OCCn1cc(C=C(C#N)C(=O)NCc2ccco2)c2ccccc21 2293531504 SKWVAFPWWFCJOG-UHFFFAOYSA-N 425.488 4.845 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc(C)cc2)ccc1OC(=O)C=Cc1ccccc1 2313530108 GIWROVZCMJJBIL-UHFFFAOYSA-N 428.488 4.776 50 10 IJGE Cc1ccc(C)c(-n2c(C)cc(C=C(C#N)C(=O)N3CCN(c4ccccc4)CC3)c2C)c1 2313566902 DALCDBPHMJAUKY-UHFFFAOYSA-N 438.575 4.967 50 10 IJGE Clc1ccc(CN2C[C@H]3CC[C@]3(CBr)C2)cc1I 2315548817 LGJZMEXVDVGNOJ-RISCZKNCSA-N 440.550 4.552 50 10 IJGE COc1ccc(C=NNC(=O)c2nc(-c3ccccc3)sc2C)cc1Br 2323746225 YUXFCSSULGFODW-UHFFFAOYSA-N 430.327 4.654 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC(=O)C(C#N)=CN(Cc1ccccc1)c1ccccc1 2325220406 OVVPLDYNHNDVRF-UHFFFAOYSA-N 428.448 4.656 50 10 IJGE Clc1ccc(I)cc1CN1[C@H]2CC[C@@H]1C[C@H](Br)C2 2327389281 LUKDUNGSCKMPJO-LMKPVCQUSA-N 440.550 4.835 50 10 IJGE Clc1ccc(I)cc1C[C@]1(CBr)C[C@]12CCOC2 2327399507 SFCWJDLSLCXHNE-UONOGXRCSA-N 441.534 4.679 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)CNC(=O)c3ccc(Cl)cc3)n2)cc1F 2331337157 DADDGJWOQSWGEQ-UHFFFAOYSA-N 443.887 4.834 50 10 IJGE CC[C@H](Cl)[C@@H]1CCCCN1C(=O)c1ccc(Cl)cc1I 2365582024 LYYDJDGABNQDTR-JSGCOSHPSA-N 426.125 4.957 50 10 IJGE CCOc1cccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(NC(C)=O)cc3)c2C)c1 1195680 JDNLURUOUOUVEJ-KGENOOAVSA-N 442.519 4.997 50 10 IJGE N#C/C(=C\c1ccc(OCc2cccc(C(=O)O)c2)c(Cl)c1)C(=O)Nc1ccc(O)cc1 9295567 CLORGKNJMUHRAZ-VCHYOVAHSA-N 448.862 4.868 50 10 IJGE COc1ccc(OCc2ccc(/C=N/NC(=O)CNc3cccc4ccccc34)o2)cc1 9695057 AGUCZTDPTVEWFL-JFLMPSFJSA-N 429.476 4.583 50 10 IJGE CC(C)CCOc1cccc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)c1 14644585 NNFGAQUHFOTESW-UHFFFAOYSA-N 432.520 4.619 50 10 IJGE CCOc1cc(Br)c(/C=C(\C#N)C(=O)Nc2ccc(CC)cc2)cc1OC 59201086 UFHJUGDXSNCVNO-MHWRWJLKSA-N 429.314 4.964 50 10 IJGE Br[C@@H](c1cccc(I)c1)c1cnn(-c2ccccc2)c1 109864628 QMACOWDKJORORF-INIZCTEOSA-N 439.094 4.961 50 10 IJGE CCOc1cc(OCC)c([N+](=O)[O-])cc1/C=N/NC(=O)C12CC3C[C@](C)(C1)C[C@@](C)(C3)C2 169889678 VMBUNGBAPGRSHG-JMOQVJHCSA-N 443.544 4.839 50 10 IJGE COc1ccc(OC)c(-c2cc(C(=O)NN=C/C=C\c3ccco3)c3ccccc3n2)c1 252637600 XUFBRLUALGMQGN-NADFZCFGSA-N 427.460 4.941 50 10 IJGE ClCc1csc2c(I)ccc(I)c12 306623507 WYFNFMQVNLGCPQ-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE Cc1nn(-c2ccccc2)c(N2CC[C@@H](OCc3ccccc3)C2)c1CBr 383865847 VMENIHNGFWRPEY-HXUWFJFHSA-N 426.358 4.871 50 10 IJGE COc1ncnc2c1nc(CCl)n2CCCN(Cc1ccccc1)Cc1ccccc1 390479367 KPBBLBDCUHIYMA-UHFFFAOYSA-N 435.959 4.666 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCC[C@H]1CCOC1 400518305 CTWGEDCOWYYRDX-SECBINFHSA-N 442.973 4.912 50 10 IJGE FC(F)Oc1c(I)ccc(CBr)c1C(F)(F)F 575722794 GCRNVPNXQFCLBJ-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE COC(=O)[C@]1(CCF)C[C@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 688653195 FEABJMIWUVCDET-AVRDEDQJSA-N 439.600 4.691 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@H]1Cn1c(CCCl)nc2cc(Br)cnc21 708568339 MUANAWMBGZQZLW-WBVHZDCISA-N 447.808 4.743 50 10 IJGE O=C(N[C@@H](CBr)C1CCC1)c1ccc(Br)cc1Br 717613820 QAVXRQSCEDJUAT-LBPRGKRZSA-N 439.973 4.505 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1ccc(C(F)(F)F)cc1 749807612 OSGVPTGSDWATGG-IBGZPJMESA-N 442.441 4.905 50 10 IJGE C=CCOc1c(Br)cc(/C=C(\C#N)C(=O)N(C)Cc2ccccc2)cc1OC 787151220 ZWTBORJPYGUFKA-WOJGMQOQSA-N 441.325 4.588 50 10 IJGE N#Cc1ccc(NNC(=O)Cc2c[nH]c3cccc(Br)c23)c(C(F)(F)F)c1 799751881 UVTAADSBCPDBCK-UHFFFAOYSA-N 437.219 4.507 50 10 IJGE Cc1ccc(Cl)cc1NC(=O)C(=O)NN=Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1084011865 UDQANONQTTVKMK-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE C=CCNC(=S)NNC(=O)[C@@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 1290174087 WYWYNUWIRRYXPH-INIZCTEOSA-N 426.394 4.508 50 10 IJGE C=CCOc1cc(OC)ccc1C(=O)NNC(=O)Nc1c(Cl)cc(Cl)cc1Cl 1625995574 RGMUUVBDNQSSTJ-UHFFFAOYSA-N 444.702 4.687 50 10 IJGE CCc1nn(-c2ccc(Br)cc2)c2c1[C@@H](c1ccccc1F)C(C#N)=C(N)O2 1865684109 TVWQYVJUZLNUHC-SFHVURJKSA-N 439.288 4.554 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@H]2c1cccc(Br)c1 1865684276 PFKIYWNNGSHDFS-GOSISDBHSA-N 435.325 4.941 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCN(C(=O)OC(C)(C)C)C(C)(C)C1 1880760153 DTGXGAQTYKXQOB-UONOGXRCSA-N 435.403 4.700 50 10 IJGE C[C@@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)c(Br)s1 1914350439 JRHSQUVZZKYOQS-JTQLQIEISA-N 443.215 4.982 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(OC)c(OC)c1OC 1915097982 AYRHIEYBDXSJCT-INIZCTEOSA-N 436.346 4.528 50 10 IJGE O=C(c1c(F)ccc([N+](=O)[O-])c1F)N(Cc1ccccc1)C1(CBr)CCC1 1915750074 RUUVXFMAORGHNA-UHFFFAOYSA-N 439.256 4.833 50 10 IJGE C[C@@H](c1ccncc1Br)[C@@H](Br)c1cc(Br)n(C)n1 1924063908 XJZUGBVQCMPBBF-JVXZTZIISA-N 437.961 4.580 50 10 IJGE C[C@H]1CCN(C(=O)c2csc(Br)c2Br)[C@@H]1CBr 1945189693 XSIWVBALLQIKIK-POYBYMJQSA-N 446.002 4.519 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1C1CCN(C[C@@H](CBr)C2CCC2)CC1 1966156375 KPHLIDURVNWASY-MOPGFXCFSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCN(C[C@@H](CBr)c2ccccc2)C1(C)C 2106887512 CJEKOUXNNSZUSI-MSOLQXFVSA-N 425.411 4.790 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc(NC(=O)[C@@H](Br)C2CCCC2)cc1F 2110729728 CQDSQWNEQHBCQY-INIZCTEOSA-N 429.330 4.743 50 10 IJGE COc1ccc([C@@H](Br)c2cn(C)c(Br)n2)c(Cl)c1Cl 2138628661 VOSULSMSGOEUDL-SECBINFHSA-N 428.939 4.982 50 10 IJGE CCC[C@@H](CCBr)CNS(=O)(=O)c1c(C)sc(C)c1Br 2143911788 ANVRXBCKFUENRP-NSHDSACASA-N 447.258 4.607 50 10 IJGE CC[C@@H]1CCCCCN1S(=O)(=O)c1cc(CBr)sc1Br 2179792039 ZYZWDSKHOBKDRV-SNVBAGLBSA-N 445.242 4.749 50 10 IJGE O=C(c1ccc(Cl)cc1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Br)C2 2190677311 HVAWVKJZZHMMLJ-ZBPZKIAKSA-N 425.523 4.581 50 10 IJGE BrC[C@]12CCCC[C@@H]1CN(Cc1ccc(I)cc1)C2 2230624061 QQEAUMLPPLYMGF-ZBFHGGJFSA-N 434.159 4.678 50 10 IJGE Cc1c(Br)csc1C(=O)N1CC[C@](CBr)(C(F)(F)F)C1 2234511354 ARUOAOXVKHLAKB-LLVKDONJSA-N 435.103 4.609 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@H]1C[C@@H]2[C@H](CBr)NC(=O)OC(C)(C)C 2241631267 VSBSKOSZELPMCK-CWVYHPPDSA-N 447.414 4.604 50 10 IJGE COc1ccc([C@H](Br)CC[C@@H]2CCOC2)cc1I 2257367816 ODVPGGDUDBWSAM-ZYHUDNBSSA-N 425.104 4.553 50 10 IJGE CN(C(=O)c1scc(Br)c1Cl)[C@H](CCBr)C(F)(F)F 2264515633 SEKLHBQACVJEOB-ZCFIWIBFSA-N 443.510 4.952 50 10 IJGE C[C@H]1C[C@@H](CBr)CCN1C(=O)c1cc(F)c(Br)cc1Cl 2282982928 ICYOSBGABPQAMN-IUCAKERBSA-N 427.539 4.877 50 10 IJGE C[C@H]1CCc2c(sc(NC(=O)C(C#N)=Cc3ccc(-c4ccc(F)cc4)o3)c2C(N)=O)C1 2296509313 JUCIVKITMPHUNX-ZDUSSCGKSA-N 449.507 4.917 50 10 IJGE Cc1cc(C)n(-c2ccc(-n3cccc3C=C(C#N)S(=O)(=O)c3ccccc3)cc2)n1 2297564913 UTDDRNJCOQRWPU-UHFFFAOYSA-N 428.517 4.618 50 10 IJGE Clc1ccc(CN[C@@H](CBr)C2CCC2)cc1I 2300240825 QVJRTDXCJVNDEY-ZDUSSCGKSA-N 428.539 4.598 50 10 IJGE ClCc1csc(COc2cc(Br)cc(I)c2)n1 2301129934 PTSQGHOFTYCMNG-UHFFFAOYSA-N 444.519 4.828 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(C(=O)NNC(=O)C=Cc3cccc4ccccc34)cc2)c1 2313541075 PRKOUTBOXSKHCP-UHFFFAOYSA-N 449.510 4.875 50 10 IJGE N#CC(=Cc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)C(=O)NC[C@@H]1CCCO1 2313738405 ATZUATLKZLYPMV-IBGZPJMESA-N 431.319 4.775 50 10 IJGE Clc1ccc(CN2C[C@@]3(CBr)CC[C@H]2C3)c(I)c1 2318537230 DUFWTQUBOKOUSH-JSGCOSHPSA-N 440.550 4.694 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccc(C(F)(F)F)s1 2320362727 WZHURAOSFRJUMD-ZDUSSCGKSA-N 436.293 4.867 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccccc2)CCN1c1ccnc(Cl)c1CBr 2328556931 UJVIXCOYUBLOCM-INIZCTEOSA-N 448.714 4.883 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@]12CCC[C@H](CN(C[C@@H](CBr)CC3CC3)C1)C2 2333679558 LCHGOPKACOOMCW-UEXGIBASSA-N 429.443 4.909 50 10 IJGE CC(C)[C@H](C)[C@H](C)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2365436393 JZSKAWOUVQFOGO-UWVGGRQHSA-N 447.258 4.707 50 10 IJGE Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)c3cccc4ccccc34)cc2)n1 16491812 OAECBXABSZFWKJ-UHFFFAOYSA-N 442.544 4.614 50 10 IJGE Cc1cc(/C=N/NC(=O)c2cccs2)c(C)n1-c1ccc(I)cc1 33540808 RIRVPQRAKHAEOH-RGVLZGJSSA-N 449.317 4.524 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OCc1ccccc1 228780880 IVJIXOYYIQIRPV-YTORKTKBSA-N 449.507 4.784 50 10 IJGE O=C(NC[C@@H]1CCCC[C@@H]1CCl)c1ccc(I)c(Cl)c1 232348873 PMYCYKORHVUEBR-NEPJUHHUSA-N 426.125 4.720 50 10 IJGE CCCOCCOc1c(Br)cc(CBr)cc1Br 233232580 WGGHIOUUSQTIMJ-UHFFFAOYSA-N 430.962 4.912 50 10 IJGE Cc1sc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(F)cc3)c2C)c(C(N)=O)c1C 728168182 BRHCLZAEBKHIDY-LICLKQGHSA-N 436.512 4.556 50 10 IJGE Cn1c(=O)ccc2ccc(NS(=O)(=O)c3cccc(S(F)(F)(F)(F)F)c3)cc21 782469995 MLEQQJCNKGQXJO-UHFFFAOYSA-N 440.415 4.997 50 10 IJGE COC(=O)c1ccc(-n2c(C)cc(C=NNC(=O)c3cc4ccccc4o3)c2C)c(C)c1 1084298181 MMEBWECDQNUULU-UHFFFAOYSA-N 429.476 4.699 50 10 IJGE COc1ccc(C=NNC(=O)COc2ccc(C(C)(C)C)cc2Br)c(C)c1C 1084320951 FPCOUGZHTNBJTG-UHFFFAOYSA-N 447.373 4.901 50 10 IJGE C=CCOc1cccc(NC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)c1 1666342742 MCUBEISIUDRIFS-UHFFFAOYSA-N 438.311 4.570 50 10 IJGE C=CCCC[C@H](NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)c1ccccc1 1687449527 CXZCZDDNBFDXHZ-QFIPXVFZSA-N 433.508 4.900 50 10 IJGE CCCCCN1C(=O)C(=NNC(=O)c2ccc(Cl)cc2)c2cc(Br)ccc21 1772752457 PKPBEZACFWINAD-UHFFFAOYSA-N 448.748 4.773 50 10 IJGE CCCCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cccc(Br)c2)cc1 1866131621 FFMRDEVTTRSBPI-SFQUDFHCSA-N 427.298 4.952 50 10 IJGE Cc1nc(Nc2ccc(SC#N)cc2)cc(N2CCN3CCc4c(F)cccc4[C@H]3C2)n1 1868480062 FBGWMIXJKAVGGN-JOCHJYFZSA-N 446.555 4.660 50 10 IJGE CC(C)(C)[C@@](C)(CBr)CN1CCC[C@@H](NC(=O)OCc2ccccc2)C1 1904840504 IWVMIEFTEOFUAC-NQIIRXRSSA-N 425.411 4.825 50 10 IJGE CCN(C)C[C@@H](Br)CCc1cccc(Br)c1Br 1949931811 VCMJXDPRDDDDFL-NSHDSACASA-N 428.006 4.859 50 10 IJGE CCN(C[C@@](C)(CI)OC1CC(C(C)C)C1)C(=O)OC(C)(C)C 1987764134 QIUNVLDQUTWQIM-JTTJXQCZSA-N 439.378 4.888 50 10 IJGE CCC[C@@H]1C[C@@H]1CO[C@](C)(CI)CN(CC)C(=O)OC(C)(C)C 1993096797 IQJQNSKHZURTIS-IIDMSEBBSA-N 439.378 4.890 50 10 IJGE Cl[C@H]1CCC[C@@H](CNc2ncc(I)cc2Br)C1 2015756424 FRSSRNQFTCEVFS-BDAKNGLRSA-N 429.527 4.658 50 10 IJGE CN[C@H](c1ccc(Br)c(C)c1Br)[C@H]1C[C@@H](Br)C1 2024281155 CSJYJIRSJLKOTG-RWEMILLDSA-N 425.990 4.954 50 10 IJGE CCC[C@@H](Cl)CCNC(=O)c1cc(I)ccc1Br 2029922608 MDPGHOBBGOSUBC-SECBINFHSA-N 444.538 4.581 50 10 IJGE C[C@H]1CN(C[C@H](CBr)c2ccccc2)C[C@@H](C)N1C(=O)OCc1ccccc1 2044701306 VDAANXGEJYEOPT-JQVVWYNYSA-N 445.401 4.897 50 10 IJGE CC[C@H](CBr)CN1CC[C@@H](C(F)(F)F)C[C@@H]1CNC(=O)OC(C)(C)C 2045432975 YWDFPNGKVOXCFA-MGPQQGTHSA-N 431.337 4.575 50 10 IJGE Cc1cccc(Cn2nc(CCl)c(I)c2C(F)(F)F)c1F 2079212012 HHUXYICEEPZHPH-UHFFFAOYSA-N 432.586 4.741 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]2(CC13CCOCC3)C[C@@]2(CBr)C(F)(F)F 2083260604 PTPKIBXOKGGUNE-ZBFHGGJFSA-N 428.289 4.510 50 10 IJGE C[C@@H](CCBr)CCN1CC[C@@](NC(=O)OC(C)(C)C)(c2ccccc2)C1 2106782528 QYDHKCAZHTVIAM-UWJYYQICSA-N 425.411 4.924 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCCCCN(C[C@H](CBr)c2ccccc2)C1 2106784153 GOGAWZWGYQICLX-RBUKOAKNSA-N 425.411 4.934 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1[C@H](CBr)C[C@@H]2CCC[C@@H]21 2115940081 LCCKJKDOWAXFIF-NRPADANISA-N 427.589 4.942 50 10 IJGE CN(Cc1ccccc1)[C@@H]1CCCCN(c2ccc([N+](=O)[O-])c(CBr)c2)C1 2169165474 IOIAVOHARISPKZ-HXUWFJFHSA-N 432.362 4.981 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)S(=O)(=O)Cc1ccccc1Br 2213761137 QTDRVTZWUVEUTK-KRWDZBQOSA-N 430.795 4.799 50 10 IJGE CCC[C@H](Br)CCNC(=O)c1ccc(Cl)c(I)c1 2256374146 FKKMNCRAMDAOPM-JTQLQIEISA-N 444.538 4.628 50 10 IJGE COCCN(CCCCCCCBr)C[C@@H]1CCCN1C(=O)OC(C)(C)C 2277449463 PDEPPALWAQGGAF-SFHVURJKSA-N 435.447 4.680 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N(CCBr)CC(F)(F)F 2285844397 MFLXSUGXDJYEEP-UHFFFAOYSA-N 441.444 4.641 50 10 IJGE CN(C(=O)Cc1cc(Br)cc(Br)c1)[C@H](CCl)C(C)(C)C 2295317347 LTRNFRWQWBZWNH-CYBMUJFWSA-N 425.592 4.866 50 10 IJGE C[C@@H]1C[C@H]1N(CCBr)Cc1ccc(Cl)cc1I 2302324928 BSMCCQTUTHQNRY-NOZJJQNGSA-N 428.539 4.550 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC(=O)C(C#N)=CNc1ccc(Cl)cc1C(F)(F)F 2318462247 FFCXYLRETXPREW-UHFFFAOYSA-N 440.765 4.734 50 10 IJGE C[C@H](C(O)=C(C#N)c1nc(-c2cccc(Cl)c2)cs1)N1C(=O)c2ccccc2C1=O 2331293827 IAGFYIVYSDJBTF-GFCCVEGCSA-N 435.892 4.941 50 10 IJGE CN(C)c1ccnc(N2CCCN(Cc3ccccc3)C(C)(C)C2)c1CBr 2377484541 INZDSMDUNWUTNR-UHFFFAOYSA-N 431.422 4.533 50 10 IJGE C[C@@H](Cl)C(=O)Nc1ccc(N(C)C)c(CN(Cc2ccco2)C(=O)c2cccs2)c1 34921556 SQPWXBWMQMLYPH-OAHLLOKOSA-N 445.972 4.816 50 10 IJGE CC(C)c1ccc(O[C@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccco2)cc1 38657556 AKJFVQDIBXHEPR-VOIUYBSRSA-N 444.487 4.994 50 10 IJGE Cc1ccc(C)c(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)COc2ccccc2)CCC3)c1 40816048 XVMFNPXKKBZWKY-VFCFBJKWSA-N 445.519 4.693 50 10 IJGE CCc1cc(Br)ccc1OCC(=O)N/N=C/c1c(OC)ccc2ccccc12 40959942 XBECQUYCIALYLU-ZMOGYAJESA-N 441.325 4.702 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@H]1Cl)c1cc(Br)ccc1Br 161208475 OECALZHSZRPIBV-CABCVRRESA-N 429.539 4.846 50 10 IJGE COc1cc([C@@H](C)[C@H](Br)C(C)=O)c(Br)cc1Br 234848640 GGFFTIGDJMAKSZ-INWYIAFRSA-N 428.946 4.676 50 10 IJGE CCOc1ccccc1C=NNC(=O)CSc1nc2ccccc2n1Cc1ccccc1 254296556 IELAPWOVLXZLSW-UHFFFAOYSA-N 444.560 4.726 50 10 IJGE O=C(COc1ccc(-c2ccccc2)cc1)NN=Cc1ccc(OC(=O)c2ccco2)cc1 254306586 BMVWOELEDKRNQC-UHFFFAOYSA-N 440.455 4.695 50 10 IJGE COc1ccc(Br)c([C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CBr)c1 382685638 ILUNRTCHHYNWNV-RISCZKNCSA-N 449.183 4.803 50 10 IJGE O=C(N[C@@H](CCl)CC(F)(F)F)c1cc(Br)c(Br)s1 717824651 RPGCAWKIWKYFAH-SCSAIBSYSA-N 429.483 4.563 50 10 IJGE O=C(NCc1ccc(COc2ccccc2)cc1)NNC(=O)c1cccc2ccccc12 743537029 PKZUPGNCFSQGRK-UHFFFAOYSA-N 425.488 4.563 50 10 IJGE COc1ccccc1-c1ncc(/C=C(/C#N)c2nc(O)c3c4c(sc3n2)CCCC4)cn1 792866353 LZTXIXIRKPCOCW-GDNBJRDFSA-N 441.516 4.805 50 10 IJGE C[C@@H](Oc1ccc(OCc2ccccc2)cc1)C(=O)NN=Cc1cccc2cccnc12 1083986949 LESHKFCNVQMWEY-LJQANCHMSA-N 425.488 4.731 50 10 IJGE C[C@H](SCc1nc(O)c2ccccc2n1)C(=O)N1CC[C@H](O[Si](C)(C)C(C)(C)C)C1 1557691314 YQUSCSUTQZZFSI-HOTGVXAUSA-N 447.677 4.580 50 10 IJGE Cc1c(C(=O)NNc2cc(C(F)(F)F)ccc2Br)nc(O)c2ccccc12 1626633145 MTGWRPITVQPOMF-UHFFFAOYSA-N 440.219 4.787 50 10 IJGE Cc1c(C(=O)NNC(=O)c2ccc(F)cc2)oc2c1C(=NNc1ccccc1)CC(C)(C)C2 1772728920 BUAZMQAPRRLSAY-UHFFFAOYSA-N 448.498 4.591 50 10 IJGE Cc1cc(C)cc(NC(=O)c2oc3c(c2C)C(=NNC(=O)COc2ccccc2)CCC3)c1 1772749919 RQGOAHBSJBOYNH-UHFFFAOYSA-N 445.519 4.693 50 10 IJGE COc1cc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(C)cc2)ccc1OC(C)C 1865696928 ULLWVMGOGUFCSF-DEOSSOPVSA-N 444.535 4.562 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C(C)(C)C 1882801449 WGQDYHJAJJVWCG-KFWWJZLASA-N 449.430 4.946 50 10 IJGE Cc1cccc(S(=O)(=O)N(Cc2ccccc2)C2(CBr)CCC2)c1F 1915756030 UBOBCNBGOPHHAI-UHFFFAOYSA-N 426.351 4.643 50 10 IJGE BrC[C@@]1(Cc2c(Br)cccc2Br)C[C@]12CCOC2 2039021406 AIEZIEDMEPGNRM-UONOGXRCSA-N 438.985 4.946 50 10 IJGE CC(C)[C@@H](C)n1nc(CBr)c(I)c1C(F)(F)F 2079256806 GVVGTWPBBWJZRS-ZCFIWIBFSA-N 425.030 4.618 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCCCC2)C[C@H](CBr)C2CC2)C1 2106786421 UWBOTPRHKIHLMU-SFHVURJKSA-N 429.443 4.909 50 10 IJGE CN(C(=O)c1ccccc1OCc1ccccc1)C1(CBr)CCSCC1 2114723383 SIDAPGOCEHEPLR-UHFFFAOYSA-N 434.399 4.998 50 10 IJGE Cc1c(Cl)cc(C(=O)NC[C@@H](CBr)C(F)(F)F)cc1Br 2167387668 JOKJNLOWTRNXSA-MRVPVSSYSA-N 437.481 4.714 50 10 IJGE CC1(C)CO[C@H](COc2c(Br)cc(CCl)cc2Br)CO1 2176668202 QVHDLVYAEVDLCK-SNVBAGLBSA-N 428.548 4.523 50 10 IJGE Brc1ccccc1[C@H](CI)O[C@H]1C[C@@H](n2cccn2)C1 2183685083 KRLRHOHQAXNBBU-ZOWXZIJZSA-N 447.114 4.542 50 10 IJGE O=C(NC[C@]1(CBr)C[C@H]1C(F)(F)F)c1ccc(OCc2ccccc2)cc1 2192579982 LIZRPOWLFMYTIB-IEBWSBKVSA-N 442.275 4.959 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCCC2)CC2(CBr)CC(F)C2)C1 2265633566 WZTFDSLIFYPGIS-UHFFFAOYSA-N 433.406 4.611 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)Nc2ccc(OC)cc2)cc(Br)c1OCC 2297382372 MCENMFYRTVFREI-UHFFFAOYSA-N 445.313 4.801 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)CCc2cccc(Cl)c2)c(OCC)c1 2314810481 OXFUXCYXQCCAQL-UHFFFAOYSA-N 427.884 4.747 50 10 IJGE CCOc1cc(C=NNC(=O)Cc2ccc(N)cc2)ccc1OCc1ccccc1Cl 2323318111 YEIZIFDGUNDBIT-UHFFFAOYSA-N 437.927 4.593 50 10 IJGE FC1(CCl)CCN(Cc2ccc(I)c(Br)c2)CC1 2325222268 RBGVTBHBYOWTTQ-UHFFFAOYSA-N 446.529 4.597 50 10 IJGE O=C(NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21)c1cc2ccccc2[nH]1 2326843764 DBXQGUZCLIVNTA-UHFFFAOYSA-N 428.879 4.502 50 10 IJGE CC(C)N1C[C@H](Br)[C@H](Cc2cc(I)ccc2Cl)C1 2327395901 WZXMVDVWQRKYCQ-YPMHNXCESA-N 442.566 4.591 50 10 IJGE CC(C)c1csc(C(C#N)=C(O)[C@H](Cc2ccccc2)N2C(=O)c3ccccc3C2=O)n1 2331329751 AVJNVSCUSGVHTI-NRFANRHFSA-N 443.528 4.967 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccc(C(F)(F)F)cc1 2343419377 YZLPQJVCCQVUHB-KRWDZBQOSA-N 430.264 4.806 50 10 IJGE CN(c1c(CBr)c(C(F)F)nn1C)[C@@H]1CN(Cc2ccccc2)C(C)(C)C1 2365332032 DJDKICKEIBNJJW-HNNXBMFYSA-N 441.364 4.742 50 10 IJGE C[C@H]1C[C@H]2C[C@]([C@@H](Br)c3cc(I)cc4c3OCC4)(C2)O1 2368505246 MNKXMJGYGGRWMH-VUKUWZNJSA-N 449.126 4.620 50 10 IJGE F[C@]12CCC[C@@]1(CCl)CN(Cc1cc(I)ccc1Cl)C2 2380512051 KMLBYEIBCXMMQS-CABCVRRESA-N 428.116 4.878 50 10 IJGE COc1ccc(Br)cc1/C=N/NC(=O)[C@@H](C)Nc1cccc2ccccc12 27528116 NXAFNJGCIYRCOX-JMKVTYIUSA-N 426.314 4.562 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2ccccc2OCc2ccccc2)cc1 58895425 SRPRDUGOKFQMAX-OIZLQNDXSA-N 432.520 4.628 50 10 IJGE C[C@H]1CCC[C@](CBr)(NC(=O)c2c(F)cc(Br)cc2F)C1 125131825 IMJHXYOAOTXOST-VFZGTOFNSA-N 425.111 4.801 50 10 IJGE CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(C(=O)OCCC(C)C)cc2)cc1OC 206243476 XJAFNHQITCYHKX-ZHZULCJRSA-N 436.508 4.842 50 10 IJGE N#C/C(=C/NCc1cccc(Br)c1)C(=O)NC(c1ccccc1)c1ccccc1 216980137 MVIUELMJGIIXAH-FXBPSFAMSA-N 446.348 4.852 50 10 IJGE CCOC(=O)c1ccc(N=Cc2cc3c(cc2O)OC(N)=C(C#N)[C@H]3c2ccccc2)cc1 254838993 ZAYFZQOCNPVBDL-DEOSSOPVSA-N 439.471 4.538 50 10 IJGE ClCc1cc2c(I)csc2cc1I 306901966 PHJSOQSJGWPQDK-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE ClCc1nc2cnccc2n1-c1cc(I)ccc1Br 311657225 VVNLNVQJZYBKMN-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1Oc1cccc(I)c1 404301600 ZMOXSTVHKSBSBO-UHFFFAOYSA-N 440.056 4.948 50 10 IJGE Clc1cc2c(cc1[C@H](Br)c1nscc1Br)OCCO2 404804556 MJKZKKBIDAHAFD-NSHDSACASA-N 425.529 4.815 50 10 IJGE Cc1ccc(C23C[C@H]4C[C@@H](CC(NC(=O)NN=Cc5cccc([N+](=O)[O-])c5)(C4)C2)C3)cc1 607743623 PIKQWKYEPINREY-JSZXIJHASA-N 432.524 4.827 50 10 IJGE Cc1ccc(NNC(=O)N[C@H](C)c2sc(-c3ccc(Br)cc3)nc2C)nc1 740062170 LDTFTHRXGBOJMS-CYBMUJFWSA-N 446.374 4.972 50 10 IJGE CC(=O)N(C)c1cccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccccc3F)c2C)c1 744776539 QXIOIMXKFXNHSL-MOSHPQCFSA-N 430.483 4.762 50 10 IJGE COc1ccc(C[C@H](NC(=O)NNc2cccc(F)c2F)c2ccccc2)cc1OC 745800716 MWWPZLQTDWWULZ-IBGZPJMESA-N 427.451 4.592 50 10 IJGE O=C(NS(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1)c1nc(Cl)cs1 789471632 HXVPXMMQRRBNDK-UHFFFAOYSA-N 428.813 4.573 50 10 IJGE COc1ccc(C(CSc2nc3ccccc3s2)=NNC(=O)c2ccccc2O)cc1 1084319603 OXXHBCUFNBHVIM-UHFFFAOYSA-N 449.557 4.937 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cccc(Oc3ccc(Cl)cn3)c2)c1C 1182768123 BQALBUWHBSCVLY-UHFFFAOYSA-N 446.898 4.753 50 10 IJGE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NNc1nc(-c2ccccn2)nc(C)c1C 1306591711 YTCIQLDIXSMSCR-OUKQBFOZSA-N 443.429 4.601 50 10 IJGE C#CC[C@@H]1CCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1438021306 UZZJTGFTVCQNFX-RXWSAZGZSA-N 436.353 4.635 50 10 IJGE C=C(CNC(=O)CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)c1ccccc1 1625804850 AVAKNJBZZRRXEY-UHFFFAOYSA-N 443.663 4.783 50 10 IJGE CC(=O)N1CCc2c(NC(=O)NNc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cccc21 1670505938 SIXUEFHHOWPLQK-UHFFFAOYSA-N 446.351 4.782 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)cc1OCC 1865688601 WBZVNVZSMVSUPG-QHCPKHFHSA-N 430.508 4.586 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](NC(=O)c2cc(-c3ccco3)on2)c2ccccc2)cc1 1866640313 SZPIRVYBPNSIJP-OAQYLSRUSA-N 444.472 4.618 50 10 IJGE C[C@@H]1[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)[C@@H]1C 1892778172 WTQUVVRYYPFNGN-YJNKXOJESA-N 435.403 4.556 50 10 IJGE CCCN[C@H](c1sc(Cl)cc1I)[C@H]1C[C@@H]1Br 1901025475 GZIGEAGFEHTDAC-BYULHYEWSA-N 434.568 4.830 50 10 IJGE CC(C)(CI)CN1CCCC[C@H]1C(C)(C)NC(=O)OC(C)(C)C 1904649885 AKDABXPLPBVNNB-AWEZNQCLSA-N 438.394 4.605 50 10 IJGE CCn1ncc(Br)c1[C@@H](Br)Cc1ccncc1Br 1924021237 JSJHWENKKONSKQ-VIFPVBQESA-N 437.961 4.502 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCCC[C@H]1CBr 1945189532 SRWBFJQCDYOISN-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE CC(C)(C)OC(=O)N[C@@]1(c2ccccc2)CCN(C[C@@H](CBr)C2CCC2)C1 1966413742 DEOZSRREHWLFGF-GCJKJVERSA-N 437.422 4.924 50 10 IJGE C[C@H](Br)[C@H]1CCCN1Cc1ccc(Br)cc1Br 2018116690 GDYLARCLVJXEGU-TVQRCGJNSA-N 425.990 4.959 50 10 IJGE CCC(CC)(CBr)CN1CC[C@@H](NC(=O)OC(C)(C)C)C(F)(F)CC1 2044696402 LMCDTHVXKDZBTB-CQSZACIVSA-N 427.374 4.812 50 10 IJGE Cn1nc(C[C@@H](CBr)c2ccc(Br)cc2)cc1Br 2049248233 BLGZZZJIJGZJOY-JTQLQIEISA-N 436.973 4.666 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2CCN(CC3(CBr)CCCCC3)CC[C@H]2C1 2106783673 BWUMTZQIORIWOQ-ROUUACIJSA-N 429.443 4.911 50 10 IJGE CCC(CC)(CBr)CN1C[C@H]2CC[C@H]1[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]21 2106788019 MFZNLYYGKOTNNM-XDNAFOTISA-N 429.443 4.765 50 10 IJGE CC1(C)C[C@@H](O[C@@](C)(CI)c2ccccc2Br)CO1 2115709183 YVUGRGWQWZEZHE-ABAIWWIYSA-N 439.131 4.683 50 10 IJGE C[C@@]1(CBr)CC(F)(F)CN1C(=O)c1cc(Br)c(Cl)s1 2115939674 GXSCCXPJLDJPFJ-JTQLQIEISA-N 437.531 4.799 50 10 IJGE C[C@@H]1[C@@H](C(F)(F)F)N(C[C@H](CBr)C2CCC2)CCN1C(=O)OC(C)(C)C 2115980593 SQBZNAOUQMNCCY-SNPRPXQTSA-N 443.348 4.670 50 10 IJGE O=S(=O)(c1cc(CBr)cc(F)c1F)N(Cc1ccccc1)C1CCCC1 2123267952 BNSGMOLFCQWASZ-UHFFFAOYSA-N 444.341 4.993 50 10 IJGE O=S(=O)(c1cc(F)c(Cl)c(CCl)c1)N(Cc1ccccc1)C[C@@H]1CCCO1 2152214197 BJOWEISNBMONDX-INIZCTEOSA-N 432.344 4.588 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](OC)C[C@@]1(C)CNC(=O)OC(C)(C)C 2163062715 MNJLHZZNSPFYEC-PXNSSMCTSA-N 449.474 4.972 50 10 IJGE Cc1cc(C(=O)N2CC[C@](CBr)(C(F)(F)F)C2)c(Br)s1 2167679216 XFWSSPKJFRUNKA-LLVKDONJSA-N 435.103 4.609 50 10 IJGE Cc1c(Cl)cc(C(=O)N(C)[C@H](CCBr)C(F)F)cc1Br 2178516193 TWNNIWILOQVVEE-LLVKDONJSA-N 433.518 4.902 50 10 IJGE COC[C@@]1([C@H](Br)c2cc(Br)c(OC)cc2Cl)CCCO1 2202367857 YYVCXYMDEHNYJK-ZIAGYGMSSA-N 428.548 4.743 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Br)[C@@H]1OCCOC1(C)C 2203000373 NXEKWJZRUJWDRY-AAEUAGOBSA-N 428.548 4.741 50 10 IJGE CC(C)(CCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(Br)c1 2217398158 VXWLBHHPXWSQEI-UHFFFAOYSA-N 434.758 4.797 50 10 IJGE CN(Cc1cc(Cl)ccc1I)[C@@H](CBr)CC1CC1 2219036538 FJSGRDJUEMXCST-CYBMUJFWSA-N 442.566 4.940 50 10 IJGE COC[C@]12C[C@]([C@H](Cl)c3cc(Br)c(Br)cc3F)(CO1)C2 2233969687 LQLVFHYRRJVOIF-MGPQQGTHSA-N 428.523 4.826 50 10 IJGE CC1CC(CBr)(CN2CCC[C@H]([C@H]3CCCN3C(=O)OC(C)(C)C)C2)C1 2265311455 HDJXCFPXWXSSRG-UISNHOIMSA-N 429.443 4.909 50 10 IJGE CC(C)[C@H]1N(C(=O)OC(C)(C)C)CC12CCN(CC1(CBr)CC(F)C1)CC2 2280360377 UEBNVCUICIFVKD-OHTSDLOESA-N 447.433 4.857 50 10 IJGE C[C@H](c1ccncc1Br)[C@@H](Br)c1cscc1S(C)(=O)=O 2288510666 GKMFSGULFDVOLT-AMIZOPFISA-N 439.194 4.549 50 10 IJGE COc1ccc(CNC(=O)C(C#N)=Cc2cc(C)n(-c3ccc(C)c([N+](=O)[O-])c3)c2C)cc1 2294187361 FLWOXAKEFIEILE-UHFFFAOYSA-N 444.491 4.543 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)CCc1cccc(CC(F)(F)F)c1 2307638353 JAQNMHPSZXFYJH-OAHLLOKOSA-N 440.259 4.784 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)C=Cc4ccc(C)cc4)ccc32)cc1 2314634228 HVZZNDHFWRXIOK-AREMUKBSSA-N 438.483 4.841 50 10 IJGE COc1ccc(C(C#N)=Cc2ccc(OC(=O)COc3ccccc3OC)cc2)cc1OC 2320507314 OJTNOTACRNGDOR-UHFFFAOYSA-N 445.471 4.761 50 10 IJGE COc1cc(C=NNC(=O)c2ccc3nc(-c4ccccc4)[nH]c3c2)cc(Cl)c1OC 2323744639 VCBPJQYDMRCRMF-UHFFFAOYSA-N 434.883 4.664 50 10 IJGE ClCC1(CNCc2ccc(I)c(Br)c2)CCCC1 2325224313 WABADALYZDFZDR-UHFFFAOYSA-N 442.566 4.943 50 10 IJGE CCCCO[C@@H]1[C@H](Br)C[C@H]1OCc1cccc(I)c1 2341609191 NQLNBUXGPHWKHQ-RBSFLKMASA-N 439.131 4.529 50 10 IJGE O=C(COc1ccc(Br)cc1Cl)N/N=C/c1ccccc1C(F)(F)F 14018303 GWXWYWJQESUUIQ-GZIVZEMBSA-N 435.627 4.650 50 10 IJGE Cc1c(C(=O)Nc2cccc(Cl)c2)oc2c1/C(=N/NC(=O)c1ccccc1O)CCC2 40826473 ONHHRFLNXHBBRS-YZSQISJMSA-N 437.883 4.670 50 10 IJGE CCCOc1ccc(C=NNC(=O)CNc2cccc(C(F)(F)F)c2)c(OCCC)c1 254492677 HEVVOEBLIZREJI-UHFFFAOYSA-N 437.462 4.845 50 10 IJGE Oc1c(Br)cccc1[C@H]1CN(Cc2ccccc2)C[C@@H]1CBr 382694363 WWEJURUDFAPOPH-HOCLYGCPSA-N 425.164 4.765 50 10 IJGE Cc1cc([C@@H](Cl)c2cnn(C)c2I)c(C)cc1Br 394063323 CZMTYAYDRYGQRT-GFCCVEGCSA-N 439.522 4.732 50 10 IJGE C[C@]1(Cn2c(CCl)nc3cc(Br)cnc32)CCCN1Cc1ccccc1 398128414 ZSOTZHRKEXXVGQ-HXUWFJFHSA-N 433.781 4.987 50 10 IJGE O=C(CBr)c1c(OC(F)F)ccc(OC(F)(F)F)c1Br 575688405 WJRDKSDGYDSTGT-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE Cc1sc(Br)cc1[C@H](Br)c1cn(C)c(Br)n1 698419726 QCLPGTFWVWYPEX-VIFPVBQESA-N 428.975 4.799 50 10 IJGE C[C@@H](Br)C[C@@H](C)NC(=O)c1scc(Br)c1Br 705513507 PUWFRTSYXNGITC-PHDIDXHHSA-N 433.991 4.565 50 10 IJGE Cc1ccnc(NNC(=O)c2cc(Cl)nc(Oc3ccc(Br)cc3)c2)c1 772473468 HLWBWOFKRARHLL-UHFFFAOYSA-N 433.693 4.750 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2cc(C)n(-c3ccc(C(=O)OC(C)C)cc3)c2C)cc1 1084145522 YZHRVTYCLSASND-UHFFFAOYSA-N 447.535 4.822 50 10 IJGE C[C@@]12CC[C@@H]3c4ccc(O)cc4CC[C@@H]3[C@@H]1CCC2=NNC(=O)c1ccc([N+](=O)[O-])cc1 1084242510 KEQULFQWPVKPAT-HXKBJWFLSA-N 433.508 4.943 50 10 IJGE O=C(O)c1cc(-c2ccc(C=NNC(=O)c3ccccc3Br)o2)ccc1Cl 1084375241 WHCQDTUSXHLFER-UHFFFAOYSA-N 447.672 4.825 50 10 IJGE Cc1cc(Br)c2oc(C(=O)NNc3nc4ccccc4[nH]c3=S)cc2c1 1641877493 UQKVBGGFUYKPEF-UHFFFAOYSA-N 429.299 4.866 50 10 IJGE CCc1nn(Cc2cccc(F)c2)c2c1[C@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865704992 JUCNIOFMHXJZSS-JOCHJYFZSA-N 432.499 4.638 50 10 IJGE Cc1oc(-c2ccc(C(C)C)cc2)nc1CC(=O)NCC(=O)Nc1ccc(SC#N)cc1 1868158717 MPHLCUXUSDONDR-UHFFFAOYSA-N 448.548 4.644 50 10 IJGE C[C@H](C[C@H]1CCCN1C(=O)OC(C)(C)C)[C@H](CBr)NC(=O)OC(C)(C)C 1880762728 YFBXGXYOJVXWDT-KFWWJZLASA-N 435.403 4.700 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1cccc(Br)c1Cl 1882086361 ASDVILQYKMJXKX-SNVBAGLBSA-N 427.564 4.933 50 10 IJGE C[C@@H]([C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1)[C@@H](CBr)NC(=O)OC(C)(C)C 1884025678 GLUDYOZOFOXJDC-YHUYYLMFSA-N 449.430 4.994 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)CCc1cccc(NC(=O)OC(C)(C)C)c1 1887823338 MHDAGLMWXSPROR-IYBDPMFKSA-N 425.367 4.598 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)N(C)CC2CC(Br)C2)cc1 1887828884 BTAABNPUOJPLIH-TUBUQKNSSA-N 425.367 4.518 50 10 IJGE C[C@@H]1C[C@@H]1CCCO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1896108524 DVXRJLHQRJZUOL-RVKKMQEKSA-N 437.362 4.644 50 10 IJGE C[C@H]1CN(Cc2cc(Br)ccc2Br)CC[C@@H]1Br 2006503418 NZONEXWRTVNIRS-CABZTGNLSA-N 425.990 4.817 50 10 IJGE CC(C)[C@H](CBr)CNC(=O)c1cccc(Br)c1Br 2031479911 PDEQWJMGPJRUFL-SECBINFHSA-N 441.989 4.609 50 10 IJGE CCN(CCCOCc1ccccc1)S(=O)(=O)c1c(C)csc1CBr 2059282302 IAWIJMUVRKEFSE-UHFFFAOYSA-N 446.432 4.569 50 10 IJGE ClC[C@@H](Nc1ncc(I)cc1Br)[C@@H]1CC=CCC1 2075336706 XQKUXUUYORZPKD-BXKDBHETSA-N 441.538 4.824 50 10 IJGE CC(C)[C@@H](CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)CCc2ccccc21 2106782155 OIXBDTKEAVUSOF-ROUUACIJSA-N 425.411 5.000 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2C[C@H]1CCN1Cc1ccccc1 2128497653 QSVYFKGFRFYXFZ-MRXNPFEDSA-N 433.781 4.558 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@@H]1CN(Cc2ccccc2)C[C@@H]1C 2153119539 HMAOYVOWVAZPCR-IFXJQAMLSA-N 447.808 4.977 50 10 IJGE CC(C)(CCl)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1I 2155827321 AYWNXZDHCFTPSN-CYBMUJFWSA-N 426.125 4.814 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@](C)(CBr)C(F)(F)F)cc1Br 2167388103 OMXRYSQUUQMFAC-LLVKDONJSA-N 437.481 4.857 50 10 IJGE Cc1cc(Br)sc1[C@@H](Br)c1ccc2c(c1)CCS2(=O)=O 2170069646 CPTSEGJMQQUFGK-ZDUSSCGKSA-N 436.190 4.633 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@@H]2COCCO2)c(C)c1Br 2220147533 IUDFZUIJBWUPLD-GXFFZTMASA-N 442.973 4.680 50 10 IJGE Cc1c(CBr)cccc1NS(=O)(=O)c1cc(Br)cs1 2268333578 ONYVVMYBDCHWLV-UHFFFAOYSA-N 425.167 4.515 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@@H]1Br)c1scc(Br)c1Cl 2279183757 NUBQQYHZRWKZBW-CABZTGNLSA-N 435.568 4.955 50 10 IJGE CCCC(CBr)(CCC)CN(C)CC1(O)CCN(Cc2ccccc2)CC1 2286348381 JDHAQNVYGZTERL-UHFFFAOYSA-N 439.482 4.927 50 10 IJGE CN(Cc1ccc(Cl)cc1I)C1CC(CBr)C1 2302309020 IIDLTCBGJBNNRW-UHFFFAOYSA-N 428.539 4.550 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)cc2I)CC[C@H]1Br 2302315131 GAOJLZKCGDJRRA-JOYOIKCWSA-N 428.539 4.550 50 10 IJGE Clc1ccc(CN2CCC[C@H]2CCBr)c(I)c1 2302325256 FMYALZVAZOWSEC-LBPRGKRZSA-N 428.539 4.694 50 10 IJGE O=C(C=Cc1cccc2ccccc12)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1 2313624405 RSBRPZPARYORNL-UHFFFAOYSA-N 435.483 4.567 50 10 IJGE C[C@H](Cl)CCCN(C)C(=O)c1cc(I)ccc1Br 2314469688 CCOPJQUENVGINV-VIFPVBQESA-N 444.538 4.533 50 10 IJGE C[C@@H]1C[C@H](CCl)CCN1Cc1ccc(I)c(Br)c1 2325205162 UXJUBBZDSGHIDT-GHMZBOCLSA-N 442.566 4.893 50 10 IJGE CN(C)c1ccc([C@@H](CNC(=O)C(C#N)=Cc2cccc(Cl)c2)N2CCCCC2)cc1 2329676787 SDUZLRZHYBTNMT-XMMPIXPASA-N 436.987 4.656 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3CCCC[C@]3(NC(=O)OC(C)(C)C)C2)C1 2345004350 JKZVVCRQWXTMAL-KKSFZXQISA-N 429.443 4.957 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@H]3CN(C(=O)OC(C)(C)C)CC[C@H]32)C1 2345005628 BGEVHJWUADJWGD-DLBZAZTESA-N 429.443 4.909 50 10 IJGE CC(C)CCOc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)cc1 14665962 MYMDREGRBFEKDX-GOSISDBHSA-N 426.557 4.638 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(Cl)c2)cc1 38651148 XWVLEONMPOVSTJ-DEOSSOPVSA-N 446.890 4.851 50 10 IJGE Cc1ccccc1NC(=O)/C(C#N)=C/c1c(Oc2ccccc2C)nc2ccccn2c1=O 39993152 QBGKMSHXSIECMD-XDJHFCHBSA-N 436.471 4.649 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2cc(Cl)c(OCC)c(Cl)c2)cc1 58893863 JZVLPUSJSLFWGN-RIMPEIONSA-N 439.339 4.755 50 10 IJGE CC(=NNC(=O)c1cccs1)c1ccc(NC(=O)COc2ccc(Cl)cc2)cc1 252643249 ZTOUQPJVAWONNX-UHFFFAOYSA-N 427.913 4.573 50 10 IJGE Cc1ccc(C=NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)c(C)c1 254668997 NLELROLRQPHISI-UHFFFAOYSA-N 441.940 4.522 50 10 IJGE CCCCOc1ccccc1-c1cc(C(=O)NN=Cc2c(O)ccc3ccccc23)[nH]n1 254836537 YDGVOROBSKBLLP-UHFFFAOYSA-N 428.492 4.878 50 10 IJGE N#C[C@H](Br)c1ccc(I)c(OCc2ccccc2)c1 309751992 ZSPCRIOFTOSEEM-ZDUSSCGKSA-N 428.067 4.830 50 10 IJGE COc1ccc([C@H](Br)c2sccc2I)cc1F 310238769 COOANSMSPGWZMF-NSHDSACASA-N 427.076 4.985 50 10 IJGE C[C@]1(c2ccc(I)cc2)CCC[C@@H](CI)O1 394499463 ORRGXQHZERSXDM-QWHCGFSZSA-N 442.078 4.511 50 10 IJGE C[C@@H](CCl)[C@@H]1CCCCN1C(=O)c1cc(Cl)ccc1I 696709555 BIHOPWFHQDBCTB-HZMBPMFUSA-N 426.125 4.814 50 10 IJGE N#Cc1ccc(-c2cccc(CNC(=O)NNC(=O)c3ccc(Cl)cc3Cl)c2)s1 740482820 DTZKQOYBWIJWJL-UHFFFAOYSA-N 445.331 4.738 50 10 IJGE C[C@H](CBr)COC(=O)CSc1nnc(-c2ccco2)n1C1CCCCC1 770405461 JSRABSRPCOHNQG-CYBMUJFWSA-N 442.379 4.710 50 10 IJGE Cc1nc(Cc2ccc(F)cc2)sc1C(=O)NNc1nc2ccccc2[nH]c1=S 1167427414 KFJIVFWDHZFEGC-UHFFFAOYSA-N 425.514 4.544 50 10 IJGE C=C(Cl)C[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccccc2C)c1C)C(=O)OCC 1535344766 HYWQKEYALNJOIT-OABJIQBASA-N 439.943 4.500 50 10 IJGE CCCCCCOc1ccc(C=NNC(=O)COc2ccc(Br)cc2)cc1 1772753803 JPVZQQUVOGVARI-UHFFFAOYSA-N 433.346 4.937 50 10 IJGE CCc1nn(-c2ccccn2)c2c1[C@H](c1cccc(OCc3ccccc3)c1)C(C#N)=C(N)O2 1865711765 HPIXVTPBNJGSTQ-XMMPIXPASA-N 449.514 4.627 50 10 IJGE C[C@H]1COC[C@H](C)N1c1cc(Nc2ccc(SC#N)cc2)nc(Cc2ccccc2)n1 1868207855 QOJABEJUYRGMFC-ROUUACIJSA-N 431.565 4.998 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)Cc1cc(Cl)c(C(F)F)s1 1892928757 DHHFBTYYCPKPJH-MRVPVSSYSA-N 434.689 4.941 50 10 IJGE Clc1ccc(I)c(C[C@@H]2CCOCC[C@H]2Br)c1 2001019243 YDWJYFLZEMWIRU-JOYOIKCWSA-N 429.523 4.677 50 10 IJGE CC(C)N(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C[C@@H](Br)C(F)(F)F 2044698760 FIDBCPAIWFVBSD-UONOGXRCSA-N 431.337 4.812 50 10 IJGE BrC[C@H]1CCN(Cc2c(Br)cccc2Br)C12CC2 2070107436 UMIQTUFARCMDNJ-SNVBAGLBSA-N 438.001 4.961 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Br)c2n1Cc1ccn(Cc2ccccc2)n1 2095435856 DZXNUTGWAGPUSX-CYBMUJFWSA-N 430.737 4.787 50 10 IJGE Cn1cc(COc2c(Br)cc(Cl)cc2CBr)c(Cl)n1 2111947251 RSZXETBJHWBITA-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1CN(CC1CC1)C[C@H](CBr)CC1CC1 2112868851 NPYAOGLSSHXTPY-RBUKOAKNSA-N 429.443 4.909 50 10 IJGE CC(C)(CCl)[C@@H]1CCCN1C(=O)c1ccc(I)c(Cl)c1 2155828708 IGYXPTPPOAGPTE-ZDUSSCGKSA-N 426.125 4.814 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ccccc2)CCN1C[C@H](CBr)c1ccccc1 2186713864 ZTKJZKVCJARYFS-VQTJNVASSA-N 441.335 4.914 50 10 IJGE COc1ccc([C@H](Br)[C@@]23CC[C@@H](C2)[C@@H](C)O3)cc1I 2269545123 MGEKIJPYWVIBRG-PBUVFVDJSA-N 437.115 4.693 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2CC3(CCC3)CO2)cc1I 2269557244 SXAALVYGLMQUFS-UONOGXRCSA-N 437.115 4.695 50 10 IJGE O=C(CSc1nc2ccccc2n1Cc1ccccc1)NN=CC=Cc1ccccc1 2293116053 PBDCGUDVGHORBP-UHFFFAOYSA-N 426.545 4.992 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)NN=Cc2cccc(OC(=O)C=Cc3ccco3)c2)cc1 2294700848 HAVLQWQTBKFWRZ-UHFFFAOYSA-N 446.503 4.725 50 10 IJGE CCCN(CCCCl)Cc1ccc(I)c(Br)c1 2306223115 ARWPRDWCCWHZDG-UHFFFAOYSA-N 430.555 4.895 50 10 IJGE Cc1ccc(Sc2ccc(C=C(C#N)C(=O)N3CCN(c4ccccc4)CC3)o2)cc1 2313567529 LBERFORDWLITHM-UHFFFAOYSA-N 429.545 4.995 50 10 IJGE COc1cccc(-c2nn(-c3ccccc3)cc2C=C(C#N)C(=O)NC2CCCCC2)c1 2314475704 AUCWHRRWDBFMND-UHFFFAOYSA-N 426.520 4.904 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccco2)C(=O)C1=Cc1ccc(OCc2ccc(C)cc2)cc1 2314618918 WTAPMZJGSJGLRO-UHFFFAOYSA-N 438.483 4.960 50 10 IJGE CC[C@@H](NC(=O)C(C#N)=CN1CCN(c2ccc(F)cc2)CC1)c1ccc2c(c1)CCCC2 2325081374 BPGNWBAIFCEDEF-AREMUKBSSA-N 446.570 4.501 50 10 IJGE ClCC[C@@H]1CCCN(Cc2ccc(I)c(Br)c2)C1 2325224611 YAPVJJZSUKKKTG-NSHDSACASA-N 442.566 4.895 50 10 IJGE ClCc1cnccc1OCc1ccc(I)c(Br)c1 2325380884 HSDAFGHMTKHULU-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE C=CC[C@H](Br)[C@H]1CCN1Cc1cc(I)ccc1Cl 2327397190 MSVWNNXDIJAGPV-GXTWGEPZSA-N 440.550 4.859 50 10 IJGE CCCCOC(=O)c1ccc(NC(=O)C(C#N)=Cc2ccc(Br)cc2)cc1 2329662873 GAXOBGBINADJRO-UHFFFAOYSA-N 427.298 4.952 50 10 IJGE N#CC(=Cc1ccc(Br)cc1)C(=O)Nc1cccc(-c2cccc(C(=O)O)c2)n1 2329665541 XJHRHWFYYAHHHK-UHFFFAOYSA-N 448.276 4.755 50 10 IJGE Brc1ccccc1[C@@H](CI)OC[C@@H]1O[C@H]2CC[C@H]1C2 2352572131 FHJBFOQEMCNFQI-AZHAFVHUSA-N 437.115 4.509 50 10 IJGE Cc1ccc(/C=N/NC(=O)c2ccccc2NC(=O)c2cccc(Br)c2)cc1 3024373 HEDNRANZJHXDMR-ZVHZXABRSA-N 436.309 4.774 50 10 IJGE O=C(OC[C@H]1O[C@H](Cl)C[C@H]1OC(=O)c1ccc(Cl)cc1)c1ccc(Cl)cc1 16954753 QEHCZULNFYDPPL-ZACQAIPSSA-N 429.683 4.730 50 10 IJGE in-vitro Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(C(C)C)cc4)ccc32)o1 38659352 RNVAVAIZVHPZDE-VWLOTQADSA-N 444.487 4.914 50 10 IJGE CC(C)c1ccc(Nc2ncnc(NNC(=O)c3ccccc3Cl)c2[N+](=O)[O-])cc1 40594676 GRAOIKYDPZYIKW-UHFFFAOYSA-N 426.864 4.662 50 10 IJGE Nc1c(NNC(=O)c2ccc(Cl)cc2Cl)ncnc1NC12CC3CC(CC(C3)C1)C2 40755763 IZIIYUZOIUVJKC-UHFFFAOYSA-N 447.370 4.503 50 10 IJGE Cc1c(C(=O)Oc2cccc3cccnc23)oc2c1/C(=N/NC(=O)c1cccs1)CCC2 40823748 MVQLDTSCNFCVHE-WGOQTCKBSA-N 445.500 4.887 50 10 IJGE COC(=O)c1ccc(-n2c(C)cc(/C=N/NC(=O)c3cc4ccccc4o3)c2C)c(C)c1 59680068 MMEBWECDQNUULU-VULFUBBASA-N 429.476 4.699 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2ccccc2Cl)cc(Br)c1OCC 169886120 QYQARGRGPXJAMI-NHDPSOOVSA-N 425.710 4.664 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)N(c2cc(C)ccc2C)S(=O)(=O)c2ccccc2)cc1 207129273 ORGOLFFESMPJAC-PGMHBOJBSA-N 446.528 4.641 50 10 IJGE CCN(CC)c1ccc(N/C=C(/C#N)C(=O)N[C@H](C)c2ccc(OC)c(OC)c2)c(C)c1 217174823 PXUSCKUERGJOLL-HWLQVLAGSA-N 436.556 4.555 50 10 IJGE CC(C)OCCOc1c(Br)cc(CBr)cc1Br 232667212 NTJHJYBZKGYYAL-UHFFFAOYSA-N 430.962 4.910 50 10 IJGE CC(C)(C)[C@H](Br)CNC(=O)c1cc(Br)c(Br)s1 324636779 VXLLPAHNNVNXLI-MRVPVSSYSA-N 448.018 4.813 50 10 IJGE ClCc1cc(Br)c(OCCOC2CCOCC2)c(Br)c1 701318268 KSWJVKLPQQHCEA-UHFFFAOYSA-N 428.548 4.525 50 10 IJGE COc1cc(C=NNC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)cc(OC)c1 1084121516 NMCPMNWIDCDLID-UHFFFAOYSA-N 432.520 4.559 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2cc(Cl)ccc2C)cc(Br)c1OC 1084337956 BJRFSWDDXXJJBF-MLPAPPSSSA-N 435.705 4.974 50 10 IJGE O=C(NN=Cc1ccc(Br)cc1)c1ccc(NC(=O)C2CCCCC2)cc1 1084477436 QUFKCFCURCFTDV-UHFFFAOYSA-N 428.330 4.732 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@H](COC(=N)O)Cc2ccccc2)c(C)n1C1CCCCC1 1469026290 UKWYHRHXWLORBB-DWFNGTSHSA-N 448.567 4.754 50 10 IJGE C=CCN(CC=C)C(=O)c1ccc(NC(=O)NNc2cc(Br)ccc2F)cc1 1622964813 RBYXZGMBKNUIBD-UHFFFAOYSA-N 447.308 4.551 50 10 IJGE C/C(=C/C(=O)NNc1ccc([N+](=O)[O-])cc1Br)c1cccc(C(F)(F)F)c1 1634722654 LUBPHWMRXLTJHA-YFHOEESVSA-N 444.207 4.923 50 10 IJGE CC(=O)c1ccc(Br)c(NC(=O)NNc2ccc(OC(F)(F)F)cc2)c1 1672622454 YGQJCAIITOSZPV-UHFFFAOYSA-N 432.196 4.699 50 10 IJGE CCOc1cc(C=NNC(=O)COc2ccc(C(C)C)c(C)c2)cc(Br)c1O 1772753857 LJZYYHSSTBPEFH-UHFFFAOYSA-N 449.345 4.514 50 10 IJGE CCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccc(O)cc1)C(C#N)=C(N)O2 1865684826 ZLUIZMFWFVOFGA-GOSISDBHSA-N 427.291 4.665 50 10 IJGE CCCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(OC)cc2)cc1 1865690107 IUYSXWKXTBULEW-XMMPIXPASA-N 444.535 4.977 50 10 IJGE CCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@H]2c1ccccc1OC(C)C 1865705285 QLCKBPXTYJYTCI-OAQYLSRUSA-N 430.508 4.584 50 10 IJGE COc1cccc(-c2nc(Nc3ccc(SC#N)cc3)cc(N3CCC[C@@H](CO)C3)n2)c1 1868505852 LRHLXMCZXXYXQI-QGZVFWFLSA-N 447.564 4.678 50 10 IJGE C[C@H]([C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)C1)[C@H](CBr)NC(=O)OC(C)(C)C 1881538924 FOAUZGZZQFOFMK-TUVASFSCSA-N 435.403 4.604 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)CC1(NC(=O)OC(C)(C)C)CCCCC1 1890316573 KXGDCRVDPNCOOA-CQSZACIVSA-N 435.403 4.892 50 10 IJGE C[C@@]1([C@H](Br)c2cc(I)cc3c2OCC3)CCCCO1 1908094169 JGOQHDFURWZVCX-CABCVRRESA-N 437.115 4.621 50 10 IJGE CCC1CC(O[C@](C)(CI)CN(CC)C(=O)OC(C)(C)C)C1 1932714225 NQZNQIJZKIKDIZ-MQBCKMQZSA-N 425.351 4.642 50 10 IJGE C[C@H](CCCBr)NC(=O)c1csc(Br)c1Br 1937736942 BVOZJUROHYUGDU-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)c1ccc(CBr)c(Br)c1 2020228692 PUPFTUNDNDXUKB-HOMQSWHASA-N 425.990 4.954 50 10 IJGE C[C@@H]1[C@H]([C@@H](Br)c2cc(I)cc3c2OCC3)C1(F)F 2036071422 MXOHZRFKGVLELC-PFZYVWIYSA-N 429.042 4.563 50 10 IJGE CCCN1C[C@H](Cc2ccc(Br)cc2Br)[C@@H](Br)C1 2039263711 YFLTUZGHIJHPMJ-FZMZJTMJSA-N 440.017 4.859 50 10 IJGE C[C@](CCl)(NC(=O)c1scc(Br)c1Br)C(F)(F)F 2043174592 RFTQEIUKHZCUIM-MRVPVSSYSA-N 429.483 4.563 50 10 IJGE CC(C)[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](CC(F)(F)F)C1 2055946993 CWYOJNLLQUEIIH-KBPBESRZSA-N 431.337 4.527 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2[C@]12C[C@@H]1CN(Cc1ccccc1)C2 2099677870 CWAHLRKKAPJYJA-VLIAUNLRSA-N 434.740 4.908 50 10 IJGE C[C@@H](CCCCCI)NCCOc1cccc(Br)c1 2117889540 WDKQCZDRGULCFZ-ZDUSSCGKSA-N 440.163 4.801 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H]1Cn1c(CCCl)nc2cncc(Br)c21 2151793941 TUUMCCUJGAMVNK-RDJZCZTQSA-N 447.808 4.743 50 10 IJGE CO[C@@H]1CC(Oc2c(CBr)ccc(Br)c2Cl)C[C@H]1OC 2166419623 QRACKNOSUAEKPP-VXGBXAGGSA-N 428.548 4.569 50 10 IJGE COc1cc(Br)c(F)cc1Oc1ncc(Br)c(CCl)n1 2207479951 FLBLMFQTMPMVHM-UHFFFAOYSA-N 426.467 4.680 50 10 IJGE COc1ccc([C@@H](Br)c2sccc2OC)cc1I 2257367508 BKHIKTXCRJWQNW-GFCCVEGCSA-N 439.112 4.854 50 10 IJGE O=C(CCCCl)Nc1ccc(N2CCN(C(=O)C=Cc3ccccc3)CC2)c(Cl)c1 2296474489 XOHNEVMFFGBPNI-UHFFFAOYSA-N 446.378 4.660 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1OCc1ccccc1 2297551581 SKLNWLPZKMIWJH-UHFFFAOYSA-N 429.432 4.728 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Br)Cc1ccc(F)cc1 2316702243 XEEMTOHIOFKUHR-VIFPVBQESA-N 440.936 4.763 50 10 IJGE ClCc1ccnc(OCc2ccc(I)c(Br)c2)c1 2325380633 FVVDJSORIQWIIZ-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)C(C#N)=Cc1ccc(F)cc1 2329639033 QRITYFCZFOMEHF-UHFFFAOYSA-N 445.450 4.641 50 10 IJGE CC(C)c1ncccc1CO[C@]1(CBr)CCCN(C(=O)OC(C)(C)C)C1 2342167969 XNIRODHBHWXVIM-FQEVSTJZSA-N 427.383 4.886 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cccc(OC(F)(F)F)c1 2369430399 CHFULHDHORXPPH-INIZCTEOSA-N 446.263 4.685 50 10 IJGE CC(C)COc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2I)cc1 33410108 YPSUSHNMAYMHSV-WJDWOHSUSA-N 446.288 4.872 50 10 IJGE COc1cc(/C=N\NC(=O)CC[C@@H](O)c2ccccc2)ccc1OCc1ccc(C)cc1 58889684 UEZYKXUSOLAUGK-MFSPXNBESA-N 432.520 4.547 50 10 IJGE C=CCOc1ccc(/C=N/NC(=O)c2cc3cc(Br)ccc3o2)cc1OC 59305264 AKNNOUWVBPWPIV-WSDLNYQXSA-N 429.270 4.533 50 10 IJGE CS[C@H](C)CCn1c(CCCl)nc2cc(I)c(F)cc21 131091240 WRZBBVQAVXKILL-SECBINFHSA-N 426.726 4.703 50 10 IJGE Cc1cc(I)ccc1NC(=O)/C(C#N)=C\Nc1ccccc1Cl 217253685 TUVDSHLXILFNQS-BENRWUELSA-N 437.668 4.711 50 10 IJGE CC(C)C[C@@H](Br)CNC(=O)c1cc(Br)c(Br)s1 226263030 GPNNAKPUHDQXDB-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE COc1ccc(-c2n[nH]c(C(=O)NN=C/C(Br)=C\c3ccccc3)c2C)cc1 254740403 TYAOVDKJGZQKHD-ZBGXONSYSA-N 439.313 4.545 50 10 IJGE CC(=NNC(=O)CCCOc1ccc(Cl)cc1C)c1cccc(NC(=O)C2CC2)c1 254821556 VCXQPRHMIYUWPC-UHFFFAOYSA-N 427.932 4.696 50 10 IJGE CC[C@@H]1CCCC[C@@H]1O[C@](C)(CI)CNC(=O)OC(C)(C)C 299979652 LGSLTZSJOZMFRC-JKIFEVAISA-N 425.351 4.690 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CCC(F)(F)[C@H](CCl)C1 403995302 KQRCMBHCQLWTJI-SECBINFHSA-N 431.502 4.548 50 10 IJGE FC(F)(F)c1ccc(Br)c(I)c1CBr 575693888 CQAUVOGPMCWFQY-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE CC(C)S(=O)(=O)CCC[C@@H](CBr)Cc1ccc(Br)cc1 696943420 FZJXLWVOUVOIEK-CQSZACIVSA-N 426.214 4.606 50 10 IJGE C=CCSCCNC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Br)cc2)c1C 1584672866 DBQSAQLTOQNBSL-AQTBWJFISA-N 444.398 4.799 50 10 IJGE Cc1cc(OCC(=O)NN=Cc2ccc(Cl)cc2)c(Br)c(C)c1Cl 1772756522 LAIVMZGNRWOQQZ-UHFFFAOYSA-N 430.129 4.902 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccc(Cl)cc2)[C@@H]1c1ccc(F)cc1 1865708419 WNOKXFCFIQOGMD-OAHLLOKOSA-N 434.780 4.902 50 10 IJGE C[C@@H]1OCC[C@@]1(CBr)Cc1cccc(Br)c1Br 1943886833 YGOZOZVKUJKNBF-ZANVPECISA-N 426.974 4.944 50 10 IJGE Cc1cc(S(=O)(=O)N(Cc2ccccc2)CC(F)(F)F)sc1CBr 2009640720 VXMSPPLTPTYLOT-UHFFFAOYSA-N 442.322 4.705 50 10 IJGE C[C@@H](Br)CN(Cc1ccc(I)c(Cl)c1)C1CC1 2026567471 SDSCJWKUICPQSU-SECBINFHSA-N 428.539 4.692 50 10 IJGE Brc1ccc(CN2C[C@@H]3CC[C@H](Br)[C@H]3C2)c(Br)c1 2031402841 LVAIOBHNIRAOHB-XDTLVQLUSA-N 438.001 4.817 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(CC2(CBr)CCCC2)CCC1(F)F 2044697915 XSRBTJMZYUFMNE-CQSZACIVSA-N 425.358 4.566 50 10 IJGE FC(F)(F)c1c(Br)cc(CBr)cc1I 2054876691 HLYDKPUTNFYPGQ-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE C[C@@]12CN(Cc3ccc(I)c(Cl)c3)C[C@@]1(CBr)C2 2086651999 MJTNYODVDNDEOL-KGLIPLIRSA-N 440.550 4.552 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2C1[C@H]2CN(Cc3ccccc3)C[C@H]12 2096805020 ZVJRBCQFGMUSHB-GJZGRUSLSA-N 431.765 4.544 50 10 IJGE FC1(F)CCC2(CC1)[C@H](Br)C[C@H]2OCCOCCOCc1ccccc1 2121105083 MPFHPRHRIBNTBN-QZTJIDSGSA-N 433.333 4.968 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1[C@H]2CC[C@@H]1C[C@H](CCl)C2 2128152182 PNNBCMRTKKKXLA-AYMMMOKOSA-N 427.589 4.895 50 10 IJGE O=C1NCCOc2ccc([C@@H](Br)c3cscc3OCc3ccccc3)cc21 2156306477 PALMGANXZGMCNC-HXUWFJFHSA-N 444.350 4.934 50 10 IJGE CC(C)(C)OC(=O)N1CCC(C)(C)[C@H](CNC(=O)c2ccc(CBr)cc2)C1 2162494946 OVGOHRSFTNWDNT-QGZVFWFLSA-N 439.394 4.595 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2ccc(CBr)cc2)[C@@H]1C(C)(C)C 2192487584 HBYSACTZZCLXHZ-IAGOWNOFSA-N 439.394 4.735 50 10 IJGE O=C(c1ccccc1I)N1CCCC12CCC(Br)CC2 2202247114 LVALTORYHRPOKM-UHFFFAOYSA-N 448.142 4.604 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@H]2CCS(=O)(=O)C2)c(C)c1Cl 2224317818 QZNMHPPAMIPGML-JOYOIKCWSA-N 430.589 4.590 50 10 IJGE COc1ccc([C@H](Br)C[C@@H]2CC[C@H](C)O2)cc1I 2257353800 IWANRXZLKQXHHW-ZMLRMANQSA-N 425.104 4.693 50 10 IJGE O=C(NC1CCC(CBr)CC1)c1cc(Br)c(F)cc1Cl 2285844117 ISZIKTOCKFNOQE-UHFFFAOYSA-N 427.539 4.925 50 10 IJGE C=CC[C@@H](CCl)CNCc1ccc(I)c(Br)c1 2306227453 LFEXPCSECRWSAR-NSHDSACASA-N 428.539 4.574 50 10 IJGE Clc1ccc(CN2CC3(CC(CBr)C3)C2)c(I)c1 2318524627 QPXWLACUUFJGEQ-UHFFFAOYSA-N 440.550 4.552 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)cc1[N+](=O)[O-] 2323168636 OXIZKCAUUKREEH-OAHLLOKOSA-N 434.496 4.754 50 10 IJGE Clc1cc(C[C@@]2(CBr)O[C@H]3CC[C@H]2C3)ccc1I 2327577111 IKIJVVYDHLDTNB-MJVIPROJSA-N 441.534 4.820 50 10 IJGE Clc1cc(Br)c(CN2CCC(COCCBr)CC2)s1 2345960024 RNDXYFFYNCLMFL-UHFFFAOYSA-N 431.621 4.788 50 10 IJGE CCCCOc1ccc(C(=O)N[C@@H](CCBr)COCc2ccccc2)cc1 2369432833 HTRCFNNCVNTISQ-FQEVSTJZSA-N 434.374 4.966 50 10 IJGE CC(C)C[C@@H](CBr)CN1C[C@@H](CCNC(=O)C(F)(F)F)c2ccccc21 2382184208 IQQVIXMCFWAIAM-LSDHHAIUSA-N 435.328 4.716 50 10 IJGE CC[C@H](Nc1ccc(Br)cc1)C(=O)N/N=C/c1cccc(Br)c1 1947154 UDTCPSCMAGBDNV-YODDIOPGSA-N 439.151 4.552 50 10 IJGE O=C(NNC(=O)c1ccccc1SCc1cccs1)c1ccc(Br)cc1 15627712 NZBLLNALDMDZSH-UHFFFAOYSA-N 447.379 4.878 50 10 IJGE CC[C@@H](C)/C(C)=N\NC(=O)c1cccc(S(=O)(=O)Nc2cc(Cl)ccc2Cl)c1 34847240 DUXBPCCFFRCYKO-JEHRSMSHSA-N 442.368 4.946 50 10 IJGE COc1ccc(Br)cc1/C=N\NC(=O)c1ccc2[nH]c3c(c2c1)C[C@H](C)CC3 169891188 UIJAKDXNQNWBCC-IFUVNARDSA-N 440.341 4.828 50 10 IJGE COc1cc(/C=N\NC(=O)Cc2ccc(O)cc2)ccc1OCc1ccc(C(C)(C)C)cc1 169901419 FMWMKOZEENNKSB-QRQIAZFYSA-N 446.547 4.970 50 10 IJGE O=C(N/N=C/c1c(F)cccc1Cl)c1cc(-c2ccccc2)nc(N2CCCCC2)n1 169927457 YTYVIEOSEIDOCZ-CVKSISIWSA-N 437.906 4.690 50 10 IJGE CCOC(=O)c1ccc(NC(=O)/C(C#N)=C\Nc2ccc(Cl)c(C(F)(F)F)c2)cc1 217100832 TVPHEILOLXBGMJ-QBFSEMIESA-N 437.805 4.994 50 10 IJGE CCCO[C@@H]1[C@@H](Cl)C[C@@H]1Oc1cc(Br)c(OC)cc1Br 233235385 JZYBJJGWXSOCJC-LEWSCRJBSA-N 428.548 4.774 50 10 IJGE C[C@@H](Br)C[C@H]1CCCCCN1S(=O)(=O)c1cc(Br)cs1 312503991 RAOWCHVCUHCCER-ZYHUDNBSSA-N 445.242 4.617 50 10 IJGE C[C@@H](Cl)c1nc2c(Br)cccc2n1C[C@H]1CN(Cc2ccccc2)CCO1 380403924 BZYFXZNOUCJUNH-NVXWUHKLSA-N 448.792 5.000 50 10 IJGE C[C@@H](CCCCBr)NC(=O)c1cc(Cl)ccc1I 398812143 YLLPVAIGSVTXNX-VIFPVBQESA-N 444.538 4.628 50 10 IJGE BrCc1cc(Br)c(OC[C@@H]2CCCOC2)c(Br)c1 690499771 ZVKBIKRJRPPFLW-SECBINFHSA-N 442.973 4.912 50 10 IJGE CCC[C@@H](CCBr)NC(=O)c1cc(Br)cc(Br)c1 716856254 RPZKKXVGFDYDEP-LBPRGKRZSA-N 441.989 4.895 50 10 IJGE CC(C)(C)OC(=O)c1ccc(/C=C(/C#N)C(=O)Nc2ccccc2Br)cc1 764885440 KBPRWZLDKAHADP-VBKFSLOCSA-N 427.298 4.950 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)N(C)C)c(Br)cc1OCc1cccc(F)c1 1084072820 QVBNDLJPIZXQSO-CXUHLZMHSA-N 447.304 4.561 50 10 IJGE O=C(CCCNc1ccc(Br)cc1)NN=Cc1ccc(Br)cc1 1084580380 ZQEIZSWVNIGFPE-UHFFFAOYSA-N 439.151 4.554 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(OC)cc2)c1C)c1ccc(F)cc1 1129717071 PGOZRNHSSJHAAZ-WZLQQZPBSA-N 427.479 4.640 50 10 IJGE C#CC[C@@H](NC(=O)NNC(=O)c1cc(-c2ccc(C)cc2)nc2ccccc12)c1ccccc1 1230565185 FSALWNQBINMGIP-XMMPIXPASA-N 448.526 4.919 50 10 IJGE CC(=O)N(C)c1ccc(CNS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)cc1 1622365228 HQNNWMXLORLFID-UHFFFAOYSA-N 444.447 4.805 50 10 IJGE C=CC[C@]1(C(=O)NNc2nc3ccc(Cl)cc3s2)CCCN1C(=O)OC(C)(C)C 1642296165 FYACUUAFZSNQDI-HXUWFJFHSA-N 436.965 4.739 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2cccc(Cl)c2)[C@@H]1c1ccccn1 1865700246 NTUNMIFQJJGARS-NRFANRHFSA-N 439.906 4.865 50 10 IJGE CCCc1nn(CC)c2c1[C@H](c1ccc(OCc3ccccc3C)cc1)C(C#N)=C(N)O2 1865702734 CYBHVPTVLLYSIW-HSZRJFAPSA-N 428.536 4.961 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@@H](c1ccccc1C(=O)O)C(C#N)=C(N)O2 1865703773 FKISULKPDYVDOF-QFIPXVFZSA-N 436.471 4.504 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)c3ccc4c(c3)C(=O)N(C(C)C)C4=O)n2)cc1 1872746172 VWAMUUHPYRRBDI-VZCXRCSSSA-N 445.500 4.773 50 10 IJGE Cc1ccc(S(=O)(=O)N(Cc2ccccc2)C[C@@H](C)Br)c2cccnc12 1914640018 WQEIZGFXDCXUMW-MRXNPFEDSA-N 433.371 4.518 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1ncc(Cl)cc1Br 1985346883 JKUGQBKQNNCHTJ-UHFFFAOYSA-N 442.832 4.816 50 10 IJGE C[C@H]1CC[C@@](CCl)(Nc2ncc(I)cc2Br)C1 2018683096 MTEZTWIHIGVGFS-QPUJVOFHSA-N 429.527 4.658 50 10 IJGE CC(C)[C@@H](Br)[C@H](C)NC(=O)c1ccc(Br)cc1Br 2041305812 ASCMVHWEQBLZAJ-QPUJVOFHSA-N 441.989 4.749 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1CN(C[C@H](Br)C(F)(F)F)C1CC1 2044702028 XTIZRVSXWYNWLK-KGLIPLIRSA-N 429.321 4.566 50 10 IJGE CC1(C)C[C@@H](Cl)CCN(c2ncc(I)cc2Br)C1 2069530644 YCWGVIZHPXEQQC-VIFPVBQESA-N 443.554 4.683 50 10 IJGE Cc1c(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)ccnc1CBr 2140705968 FBFFXBXWVLFCON-SFHVURJKSA-N 428.296 4.538 50 10 IJGE O=C(c1cc(Br)ccc1Cl)N1CC[C@H](CBr)C(F)(F)C1 2146374385 BWIVKBLGFUEHCY-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE CC1(C)CCN(C(=O)c2ccc(I)c(Cl)c2)C[C@H]1CCl 2148664574 BOYUTVMPXHZAPT-LLVKDONJSA-N 426.125 4.672 50 10 IJGE O=C(c1c(Br)cccc1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Cl)C2 2190688641 XUCAGVSYORYBCE-LXOIKGMDSA-N 425.523 4.534 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)c2ccccc21 2196912921 BFOUODMDMMTSQO-UXLLHSPISA-N 437.378 4.547 50 10 IJGE COc1cc(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)ccc1CBr 2204559499 PRSPMYNNOSXZPC-FPOVZHCZSA-N 429.402 4.939 50 10 IJGE BrCCc1sc(Br)c(Br)c1Br 2208974933 YLRULFSLTCSEOU-UHFFFAOYSA-N 427.781 4.973 50 10 IJGE CC(C)(C)[C@H]1C[C@H](S(=O)(=O)N(Cc2ccccc2)[C@@H](CBr)C2CC2)C1 2223683010 GBIYCVVYSOXATC-FHWLQOOXSA-N 428.436 4.817 50 10 IJGE O=C(Nc1ccc(I)cc1)O[C@H]1CCCC[C@H]1CBr 2227209274 MJYKZENZZQLPJX-GWCFXTLKSA-N 438.103 4.793 50 10 IJGE Cc1sc(C(=O)NC[C@@]2(CBr)C[C@H]2C(F)(F)F)cc1Br 2234474718 MMCTYTJYRIYZLE-KOLCDFICSA-N 435.103 4.512 50 10 IJGE CC1CC(CBr)(CN2CCC([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)C1 2265313274 GBDDBYIXLHADIP-NCYVPVAZSA-N 429.443 4.767 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(OC[C@H]2CC(F)(F)C23CCC3)C1 2266115899 WOZKIRJBUGFLMY-PBHICJAKSA-N 438.353 4.993 50 10 IJGE CC1(C)C[C@@H](Br)CN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285847321 ZPMUYOJTOAONFA-MRVPVSSYSA-N 427.539 4.877 50 10 IJGE CC1([C@@H](CBr)NCc2ccc(Cl)c(I)c2)CC1 2300240517 NBBSBJFCBVFSIM-GFCCVEGCSA-N 428.539 4.598 50 10 IJGE C[C@H]1[C@@H](CBr)CCN1Cc1ccc(Cl)cc1I 2302335129 BBRBLKRDNHHULB-VHSXEESVSA-N 428.539 4.550 50 10 IJGE C[C@H](Cl)[C@@H]1CCN(Cc2ccc(I)c(Br)c2)C1 2306221848 MQZYPVMYADIOQN-GXSJLCMTSA-N 428.539 4.503 50 10 IJGE C[C@H](Br)CC1C[C@@H]2CC[C@H](C1)N2C[C@H]1CC1(Br)Br 2318712591 PFIKSWVGGACBKN-AAGQIVHDSA-N 444.049 4.909 50 10 IJGE CCc1ccc(-c2csc(C(C#N)=C(O)CCN3C(=O)c4ccccc4C3=O)n2)cc1 2331245581 ZCQUMOMMVCKXOI-UHFFFAOYSA-N 429.501 4.851 50 10 IJGE FC(F)(CI)C(F)(F)CNCc1cc(Cl)cc(Cl)c1 2336543572 LHMPSVQAUQQPQB-UHFFFAOYSA-N 430.010 4.789 50 10 IJGE Cn1cc(I)c(C[C@@H]2CCCc3ccccc3[C@@H]2Br)n1 2367611720 RDPKIVBQZSTVBR-BLLLJJGKSA-N 445.142 4.656 50 10 IJGE CCN(c1cccc(C)c1)c1ncnc(NNC(=O)c2ccc(Cl)cc2Cl)c1N 40661883 XRYMNTSHVGTIOQ-UHFFFAOYSA-N 431.327 4.589 50 10 IJGE Cc1cccc2sc(Nc3ncnc(NNC(=O)c4cccc5ccccc45)c3N)nc12 40783479 WFSYDKYLFZOEMD-UHFFFAOYSA-N 441.520 4.631 50 10 IJGE O=C(Cc1ccc(F)cc1)N/N=C/c1ccccc1OCc1ccc(Br)cc1 59447283 MMFCNJXVMCCWOS-AFUMVMLFSA-N 441.300 4.860 50 10 IJGE CCOc1ccc(/C=C2\C(=O)N([C@@H](C)c3ccccc3)C(=O)C(C#N)=C2C)cc1OCC 214343040 PWFNEKQMDYEJSF-SBGXLDQMSA-N 430.504 4.837 50 10 IJGE CCOc1ccc(C=NNC(=O)CSc2nc3ccccc3n2Cc2ccccc2)cc1 254625919 XAIFLLFBUGFBTA-UHFFFAOYSA-N 444.560 4.726 50 10 IJGE O=S(=O)(Nc1c(Br)cccc1Br)c1ccccc1CCl 312678052 YWENRHKKETVMHX-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE CC[C@H](Cl)[C@@H](CC)NC(=O)c1cc(Br)ccc1I 313089146 FTBGDIYTZNVNMR-CMPLNLGQSA-N 444.538 4.580 50 10 IJGE COC[C@@H](O[C@@H](CI)c1ccccc1Br)C(C)C 404098854 CETVZCLLSJIIMQ-UONOGXRCSA-N 427.120 4.613 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@@H]1C(C)(C)[C@@]21CC[C@@](C)(CI)O1 686237126 OGJSKSYHNJEXQC-TUFGIGEDSA-N 449.373 4.785 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2CCC1SCCS1 693830603 NOJBRDRVCXRESP-UHFFFAOYSA-N 442.750 4.715 50 10 IJGE Clc1cc(Br)c(OCCCO[C@H]2CCOC2)c(CBr)c1 708073145 LFMKPSJONVPKDI-LBPRGKRZSA-N 428.548 4.572 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 741285295 YXMARVWHBPOSFY-VXGBXAGGSA-N 449.307 4.759 50 10 IJGE Cc1cc(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)ccc1NC(=O)OC(C)(C)C 772460069 ZOWDINSNWWRZDM-UHFFFAOYSA-N 448.527 4.568 50 10 IJGE Cc1cc(Br)cc(C)c1NC(=O)CCCOC(=O)/C(C#N)=C\c1ccccc1 785350888 KACPYVSLEOUEBZ-AQTBWJFISA-N 441.325 4.935 50 10 IJGE Cc1cc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)ccc1OC1CCOCC1 799400507 HVKPYWMSPJTDJR-UHFFFAOYSA-N 434.418 4.592 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(CC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1 799749586 VZCICZCMJXHSKR-UHFFFAOYSA-N 434.418 4.610 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCCC(F)(F)C2)c(-c2ccccc2)n1 816789146 HTSXJYQMZPPGEL-JZQBQCRLSA-N 437.494 4.703 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1cccs1 1628603910 PVDPKVHIRNHZOM-SQFISAMPSA-N 426.925 4.845 50 10 IJGE COc1cc(C=NNC(=O)COc2ccc(C(C)C)cc2)ccc1OCCc1ccccc1 1772753977 MVZQXPRJQKJTTL-UHFFFAOYSA-N 446.547 4.969 50 10 IJGE CCOOP(=O)(CC1C=CC(C)(P(=O)(OOCC)OOCC)C=C1)OOCC 1848435064 VBIHFDCBPQRKJF-UHFFFAOYSA-N 444.354 4.746 50 10 IJGE CCCc1nn(Cc2cccc(F)c2)c2c1[C@@H](c1cccc(OCC)c1)C(C#N)=C(N)O2 1865689463 AAULDSATMTUSJD-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3-c2ccc(Br)cc2)cc1 1865707154 PFOHVYZAQCTQJI-FQEVSTJZSA-N 449.352 4.978 50 10 IJGE COc1ccc(-c2ccc(C(=O)N/N=C(/C)c3ccc4c(c3)CCC4)c(C)n2)cc1OC 1865763323 GGGCNGKLUDJQEJ-NTFVMDSBSA-N 429.520 4.717 50 10 IJGE CN(C)c1ccc([C@H](CNC(=O)/C(C#N)=C/c2cccc(Cl)c2)N2CCCCC2)cc1 1866129923 SDUZLRZHYBTNMT-VOZFUJEASA-N 436.987 4.656 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)OC3CCCCC3)cc2)cc1OC 1866130480 WZZSZLGICNCSIY-XMHGGMMESA-N 434.492 4.739 50 10 IJGE Cc1cc(F)c(C[C@H](CBr)NC(=O)OC(C)(C)C)c(Br)c1 1885093234 LOKFOUZOGVVXAQ-SNVBAGLBSA-N 425.136 4.727 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)CC1(N(C)C(=O)OC(C)(C)C)CCCCC1 1887833594 VNEJQFMHAAXHKU-WKILWMFISA-N 431.415 4.578 50 10 IJGE Clc1ccc(I)c(CN2CC[C@H](Br)C23CCC3)c1 1914397662 BELGZSDEBNVFRR-ZDUSSCGKSA-N 440.550 4.837 50 10 IJGE C[C@@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(Br)c1 1914662940 BQJJHQJYIHOMAN-GFCCVEGCSA-N 437.186 4.921 50 10 IJGE CC(C)(CCBr)NC(=O)c1c(Br)cccc1Br 1945333365 OZYSEKKDCQMOES-UHFFFAOYSA-N 427.962 4.505 50 10 IJGE C[C@H]1[C@@H](CBr)CCN1Cc1c(Br)cccc1Br 1945333748 UQJFVAZRDIISJG-VHSXEESVSA-N 425.990 4.817 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)[C@H]1CCN(C(=O)OCc2ccccc2)C1 1999500157 DICABYZBXSONSH-RTWAWAEBSA-N 431.374 4.508 50 10 IJGE BrC[C@H]1CN(Cc2cc(Br)ccc2Br)CCS1 2006498664 FQNAXLVMPXPJHL-NSHDSACASA-N 444.030 4.524 50 10 IJGE Fc1ccc(C[C@H](Br)c2cc(I)sn2)c(F)c1 2007643919 LZNQNDDMFXRSMQ-QMMMGPOBSA-N 430.055 4.705 50 10 IJGE CC[C@H](C[C@@H](C)Br)NC(=O)c1cccc(Br)c1Br 2031478974 UUQPBYDPJBXGJL-RKDXNWHRSA-N 441.989 4.894 50 10 IJGE Cc1c(Cl)cc(C(=O)NCCCCCI)cc1Br 2048496022 FKYARMJERXCWCW-UHFFFAOYSA-N 444.538 4.746 50 10 IJGE O=C(CBr)c1cc(Br)c(Br)cc1OC(F)(F)F 2054922560 ZYBWCNSEOGMARS-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE CCC(CC)(CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1CC(F)F 2063525473 VSEAQKRXYRPDQN-AWEZNQCLSA-N 427.374 4.764 50 10 IJGE CC(C)(C)OC(=O)N1CC[S@@](=O)(=NC[C@@H](CBr)C(C)(C)C)C(C)(C)C1 2069025073 HPHCXFANCNGRBN-PWECECGKSA-N 439.460 4.541 50 10 IJGE ClC[C@H](Nc1ncc(I)cc1Br)[C@@H]1CC=CCC1 2075336709 XQKUXUUYORZPKD-SKDRFNHKSA-N 441.538 4.824 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)[C@H](Br)C2CCCC2)n1 2082962917 SGBYXMVSNYXTQT-ZWNOBZJWSA-N 432.384 4.621 50 10 IJGE Brc1ccc([C@@H](CI)OC[C@@H]2C3C[C@@H]4C2[C@@H]4C3)cc1 2134517759 KAVAGYWYUXTZBU-ZFCFLOGKSA-N 433.127 4.844 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@H](Br)c2cc(Br)c(Cl)s2)C1 2137224884 DZZKFFAPCLSRAO-KOLSJAJHSA-N 448.629 4.815 50 10 IJGE C[C@@]1(CCl)CC(F)(F)CN1C(=O)c1c(Br)cccc1Br 2159052105 NNKKKSSOMCJXKD-LBPRGKRZSA-N 431.502 4.690 50 10 IJGE CO[C@@H]1CCN(CC2(CBr)CCCCCC2)[C@@H](CNC(=O)OC(C)(C)C)C1 2163063235 PCPWZBFFJIKLLS-QZTJIDSGSA-N 447.458 4.726 50 10 IJGE C[C@@H](Br)CCCc1cn(-c2c(Cl)cc(F)cc2Br)nn1 2189284545 LLNRWKOUZHJYFD-MRVPVSSYSA-N 425.527 4.928 50 10 IJGE Cc1cc(C(=O)N2[C@H](CBr)CCC23CCC3)ccc1I 2207103882 DPZHDWIWMYVAJX-ZDUSSCGKSA-N 448.142 4.522 50 10 IJGE Cc1sc(C(=O)N(C)C2(CBr)CCSCC2)cc1Br 2226078350 OQMKUUDFFOFQLU-UHFFFAOYSA-N 427.227 4.552 50 10 IJGE CCCN(CCC)c1ccc(C=C(C#N)C(=O)NCCc2ccc(OC)c(OC)c2)cc1 2295672427 XNTASPVBCZCBAF-UHFFFAOYSA-N 435.568 4.596 50 10 IJGE COC(=O)c1ccc(C(=O)OC)c(NC=C(C#N)c2nc(-c3ccc(C)cc3)cs2)c1 2295937327 WVADTOIOIWAMJD-UHFFFAOYSA-N 433.489 4.668 50 10 IJGE COc1ccccc1NC(=O)C(C#N)=Cc1ccc(OC(=O)c2cccs2)c(OC)c1 2297382166 NLYVDVQKVLOBQE-UHFFFAOYSA-N 434.473 4.530 50 10 IJGE O=S1(=O)CC[C@H]([C@@H](Cl)c2cc(Br)ccc2OCc2ccccc2)C1 2299504316 MHRHHYCYUGFZEQ-KBXCAEBGSA-N 429.763 4.743 50 10 IJGE CN(CC(C)(C)CI)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 2306817297 YIINVYAIIULHRB-INIZCTEOSA-N 446.373 4.645 50 10 IJGE CCCCCOC(=O)c1ccc(NC(=O)C(C#N)=Cc2ccc(OCC)c(OC)c2)cc1 2314729210 YXRHQIXHDJVAAC-UHFFFAOYSA-N 436.508 4.987 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](OCCCCC(F)(F)C(F)(F)F)[C@H](Br)C1 2315804621 UHHRNFPXWVVPKA-MNOVXSKESA-N 440.247 4.754 50 10 IJGE CC1(C)CC(CBr)(Cn2cc(Br)cc(Br)c2=O)C1 2321758733 JBXMXAJRZHQBKT-UHFFFAOYSA-N 441.989 4.575 50 10 IJGE Fc1cc(Cl)c(Br)c(Cl)c1[C@H](Br)C1COCCOC1 2335298479 FMHRQAIZSLYUSQ-SNVBAGLBSA-N 436.930 4.994 50 10 IJGE COc1ccc([C@@H](Cl)c2c(Br)c(Br)nn2C)cc1Cl 2338722337 LUWMLZQEMUZQIM-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE Cc1c(Br)c(COc2cc(F)c(CBr)c(Cl)c2)nn1C 2379784728 XLNWJZVUWYBTFP-UHFFFAOYSA-N 426.511 4.757 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)NC2CCCCC2)ccc1OCc1ccc([N+](=O)[O-])cc1 862404 BVSAYBPPKARVQN-ZHZULCJRSA-N 449.507 4.928 50 10 IJGE N#C/C(=C\c1cccn1-c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(C(F)(F)F)c1 35516820 ALNFGVWLZGIVGX-SDNWHVSQSA-N 426.354 4.950 50 10 IJGE CCOC(=O)c1sc(NC(=O)N/N=C/c2ccc(C(C)C)cc2)c(C(=O)OCC)c1C 40840267 PUVONQMEZHGAJN-FSJBWODESA-N 445.541 4.689 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2ccc(-c3ccc(Cl)cc3)o2)cc1 58893115 GVAREHIOBZUPLO-QEMKNDADSA-N 426.900 4.963 50 10 IJGE COc1ccc(F)cc1[C@@H](Br)c1csc(I)c1 123461955 BTLMDADNHNFOFT-LBPRGKRZSA-N 427.076 4.985 50 10 IJGE CCOc1cc(C=NNC(=O)c2cccnc2)ccc1OC(=O)c1cccc2ccccc12 254291294 XGZVHRINYPEOQO-UHFFFAOYSA-N 439.471 4.617 50 10 IJGE CC[C@H](Br)[C@@H](CC)NC(=O)c1cc(Cl)ccc1I 313086926 PNDWTOJUKHSSAQ-CMPLNLGQSA-N 444.538 4.627 50 10 IJGE CC[C@@H](Br)[C@@H](CC)NC(=O)c1cc(Br)c(Br)s1 313102112 FYQLCUGIVXHQRE-HTRCEHHLSA-N 448.018 4.955 50 10 IJGE Oc1cc(Cl)ccc1[C@@H]1CN(Cc2ccccc2)C[C@@H]1CI 382677832 ZYZQZCJQPCHLQR-WMLDXEAASA-N 427.713 4.696 50 10 IJGE CC[C@H](OC1(CI)CCN(C(=O)OC(C)(C)C)CC1)C1CCC1 719656292 HDWJBZWVBDCICQ-HNNXBMFYSA-N 437.362 4.786 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OCc2ccc(Cl)cc2F)c(-c2ccccc2)n1 781125594 CVSKWCLCZBVPIC-WQRHYEAKSA-N 434.858 4.907 50 10 IJGE CC1(C)[C@H]2CC[C@@]1(C)[C@@H](Oc1ccccc1C=NNC(=O)c1nnc(O)c3ccccc13)C2 794470228 FJSNPTYFFHJXEL-CWVVSJDFSA-N 444.535 4.693 50 10 IJGE CN(C(=O)c1cccc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1)c1ccccc1 799747559 DNLGFCZLRYRFKW-UHFFFAOYSA-N 438.409 4.611 50 10 IJGE CCOC(=O)[C@](C)(CC)n1nc([C@@H](C)O[Si](C)(C)C)nc1[C@H](C)O[Si](C)(C)C 1078341120 OEWOHBKIZHWRIV-VCBZYWHSSA-N 429.710 4.791 50 10 IJGE Cc1cccc(-n2c(C)cc(C=NNC(=O)CSCc3ccc([N+](=O)[O-])cc3)c2C)c1 1084464939 AFPPLOVGMIVVDP-UHFFFAOYSA-N 436.537 4.694 50 10 IJGE CC(=O)CCc1ccc(OCCC(=O)NNc2ccc(Cl)c(C(F)(F)F)c2)cc1 1632195541 WXKRSRSYECFSIN-UHFFFAOYSA-N 428.838 4.793 50 10 IJGE C#CCCCC(=O)NNC(=O)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1 1668125033 NJXKCHWLTPNRRC-UHFFFAOYSA-N 440.862 4.776 50 10 IJGE Cc1ccc(OCC(=O)NNC(=O)c2ccc(SCC(C)C)cc2)c(C(C)(C)C)c1 1865757947 BTUDUKJUGUOPNZ-UHFFFAOYSA-N 428.598 4.881 50 10 IJGE COc1cc(OC)c(OC)cc1/C=C(\C#N)c1nc(-c2ccc3c(c2)OCCO3)cs1 1872792111 FKRKDILADSYHTO-LZYBPNLTSA-N 436.489 4.671 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCC2(CCC2)N(C(=O)OC(C)(C)C)C1 1882087391 JJLGRYLEHNPUCR-LSDHHAIUSA-N 447.414 4.844 50 10 IJGE CN(C[C@@H](CBr)CC1CC1)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 1890234028 MRRNOJYCAPOIPR-MJGOQNOKSA-N 425.411 4.995 50 10 IJGE CCCn1nc(Br)nc1N(Cc1ccccc1)[C@@H](CBr)C1CC1 1905466415 MVDMAUDGXCFJDZ-HNNXBMFYSA-N 442.199 4.631 50 10 IJGE O=C(Cc1ccc(Br)cc1F)N(CCCBr)Cc1ccccc1 1914653593 WCSKVJKBEBKPKP-UHFFFAOYSA-N 443.154 4.945 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCOc2ccc(Br)cc21 1975074182 WUGRLALXPVPEJQ-YPMHNXCESA-N 435.156 4.603 50 10 IJGE CC(C)(C)CC1CC(O[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2I)C1 1987833961 OLUPIGLTQPSQMC-PFSRBDOWSA-N 437.362 4.641 50 10 IJGE CC[C@@H](C)[C@@H](Br)CNC(=O)c1cccc(Br)c1Br 2031482203 PPIWXCDBGPYUPS-KCJUWKMLSA-N 441.989 4.751 50 10 IJGE O=C(N[C@@H]1CC[C@H](CBr)C1)c1cccc(Br)c1Br 2031482292 QKSDVOSGBJSLOC-DTWKUNHWSA-N 439.973 4.505 50 10 IJGE O=S(=O)(c1cc(Br)cc(CCl)c1F)N(Cc1ccccc1)CC1CC1 2034775778 FMCRFPCVFJPDSH-UHFFFAOYSA-N 446.769 4.928 50 10 IJGE CC(C)(CBr)CN(C1CC1)[C@H](CCNC(=O)OC(C)(C)C)C(F)(F)F 2044704449 CSTJFTMDMOFYCD-CYBMUJFWSA-N 431.337 4.718 50 10 IJGE Cn1nc(C[C@@H](CBr)c2cccc(Br)c2)cc1Br 2049248426 DSLPUHVWJGOYOE-JTQLQIEISA-N 436.973 4.666 50 10 IJGE O=C(CBr)c1cc(Br)c(OC(F)(F)F)c(Br)c1 2054920034 WOOSKRHTQHDQMF-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE FC(F)(F)c1c(Br)c(CBr)nn1-c1ccncc1C1CC1 2078912530 QZWSXIMBHWMDPO-UHFFFAOYSA-N 425.046 4.821 50 10 IJGE CC(C)(C)OC(=O)N1CC2(CC=CCN2CC2(CBr)CCCCCC2)C1 2106783031 WFDAGZROAGDDBP-UHFFFAOYSA-N 427.427 4.973 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C(F)(F)F)N(C[C@@H](CBr)C(C)(C)C)CC1 2106783802 CRWJKJYFUVDHNI-KGLIPLIRSA-N 445.364 4.917 50 10 IJGE Cc1cc(Br)c(F)c([C@@H](Br)c2cc(S(C)(=O)=O)cs2)c1 2149492258 HBEJYJKOXQCNOP-GFCCVEGCSA-N 442.169 4.846 50 10 IJGE Cc1cnc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)c(CBr)c1 2159669435 DASMPWXNPCIQHW-NMIHRBCNSA-N 426.402 4.632 50 10 IJGE CC(C)(C)[C@H]1C[C@H](CCl)CN(C(=O)c2sccc2I)C1 2165006876 IOEPOSPCNLXFDG-MNOVXSKESA-N 425.763 4.716 50 10 IJGE Fc1ccc(I)cc1[C@@H](Br)c1ccc2c(c1)OCCO2 2169666991 CSVKTFSTSINHTJ-HNNXBMFYSA-N 449.057 4.686 50 10 IJGE CCOCc1cc(Br)c([C@H](Br)c2cnc(Cl)n2C)s1 2224795746 DCCFHNUUSCISIQ-SNVBAGLBSA-N 428.577 4.918 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(OC2C3CC4CC(C3)CC2C4)CC1 2230452025 VDCNGUQHLCHDHL-UHFFFAOYSA-N 428.411 4.992 50 10 IJGE COc1ccc([C@@H](Cl)c2ccoc2Br)cc1I 2248885798 DAQUEEVOQNSTLL-LLVKDONJSA-N 427.463 4.984 50 10 IJGE COCC1([C@@H](Br)c2ccc(OC)c(I)c2)CCCC1 2269539141 DEGXGENRMBGHSG-AWEZNQCLSA-N 439.131 4.943 50 10 IJGE COc1ccc([C@H](Br)C[C@@H]2COC(C)(C)C2)cc1I 2269542347 JUQXSZFHLRKEML-CMPLNLGQSA-N 439.131 4.941 50 10 IJGE Cc1ccc(NC(=O)C(C#N)=Cc2c(Oc3cccc(C)c3)nc3ccccn3c2=O)cc1 2296542733 GNRVITGQKUVSTA-UHFFFAOYSA-N 436.471 4.649 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=C(C#N)c3nc(O)c4cc(OC)ccc4n3)o2)cc1 2314433933 XQJLOQBNMXSYKZ-UHFFFAOYSA-N 441.443 4.845 50 10 IJGE COc1cc(OCc2sccc2I)ccc1CBr 2316754160 GCLWGQLZUTULIM-UHFFFAOYSA-N 439.112 4.835 50 10 IJGE CN(CCCCCBr)C(=O)c1ccc(Cl)cc1I 2317767705 ACUBQSRNDOKGBT-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE CC[C@H](Oc1ccccc1[C@@H](C)CC)C(=O)NNC(=O)COc1ccc(C(C)C)cc1 10682454 OYAXSZSZAUYTMM-AVRDEDQJSA-N 426.557 4.707 50 10 IJGE CC[C@@H](C)c1ccccc1OCC(=O)NNC(=O)[C@@H](C)Oc1ccc(-c2ccccc2)cc1 14038547 HFGTTWQNFRFWAZ-WOJBJXKFSA-N 446.547 4.861 50 10 IJGE CCCCN1C(=O)/C(=C/Nc2ccc(Cl)cc2Cl)C(=O)N(CCCCl)C1=O 214395973 OEZLAHJASZQPJM-QBFSEMIESA-N 432.735 4.509 50 10 IJGE N#C/C(=C/NCCc1ccccc1Br)C(=O)Nc1ccccc1C(F)(F)F 217067345 MEPIHIAZIYHVRX-OWBHPGMISA-N 438.247 4.646 50 10 IJGE CCC(CC)(CBr)CNS(=O)(=O)c1ccc(Br)cc1Cl 230257029 ZYVFDGZERKCLHF-UHFFFAOYSA-N 447.620 4.582 50 10 IJGE C[C@@H]1C[C@@H](O[C@@](C)(CI)CNC(=O)OC(C)(C)C)CC(C)(C)C1 231313274 CMQDLGHMLAEVLC-LBTNJELSSA-N 439.378 4.936 50 10 IJGE COCCO[C@H]1[C@@H](Oc2cc(Cl)c(Br)cc2Cl)C[C@H]1Br 234724784 YONWPCOBPPNMRT-OXHMUOHRSA-N 448.966 4.702 50 10 IJGE O=C(Cc1cccc2ccccc12)NN=Cc1ccc(OC(=O)c2ccccc2F)cc1 254302562 JURUPCFKMJKTNI-UHFFFAOYSA-N 426.447 4.891 50 10 IJGE C[C@H]1CCc2sc(C(=O)NN=Cc3ccc(OC(F)F)cc3OC(F)F)cc2C1 254402535 AZSLCDTZYPOTBL-JTQLQIEISA-N 430.423 4.840 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1 404298885 PETWHVLGBKYHSN-CVEARBPZSA-N 436.375 4.510 50 10 IJGE CC[C@@H](Br)CCNc1ncc(C(F)(F)F)cc1I 686108342 DYMPWNBPPJLEAX-MRVPVSSYSA-N 437.041 4.681 50 10 IJGE O=C(NC1(CCCl)CCSCC1)c1cc(Br)cc(Br)c1 719664275 DCRWBUSJXWLUCT-UHFFFAOYSA-N 441.616 4.836 50 10 IJGE C/C(=C\C(=O)NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl)c1cccc(F)c1 732267291 WIASLNVPWNUDBS-JXMROGBWSA-N 431.842 4.919 50 10 IJGE Cc1ccc([C@@H](C)CNC(=O)NNC(=O)Nc2ccc(Br)cc2Cl)cc1 745833396 VMSBIBYLCKDBSZ-LBPRGKRZSA-N 439.741 4.550 50 10 IJGE C=CCN(C(=O)/C(C#N)=C/c1cc(C)n(CC(C)C)c1C)c1nc(C(=O)OCC)cs1 749129474 WXSIOKUPCSLNAZ-YBFXNURJSA-N 440.569 4.520 50 10 IJGE O=C(NN=C1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(COc2ccccc2)o1 768355263 OLAPWVRBBCUGCF-SZPZYZBQSA-N 429.520 4.771 50 10 IJGE CN(C)Cc1cnc(/C=C(\C#N)C(=O)Nc2nc(-c3ccccc3Cl)cs2)s1 794696583 HDGMASWNDKXPPY-KPKJPENVSA-N 429.958 4.527 50 10 IJGE CC(C)(C)c1noc(-c2ccccc2C(=O)NNc2ccc(C#N)cc2C(F)(F)F)n1 799749090 MRVNPJSOAAOJJD-UHFFFAOYSA-N 429.402 4.681 50 10 IJGE CC(=NNC(=O)Cc1nc(O)c2c(C)c(C)sc2n1)[C@@H]1C[C@@H]1c1ccccc1Cl 920365634 SUOAQANSJDPLPM-LSDHHAIUSA-N 428.945 4.505 50 10 IJGE C=CCOc1cc(Br)c(C=NNC(=O)c2cc3ccccc3o2)cc1OCC 1084056409 XONUOAXPEKFNBD-UHFFFAOYSA-N 443.297 4.923 50 10 IJGE COc1cc(C=NNC(=O)c2cccs2)ccc1OCc1ccc(Br)cc1 1084362678 UGRMTHQKOZNUNK-UHFFFAOYSA-N 445.338 4.862 50 10 IJGE O=C(NN=Cc1ccccc1OCc1ccccc1Cl)c1cccc(N2CCCC2=O)c1 1084494322 GRZKAPJWZGHDDP-UHFFFAOYSA-N 447.922 4.810 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1)c1ccccc1C(F)(F)F 1135740356 DEGNSMMRKOQVBQ-JQIJEIRASA-N 434.458 4.995 50 10 IJGE CCc1ccc(NNC(=O)CCSCc2nc(O)c3c4c(sc3n2)CCCC4)cc1 1468130667 NFEVIUWOMWOQLY-UHFFFAOYSA-N 442.610 4.605 50 10 IJGE Cc1cc(Nc2ccc3c(c2)CCCC3)c(C(=O)NNc2cc(F)c(F)c(F)c2)c(O)n1 1545929927 RTQSOTVHZZXVIJ-UHFFFAOYSA-N 442.441 4.892 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)COc3ccc(Cl)cc3Cl)c(C)n2)cc1 1865757384 AEVQFNSGVDLXOA-UHFFFAOYSA-N 444.318 4.512 50 10 IJGE CC(=O)N1CCc2cc(/C(C)=N/NC(=O)c3ccc(-c4ccc(Cl)cc4)nc3C)ccc21 1865762749 ATAIWDLAURRDKT-RWPZCVJISA-N 446.938 4.773 50 10 IJGE C/C(=N/NC(=O)c1ccc(-c2ccc(Cl)cc2Cl)nc1C)c1ccc(O)c(O)c1 1865763542 QIDOYYIAOXDCDE-GATIEOLUSA-N 430.291 4.929 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(OCCCOCc2ccccc2)C1 1881762288 ALZNOEGJSNKNRL-NRFANRHFSA-N 442.394 4.775 50 10 IJGE Brc1cnccc1C[C@H](Br)c1sncc1Br 1924010783 BVQDAUIPODUSCU-ZETCQYMHSA-N 426.959 4.742 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@]1(CC[C@@](C)(CI)O1)C2 1949547702 KWEFGRWYZOHEJZ-PKOBYXMFSA-N 449.373 4.931 50 10 IJGE Clc1nc(N2CC[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)sc1CBr 2003091801 ZSASBWVCFNRNOZ-CABCVRRESA-N 426.811 4.650 50 10 IJGE CC(C)[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](CC(F)(F)F)C1 2055946995 CWYOJNLLQUEIIH-UONOGXRCSA-N 431.337 4.527 50 10 IJGE CC(C)C(F)(F)[C@H](Br)c1cc(I)cc2c1OCC2 2065536901 WCIPNNRLCBTYRS-GFCCVEGCSA-N 431.058 4.953 50 10 IJGE Cl[C@@H]1C[C@@H](CNc2ncc(I)cc2Br)C12CCC2 2069527890 FLUSYVMSNDXYRF-GZMMTYOYSA-N 441.538 4.658 50 10 IJGE CCN1CCC[C@H]([C@@H](Br)c2ccc(OCc3ccccc3)cc2)S1(=O)=O 2089514913 NKTSMIVRXDFADE-UXHICEINSA-N 438.387 4.516 50 10 IJGE CCC[C@H](CBr)CN=[S@](=O)(CCNC(=O)OC(C)(C)C)c1ccccc1 2107397841 WXEDOQCPLLCNGB-DXPJPUQTSA-N 447.439 4.849 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@H]2CCCN(C[C@@H](CBr)c3ccccc3)C2)C1 2163064199 TVDKFJRHADCZIV-RBUKOAKNSA-N 437.422 4.744 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN(C(=O)[C@@H](Br)C2CCCC2)C1 2167034570 XHVPXOOVFURZGU-KURKYZTESA-N 443.426 4.578 50 10 IJGE O=C(c1ccc(I)c(Cl)c1)N(CCCl)Cc1cccs1 2171086547 DWQHQTRRMZTRCX-UHFFFAOYSA-N 440.133 4.887 50 10 IJGE CO[C@H]1CC[C@H]1COc1c(Br)cc(Br)cc1CBr 2220575496 JEQCABLWRGOZMU-UFBFGSQYSA-N 442.973 4.910 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1cc(C)c(Br)c(C)c1 2227416708 GRVOGNGSFIRSFW-ZANVPECISA-N 438.147 4.645 50 10 IJGE Cc1cnc(N(C)Cc2cccc(I)c2)c(CBr)c1 2265533467 VDNSACSVSVQLLO-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE COc1ccc(CCNC(=O)C(C#N)=Cc2cn(-c3ccccc3)nc2-c2ccccc2)cc1 2295266165 CMVLEWHVYAPXHT-UHFFFAOYSA-N 448.526 4.814 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=C(C#N)C(=O)Nc3ccc([N+](=O)[O-])cc3C)o2)cc1 2297551468 MMUWQBKGDCDBHG-UHFFFAOYSA-N 445.431 4.886 50 10 IJGE CC1(C)[C@@H](Cl)C[C@H]1OCc1cc(I)ccc1Br 2302815194 XMOREWVHGHYMKW-NWDGAFQWSA-N 429.523 4.976 50 10 IJGE CC(C)[C@H](CCCl)NCc1ccc(I)c(Br)c1 2306216009 AQEMVAFQJLHOBJ-ZDUSSCGKSA-N 430.555 4.797 50 10 IJGE C[C@H]1C[C@H](CBr)CN(Cc2ccc(Cl)c(I)c2)C1 2315550804 IRCPKPMOCHAPCA-CMPLNLGQSA-N 442.566 4.798 50 10 IJGE COc1ccc(Cl)c(CC(=O)NN=Cc2c(O)ccc3cc(Br)ccc23)c1 2323676106 PQFSBSKZOCJDJD-UHFFFAOYSA-N 447.716 4.663 50 10 IJGE CC(C)[C@H]1[C@@H](Cl)CCN1Cc1ccc(I)c(Br)c1 2325210069 VBKPYQXIKBEIDX-JSGCOSHPSA-N 442.566 4.891 50 10 IJGE CC(C)C[C@H](CBr)CN1CC[C@@H](C(F)(F)F)[C@H](NC(=O)OC(C)(C)C)C1 2353835443 SKDJTDCMEXWBFF-RBSFLKMASA-N 445.364 4.821 50 10 IJGE COc1cc(/C=C(\C#N)c2ccc(C(=O)O)cc2)ccc1OCc1cccc([N+](=O)[O-])c1 9260265 QEDGXPPUAWHJOR-RGVLZGJSSA-N 430.416 4.945 50 10 IJGE N#C/C(=C/c1cccc(OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1)c1ccccc1F 31902865 YIHFXJMNFQAXRP-PXNMLYILSA-N 433.351 4.925 50 10 IJGE Cc1ccccc1COc1ccccc1/C=N/NC(=O)CSc1nc2ccccc2[nH]1 32520589 IFRFHSCQHFXLEZ-AFUMVMLFSA-N 430.533 4.693 50 10 IJGE COc1cc(OC)c([C@@H]2C(C#N)=C(N)C(C#N)(C#N)C3=CC[C@H](C(C)(C)C)C[C@@H]32)cc1OC 35168898 XPUFJDNCDUJFAM-PBPSECFOSA-N 446.551 4.578 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4)ccc32)c1 38684355 JIDQEUQHWBETQO-DEOSSOPVSA-N 426.472 4.913 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(OC)cc4)ccc32)c1 38684837 WQKBAYBDNKWIQF-XMMPIXPASA-N 442.471 4.531 50 10 IJGE Cc1ccc(-n2nc(C)c(/C=N/NC(=O)c3ccc(Br)cc3)c2C)c(C)c1 59152436 YWZOBWLKZNENTD-FSJBWODESA-N 425.330 4.632 50 10 IJGE COc1ccc2nc(Cl)c(/C=C(/C#N)c3nc(O)c4cc(OC)c(OC)cc4n3)cc2c1 83970168 WUHDEKBBWDWUTN-AUWJEWJLSA-N 448.866 4.627 50 10 IJGE CCC(=NNC(=O)c1ccc(C(=O)NN=C(CC)c2ccccc2)cc1)c1ccccc1 252617223 KOTMUFOKBJWRRG-UHFFFAOYSA-N 426.520 4.775 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@@H](O[C@H]2C[C@H]3CC[C@@]2(C)C3(C)C)C1 303741837 PZNCMNCMCWAADV-QWHKOUAISA-N 449.373 4.641 50 10 IJGE Clc1cccc(C(CBr)(CBr)COC2CCOCC2)c1 312947287 JQPVNDPCAXUYQJ-UHFFFAOYSA-N 426.576 4.563 50 10 IJGE COC[C@H](O[C@@H](CI)c1ccc(Br)cc1)C(C)C 404107526 HOYIRFMCIZGVOU-KBPBESRZSA-N 427.120 4.613 50 10 IJGE C[C@@H]1CN(Cc2cc(Cl)ccc2I)CC[C@H]1Br 405351917 VFDPKYPAKKFNIN-BXKDBHETSA-N 428.539 4.550 50 10 IJGE CCCCN(CCCl)C(=O)c1ccc(I)c(Br)c1 721603610 MZCQSRRWDJNCTJ-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE CN(C)c1ccc(NC(=S)NNC(=O)c2csc(-c3cccc4ccccc34)n2)cc1 777983627 XOHHRGDQYXYBSW-UHFFFAOYSA-N 447.589 4.661 50 10 IJGE C#CCOCCNC(=O)Nc1cc(Br)ccc1CO[Si](C)(C)C(C)(C)C 1310784770 PRLUITDYUJZIQN-UHFFFAOYSA-N 441.442 4.742 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2ccc3oc(O)nc3c2)c(C)n1-c1ccc(Cl)cc1 1583956419 NXRPZJKPNXNGPM-WQRHYEAKSA-N 446.894 4.818 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)c1 1644011458 IDXZFCGOZPIGFU-UHFFFAOYSA-N 440.503 4.654 50 10 IJGE C=CCC[C@@H](NC(=O)NNc1cccc(C(=O)OC)c1F)c1ccc(C(F)(F)F)cc1 1679306262 WIBPKJISTGNPFK-MRXNPFEDSA-N 439.409 4.965 50 10 IJGE Cc1ccc(C(=O)NN=C2CCCc3oc(C(=O)N4CCCc5ccccc54)c(C)c32)cc1 1772745164 UIVKUCVVGPJFFB-UHFFFAOYSA-N 441.531 4.960 50 10 IJGE Cc1ccc(O)c([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2Cl)c1 1865687628 WGPUZLZBPUTIME-INIZCTEOSA-N 446.816 4.777 50 10 IJGE CCc1nn(Cc2ccccc2)c2c1[C@@H](c1c(OC)ccc3ccccc13)C(C#N)=C(N)O2 1865687931 DGNDVSQMZWXHBD-XMMPIXPASA-N 436.515 4.874 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2cccc(F)c2)cc1 1865694168 QUDVAPVKVRYZAK-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE CCC[C@@H](CBr)CN(OCc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 1881877960 DEBWAXSHWPDZOP-SFHVURJKSA-N 441.410 4.851 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H](CCC(=O)NC[C@H]1C[C@H](Br)C1)C(C)(C)C 1887784983 XLCMQLSYKMWMEA-JYJNAYRXSA-N 433.431 4.633 50 10 IJGE O=S(=O)(c1ccccc1N(Cc1ccccc1)[C@H](CBr)C1CC1)C(F)F 1915189541 QYTWBZIMYAINCW-QGZVFWFLSA-N 444.341 4.863 50 10 IJGE O=S(=O)(c1sccc1Br)N(Cc1ccccc1)[C@@H](CCl)C1CC1 1915208938 OQAKKUZHSIIPIP-HNNXBMFYSA-N 434.808 4.719 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)c1nccn2nc(C(F)(F)F)cc12 1915762058 CSUZJSWVRJCQLG-UHFFFAOYSA-N 427.268 4.928 50 10 IJGE O=C(NCC[C@H](Br)C1CC1)c1csc(Br)c1Br 1945189015 GUYHTJLYGAASBE-QMMMGPOBSA-N 446.002 4.567 50 10 IJGE CC[C@H](NC(=O)c1c(Br)cccc1Br)[C@H](C)Br 1945321857 JAWXQZLYKKISMC-XVKPBYJWSA-N 427.962 4.503 50 10 IJGE Brc1cc([C@@H](Br)Cc2ncccc2Br)ns1 1983294708 JARJEHHBYDCHED-ZETCQYMHSA-N 426.959 4.742 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@H](OCCNC(=O)OC(C)(C)C)C1 2112695714 IJFSXNUASMDOBA-KRWDZBQOSA-N 435.447 4.584 50 10 IJGE CC(C)(C)OC(=O)N1CCCN(Cc2ccc(CBr)cc2)CC(F)(F)C1 2126471593 MIKOLUDOTPYZHC-UHFFFAOYSA-N 433.337 4.660 50 10 IJGE CC1(C)CCN(c2c(CBr)ccc(Br)c2Cl)CC[S@]1=O 2154376300 SAXGMJJXYMNTPH-HXUWFJFHSA-N 443.632 4.735 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CCN(C[C@H](CBr)c3ccccc3)C2)C1 2163061716 HSTNLNNSLWXTQV-SIKLNZKXSA-N 437.422 4.888 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2185510333 ICOHREUTANNDLF-FGZHOGPDSA-N 437.466 4.943 50 10 IJGE Cc1ccc(I)c([C@@H](Br)c2ncn3ccsc23)c1 2224056515 YIIGXHANJUDFNW-LLVKDONJSA-N 433.112 4.793 50 10 IJGE FC(F)(F)c1ccc(CO[C@H](CCl)[C@@H](I)CCl)cc1 2231129900 QRPHEWJYYGFUMF-WDEREUQCSA-N 427.031 4.872 50 10 IJGE Cc1c(Br)csc1C(=O)NC[C@]1(CBr)C[C@H]1C(F)(F)F 2234514008 HDLKOEXBSVOUDS-LDYMZIIASA-N 435.103 4.512 50 10 IJGE C[C@@H](Br)[C@@H](NC(=O)c1scc(Br)c1Cl)C(F)(F)F 2253534502 AVJYXDOYLPGAQF-WVBDSBKLSA-N 429.483 4.608 50 10 IJGE Cc1ccc(CBr)cc1NS(=O)(=O)c1cc(Br)sc1C 2296213823 JNFCNOCOSYDPMN-UHFFFAOYSA-N 439.194 4.823 50 10 IJGE N#CC(=Cc1ccc(OCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1)c1nc2ccccc2[nH]1 2297559160 WVAIHTPYOBOAOR-UHFFFAOYSA-N 439.431 4.553 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)NN=Cc2cccc(OC(=O)c3cccc(F)c3)c2)cc1 2297708344 YFGFVINMGWVIHC-UHFFFAOYSA-N 448.494 4.872 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OC2C[C@H]3CC[C@H](C2)C3)C1 2299545623 RFFHPKYENXLARC-DOXZYTNZSA-N 449.373 4.786 50 10 IJGE ClC[C@]1(Cc2ccc(I)c(Br)c2)CCCCO1 2306225462 DJVZOXUJTFIQAW-CYBMUJFWSA-N 429.523 4.774 50 10 IJGE CCCN1C(=O)C(=Cc2ccc(OCc3ccccc3)c(OCC)c2)C(C)=C(C#N)C1=O 2314611291 SJNADAFHOVQGNS-UHFFFAOYSA-N 430.504 4.667 50 10 IJGE Fc1c(Br)cc(Cl)c([C@H](Cl)C2COCCOC2)c1Br 2337090167 KEDKYEDKNIUZAY-LLVKDONJSA-N 436.930 4.947 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)COc1ccc([C@H](C)CC)cc1 9873868 RCXUKSVJHCWPPQ-CEXWTWQISA-N 426.557 4.707 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)Nc3ccccc3)cc2)cc1 12492036 ZSFFQVHQQVGEHO-UHFFFAOYSA-N 430.508 4.703 50 10 IJGE CCCCN(CC(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(C)cc1)C(=O)[C@@H](C)Cl 35691482 MTORLWPHAQKOKR-QGZVFWFLSA-N 432.996 4.673 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(Cl)c4)ccc32)cc1 38650389 IYGLEHVJHDWFMX-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE CCC[C@H](Oc1ccc(Cl)cc1)C(=O)NN=Cc1cc(Br)ccc1O 252600562 DSLJOXWSUWDKAV-KRWDZBQOSA-N 425.710 4.506 50 10 IJGE COc1cc(C=NNC(=O)Cc2cccc(C(F)(F)F)c2)ccc1OCc1ccccc1 254306055 AYRIGRGUVVFSEL-UHFFFAOYSA-N 442.437 4.986 50 10 IJGE Cc1cccc(OCC(=O)NN=C2C(=O)N(Cc3cccc4ccccc34)c3ccccc32)c1 254869245 TZHOKJNJFWFJKA-UHFFFAOYSA-N 449.510 4.594 50 10 IJGE COCC[C@@H](C)Oc1c(Br)cc(Br)cc1CBr 310298970 PQZGPNFDLQGYGS-MRVPVSSYSA-N 430.962 4.910 50 10 IJGE O=S(=O)(Nc1ccc(OCc2ccccc2)cc1)c1ccc(CBr)cc1 386997345 UXKNMRBSPNYKTR-UHFFFAOYSA-N 432.339 4.961 50 10 IJGE CC(C)(C)[Si](C)(C)OCCN1C[C@@H](S(=O)(=O)c2ccccc2)Cc2ccccc21 616672451 OKDNRVLXDHCVHE-NRFANRHFSA-N 431.674 4.913 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)c1 1471690924 HKQQQBSOUYLGDG-UHFFFAOYSA-N 439.462 4.985 50 10 IJGE Cc1cccc(Br)c1NNC(=O)c1cccc2nc(O)n(CC(C)(C)C)c12 1632162861 DNURTEUKLCRDCJ-UHFFFAOYSA-N 431.334 4.616 50 10 IJGE C=CCC[C@@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2)c1C)C(=O)OCC 1635699397 VXEDMCFCJZFSRY-OOIVEFLKSA-N 439.943 4.669 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccccc2Cl)c1 1865690077 IFSREJDEOMTFTG-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE CCCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1ccccc1F 1865703142 NYSTVMRXQQRLMQ-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE COc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2-c1ccc(Cl)cc1 1865709884 JIXCKLNIVPKEIY-INIZCTEOSA-N 446.816 4.771 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc(C[C@@H](CBr)NC(=O)OC(C)(C)C)c1 1880768516 XXWUSPJRWATFGF-HNNXBMFYSA-N 429.355 4.864 50 10 IJGE C[C@@H](CCCl)N(Cc1ccccc1)C(=O)c1cccc(I)c1 1915084182 XUTRJBCUIFVGEO-AWEZNQCLSA-N 427.713 4.951 50 10 IJGE O=S(=O)(c1ccc(Br)s1)N(Cc1ccccc1)C1(CCl)CCC1 1915759189 ATADFHOEOSGVKF-UHFFFAOYSA-N 434.808 4.863 50 10 IJGE C[C@@H](CBr)CCCNC(=O)c1csc(Br)c1Br 1945189747 YXWTZGUPGZHJBS-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE C[C@H](Br)C[C@H](C)NC(=O)c1c(Br)cccc1Br 1945333869 WBMSZFDCBKGTOV-YUMQZZPRSA-N 427.962 4.503 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1C[C@@]1(C)CC[C@](C)(CI)O1 1979567071 NFDHHZWZTFGRIY-ZTFGCOKTSA-N 437.362 4.929 50 10 IJGE O=C(NC[C@H]1CCC[C@H]1Br)c1c(Br)cccc1Br 2033094262 NPFIZTUVWUXGSO-RKDXNWHRSA-N 439.973 4.505 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)C(C)(C)C)[C@@H](CC(F)F)C1 2063525291 TXOJGSMPEQCZOH-KGLIPLIRSA-N 427.374 4.620 50 10 IJGE C[C@H](Br)CCc1cn(-c2cc(Br)ccc2Br)nn1 2068991208 LJROQGYDZQSLAF-QMMMGPOBSA-N 437.961 4.508 50 10 IJGE C[C@@H]1CN(c2ncc(I)cc2Br)CC[C@H]1CCCl 2069529889 UCIOGFOEJONQNL-NXEZZACHSA-N 443.554 4.540 50 10 IJGE CN(C[C@@]1(Br)CC1(F)F)c1ccc(CBr)c(Br)c1 2082521862 NPBJCJCWYQEYEL-NSHDSACASA-N 447.943 4.953 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)N2CCC(Br)CC2)c1F 2106301316 HYERKASEALWBNG-UHFFFAOYSA-N 434.281 4.703 50 10 IJGE Cc1c(Br)ccc([C@@H](Cl)C2CCS(=O)(=O)CC2)c1Br 2138870550 JPCBZVKCMZCYFG-ZDUSSCGKSA-N 430.589 4.625 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@@H]2CCCN(C[C@@H](CBr)c3ccccc3)C2)C1 2163064201 TVDKFJRHADCZIV-RTBURBONSA-N 437.422 4.744 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1ccc(C(F)(F)F)cc1F 2181743622 RNTPTHLUPCBZSQ-UHFFFAOYSA-N 428.517 4.840 50 10 IJGE C[C@H](Br)CCCc1cn(-c2cc(Br)c(Cl)cc2F)nn1 2189279939 QOJCVBSPVRSQQO-QMMMGPOBSA-N 425.527 4.928 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2C[C@]1(Cl)CC1(F)F 2205570145 FANJKROTMORUMJ-LLVKDONJSA-N 435.014 4.535 50 10 IJGE ICCCCCN1CCC2(CC1)CCN(Cc1ccccc1)CC2 2214714474 WFMCHBTXNUBAQH-UHFFFAOYSA-N 440.413 4.970 50 10 IJGE ClCCc1nc2cc(Cl)ccc2n1C[C@@H]1CC1(Br)Br 2224807547 SZDNVICGAORWRF-QMMMGPOBSA-N 426.967 4.977 50 10 IJGE CS[C@@H]1COC[C@H]1n1c(CCl)nc2cc(Br)c(Br)cc21 2234076128 UWLRJUNIPSAQHZ-VXGBXAGGSA-N 440.588 4.603 50 10 IJGE COc1ccc([C@H](Cl)c2nscc2Br)cc1I 2248885522 CSKNDIYYKCQACY-JTQLQIEISA-N 444.519 4.847 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1Cc1ccc(Br)cc1Br 2251034410 VQAQUSIQPUBQTO-AAEUAGOBSA-N 425.990 4.959 50 10 IJGE CCN[C@@H](Cc1cc(Br)cc(Br)c1)[C@H]1C[C@@H](Br)C1 2263511607 SQANLMRKDWJQGL-GDLCADMTSA-N 440.017 4.906 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)N(C)C)c(Br)cc1OCc1ccc(F)cc1 2313568488 TVLLIPNEEUQAOI-UHFFFAOYSA-N 447.304 4.561 50 10 IJGE Cl[C@H]1CCC2(CC2)N(Cc2ccc(I)c(Br)c2)C1 2325211495 JHXPQHYDIOUIOO-NSHDSACASA-N 440.550 4.790 50 10 IJGE COc1nc(OCc2ccc(Cl)cc2I)c(CCl)s1 2340109038 AYDBEDWMLPFGJE-UHFFFAOYSA-N 430.094 4.728 50 10 IJGE COc1cccc(OCc2cccc(I)c2)c1CBr 2341792252 HKVOLGJSSRDVHJ-UHFFFAOYSA-N 433.083 4.774 50 10 IJGE Cc1ccc(C(=O)NNc2ncnc(Nc3ccc(Cl)cc3Cl)c2[N+](=O)[O-])cc1 40650199 PMVLFGLNFJRXJP-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE CCCOc1ccccc1/C=C/C(=O)Oc1ccc(/C=C(\C#N)C(=O)NC(C)C)cc1OC 40950488 OOTALMXIZHJSCQ-DTXJCZLISA-N 448.519 4.534 50 10 IJGE Cc1cccc(C(=O)N/N=C\c2cc(Br)ccc2OC(=O)c2ccccc2)c1 59500454 GMDOIFXFIFQMLT-OYKKKHCWSA-N 437.293 4.741 50 10 IJGE O=[N+]([O-])c1ccc(OCc2ccc(I)cc2)c(CBr)c1 115901832 OJABDEJDDQOWOO-UHFFFAOYSA-N 448.054 4.673 50 10 IJGE O=C(NCCCCCCCl)c1cc(I)ccc1Br 236014858 SVKZGMBHQYQZFK-UHFFFAOYSA-N 444.538 4.583 50 10 IJGE CCCc1ccc(OCC(=O)NN=Cc2ccc(OCc3ccccc3)c(OC)c2)cc1 252616592 KBLFZUCQAGMIMZ-UHFFFAOYSA-N 432.520 4.756 50 10 IJGE ClCc1ccc(N2CC[C@H](N3CCN(Cc4ccccc4)CC3)C2)cc1Br 380085233 JWMDNJIKILPGIN-NRFANRHFSA-N 448.836 4.584 50 10 IJGE COc1cccc([C@@H]2CN(Cc3ccccc3)C[C@@H]2CI)c1Cl 382721744 NUIORNMZHPJLSV-DOTOQJQBSA-N 441.740 4.999 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CCl)[C@@H](c2cc(I)ccc2F)C1 394695189 SLTGYLUNGZXWMP-MFKMUULPSA-N 439.696 4.620 50 10 IJGE C[C@H](Br)[C@H]1CCCN(c2ncc(Br)cc2Br)C1 688974833 BMVOAMRPBHLTIQ-IUCAKERBSA-N 426.978 4.606 50 10 IJGE CC(C)n1ncc2cc(NC(=O)/C(C#N)=C/c3cn(CCC#N)nc3-c3ccccc3)ccc21 735290786 DXCWUFBPQJWCNN-DEDYPNTBSA-N 449.518 4.940 50 10 IJGE O=C(NNc1cccc(F)c1F)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 743721273 NZQLUCQBYPLAQB-UHFFFAOYSA-N 432.814 4.895 50 10 IJGE Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)C(=O)NNc1ccc(F)c(F)c1F 784812068 FPQNPQVKDFXKIO-CQSZACIVSA-N 443.425 4.634 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2CCC(CC(F)(F)F)CC2)c(-c2ccccc2)n1 803673725 IDIFWGJBBKHYGV-CPNJWEJPSA-N 441.457 4.562 50 10 IJGE Cc1cc(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)cc(Cl)c1Br 806888396 MZCIVBBMZOXEPX-UHFFFAOYSA-N 446.736 4.637 50 10 IJGE COc1cc(Cl)c(C=NNC(=O)c2cc3cc(Br)ccc3o2)cc1OC 1084112574 KWPITQMPGCKORA-UHFFFAOYSA-N 437.677 4.630 50 10 IJGE CC(C)c1cc(Br)cc2sc(NNC(=O)C(Cl)(Cl)Cl)nc12 1615892322 NUAMYFFUJNCXRN-UHFFFAOYSA-N 431.570 4.996 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CC)nn2-c1ccc(Cl)cc1 1865691417 RFCVKSGQBCNUQW-OAQYLSRUSA-N 432.911 4.871 50 10 IJGE Cc1nn(-c2ccccc2)c2c1[C@@H](c1ccc(OC(=O)c3ccccc3)cc1)C(C#N)=C(N)O2 1865704764 DFOHMAHJZVTSIB-DEOSSOPVSA-N 448.482 4.618 50 10 IJGE Cc1ccc(C)c(Cn2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2ccccc2OC(C)C)c1 1865705206 ORWDONVJGKRVJM-DEOSSOPVSA-N 428.536 4.862 50 10 IJGE COc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3Cc2ccccc2)c1 1865711647 DLOCYLCAOUFCGY-QHCPKHFHSA-N 434.499 4.825 50 10 IJGE CCCOc1ccccc1/C=C/C(=O)NNC(=O)c1ccc(-c2ccc(Cl)cc2)nc1C 1865755868 UVTGRVLYRJTORC-XNTDXEJSSA-N 449.938 4.974 50 10 IJGE CC(C)(C)Oc1cccc(CCNC(=O)/C(C#N)=C/c2cccc(Br)c2)c1 1866130725 JBGMKZVSZUNEDQ-LDADJPATSA-N 427.342 4.892 50 10 IJGE COc1ccccc1-c1csc(/C(C#N)=C(\O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)n1 1872746933 GEASZDMEXGXSLO-CYVLTUHYSA-N 438.421 4.893 50 10 IJGE CCOc1ccc(-c2csc(/C(C#N)=C(\O)[C@@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1 1872747581 JTJOFCNHPTVQGE-DIGCTUSJSA-N 445.500 4.686 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1Cl 1914354444 YVDQLETYBVDDMJ-GFCCVEGCSA-N 437.186 4.968 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)[C@@H](C)CCBr)c(OC)c1OC 1915091549 YRXWHFZHSRDALS-HNNXBMFYSA-N 436.346 4.528 50 10 IJGE O=S(=O)(c1ccc(Cl)c(CCl)c1Cl)N(Cc1ccccc1)[C@H]1CCOC1 1915469135 BTGNILGRQZTYNF-AWEZNQCLSA-N 434.772 4.712 50 10 IJGE Cc1c(Br)sc([C@H](Br)[C@H]2OCCO[C@@H]2C)c1Br 1922921423 QPBZUYFAPBEDSW-VDAHYXPESA-N 449.002 4.821 50 10 IJGE Cc1sc(Br)cc1C(=O)NCCCCCCI 1946647239 CUIRCDASERLDKF-UHFFFAOYSA-N 430.149 4.544 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1c(F)cccc1Br 2010827856 XSVHYQACMRNZGH-UHFFFAOYSA-N 439.416 4.584 50 10 IJGE C[C@H](CCBr)CCN=[S@@]1(=O)CC[C@@H](CNC(=O)OC(C)(C)C)C1(C)C 2044706709 WMICHSGKWQEQAS-OKXMYEFYSA-N 439.460 4.589 50 10 IJGE O=C(CBr)c1c(Br)ccc(C(F)(F)F)c1OC(F)(F)F 2054796924 ZYEZAVVHJCGYQK-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE Brc1ccc(CN2C[C@H]3C[C@@H](Br)C[C@H]3C2)c(Br)c1 2065402373 JUPFYHCLZBLYTB-PTEHBNRSSA-N 438.001 4.817 50 10 IJGE C[C@@H]1[C@@H](n2c(CCCl)nc3cncc(Br)c32)CCN1Cc1ccccc1 2095446705 ZMLYCNKIFIDWBX-KDOFPFPSSA-N 433.781 4.811 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCC([C@@H](F)CCl)CC1 2106950424 OIWQEHAOAURFQX-VIFPVBQESA-N 433.568 4.702 50 10 IJGE O=C(N[C@@H](CCl)c1cccs1)c1ccc(I)c(Cl)c1 2119048434 TUENTGCTJLXXTK-NSHDSACASA-N 426.106 4.716 50 10 IJGE ClCc1ccc2c(c1)CN(c1ncc(I)cc1Br)C2 2133371960 ACEDYNRDEFAKRQ-UHFFFAOYSA-N 449.517 4.708 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)C(C)(C)c1ccc(NC(=O)OC(C)(C)C)cc1 2196915469 YTYAYFUNJZCXFJ-KOMQPUFPSA-N 439.394 4.943 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CCCCI)C2(CCCCC2)C1 2243588680 FKTLURLRFUVXAS-HNNXBMFYSA-N 436.378 4.504 50 10 IJGE C=CC[C@](C)(CBr)CNC(=O)c1cc(F)c(Br)cc1Cl 2282988717 VLDUGOZXHYIMMW-CQSZACIVSA-N 427.539 4.949 50 10 IJGE COc1cccc(C[C@H](Br)c2ccc(OC)c(I)c2)c1 2285012464 RYPHFUDRWDBLMZ-AWEZNQCLSA-N 447.110 4.987 50 10 IJGE CC(C)CN(C[C@@H](C)Br)C(=O)Cc1ccc(Br)cc1Cl 2288050762 YTCXFSLTYDQFFK-LLVKDONJSA-N 425.592 4.913 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H](COC)C[C@@H]1CNC(=O)OC(C)(C)C 2289589270 GMIGGMUGHGGDLS-QZTJIDSGSA-N 449.474 4.830 50 10 IJGE C[C@@H]1CC[C@H](Cl)CN1Cc1ccc(I)c(Br)c1 2306219628 OJKUGCQFTDYUJF-KOLCDFICSA-N 428.539 4.645 50 10 IJGE Clc1ccc(CN[C@H](CBr)C2CCCC2)cc1I 2315550558 FSMQGGKHAGUPES-CQSZACIVSA-N 442.566 4.988 50 10 IJGE CC(C)C[C@@H](CBr)CN=[S@@]1(=O)CCN(C(=O)OC(C)(C)C)CC1(C)C 2328518709 JDDRLQOEWILHEM-ODCWNRFASA-N 439.460 4.541 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@H]2CC(Cl)C[C@@H](C2)C1 2338869875 SSSKXIMYGSSSPZ-HTQZYQBOSA-N 427.589 4.753 50 10 IJGE Cc1cc2c(c(=O)n1CCc1ccccc1)[C@H](c1ccc(C(C)C)cc1)C(C#N)=C(N)O2 2213253 CHCIWTMBOKBMDL-XMMPIXPASA-N 425.532 4.741 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccc(Cl)cc3)ccc2[C@@H]1c1cccc([N+](=O)[O-])c1 38653421 SEKWNAXGJZNNGH-NRFANRHFSA-N 447.834 4.686 50 10 IJGE COc1cc(/C=N/NC(=O)COc2cccc(C)c2)ccc1OCc1ccccc1Cl 40840479 IJOAEGYTONQCDB-VULFUBBASA-N 438.911 4.765 50 10 IJGE CCc1ccc(N(C(=O)/C(C#N)=C/c2ccc(OC)cc2)S(=O)(=O)c2ccccc2)cc1 40971379 MFNQBBPAPZWELT-HEHNFIMWSA-N 446.528 4.587 50 10 IJGE COc1ccc(CCN2C(=O)C(C#N)=C(C)/C(=C\Nc3ccc4ccccc4c3)C2=O)cc1 209893842 NOCCUESPJQKNAI-KOEQRZSOSA-N 437.499 4.596 50 10 IJGE CC[C@@H](Br)c1nnc(-c2ccc(F)cc2I)s1 233825076 PKRSMWYBMNFYQZ-MRVPVSSYSA-N 427.080 4.795 50 10 IJGE CCCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3ccc(F)cc3)cc2)cc1 254429254 DALOSPLKIYXFFG-UHFFFAOYSA-N 434.467 4.988 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CBr)[C@H](c2c(F)cccc2Br)C1 382689017 KNYJYJFCXGJNBZ-WDEREUQCSA-N 437.147 4.934 50 10 IJGE Cc1cccc(C(=O)N[C@H](CBr)CC(C)(C)C)c1I 393532414 XICWPNYEKQKUFJ-NSHDSACASA-N 438.147 4.529 50 10 IJGE CC[C@@H](NC(=O)c1cc(Br)cc(Br)c1)[C@H](C)Br 395378110 RPQWUGKCGRNPQM-WRWORJQWSA-N 427.962 4.503 50 10 IJGE CCCC(CBr)(CCC)CN(C)C[C@@]1(O)CCN(Cc2ccccc2)C1 711756069 LHBQHUHQDQZWSU-QFIPXVFZSA-N 425.455 4.537 50 10 IJGE Cc1ccc(NNC(=O)C(=O)Nc2ccc(Oc3ccc(Cl)cc3Cl)c(F)c2)nc1 783484473 BZFMKNTTYJJBPS-UHFFFAOYSA-N 449.269 4.710 50 10 IJGE COc1ccc(C(=O)NN=Cc2ccc(OC(=O)c3ccc(Cl)c(Cl)c3)cc2)cc1 1084655947 PAYNZVPTHVFBFB-UHFFFAOYSA-N 443.286 4.985 50 10 IJGE C=C(C)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC=C(C#N)CC1 1151206433 IYWDWOZGXFRVHK-VWLOTQADSA-N 441.531 4.542 50 10 IJGE COc1ccc(NNC(=O)c2cc3ccc(C(F)(F)F)cc3nc2O)c(C(F)(F)F)c1 1306851921 MNIHRJQUFQCDGQ-UHFFFAOYSA-N 445.319 4.744 50 10 IJGE Cc1ccc(C)c(-c2csc(/C(C#N)=C(\O)c3ccc(NS(C)(=O)=O)cc3)n2)c1 1872749819 JSEOSVIPSANOII-ZZEZOPTASA-N 425.535 4.748 50 10 IJGE CC1(C)C[C@H]([C@H](CBr)NC(=O)OC(C)(C)C)CN(C(=O)OC(C)(C)C)C1 1880760549 HLZQJGQNYXHUOL-KBPBESRZSA-N 435.403 4.558 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)O[C@H]1CCC2(CCCC2)C1 1902880707 GDICXGNSWHNPBK-WMLDXEAASA-N 437.362 4.834 50 10 IJGE CC(C)[C@@H](CBr)CNC(=O)c1csc(Br)c1Br 1945189609 VFVZZADUROGDSK-ZETCQYMHSA-N 448.018 4.670 50 10 IJGE CCCC1CC(OC2(CI)CCN(C(=O)OC(C)(C)C)CC2)C1 1987758694 FWGIUXWLHMTJRE-UHFFFAOYSA-N 437.362 4.786 50 10 IJGE CCN(C[C@](C)(CI)O[C@H]1CCCC[C@H]1F)C(=O)OC(C)(C)C 1991632820 DCUGRMFOFCSVKP-KEYYUXOJSA-N 443.341 4.734 50 10 IJGE C[C@H]1C[C@H]1N(CCBr)C(=O)c1csc(Br)c1Br 2002026023 IDELYSVBJLKJDC-POYBYMJQSA-N 446.002 4.519 50 10 IJGE O=C(NC[C@H]1CCCN(C[C@H](CBr)c2ccccc2)C1)OCc1ccccc1 2044697859 XFPDDTJUCCLNHH-IRLDBZIGSA-N 445.401 4.804 50 10 IJGE CCN(CCCOCc1ccccc1)S(=O)(=O)c1cc(C)c(CBr)s1 2059287299 WEDXDVLFBTVWBM-UHFFFAOYSA-N 446.432 4.569 50 10 IJGE O=C(NCCCCCCCl)c1ccc(Br)cc1I 2086147882 TXNDQLNDKVFLCX-UHFFFAOYSA-N 444.538 4.583 50 10 IJGE CC(C)[C@@H](CBr)CN1C[C@H](NC(=O)OC(C)(C)C)CCc2ccccc21 2106782156 OIXBDTKEAVUSOF-ZWKOTPCHSA-N 425.411 5.000 50 10 IJGE CCC(CC)(CBr)CN1CC[C@H](C(F)(F)F)[C@H](NC(=O)OC(C)(C)C)C1 2106783148 XHOVOEURZPTKQU-UONOGXRCSA-N 445.364 4.965 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1[C@H](CBr)C[C@H]2CCC[C@@H]21 2115940083 LCCKJKDOWAXFIF-WEDXCCLWSA-N 427.589 4.942 50 10 IJGE Cc1c(Br)ccc([C@H](Cl)C2(S(C)(=O)=O)CCC2)c1Br 2138852945 UWSDTFLSSYCRAE-LBPRGKRZSA-N 430.589 4.767 50 10 IJGE CCC[C@@]1(CNC(=O)c2ccc(CBr)cc2)CCCN1C(=O)OC(C)(C)C 2162494289 HGBWMAQPQDHFKH-NRFANRHFSA-N 439.394 4.881 50 10 IJGE COc1cc(F)c([C@H](Br)c2nn(C)c(Cl)c2Br)c(F)c1 2167047332 IKJOKKJBFFZEPP-VIFPVBQESA-N 430.474 4.607 50 10 IJGE COc1cc(Cl)c([C@@H](Br)[C@@H]2CCCCS2(=O)=O)cc1Br 2202349316 XMJIPEOBBJZTDT-QWHCGFSZSA-N 446.588 4.514 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](C[S@](C)(=O)=NCCCCCCBr)C(C)(C)C 2223286919 BFMRQLDRRTZGFR-MQNRADLISA-N 441.476 4.979 50 10 IJGE Cc1ccc(I)c(C(=O)Nc2cccc(CBr)c2)c1 2232156395 IEYHOOUPYMBKPG-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE Cc1cc(Br)c([C@H](Br)C2CCS(=O)(=O)CC2)c(C)c1Cl 2232510640 NHLHBLFUAZOOFN-CYBMUJFWSA-N 444.616 4.980 50 10 IJGE F[C@H]1COCC[C@@H]1n1c(CCl)nc2cc(Br)c(Br)cc21 2234073223 JEGSJHGWRRJIIF-ONGXEEELSA-N 426.511 4.600 50 10 IJGE Cc1cc(F)c(CBr)c(N2CC[C@]3(CN(Cc4ccccc4)CCO3)C2)c1 2283385257 FVTURXPHUZAYRS-QFIPXVFZSA-N 433.365 4.510 50 10 IJGE N#CC(=Cc1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1)C(=O)Nc1ccc(C(=O)O)cc1 2293547228 NYGVJFGPSDSDGX-UHFFFAOYSA-N 437.795 4.752 50 10 IJGE N#CC(=Cc1ccc(OCc2ccccc2)cc1)C(=O)Nc1ccc(N2CCOCC2)cc1 2297382412 JJUYLPHBWKDPGK-UHFFFAOYSA-N 439.515 4.648 50 10 IJGE C=CCOc1c(Br)cc(C=C(C#N)C(=O)Nc2ccc(OC)cc2)cc1OC 2313511200 TYNRZVYAKPWNDS-UHFFFAOYSA-N 443.297 4.577 50 10 IJGE COc1cc(C=C(C#N)c2ccccc2)ccc1OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 2314720696 ZYFBYUGFWMKSGA-UHFFFAOYSA-N 445.387 4.795 50 10 IJGE Clc1ccc(CN2C[C@@H](Br)C3(CCC3)C2)cc1I 2315554792 JNSDYXNGUKJFEW-CYBMUJFWSA-N 440.550 4.694 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H](C3)[C@@H]2CBr)c(I)c1 2318537975 GWQQHBFQYLNNQP-WFBYXXMGSA-N 440.550 4.692 50 10 IJGE N#CC(=CN1CCN(c2cccc(Cl)c2)CC1)C(=O)Nc1cccc(Cl)c1Cl 2324381034 ZBWODBHTWXUYHI-UHFFFAOYSA-N 435.742 4.815 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@H]1CCCCN1C[C@@]1(CBr)CC1(F)F 2326918163 ZHDZDRXNBIGDSZ-DYVFJYSZSA-N 425.358 4.565 50 10 IJGE CCOc1ccc(OCC)c(-c2csc(C(C#N)=C(O)[C@@H]3CC(=O)N(C(C)C)C3)n2)c1 2331376402 AHMSJDCFEOZWTG-OAHLLOKOSA-N 441.553 4.657 50 10 IJGE CC1(C)COC[C@H]1CO[C@@H](CI)c1ccccc1Br 2339010112 IXCJLQNWQNTTLB-FZMZJTMJSA-N 439.131 4.614 50 10 IJGE COc1ccc([C@@H](Br)C23CC(C[C@H](C)O2)C3)cc1I 2342244790 UOGAYOLPCKPSHU-AYFMIFPQSA-N 437.115 4.693 50 10 IJGE CN(Cc1ccc(Br)s1)c1c(CBr)c(C(F)F)nn1C 2365332447 IGBLVEMSZILEPP-UHFFFAOYSA-N 429.128 4.713 50 10 IJGE COc1ccc([C@H](Br)c2ccccc2I)cc1OC 40279302 YMEDZWSYOUXOIY-HNNXBMFYSA-N 433.083 4.793 50 10 IJGE O=C(NCC1(CCBr)CC1)c1cc(Br)c(Br)s1 97907888 GVZSJEOXWDXTHQ-UHFFFAOYSA-N 446.002 4.568 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Cl)c3cc(F)cc(Br)c3)cc2[nH]1 109883699 MNTBAROLDIBZKE-CYBMUJFWSA-N 434.490 4.849 50 10 IJGE O=C(N/N=C/c1cc(Cl)c(O)c(Cl)c1O)c1ccc2[nH]c(-c3ccccc3)nc2c1 169926952 HJVSBSAHKCNTTF-YSURURNPSA-N 441.274 4.712 50 10 IJGE CCCOc1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)NN=C(C)c2ccccc2)cc1 254378195 NNRZWSCTUQJFNN-DZVAZSKOSA-N 441.531 4.787 50 10 IJGE C[C@@H](C=NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(Cl)c2)c1)c1ccccc1 254795584 SDXUUOSWCNMHLH-INIZCTEOSA-N 441.940 4.660 50 10 IJGE O=C(CCC(=O)Nc1ccc(Cl)c(Cl)c1)NN=Cc1c(O)ccc2ccccc12 254826790 MIZOMWCCFOSNSQ-UHFFFAOYSA-N 430.291 4.721 50 10 IJGE ClCc1nc2cc(I)ccc2n1CCCOCc1ccccc1 389960481 MBGIGGHHXQUSTL-UHFFFAOYSA-N 440.712 4.987 50 10 IJGE CN(C[C@H]1CCCCN1Cc1ccccc1)c1nc2sccn2c1CBr 720015675 CISNBLVSWJBRJW-QGZVFWFLSA-N 433.419 4.782 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2cc(C)n(C3CCCCC3)c2C)cc1 725384642 LRPHIXMWSGSPFB-DEOSSOPVSA-N 425.573 4.973 50 10 IJGE N#Cc1ccc(NNC(=O)c2cn(-c3ccc(Cl)c(Cl)c3)cn2)c(C(F)(F)F)c1 799753315 WYSPZBNXMCTUBC-UHFFFAOYSA-N 440.212 4.826 50 10 IJGE COC(=O)/C(C#N)=C\c1cc(Br)c(OCc2ccc(Cl)cc2)c(OC)c1 1081085433 KOXFVGQLPPUKRA-AUWJEWJLSA-N 436.689 4.770 50 10 IJGE C=CCc1cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)cc(Br)c1OCC#N 1083954590 LKHUSFNXGHLKHD-LDADJPATSA-N 436.309 4.934 50 10 IJGE C[C@H](SCc1ccccc1)C(=O)NN=Cc1ccccc1OCc1ccc(C(=O)O)cc1 1084570511 KYKCQYIWFIUMOB-SFHVURJKSA-N 448.544 4.736 50 10 IJGE C=CC1(CC(=O)NNC(=O)c2ccc(CSc3nc(C)cc(C)n3)cc2)CCCCC1 1588027077 MKXVMRUQLDNDBA-UHFFFAOYSA-N 438.597 4.673 50 10 IJGE C[C@H](Cl)C(=O)Nc1ccc(Oc2ccc(NC(=O)[C@@H]3CCCC[C@H]3C(=O)O)cc2)cc1 1859505273 SCUYKLBZWZHYOR-VHKYSDTDSA-N 444.915 4.874 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1ccc(Cl)cc1 1865690925 FCFXEEHPGMANFU-QFIPXVFZSA-N 446.938 4.930 50 10 IJGE CCCc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1ccccc1O)C(C#N)=C(N)O2 1865708147 PJCOZECVHHSDCX-HXUWFJFHSA-N 438.890 4.600 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1ccc(OC)cc1)C(C#N)=C(N)O2 1865712639 DHYCGQBXNQZBLL-HXUWFJFHSA-N 438.890 4.513 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(Cl)c(Cl)c2)cc1 1865714337 HQMSJACNTNERHN-HXUWFJFHSA-N 441.318 4.773 50 10 IJGE CCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)CC(C)(C)CI 1904650383 FKBIZPFRIITQPW-OAHLLOKOSA-N 438.394 4.559 50 10 IJGE COc1cc(Br)ccc1C(=O)N(Cc1ccccc1)[C@@H](C)CBr 1914215168 FUVGNJHHXWPEFV-ZDUSSCGKSA-N 441.163 4.884 50 10 IJGE CC1(C)C[C@H](CBr)N(c2ncc(Br)cc2Br)C1 1945909188 WWCBZMJYNSCQCA-SECBINFHSA-N 426.978 4.606 50 10 IJGE Fc1ccc(-n2c(Cl)nc(Cl)c2CBr)c(I)c1 2006646435 BGRIBVKFVPHKCW-UHFFFAOYSA-N 449.876 4.818 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1F 2008322131 PZTIHRMGFSGBRT-CQSZACIVSA-N 434.758 4.844 50 10 IJGE CC[C@@H](Br)CN(CC)Cc1ccc(I)c(Cl)c1 2026563108 HKBZOIUZGXLWKX-LLVKDONJSA-N 430.555 4.940 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@H]1Cc1ccc(I)c(Cl)c1 2026564482 UEUHSWOLXXQQHL-GIPNMCIBSA-N 429.523 4.676 50 10 IJGE C[C@@H](NC(=O)c1cccc(Br)c1Br)C(C)(C)CBr 2031482871 XUEGUZJLYDMSIT-MRVPVSSYSA-N 441.989 4.751 50 10 IJGE O=C(NCC[C@H](Br)C1CC1)c1c(Br)cccc1Br 2033091000 MCGWKGIBSSTENA-VIFPVBQESA-N 439.973 4.505 50 10 IJGE CC1(C)C[C@@H](Br)CN1C(=O)c1c(Br)cccc1Br 2037325853 QNZRVKJOQDDDHG-MRVPVSSYSA-N 439.973 4.600 50 10 IJGE BrC[C@@]12CC[C@@H](CN1Cc1cc(Br)ccc1Br)C2 2054712846 JPLUJEMCHGEFQK-YGRLFVJLSA-N 438.001 4.961 50 10 IJGE COCC(C)(C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)sc1C 2059286777 PJNDQMSVPSITBP-UHFFFAOYSA-N 446.432 4.567 50 10 IJGE CC(C)C(=O)[C@@H](Br)Cc1ccc(C(F)(F)F)cc1I 2139267989 ZIAZYZQFMPXLNK-JTQLQIEISA-N 449.048 4.841 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H]1CN(CC3(CBr)CCCCC3)C[C@H]21 2163057922 GJTQABNNKMROJI-YRXWBPOGSA-N 441.454 4.909 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@H](CBr)c2cscn2)cc1Cl 2175668816 JIOWDLYSHUOQMI-LLVKDONJSA-N 438.572 4.733 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@H](c2ccccc2)[C@H](CNC(=O)OC(C)(C)C)C1 2185528926 KZGVIDFMNDROTN-VAMGGRTRSA-N 439.438 4.894 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)C[C@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 2196915571 ZOJIILFLKJWHCV-HRCADAONSA-N 437.378 4.547 50 10 IJGE Cc1sc(C[C@H](CBr)NC(=O)OC(C)(C)C)c(Br)c1C 2209324845 VGJBHLGPUDLWBA-SNVBAGLBSA-N 427.202 4.958 50 10 IJGE CC[C@H](COC)Oc1c(Br)cc(Br)cc1CBr 2217088311 NESJAYNGDABSBX-SNVBAGLBSA-N 430.962 4.910 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2[C@@]12C[C@@H]1CN(Cc1ccccc1)C2 2224708267 HNVQFSXSHRBAHW-JLTOFOAXSA-N 434.740 4.908 50 10 IJGE CCN[C@H](Cc1cc(Br)cc(Br)c1)[C@@H]1C[C@@H]1Br 2252833810 ZETWPHLJUMJUKF-FRRDWIJNSA-N 425.990 4.516 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1cccc(Cl)c1Br 2256123937 SHCUIXKSAAPZOD-KCJUWKMLSA-N 444.538 4.682 50 10 IJGE CC[C@H](C[C@H](C)Br)NC(=O)c1ccc(Cl)c(I)c1 2256387864 GXIPPEDSMBVXFV-WCBMZHEXSA-N 444.538 4.627 50 10 IJGE C[C@]1(CBr)CC(F)(F)CN1C(=O)c1cccc(Cl)c1Br 2283196807 ADRGAAIFOHALQT-GFCCVEGCSA-N 431.502 4.737 50 10 IJGE CS(=O)(=O)C1CC([C@@H](Br)c2csc3c(Br)cccc23)C1 2285283556 NLMVWDNIEUKBFV-KJHLLKJSSA-N 438.206 4.923 50 10 IJGE C[C@H](Br)CN(CCC(C)(C)C)Cc1nn(C)c(Cl)c1Br 2288152992 CQGKLPMQQHKFNS-JTQLQIEISA-N 429.628 4.858 50 10 IJGE CC(C)COc1ccc(C=C(C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2Br)cc1 2297491179 OQJKPTMSAVSDPJ-UHFFFAOYSA-N 444.285 4.938 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@H](CC2CC2)C2CC2)C1 2303848996 FURHZPMZBIWNQO-VQIMIIECSA-N 449.373 4.786 50 10 IJGE Clc1ccc(I)cc1CN[C@H](CCBr)C1CC1 2307328341 LSINOKQCNYXRAA-CYBMUJFWSA-N 428.539 4.598 50 10 IJGE C[C@H]1C[C@H](Br)CCN(Cc2ccc(Cl)cc2I)C1 2318513935 YDEUGYXMEXLAAD-CMPLNLGQSA-N 442.566 4.940 50 10 IJGE COc1ccc2c(c1)c(C=NNC(=O)c1ccc(-c3ccc(F)cc3F)nc1C)cn2C 2321244551 SWVPRBARUYKSMX-UHFFFAOYSA-N 434.446 4.599 50 10 IJGE CCCCOCCCNC(=O)C(C#N)=CNc1cc(C(F)(F)F)cc(C(F)(F)F)c1 2324738260 XYSPZRNGZOWYEI-UHFFFAOYSA-N 437.384 4.867 50 10 IJGE C[C@H](NCc1ccc(I)c(Br)c1)[C@H]1CCC[C@@H]1Cl 2325203709 ICZWEOLJISFWKB-NDMJEZRESA-N 442.566 4.939 50 10 IJGE FC(F)(F)[C@H]1[C@@H](Br)CCCN1Cc1ccc(I)cc1 2344184053 IKFJFBNSKNQVFN-NWDGAFQWSA-N 448.064 4.581 50 10 IJGE Cc1nn(Cc2ccccc2)c(C)c1/C=N/NC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 59152031 SAYSAPAGRKWFSB-KWJLSGNOSA-N 445.350 4.773 50 10 IJGE COc1ccc(C(=O)[C@H](Br)[C@@H](Br)c2ccc(OC)cc2)cc1 105418961 DTAHPGMKUAKDKW-JKSUJKDBSA-N 428.120 4.786 50 10 IJGE Cc1ccsc1Cn1c(CCCl)nc2cc(I)c(F)cc21 122654726 ZICHIXQLAVLHJA-UHFFFAOYSA-N 434.705 4.980 50 10 IJGE CC(=NNC(=O)c1cccc(Br)c1)c1cccc(NC(=O)c2cccs2)c1 254346087 AFBYPIUJHPDVJS-UHFFFAOYSA-N 442.338 4.917 50 10 IJGE O=C(c1ccc(Br)cc1Br)N(CCCBr)C1CC1 404223067 NEEJCSQBSUPAEM-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE O=C(NNc1ncccc1Cl)c1cccnc1Oc1ccc(F)cc1Br 734245784 NELJRTYZYRIDID-UHFFFAOYSA-N 437.656 4.581 50 10 IJGE O=C(NNc1c(F)cc(F)cc1Br)c1c(F)ccc(Br)c1F 783781666 FFGWOIRQACHYNG-UHFFFAOYSA-N 442.004 4.525 50 10 IJGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)N[C@@H]1C[C@H]1c1ccc2ccccc2c1 798048617 IXBMGMWOVKSFCZ-LEWJYISDSA-N 442.544 4.772 50 10 IJGE C[C@@H](OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)c1ccc(F)cc1F 920155669 BPEADYPLAWORAJ-UWCCDQBKSA-N 432.430 4.953 50 10 IJGE Cc1ccc(NC(=O)C(=O)NN=Cc2cc(C)n(-c3ccc(Cl)cc3Cl)c2C)cc1 1083943496 TURVSOJHTZCZTK-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE O=C(NN=Cc1ccccc1OCc1ccc(F)cc1)c1ccccc1Br 1084022161 MUWYZRIBWFNHPY-UHFFFAOYSA-N 427.273 4.931 50 10 IJGE C#C[C@H](NC(=O)NNc1ccc(Br)cc1Cl)c1ccc(Cl)cc1F 1683516484 AYONNCPRCGPDFS-AWEZNQCLSA-N 431.092 4.896 50 10 IJGE CCc1nn(CC)c2c1[C@H](c1cccc(OC)c1OCc1cccc(C)c1)C(C#N)=C(N)O2 1865706556 ZGXWGBZKVZHPSR-JOCHJYFZSA-N 444.535 4.580 50 10 IJGE Cc1ccc(C(=O)CCC(=O)NNC(=O)CC(c2ccccc2)c2ccccc2)c(C)c1 1865760279 PSCINHZNPHROED-UHFFFAOYSA-N 428.532 4.636 50 10 IJGE C[C@H]([C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1)[C@H](CBr)NC(=O)OC(C)(C)C 1884025675 GLUDYOZOFOXJDC-FPCVCCKLSA-N 449.430 4.994 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1ccc(C(F)(F)F)cc1 1916350111 XQHYHUWIVWMYHG-KRWDZBQOSA-N 430.264 4.758 50 10 IJGE O=C(NC1(C(F)(F)F)CCC(Br)CC1)c1ccsc1Br 1924736624 MMLOITHGVHZFJZ-UHFFFAOYSA-N 435.103 4.879 50 10 IJGE C[C@@H]1OCC[C@]1(CBr)Cc1ccc(Br)cc1Br 1943843258 IBDQAOHCVKIUQI-TVQRCGJNSA-N 426.974 4.944 50 10 IJGE CCn1cc(Br)c(CN(Cc2ccccc2)C2(CBr)CCC2)n1 1985198813 VUJVIFJWXCIGPL-UHFFFAOYSA-N 441.211 4.985 50 10 IJGE O=C(N[C@H](CBr)CC1CC1)c1cc(Br)cc(Br)c1 2029976458 CJOSEBSDKOJTQE-LBPRGKRZSA-N 439.973 4.505 50 10 IJGE COc1ccc(C)c(-n2nc(CBr)c(Br)c2C(F)(F)F)c1 2079233802 FYFGRPZPXAZJQC-UHFFFAOYSA-N 428.046 4.866 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CN(C(=O)CCCCBr)c2ccccc21 2106771673 JVWQZOBHHPIZTK-OAHLLOKOSA-N 425.367 4.597 50 10 IJGE CC(C)(C)OC(=O)N(CC(F)F)[C@@H]1CCCN(C[C@H](CBr)CC2CC2)C1 2112865632 DRBRDFSWSIUKLW-JKSUJKDBSA-N 439.385 4.764 50 10 IJGE O=C(c1cc(Br)sc1Br)N1[C@H]2CC[C@@H]1C[C@H](CCl)C2 2128152838 YSRUPUNVEUPQNM-AYMMMOKOSA-N 427.589 4.895 50 10 IJGE C[C@H]1[C@H](NC(=O)OC(C)(C)C)CC(C)(C)CN1C(=O)c1ccc(CBr)cc1 2162872366 MEACROVBBPIAHD-WMLDXEAASA-N 439.394 4.735 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2Cc1nccn1Cc1ccccc1 2224704679 PTMIKPPNIYKXNP-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@@H](Br)c1cn(C)nc1Br 2264375292 QNURBAJZBFMNET-LLVKDONJSA-N 428.939 4.982 50 10 IJGE O=C(N[C@H](CCCl)C1CCCC1)c1ccc(Cl)c(I)c1 2283653259 DPTVHFHLHANECT-CQSZACIVSA-N 426.125 4.862 50 10 IJGE C[C@@H]1CC[C@H](CBr)N(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285960293 UJMDLTRKCBQDQY-RKDXNWHRSA-N 427.539 4.877 50 10 IJGE CN(CC1(CBr)CC(C)(C)C1)[C@@H](CNC(=O)OC(C)(C)C)C(F)(F)F 2321758571 GKERQGFOXWJWIF-LBPRGKRZSA-N 431.337 4.575 50 10 IJGE C[C@@H]1C[C@H](Cl)[C@@H](C)N(Cc2ccc(I)c(Br)c2)C1 2325227847 FABXNCDPWHGFCD-BREBYQMCSA-N 442.566 4.891 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C)CN(CCCCCCCBr)CC1(F)F 2326656865 LTSMYAXRMRMXGV-KRWDZBQOSA-N 427.374 4.814 50 10 IJGE COC(=O)c1c(NC(=O)CCl)sc(C(=O)Nc2cccc(Cl)c2Cl)c1C 21252971 IGUUDWRCSOJUPO-UHFFFAOYSA-N 435.716 4.580 50 10 IJGE C=CCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C/c2ccc(C(C)C)cc2)c(OC)c1 34896125 NZOWAOVBMFEJIB-TWSKGESGSA-N 430.504 4.647 50 10 IJGE COc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4Cl)ccc32)c1 38650122 JDFSWOBGYBWUBX-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE Cc1cc(Cl)ccc1Nc1ncnc(NNC(=O)c2cccc(Cl)c2)c1[N+](=O)[O-] 40590616 CUTVRASAVBSJMG-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE CCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@H](C(=O)Nc2ccccc2)c2ccccc2)c1C 107646209 CTFUEZJEPXDGFG-PBMMVTTKSA-N 440.547 4.918 50 10 IJGE O=C(NC1(CBr)CCCC1)c1ccc(Br)c(C(F)(F)F)c1 122579927 NDBZZYKZTJAFQZ-UHFFFAOYSA-N 429.074 4.905 50 10 IJGE N#C/C(=C/NC(c1ccccc1)c1ccccc1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 217228515 IVSFRFFTGQQPJR-SDXDJHTJSA-N 432.867 4.973 50 10 IJGE O=C(CBr)c1cc(Br)c(OC(F)F)c(OC(F)(F)F)c1 575680226 JVRYHTYBBBUYQZ-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE C[C@@]1(CBr)CCCN(c2ncc(Br)cc2Br)C1 688778982 VRVVDSNVWSWJAQ-LBPRGKRZSA-N 426.978 4.608 50 10 IJGE CCOc1ccc(-c2nc(CC(=O)Oc3ccc([N+](=O)[O-])c4ncccc34)cs2)cc1 770136215 NMNHDHLPSMULOY-UHFFFAOYSA-N 435.461 4.813 50 10 IJGE COc1cc(C)ccc1C(=O)NN=Cc1cc(C)n(-c2ccc(C(=O)O)c(Cl)c2)c1C 1083949429 YUSYSCXFRQATPM-UHFFFAOYSA-N 439.899 4.527 50 10 IJGE Cc1ccc(NC(=O)C(=O)NN=Cc2cc(C)n(-c3ccc(Cl)c(Cl)c3)c2C)cc1 1084002700 YKBJBQHPPCAPAF-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNC(=O)Nc1ccc(OC(F)F)cc1 1138915039 KHNHVEOWKYFDKG-KTKRTIGZSA-N 430.238 4.851 50 10 IJGE C/C(=C/c1ccccn1)C(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12 1540694114 GGKDPCLKMKLZFC-PEZBUJJGSA-N 442.906 4.815 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2cccc(Br)c2)sc2c1CCC2 1866131982 WMSLWXDUOKIXKV-UKTHLTGXSA-N 445.338 4.722 50 10 IJGE CC[C@@H](NC(=O)[C@H](c1ccc(Cl)cc1)C1CC1)C(=O)Nc1ccc(SC#N)cc1 1866999946 CPZOWEGYRHKHDV-UXHICEINSA-N 427.957 4.940 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1ccc(Br)cc1Cl 1882087697 LPSASXSHNRDWEB-NSHDSACASA-N 427.564 4.933 50 10 IJGE C[C@H](CC(=O)N(C)C[C@H]1C[C@@H]1Br)c1ccc(NC(=O)OC(C)(C)C)cc1 1887829866 OYYBWYZIWMKNAN-UNEWFSDZSA-N 425.367 4.769 50 10 IJGE Brc1ccc(OCc2ccccc2)c([C@@H](Br)[C@H]2COCCO2)c1 1899856844 MEQASXNYTRTATK-QZTJIDSGSA-N 442.147 4.880 50 10 IJGE COc1ncc(Br)c(C)c1CN(Cc1ccccc1)[C@@H](C)CBr 1902484666 PFAYVANZCYLNSY-ZDUSSCGKSA-N 442.195 4.947 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1cc(OC)c(OC)c(OC)c1 1915099079 OMFFRKKQGLXNEL-QGZVFWFLSA-N 436.346 4.528 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(Br)cc1)[C@H](F)CBr 1951578145 VHJJOQPSOWWTCM-OLZOCXBDSA-N 425.136 4.618 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@@H]2CCCCN(C[C@@H](CBr)C3CCC3)C2)C1 1966480594 CKNFHIVAFWRPCS-QZTJIDSGSA-N 429.443 4.767 50 10 IJGE C[C@@]1(CCBr)CCN(c2ncc(Br)cc2Br)C1 2014782616 JBRDBLOSTHQXQP-GFCCVEGCSA-N 426.978 4.608 50 10 IJGE Clc1nc(Cl)n(C[C@]23CC[C@@H]2CN(Cc2ccccc2)C3)c1CBr 2023079785 VXEHIRXIQULDOA-RDTXWAMCSA-N 429.189 4.997 50 10 IJGE Cc1cc(Br)ccc1S(=O)(=O)N(Cc1ccccc1)[C@@H](C)CCCl 2025939311 OPXVYKRRDAYCJR-HNNXBMFYSA-N 430.795 4.966 50 10 IJGE CCC(CC)(CBr)CN1CC=CCC12CN(C(=O)OCc1ccccc1)C2 2026494014 GSPCRHFYUATZNX-UHFFFAOYSA-N 435.406 4.841 50 10 IJGE C[C@@]1(CBr)CCCN(Cc2ccc(I)c(Cl)c2)C1 2086658088 KJDGJTSFESJHHS-AWEZNQCLSA-N 442.566 4.942 50 10 IJGE Brc1ccccc1[C@H](CI)OC[C@H]1CCCCCO1 2096321534 FMIGFOHUSVWALX-DOMZBBRYSA-N 439.131 4.901 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)c2ccccc2)C[C@@H]1CC(F)F 2177310845 AWUQVPJKENOLIA-SJORKVTESA-N 447.364 4.742 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ncc(Br)cc2Cl)C[C@@H]1CBr 2183590802 QQSHIYVIJIHSHQ-IONNQARKSA-N 436.497 4.503 50 10 IJGE C[C@@H](CC1CCN(C(=O)c2ccc(CBr)cc2)CC1)NC(=O)OC(C)(C)C 2203523109 GMKYVWYFJWMGKP-HNNXBMFYSA-N 439.394 4.737 50 10 IJGE O=S1(=O)CCCC[C@H]1[C@@H](Cl)c1cc(Br)c(Br)cc1F 2225633504 KBWSUAWJUKUKOQ-RYUDHWBXSA-N 434.552 4.598 50 10 IJGE CN[C@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@H]1Br 2250747373 LFVFLXPKQJPXLK-XOGFGSHOSA-N 433.916 4.534 50 10 IJGE COc1ccc([C@H](Br)C23CCC(CC2)OC3)cc1I 2269547073 CDOUWNBYGDQPHH-WPBUFGDCSA-N 437.115 4.695 50 10 IJGE Cc1nsc(CN(C)c2c(CBr)ccc(Br)c2Cl)n1 2273151880 XZWBEVMGNXMKFO-UHFFFAOYSA-N 425.577 4.794 50 10 IJGE CN(Cc1sccc1I)[C@H](CBr)c1ccccc1 2316764559 NTZJNKBLBPNXAR-CYBMUJFWSA-N 436.156 4.921 50 10 IJGE COc1cc(C=NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCc1cc(C)ccc1C 2322974876 CDXWPRSMHDNSKB-UHFFFAOYSA-N 433.464 4.563 50 10 IJGE Cc1ccc(CN(C)CCCCCI)c(O)c1Br 2327610610 VZDDHJPYMOQHQR-UHFFFAOYSA-N 426.136 4.500 50 10 IJGE CCCCCCOC(=O)c1ccc(NC(=O)C(C#N)=Cc2ccc(OC)c(OC)c2)cc1 2329702971 DABBDORZSLMRLS-UHFFFAOYSA-N 436.508 4.987 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(OC)c4)ccc32)c1 38684842 ATUVKQFSHLGTBN-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE CN(C)c1ccc([C@H](C(=O)NC2CCCCC2)N(Cc2ccccc2)C(=O)CCl)cc1 97914626 SVODMJREPVBQRN-XMMPIXPASA-N 442.003 4.510 50 10 IJGE CCCCOc1ccc(/C=C2\C(=O)N(CCc3ccc(OC)cc3)C(=O)C(C#N)=C2C)cc1 214403620 VXZGUQSNIGSVIH-ULJHMMPZSA-N 444.531 4.709 50 10 IJGE CCN(C[C@@](C)(CI)OCCC(C)(C)C)C(=O)OC(C)(C)C 231317830 LTSFGZXDAKFETG-QGZVFWFLSA-N 427.367 4.890 50 10 IJGE Cc1ccccc1C(=O)Oc1ccc(C=NNC(=O)COc2ccc3ccccc3c2)cc1 254403038 RMKVLRCYELFSMH-UHFFFAOYSA-N 438.483 4.897 50 10 IJGE Cc1ccc(C(C)C)cc1OCC(=O)NN=Cc1ccc(OC(=O)c2cccs2)cc1 254566527 JKDKIFNVEKWGHI-UHFFFAOYSA-N 436.533 4.928 50 10 IJGE O=C(NN=Cc1ccccc1OC(F)F)c1ccccc1OCCOc1ccccc1 254906771 RQIUSVDQQUPZPU-UHFFFAOYSA-N 426.419 4.510 50 10 IJGE Cc1cc([C@H](Br)c2cnn(C)c2I)sc1Cl 379197003 GENZYRMGCBLRFV-MRVPVSSYSA-N 431.524 4.532 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CCC(F)(F)[C@H](CCl)C1 404001755 MDAHPGJQUGFFPO-ZCFIWIBFSA-N 437.531 4.609 50 10 IJGE CC(C)(C)CN(CCBr)S(=O)(=O)c1ccc(Cl)c(Br)c1 690941906 AZZXOHMDYUSGLO-UHFFFAOYSA-N 447.620 4.534 50 10 IJGE O=C(NCC1(N(Cc2ccccc2)Cc2ccccc2)COC1)[C@H](Cl)c1ccccc1 706606365 XGOCOFHZHAGFTC-XMMPIXPASA-N 434.967 4.554 50 10 IJGE COc1cc([C@@H](C)NC(=O)NNc2cccc(F)c2F)ccc1OCc1ccccc1 745668271 UJJYINWMIDGRRH-OAHLLOKOSA-N 427.451 4.940 50 10 IJGE Cc1ccc(F)c(NNC(=O)CSc2nnc(-c3ccco3)n2C2CCCCC2)c1 768233466 XTAXUUUPUXZIPB-UHFFFAOYSA-N 429.521 4.726 50 10 IJGE O=C(CCCNc1ccc(Cl)cc1)NN=Cc1ccc(OCc2ccc(F)cc2)o1 1084433152 FYOQNMHOTLHGQT-UHFFFAOYSA-N 429.879 4.994 50 10 IJGE COc1ccc(NC(=O)/C(C#N)=C\c2cc(Br)c(OC(C)C)c(OC)c2)cc1 1084624037 UCMNFCAEVFRADN-DHDCSXOGSA-N 445.313 4.799 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cccc3nc(O)[nH]c23)c(C)n1-c1ccc(Cl)cc1 1468618010 YVTOEUYLYOCSDB-WJDWOHSUSA-N 431.883 4.875 50 10 IJGE COc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2C)CCC3)cc1 1772744378 WLYGFSZHHGZSRT-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE CC[C@@H](C)NC(=O)c1oc2c(c1C)C(=NNC(=O)Cc1coc3cc(C)cc(C)c13)CCC2 1772751518 DYOUNARCJSUTLE-MRXNPFEDSA-N 449.551 4.879 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1(C)C 1881456382 TUDYBADABYGPHP-UONOGXRCSA-N 435.403 4.700 50 10 IJGE CC(C)[C@H](C)[C@H](C)OC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1901489473 BLMDYCRCFHTXKS-GJZGRUSLSA-N 439.378 4.888 50 10 IJGE CC(C)[C@@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1cscc1Br 1915281672 SEBSPGIRPCRVMK-OAHLLOKOSA-N 436.824 4.965 50 10 IJGE O=C(NCC1(CCBr)CC1)c1csc(Br)c1Br 1945189169 KOEGCZZXBOMPGE-UHFFFAOYSA-N 446.002 4.568 50 10 IJGE CC(C)N1C[C@@H](Br)[C@@H](c2c(Br)cccc2Br)C1 1950852597 ZVENDVCXTRCZRS-JOYOIKCWSA-N 425.990 4.783 50 10 IJGE C[C@@H]1C[C@@H](Br)CN(Cc2cc(Br)ccc2Br)C1 2006497153 QJYUCIKZJWERBG-BXKDBHETSA-N 425.990 4.817 50 10 IJGE C[C@@H]1CCCN(C[C@@H](Br)C(F)(F)F)[C@@H]1CCCNC(=O)OC(C)(C)C 2044704975 HXTCPTGLCSJPJA-MGPQQGTHSA-N 431.337 4.718 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3C[C@@H](Br)C[C@H]2C3)c1 2054715246 VVSGJURMHMHLBB-ZWKOPEQDSA-N 438.001 4.959 50 10 IJGE CC(C)CN(Cc1ccccc1)S(=O)(=O)c1cc(CBr)n(C(C)C)c1 2059311926 DDILNYUKOCNPLE-UHFFFAOYSA-N 427.408 4.811 50 10 IJGE Cc1cc(C)c(O)c(-n2nc(CBr)c(Br)c2C(F)(F)F)c1 2079235989 LBMFIVMGAHSRRM-UHFFFAOYSA-N 428.046 4.871 50 10 IJGE COCc1cc(Br)c([C@H](Cl)c2nn(C)c(Br)c2C)s1 2111930337 QYYBAQWDUJTHLR-SECBINFHSA-N 428.577 4.790 50 10 IJGE Cc1cc(C(=O)NC[C@@H](Br)CC(C)(C)C)ccc1I 2142105347 CNAAHWSQSUJMGU-LBPRGKRZSA-N 438.147 4.529 50 10 IJGE O=S(=O)(c1cc(Cl)c(Br)s1)N(CCCl)Cc1cccs1 2171095213 WFTHMGRIZOOTFQ-UHFFFAOYSA-N 435.217 4.655 50 10 IJGE CCc1nn(C)c(C(=O)N(Cc2ccccc2)[C@H](CBr)C(C)C)c1Cl 2224042661 UJLOPCYBEYHENP-MRXNPFEDSA-N 426.786 4.698 50 10 IJGE Cc1nnsc1Cn1c(CCl)nc2cc(Br)c(Br)cc21 2234069823 SNGFKEHCCDWKPE-UHFFFAOYSA-N 436.560 4.508 50 10 IJGE O=[N+]([O-])c1ccc(N2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)cc1CBr 2234718970 GOOCVBYJQYILLB-BGYRXZFFSA-N 430.346 4.733 50 10 IJGE COc1ccc([C@@H](Br)c2sccc2F)cc1I 2248884590 HADAGJBNYRJKIN-LLVKDONJSA-N 427.076 4.985 50 10 IJGE C[C@H]1CCN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@@H]1CBr 2285959315 PQBBSOPSAXUTKP-IUCAKERBSA-N 427.539 4.735 50 10 IJGE CCOc1cccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3ccc4c(c3)OCO4)c2C)c1 2294193374 JSRANXZWQRPABZ-UHFFFAOYSA-N 429.476 4.767 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)C=Cc3ccccc3)ccc2[C@H]1c1ccc(F)c(F)c1 2297679818 RZIGPCLOQPRXSH-XMMPIXPASA-N 430.410 4.802 50 10 IJGE ClC[C@]1(Cc2ccc(I)c(Br)c2)CC=CCO1 2306230782 BFUDMWGAZNTXON-CYBMUJFWSA-N 427.507 4.550 50 10 IJGE COc1cc(C=C(C#N)C(=O)NC2CCCCC2)c([N+](=O)[O-])cc1OCc1ccccc1 2313511195 TVMYWLZRAWZPHC-UHFFFAOYSA-N 435.480 4.538 50 10 IJGE C[C@@H](Cl)CCCN(C)C(=O)c1ccc(Br)cc1I 2314589011 ULDVYTYAAPUDJD-SECBINFHSA-N 444.538 4.533 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)C=Cc2ccc(OCCC)cc2)cc1 2314777764 SZSACGNWJAQWLZ-UHFFFAOYSA-N 432.520 4.917 50 10 IJGE CCCNC(=O)C(C#N)=Cc1ccc(OC(=O)CCc2ccc(C(C)(C)C)cc2)c(OC)c1 2314790267 YUHCXKPEWDJMIP-UHFFFAOYSA-N 448.563 4.964 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@H]2[C@H](CBr)C3)c(I)c1 2318546488 SQECZVSKQWJOEB-JKOKRWQUSA-N 440.550 4.692 50 10 IJGE COc1ccccc1C(C#N)=Cc1ccc(OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 2320507251 IPFQNUHOKNHGDM-UHFFFAOYSA-N 445.387 4.795 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc(-c3cccc(OC)c3)nc2C)cc1OCC 2321239437 DTZVNECRKPLQJO-UHFFFAOYSA-N 433.508 4.627 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OCc1cccc(Cl)c1 2321677303 MGWQHGZGURLEAW-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3[C@@H]4CC[C@@H](CN4C(=O)OC(C)(C)C)[C@H]3C2)C1 2371131628 PPUDINVNWYDILO-MHORFTMASA-N 441.454 4.765 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1Cl)c1ccc(OCCc2ccccc2)cc1 14041572 JUHQLEXZKZYNFR-UHFFFAOYSA-N 429.303 4.690 50 10 IJGE COc1ccc(/C(C#N)=C\c2ccc(OC(=O)COc3ccccc3OC)c(OC)c2)cc1 31902273 RRKNINFOCWOJED-ZHZULCJRSA-N 445.471 4.761 50 10 IJGE CCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)c2ccc(Cl)c(Cl)c2)c(OC)c1 40884540 XZRPZGUAVQMUFG-OQLLNIDSSA-N 433.291 4.654 50 10 IJGE CCOc1ccc(/C=C(\C#N)C(=O)Nc2nc(-c3ccccc3OC)cs2)cc1OC 40977742 XCLPMHGFIGSROD-LFIBNONCSA-N 435.505 4.772 50 10 IJGE CCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C/c2ccc(OCCC)cc2)c(OC)c1 98027939 FANSOMOVIIKYIZ-ASBGPMMZSA-N 448.519 4.536 50 10 IJGE CC(C)N(CCCBr)C(=O)c1cc(Br)ccc1Br 161193814 FXWAFQIGFHVYHD-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE CC[C@@H](Br)C(=O)Nc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OC 170508084 IGQFGQYWGCJFJC-SSDOTTSWSA-N 436.089 4.547 50 10 IJGE O=C(c1ccc(Br)cc1Br)N(CCBr)C1CCC1 232486721 IVMCCOFJOHUNPO-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE CC[C@](C)(CO[C@H](CI)c1ccccc1Br)OC 319061833 HPUWMUSDAXZJIJ-ZIAGYGMSSA-N 427.120 4.757 50 10 IJGE C[C@@H](Cl)c1nc2c(Br)cccc2n1C[C@@H]1CN(Cc2ccccc2)CCO1 380403928 BZYFXZNOUCJUNH-WBVHZDCISA-N 448.792 5.000 50 10 IJGE CC1(C)C[C@H](Cl)CCN(C(=O)c2ccc(I)c(Cl)c2)C1 395351947 SDUAUMIZNMWAMM-LLVKDONJSA-N 426.125 4.814 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@@H]2CC[C@@H](Cl)C[C@H]2C1 398668293 GWHNQCVGIYFIOW-XHNCKOQMSA-N 427.589 4.753 50 10 IJGE C[C@@H]1CCN(Cc2cc(Cl)ccc2I)C[C@H]1Br 405345546 PWQOHZCAJDYLTA-BXKDBHETSA-N 428.539 4.550 50 10 IJGE O=C(CBr)c1cc(I)c(F)c(SC(F)(F)F)c1 575705414 YCWOTRHARYZKMH-UHFFFAOYSA-N 442.997 4.620 50 10 IJGE CN(C(=O)c1ccc(Br)cc1Br)[C@@H]1CCC[C@@H]1Br 709268699 RVBXEELKOPVBRN-CMPLNLGQSA-N 439.973 4.600 50 10 IJGE CC(=NNC(=O)c1ccc(CSc2nncn2C)cc1)c1ccc(-c2ccccc2)s1 744608963 YGRSMKXGLJROCL-UHFFFAOYSA-N 447.589 4.990 50 10 IJGE COc1cc(/C=C(/C#N)c2ncc(C(F)(F)F)cc2Cl)ccc1OCCC(=O)O 763372203 ARNISEJXVGEZTN-SDQBBNPISA-N 426.778 4.680 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)N2CCn3c(C(C)C)nnc3[C@@H]2C)c1C 784695467 FFGMWGGHHUCLHG-ISXGRJCASA-N 442.567 4.628 50 10 IJGE CC(=NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)[C@H](C)CCCCC(=O)O 814703474 DIVVTEPUADUDOH-GOSISDBHSA-N 432.524 4.926 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)c1ccc(OCc2cscn2)c(OC)c1 914445973 LMLDTKXNWILRBU-UHFFFAOYSA-N 426.450 4.587 50 10 IJGE CC(=NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2)c1ccc([S@](=N)(=O)O)cc1 916356333 RZYIGUOZUOHJTR-MRXNPFEDSA-N 433.599 4.932 50 10 IJGE CCCOc1ccc(OC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cc1 916853647 DJMMQJWYUJSBQH-CAPFRKAQSA-N 426.476 4.765 50 10 IJGE C[C@@]12CC[C@@H]3c4ccc(O)cc4CC[C@@H]3[C@@H]1CCC2=NNC(=O)c1cccc([N+](=O)[O-])c1 1084617547 PEVAPRZFSJGMGN-HXKBJWFLSA-N 433.508 4.943 50 10 IJGE Cc1c(O)nc2ccccc2c1C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2 1538732183 YIEDCYYBNYGRCD-HNNXBMFYSA-N 437.565 4.536 50 10 IJGE C=CC1(CC(=O)NNc2c(Cl)cc(Cl)cc2Cl)CN(C(=O)OC(C)(C)C)C1 1624099060 XFGHORRZQDYPLS-UHFFFAOYSA-N 434.751 4.903 50 10 IJGE C=CC[C@@H]1CCCC[C@@H]1NC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1 1687035978 FKQCOUBMFGWYHD-GCJKJVERSA-N 441.959 4.998 50 10 IJGE CCc1nn(Cc2ccc(F)cc2)c2c1[C@@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 1865685756 MLHBHHHLQJCFMH-GOSISDBHSA-N 426.854 4.644 50 10 IJGE CCc1nn(-c2ccc(Br)cc2)c2c1[C@@H](c1ccccc1C)C(C#N)=C(N)O2 1865712656 DVJKJJLCWCBCHC-IBGZPJMESA-N 435.325 4.724 50 10 IJGE CCc1nn(C)c(CN(Cc2ccccc2)[C@@H](C)CCBr)c1Br 1915116937 ZZJIVIAGUYXFMJ-AWEZNQCLSA-N 443.227 4.921 50 10 IJGE CCN(C[C@@](C)(CI)O[C@H](C)CC1CC1)C(=O)OC(C)(C)C 1917441095 CLQINUIVMWEQNR-CXAGYDPISA-N 425.351 4.642 50 10 IJGE C[C@@H]1CO[C@@](CBr)(Cc2cccc(Br)c2Br)C1 1943885433 FRIXRYSLOCFPBL-TVQRCGJNSA-N 426.974 4.944 50 10 IJGE Cc1ccc(C(F)(F)F)c(C[C@@H](Br)CN2C(=O)c3ccccc3C2=O)c1 1994839437 GXLFGKJELBDKRC-CYBMUJFWSA-N 426.232 4.616 50 10 IJGE CC1CC(CBr)(NC(=O)c2scc(Br)c2Br)C1 1999807965 HKBMZJMPNJRNIC-UHFFFAOYSA-N 446.002 4.567 50 10 IJGE COc1ccc([C@@H](Cl)c2cc(I)sn2)cc1Br 2007646224 WIMRWOKLYXQTOG-LLVKDONJSA-N 444.519 4.847 50 10 IJGE C=CCC[C@@H](CBr)NC(=O)c1csc(Br)c1Br 2019482388 FPYABDHLOVDBNP-ZETCQYMHSA-N 446.002 4.733 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](OC[C@H]2C[C@H]2C2CCCCC2)C1 2022594682 LRSYEJWNDGURFI-LTIDMASMSA-N 449.373 4.642 50 10 IJGE O=C(NC1(CCCBr)CC1)c1c(Br)cccc1Br 2033091281 OYPHNDHYVUCTHD-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(NS(=O)(=O)CCC(CCl)CCl)c(Cl)c1 2106298488 NTEFKMQPJMMPFJ-UHFFFAOYSA-N 445.796 4.913 50 10 IJGE CCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](Br)C1CCCC1 2110714207 AZIFTPBTDYQHMU-IRXDYDNUSA-N 431.415 4.578 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)C(C)(C)C)C[C@@H]1CC(F)(F)F 2119512310 FQUFTGVCMNRECR-KBPBESRZSA-N 445.364 4.917 50 10 IJGE Brc1ccc([C@H](CI)OC[C@H]2[C@H]3C[C@@H]4[C@H]2[C@@H]4C3)cc1 2134537920 KAVAGYWYUXTZBU-NAXIGVNNSA-N 433.127 4.844 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)c(Br)c2F)C[C@H](CCBr)O1 2179383368 SNLCMUWILOPMQA-KOLCDFICSA-N 429.555 4.616 50 10 IJGE ICCCCCN1CC[C@]2(CCCN(Cc3ccccc3)C2)C1 2211186215 NUQPMUASBOXYLU-HXUWFJFHSA-N 426.386 4.580 50 10 IJGE Cc1sc(C(=O)N2C[C@]3(F)CCC[C@]3(CBr)C2)cc1Br 2234472769 YFJKFHYNYIYUHI-UONOGXRCSA-N 425.161 4.548 50 10 IJGE CC(C)(C)C[C@H](CBr)NC(=O)Cc1ccc(Br)cc1Cl 2237441210 PNPRJHYRCMYWEO-GFCCVEGCSA-N 425.592 4.961 50 10 IJGE CCCN(C[C@@H](C)Br)C(=O)c1c(Br)cccc1Br 2259744036 ABDCBQSOLWWDAD-SECBINFHSA-N 441.989 4.847 50 10 IJGE CC1CC(CBr)(CN2CCC([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)C1 2265313273 GBDDBYIXLHADIP-JGCRXCKMSA-N 429.443 4.767 50 10 IJGE Cc1cc(=O)oc2cc(NC=C(C#N)c3nc(-c4ccc5c(c4)OCO5)cs3)ccc12 2295945897 RPNVJAVUBZRVPW-UHFFFAOYSA-N 429.457 4.930 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccc(C(F)(F)F)c(Cl)c2)cc(OC)c1OC 2314571448 FNDTWOJVXQUPCI-UHFFFAOYSA-N 440.805 4.930 50 10 IJGE CC(C)c1ccccc1OCC(=O)Oc1ccc(C=C(C#N)C(=O)NCc2ccco2)cc1 2314760657 UPNDKTFRRQDUEK-UHFFFAOYSA-N 444.487 4.611 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Br)c2)C[C@H]1CCl 2325217796 IDNYZIKNHYKIPB-LLVKDONJSA-N 442.566 4.751 50 10 IJGE Cl[C@H]1CN(Cc2ccc(I)c(Br)c2)C2(CCC2)C1 2325219081 VLUKTSQXOMCBKW-LLVKDONJSA-N 440.550 4.790 50 10 IJGE N#CC(=C(O)CN1C(=O)c2ccccc2C1=O)c1nc(-c2ccc(Cl)s2)cs1 2331400823 ZQJOEBQXRNWLFU-UHFFFAOYSA-N 427.894 4.614 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C/c2cccc(Cl)c2)c(OC)c1 40993280 HLJBARDEQPYTEM-JDCCHMEXSA-N 438.911 4.791 50 10 IJGE C[C@](CI)(OC[C@H]1CCCCO1)c1ccccc1Br 161961009 SMNUBASHXIIXIA-IUODEOHRSA-N 439.131 4.685 50 10 IJGE CC(CC(=O)NC12CC3CC(CC(C3)C1)C2)=NNC(=O)Cc1ccc(-c2ccccc2)cc1 252607357 HBGDMXPYLWJCMO-UHFFFAOYSA-N 443.591 4.863 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=NNC(=O)CSCc3ccc(C)cc3)o2)cc1 254300931 UVNLRYZIRSSICV-UHFFFAOYSA-N 436.533 4.815 50 10 IJGE COc1ccc(CC(=O)NN=Cc2c(C)n(Cc3ccccc3)c3ccccc23)cc1OC 254378603 SZEGHWJZQARFQS-UHFFFAOYSA-N 441.531 4.708 50 10 IJGE COc1ccc2ccccc2c1C=NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1 254405143 WXUOVBFZILDLAE-UHFFFAOYSA-N 435.483 4.916 50 10 IJGE C=CCOc1ccc(C(=O)NN=Cc2ccc(OC(=O)c3ccc(OCC)cc3)cc2)cc1 254444004 LNFJJMBYGOSOLB-UHFFFAOYSA-N 444.487 4.633 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc(COc3cccc4cccnc34)cc2)cc1OC 254762757 AIZKZMISPKOJRM-UHFFFAOYSA-N 441.487 4.595 50 10 IJGE C[C@@H](Br)c1cn(-c2c(Br)cc(Cl)cc2Br)nn1 304158687 VNWQDQGXPPHGBJ-RXMQYKEDSA-N 444.352 4.902 50 10 IJGE CC1(C)CN(C(=O)c2cc(Br)c(Br)s2)C[C@H]1Br 387912599 VZLHFMDEGYGHNK-MRVPVSSYSA-N 446.002 4.519 50 10 IJGE CC(C)S(=O)(=O)CCC[C@H](CBr)Cc1ccccc1Br 696943475 HSCBOVXSFCAKMH-ZDUSSCGKSA-N 426.214 4.606 50 10 IJGE CN1CCC[C@H](CNC(=O)NNc2cc(C(F)(F)F)ccc2F)[C@@H]1c1cccs1 754646333 MIUJNHMRRLYQCC-SJKOYZFVSA-N 430.471 4.615 50 10 IJGE CC(=O)N(c1nc(/C=C(\C#N)C(=O)c2cccc(C#N)c2)cs1)c1ccc(F)cc1F 771535691 ZGOLLLBARLOBBM-LZYBPNLTSA-N 434.427 4.767 50 10 IJGE Cc1ccc(F)c(NNC(=O)C(=O)Nc2ccc3c(c2)CN(c2ccc(C(C)C)cc2)C3)c1 784885186 GSBLVBQVQOTODR-UHFFFAOYSA-N 446.526 4.860 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(Cl)cc2C(=O)c2ccc[nH]2)c(C(F)(F)F)c1 799408390 OBHMCWWZBUFPCQ-UHFFFAOYSA-N 447.804 4.938 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc(OCc3ccc(Br)cc3)cc2)cc1 1081086645 DTXNQXUNHBGRPX-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE C=C[C@@H]1OCC[C@H]1NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1129009217 SAHFYWPRDYVNOC-VLSBCQGMSA-N 430.335 4.768 50 10 IJGE C/C(=C/C(=O)NNC(=O)Nc1ccc(Br)cc1)c1cccc(C(F)(F)F)c1 1467430038 UMKUJGDPUFIZPB-LUAWRHEFSA-N 442.235 4.724 50 10 IJGE CCc1nn(-c2ccc(C)cc2)c2c1[C@H](c1ccc(OC(C)C)c(OC)c1)C(C#N)=C(N)O2 1865696753 KBMXGCKQTHHOEL-HSZRJFAPSA-N 444.535 4.757 50 10 IJGE CCCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@H](c1cccn1C)C(C#N)=C(N)O2 1865699126 LRRKUGPRZHNAAT-IBGZPJMESA-N 442.350 4.747 50 10 IJGE Cc1nn(-c2cccc(Cl)c2)c2c1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865705974 KZQRLIZZHGZFFV-GOSISDBHSA-N 442.262 4.614 50 10 IJGE N#C/C(=C(/O)CNC(=O)c1ccc(Cl)cc1)c1nc(-c2ccc(F)cc2F)cs1 1872817954 FGQHNRYRWWYEJG-SDXDJHTJSA-N 431.851 4.964 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C)C[C@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1880767117 NBBLDLXAZCITHG-KBUPBQIOSA-N 435.403 4.556 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@H](CCl)C2(CCC2)C1 1914487059 QDCZWNCXTVFLAN-QMMMGPOBSA-N 427.589 4.754 50 10 IJGE BrC[C@@H]1CCCCN1Cc1ccc(Br)cc1Br 1943840842 DNRVVZNMPYGLOK-LBPRGKRZSA-N 425.990 4.961 50 10 IJGE FC(F)(F)[C@H](CBr)NCc1ccc(Br)cc1Br 1943846194 LFHLXZXIZUAZNE-VIFPVBQESA-N 439.895 4.627 50 10 IJGE CCN(C)C[C@H](Br)CCc1c(Br)cccc1Br 1949935605 WEVRDEVJORYPKQ-SNVBAGLBSA-N 428.006 4.859 50 10 IJGE C[C@H]1C[C@@H]1N(CCBr)C(=O)c1csc(Br)c1Br 2002026025 IDELYSVBJLKJDC-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE CCC[C@H](CBr)CNC(=O)c1csc(Br)c1Br 2008109180 QVMLPHCBSAHXRE-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2C[C@H]1CC[C@@H]2Br 2033087198 ULZJZHAXQVASIH-FOGDFJRCSA-N 438.001 4.959 50 10 IJGE CC(C)[C@H](Br)[C@@H](C)NC(=O)c1cc(Br)ccc1Br 2041309121 XTEDTRGZVKUGEN-PELKAZGASA-N 441.989 4.749 50 10 IJGE FC(F)Oc1cc(I)c(CBr)c(OC(F)(F)F)c1 2060221167 MLXKPDVJESZVMF-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE CN(C(=O)c1ccc(Br)cc1I)C(C)(C)CCCl 2086151624 QHWXTLHKEPGZTA-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@H](CBr)C(C)(C)C)CC[C@H]1C(F)(F)F 2106781641 JVENBZGPLGFLAL-BFHYXJOUSA-N 445.364 4.821 50 10 IJGE COc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)C(C)C)cc1CBr 2123270866 OTABEKQZHCBPMN-INIZCTEOSA-N 440.403 4.826 50 10 IJGE O=C(NC[C@@]12CCC[C@@]1(CCl)C2)c1scc(Br)c1Br 2142937695 SHSSBUPYVMCQPO-STQMWFEESA-N 427.589 4.802 50 10 IJGE Fc1cc(CBr)ccc1N1CCC[C@@]2(CN(Cc3ccccc3)CCO2)C1 2151740887 ULAMWNWNYSEDBU-JOCHJYFZSA-N 433.365 4.592 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC2(CCC2)[C@H]1NC(=O)[C@@H](Br)C1CCCC1 2167033559 RVYFYIRPYGYESJ-ULQDDVLXSA-N 443.426 4.530 50 10 IJGE CN(CC1(C)CCCC1)S(=O)(=O)c1cc(CBr)sc1Br 2179790889 JZGSPHSDJUEARW-UHFFFAOYSA-N 445.242 4.606 50 10 IJGE C[C@@H](CC1CCN(C(=O)[C@H](Br)C2CCCC2)CC1)N(C)C(=O)OC(C)(C)C 2203636460 BAOMZIKYHCBZAE-MAUKXSAKSA-N 445.442 4.824 50 10 IJGE Br[C@@H]1CCC[C@@H]2CN(Cc3ccc(I)cc3)CC[C@H]21 2225475349 UMUUTYXWLIRBDT-FVQBIDKESA-N 434.159 4.677 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1Cc1nncs1 2234069146 QVFSTHYNVORTDH-LURJTMIESA-N 436.560 4.761 50 10 IJGE Cc1c(Br)ccc([C@@H](Cl)[C@H]2C[C@H](S(C)(=O)=O)C2)c1Br 2269777926 YQHPPHQWPSMLFF-RVBZMBCESA-N 430.589 4.623 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H](CBr)[C@H]2CC[C@@H]1C2 2285846617 QALOAQLFQPJNSJ-HHURGBBESA-N 425.523 4.630 50 10 IJGE N#CC(=Cc1ccccc1OCc1ccc(Br)cc1)C(=O)NCc1ccco1 2295459610 FSIAJBNMBRTOMH-UHFFFAOYSA-N 437.293 4.844 50 10 IJGE Cc1ccc(CBr)cc1NC(=O)c1cc(I)ccc1F 2296111258 AJYOROMUYIPBKR-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE N#CC(=Cc1cccn1-c1ccc([N+](=O)[O-])cc1)C(=O)Nc1sc2c(c1C#N)CCCC2 2314490089 YBYIXHFILWBHOR-UHFFFAOYSA-N 443.488 4.743 50 10 IJGE C=CC[C@@H](Br)[C@@H]1CCN1Cc1ccc(Cl)c(I)c1 2315549153 ORTOIOCMXGTPGR-RISCZKNCSA-N 440.550 4.859 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Br)[C@@H]1COCCO1 2317395530 JGSNJZXITGNGSJ-WPRPVWTQSA-N 446.936 4.511 50 10 IJGE CN(Cc1cc(I)ccc1Cl)C[C@H]1CCC[C@@H]1Br 2327398477 FCFDIZXLYBBBLY-MFKMUULPSA-N 442.566 4.940 50 10 IJGE Cc1c(Br)sc([C@@H](Br)[C@]23CCC[C@H]2CS(=O)(=O)C3)c1C 2358570930 CHAKOKARWRQJAP-SUHUHFCYSA-N 442.238 4.778 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(OCc2cc(C(C)(F)F)ccn2)C1 2381515449 PPASWEHHDBJDLJ-LJQANCHMSA-N 449.336 4.875 50 10 IJGE Cc1ccccc1Oc1nc2ccccn2c(=O)c1/C=C(/C#N)c1nc2ccccc2n1C 35549934 ZSFAAOIVKAARRK-SDXDJHTJSA-N 433.471 4.746 50 10 IJGE C=CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2F)cc1 38652066 HQGUMAWBPYHMGX-XMMPIXPASA-N 442.446 4.828 50 10 IJGE CCc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2OC)CCC3)cc1 40813149 XXPJHIPGQCXZSC-VFCFBJKWSA-N 445.519 4.882 50 10 IJGE Cc1c(C(=O)N2CCCc3ccccc32)oc2c1/C(=N/NC(=O)c1cccs1)CCC2 40823721 BVPMIYZEVIDYQX-KOEQRZSOSA-N 433.533 4.713 50 10 IJGE C[C@@H](Cc1cccs1)N(C)S(=O)(=O)c1cc(CCl)sc1Br 123458091 SQVJDRLAMYNOBO-VIFPVBQESA-N 428.826 4.563 50 10 IJGE COc1ccc(Cl)c(CC(=O)N/N=C/c2c(O)ccc3cc(Br)ccc23)c1 169922028 PQFSBSKZOCJDJD-FOKLQQMPSA-N 447.716 4.663 50 10 IJGE COc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccs2)cc1 205646765 FOUBXOKWNIINKE-UTFPEODTSA-N 430.485 4.594 50 10 IJGE CCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C\c2ccccc2OCCC)c(OC)c1 207004389 QPQSETPZWGSAEL-VUTRRGLJSA-N 448.519 4.536 50 10 IJGE CCCOc1ccc(/C=C2\C(=O)N(Cc3ccc(F)cc3)C(=O)C(C#N)=C2C)cc1OCC 214410592 LHGGDOGTGDMPCQ-BKUYFWCQSA-N 448.494 4.806 50 10 IJGE CCCCOC(=O)c1ccccc1N/C=C(/C#N)C(=O)Nc1cc(Cl)ccc1OC 217164392 UFSTWVPVWLGHNL-PFONDFGASA-N 427.888 4.764 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2cc(I)ccc2F)[C@@H](CCl)C1 394695184 SLTGYLUNGZXWMP-GWCFXTLKSA-N 439.696 4.620 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCCC[C@@H]1CBr 705397011 BQNRDCTVXSOAPG-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE Cc1ccccc1COc1cccc(NC(=O)NNC(=O)c2cccc3cccnc23)c1 756543576 DGQVJSALMMCTRI-UHFFFAOYSA-N 426.476 4.589 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2ccc3c(c2F)CCNC3=O)c(C)n1C1CCCCC1 791356293 ISBJSVVMNFHJGU-QGOAFFKASA-N 434.515 4.581 50 10 IJGE Cc1cc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)c2ccc(Br)cc2n1 799753826 UOJQTZAQWNHVIQ-UHFFFAOYSA-N 449.230 4.953 50 10 IJGE Cc1cccc(Cn2cc(C=NNC(=O)CC[C@H](O)c3ccccc3)c3ccccc32)c1 1084281777 BKDLQPJGXQKYQF-SANMLTNESA-N 425.532 4.962 50 10 IJGE Cc1cccc2c(C=NNC(=O)C(=O)Nc3ccccc3Cl)c(-c3ccccc3)[nH]c12 1084477922 UBCWXGNBLQVODR-UHFFFAOYSA-N 430.895 4.886 50 10 IJGE C/C=N/NC(=O)CC[C@H](C)[C@@H]1CC[C@@H]2[C@H]3[C@H](O)C[C@H]4C[C@@H](O)CC[C@]4(C)[C@@H]3CC[C@]12C 1085895347 JACKUUJOKIRMRC-QUWLIFAQSA-N 432.649 4.515 50 10 IJGE C=C(C)[C@@H](NC(=O)NNc1ccc(OC)cc1Br)c1ccc(F)c(F)c1 1226661691 SVHIJZXUGMLRBO-QGZVFWFLSA-N 426.261 4.679 50 10 IJGE C/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl 1524625797 XAATVCCEKXTTLP-QBFSEMIESA-N 425.287 4.542 50 10 IJGE Cc1c(C(=O)N2CCCC[C@H]2C)oc2c1C(=NNC(=O)c1cccc(Cl)c1)CCC2 1772746490 WHQWYEAZIVNKGO-CQSZACIVSA-N 427.932 4.726 50 10 IJGE Cc1cc(C)cc(NC(=O)COc2cccnc2NC(=O)Nc2ccc(SC#N)cc2)c1 1858833710 YIHXTDIVJNLNKC-UHFFFAOYSA-N 447.520 4.933 50 10 IJGE CN(C)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccc2)cc1 1865683010 CUSLRGCOZWCSKA-HSZRJFAPSA-N 433.515 4.823 50 10 IJGE COc1ccc(-c2nn(Cc3ccc(C)cc3)c3c2[C@@H](c2ccccn2)C(C#N)=C(N)O3)cc1 1865700572 XQRQOBOPFJJQMM-HSZRJFAPSA-N 449.514 4.529 50 10 IJGE Cc1cnc2c(S(=O)(=O)N(Cc3ccccc3)C[C@H](C)Br)cccc2c1 1914654074 CEZJCVIXOXEXTO-INIZCTEOSA-N 433.371 4.518 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1ncsc1Br 1915272928 ZMMCOVIGYJUXHO-CYBMUJFWSA-N 446.208 4.968 50 10 IJGE F[C@]1(CBr)CCN(Cc2cc(Br)ccc2Br)C1 2006501369 VXYCIHPIKXHMGP-LBPRGKRZSA-N 429.953 4.521 50 10 IJGE C[C@@H](Br)C12CCC(CC1)N2c1ncc(Br)cc1Br 2035844656 NCWMNWGVANIPBM-NCZMNARYSA-N 438.989 4.891 50 10 IJGE C[C@@](CCl)(NC(=O)c1scc(Br)c1Br)C(F)(F)F 2043174593 RFTQEIUKHZCUIM-QMMMGPOBSA-N 429.483 4.563 50 10 IJGE CC(C)[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)CC[C@@H]1C(F)(F)F 2044699516 LWTPHWACRTZSMA-ZIAGYGMSSA-N 431.337 4.527 50 10 IJGE CN(C(=O)c1sccc1I)C1(CBr)CCCCC1 2050803470 PVPFMCSCZVJUNA-UHFFFAOYSA-N 442.160 4.523 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1c(Br)cccc1Br 2081245320 DMCASVTVIOAAKP-GZMMTYOYSA-N 441.989 4.751 50 10 IJGE Cn1nc(COc2ccc(CBr)cc2Cl)c(Br)c1Cl 2096689049 UDNNZONTJVAFRE-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE O=C(N(Cc1ccccc1)[C@H](CBr)C1CC1)C1(C(F)(F)F)CCOCC1 2116582133 YIZNIKYKKHODFS-MRXNPFEDSA-N 434.296 4.548 50 10 IJGE Brc1cccc([C@@H](CI)OC[C@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)c1 2134537846 FKOJSISRKQDBLI-YSHXYTTRSA-N 433.127 4.844 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Br)c1cnc(Cl)n1C 2138246561 PEIASRHDXALFEW-JTQLQIEISA-N 428.939 4.982 50 10 IJGE COCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)CC1(CBr)CCCCC1 2163058636 MCXGBYWUANWTNW-GOSISDBHSA-N 447.458 4.680 50 10 IJGE Cn1ncc(Cl)c1CC(CBr)(CBr)c1ccccc1Cl 2168230701 BJEPRMCEPABFKX-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE CN(C(=O)c1cc(Cl)ccc1I)[C@H]1CCCCC[C@@H]1Cl 2172546797 IXIABOXLUUPNIA-JSGCOSHPSA-N 426.125 4.957 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CN(CCCCCCCCCBr)C[C@@H]1CCO2 2175184360 VEVBXYLABDKOOQ-GHTZIAJQSA-N 447.458 4.728 50 10 IJGE CCCN(CCCCI)C1CCC(NC(=O)OC(C)(C)C)CC1 2243586110 LNZCBAWVEGNKNT-UHFFFAOYSA-N 438.394 4.750 50 10 IJGE C[C@@]1(CBr)C=CCCN1Cc1ccc(I)c(Cl)c1 2253525443 DDIVGNODKJFXLM-AWEZNQCLSA-N 440.550 4.860 50 10 IJGE O=C(N[C@@H](CCl)c1cccs1)c1ccc(Cl)c(I)c1 2268354149 BMAXKSZVOOUUGX-NSHDSACASA-N 426.106 4.716 50 10 IJGE Cc1ccc(CBr)cc1NC(=O)c1ccccc1I 2278649876 KFMSZFSDBQYTPP-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE C[C@H]1CC[C@@H](CBr)CN1C(=O)c1cc(F)c(Br)cc1Cl 2282973915 FIRFQSMFJVFMHD-IUCAKERBSA-N 427.539 4.877 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@H]2C[C@@H](Br)C[C@H]1C2 2285849453 ZAAWTQVMBMMXKY-DJLDLDEBSA-N 425.523 4.630 50 10 IJGE CCc1ccc(-c2csc(C(C#N)=CNc3cc(C(=O)OC)cc(C(=O)OC)c3)n2)cc1 2296024867 VEIGPXCHHDRFOZ-UHFFFAOYSA-N 447.516 4.922 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1Cc1ccc(Cl)c(I)c1 2300238728 OJYYZBVFAARIMT-RNCFNFMXSA-N 428.539 4.692 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@@H](OC[C@@H]2C[C@H]3CCC[C@H]2CC3)C1 2301132084 UXWADPLOJUNPPO-WOYTXXSLSA-N 449.373 4.642 50 10 IJGE CC1(C)[C@H](CBr)CCN1Cc1ccc(Cl)c(I)c1 2315553599 UVJAPEUCPTYDFI-NSHDSACASA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@](C)(CBr)C(C)(C)C)C[C@H]1C(F)F 2327093817 UTTCJVYBRFPHAJ-VFVRVIDISA-N 427.374 4.524 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@H]2CC[C@@H](Cl)[C@@H]1C2 2330962920 HZQAYYJCQHGBND-QNSHHTMESA-N 427.589 4.895 50 10 IJGE CC1(C)CN(C(=O)c2ccc(Cl)cc2I)C[C@@H]1CCCl 2365594921 DOAAGGDHKSMKBY-JTQLQIEISA-N 426.125 4.672 50 10 IJGE CC(C)(C)[C@](C)(CBr)CS(=O)(=O)Cc1cccc(Br)c1 2380274633 HILMCDSYTAWUPT-OAHLLOKOSA-N 426.214 4.811 50 10 IJGE CCO[C@@H](Nc1ccc(C(=O)C(Cl)Cl)cc1)C(=O)c1cc([N+](=O)[O-])ccc1Cl 3609643 HJSHVUYWXKYBHW-GOSISDBHSA-N 445.686 4.892 50 10 IJGE CC(C)CCOc1ccc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cc1 14036663 HJHVTZDJELXEHX-UHFFFAOYSA-N 432.520 4.619 50 10 IJGE CCCCC/C(C)=N/NC(=O)COc1c(C)cc(Br)cc1Br 66202087 GUTZGOHMHUOIBU-XDHOZWIPSA-N 434.172 4.971 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Cl)c3ccc(F)cc3Br)cc2[nH]1 109883892 CJQUPVRZROBVAY-CYBMUJFWSA-N 434.490 4.849 50 10 IJGE Cc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2F)cc1 205644797 OMBCEEXOFXSFPP-VPUOEENPSA-N 426.447 4.971 50 10 IJGE N#C/C(=C/c1cc(Br)c2c(c1)OCO2)C(=O)Nc1cccc(C(F)(F)F)c1 207813189 ZZOIFUNWDBBZFL-WCIBSUBMSA-N 439.187 4.742 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OCC2CCCCC2)C1 231315625 KWCJJEKWKKFOND-GOSISDBHSA-N 437.362 4.788 50 10 IJGE O=C(Cn1nnc2ccccc21)N/N=C(\Cc1ccccc1)c1ccc(-c2ccccc2)cc1 253571919 PNSFHJDAMNXDMP-PBBVDAKRSA-N 445.526 4.862 50 10 IJGE Cc1ccc(-n2c(SCC(=O)NN=Cc3sccc3C)nnc2-c2ccccc2)cc1 254304562 KCXIOOJSFQFQKZ-UHFFFAOYSA-N 447.589 4.855 50 10 IJGE CC(=O)[C@@H](Br)[C@H](C)c1ccc(I)c(Br)c1 300892022 FZBGHOVANDXODO-KBUNVGBDSA-N 445.920 4.510 50 10 IJGE CCC[C@@H](CCCl)NS(=O)(=O)c1cc(Br)c(C)cc1Br 716905592 NCLBKWCUQLBCBN-JTQLQIEISA-N 447.620 4.596 50 10 IJGE C=CCN(C(=O)/C(C#N)=C\c1cc(C)n(CC(C)C)c1C)c1nc(C(=O)OCC)cs1 749129472 WXSIOKUPCSLNAZ-ODLFYWEKSA-N 440.569 4.520 50 10 IJGE O=C(CSc1nnc(-c2ccco2)n1C1CCCCC1)NNc1ccc2ccccc2n1 777464910 MYGGVKKSYBHNOI-UHFFFAOYSA-N 448.552 4.827 50 10 IJGE Cc1cccc(COc2c(Cl)cc(/C=C(\C#N)C(=O)N(C)C)cc2Br)c1 1084419608 OEGQVDHLYQIEHO-LZYBPNLTSA-N 433.733 4.985 50 10 IJGE C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@@]2(c3ccccc3)C[C@@H]2Br)cc1 1142298644 POODPCIZWCAOJL-NZQKXSOJSA-N 439.353 4.545 50 10 IJGE Cc1c(C(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)cccc1[N+](=O)[O-] 1860391403 FAEZKTPXIJPJPS-UHFFFAOYSA-N 431.473 4.860 50 10 IJGE CCCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1cccn1C)C(C#N)=C(N)O2 1865699127 LRRKUGPRZHNAAT-LJQANCHMSA-N 442.350 4.747 50 10 IJGE CC[C@@H](NC(=O)[C@@H](Cc1ccccn1)c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1866697770 VYNLMZODTGSWIN-XZOQPEGZSA-N 444.560 4.515 50 10 IJGE O=C(c1occc1Br)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915313429 NONNHWHANPLWLT-OAHLLOKOSA-N 427.136 4.858 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)CN1c1ccc(CBr)cc1[N+](=O)[O-] 1921468090 CIHUVVWKXQZUSQ-SJORKVTESA-N 432.362 4.837 50 10 IJGE CC(C)N(CCCBr)Cc1ccc(I)c(Cl)c1 2026560918 NTWJMKKAGKPERQ-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE Cn1ncc(Br)c1C[C@@H](CBr)c1cccc(Br)c1 2027123070 VEGIRVFRWIGXLP-JTQLQIEISA-N 436.973 4.666 50 10 IJGE ClCc1nc2cc(I)ccc2n1CC1(Br)CCC1 2049231564 SPSHFSFEHZXLKX-UHFFFAOYSA-N 439.522 4.697 50 10 IJGE CCC[C@H](CBr)CN1CCCC[C@H]1C(F)(F)CNC(=O)OC(C)(C)C 2065453436 ROGMIZSMIURULD-CABCVRRESA-N 427.374 4.812 50 10 IJGE C[C@@H]1CCc2c1c(CBr)nn2Cc1c(F)cccc1I 2080702480 DYORJPZKQHVRDW-SECBINFHSA-N 449.105 4.620 50 10 IJGE Clc1cc(CN2C[C@H]3CC(Br)C[C@@H]3C2)ccc1I 2086655713 PXVMABXEGHPSNY-GHMZBOCLSA-N 440.550 4.550 50 10 IJGE COc1cc([C@H]2C(C#N)=C(N)Oc3cc4c(cc32)[C@@H](C)CC(C)(C)N4C)cc(OC)c1OC 2087934206 ZAHNTKBQPBRGBI-LFVRLGFBSA-N 449.551 4.653 50 10 IJGE O=C(c1cc(Br)sc1Br)N1[C@H](CCl)C[C@H]2CCC[C@H]21 2108400762 ZMAOCJZCAUCFQH-KHQFGBGNSA-N 427.589 4.895 50 10 IJGE CN(Cc1cccc(NC(=O)[C@@H](Br)C2CCCC2)c1)C(=O)OC(C)(C)C 2110721225 HFHUNTHMZOEPSB-KRWDZBQOSA-N 425.367 4.946 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2Cc1cnn(Cc2ccccc2)c1 2128496141 BAQIKOLKYTWZFL-UHFFFAOYSA-N 430.737 4.534 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCCCC12CN(C(=O)OC(C)(C)C)C2 2209328652 UFCODQNACMGEIA-HUUCEWRRSA-N 447.414 4.702 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1Cc2ccc(NC(=O)[C@@H](Br)C3CCCC3)cc2C1 2234141482 XMRWRKLSZIQUJO-ROUUACIJSA-N 437.378 4.571 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CC(C)(C)CO2)cc1I 2257354093 JQRFIDSNDGQKRN-OLZOCXBDSA-N 425.104 4.551 50 10 IJGE CCO[C@@H]1CC[C@@H]([C@@H](Br)c2ccc(OC)c(I)c2)C1 2269535965 XLNIHQDJUFWZHF-IXPVHAAZSA-N 439.131 4.941 50 10 IJGE C[C@H]1CCCN(C(=O)c2cc(F)c(Br)cc2Cl)[C@H]1CBr 2282978961 SXYYBBLOGSNUBB-SDBXPKJASA-N 427.539 4.877 50 10 IJGE C[C@@H]1CO[C@](CBr)(Cc2ccc(Cl)c(I)c2)C1 2300240133 ILIUPKJSRPCFHJ-ZANVPECISA-N 429.523 4.677 50 10 IJGE BrC[C@H]1C[C@@H]2CC[C@H]1N2Cc1ccc(Br)cc1Br 2308525612 VKWFBCZEBNKPIY-SCDSUCTJSA-N 438.001 4.959 50 10 IJGE CO[C@@H]1C[C@@]2([C@@H](Br)Cc3cc(Br)cc(Br)c3)C[C@@H]12 2313495681 NZUWAWAFMZHAHD-CRWXNKLISA-N 438.985 4.943 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2ccc(-c3cccc(OC)c3)nc2C)cc1OC 2321239453 KIBGTVGMYAAQTN-UHFFFAOYSA-N 433.508 4.627 50 10 IJGE Cl[C@@H]1C[C@@H]2C[C@H](C1)CN2Cc1ccc(I)c(Br)c1 2325207883 RXVZGDDHWIBDLQ-SRVKXCTJSA-N 440.550 4.645 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)c(Br)cc2n1[C@@H]1COC[C@H]1F 2358565749 OAXHMQNFHOVKKB-AKGNYGMASA-N 426.511 4.771 50 10 IJGE FC(F)(F)c1cscc1CNCC(F)(F)C(F)(F)CI 2361674926 QHWWGKOVBRQRQV-UHFFFAOYSA-N 435.146 4.562 50 10 IJGE CC[C@H]1CCCCN1CC(=O)/C(C#N)=C1\NC(c2ccc(Br)cc2)=CS1 25325965 ZBWVVYZDMFSRIM-TXCMAPRMSA-N 432.387 4.653 50 10 IJGE C/C(=N/NC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@H]2C)cc1)c1ccc(Cl)s1 33496926 DSXACJQJAYZSOK-MJXVQFDPSA-N 447.988 4.724 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3[N+](=O)[O-])ccc2[C@@H]1c1cccc(Cl)c1 38651184 QRECVAYWJGJAIG-NRFANRHFSA-N 447.834 4.686 50 10 IJGE CC(C)Oc1cccc(/C=N/NC(=O)c2cc(-c3ccccc3)nc(N3CCCCC3)n2)c1 169927440 ZUCWOUZFZJRNLZ-OVVQPSECSA-N 443.551 4.685 50 10 IJGE CC[C@H](Cl)c1noc(-c2cc(I)ccc2Br)n1 234029144 JPOHTEWVKIEJMW-VIFPVBQESA-N 427.467 4.794 50 10 IJGE O=C(CCCC[C@H]1CCSS1)N1CC[C@H](Oc2ncccc2Br)C1 238815048 BFZOJZIJAOLYMV-KBPBESRZSA-N 431.421 4.538 50 10 IJGE CC(=NNC(=O)c1ccc(Br)o1)c1cccc(NC(=O)C2CCCCC2)c1 254679104 JSBGAHMMXLRREX-UHFFFAOYSA-N 432.318 4.715 50 10 IJGE Oc1ccc(Br)cc1[C@@H]1CN(Cc2ccccc2)C[C@H]1CBr 382704610 DZKMEUPRRZSXCK-RHSMWYFYSA-N 425.164 4.765 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(OC[C@@H]2C[C@@H]3CCCC[C@@H]3O2)C1 393257660 AKAUOIZGPIFTER-OGNFBWPZSA-N 432.399 4.515 50 10 IJGE C[C@@H]1[C@@H](C)N(Cc2ccccc2)[C@H](C)CN1c1nc2ccccn2c1CBr 404261079 DMOJEVTVAJCZBA-KZNAEPCWSA-N 427.390 4.717 50 10 IJGE O=C1Cc2cc([C@@H](Br)c3occc3Br)c(Br)cc2N1 696528345 NDOANPWLMXNXEI-GFCCVEGCSA-N 449.924 4.784 50 10 IJGE CCCOc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CI)cc1 725401828 WGJJLMMERJTPAA-WBVHZDCISA-N 445.341 4.861 50 10 IJGE CCN(C(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C)[C@H](C)Cc1ccc(OC)cc1 731336269 WHIJPROQWZZJSO-SPVAZNHHSA-N 449.595 4.679 50 10 IJGE COc1cccc(NNC(=O)Nc2ccc(Oc3nncc4ccccc34)c(Cl)c2)n1 780603913 HZEHUERNNGRFBW-UHFFFAOYSA-N 436.859 4.628 50 10 IJGE CC(C)c1cnc(COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)s1 783484784 BPIVAZQABLQYET-WQRHYEAKSA-N 431.521 4.694 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 1470319945 UVSRIRRFPIBDSC-UHFFFAOYSA-N 446.492 4.570 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CC1CCCCC1)C(=O)NNc1nc2ccccc2[nH]c1=S 1633443197 BGNKWVMDXBRGOH-QGZVFWFLSA-N 445.589 4.599 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)C(=NNC(=O)Cc2ccccc2)CCC3)cc1 1772749374 KGGHGTNKELUNBU-UHFFFAOYSA-N 430.504 4.769 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc3ccccc23)cc1OC 1865707146 PBVYTVZKSBNBAW-DEOSSOPVSA-N 438.487 4.569 50 10 IJGE Cc1nc(Br)c([C@H](Br)c2sccc2Br)n1C 1900420785 GIEAIIKOTAVGNE-ZETCQYMHSA-N 428.975 4.799 50 10 IJGE O=C(NC[C@@H]1CCC[C@H]1Br)c1csc(Br)c1Br 1945189507 RYEOCAKRGNQBDK-POYBYMJQSA-N 446.002 4.567 50 10 IJGE CC(C)[C@H](Br)CN(C)C(=O)c1scc(Br)c1Br 2002413642 CRUDFWUPKYINSY-SSDOTTSWSA-N 448.018 4.765 50 10 IJGE C[C@@]1(CCBr)CCN1C(=O)c1cc(Br)c(Br)s1 2025216707 QDBKPWZMSUIZEC-LLVKDONJSA-N 446.002 4.663 50 10 IJGE Brc1cccc(Br)c1CN1C[C@@H](Br)[C@@H](C2CC2)C1 2033087232 USCNBLIFYLWOSM-QMTHXVAHSA-N 438.001 4.817 50 10 IJGE CC(C)N(C[C@@H](C)Br)C(=O)c1c(Br)cccc1Br 2033088966 NUNKLVHQAFBENR-SECBINFHSA-N 441.989 4.846 50 10 IJGE Brc1cnc(N2C[C@@H]3CCC[C@H](Br)[C@H]3C2)c(Br)c1 2033547421 SILUMFLRJOFODQ-LSJOCFKGSA-N 438.989 4.606 50 10 IJGE CC[C@@H](CCCBr)NC(=O)c1ccc(I)c(Cl)c1 2036513018 FECCUQCXEADPIY-JTQLQIEISA-N 444.538 4.628 50 10 IJGE FC(F)[C@@H]1C[C@@H]1[C@@H](Br)c1cc(I)cc2c1OCC2 2041791471 ALTJHQICKBYXRA-IQJOONFLSA-N 429.042 4.563 50 10 IJGE C[C@]12CN(Cc3cccc(Br)c3Br)C[C@]1(CBr)C2 2046798888 QYSDSXVKGWBYQH-UONOGXRCSA-N 438.001 4.819 50 10 IJGE BrC[C@H]1[C@H]2CC[C@@H](C2)N1Cc1c(Br)cccc1Br 2058369397 BOKPGIFLSKRLLJ-BHDSKKPTSA-N 438.001 4.959 50 10 IJGE Cc1nn(C)c(C[C@H](Br)c2cccc(Br)c2)c1Br 2072279740 LYRREEORBHYQLK-NSHDSACASA-N 436.973 4.932 50 10 IJGE CCc1nn(C)c(C(=O)N(Cc2ccccc2)[C@@H](CCl)C(C)C)c1Br 2072300727 OSXPWUSLZCETRR-INIZCTEOSA-N 426.786 4.651 50 10 IJGE O=C1Cc2cc([C@H](Br)[C@H]3C[C@H](Br)C3)c(Br)cc2N1 2076181765 IULSZLBEDARHRU-OTPXZMOZSA-N 437.957 4.553 50 10 IJGE Cc1nc(Cl)ccc1-n1nc(CCl)c(I)c1C(F)(F)F 2078882447 YREGWOCSSYMPCB-UHFFFAOYSA-N 436.002 4.591 50 10 IJGE ClCCc1nc2ccc(Br)cc2n1[C@]12C[C@H]1CN(Cc1ccccc1)C2 2099679086 NRDZSEVNBIMTLU-KKSFZXQISA-N 430.777 4.811 50 10 IJGE CC(C)(C)[C@]1(CBr)CCN(Cc2ccc(I)cc2)C1 2104636317 WFWGJWKCCBPQEK-INIZCTEOSA-N 436.175 4.924 50 10 IJGE C[C@H]1CN(C[C@@H](Br)C(F)(F)F)c2ccccc2CN1C(=O)OC(C)(C)C 2106783750 CJTXTEIOSQWQDK-SWLSCSKDSA-N 437.300 4.958 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@H](CBr)c2ccccc2)CC1(C)C 2106786200 SVYQJDVSODFSCB-ZWKOTPCHSA-N 425.411 4.790 50 10 IJGE CN(C[C@H]1CCCN(C[C@@H](CBr)c2ccccc2)C1)C(=O)OC(C)(C)C 2106788669 RQFZYKVCBMIGPH-IEBWSBKVSA-N 425.411 4.744 50 10 IJGE BrC[C@H]1CC2(CCCC2)CN1C[C@H]1CC1(Br)Br 2213087924 KKLRHUCHHBDFDF-GHMZBOCLSA-N 430.022 4.522 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1sc(C)c(Br)c1C 2218969685 PCALAXHLSFYJFH-XVKPBYJWSA-N 444.176 4.707 50 10 IJGE CC(C)(C)[C@@H](CCl)CNC(=O)Cc1cc(Br)cc(Br)c1 2295310053 RKWDWFQUUZDXQZ-NSHDSACASA-N 425.592 4.771 50 10 IJGE CN(Cc1ccc(Cl)cc1I)[C@H]1CCC[C@H]1Br 2302326665 RMIVGSBIMLAOMC-YPMHNXCESA-N 428.539 4.692 50 10 IJGE CC1(C)OC[C@H](Cc2ccc(Cl)cc2I)[C@H]1Br 2302335865 JACRVIQDARPHGH-JOYOIKCWSA-N 429.523 4.676 50 10 IJGE C[C@H]1CN(Cc2cc(I)ccc2Cl)CC[C@@H]1Br 2307335023 XZQCJFPHIZSFEA-CABZTGNLSA-N 428.539 4.550 50 10 IJGE CCOc1ccc(N2C(=O)[C@@H](CC)SC2=C(C#N)C(=O)N[C@H](C)c2ccccc2)cc1 2314594060 YICHTOFEFGIBLM-IIBYNOLFSA-N 435.549 4.556 50 10 IJGE CCOc1cc(C=C2C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 2314618072 GQAFHVWNXNWRII-UHFFFAOYSA-N 434.492 4.506 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)cc1Br 2318415971 ZCGTXLHLEYFQPM-CYBMUJFWSA-N 440.341 4.828 50 10 IJGE COc1ccc([C@@H](C)NC(=O)C(C#N)=CNC(c2ccccc2)c2ccccc2)cc1OC 2325044973 REVBFFCHQQZQCW-LJQANCHMSA-N 441.531 4.668 50 10 IJGE CCOc1cccc(N2CC[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)c1CBr 2367555677 OKMQNBODBVOHEF-UXHICEINSA-N 429.402 4.939 50 10 IJGE CC1=C/C(=N/NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c2ccccc2C1=O 1507261 ICGFCSKMQUUTAH-SLMZUGIISA-N 443.890 4.869 50 10 IJGE C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)COc1ccc2ccccc2c1 14038584 YPNSTQYMZGRRPZ-IBGZPJMESA-N 440.499 4.501 50 10 IJGE O=C(N/N=C/c1cccc(OCc2ccccc2)c1)[C@H]1COc2cc3ccccc3cc2O1 36046483 UDEMVASRFKDHDL-BGUYBBADSA-N 438.483 4.709 50 10 IJGE CC1=C(C#N)C(=O)N([C@@H](C)c2ccccc2)C(=O)/C1=C/Nc1cccc(C(F)(F)F)c1 101234949 RSJZYMHXPQKARE-NPRIEWAGSA-N 425.410 4.971 50 10 IJGE CNC(=O)/C(C#N)=C1\S[C@@H](Cc2ccc(C(C)C)cc2)C(=O)N1c1ccc(C)c(C)c1 101240698 UWXZJTWEJZXHRD-JSIHEXFSSA-N 433.577 4.599 50 10 IJGE C/C(CC(=O)Nc1cccc(C(F)(F)F)c1)=N\NC(=O)c1ccccc1Br 103628139 UENULOAJZKSHSW-BHGWPJFGSA-N 442.235 4.602 50 10 IJGE CCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@H]2CCOc3ccc(Br)cc32)c1C 108784635 DMVDLXIDGBNKQZ-OWMRDYPQSA-N 442.357 4.824 50 10 IJGE Br[C@@H](c1cccc(I)c1)c1ccc2c(c1)OCCO2 109851580 DKAKJGZNCLPRFD-HNNXBMFYSA-N 431.067 4.547 50 10 IJGE COc1cc(C=NNC(=O)COc2c(C)cccc2C)ccc1OCc1cccc(F)c1 252620789 MMAVBOKJPKOVIZ-UHFFFAOYSA-N 436.483 4.559 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2O)ccc1OC(=O)c1cccc2ccccc12 252630134 UVGIJMVLLYDXFP-UHFFFAOYSA-N 440.455 4.537 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)NN=Cc2ccc(OC(=O)c3ccccc3)cc2)cc1 254349396 OWGRJJLYUADVRT-UHFFFAOYSA-N 430.504 4.732 50 10 IJGE CC[C@@H](Br)CCCNC(=O)c1cc(Br)sc1Br 398533366 CDTZMQRBNGOAMF-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE O=C(NC1(CCBr)CCCCC1)c1cccc(I)c1 687326839 NXYQVRZNXBNXBQ-UHFFFAOYSA-N 436.131 4.509 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)NNc1ccc(F)cc1Br)O[C@@H](C)C2 748073890 GMRBOOOVRWUSSY-HZUKXOBISA-N 449.320 4.557 50 10 IJGE N#CCOc1c(Cl)cc(C=NNC(=O)c2cc3ccccc3o2)cc1Br 1083875658 BNERFOHQJIAMFF-UHFFFAOYSA-N 432.661 4.515 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2ccc(-c3ccc(C(C)=O)cc3)o2)cc1 1084193180 VLKVNDWDJFUCQF-HSZRJFAPSA-N 434.492 4.512 50 10 IJGE COc1ccc(Br)cc1C=NNC(=O)c1ccccc1OCc1ccccc1 1084356951 POHLXOPVSNHHLY-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE CCN(CC)c1ccc(-n2c(C)cc(C=NNC(=O)CC[C@@H](O)c3ccccc3)c2C)cc1 1084359608 CFVPEPAKDXWMKK-AREMUKBSSA-N 446.595 4.904 50 10 IJGE Cc1cccc(C(=O)NN=C2CCCc3oc(C(=O)NCc4ccccc4Cl)c(C)c32)c1 1772744883 MVGWRIGQBQBCSS-UHFFFAOYSA-N 449.938 4.950 50 10 IJGE O=C(CCCC[C@H]1CCSS1)Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1 1874185583 HXCXGJUKKPDAKK-INIZCTEOSA-N 437.612 4.535 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CN(C(=O)OC(C)(C)C)C12CCCCC2 1883178943 DWDBWAOWJCXTES-LSDHHAIUSA-N 447.414 4.844 50 10 IJGE C[C@H](c1cc(F)ccc1Br)[C@H](CBr)NC(=O)OC(C)(C)C 1885094165 SLRVEVTZSCDBNW-RNCFNFMXSA-N 425.136 4.980 50 10 IJGE COc1ccc(Br)cc1C(=O)N(Cc1ccccc1)[C@H](C)CBr 1914215753 OATHYQQDKHXCKB-CYBMUJFWSA-N 441.163 4.884 50 10 IJGE C[C@H]1C[C@@H](CBr)CN1Cc1cccc(Br)c1Br 1950534091 BJCBHXRHHOEPAC-UWVGGRQHSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CC[C@@H](CI)O2)C12CCCC2 1994328389 TWSJNLIARTVSJR-KBXCAEBGSA-N 435.346 4.683 50 10 IJGE Clc1nc(N2[C@H]3CCC[C@H]2CN(Cc2ccccc2)C3)sc1CBr 2011233381 RNWHSDOEZKOBLC-GJZGRUSLSA-N 426.811 4.935 50 10 IJGE C=CCC[C@H](CBr)NC(=O)c1scc(Br)c1Br 2019477775 LXBWSIYZKHTTPE-SSDOTTSWSA-N 446.002 4.733 50 10 IJGE CC(F)(F)C[C@@H](CCl)NC(=O)c1cc(Br)c(Br)s1 2050368216 WIDACNXFKUQORT-YFKPBYRVSA-N 425.520 4.656 50 10 IJGE FC(F)(F)c1cc(Br)cc(-n2nc3c(c2CBr)[C@H]2C[C@@H]2C3)n1 2080641458 BQRYQACDYDTSFK-SVRRBLITSA-N 437.057 4.603 50 10 IJGE CC[C@@H]1[C@@H](CBr)CCN1Cc1ccc(I)c(Cl)c1 2086658803 QMEAQPQJDJOYGH-BXUZGUMPSA-N 442.566 4.940 50 10 IJGE O=S1(=O)CCC([C@@H](Br)c2cc(C3CC3)c(Br)s2)CC1 2094667936 BEBKGGTXBJMSCC-GFCCVEGCSA-N 428.211 4.649 50 10 IJGE O=C(NC[C@]1(CCl)CC12CCC2)c1cc(Br)sc1Br 2097912184 UNQHJLNOHASOQB-CYBMUJFWSA-N 427.589 4.802 50 10 IJGE C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CCN1C[C@@H](CBr)c1ccccc1 2106786340 UNTDSOZSVCMNQV-ZIFCJYIRSA-N 425.411 4.790 50 10 IJGE CC12CC([C@@H](Br)c3cc(I)cc4c3OCC4)(CCO1)C2 2164972535 FDYXPEKGBHNICE-FHERZECASA-N 449.126 4.621 50 10 IJGE Fc1cc(F)c(CBr)c(N2CCN(Cc3ccccc3)CC(F)(F)C2)c1 2227543274 OJCYSWGSLNTDDN-UHFFFAOYSA-N 431.271 4.817 50 10 IJGE COc1cc(C=CC(=O)Cl)cc(I)c1OCc1cccc(F)c1 2293941049 WPWYFTLQTYWHCJ-UHFFFAOYSA-N 446.643 4.797 50 10 IJGE O=C(Cc1cc(Br)cc(Br)c1)N[C@@H](CCl)c1ccsc1 2295311814 PJTSDTHXLWGPAJ-ZDUSSCGKSA-N 437.584 4.912 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1 2304517657 RMISDVBPBTXXSV-IBGZPJMESA-N 437.422 4.826 50 10 IJGE BrC[C@@]12CCC[C@@H](CN(Cc3sccc3I)C1)C2 2316755523 UJBXTZOIKPLFBB-RISCZKNCSA-N 440.188 4.740 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1OCc1ccc(Cl)cc1 2321677298 KFLNOBADAXOUDA-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE CCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2326919752 QKPUMSRVAKVENA-PBHICJAKSA-N 425.358 4.518 50 10 IJGE Clc1ccc(I)cc1CN1[C@H]2CC[C@@H]1C[C@H]2CBr 2327395164 NUCABRUPJXPCES-BHYNMZESSA-N 440.550 4.692 50 10 IJGE CC(C)(C)Oc1cccc(CCNC(=O)C(C#N)=Cc2cccc(Br)c2)c1 2329694424 JBGMKZVSZUNEDQ-UHFFFAOYSA-N 427.342 4.892 50 10 IJGE Cc1c(CBr)ccc(NS(=O)(=O)C2CC(OCc3ccccc3)C2)c1C 2342158809 WJFDTJVACHQFSB-UHFFFAOYSA-N 438.387 4.688 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](OCc2cccc(CC(F)(F)F)c2)[C@H](Br)C1 2353123179 FKYFKNFUFINMNN-CABCVRRESA-N 438.284 4.691 50 10 IJGE CC(C)(C)OC(=O)N1CCO[C@@]2(CCCN(C[C@@](C)(CBr)C(C)(C)C)C2)C1 2380192443 QGJQVAWFPGEXRH-NHCUHLMSSA-N 447.458 4.536 50 10 IJGE O=C(CCCc1c(-c2ccccn2)[nH]c2ccccc12)NNC(=O)c1ccccc1Cl 39846651 WWRURMIFUXAEJY-UHFFFAOYSA-N 432.911 4.667 50 10 IJGE Cc1c(C(=O)Nc2ccccn2)oc2c1/C(=N/NC(=O)c1cccc3ccccc13)CCC2 40813626 JCGUGVYDEZCLIA-ZTKZIYFRSA-N 438.487 4.859 50 10 IJGE O=C(CSCc1ccccc1)N/N=C1/C(=O)N(Cc2ccccc2Cl)c2ccccc21 59167480 VNVVOOVQDNQRAG-SLEBQGDGSA-N 449.963 4.641 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@@H]1Cl)c1cc(Br)ccc1Br 161208349 OECALZHSZRPIBV-GJZGRUSLSA-N 429.539 4.846 50 10 IJGE Cc1cccc(N2CCN(/C=C(/C#N)C(=O)N[C@H](C)C34CC5CC(CC(C5)C3)C4)CC2)c1C 217054842 DZQHPNHIQJQZHB-HLSWJPBXSA-N 446.639 4.554 50 10 IJGE C[C@@H](Br)C(C)(C)NC(=O)c1ccc(Br)cc1Br 235107473 LETCLRZTTRQBPE-SSDOTTSWSA-N 427.962 4.503 50 10 IJGE C[C@H](Br)C(C)(C)NC(=O)c1ccc(Br)cc1Br 235455579 LETCLRZTTRQBPE-ZETCQYMHSA-N 427.962 4.503 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2O)ccc1OCc1cccc2ccccc12 254307073 DOHRAYCPZCCWDQ-UHFFFAOYSA-N 426.472 4.897 50 10 IJGE Cc1ccccc1-n1c(C)cc(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)c1C 736691236 NUFDFLZQEZWCRS-UHFFFAOYSA-N 426.524 4.628 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc3[nH]c4c(c3c2)CCCCC4)c1C 736696385 FJDSFGKKIVADKQ-UHFFFAOYSA-N 426.524 4.663 50 10 IJGE N#Cc1ccc(COc2ccc(C=NNC(=O)c3ccccc3Br)cc2)cc1 1084428841 LYOMVOAPCZUDHH-UHFFFAOYSA-N 434.293 4.664 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)CSCc2ccc(C(C)(C)C)cc2)c1C 1306590659 KTTUICPHTFCWPZ-UHFFFAOYSA-N 435.597 4.829 50 10 IJGE O=C(NN[C@@H](c1ccccc1)c1nc(-c2ccccc2)no1)c1ccc(Br)cc1 1319711486 REPXEDBRJRGSTR-IBGZPJMESA-N 449.308 4.523 50 10 IJGE CCc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2OC)CCC3)cc1 1772746600 XXPJHIPGQCXZSC-UHFFFAOYSA-N 445.519 4.882 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CCC)nn3-c2ccc(OC)cc2)cc1 1865692438 BLRYZGUGOWIAAD-QHCPKHFHSA-N 444.535 4.840 50 10 IJGE COc1ccc(-c2nn(Cc3ccc(F)cc3)c3c2[C@@H](c2ccco2)C(C#N)=C(N)O3)cc1 1865698301 PQMIOPDYCFXRCA-OAQYLSRUSA-N 442.450 4.557 50 10 IJGE CCCCCCN(C)S(=O)(=O)c1cc(CBr)sc1Br 1887126554 PWOYMNXEZSSITQ-UHFFFAOYSA-N 433.231 4.606 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)Cc1nn(C)c(Cl)c1Br 1914614431 WATXPIXCWHKOSI-LLVKDONJSA-N 435.591 4.622 50 10 IJGE CN(C[C@H](Br)Cc1c(Br)cccc1Br)C1CC1 1949865508 ZPQDTRWGXKTZIA-SECBINFHSA-N 425.990 4.612 50 10 IJGE CN(Cc1cc(Cl)ccc1I)C[C@H]1C[C@@H](Br)C1 2020201617 NFUGLHXUGDQHRS-JGZJWPJOSA-N 428.539 4.550 50 10 IJGE Cn1ncc(Br)c1C[C@@H](CBr)c1ccccc1Br 2027121771 HWJSHRFGMAOIBA-VIFPVBQESA-N 436.973 4.666 50 10 IJGE CC(C)n1c(SCC(=O)C(C#N)=C2Nc3ccccc3S2)nc2ccccc2c1=O 2040965569 PMEXAXBWQXLMTB-UHFFFAOYSA-N 434.546 4.592 50 10 IJGE C[C@H](Cl)CC(=O)N(CCCNC(=O)OC(C)(C)C)c1cccc(Br)c1 2054473795 FTBVKBUIBXPRLY-ZDUSSCGKSA-N 433.774 4.714 50 10 IJGE CCCn1cc(S(=O)(=O)N(Cc2ccccc2)CC(C)C)cc1CBr 2059313268 WIAOUYARJNVTIC-UHFFFAOYSA-N 427.408 4.640 50 10 IJGE O=C(CBr)c1cc(I)cc(C(F)(F)F)c1C(F)F 2060394544 MFSQSCCNNCCIQU-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE C[C@@H](Br)CCc1cn(-c2cc(Br)ccc2Br)nn1 2068991207 LJROQGYDZQSLAF-MRVPVSSYSA-N 437.961 4.508 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1ccc(Cl)c(Br)c1 2081236402 OWRNGCMWIIVPBD-PELKAZGASA-N 444.538 4.682 50 10 IJGE C[C@@]12CN(Cc3ccc(I)c(Cl)c3)C[C@]1(CBr)C2 2086652001 MJTNYODVDNDEOL-ZIAGYGMSSA-N 440.550 4.552 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@@H]2CCC[C@@]2(CCl)C1 2103177295 WIICUULWBTWHTN-ISVAXAHUSA-N 427.589 4.754 50 10 IJGE CC(C)[C@H](CBr)CN1CC[C@@H](C(F)(F)F)C[C@@H]1CNC(=O)OC(C)(C)C 2107584934 NYTWBLDNRSSMGB-RBSFLKMASA-N 445.364 4.821 50 10 IJGE CC(C)(C)OC(=O)NCCCN(Cc1ccc(CBr)cc1)CC(F)(F)F 2126466083 LIQBBRAROIFSMZ-UHFFFAOYSA-N 439.316 4.861 50 10 IJGE Cc1sc(Br)c(C(=O)N2CC[C@H](CBr)C(F)(F)C2)c1C 2157253709 XPOYSDYYYBZCHY-SECBINFHSA-N 431.140 4.620 50 10 IJGE CC(C)(C)OC(=O)N1CC2(CCCC[C@@]23CC[C@](C)(CI)O3)C1 2211826475 SYLXDBAQHKRGOQ-SJLPKXTDSA-N 435.346 4.540 50 10 IJGE Cc1ccc(I)c(C(=O)Nc2cccc(CCBr)c2)c1 2240915867 STWXUJWKRFHLCK-UHFFFAOYSA-N 444.110 4.789 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1Cc2ccccc2N(CC2(CBr)CC(F)C2)C1 2280358620 FGGQVAVNOGUCAW-NNDYNSRJSA-N 441.385 4.703 50 10 IJGE O=C(N[C@@H]1CCC[C@@H](CBr)C1)c1cc(F)c(Br)cc1Cl 2282983550 QQJUHJPHMPFBKK-RKDXNWHRSA-N 427.539 4.925 50 10 IJGE C[C@H]1CCC[C@@](CCl)(NC(=O)c2ccc(Cl)c(I)c2)C1 2283655792 KEQAUOHKWRBKKP-ZUZCIYMTSA-N 426.125 4.862 50 10 IJGE CC(=NNC(=O)C(=Cc1cccs1)NC(=O)c1ccccc1)c1ccc2c(c1)CCCC2 2293415033 HDOQQTXZSSNRKG-UHFFFAOYSA-N 443.572 4.938 50 10 IJGE Cc1ccc(C)c([C@@H](C)NC(=O)C(C#N)=Cc2cc3c(cc2Br)OCO3)c1 2295551720 IZHZCYWYKVMDHM-CQSZACIVSA-N 427.298 4.579 50 10 IJGE CCc1ccccc1N=c1cc(-c2cccnc2)nc(C2CCN(C(=O)[C@H](C)Cl)CC2)[nH]1 2296572177 BVQBUWCTISEROA-KRWDZBQOSA-N 449.986 4.600 50 10 IJGE O=C(C=Cc1ccco1)Oc1cccc(C=NNC(=O)c2cc3ccccc3cc2O)c1 2297550923 MDFRDBCJVGIHGA-UHFFFAOYSA-N 426.428 4.521 50 10 IJGE CN(Cc1sccc1I)C[C@@H](Br)C1CCCC1 2301071428 NDOMLWLDCLWCHZ-LLVKDONJSA-N 428.177 4.738 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)C(C#N)=CNCc1ccc(Br)cc1 2325079156 SPKJIXUDWQJOKM-INIZCTEOSA-N 442.357 4.531 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)c3cc4ccccc4oc3=O)n2)cc1OC 2331242683 AWXXJPLWFHUXOT-UHFFFAOYSA-N 432.457 4.884 50 10 IJGE C[C@H](C(O)=C(C#N)c1nc(-c2ccc(Cl)cc2)cs1)N1C(=O)c2ccccc2C1=O 2331295951 YNSALCSKHXKXSQ-GFCCVEGCSA-N 435.892 4.941 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@H]1CCCC[C@@H]1C(F)(F)F 2343414958 VPBLMEYKWDLHQP-IKGGRYGDSA-N 436.312 4.842 50 10 IJGE FC(F)(F)c1ccc(CBr)c(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)n1 2369845486 UOTRNALTACWOHL-DLBZAZTESA-N 440.307 4.706 50 10 IJGE CCO[C@H](Nc1ccc(C(=O)C(Cl)Cl)cc1)C(=O)c1cc([N+](=O)[O-])ccc1Cl 3609641 HJSHVUYWXKYBHW-SFHVURJKSA-N 445.686 4.892 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)COc1ccc(Cl)cc1Cl 9871852 RXOJYLYEPKGGKC-UONOGXRCSA-N 439.339 4.501 50 10 IJGE CCCOC(=O)c1ccc(OCC(=O)N/N=C(\C)C(c2ccccc2)c2ccccc2)cc1 66202619 FEHFQGSSPFXHGM-VFCFBJKWSA-N 444.531 4.956 50 10 IJGE Cn1ccnc1COc1ccc(/C=C(/C#N)C(=O)Nc2cc(Cl)ccc2Cl)cc1 97147266 HTVFAUYCCXMLCK-GDNBJRDFSA-N 427.291 4.852 50 10 IJGE ClCc1nc2cc(Br)cnc2n1CCc1ccc(Br)s1 226300750 FKOOKCREZCQQEC-UHFFFAOYSA-N 435.572 4.999 50 10 IJGE COC(=O)[C@@H](Br)C1(Oc2c(C)cc(Br)cc2Cl)CCC1 312910013 ZTFJBGCVVSVBDY-GFCCVEGCSA-N 426.532 4.649 50 10 IJGE Cc1cc([C@@H](Br)c2cnn(C)c2Br)sc1Br 382221028 ZMMRIHVKLJIWPZ-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE CC[C@@H](Cl)CCCNC(=O)c1cc(Br)ccc1I 398486165 ZPKGCXFQZDZVJJ-SNVBAGLBSA-N 444.538 4.581 50 10 IJGE Cn1cc([C@H](Br)c2ccc(F)c(Br)c2F)nc1Br 691562325 RUCXWYVXWFHQMG-MRVPVSSYSA-N 444.899 4.708 50 10 IJGE ClCc1cc(Br)cc(Br)c1OCC1=CSC2=NCCN12 699166404 GBJMXPZLDXVWRF-UHFFFAOYSA-N 438.572 4.589 50 10 IJGE C[C@]1(CBr)CCCN1C(=O)c1scc(Br)c1Br 723027556 SFOCQYJHFLWZDO-LLVKDONJSA-N 446.002 4.663 50 10 IJGE Cc1cccc(NC(=S)NNC(=O)[C@@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)c1 732576938 DIYVSZDCFALDFS-DHIUTWEWSA-N 431.561 4.695 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N2[C@H]3CC[C@H]2CC(O)C3)c(C)n1-c1cc(Cl)ccc1Cl 736189529 PVPDVVJRXUSLCG-WNPVJCIISA-N 444.362 4.822 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2occc2CSc2ccccc2)c1C 736693365 CNMVCJJWLAZQBZ-UHFFFAOYSA-N 431.521 4.798 50 10 IJGE N#Cc1cccc(Oc2ccc(NC(=O)NNc3ccc(C#N)cc3C(F)(F)F)cn2)c1 799386459 XWDGKNGWUGMURX-UHFFFAOYSA-N 438.369 4.785 50 10 IJGE N#Cc1c(F)cccc1Oc1ccc(C(=O)NNc2nc3ccccc3[nH]c2=S)cc1 1148223840 RYQMPOFTTXJNKX-UHFFFAOYSA-N 431.452 4.852 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNc2ccnc(Br)c2)cc1 1296764464 NTKHGTBDSUBTOO-UHFFFAOYSA-N 425.286 4.547 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccc(F)cc1 1540465812 KSHZEDFIQSLGOV-FBMGVBCBSA-N 440.478 4.543 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N2CCCc3ccnc(O)c32)c(C)n1-c1ccc(Cl)cc1 1617657223 QSDDXIICLRGRHE-CPNJWEJPSA-N 432.911 4.735 50 10 IJGE C=C1CCC(CNC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)CC1 1645011095 FHQBRGBFEMHVTM-MOSHPQCFSA-N 433.943 4.887 50 10 IJGE C=CCn1cc2ccc(NC(=O)NNC(=O)c3ccc(OCCCCCC)cc3)cc2n1 1680698543 QNVZBNXRCGTUQW-UHFFFAOYSA-N 435.528 4.648 50 10 IJGE COc1ccc(C(=O)NNc2ccc(OCCOc3ccc(Cl)cc3)cc2)cc1OC 1858080610 JGVCRCFLEVPJME-UHFFFAOYSA-N 442.899 4.572 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CC)c1 1865692671 DRJAQCXVEDFMJK-OAQYLSRUSA-N 430.508 4.586 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2Cl)[C@@H]1c1cccnc1 1865700581 XYNBNUSNGBRIDI-HXUWFJFHSA-N 425.879 4.806 50 10 IJGE Cc1ccc(C(=O)CCC(=O)N/N=C\c2cc(Cl)cc(Br)c2O)c(C)c1 1865762484 IRUKPQACBUSOFH-YVNNLAQVSA-N 437.721 4.538 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H]1C(C)(C)C 1881339348 KHJRFKRVDQLGRZ-MJBXVCDLSA-N 435.403 4.556 50 10 IJGE C[C@H](Br)CCCNC(=O)c1csc(Br)c1Br 1937737721 LSTZSSIMIRVJFY-LURJTMIESA-N 433.991 4.567 50 10 IJGE BrC[C@@H]1CCCCN1Cc1c(Br)cccc1Br 1945333146 LYKDXDSHAOGOOD-JTQLQIEISA-N 425.990 4.961 50 10 IJGE CC1(C)C[C@H](Br)CN1C(=O)c1cc(Br)ccc1Br 2037329996 XPEODNLCGDHFMI-VIFPVBQESA-N 439.973 4.600 50 10 IJGE CC(C)(C)c1ncccc1-n1nc(CCl)c(I)c1C(F)(F)F 2078881747 HXZQXCFSFYIXNV-UHFFFAOYSA-N 443.638 4.927 50 10 IJGE COc1ccc([C@H](Br)c2nn(C)c(Cl)c2Cl)c(Br)c1 2094339136 MXQUSILOSWRPHI-VIFPVBQESA-N 428.939 4.982 50 10 IJGE COCCCN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(CCl)c1Cl 2095871830 JOVNWHFHWDTXOH-UHFFFAOYSA-N 436.788 4.960 50 10 IJGE C[C@@H]1[C@@H](C(F)(F)F)N(C[C@@H](CBr)C2CCC2)CCN1C(=O)OC(C)(C)C 2115980595 SQBZNAOUQMNCCY-YUELXQCFSA-N 443.348 4.670 50 10 IJGE Cc1cnc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)c(CBr)c1 2130158657 BWBGQKQXNLACFB-QGZVFWFLSA-N 428.296 4.538 50 10 IJGE Cc1cc(NCCSSCCNC(=O)OC(C)(C)C)c(C(F)(F)F)cc1N 2181743092 KJBBSMZQAYWPSK-UHFFFAOYSA-N 425.542 4.914 50 10 IJGE CO[C@H]1C[C@H](Oc2c(Br)cc(Cl)cc2CBr)C[C@H]1OC 2187175457 YPUQKYLHRYLREB-UOJUARBOSA-N 428.548 4.569 50 10 IJGE CC(C)[S@](=O)(=NCCCCCCBr)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2223291901 WLXIAESUZHRNGT-IVCQMTBJSA-N 439.460 4.828 50 10 IJGE Cc1ccc(I)c(C(=O)N2C[C@@H](Br)CCC23CCC3)c1 2240921775 KZLGEOMPWQSTAW-LBPRGKRZSA-N 448.142 4.522 50 10 IJGE C[C@H](N(Cc1ccccc1)S(=O)(=O)c1cncc(CBr)c1)C(C)(C)C 2256188478 JRYWRYFYAILDMH-HNNXBMFYSA-N 425.392 4.602 50 10 IJGE COC[C@]1(C)C[C@]1(CBr)Cc1cc(Cl)ccc1I 2257075767 UYCXXYXHKCGUDX-KBPBESRZSA-N 443.550 4.925 50 10 IJGE CC(C)(C)OC(=O)NCc1cc(F)ccc1NC(=O)[C@H](Br)C1CCCC1 2268580748 TVBWRIMVWKWULA-MRXNPFEDSA-N 429.330 4.743 50 10 IJGE C[C@H](NC(=O)c1cc(Br)c(F)cc1Cl)[C@@H]1CCC[C@@H]1Br 2285836021 WCUDBYQXASWNNQ-NRPADANISA-N 427.539 4.924 50 10 IJGE CC[C@H](C)[C@@H](CCl)NCc1ccc(I)c(Br)c1 2306218806 DWXQMDFGLDFMTL-TVQRCGJNSA-N 430.555 4.797 50 10 IJGE ClCC1CCN(Cc2ccc(I)c(Br)c2)CC1 2306231309 HYFUAOKAEXFUMP-UHFFFAOYSA-N 428.539 4.505 50 10 IJGE Clc1ccc(I)cc1CN1CCC[C@@H](CBr)C1 2307323300 YUSTZMDBQJAOQL-JTQLQIEISA-N 428.539 4.552 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@@H]1[C@H]2COC[C@H]21 2317403307 NBKGETAOAXXVAW-HJGGDWJDSA-N 442.948 4.988 50 10 IJGE Cc1ccc(-c2csc3ncn(CC(=O)NN=Cc4ccc(C(C)C)cc4)c(=O)c23)cc1 2325904524 MIKYIYQLLUCYLF-UHFFFAOYSA-N 444.560 4.707 50 10 IJGE COc1ccc(CCOC2(CI)CCCC2)c(Br)c1 2339252666 DIKAZQYCHHRYNL-UHFFFAOYSA-N 439.131 4.765 50 10 IJGE O=C(CCC(=O)Nc1ccc(Cl)cc1Cl)N/N=C/c1ccc(Br)cc1 12580929 YCWWTEJNHMGSSG-UFFVCSGVSA-N 443.128 4.625 50 10 IJGE C=CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccs2)cc1 38656428 SUSPUCMBQUWDPI-JOCHJYFZSA-N 430.485 4.750 50 10 IJGE Nc1c(NNC(=O)C(c2ccccc2)c2ccccc2)ncnc1Nc1ccccc1Cl 40781319 GZVZIOFAGRIEMY-UHFFFAOYSA-N 444.926 4.731 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2cccnc2)C(=O)/C1=C/c1ccc(-c2cccc(Cl)c2)o1 101336549 SIIXKZDSBJFTPM-RGVLZGJSSA-N 429.863 4.787 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N(CCBr)C1CCCCC1 147313404 MPJIMABULPVPGA-UHFFFAOYSA-N 445.242 4.537 50 10 IJGE C[C@H](Br)C[C@@H](C)NC(=O)c1cc(Br)c(Br)s1 165527123 CDUMVHADGWRLIT-NTSWFWBYSA-N 433.991 4.565 50 10 IJGE CC1(C)O[C@@H]2[C@H](CO[Si](C)(C)C(C)(C)C)O[C@H](n3ccc4c(Cl)ncnc43)[C@@H]2O1 195779499 PTFANUVYJLNMOM-BORJPKMPSA-N 440.016 4.524 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)/C(C#N)=C\NCc1ccccc1Br 217187489 AGSCIJKIDCIKNH-VVZNPABPSA-N 442.357 4.531 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(OC[C@@H]2C[C@@H]3CCCC[C@H]3O2)CC1 380845197 ZLLVWAXURMHKKQ-YESZJQIVSA-N 432.399 4.515 50 10 IJGE Brc1cccc([C@@H](CI)OCCOCC2CCC2)c1 400690936 HKBBWZCARCRRNL-OAHLLOKOSA-N 439.131 4.759 50 10 IJGE C[C@H]1C[C@H](Br)CN(Cc2cc(Cl)ccc2I)C1 405309632 SJWAOCBWKZFLHG-ONGXEEELSA-N 428.539 4.550 50 10 IJGE C[C@H]1CCN(C(=O)c2scc(Br)c2Br)[C@@H]1CBr 705518941 SYWADLBOGKPHDY-POYBYMJQSA-N 446.002 4.519 50 10 IJGE ClCc1cc(Br)cnc1N1C[C@H]2CC[C@H]1[C@@H]1CN(Cc3ccccc3)C[C@H]21 705845713 MJTIVOOVTXBNOW-OTNPHJDUSA-N 446.820 4.930 50 10 IJGE CCC(CC)(CBr)COc1ccc(OC)c(I)c1 712907419 ZYVQTZZMXRDTKA-UHFFFAOYSA-N 427.120 4.880 50 10 IJGE Cn1cc(CC(CCl)(CCl)c2ccc(Br)cc2)c(Br)n1 714089628 RLAIHQHVKSGDER-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE CC[C@H](Oc1ccccc1C(C)C)C(=O)NNC(=S)Nc1ccc(OC(C)C)cc1 730036863 RTAXXEFISYKLIS-FQEVSTJZSA-N 429.586 4.772 50 10 IJGE CCN(C(=O)/C(C#N)=C/c1cc(C)n([C@H](C)COC)c1C)[C@H](C)Cc1ccc(OC)cc1 731335427 OEGFATXGPYWJGV-RPPQRLJCSA-N 437.584 4.708 50 10 IJGE Cc1ccc(CCNC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)cc1 734816870 GCUJUNUKDXTFNT-QNGOZBTKSA-N 443.938 4.691 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccccc2COc2cccc(C=O)c2)c(C(F)(F)F)c1 799751531 PKNSWPXQEMXFNH-UHFFFAOYSA-N 439.393 4.725 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2ccc(OCc3ccccn3)cc2)c(C)n1CC(C)C 917755801 HFPZTSMTBFSAOI-ZVHZXABRSA-N 442.563 4.958 50 10 IJGE Cc1ccc(C)c(NC(=O)C(=O)NN=Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)c1 1083913582 ZFQDCXWEUZWOSV-UHFFFAOYSA-N 430.291 4.959 50 10 IJGE Cc1ccc(-n2c(C)c(Br)c(C=NNC(=O)c3ccccc3O)c2C)cc1 1084235198 DIHHDTGQWMRYBI-UHFFFAOYSA-N 426.314 4.635 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2c(C)n(C3CCCC3)c3ccc(OC)cc23)c1 1455415792 IOCLJWDNTUAHPX-UHFFFAOYSA-N 446.576 4.686 50 10 IJGE C#CCN(C[C@@H](CBr)C1CC1)[C@@H]1CCOc2ccc(Br)cc21 1473168327 OCUQRFINBVKEAB-RHSMWYFYSA-N 427.180 4.629 50 10 IJGE C=C(C)CN(Cc1ccc(CO)o1)C(=O)/C(C#N)=C/c1cc(C)n(-c2ccccc2F)c1C 1556558203 PGBUREXGEOKVJL-CIAFOILYSA-N 447.510 4.830 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1ccccc1SCc1cscn1 1633440458 ZEQRQAQNEPWFKQ-UHFFFAOYSA-N 425.564 4.798 50 10 IJGE CCN(C(=O)c1oc2c(c1C)C(=NNC(=O)Cc1ccccc1)CCC2)c1ccccc1 1772748973 FUQLJNREJZTALZ-UHFFFAOYSA-N 429.520 4.654 50 10 IJGE CCCOC(=O)c1oc2c(c1C)C(=NNC(=O)Cc1coc3c(C)c(C)ccc13)CCC2 1772752043 SIGOPUZZBKVZFU-UHFFFAOYSA-N 436.508 4.917 50 10 IJGE CC(=O)[C@@H](Br)c1c(I)cccc1SC(F)(F)F 1848425899 PIKJANLNMSSSDJ-SECBINFHSA-N 439.034 4.928 50 10 IJGE CCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccccc1OC)C(C#N)=C(N)O2 1865709707 FFTOEBISGAHULC-IBGZPJMESA-N 441.318 4.968 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cccc(Cl)c1 1915291772 RURDCUGHABTLEO-SFHVURJKSA-N 430.795 4.950 50 10 IJGE CN(Cc1sccc1Br)C[C@H](Br)COCc1ccccc1 1916347573 JMVPFFOLXMGINS-AWEZNQCLSA-N 433.209 4.923 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1ccsc1Br 1916365927 DBWLLIXYUGLOQB-CYBMUJFWSA-N 447.192 4.563 50 10 IJGE Brc1cc([C@H](Br)[C@@H]2[C@@H]3CCOC[C@H]32)c(Br)s1 1937556894 BMPRUVOYPXQRCN-PXMQNUKVSA-N 430.987 4.992 50 10 IJGE C[C@@H]1CN(Cc2ccc(Br)cc2Br)CC[C@H]1Br 1943841943 FZBQDYRVNIQVOW-BXKDBHETSA-N 425.990 4.817 50 10 IJGE Br[C@@H](c1sccc1I)c1ncn2ccsc12 1994414138 UQGFCVYARPQKGZ-SSDOTTSWSA-N 425.114 4.546 50 10 IJGE CC(C)(C)C[C@@H](Cl)CNc1ncc(I)cc1Br 2015756430 FTRVUYNPCHBDOM-MRVPVSSYSA-N 431.543 4.904 50 10 IJGE FC1(F)C[C@]1(Br)COc1cccc(Br)c1CBr 2023780009 FWLIGCBVFKDPHV-JTQLQIEISA-N 434.900 4.896 50 10 IJGE CCN(C)C[C@H](Br)CCc1ccc(I)c(Cl)c1 2026562232 ZGIALMHFQJENII-LLVKDONJSA-N 430.555 4.592 50 10 IJGE CCC[C@](C)(CCl)NC(=O)c1ccc(I)c(Br)c1 2029946318 UAPUYTKQONDZRC-CYBMUJFWSA-N 444.538 4.581 50 10 IJGE N#CC(C(=O)COC(=O)C(=Cc1ccc(F)cc1)c1cccs1)=C1Nc2ccccc2N1 2040422409 UORRUQKHUWFKQS-UHFFFAOYSA-N 445.475 4.813 50 10 IJGE Cc1c([C@@H](Br)Cc2cccc(Br)c2)nn(C)c1Br 2049254828 BWGRIHZTVHHSEK-NSHDSACASA-N 436.973 4.932 50 10 IJGE C[C@@H](Cl)[C@@H](NC(=O)c1csc(Br)c1Br)C(F)(F)F 2074720875 PUWRTPRCGUCFPN-AWFVSMACSA-N 429.483 4.561 50 10 IJGE O=C(c1csc(Br)c1Br)N1[C@H](CCl)C[C@@H]2CCC[C@H]21 2108399812 QYQGDXYXVCNLTI-OYNCUSHFSA-N 427.589 4.895 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CCC[C@H]1[C@H]1CCN(Cc2ccccc2)C1 2145255940 RFWSIEROCCZQQY-VXKWHMMOSA-N 427.386 4.708 50 10 IJGE Cc1cc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)ncc1CBr 2151925571 OERCAADCBXLLRF-YJMBLLCNSA-N 426.402 4.632 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](NC(=O)OC(C)(C)C)C[C@]12CCOC2 2163061698 HQWXLFJLCJWZFR-UWJYYQICSA-N 447.458 4.726 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CC2(CBr)CCC2)C[C@@H]1c1ccccc1 2185530237 SFTKYQJMKJKWOM-RBUKOAKNSA-N 437.422 4.792 50 10 IJGE Cc1cc(Br)c([C@H](Cl)C2CCS(=O)(=O)CC2)c(C)c1Br 2235613487 YDQOPIRURYFQNI-CQSZACIVSA-N 444.616 4.933 50 10 IJGE Br[C@@H]1C[C@@H]2CCCC[C@@H]2N(C[C@@H]2CC2(Br)Br)C1 2246599619 UNVDVMBKXZOGML-YFKTTZPYSA-N 430.022 4.520 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@H](Br)c1cc(Br)n(C)n1 2264366769 LPBRPDUGHYYRTL-LBPRGKRZSA-N 428.939 4.982 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2Cc3ccccc3O2)cc1I 2284998057 JPHWEYLIAXQRRT-HOTGVXAUSA-N 445.094 4.740 50 10 IJGE CN(C[C@@H]1CCC[C@H]1Br)C(=O)c1cc(Br)c(F)cc1Cl 2285843588 ATMLBSHXPDGAOS-WCBMZHEXSA-N 427.539 4.877 50 10 IJGE COC[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)N(CCCCCCCCCBr)C1 2289509264 UEPQSYZHJQZMHA-RTBURBONSA-N 449.474 4.974 50 10 IJGE Cc1sc(Br)cc1C(=O)N1CCC(CBr)(C(F)F)CC1 2289944859 KEEUPMSQPGEFTI-UHFFFAOYSA-N 431.140 4.701 50 10 IJGE COc1cccc(C=C(C#N)C(=O)Nc2ccccc2C(=O)O)c1OCc1ccc(F)cc1 2293523515 ABSLGYABRCLSOA-UHFFFAOYSA-N 446.434 4.657 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3cccc(C(=O)O)c3)c2C)cc1 2294168574 SMYXNBNRRVWWKG-UHFFFAOYSA-N 429.476 4.737 50 10 IJGE FC(F)(CBr)[C@H]1CCN(c2nc3ccc(Br)cc3s2)C1 2296503997 RBGHXNGEYXKYTQ-QMMMGPOBSA-N 426.124 4.915 50 10 IJGE CN(Cc1sccc1I)C1(CBr)CCCCC1 2301080036 ZUADCCVZKLRZLT-UHFFFAOYSA-N 428.177 4.882 50 10 IJGE CC[C@H](C)N1C(=O)C(=Cc2ccc(OCc3ccccc3)c(OC)c2)C(C)=C(C#N)C1=O 2314611725 ZJPMXPQWVUETIE-KRWDZBQOSA-N 430.504 4.665 50 10 IJGE COC(=O)c1c(-c2ccccc2)csc1NC(=O)C(C#N)=Cc1ccc(OC)c(OC)c1 2314730566 FZAWZELRWIYSHK-UHFFFAOYSA-N 448.500 4.765 50 10 IJGE CC(C)(C)OC(=O)NCCC[C@@H]1CCCCN1C[C@]1(CBr)CC1(F)F 2326917281 NRJFLVQHIXNVCJ-WMLDXEAASA-N 425.358 4.566 50 10 IJGE CC(C)C[C@@H](CBr)CN(CCN(C)C(=O)OC(C)(C)C)CC(F)(F)F 2328529434 VAISYJPQZWKOKA-AWEZNQCLSA-N 433.353 4.775 50 10 IJGE FC(F)(CCl)C(F)(F)CNCc1ccc(Br)cc1Br 2336533166 BBBUGFVUHOYTTI-UHFFFAOYSA-N 427.461 4.811 50 10 IJGE CN(CC1(CBr)CCCC1)C1C[C@@H]2C[C@H](C1)CN(C(=O)OC(C)(C)C)C2 2339979395 PKHFWXSRXSITOD-JWTNVVGKSA-N 429.443 4.909 50 10 IJGE O=C(N/N=C/c1cccc(C(F)(F)F)c1)c1cnn(-c2ccccc2)c1C(F)(F)F 1508370 NBRSVKHWCSXBLX-NSKAYECMSA-N 426.320 4.674 50 10 IJGE COc1cc(/C=C(\C#N)c2ccc(C(=O)O)cc2)c([N+](=O)[O-])cc1OCc1ccccc1 2882879 HKVFIWAASGJYPF-RGVLZGJSSA-N 430.416 4.945 50 10 IJGE CC(C)Oc1ccc(Br)cc1/C=C(/C#N)c1nn(-c2ccccc2)c(N)c1C#N 33247320 KUVURSUKPYAITP-YBEGLDIGSA-N 448.324 4.940 50 10 IJGE COc1ccc(C[C@H](Br)c2ccc(I)cc2)cc1OC 110295439 UXFOGXCZAVRLMF-AWEZNQCLSA-N 447.110 4.987 50 10 IJGE CC(C)Oc1ccc(/C=N/NC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cc1Cl 169928037 FKZLMTUXDJMCEG-GEVRCRHISA-N 436.126 4.829 50 10 IJGE O=C(NC[C@@H]1CC[C@@H](Br)C1)c1ccc(Br)cc1Br 227668675 YWVLFVJEOJTQBV-RKDXNWHRSA-N 439.973 4.505 50 10 IJGE CC(CC(=O)Nc1cccc(C(F)(F)F)c1)=NNC(=O)COc1cccc2ccccc12 254622715 BZALNMGCKJDPTG-UHFFFAOYSA-N 443.425 4.758 50 10 IJGE C[C@H]1CN(c2nc3sccn3c2CBr)[C@H](C)[C@@H](C)N1Cc1ccccc1 404295722 WZWNLWBSRJJDBV-ARFHVFGLSA-N 433.419 4.778 50 10 IJGE C[C@@H]1CCCN(c2ncc(Br)cc2Br)[C@H]1CCBr 700290428 DMRWQVLRZLZBCP-SKDRFNHKSA-N 441.005 4.997 50 10 IJGE CC1(C)C[C@@H](Cl)C[C@H](NC(=O)c2ccc(I)c(Cl)c2)C1 703341854 QDUAMDVJHJGYEA-QWRGUYRKSA-N 426.125 4.861 50 10 IJGE O=C(CSCc1cccc(Cl)c1)NN=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 1084222438 VEGMFJZICIMHLS-UHFFFAOYSA-N 429.885 4.892 50 10 IJGE C=CCCOCCNC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1267336786 VOJLSSWASRGKCQ-UYRXBGFRSA-N 431.458 4.729 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C)c1ccccc1C(F)(F)F 1290210283 IFPPXQUISOEMFJ-FYWRMAATSA-N 441.453 4.977 50 10 IJGE C/C(=C/c1cccc(Cl)c1)C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1 1523453260 OVKXDWOIMKJBPG-SSZFMOIBSA-N 438.886 4.923 50 10 IJGE C/C(=C\c1ccccn1)C(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 1530105307 VRDQTTNRROTYTP-JQIJEIRASA-N 437.952 4.892 50 10 IJGE C/C(=C/c1ccccn1)C(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 1530105309 VRDQTTNRROTYTP-PEZBUJJGSA-N 437.952 4.892 50 10 IJGE C=C(C)C[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(=O)OCC 1625184367 POEGJYCTJGDKFU-JJEHFPDLSA-N 439.943 4.669 50 10 IJGE C=C(C)[C@H](NC(=O)NNC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)c(F)c1 1671851656 HTGZCJPIMHKWGY-INIZCTEOSA-N 429.254 4.925 50 10 IJGE Cc1c(C(=O)N(C)c2ccccc2)oc2c1C(=NNC(=O)c1ccccc1Cl)CCC2 1772744559 WTTUCCVAZRHYSA-UHFFFAOYSA-N 435.911 4.988 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(F)cc2)cc1 1865693621 XKDNEOGYDUPFJR-HSZRJFAPSA-N 432.499 4.776 50 10 IJGE COC(=O)c1ccc2c(O)nc(/C(C#N)=C/c3ccccc3OCc3ccccc3)nc2c1 1872727626 PGKDJXJQHKHYRV-DEDYPNTBSA-N 437.455 4.765 50 10 IJGE CC(C)[C@H](CCNC(=O)OC(C)(C)C)CCC(=O)N(C)C[C@H]1C[C@@H](Br)C1 1887822421 AZRJJIMFZSVWPH-YESZJQIVSA-N 433.431 4.586 50 10 IJGE CCC[C@]1(C(=O)N(C)C[C@H]2C[C@@H](Br)C2)CCCCN1C(=O)OC(C)(C)C 1887828819 BAGDIHBZEJZRRJ-GQIGUUNPSA-N 431.415 4.578 50 10 IJGE CN(Cc1ccc(Br)cc1Br)C1(CBr)CCC1 1914970409 BABZMLYCADGTDV-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(Br)cn1 1915128790 ZOTWACIGVWSWJS-CQSZACIVSA-N 426.152 4.660 50 10 IJGE Cc1cccc(C(=O)N2[C@H]3CCC[C@H]2CC(Br)C3)c1I 1922745195 FBHGFXQYFOXSBE-STQMWFEESA-N 448.142 4.520 50 10 IJGE CC(C)CCN(CCBr)S(=O)(=O)c1ccc(Cl)c(Br)c1 1924443503 WGWQMUZHDMTBCW-UHFFFAOYSA-N 447.620 4.534 50 10 IJGE CCO[C@H](C)C(CBr)(CBr)c1ccc(Br)cc1 1941147731 DTAJKMYLVGACRT-SNVBAGLBSA-N 428.990 4.902 50 10 IJGE CN(C(=O)c1csc(Br)c1Br)[C@H]1CCC[C@@H]1Br 1945186470 HZUCKNGTFFBNNM-YUMQZZPRSA-N 446.002 4.661 50 10 IJGE CCN(C)C[C@H](Br)CCc1ccc(Br)cc1Br 1949931675 SWUDSZYVSSZCQG-GFCCVEGCSA-N 428.006 4.859 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN1Cc1cccc(Br)c1Br 2018116073 YGUPTMGOIDUOBR-SKDRFNHKSA-N 425.990 4.959 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)CC1(CBr)CC1 2026563806 NJTIWFXEUZPDGP-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE C[C@H](CCCBr)CNC(=O)c1cccc(Br)c1Br 2031480402 VMEONYNFKKXWJY-SECBINFHSA-N 441.989 4.753 50 10 IJGE Cc1oc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)CC1CCCC1 2059284791 PRVGGZRYIPTXRL-UHFFFAOYSA-N 426.376 4.864 50 10 IJGE CC(C)(C)[C@H]1[C@@H](Br)CCN1c1ncc(Br)cc1Br 2065423893 WZEOMVCWDCXMAQ-GXSJLCMTSA-N 441.005 4.995 50 10 IJGE CN(C[C@]1(Br)CC1(F)F)c1ccc(Br)cc1CBr 2082522485 YMBRLXNWKNIZGY-LLVKDONJSA-N 447.943 4.953 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@@H](Cl)c2sc(Br)cc2Br)C1 2137239063 PHEZFEIXNJBHNQ-CQFDHEJISA-N 448.629 4.768 50 10 IJGE C[C@]1(CCl)CC(F)(F)CN1C(=O)c1c(Br)cccc1Br 2159052104 NNKKKSSOMCJXKD-GFCCVEGCSA-N 431.502 4.690 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)C1C[C@@H]2CC[C@H](C1)O2 2181337668 TXXKKHNJYLYLFN-QXTGLRCKSA-N 449.126 4.620 50 10 IJGE ClCc1nc2cc(Br)c(Br)cc2n1CCc1cscn1 2234064806 IFYKYVMFELPICE-UHFFFAOYSA-N 435.572 4.999 50 10 IJGE Oc1nc(Cn2c(CCl)nc3cc(Br)c(Br)cc32)cs1 2234071947 YPKDPHHBMOBSLG-UHFFFAOYSA-N 437.544 4.511 50 10 IJGE CCN[C@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@H]1Br 2260006478 SPCQWMZLVIHLAO-MQNJHXBQSA-N 447.943 4.924 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1C(=O)c1cc(Br)ccc1Br 2260370456 CJFQGSRWRMSLIJ-RYUDHWBXSA-N 439.973 4.600 50 10 IJGE Clc1ccc(CN2CC[C@@H](Br)C3(CC3)C2)cc1I 2315552059 ZBIRDTQKOOMZHD-CYBMUJFWSA-N 440.550 4.694 50 10 IJGE N#CC(=CNc1ccc(Nc2ccccc2)cc1)C(=O)N1CCN(c2ccc(F)cc2)CC1 2318461940 AYOPOEBQQRJSEO-UHFFFAOYSA-N 441.510 4.737 50 10 IJGE Clc1ccc(CN2C[C@H](Br)CCC23CC3)c(I)c1 2318537966 GUCBSWOZDXWLBC-LLVKDONJSA-N 440.550 4.837 50 10 IJGE COc1ccc(OC)c(C(C)=NNC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)c1 2321278478 UPAUNBSUVNIKIT-UHFFFAOYSA-N 425.435 4.506 50 10 IJGE Clc1ccc(I)cc1CN1[C@H](CBr)[C@H]2CC[C@@H]1C2 2327405674 DYOHSFPZHUHOQH-MRCXROJRSA-N 440.550 4.692 50 10 IJGE Brc1cccc([C@H](CI)OC[C@H]2O[C@H]3CC[C@H]2C3)c1 2352707571 LTXWNIGEHGMRFQ-CYUUQNCZSA-N 437.115 4.509 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]1C(F)(F)F 2353827462 ZFSSLSKUUYEUHC-RBSFLKMASA-N 445.364 4.916 50 10 IJGE COCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C[C@@](C)(CBr)C(C)(C)C 2380165132 QGWXHCFTNWTEFS-LAUBAEHRSA-N 449.474 4.782 50 10 IJGE COc1ccc(/C(C)=N/NC(=O)COc2ccc(C(C)C)cc2Br)c(OC)c1 12580187 UJFNYAZYUCJWMB-OEAKJJBVSA-N 449.345 4.509 50 10 IJGE N#C/C(=C/c1cc(Br)ccc1OCc1ccc(Cl)c(Cl)c1)C(N)=O 59292028 RGHKTEHMDDKIDX-SDQBBNPISA-N 426.097 4.727 50 10 IJGE COC(=O)/C(C#N)=C\c1cccc(OC(=O)/C=C\c2ccc(OCc3ccccc3)cc2)c1 98028245 WTRFPSQAKJUFCF-NNRZVWGZSA-N 439.467 4.964 50 10 IJGE O=S1(=O)CC[C@H](C(CCl)(CCl)Cc2ccc(Br)cc2Cl)C1 168964671 PMQCOVOBOBGTFX-NSHDSACASA-N 434.610 4.544 50 10 IJGE CC[C@H](NC(=O)/C(C#N)=C\Nc1cc([N+](=O)[O-])ccc1OC)c1ccc2c(c1)CCCC2 217192620 BSZPJNJNVMYAKG-SACXWWFQSA-N 434.496 4.569 50 10 IJGE CC[C@@](C)(CCBr)NC(=O)c1cc(Br)sc1Br 228574174 DPSALAGRCURQQK-NSHDSACASA-N 448.018 4.957 50 10 IJGE C[C@H](Cl)c1nc2cc(I)ccc2n1C[C@H]1CSCCS1 229627172 FLMSTSAVZOEPNY-ONGXEEELSA-N 438.787 4.789 50 10 IJGE Cc1ccc(-n2c(SCC(=O)NN=C/C=C/c3ccco3)nnc2-c2ccccc2)cc1 254313361 SRUPAXPXBQFDKB-LAZVDATLSA-N 443.532 4.743 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1Oc1ccc(I)cc1 404259790 CXFMMCYCKKXCSM-UHFFFAOYSA-N 440.056 4.948 50 10 IJGE C[C@@H]1[C@H]2CC[C@@H](C[C@@]13CCC[C@@H](CI)O3)N2C(=O)OC(C)(C)C 686237940 UODORMZWPHZNQH-VAVSNJLASA-N 435.346 4.537 50 10 IJGE COc1ccc(O[C@@H]2C[C@@H](Br)C23CCCC3)cc1I 712929999 KIIQPAGQZBFCJG-ZIAGYGMSSA-N 437.115 4.775 50 10 IJGE O=C(NCC1(CBr)CCC1)c1scc(Br)c1Br 717689934 FQTJGIAJZNELNB-UHFFFAOYSA-N 446.002 4.568 50 10 IJGE C/C(=C\C(=O)NNC(=O)c1ccc(COc2ccccc2)o1)c1ccccc1C(F)(F)F 742035711 WPTGRIXSVCAGSD-FYWRMAATSA-N 444.409 4.742 50 10 IJGE O=C(NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)[C@H]1C[C@H]1c1cc(F)ccc1F 804206083 BWMUNKPPGMZQCG-HOCLYGCPSA-N 434.368 4.687 50 10 IJGE Cc1ccc(C(=O)N2CCN(c3c(Cl)cccc3NC(=O)CCCCl)CC2)cc1 953055325 BHMBMBHMUKQJDC-UHFFFAOYSA-N 434.367 4.568 50 10 IJGE CC(=O)c1ccccc1C(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12 1141361185 GSAQMZFIFBICBQ-UHFFFAOYSA-N 443.890 4.833 50 10 IJGE C#CCCCC(=O)NNC(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 1203392275 SRNNKJFFKAJSEG-UHFFFAOYSA-N 428.901 4.698 50 10 IJGE CC(=O)c1cc(C(=O)NNc2ccc(Cl)cc2Br)ccc1OC(C)C 1641330579 RLYLWXWMHZYCPB-UHFFFAOYSA-N 425.710 4.849 50 10 IJGE C=CCC[C@H](NC(=O)NNc1ncc(Br)cn1)c1ccc(C(F)(F)F)cc1 1680854253 DHIJUQYZSLDRCY-AWEZNQCLSA-N 444.255 4.592 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1cccc(OC)c1)C(C#N)=C(N)O2 1865711720 GPVAPJHKZQZBRR-NRFANRHFSA-N 434.927 4.764 50 10 IJGE Cc1ccc(COc2cccc(/C=N/NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)c2)cc1 1873795659 WDEKUYQQMGCXDM-WGLQLPMYSA-N 439.556 4.573 50 10 IJGE CN(C(=O)OC(C)(C)C)C1CCC([C@@H](CBr)NC(=O)OC(C)(C)C)CC1 1880762078 SFMFSMXMWDLPAK-YMAMQOFZSA-N 435.403 4.700 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)CCc1ccc(Cl)cc1Cl 1905341497 AVHDRWXCCBQCHB-GFCCVEGCSA-N 427.125 4.986 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)C(=O)c1ccc(I)c(O)c1 1915115322 VDQHIGQDHBXXIS-HNNXBMFYSA-N 443.712 4.657 50 10 IJGE CCC[C@@H](Br)CNC(=O)c1csc(Br)c1Br 1937739224 ZPOVWLXOTGAXFX-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE O=C(NCC[C@@H](Br)C1CC1)c1scc(Br)c1Br 1942746976 YRAMWGQTEVLFJM-SSDOTTSWSA-N 446.002 4.567 50 10 IJGE O=S(=O)([C@H]1C[C@H](OCc2ccccc2)C1)N(Cc1ccccc1)[C@H](CCl)C1CC1 1958928512 PQHYRSWBGRYSFP-DNVJHFABSA-N 434.001 4.584 50 10 IJGE O=C(N[C@@H](CBr)CC1CC1)c1cc(Br)cc(Br)c1 2029976457 CJOSEBSDKOJTQE-GFCCVEGCSA-N 439.973 4.505 50 10 IJGE F[C@H]([C@H](Br)c1cc(I)cc2c1OCC2)C(F)(F)F 2059187372 OBEVXKBWTYXBFM-PSASIEDQSA-N 438.984 4.563 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)[C@@H](Br)C2CCCC2)n1 2082966110 SGBYXMVSNYXTQT-MFKMUULPSA-N 432.384 4.621 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@H]1Cl)c1csc(Br)c1Br 2150344914 WIRBUVKPRLQCGR-PWSUYJOCSA-N 435.568 4.908 50 10 IJGE CC(C)(C)OC(=O)NC1CC2(CCCCN2C(=O)c2ccc(CBr)cc2)C1 2162868172 NXFHQWZBNVFPSU-UHFFFAOYSA-N 437.378 4.634 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H](OC)C[C@@]1(C)CNC(=O)OC(C)(C)C 2163062720 MNJLHZZNSPFYEC-XLIONFOSSA-N 449.474 4.972 50 10 IJGE CC(C)(C)[C@@H](CBr)CN1C[C@@H](CCNC(=O)C(F)(F)F)c2ccccc21 2163065096 XJXICJOJJIQZBT-KGLIPLIRSA-N 435.328 4.716 50 10 IJGE Cc1c(Cl)cc(C(=O)N2CCSC[C@@H]2CCBr)cc1Br 2167376410 IJKKRZYTBIBPRX-NSHDSACASA-N 441.616 4.754 50 10 IJGE C[C@@H](Br)CCCc1cn(-c2ccc(Br)c(Cl)c2F)nn1 2189276935 ABUSCZGNIOLVOE-MRVPVSSYSA-N 425.527 4.928 50 10 IJGE COc1cc(Cl)c([C@H](Br)[C@]23COC[C@@H]2C3(F)F)cc1Br 2202364174 GSUBOJBUGZUWIJ-SRVKXCTJSA-N 432.486 4.829 50 10 IJGE Cc1ccc(NC(=O)c2ccc(CBr)cc2)c(I)c1 2231878617 KLMMGCVZFHSMTJ-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCC[C@H](CI)O2)C[C@@H]2CCCC[C@H]21 2246608480 ZNWJAJNWMMAMIA-MKSNKDDYSA-N 449.373 4.929 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC2(CCC2)C[C@@H]1CBr 2264512137 AIAKWRDXNNZKNA-MRVPVSSYSA-N 427.589 4.944 50 10 IJGE CCOC(=O)C(C#N)=Cc1c(Oc2ccc(C(C)(C)C)cc2)nc2c(C)cccn2c1=O 2296719361 IKBPTWQFGADHHQ-UHFFFAOYSA-N 431.492 4.563 50 10 IJGE C[C@]1(CCCl)CCN1Cc1ccc(I)c(Br)c1 2306220605 ZJIYDMDPRIWOKX-ZDUSSCGKSA-N 428.539 4.647 50 10 IJGE CC(C)c1cccc(OCC(=O)Oc2ccc(C=C(C#N)C(=O)NCc3ccco3)cc2)c1 2314760630 RVNAJJOZQGZMNU-UHFFFAOYSA-N 444.487 4.611 50 10 IJGE CCN(CC)Cc1ccc(C=NNC(=O)c2ccc(-c3ccc(OC)cc3)nc2C)cc1 2321218447 PHTIBVIRCAJMEH-UHFFFAOYSA-N 430.552 4.671 50 10 IJGE O=C(c1scc(Br)c1Br)N1[C@H]2CCC[C@H]2C[C@@H]1CCl 2329617490 VYDJWGORGYUBEX-XKSSXDPKSA-N 427.589 4.895 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)CCN1c1nc(C(F)(F)F)ccc1CBr 2343777786 NMMGSIOUKBTBLQ-CQSZACIVSA-N 428.296 4.706 50 10 IJGE COc1c(F)cc([C@@H](Br)c2nn(C)c(Cl)c2Br)cc1F 2370460374 QEGRJKKXFGZMIS-MRVPVSSYSA-N 430.474 4.607 50 10 IJGE CCOC(=O)c1c(NC(=O)CCl)sc(C(=O)Nc2cccc(Cl)c2Cl)c1C 21233570 GVCDKVIFWHKEDM-UHFFFAOYSA-N 449.743 4.970 50 10 IJGE N#C/C(=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1nc2ncc(Br)cc2[nH]1 33467111 OYEUHPVQEJYJAN-GHXNOFRVSA-N 436.225 4.953 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)Cc3ccc(Cl)cc3)ccc2[C@@H]1c1cccc(F)c1 38678372 KIOOPRZLRRNXMK-QHCPKHFHSA-N 434.854 4.845 50 10 IJGE O=C(NC[C@H]1CCC[C@H]1Br)c1cc(Br)c(Br)s1 124332531 VRPZWHFWJSDCHT-RNFRBKRXSA-N 446.002 4.567 50 10 IJGE O=C(N/N=C\c1cccc(OCc2ccc(Cl)cc2)c1)c1ccc2nc(S)[nH]c2c1 169917441 WLSMUIXHJGHNRY-MSXFZWOLSA-N 436.924 4.848 50 10 IJGE CCn1c(SCC(=O)NN=C(C)c2ccccc2)nnc1-c1ccc(C(C)(C)C)cc1 254598410 WBRVWIIVGNFERR-UHFFFAOYSA-N 435.597 4.895 50 10 IJGE O=C(NC[C@H]1CCC[C@H](CCl)C1)c1cc(Cl)ccc1I 312524995 USAQMUONRFYAOE-QWRGUYRKSA-N 426.125 4.720 50 10 IJGE CC(C)(C)S(=O)(=O)CCOc1c(Br)cc(Br)cc1CCl 383594443 SHKJDDRZXWPUJQ-UHFFFAOYSA-N 448.604 4.543 50 10 IJGE CC[C@H](Br)[C@@H](C)NC(=O)c1cc(Br)c(Br)s1 395374463 QIPFMVROOYPFTI-RITPCOANSA-N 433.991 4.565 50 10 IJGE CC[C@H](O[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1I)c1ccccc1 403286803 RWYRVQQSCYKYQD-JYJNAYRXSA-N 431.314 4.577 50 10 IJGE Cc1cc([C@H](Br)c2cn(C)c(Br)n2)sc1Br 698419715 QBNMAFICSKHZKZ-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE BrCc1cc(Br)ccc1N1CC2(CN(Cc3ccccc3)C2)C1 706135082 YHDMNBSCMRMOBF-UHFFFAOYSA-N 436.191 4.666 50 10 IJGE Cc1cccc(NC(=O)Nc2cccc(CNC(=O)NNc3cccc(F)c3F)c2)c1 745664718 KLEGDWDKOOKBQO-UHFFFAOYSA-N 425.439 4.744 50 10 IJGE CCCCSc1ccc(C(=O)NNc2nc(-c3cccnc3)no2)cc1C(F)(F)F 760875458 AVGKDWUMIFXJRC-UHFFFAOYSA-N 437.447 4.800 50 10 IJGE CC(C)Cn1nc(-c2ccccc2)cc1NC(=O)C(=O)NNc1cc(Cl)cc(Cl)c1 792438701 YTFFACURYADWNS-UHFFFAOYSA-N 446.338 4.595 50 10 IJGE C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](O[Si](C)(C)C(C)(C)C)C1 1149155866 BXOPKCWSNYTNQD-JKSUJKDBSA-N 433.065 4.645 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)Nc3cccc4c(O)nccc34)c2C)cc1 1449492439 YVZBBDOUGQYPPS-XMHGGMMESA-N 438.487 4.902 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1ccn(-c2ccc(Cl)c(Cl)c2)n1 1453773991 UJMXVXAUCUPYAV-UHFFFAOYSA-N 431.308 4.542 50 10 IJGE Cc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)N3c4ccccc4C[C@H]3C)c(C)c21 1772744300 VLQAVMHUYZUAAL-QGZVFWFLSA-N 441.531 4.958 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2F)[C@H]1c1ccccc1Cl 1865684951 CAFIYANBZBNROF-INIZCTEOSA-N 448.807 4.961 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccc(Cl)cc2)c1 1865690425 QUNQRAKGDDWZDP-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc3ccccc23)[C@@H]1c1ccccn1 1865699757 BRYYYQIIVQKFPY-SFHVURJKSA-N 433.393 4.657 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CNC(=O)/C(C#N)=C/c1ccccc1)c1cccc(Cl)c1 1868026109 KHGOINZXNYQTPW-YWFITGJYSA-N 425.916 4.629 50 10 IJGE COc1cccc(-c2csc(/C(C#N)=C(\O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3C)n2)c1 1872744340 NMSJMINTHLVNMV-MNDPQUGUSA-N 438.421 4.893 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Cl)CCc1cccc(Cl)c1Br 1905407317 YADJZAXHBJWFNM-LBPRGKRZSA-N 427.125 4.939 50 10 IJGE O=C(c1ccc(Br)cc1O)N(CCCBr)Cc1ccccc1 1914628319 RRJJRNYCWXYIRN-UHFFFAOYSA-N 427.136 4.582 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@@]2(CCC[C@@H]2Cl)C1 1918932511 ARJKBHRECRYAIF-ZANVPECISA-N 427.589 4.897 50 10 IJGE Cc1ccnc(C(=O)N(Cc2ccccc2)[C@H](C)CCBr)c1Br 1927120613 DAPPMQAVEJLSOT-CQSZACIVSA-N 440.179 4.968 50 10 IJGE C[C@H](Br)C(C)(C)NC(=O)c1csc(Br)c1Br 1937737519 JVYHACJKCRRYEO-YFKPBYRVSA-N 433.991 4.565 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@](C)(CI)O2)C[C@@H]1C1CC1 1990240816 MCQSNYUQGYIWMC-ZTFGCOKTSA-N 435.346 4.539 50 10 IJGE Clc1ccc(I)c(C[C@H]2CCOCC[C@H]2Br)c1 2001019241 YDWJYFLZEMWIRU-BXKDBHETSA-N 429.523 4.677 50 10 IJGE CC(C)CN(CCBr)C(=O)c1ccc(Br)cc1Br 2036717547 JZSCAHCFMOGQCG-UHFFFAOYSA-N 441.989 4.705 50 10 IJGE FC(F)(F)c1ccc(CCl)c(I)c1I 2060235156 FUTXRWZHYFEFRJ-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE ClCc1cccc(CNc2ncc(I)cc2Br)c1 2069526287 TYDQBOLKXLDSHM-UHFFFAOYSA-N 437.506 4.800 50 10 IJGE CN(c1ncc(I)cc1Br)C1CCC(CCl)CC1 2069528240 HIZUVMIWWGTKLO-UHFFFAOYSA-N 443.554 4.683 50 10 IJGE CC[C@@H]1CCOC[C@@H]1O[C@@H](CI)c1ccccc1Br 2096209355 YJTHXINFOVIRLJ-UGFHNGPFSA-N 439.131 4.757 50 10 IJGE ClCCc1nc2cncc(Br)c2n1CC[C@H]1CCN(Cc2ccccc2)C1 2151778257 LAMIOVUWDLQJHJ-QGZVFWFLSA-N 447.808 4.887 50 10 IJGE Cc1sc(Br)c(C(=O)N2CCC(F)(F)[C@@H](CBr)C2)c1C 2157248267 JSBRIRLJNLBIOS-VIFPVBQESA-N 431.140 4.620 50 10 IJGE CC(C)N(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2167033296 QLHRXIWRFWWMNI-QZTJIDSGSA-N 445.442 4.967 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C[C@@H](CBr)CC2CC2)C1 2185502003 PQWSPNNPTALAJW-HZPDHXFCSA-N 441.414 4.747 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CC2(CBr)CCC2)C[C@H]1c1ccccc1 2185530235 SFTKYQJMKJKWOM-MOPGFXCFSA-N 437.422 4.792 50 10 IJGE Cc1ccc(I)c(C(=O)NCCCC(C)(C)CBr)c1 2232157287 DTTUINOEGZKDFD-UHFFFAOYSA-N 438.147 4.531 50 10 IJGE CCc1nc(Br)c(Br)n1CC1(CBr)CC(C)C1 2246824040 QGDSJTOCJORAGC-UHFFFAOYSA-N 428.994 4.782 50 10 IJGE C[C@H]1CN(CCCCI)c2ccccc2CN1C(=O)OC(C)(C)C 2248246452 BKWDTJJJOXTZMH-HNNXBMFYSA-N 444.357 4.847 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCCCBr)C[C@@H]1CC(F)F 2263165409 TWJGXEUNGMYNJW-HNNXBMFYSA-N 427.374 4.908 50 10 IJGE C[C@H](Br)[C@H]1CCCN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282978935 SSKTWNSABAYLIR-IUCAKERBSA-N 427.539 4.877 50 10 IJGE COc1ccc(-c2[nH]nc(C(=O)NN=CC(Br)=Cc3ccccc3)c2C)cc1 2294737321 TYAOVDKJGZQKHD-UHFFFAOYSA-N 439.313 4.545 50 10 IJGE CN(Cc1ccc(I)cc1)[C@H](CBr)Cc1ccccc1 2296471607 LEDBNQWNIKBSPC-KRWDZBQOSA-N 444.154 4.729 50 10 IJGE CCCCCOc1ccc(C=C2C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)cc1OC 2314618301 KZLXRKGWQCUCPK-UHFFFAOYSA-N 434.492 4.650 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)C=Cc1cccc(OC(C)C)c1 2321059198 SYZFVQHFXFSWLA-UHFFFAOYSA-N 449.938 4.972 50 10 IJGE N#CC(=CNCc1cccc(Br)c1)C(=O)Nc1ccc(Cl)cc1Cl 2324494709 YCTVAWGPTSQHAT-UHFFFAOYSA-N 425.113 4.892 50 10 IJGE C[C@H](NC(=O)C(C#N)=CNc1cc([N+](=O)[O-])ccc1Cl)C12CC3CC(CC(C3)C1)C2 2324900419 CHIWXBDOEPKOKS-QRYOHXEKSA-N 428.920 4.789 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CC[C@@H]3C[C@H]2CO3)cc1I 2334463531 LAECCBRCWYEDSK-YFCNSXCBSA-N 437.115 4.551 50 10 IJGE O=C(NCC(F)(F)C(F)(F)CBr)c1ccc(OCc2ccccc2)cc1 2336543276 HZEVOJPIRDEGID-UHFFFAOYSA-N 434.227 4.661 50 10 IJGE CC(C)(C)[C@@H]1CC[C@@H](Br)[C@H](Cc2ncc(I)cn2)C1 2353065761 QVGYTFIAQAGOST-DMDPSCGWSA-N 437.163 4.850 50 10 IJGE Cc1c(CBr)ccc(NS(=O)(=O)c2cscc2Br)c1C 2367942394 JZUXMXLIQFPZLM-UHFFFAOYSA-N 439.194 4.823 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1 9874163 GZMKZUAEXATLDN-RBUKOAKNSA-N 426.557 4.854 50 10 IJGE C/C(=N\NC(=O)COc1ccc2cc(Br)ccc2c1Br)C1CC1 12491431 OAOLCPPREAMPFF-KEBDBYFISA-N 440.135 4.646 50 10 IJGE CN(Cc1ccc(Cl)nc1)c1c([N+](=O)[O-])c(C(Cl)Cl)nn1-c1ccccc1 33353562 ZYKYRJLAVXSFDC-UHFFFAOYSA-N 426.691 4.942 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(OC)cc4)ccc32)cc1 38676797 NZBGXYLZBYDIFD-DEOSSOPVSA-N 426.472 4.695 50 10 IJGE CCCCCCOc1ccc(/C=N/NC(=O)[C@@H](C)Oc2cccc(OC)c2)cc1OC 40960735 KOYDDUGFTSLIRJ-UPMNJHNBSA-N 428.529 4.581 50 10 IJGE C=CCOc1cc(Br)c(/C=N/NC(=O)c2cc3ccccc3o2)cc1OC 59305189 NGZGZIRXVZGHHD-WSDLNYQXSA-N 429.270 4.533 50 10 IJGE O=[N+]([O-])c1ccccc1C[C@@H](Br)c1ccccc1I 110296357 AOLYQSIFZATMPZ-GFCCVEGCSA-N 432.055 4.878 50 10 IJGE CCCOc1c(Cl)cc(/C=N/NC(=O)c2cc(-c3ccccc3)nc(O)n2)cc1Cl 169923249 LDUCZULLYKXGFN-WYMPLXKRSA-N 445.306 4.709 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccc(C)cc3)c(OCC)c2)C1=O 214222973 KFAXHHVGUHLJBR-HMAPJEAMSA-N 444.531 4.975 50 10 IJGE CC[C@H](N/C=C(/C#N)C(=O)N1CCN(c2ccc(F)cc2)CC1)c1ccc2c(c1)CCCC2 217237052 WWNIVMOYADZTTF-WHSZPFTHSA-N 446.570 4.501 50 10 IJGE CC[C@@H](Br)CCNC(=O)c1ccc(Br)cc1Br 233853643 BGVNIAMQDPJYGO-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE CC(=NNC(=O)/C(=C/C(C)=C\c1ccccc1)NC(=O)c1ccccc1)c1ccccc1O 252610352 IAVPMFYZZSHZEZ-CXEMBKQWSA-N 439.515 4.650 50 10 IJGE CCCCCCCCOc1ccc(OCC(=O)NN=Cc2cccc([N+](=O)[O-])c2)cc1 254756508 RANVDXTUIJNFBN-UHFFFAOYSA-N 427.501 4.863 50 10 IJGE ClCc1cc(I)cc2sc(I)cc12 307493053 KADHWVQQTLUNHI-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE O=C(OCc1ccccc1)N1C[C@@H](CI)[C@H](c2ccccc2F)C1 382697089 SOXDARICFPJRGU-NVXWUHKLSA-N 439.268 4.613 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1C(=O)c1scc(Br)c1Br 705440498 AWTRGDCAUTXZIS-RQJHMYQMSA-N 446.002 4.661 50 10 IJGE COc1ccc(C(=O)NN=Cc2ccc(Sc3nc4ccccc4s3)o2)cc1OC 1084568171 QOSWZIFAXDCGQR-UHFFFAOYSA-N 439.518 4.822 50 10 IJGE Cc1cc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)ccc1[N+](=O)[O-] 1614641141 IDQWQYQQGNGPFB-ROUUACIJSA-N 433.302 4.650 50 10 IJGE CCOc1ccc([C@]2(C(=O)NNc3nc4ccccc4[nH]c3=S)CC2(Cl)Cl)cc1 1646017760 RKEKFGFMBCKAGG-IBGZPJMESA-N 449.363 4.650 50 10 IJGE Cc1nn(-c2cccc3ccccc23)c2c1[C@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689600 UCYIVHCASDJXIP-JOCHJYFZSA-N 428.879 4.911 50 10 IJGE COc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc3ccccc23)c1OC 1865701195 OTJZCXUIUWFWNX-QHCPKHFHSA-N 438.487 4.569 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865713088 QMBKRHUYDSXPLD-FQEVSTJZSA-N 449.898 4.664 50 10 IJGE C[C@@H](/C(O)=C(\C#N)c1nc(-c2ccc(F)cc2F)cs1)N1C(=O)c2ccccc2C1=O 1872818291 VXQSVOWKCKBUPC-WTAXECHQSA-N 437.427 4.566 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)C(=O)Cc1cccc(Br)c1 1914217221 YJJMLXKXKZQABF-CQSZACIVSA-N 425.164 4.804 50 10 IJGE CCCC(CBr)(CCC)CN=[S@](C)(=O)C[C@H](C)NC(=O)OC(C)(C)C 2044700049 PEVPUJDDSROZHR-ODCWNRFASA-N 441.476 4.979 50 10 IJGE O=C(Nc1cc(Cl)ccc1I)[C@@H](Br)C1CCCC1 2048149292 WICNZWJUYJPMOY-LBPRGKRZSA-N 442.522 4.837 50 10 IJGE Cn1ncc(COc2c(Br)cc(Br)cc2CCl)c1Cl 2111944724 NNWWILRWVUQDBK-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](NC(=O)c2ccc(CBr)cc2)CC1 2133337545 RDJWVONBPVPHQR-DLBZAZTESA-N 425.367 4.537 50 10 IJGE C[C@H](Br)C[C@@H]1CCCCCN1Cc1nn(C)c(Cl)c1Br 2152984853 IDHKJAFVJYDHJN-QWRGUYRKSA-N 427.612 4.754 50 10 IJGE CN(c1nc2ccccn2c1CBr)[C@@H]1CN(Cc2ccccc2)C(C)(C)C1 2154829626 IDQDAYCVFVXDMZ-SFHVURJKSA-N 427.390 4.719 50 10 IJGE C[C@@H]1CCCN(C(=O)[C@H](Br)C2CCCC2)[C@H]1CCCNC(=O)OC(C)(C)C 2167031933 HBEKSKWGUBEQQI-BPQIPLTHSA-N 445.442 4.872 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CNC(=O)[C@H](Br)C3CCCC3)CCC[C@H]12 2167033092 PLWMOSNPGRCHEP-FVJLSDCUSA-N 443.426 4.626 50 10 IJGE Clc1cc(Br)ccc1CN1CCC(COCCBr)CC1 2167391961 LRGVVVDHFWMMEJ-UHFFFAOYSA-N 425.592 4.726 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@@]12CCCC[C@H]1N(C(=O)OC(C)(C)C)CCC2 2196908444 XNCUVYRKTWJXTN-KYFSNAEOSA-N 443.426 4.578 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)CC[C@@H](CCNC(=O)OC(C)(C)C)C(C)(C)C 2196914475 NPPJXHUIIGBMFZ-ULQDDVLXSA-N 447.458 4.976 50 10 IJGE Cc1cc(C(=O)N2[C@H]3CCC[C@H](Br)[C@H]2CC3)ccc1I 2207096118 JGMQKRBSHXFLHZ-KCQAQPDRSA-N 448.142 4.520 50 10 IJGE Cc1sc([C@H](Br)c2nn(C)nc2Br)c(C)c1Br 2214373004 NLKJNJQETNZMKH-SSDOTTSWSA-N 443.990 4.503 50 10 IJGE CC1(C)CN(c2ncc(I)cc2Br)C[C@@H]1CCCl 2222561351 QZUJRXWKNDXODT-VIFPVBQESA-N 443.554 4.540 50 10 IJGE BrCc1nnc(Cc2cc(Br)cc(Br)c2)s1 2246003091 CRMSQVVQBCALJR-UHFFFAOYSA-N 426.959 4.549 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CCCCCCCBr)C[C@H]1C(F)(F)F 2263154717 SGZQBRLYVZDWPY-KGLIPLIRSA-N 431.337 4.719 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)CC[C@H]1CBr 2282980194 KOLNCDZWQOSONJ-BDAKNGLRSA-N 427.539 4.735 50 10 IJGE COc1ccc(C=C(C#N)C(=O)NCc2ccco2)cc1COc1ccc2c(c1)CCC2 2295672683 QNXPHNKONKAUKV-UHFFFAOYSA-N 428.488 4.579 50 10 IJGE N#CC(C(=O)Nc1ccc(F)cc1)=C1S[C@H](Cc2ccccc2)C(=O)N1c1ccccc1 2296552194 WFBDMLGIYWDYGW-JOCHJYFZSA-N 443.503 4.891 50 10 IJGE Cl[C@H](CCNCc1ccc(I)c(Br)c1)C1CC1 2306224560 RMYZDCVPEIEIOA-GFCCVEGCSA-N 428.539 4.551 50 10 IJGE C[C@@H]1CCN(Cc2cc(I)ccc2Cl)[C@H]1CBr 2307324121 IOKPQFJSJLHHCY-RNCFNFMXSA-N 428.539 4.550 50 10 IJGE COc1ccc(NC(=O)C(C#N)=Cc2ccc(OCc3cccc(F)c3)c(OC)c2)cc1 2313724513 DFWWHMWBBJOWQJ-UHFFFAOYSA-N 432.451 4.968 50 10 IJGE Clc1cc(CN2C[C@H]3CC[C@H]2C[C@H]3Br)ccc1I 2315477284 ZWSBUQKCBLEUQJ-GRYCIOLGSA-N 440.550 4.692 50 10 IJGE C[C@@H]1CCCN(Cc2ccc(Cl)c(I)c2)[C@@H]1CBr 2315551759 VTJJWNVPRASOKG-QMTHXVAHSA-N 442.566 4.940 50 10 IJGE CC[C@](C)(CCBr)NC(=O)c1ccc(Cl)cc1I 2317765659 HFDOCHSXRFMGTN-CYBMUJFWSA-N 444.538 4.628 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@H]2C[C@H](Cl)CC[C@H]21 2328608293 HVZZYQREJPNWBP-QXFUBDJGSA-N 427.589 4.895 50 10 IJGE COc1ccc(CC(O)=C(C#N)c2nc(-c3ccc(OC)cc3OC)cs2)c(OC)c1 2331385777 ISQYXVIESILBJN-UHFFFAOYSA-N 438.505 4.880 50 10 IJGE CC(C)N(C[C@@H]1CCCN(C[C@]2(CBr)CC2(F)F)C1)C(=O)OC(C)(C)C 2351889116 OPPOJEBHYZAMHU-CRAIPNDOSA-N 439.385 4.764 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H](NC(=O)OC(C)(C)C)C[C@@]1(C)COC 2364208794 MCFZBCOOHOQPCX-XLIONFOSSA-N 449.474 4.972 50 10 IJGE CC(C)CCOc1ccc(C(=O)NNC(=O)c2cccc(OCCc3ccccc3)c2)cc1 10331799 LJROVFRAEVZLOA-UHFFFAOYSA-N 446.547 4.808 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2OC)cc1 38650003 OWPPMMRITHTDGA-XMMPIXPASA-N 442.471 4.531 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)cc1 38652641 SFRNJUBNLRQXSC-HSZRJFAPSA-N 430.435 4.662 50 10 IJGE Cc1cc(OCC(=O)N/N=C/c2c[nH]c3ccccc23)c(C(C)C)cc1Br 40912285 MCBUJXXMQRCGGO-BHGWPJFGSA-N 428.330 4.891 50 10 IJGE O=C(NNC(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12)Nc1cccnc1Cl 72040084 UMPVEGZLPAMQEV-UHFFFAOYSA-N 435.846 4.556 50 10 IJGE CCC[C@@H](CCBr)CNS(=O)(=O)c1ccc(Cl)c(Br)c1 227506207 BPWXBNUKXBRUBA-JTQLQIEISA-N 447.620 4.582 50 10 IJGE O=C(COc1ccc(Br)cc1)NN=Cc1cccc(OCc2ccccc2)c1 252461160 LARCZLIZIDGXNR-UHFFFAOYSA-N 439.309 4.557 50 10 IJGE C[C@@H](NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1ccc(Oc2ccccc2)cc1 303179642 WYZBTZGAVTXADB-QGZVFWFLSA-N 428.492 4.676 50 10 IJGE ClCc1csc2c(I)cc(I)cc12 306650770 HPKGQMSQMMZYBW-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CCC[C@@H](CCBr)NC(=O)c1cc(Cl)ccc1I 716856581 SQGJBBHKZDZKTD-JTQLQIEISA-N 444.538 4.628 50 10 IJGE CC[C@H](C[C@@H](C)Cl)NS(=O)(=O)c1cc(Br)c(C)cc1Br 716891055 JLRAMPAOUMRKGZ-NXEZZACHSA-N 447.620 4.594 50 10 IJGE O=C(CC[C@H](O)c1ccccc1)NN=Cc1ccc(-c2ccc(Br)cc2)o1 725423540 QTFOHQADRUIFCL-IBGZPJMESA-N 427.298 4.673 50 10 IJGE CCC[C@@H](Cc1ccccc1)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 727810684 CIHBQYFHFNAEMW-YFORGORKSA-N 437.547 4.898 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)c1C 736697037 RBBXVQBAAJHDEH-CQSZACIVSA-N 426.524 4.518 50 10 IJGE COc1cc(C)c(C(=O)NNc2c(Cl)cc(Br)cc2Cl)cc1OC 755350850 YIWGUJNNDBMYFP-UHFFFAOYSA-N 434.117 4.838 50 10 IJGE Cc1cc(NNC(=O)CCc2nc(O)c3c4c(sc3n2)C[C@@H](C)CC4)ccc1Cl 1154547277 UEMHPCVYUXXIHI-NSHDSACASA-N 430.961 4.559 50 10 IJGE CC(=O)c1cc(F)c(O)c(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccccc3C)c2C)c1 1178428623 IELWTGSHZKCZSV-JMIUGGIZSA-N 431.467 4.996 50 10 IJGE C=CCC1(CNC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)CCCC1 1248675062 OEPNNRNBWAUBOJ-UHFFFAOYSA-N 443.551 4.620 50 10 IJGE C#C[C@H](NC(=O)NNc1c(C)cccc1Br)c1ccc(Br)cc1 1312936032 FEMZKKSFGXAYEJ-HNNXBMFYSA-N 437.135 4.521 50 10 IJGE CC(=O)CCc1ccc2oc(C(=O)NNc3cc(Br)ccc3F)c(C)c2c1 1456700837 OBAMOWDPYAGQOC-UHFFFAOYSA-N 433.277 4.921 50 10 IJGE C=CCN(CC(=O)OCC)C(=O)/C(C#N)=C\c1cc(C)n(-c2cccc3ccccc23)c1C 1535635028 DITMUOQNYPGYRJ-KQWNVCNZSA-N 441.531 4.732 50 10 IJGE C/C(=C/C(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(C)c1C)c1ccc(F)cc1 1543608327 UCIZGMKXTHPOES-ICFOKQHNSA-N 442.494 4.688 50 10 IJGE C=CCCC[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2)c1C)C(=O)OC 1558384505 ZTAUSRFNYRIUSJ-QUYTYNJFSA-N 439.943 4.669 50 10 IJGE C/C(=C/c1ccco1)C(=O)NNc1nc2ccccc2c(=O)n1-c1ccc(C(C)C)cc1 1617519028 GBSCPBHERUSMRD-ICFOKQHNSA-N 428.492 4.649 50 10 IJGE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NNc1nc(-c2cccnc2)nc(C)c1C 1648578069 HUMNOPHTNCHMHD-ACCUITESSA-N 443.429 4.601 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNc1ccc(OC)cc1Br 1651334790 VOYCEHBXWKILPO-UHFFFAOYSA-N 445.235 4.798 50 10 IJGE CCCc1nn(-c2ccccn2)c2c1[C@@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 1865685130 DKRYVPPRVSXLAS-SFHVURJKSA-N 426.307 4.745 50 10 IJGE Cc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2ccccc2C(=O)O)cc1 1865704179 PKDUTUOVPSZPAO-QFIPXVFZSA-N 448.482 4.764 50 10 IJGE COc1ccc2c(c1)c(/C=C1\Oc3cc(OC(=O)C(Cl)Cl)cc(C)c3C1=O)cn2C 1871386163 HEWTXWROXURNDD-WSVATBPTSA-N 446.286 4.821 50 10 IJGE C[C@@H](/C(O)=C(\C#N)c1nc(-c2c[nH]c3ccccc23)cs1)N1C(=O)c2ccccc2C1=O 1872753047 FPBRFBVTFLOQAA-ZCBJIMFGSA-N 440.484 4.769 50 10 IJGE CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1ccc(-c2ccccc2Cl)o1 1873793272 GPNFLQSBEYLYHC-VQXFCIMOSA-N 433.936 4.990 50 10 IJGE C[C@@H](C(=O)N(C)C[C@H]1C[C@H](Br)C1)c1ccc(NC(=O)OC(C)(C)C)cc1 1887822819 GIQDESXJXHTLPZ-IIAWOOMASA-N 425.367 4.769 50 10 IJGE CCCCOCCOCCOCCN(Cc1ccccc1)C1(CBr)CCC1 1915751776 XEWGRHCKGIZYGA-UHFFFAOYSA-N 442.438 4.656 50 10 IJGE C[C@H]1C[C@@H](CBr)CN1C(=O)c1scc(Br)c1Br 1950513266 QUCNSSFWMUSNDW-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE Cc1csc(C(=O)NCCCCCCI)c1Br 1950888614 ZXZYMDVAKWMNRD-UHFFFAOYSA-N 430.149 4.544 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@H]1CCCN(C[C@H](CBr)C2CC2)C1 1966339755 SWKPNBWNWFVFSJ-GBESFXJTSA-N 429.443 4.909 50 10 IJGE O=C(OCc1ccccc1)N1CCC2(CC1)CCN2CC1(CBr)CCCC1 1999501781 PXBZDUFYSJVCFM-UHFFFAOYSA-N 435.406 4.819 50 10 IJGE BrC[C@@H]1CSCCN1Cc1cc(Br)ccc1Br 2006497500 VGBPMCIYBGOBFM-LLVKDONJSA-N 444.030 4.524 50 10 IJGE CC1([C@H](Br)c2cc(I)cc3c2OCC3)CC(F)C1 2035874500 HBYURPKGERGAKF-JRZRUSQNSA-N 425.079 4.800 50 10 IJGE FC1(F)C[C@H](CBr)N(Cc2ccc(Br)cc2Br)C1 2041126593 FZKGSYDFAVZFEU-SNVBAGLBSA-N 447.943 4.816 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1ccc(Cl)c(NC(=O)OC(C)(C)C)c1 2076221017 ROUDDKOZDGBFJA-UHFFFAOYSA-N 431.758 4.933 50 10 IJGE Cn1nc(COc2ccc(Br)cc2CCl)c(Br)c1Cl 2096689317 XQAJWJFPHUFAKW-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE Cc1c(NC(=O)OC(C)(C)C)cccc1NS(=O)(=O)CCC(CCl)CCl 2106302442 MIVQHLBQFJKJAN-UHFFFAOYSA-N 425.378 4.568 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCc2ccccc2N(C[C@@H](Br)C(F)(F)F)C1 2106781514 INWWHRCNPURBFF-DZGCQCFKSA-N 437.300 4.658 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN(C[C@@H](CBr)C2CCC2)C1 2106787296 YOTOJZRMPYNTQL-IPMKNSEASA-N 429.443 4.909 50 10 IJGE CCN(CC)[C@H](C)CO[C@@H](CI)c1ccccc1Br 2119222327 YCAFGBQHGBUMJR-DOMZBBRYSA-N 440.163 4.672 50 10 IJGE CCN(CC)S(=O)(=O)C[C@@H](Br)c1cc(Cl)c(C)cc1Br 2145642033 KDMIJRGHMKAVDG-GFCCVEGCSA-N 447.620 4.519 50 10 IJGE Cc1nc([C@@H](Cl)c2cc3c(cc2Br)NC(=O)C3)c(Br)s1 2169495900 ONYISAPMTIJTFE-NSHDSACASA-N 436.556 4.799 50 10 IJGE O=C(c1cccc(Br)c1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Cl)C2 2190688718 YFRQTAWZOUIQAG-IRDCDUOOSA-N 425.523 4.534 50 10 IJGE Cc1cc(Br)c(C(=O)NCCCCCCI)s1 2215946640 WVUGIWUUYRDTHO-UHFFFAOYSA-N 430.149 4.544 50 10 IJGE CC1(C)[C@H]2CC[C@@H](C2)[C@@]1(CI)O[C@H]1CCN(Cc2ccccc2)C1 2250382564 DZWXRQWHWBSEQY-VNYTWHDVSA-N 439.381 4.907 50 10 IJGE O=C(N[C@@H](CBr)CC(F)(F)F)c1scc(Br)c1Cl 2253545679 LDHRLIZYMUYOBW-SCSAIBSYSA-N 429.483 4.610 50 10 IJGE CN(Cc1ccccc1I)c1ccc(CBr)cc1F 2265531108 TYEWBLGWQCIVNH-UHFFFAOYSA-N 434.090 4.962 50 10 IJGE CN(Cc1ccc(I)cc1)[C@@H](CBr)c1ccccc1 2278835961 KJUJBOFYEADFDX-INIZCTEOSA-N 430.127 4.859 50 10 IJGE CCC(CC)[C@H](Cl)CNC(=O)Cc1cc(Br)cc(Br)c1 2295307329 IJKYHJKZTXWTAO-CQSZACIVSA-N 425.592 4.914 50 10 IJGE Cc1ccccc1Cn1cc(C=C(C#N)C(=O)NCc2ccc3c(c2)OCO3)c2ccccc21 2295422638 UYIXQIAQWIRBOV-UHFFFAOYSA-N 449.510 4.950 50 10 IJGE O=S1(=O)CC[C@H]([C@H](Cl)c2ccc(OCc3ccccc3)cc2Br)C1 2299501337 NIIVFQWCZAKTSR-KSSFIOAISA-N 429.763 4.743 50 10 IJGE CC1=C(C#N)C(=O)N(C(C)C)C(=O)C1=Cc1ccc(-c2ccc(Br)cc2)o1 2314611742 ZOPCXYPPAUWXMI-UHFFFAOYSA-N 425.282 4.710 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@@]1(C)CBr 2315552009 YIPGVBJMQYURRQ-IINYFYTJSA-N 442.566 4.798 50 10 IJGE CC[C@@H](Br)CCCNC(=O)c1ccc(Cl)cc1I 2317770411 GODIIJLNKNANMD-SECBINFHSA-N 444.538 4.628 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)C[C@H]1CCC[C@@H]1Cl 2325224887 ZZVJLDWIBPLNAM-YPMHNXCESA-N 442.566 4.893 50 10 IJGE N#CC(=CNCc1ccc2c(c1)OCO2)C(=O)Nc1ccccc1Sc1ccccc1 2325336224 SBWPDIFPDWKYLI-UHFFFAOYSA-N 429.501 4.702 50 10 IJGE Cc1onc(OCc2ccc(I)c(Br)c2)c1CCl 2325386102 JKYVKOVYSIDJFI-UHFFFAOYSA-N 442.478 4.668 50 10 IJGE CSCC[C@@H](NC(=O)C(C)=Cc1ccccc1)C(=O)Nc1ccc(SC#N)cc1 2330453877 APYOTYDFTIEBNS-HXUWFJFHSA-N 425.579 4.540 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1I)[C@@H]1CCCCC[C@H]1Cl 2365582952 XMBRISNOODSXSV-TZMCWYRMSA-N 426.125 4.957 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)COc3ccc(Cl)cc3)ccc2[C@@H]1c1cccs1 38656212 PRBMOWNNCDFIJV-NRFANRHFSA-N 438.892 4.604 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)COc3ccccc3Cl)ccc2[C@@H]1c1cccs1 38656392 PBWAFLTYYOWNFP-NRFANRHFSA-N 438.892 4.604 50 10 IJGE Cc1cccc(NC(=O)/C(C#N)=C/c2c(Oc3ccccc3C)nc3ccccn3c2=O)c1 39993158 PPKXVRKIIACTDN-XDJHFCHBSA-N 436.471 4.649 50 10 IJGE CCOC(=O)c1c(NC(=O)N/N=C/c2ccc(N(CC)CC)cc2)sc2c1CCCC2 40840131 BJTKQNYXTCIHKR-BUVRLJJBSA-N 442.585 4.805 50 10 IJGE Cc1cc(S(=O)(=O)Nc2ccc(CBr)cc2)sc1Br 136884410 MSBAEBRKCBNNGV-UHFFFAOYSA-N 425.167 4.515 50 10 IJGE CC[C@@H](Br)C(=O)Nc1oc(C)c(C(=O)OC)c1-c1nc2ccccc2s1 170499092 KPOCHSDNNRDJET-SNVBAGLBSA-N 437.315 4.763 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3ccc(C)o3)n2-c2ccc(C)cc2)cc1 254869416 GYCVMOZMZUCWHR-UHFFFAOYSA-N 445.548 4.695 50 10 IJGE Nc1cccc(Cl)c1[C@@H]1CN(Cc2ccccc2)C[C@@H]1CI 382715609 KBPPUJIBYCQNOH-LSDHHAIUSA-N 426.729 4.573 50 10 IJGE CC[C@H](NC(=O)c1ccc(Br)cc1Br)[C@H](C)Br 386698399 MGKOSQSAZZLPOH-CPCISQLKSA-N 427.962 4.503 50 10 IJGE O=C(N[C@H]1CCC[C@H](Br)C1)c1cc(Br)ccc1Br 694508043 STDCRMFCDNASCO-WPRPVWTQSA-N 439.973 4.648 50 10 IJGE C[C@H]1CCCN(C(=O)c2cc(Cl)ccc2I)[C@H]1CCCl 697192863 FFKMJRMLPNUXFM-HZMBPMFUSA-N 426.125 4.814 50 10 IJGE COc1nscc1COc1c(Br)cc(Br)cc1CCl 711622821 HSCRGGVAOOOHHL-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE Cn1cc(C[C@@H](CBr)c2cccc(Br)c2)c(Br)n1 714085736 QBLFEDGEZBOOAN-JTQLQIEISA-N 436.973 4.666 50 10 IJGE O=C(NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1ccc(-c2ccccc2)o1 753417353 UGDPJZUJZWVXIT-UHFFFAOYSA-N 425.370 4.574 50 10 IJGE Cc1cccc(C2=CCN(C(=O)/C(C#N)=C\c3cn(CCC#N)nc3-c3ccccc3)CC2)c1 771258175 GZUDLSYZGKMFDX-BWAHOGKJSA-N 447.542 4.995 50 10 IJGE Cc1nc(COc2ccccc2C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cs1 799747519 DCGCAIZSORECSM-UHFFFAOYSA-N 432.427 4.678 50 10 IJGE Cc1cc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)nc(-c2ccc(Cl)cc2)n1 799747717 GTNHOPXWERFFBM-UHFFFAOYSA-N 431.805 4.753 50 10 IJGE C/C(=C/c1ccc(F)cc1)C(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(C)c1C 1465160796 MNMUODRVNKLLJA-ICFOKQHNSA-N 442.494 4.688 50 10 IJGE C[C@@H](SCc1nc(O)c2ccccc2n1)C(=O)Oc1ccc([N+](=O)[O-])c2ccccc12 1517537337 ISIRLMMZGUGEGP-CYBMUJFWSA-N 435.461 4.624 50 10 IJGE O=C(NN=Cc1ccc(F)cc1)c1ccc(-n2nc(C(F)(F)F)c3c2CCCC3)cc1 1772722121 AMXBQCZVXVRDLR-UHFFFAOYSA-N 430.405 4.673 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2-c1ccccc1 1865691648 XJCVYMSKRSEUGD-GOSISDBHSA-N 438.409 4.674 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccccc2Cl)c1 1865692512 GPLLZBBIFHBAQL-QFIPXVFZSA-N 434.927 4.900 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)N/N=C\c1ccc(Br)cc1 1865760582 FKKBQDRANQGGJD-MYKKPKGFSA-N 430.252 4.862 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C1CCC2(CC1)C[C@H]2NC(=O)OC(C)(C)C 1882086482 BYNTVTULGGYWAK-LNWMTBOKSA-N 447.414 4.748 50 10 IJGE Cc1cc(Br)c(CBr)c(N(C)C[C@@H]2C[C@H]2Br)c1 1910158825 AYFVBLBVJLEXOX-GXSJLCMTSA-N 425.990 4.872 50 10 IJGE COC(=O)[C@@]1(C(C)C)C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 1912260394 SGCVWFPRCVYWRR-XXBNENTESA-N 435.637 4.987 50 10 IJGE COc1ccc(Br)c(C(=O)N(Cc2ccccc2)C[C@H](C)Br)c1 1914609973 ISEVFHYMOWNHHP-ZDUSSCGKSA-N 441.163 4.884 50 10 IJGE O=C(c1cccnc1C(F)(F)F)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915263312 FQIPRBSZTLCNGN-INIZCTEOSA-N 427.264 4.916 50 10 IJGE CC1(C)C[C@H](Br)CN(Cc2cc(Cl)ccc2I)C1 1923148922 ZPPCUEBTWVCBNQ-NSHDSACASA-N 442.566 4.940 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)C(=O)c1ccc(O)c(Br)c1 1961198577 GQCJMFOKQMWPHP-GFCCVEGCSA-N 427.136 4.581 50 10 IJGE C[C@]1(CBr)C[C@H](NC(=O)c2scc(Br)c2Br)C1 2009754700 MWBXFXJLRPQILD-MHWOZMEASA-N 446.002 4.567 50 10 IJGE FC1(F)C[C@]1(Br)COc1c(Br)cccc1CBr 2023779164 RSLTTYOFFCTQKO-JTQLQIEISA-N 434.900 4.896 50 10 IJGE CC[C@H](CBr)CN1CC[C@@H](C(F)(F)F)C[C@H]1CNC(=O)OC(C)(C)C 2045432974 YWDFPNGKVOXCFA-MCIONIFRSA-N 431.337 4.575 50 10 IJGE FC(F)c1cc(CCl)c(I)cc1I 2060237380 KLQCDWAZOZRWPC-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCC2)[C@@H](CC(F)F)C1 2063524754 OOCNMFKXMGLKCU-AWEZNQCLSA-N 425.358 4.518 50 10 IJGE Fc1ccc(F)c(Cn2nc(CBr)c(Br)c2C(F)(F)F)c1 2079230291 PEXGZZFTDQFPEU-UHFFFAOYSA-N 434.000 4.886 50 10 IJGE C[C@H](Br)C1CCN(Cc2ccc(I)c(Cl)c2)CC1 2086659266 VAVWYXFKWIXFDQ-JTQLQIEISA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CCN(C[C@H](CBr)c2ccccc2)C1(C)C 2106887515 CJEKOUXNNSZUSI-ZWKOTPCHSA-N 425.411 4.790 50 10 IJGE C[C@@H]1[C@H](C(F)(F)F)N(C[C@H](CBr)CC2CC2)CCN1C(=O)OC(C)(C)C 2115980977 XEFDSVPBSPCODD-VHDGCEQUSA-N 443.348 4.670 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ccccc2)CCN1c1ncc(Br)cc1CCl 2130165875 IHFLNHACPGBXKN-MRXNPFEDSA-N 448.714 4.836 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CCC(OCCCBr)CC1 2142527884 UGJNQGGJQLSZCO-UHFFFAOYSA-N 438.387 4.733 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H]1Cn1c(CCCl)nc2cncc(Br)c21 2151793939 TUUMCCUJGAMVNK-DOTOQJQBSA-N 447.808 4.743 50 10 IJGE FC(F)(F)COC1CN(c2c(CBr)ccc(Br)c2Cl)C1 2154364303 UJWXWQFXMYOWEG-UHFFFAOYSA-N 437.481 4.765 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(NC(=O)[C@@H](Br)C3CCCC3)CCCCC[C@H]12 2167031756 JSIWQPRITJAYMN-XGHQBKJUSA-N 443.426 4.769 50 10 IJGE COc1cc(F)c(Cl)cc1[C@@H](Br)c1c(C)nn(C)c1Br 2207376966 GXJBXKUKJLPCIP-GFCCVEGCSA-N 426.511 4.776 50 10 IJGE Brc1cccc([C@H](CI)OC2(C3CCC3)COC2)c1 2272930521 PVYDDUOFIMPBQG-AWEZNQCLSA-N 437.115 4.511 50 10 IJGE CS(=O)(=O)c1cscc1C[C@H](CBr)c1ccccc1Br 2288490160 CONVDALADKETIV-SNVBAGLBSA-N 438.206 4.635 50 10 IJGE CCc1ccccc1-n1c(C)cc(C=C(C#N)C(=O)N2CCN(c3ccccc3)CC2)c1C 2313568366 VFKFODHQVCGYIA-UHFFFAOYSA-N 438.575 4.912 50 10 IJGE COc1cc(C=C2C(=O)N(Cc3ccccc3)C(=O)C(C#N)=C2C)ccc1OCC(C)C 2314617837 BRRKRFMJJWOXJL-UHFFFAOYSA-N 430.504 4.522 50 10 IJGE Cc1c(F)ccc(C(=O)N[C@@H](CCBr)COCc2ccccc2)c1Cl 2320362897 ZCTKBOXAUHKDHT-HNNXBMFYSA-N 428.729 4.888 50 10 IJGE FC(F)(CCl)C(F)(F)CNCc1cccc(Br)c1Br 2336532782 XMTRXOYNGOOXCW-UHFFFAOYSA-N 427.461 4.811 50 10 IJGE CC[C@@H](Cl)[C@H]1CCCCN1C(=O)c1ccc(Cl)cc1I 2365582026 LYYDJDGABNQDTR-TZMCWYRMSA-N 426.125 4.957 50 10 IJGE O=C(c1cc2ccccc2oc1=O)N(/N=C/c1ccco1)c1nc2ccc(F)cc2s1 9148836 FZBXVZIQBJUTAD-WYMPLXKRSA-N 433.420 4.816 50 10 IJGE O=C(COc1ccc(Cl)cc1)NNC(=O)N1c2ccccc2Sc2ccccc21 13988833 YYMUGSWVEXSUKK-UHFFFAOYSA-N 425.897 4.763 50 10 IJGE Cc1ccc(N2C(N)=C(C#N)[C@@H](c3ccc([N+](=O)[O-])cc3)C3=C2CC(C)(C)CC3=O)cc1 20367517 CEXBNCIARJUNKE-JOCHJYFZSA-N 428.492 4.844 50 10 IJGE COc1cc(/C=C(/C#N)c2ccc(Cl)cc2)ccc1OC(=O)CNC(=O)c1ccccc1 31902160 UDHWXBGCZPGPBR-MOSHPQCFSA-N 446.890 4.748 50 10 IJGE COc1cc(/C=C/C(=O)Oc2ccc(C=C(C#N)C#N)cc2)cc(Br)c1OC 40992486 WQORLNGEUZVUJM-VMPITWQZSA-N 439.265 4.516 50 10 IJGE COc1cc(N/C=C(/C#N)c2nc(-c3ccc4c(c3)OCO4)cs2)c(C(C)=O)cc1OC 102420488 IZTNPNOJSAEBQM-GDNBJRDFSA-N 449.488 4.735 50 10 IJGE Cc1ccc(C(=O)NC2=N/C(=C(\C#N)C(=O)Nc3cc(C)ccc3C)c3ccccc32)cc1 102595367 GJQFPSPOXYDZQW-ZNTNEXAZSA-N 434.499 4.675 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)c1ccc(COc2cccc(Br)c2)o1 110781065 BKZOQYABVVRSQT-UHFFFAOYSA-N 441.203 4.795 50 10 IJGE CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\c1cn(-c2ccccc2)nc1-c1c(C)cc(C)cc1C 214203660 VMRLRLHXTUERSU-XKZIYDEJSA-N 436.515 4.687 50 10 IJGE CCOC(=O)c1ccccc1N/C=C(/C#N)C(=O)NC(c1ccccc1)c1ccccc1 216972918 RGQMCQSFJAZQNU-UZYVYHOESA-N 425.488 4.588 50 10 IJGE CCOc1ccc(CCN/C=C(/C#N)C(=O)Nc2ccc(Cl)c(Cl)c2)cc1OCC 217005337 AWCIQIZURGQKOD-PEZBUJJGSA-N 448.350 4.969 50 10 IJGE CCOc1ccc(CCN/C=C(/C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1OCC 217177503 UYBDUSPGLQKIDH-PEZBUJJGSA-N 448.350 4.969 50 10 IJGE O=C(N[C@H]1CCC[C@H]1CBr)c1cc(Br)c(Br)s1 231556878 BYOAUSRPWDLGPC-XPUUQOCRSA-N 446.002 4.567 50 10 IJGE Cc1nn(CCC(=O)NN=Cc2cn(-c3ccccc3)nc2-c2ccccc2)c(C)c1Cl 254682613 JOAWUFGLUWETML-UHFFFAOYSA-N 446.942 4.546 50 10 IJGE O=C(NCCC1(CBr)CC1)c1ccc(Br)cc1Br 395933442 GPAILDLYETUWCB-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE ClCc1cc(Br)cc(Br)c1OCCOC1CCOCC1 701319961 RCWBJAFEGTYBPN-UHFFFAOYSA-N 428.548 4.525 50 10 IJGE O=[N+]([O-])c1ccc(N2CC[C@@H]3CC[C@H](C2)N3Cc2ccccc2)cc1CBr 717410636 BTSHAMTZQQQUAH-AZUAARDMSA-N 430.346 4.733 50 10 IJGE CN(C[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(CBr)cc1[N+](=O)[O-] 720017107 QFKTUSWEYNHNEF-LJQANCHMSA-N 432.362 4.838 50 10 IJGE CC(C)NC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1)C[C@@H](C)C2 745139349 CFDTZEGGPDQVBY-JFPYRBRCSA-N 428.536 4.710 50 10 IJGE O=C(NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)c1ccc(-c2ccccc2)o1 753415144 AYYWWFQMNLYMJX-UHFFFAOYSA-N 425.370 4.574 50 10 IJGE COc1cc(C=NNC(=O)c2cc3ccccc3o2)ccc1OCc1ccc2c(c1)OCO2 1084075984 ACTILONOYUNBNX-UHFFFAOYSA-N 444.443 4.513 50 10 IJGE C=C(C)[C@H](NC(=O)NNc1ccc(OC)cc1Br)c1ccc(F)c(F)c1 1226661690 SVHIJZXUGMLRBO-KRWDZBQOSA-N 426.261 4.679 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNc2ccc(OCc3ccccc3)cc2)c(O)n1 1557605523 GHSWNINNEVVTSA-UHFFFAOYSA-N 441.487 4.799 50 10 IJGE CC(=NNC(=O)COc1ccc(Cl)cc1Br)c1ccc2c(c1)CCCC2 1565517777 CYMVYVSGEFUPDJ-UHFFFAOYSA-N 435.749 4.901 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccc(Cl)cc2)[C@@H]1c1ccc[nH]1 1865709398 BJOWNWCGMHMJME-FQEVSTJZSA-N 427.895 4.798 50 10 IJGE Cc1nncn1C1CCN(c2cc(Nc3ccc(SC#N)cc3)nc(C(C)C)n2)CC1 1868231276 BCYAOCCIUHQGEV-UHFFFAOYSA-N 434.573 4.658 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N(Cc2ccccc2)C[C@@H](C)Cl)c1Br 1914667283 MRGWKEIKXICBMN-LLVKDONJSA-N 436.824 4.946 50 10 IJGE CC(C)(C)[C@H](Br)CNC(=O)c1csc(Br)c1Br 1945188962 FSJUTUICKYZOHX-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE I[C@@H]1CCCCCC[C@@H]1OCCOCCOCc1ccccc1 1983389619 HBHBYWJSBNWFRC-MOPGFXCFSA-N 432.342 4.763 50 10 IJGE CC[C@@H](C)[C@@H](Br)CNC(=O)c1ccc(Br)cc1Br 2029977463 MGGYMEONUATTSW-PELKAZGASA-N 441.989 4.751 50 10 IJGE FC1(F)[C@H]2C[C@](CBr)(Cc3ccc(I)cc3)C[C@H]21 2045492435 LZTIFUOPAIUMHT-ITGUQSILSA-N 427.070 4.890 50 10 IJGE O=C(CBr)c1ccc(Br)c(C(F)(F)F)c1OC(F)(F)F 2054796712 RMQDXGPJBIFRST-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE CCC[C@@H](CBr)CN1CCCC[C@H]1C(F)(F)CNC(=O)OC(C)(C)C 2065453437 ROGMIZSMIURULD-GJZGRUSLSA-N 427.374 4.812 50 10 IJGE CC1(C)OCCO[C@H]1[C@@H](Br)c1cc(Br)ccc1Br 2066691195 SYNQYXXINFVGGU-RYUDHWBXSA-N 442.973 4.842 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(CC2(CBr)CCCC2)C1 2106786379 FFPIZLKUICXEFC-FJIDUMEYSA-N 427.427 4.519 50 10 IJGE CC(C)(C)OC(=O)N(CC1CC1)C1CCN(C[C@@H](CBr)CC2CC2)CC1 2112868534 KPKILGIUTFIRBD-GOSISDBHSA-N 429.443 4.909 50 10 IJGE CCC[C@@H](CCBr)CNC(=O)c1ccc(I)c(C)c1 2142108093 UXPHQEJZPVZUHK-LBPRGKRZSA-N 438.147 4.531 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(CCNC(=O)c2ccc(CBr)cc2)cc1 2162496410 ZICSRJIDJPXVSD-UHFFFAOYSA-N 433.346 4.901 50 10 IJGE O=C(NC[C@@H]1CCCC[C@H](Cl)C1)c1ccc(I)c(Cl)c1 2163752856 COMJBYHWXWTTAT-PWSUYJOCSA-N 426.125 4.862 50 10 IJGE Cc1c(Cl)cc(CN2CCO[C@@H](CBr)C2(C)C)cc1Br 2167386502 WEIOAMVMCUZDAO-AWEZNQCLSA-N 425.592 4.785 50 10 IJGE O=C(c1ccc(OCc2ccccc2)cc1)N1C[C@@]2(F)CCC[C@@]2(CBr)C1 2176639646 IXIVHEYPOLNKHZ-YADHBBJMSA-N 432.333 4.995 50 10 IJGE Cc1nc(-c2ccc(I)cc2)nc(C)c1CCCBr 2228788376 NRGKLKPPNNKRKS-UHFFFAOYSA-N 431.115 4.693 50 10 IJGE Cc1sc(C(=O)N2[C@H]3CC[C@H]2[C@H](F)[C@@H](Br)C3)c(C)c1Br 2234464371 NHZQBBQMKMMKPM-QFOLPQNPSA-N 425.161 4.606 50 10 IJGE COc1ccc([C@H](Cl)c2cc(Br)co2)cc1I 2249400536 COUWJJGCBIUERY-LBPRGKRZSA-N 427.463 4.984 50 10 IJGE O=C(NC[C@@H]1CCCC[C@@H]1Br)c1cc(F)c(Br)cc1Cl 2282972775 UDXVYGTVVJPIGZ-WPRPVWTQSA-N 427.539 4.925 50 10 IJGE COc1ccc([C@H](Br)[C@H]2COc3ccccc32)cc1I 2285000177 SIQDDUQGJSRFIV-LRDDRELGSA-N 445.094 4.912 50 10 IJGE CC1(C)[C@@H](Br)CC[C@@H]1NC(=O)c1cc(Br)c(F)cc1Cl 2285836942 IEKMRMBFMJIWFE-RYUDHWBXSA-N 427.539 4.924 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1Br 2297551562 RQBOWWFYDSQKPS-UHFFFAOYSA-N 436.649 4.565 50 10 IJGE C[C@H]([C@@H](Br)c1c(F)cc(Cl)c(Br)c1Cl)S(C)(=O)=O 2313742932 IGFUBBMJAOPQKU-SPGJFGJESA-N 442.959 4.764 50 10 IJGE CC(C)c1ccc(C=C(C#N)C(=O)Nc2ccc(S(=O)(=O)Nc3ccccn3)cc2)cc1 2314736137 WUDMEBFQDQSFOZ-UHFFFAOYSA-N 446.532 4.551 50 10 IJGE CCCO[C@H]1[C@@H](Oc2cc(Br)cc(Br)c2)C[C@H]1Br 2316829343 PHMQHQOSLDAXHO-FRRDWIJNSA-N 442.973 4.921 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)C(C#N)=CNc1cc(OC)c(Cl)cc1OC 2325075934 OMAOOAIWPRRANU-HNNXBMFYSA-N 443.931 4.761 50 10 IJGE F[C@@]1(CBr)CCCN(Cc2cc(I)ccc2Cl)C1 2327404818 LLCPLMJPPAXGHB-CYBMUJFWSA-N 446.529 4.644 50 10 IJGE CC(C)N(C[C@@H]1CCCN(C[C@@]2(CBr)CC2(F)F)C1)C(=O)OC(C)(C)C 2351889118 OPPOJEBHYZAMHU-QAPCUYQASA-N 439.385 4.764 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1CCc2scc(Br)c2C1 2361581574 MITHMKQFPPSRHF-UHFFFAOYSA-N 438.166 4.938 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1I)C1(CCl)CC(C)(C)C1 2365595913 OZRWPUIWDPLMGD-UHFFFAOYSA-N 426.125 4.814 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccc2ccccc2c1O 2369677173 IRYKBFNXWZVLOJ-SFHVURJKSA-N 428.326 4.646 50 10 IJGE COc1ccccc1CN(C(=O)CCl)[C@@H](C(=O)NC1CCCCC1)c1ccccc1F 3033928 CKDUXZYZMOJNHW-HSZRJFAPSA-N 446.950 4.592 50 10 IJGE C=CCc1cccc(/C=N/NC(=O)c2cccc(NC(=O)c3ccccc3Cl)c2)c1O 27520110 AXRYCXREWPDGET-CVKSISIWSA-N 433.895 4.790 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)c3nc(O)c4cc(OC)ccc4n3)o2)cc1 34988528 XQJLOQBNMXSYKZ-ATVHPVEESA-N 441.443 4.845 50 10 IJGE COc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4ccc(C)c(C)c4)c(C)c32)cc1 40813822 VCQRPOHCCUMTQX-SGWCAAJKSA-N 445.519 4.936 50 10 IJGE Cc1cc(C(=O)O)ccc1-c1ccc(/C=N/NC(=O)Cc2cccc(C(F)(F)F)c2)o1 59136599 ZMBOFKKCUOCFIP-RPPGKUMJSA-N 430.382 4.665 50 10 IJGE O=S1(=O)CCCC[C@@H]1[C@@H](Br)c1cc(Cl)c(Br)cc1F 97896033 MCFLMJRDBHERGU-NEPJUHHUSA-N 434.552 4.645 50 10 IJGE COc1ccc([C@H](Br)c2csc(I)c2)c(F)c1 123464043 IXBXNAZNURWPRV-GFCCVEGCSA-N 427.076 4.985 50 10 IJGE CCOc1ccc(N/C=C(/C#N)C(=O)N2CCC(Cc3ccccc3)CC2)cc1OCC 216878360 KGMZKBRGNFGKJV-QOCHGBHMSA-N 433.552 4.785 50 10 IJGE O=C(NCCCCCI)c1ccc2cc(Br)ccc2c1 229224040 TWOXJUFJGIFUKN-UHFFFAOYSA-N 446.126 4.937 50 10 IJGE ClCc1ccc(Br)cc1N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21 404140995 FUMMNFMIXLGDHS-NHCUHLMSSA-N 435.793 4.668 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1cccc([C@H]2COCCN2S(=O)(=O)c2ccccc2)c1 616601728 OPFULBSCHNDNFF-JOCHJYFZSA-N 447.673 4.971 50 10 IJGE C[C@H]1[C@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1scc(Br)c1Br 686181239 MGSCPWFMYUXLMI-MVHNUAHISA-N 427.589 4.894 50 10 IJGE Cc1cc(CBr)cnc1N1C[C@H]2CC[C@H]1[C@H]1CN(Cc3ccccc3)C[C@H]21 705875508 PEIQTZFFBKXURU-CZYKHXBRSA-N 426.402 4.632 50 10 IJGE CN(C(=O)c1scc(Br)c1Br)[C@H]1CCC[C@@H]1Br 709228357 OGYKKGKTTIPRFC-XPUUQOCRSA-N 446.002 4.661 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)Nc2cc(C3CCCCC3)[nH]n2)c(-c2ccccc2)n1 750069770 DVIPHJHNRRGGOK-XSFVSMFZSA-N 439.523 4.780 50 10 IJGE CC(C)Cn1nc(-c2ccccc2)cc1NC(=O)C(=O)NNc1c(Cl)cccc1Cl 773697963 TWMQZDDDFLYITH-UHFFFAOYSA-N 446.338 4.595 50 10 IJGE O=C(NNc1cc(Cl)cc(Cl)c1)c1cc(O)nc2ccc(Br)cc12 791719429 HIGLAVZXXVPFEY-UHFFFAOYSA-N 427.085 4.767 50 10 IJGE O=C(NN=Cc1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)c1ccncc1 1084014776 HSUJUYCNAJNICS-UHFFFAOYSA-N 435.490 4.515 50 10 IJGE CCOc1cc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3CC)ccc1OCc1ccccc1 1865693826 MAHJTCWEPDTCIB-QHCPKHFHSA-N 444.535 4.661 50 10 IJGE CCCn1nc(C)c2c1OC(N)=C(C#N)[C@H]2c1ccc(OCc2ccc(C)cc2)c(OC)c1 1865695171 LTKVJPZZNCSNEQ-XMMPIXPASA-N 444.535 4.716 50 10 IJGE CCc1nn(Cc2ccccc2F)c2c1[C@@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2 1865711368 WMQIVFMQMMDQQO-IBGZPJMESA-N 442.416 4.870 50 10 IJGE CCCOc1ccccc1/C=C/C(=O)NNC(=O)c1ccc(-c2ccc(C)cc2)nc1C 1865757740 RVHSNQXVOPRCIK-DTQAZKPQSA-N 429.520 4.629 50 10 IJGE CCOc1ccc(-c2csc(/C(C#N)=C(\O)[C@H]3CC(=O)N(C(C)C)C3)n2)c(OCC)c1 1872755415 LWIPFKJCWCXHGF-YUCJCZDXSA-N 441.553 4.657 50 10 IJGE COc1cc(F)c([C@@H](Br)c2c(C)nsc2Br)cc1OC 1912980051 FRYFSWILFPGSGI-GFCCVEGCSA-N 425.117 4.855 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1csnc1Br 1925209743 BNQQZEWXNORZHG-LBPRGKRZSA-N 432.181 4.722 50 10 IJGE CC[C@@H](NC(=O)c1c(Br)cccc1Br)[C@@H](C)Br 1945321852 JAWXQZLYKKISMC-GMSGAONNSA-N 427.962 4.503 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CCS[C@H](CCBr)C1 1950317010 VLOYPFWASJFLCT-OAHLLOKOSA-N 426.401 4.670 50 10 IJGE CCN(C[C@@](C)(CI)O[C@@H]1CCCC12CC2)C(=O)OC(C)(C)C 1986117871 CLMBGZCKBIMQFE-RHSMWYFYSA-N 437.362 4.786 50 10 IJGE Cc1cc([C@@H](Br)c2cc(S(C)(=O)=O)cs2)c(Br)s1 2039500560 KFIXRAOEQCRAPQ-SNVBAGLBSA-N 430.208 4.768 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc([S@](C)(=O)=NC[C@H](CBr)C2CC2)cc1 2044703534 VNYSQIPHVBBCOL-SXBQZSJRSA-N 431.396 4.911 50 10 IJGE O=S(=O)(c1cc(Cl)ccc1F)N(Cc1ccccc1)[C@@H](CBr)C1CC1 2057408366 RFNCFUQCJMDSAR-KRWDZBQOSA-N 446.769 4.844 50 10 IJGE O=[N+]([O-])c1cc(Br)c(OC[C@H]2C[C@H](Br)C2)c(Br)c1 2076257089 HDADJSNAORISSH-LJGSYFOKSA-N 443.917 4.672 50 10 IJGE C[C@H](CCBr)CCN1CC[C@@](NC(=O)OC(C)(C)C)(c2ccccc2)C1 2106782527 QYDHKCAZHTVIAM-UTKZUKDTSA-N 425.411 4.924 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](C(C)(C)C)CN(C[C@@H](Br)C(F)(F)F)C1 2108377574 SPLYYQYWCMPPSH-MELADBBJSA-N 445.364 4.821 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1Cc1cnc(Br)s1 2151780772 TVVLAVCREKYWLH-LURJTMIESA-N 436.560 4.761 50 10 IJGE CC(C)(C)OC(=O)NC1(C2CCN(C[C@H](CBr)c3ccccc3)CC2)CC1 2163057748 DWXXUHXLSGUXJB-SFHVURJKSA-N 437.422 4.934 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CCC([C@@H](F)CCl)CC1 2163241477 BYBPJAMHZOGYGW-LBPRGKRZSA-N 427.539 4.641 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCN(C[C@@H](CBr)c3ccccc3)C2)C1 2163324576 HPBZFSRDRXZHOG-KNQAVFIVSA-N 437.422 4.888 50 10 IJGE CN(C[C@H]1CCCCN1Cc1ccccc1)c1cc([N+](=O)[O-])ccc1CBr 2176906977 RIKMTZVMOCRIGY-HXUWFJFHSA-N 432.362 4.981 50 10 IJGE O=[N+]([O-])c1ccc(N2[C@H]3CCC[C@@H]2CN(Cc2ccccc2)C3)cc1CBr 2234691389 XSXIVZSQMBDLOF-BGYRXZFFSA-N 430.346 4.733 50 10 IJGE CCCN[C@H](Cc1cc(Br)cc(Br)c1)[C@@H]1C[C@@H]1Br 2263513542 OYVMJDPUYKAONC-HZSPNIEDSA-N 440.017 4.906 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@@H]1COC2(CCC2)C1 2284739711 KRLQHWLUFDMYCR-SMDDNHRTSA-N 449.126 4.621 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc(OCC)cc2)sc2c1CC[C@@H](C)C2 2314735326 QXBFSGIKYGFNIP-OAHLLOKOSA-N 438.549 4.994 50 10 IJGE BrCC12CC(CCN1Cc1cccc(Br)c1Br)C2 2314879820 HUNDDUBLZLXHHD-UHFFFAOYSA-N 438.001 4.961 50 10 IJGE Cc1c(F)ccc(CO[C@H](CCl)[C@@H](I)CCl)c1Cl 2317183802 NJJQHVKSGAFZQB-WDEREUQCSA-N 425.496 4.954 50 10 IJGE CCCCCOc1ccc(C=NNC(=O)c2cccn(Cc3ccc(C)cc3)c2=O)cc1 2323648026 QJIFVQGOMUHDAJ-UHFFFAOYSA-N 431.536 4.538 50 10 IJGE Fc1ccc(C(F)F)c(CO[C@H](CCl)[C@H](I)CCl)c1 2338247944 AZFKVDRPYPOUKG-GHMZBOCLSA-N 427.031 4.930 50 10 IJGE ClCCCN(Cc1cc(Cl)ccc1I)C1CCOCC1 2381155510 DAMPUBLHQXQPOI-UHFFFAOYSA-N 428.141 4.555 50 10 IJGE CCOC(=O)/C(C#N)=C1/S[C@@H](Cc2cccc(Cl)c2)C(=O)N1c1ccc(C)cc1 33729344 BBXIIOBUOSUWJV-PMIVHWTLSA-N 426.925 4.638 50 10 IJGE CCOC(=O)/C(C#N)=C\c1cc(Cl)c(OCCOc2ccc(C)c(C)c2)c(OC)c1 33776910 VTKQNRMHSVGKMH-WQRHYEAKSA-N 429.900 4.893 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)ccc1OCCOc1cccc(C)c1 34703087 QXMZQXXYPXCIKM-KQWNVCNZSA-N 442.515 4.685 50 10 IJGE Cc1ccc(NNC(=O)CNc2ccc(Br)cc2C(=O)c2ccccc2)cc1 35549365 AWWKGAICKVQPKR-UHFFFAOYSA-N 438.325 4.544 50 10 IJGE N#CC1=C(N)N2C(=C(C#N)[C@H]1c1ccc(-c3ccccc3[N+](=O)[O-])o1)Sc1ccccc12 39794226 AFSZJIFXQKSICY-NRFANRHFSA-N 439.456 4.993 50 10 IJGE Cc1cccc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)Nc2ccccc2C)c1 39992881 VMPFZIWYXGPILN-XDJHFCHBSA-N 436.471 4.649 50 10 IJGE O=C(NNc1ncnc(NCCC2=CCCCC2)c1[N+](=O)[O-])c1cccc2ccccc12 40622206 REYSADNFMQKHHP-UHFFFAOYSA-N 432.484 4.597 50 10 IJGE CCCCCCOc1ccc(/C=N/NC(=O)COc2ccc(OCC)cc2)cc1OC 40911062 QYFZMZLDXWKESP-KOEQRZSOSA-N 428.529 4.582 50 10 IJGE Cc1ccccc1SCC(=O)N/N=C/c1c(C)nn(Cc2ccccc2Cl)c1C 59148551 WBMHZAPBLNITIR-WYMPLXKRSA-N 426.973 4.752 50 10 IJGE Cc1cc(N2CCCC2)ccc1/C=N/NC(=O)CN(Cc1ccccc1)Cc1ccccc1 59151640 WGFXBMYSPNTCGB-VUTHCHCSSA-N 440.591 4.748 50 10 IJGE O=C(N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21)c1nc2ccccc2s1 59157339 WCFJFANXTDEJSA-QOMWVZHYSA-N 446.919 4.631 50 10 IJGE C[C@H](Cc1cccs1)N(C)S(=O)(=O)c1cc(CCl)sc1Br 123458335 SQVJDRLAMYNOBO-SECBINFHSA-N 428.826 4.563 50 10 IJGE ClCCCc1nnc(-c2cc(I)ccc2Br)s1 236013242 LKQRLPHKSSWYAC-UHFFFAOYSA-N 443.535 4.744 50 10 IJGE Fc1ccsc1[C@H](Br)c1cc(I)cc2c1OCC2 310759826 MGWQASDLTBQTEL-LLVKDONJSA-N 439.087 4.911 50 10 IJGE CC[C@H](Br)[C@H](CC)NC(=O)c1cc(Br)sc1Br 313125244 VKWBVNKSVXRVMA-YUMQZZPRSA-N 448.018 4.955 50 10 IJGE Cc1ccc([C@@H](Br)c2cnn(C)c2I)c2ccccc12 379216851 QPRHCQBGDCTXCF-OAHLLOKOSA-N 441.110 4.971 50 10 IJGE COc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CBr)cc1Br 394588096 YOWHHPMIHKVXNZ-STQMWFEESA-N 449.183 4.803 50 10 IJGE CC[C@H]1CN(C(=O)c2scc(Br)c2Br)C[C@H]1Br 705442200 MUFVQPFLVHHJKJ-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE CCN(C[C@](C)(CI)O[C@H](C)C1CCC1)C(=O)OC(C)(C)C 719774204 FLFADVPGZPNYSR-DYVFJYSZSA-N 425.351 4.642 50 10 IJGE CCc1c(C)nn(-c2cccc(C(=O)NNc3nc(-c4ccc(Cl)cc4)no3)c2)c1C 766978597 XZPKEBVDVZJLDV-UHFFFAOYSA-N 436.903 4.512 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCc2cccc(Br)c2)c1C 768746941 IJOKLXYIZFVHIS-HNIBHBHRSA-N 431.330 4.725 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccccc2OC[C@@H]2CCCCO2)c(C(F)(F)F)c1 799390910 FLLLUDBQJYFXLM-HNNXBMFYSA-N 434.418 4.674 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OC[C@@H]2Cc3ccccc32)c(-c2ccc(Cl)cc2)n1 803218649 WCIKDLWQMIGDAM-FNGUVFISSA-N 442.906 4.907 50 10 IJGE CC(C)Oc1ccc(COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cc1 918532661 CFPGUDPEDUYFSG-JCMHNJIXSA-N 440.503 4.901 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2cc(Cl)c(OCC)c(Cl)c2)cc1 1084005584 JZVLPUSJSLFWGN-LJQANCHMSA-N 439.339 4.755 50 10 IJGE COc1ccc(C(C)=NNC(=O)CCCSc2nc3ccc([N+](=O)[O-])cc3s2)cc1 1084258155 PXDIGSNMOHOWMM-UHFFFAOYSA-N 444.538 4.626 50 10 IJGE O=C(COc1ccc(Br)cc1Cl)NN=Cc1cccc(C(F)(F)F)c1 1084550377 WFONWJWZAHACFN-UHFFFAOYSA-N 435.627 4.650 50 10 IJGE C=CCCSCCNC(=O)NNC(=O)c1ccc(COc2ccc3ccccc3c2)cc1 1470733703 FKYCCOLDIQPLDW-UHFFFAOYSA-N 449.576 4.672 50 10 IJGE CN(C(=O)c1c(Br)cccc1Br)C1(CBr)CCC1 1914996758 JLDQQWGSVBHYDB-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE O=S(=O)(c1ccc(Cl)cc1)N(Cc1ccccc1)C1(CBr)CCC1 1915775023 VKNDPRHJJLERNW-UHFFFAOYSA-N 428.779 4.849 50 10 IJGE C[C@@]1(CBr)CCCN1Cc1ccc(I)c(Cl)c1 2026567289 QOFPJUIAZLMXAE-ZDUSSCGKSA-N 428.539 4.694 50 10 IJGE CCCN(C[C@H](Br)C(F)(F)F)C[C@H]1CCCCN1C(=O)OC(C)(C)C 2044700371 QAXHQFDYNUHLPX-KGLIPLIRSA-N 431.337 4.814 50 10 IJGE CC[C@@H](Br)[C@@H]1CCCCN1C(=O)c1csc(I)c1 2051077543 FRBBJSFJCSPMTK-MNOVXSKESA-N 442.160 4.521 50 10 IJGE Cc1nn(-c2cc(Br)cc(F)c2CCl)c(C)c1I 2051131596 NHXVQWZVOABFAQ-UHFFFAOYSA-N 443.485 4.734 50 10 IJGE Cc1nn(C)c(C[C@H](Br)c2ccc(Br)cc2)c1Br 2072280479 SRPFRQJKBADFFB-NSHDSACASA-N 436.973 4.932 50 10 IJGE Cc1ccc(Cn2nc(CBr)c(Br)c2C(F)(F)F)c(O)c1 2079234410 VWSKSINLJODOSI-UHFFFAOYSA-N 428.046 4.622 50 10 IJGE CN(c1ncc(Br)c(CCl)n1)C1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2094900238 JTHFKWCDWCTCNN-SJPCQFCGSA-N 435.797 4.610 50 10 IJGE CN(Cc1ccc(NC(=O)[C@@H](Br)C2CCCC2)cc1)C(=O)OC(C)(C)C 2110722150 JRPGRVFDSGEWLB-KRWDZBQOSA-N 425.367 4.946 50 10 IJGE FC1(F)C[C@]12C[C@@H]2[C@H](Br)c1cc(I)cc2c1OCC2 2115294691 MPFJZIOYQPZMNO-WZRBSPASSA-N 441.053 4.707 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]2CCC[C@H]2N1C[C@@H](CBr)c1ccccc1 2164654461 AELCOYANOIHHPM-ZGXWSNOMSA-N 437.422 4.933 50 10 IJGE CC(C)(C)[C@H]1CCCN1S(=O)(=O)c1cc(CBr)sc1Br 2191964672 WVIKZKZLIDIMFE-LLVKDONJSA-N 445.242 4.605 50 10 IJGE C[C@H]1CCCN(CCCCCI)[C@@H]1CCNC(=O)OC(C)(C)C 2211184287 LEBKUBFIPXGCKI-JKSUJKDBSA-N 438.394 4.607 50 10 IJGE CC1(C)CCN(Cc2ccccc2)CCN1c1cc([N+](=O)[O-])ccc1CBr 2239862579 VPQXROQUHPZMKA-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE Cc1nscc1C[C@H](Br)c1ccc(F)cc1I 2246960704 YRYULGAIMPYREY-NSHDSACASA-N 426.092 4.874 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CCN(CCCCI)c2ccccc21 2248240553 GKVSCILEHRVFCG-OAHLLOKOSA-N 444.357 4.720 50 10 IJGE CCOC(=O)C(C#N)=Cc1cc(OC)c(OCc2ccccc2F)cc1Br 2293707254 NQCFWPSONIAOJN-UHFFFAOYSA-N 434.261 4.646 50 10 IJGE C[C@]1(CCBr)CCN1Cc1ccc(Cl)c(I)c1 2300237689 CBCNQRJBWHPKEY-ZDUSSCGKSA-N 428.539 4.694 50 10 IJGE COC[C@@]1(C)C[C@@]1(CBr)Cc1ccc(Cl)c(I)c1 2315552408 DQNCOYANLPQURL-ZIAGYGMSSA-N 443.550 4.925 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]([S@@](C)(=O)=NC[C@@](C)(CBr)C(C)(C)C)C1 2327092539 LNGHSIQXRFOMAN-XFBIRTSGSA-N 439.460 4.541 50 10 IJGE BrC1CCC([C@@H]2CCN(C[C@H]3CC3(Br)Br)C2)CC1 2327998292 DSVRYJXTLWCHNQ-QZQSVVMZSA-N 444.049 4.768 50 10 IJGE CC(C)[C@@H](C)[C@H](C)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2365436395 JZSKAWOUVQFOGO-ZJUUUORDSA-N 447.258 4.707 50 10 IJGE CN(C[C@H]1CN(C[C@@H](CBr)c2ccccc2)CC12CC2)C(=O)OC(C)(C)C 2366104154 MJSRUHJTVLYVRO-MOPGFXCFSA-N 437.422 4.744 50 10 IJGE O=C(COc1ccccc1)N/N=C/c1ccccc1OCc1cccc(Br)c1 20523452 KFAACMYEPPCVJI-ZVHZXABRSA-N 439.309 4.557 50 10 IJGE CCOC(=O)c1c(-c2ccc(OC)cc2)csc1NC(=O)/C(C#N)=C\c1ccccc1O 33396608 PVKFAEKANQYCRN-ATVHPVEESA-N 448.500 4.852 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(C)cc4)ccc32)cc1 38685589 UXRYAFFYANVCHP-DEOSSOPVSA-N 426.472 4.831 50 10 IJGE Cc1ccc(C(=O)NNc2ncnc(Nc3ccc(Oc4ccccc4)cc3)c2N)cc1 40784236 HXFATAYUBVNNBW-UHFFFAOYSA-N 426.480 4.660 50 10 IJGE CC(C)N(CCBr)C(=O)c1cc(Br)c(Br)s1 123338986 XKEWHJFLOFORSD-UHFFFAOYSA-N 433.991 4.519 50 10 IJGE O=C(NC1CCC(Br)CC1)c1cc(Br)ccc1Br 161217058 PZXSYQOFUOARFF-UHFFFAOYSA-N 439.973 4.648 50 10 IJGE CN(Cc1cc(Cl)ccc1I)CC1CC(Br)C1 405341659 NFUGLHXUGDQHRS-UHFFFAOYSA-N 428.539 4.550 50 10 IJGE CC[C@H](Br)[C@H](C)NC(=O)c1scc(Br)c1Br 705439963 VIYCEHLOTFOBBE-WDSKDSINSA-N 433.991 4.565 50 10 IJGE CC[C@@H](C)N(CCBr)C(=O)c1scc(Br)c1Br 707886963 UOIGODOLYXBJLM-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE O=C(COc1ccc(C(=O)c2ccc(Cl)cc2)cc1)NNc1ccc(F)c(F)c1F 728715441 GHMRJCORYRTTTA-UHFFFAOYSA-N 434.801 4.510 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCc2cc(Cl)ccc2OCC#N)c1C 735333370 YROHSDKIMGSFRR-WSLMLHKMSA-N 441.915 4.519 50 10 IJGE CC(=C\c1ccc(Cl)cc1)/C=C(\C#N)c1nnc(N2CCOCC2)n1-c1ccccc1 753714004 LLLYUMKUCOTIJE-GRKJIKSTSA-N 431.927 4.768 50 10 IJGE CN(C)CC1CCC(NC(=O)C(=O)Nc2cccc(S(F)(F)(F)(F)F)c2)CC1 762669597 PYLXTGLTKKELOK-UHFFFAOYSA-N 429.455 4.519 50 10 IJGE C=C[C@H](CC(=O)NNc1nc2ccccc2c(=O)n1-c1cccc(C)c1C)c1ccccc1 1136795160 IERXISMDQQJFSE-HXUWFJFHSA-N 438.531 4.806 50 10 IJGE C=CCn1nc(C)c(-c2cc(C(=O)NNc3c(Cl)cc(Cl)cc3Cl)n[nH]2)c1C 1290090053 XUJWVHHYEBAQEL-UHFFFAOYSA-N 439.734 4.793 50 10 IJGE C#CC[C@]1(C(=O)NNc2ccc(OCc3ccccc3)cc2)CCCN1C(=O)OC(C)(C)C 1301224257 IAFUPHOSGKKPDX-AREMUKBSSA-N 449.551 4.502 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2ccc3oc(O)nc3c2)c(C)n1-c1ccc(Cl)cc1 1583956416 NXRPZJKPNXNGPM-WOJGMQOQSA-N 446.894 4.818 50 10 IJGE CCc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(OC)cc2)CCC3)cc1 1772745590 FTRWMXWTKZYJQL-UHFFFAOYSA-N 445.519 4.882 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2cccc(Cl)c2)c1 1865693711 QGGMHHIOSWXZSE-QFIPXVFZSA-N 434.927 4.900 50 10 IJGE Cc1nc(Cc2ccccc2)sc1C(=O)NNC(=O)c1ccccc1SCC(C)C 1865845056 GJLHDNOPEAGGOT-UHFFFAOYSA-N 439.606 4.865 50 10 IJGE CCCn1nc(Br)nc1N(Cc1ccccc1)[C@H](CBr)C1CC1 1905466416 MVDMAUDGXCFJDZ-OAHLLOKOSA-N 442.199 4.631 50 10 IJGE C[C@H](Nc1ncc(I)cc1Br)[C@H]1CCC[C@H]1Cl 2015759068 QEKUSUOABRHZKB-JVUFJMBOSA-N 429.527 4.657 50 10 IJGE Cc1c(Br)sc([C@@H](Cl)C2(S(C)(=O)=O)CCC2)c1Br 2047873510 OQYCFBGJDFYIBE-SECBINFHSA-N 436.618 4.829 50 10 IJGE Cc1csc(C(=O)N[C@H](C)CCCCCI)c1Br 2054169488 FORJQXWFCJUDQF-SNVBAGLBSA-N 444.176 4.933 50 10 IJGE C[C@@H]1Cc2cc([C@H](Br)c3cc(I)sn3)ccc2O1 2056486979 GVZYXSKDALDZON-UHLUBPPHSA-N 436.112 4.555 50 10 IJGE O=C(CBr)c1c(I)cc(C(F)(F)F)cc1C(F)F 2060395044 BIHGJNSZALNSFZ-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE CCc1nn(-c2ccc(CBr)cc2F)c(CC)c1I 2093920458 ZZBCYJQQYVVXEY-UHFFFAOYSA-N 437.094 4.636 50 10 IJGE CO[C@@](C)(COCc1ccccc1)Cn1c(CCl)nc2cncc(Br)c21 2095437265 MKINGAQEMJNCBM-LJQANCHMSA-N 438.753 4.555 50 10 IJGE C[C@@H]1CCOC[C@@H]1O[C@@](C)(CI)c1ccccc1Br 2096205182 YLIHSNZELNDMLJ-UGFHNGPFSA-N 439.131 4.541 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@H]2CCC[C@@]2(CCl)C1 2103177294 WIICUULWBTWHTN-AMIZOPFISA-N 427.589 4.754 50 10 IJGE ClCc1ccc(Br)c(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)n1 2120532279 SIQWZUCQVHIPJH-ZWKOTPCHSA-N 434.809 4.931 50 10 IJGE O=C(c1cc(Br)sc1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Cl)C2 2134132033 XYEHSMSCYDLAQZ-WXKLWKFWSA-N 431.552 4.596 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2C[C@H]1CCN1Cc1ccccc1 2137598879 QWJWKZXAMYCAIB-OAHLLOKOSA-N 434.765 4.821 50 10 IJGE Sc1nc2cc(Br)c(Br)cc2n1C[C@H]1C[C@@H]1Br 2213495312 CJTDMPIOFZYFIX-RITPCOANSA-N 440.986 4.633 50 10 IJGE C[C@@H]1C[C@@H]([C@H](Br)Cc2cc(Br)cc(Br)c2)CO1 2252834152 GVNHUQLIPHKEBR-ZDSQKVDBSA-N 426.974 4.943 50 10 IJGE COCCCCCO[C@](C)(CI)c1ccccc1Br 2271415061 IUASDVUPLVEUEO-OAHLLOKOSA-N 441.147 4.933 50 10 IJGE COc1ccc(Br)cc1C=C(C#N)C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] 2297551419 IWNLWDNLQOKILT-UHFFFAOYSA-N 436.649 4.565 50 10 IJGE CCN[C@@H](Cc1cc(Br)cc(Br)c1)[C@@H]1C[C@@H]1Br 2298801762 ZETWPHLJUMJUKF-AGIUHOORSA-N 425.990 4.516 50 10 IJGE CC[C@H](C[C@H](C)Br)NCc1cc(I)ccc1Cl 2307315126 DFZJSJNXLMJRED-JOYOIKCWSA-N 430.555 4.986 50 10 IJGE Clc1ccc(I)c(CN2CC[C@H]3C[C@]2(CBr)C3)c1 2315171416 KSKGBVXYMIENIM-WJONMLJTSA-N 440.550 4.694 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)[C@@H]3CC[C@@H]32)c(I)c1 2318524251 LYJLRIZEFTZIQM-OBJOEFQTSA-N 440.550 4.692 50 10 IJGE O=C(NN=Cc1cccc(Cl)c1)c1cccn(Cc2ccc(Cl)c(Cl)c2)c1=O 2323651835 JXUXSJCYQAUMEK-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE C[C@@H](NC(=O)C(C#N)=CNCc1cccc(Br)c1)C12CC3CC(CC(C3)C1)C2 2324904657 XESQDPCCCJMCET-MBAYWBQQSA-N 442.401 4.667 50 10 IJGE COc1cc(C=C(C#N)c2nc(-c3ccccc3)cs2)ccc1OCCN1CCOCC1 2331439999 OTQDUYNKUFQVPO-UHFFFAOYSA-N 447.560 4.594 50 10 IJGE Cc1c(F)ccc(CNCC(F)(F)C(F)(F)CI)c1Cl 2364614191 VHPCPVDWVIEWRX-UHFFFAOYSA-N 427.582 4.583 50 10 IJGE F[C@@]12CCC[C@@]1(CCl)CN(Cc1ccc(Cl)cc1I)C2 2366738059 JBBQPHNKBZWUGT-HUUCEWRRSA-N 428.116 4.878 50 10 IJGE CC[C@@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)c1ccc(OCCC(C)C)cc1 9874159 GZMKZUAEXATLDN-RTBURBONSA-N 426.557 4.854 50 10 IJGE Cc1c(C(=O)Nc2ccc(/N=N/c3ccccc3)cc2)oc2c1/C(=N/NC(N)=O)CCC2 40824368 BDHQAEKVPAYSCY-XWIDLWJRSA-N 430.468 4.964 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)/C(C#N)=C\N1CCC(Cc2ccccc2)CC1 217183271 ZRBKBAYQJVPKET-AZJLSSPBSA-N 431.580 4.933 50 10 IJGE Clc1ccc(N2CC[C@H](N3CCN(Cc4ccccc4)CC3)C2)c(CBr)c1 312597798 FJUVIVAZEDKYFW-NRFANRHFSA-N 448.836 4.631 50 10 IJGE O=S(=O)(Nc1ccc(CBr)cc1)c1c(Cl)cccc1Br 312798209 GTWMQJHTLPEFEV-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE O=C(NC[C@H](Br)C1CCC1)c1cc(Br)cc(Br)c1 315860785 OUOGXMCRMYMUES-LBPRGKRZSA-N 439.973 4.505 50 10 IJGE CC[C@H](COc1c(Br)cc(Br)cc1CBr)OC 397079762 QBMCJFKOJKRPGH-SNVBAGLBSA-N 430.962 4.910 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1ccccc1[C@H]1Cc2ccccc2N(S(N)(=O)=O)C1 616690439 RUZRMBAGLFUBQI-FQEVSTJZSA-N 446.689 4.601 50 10 IJGE CCCc1c(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)nnn1-c1cccc(Cl)c1 799754902 VHQXBTOOKTVJCN-UHFFFAOYSA-N 448.836 4.521 50 10 IJGE C=CC[C@H](Cc1ccccc1)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 1642542231 VXDBFDWPNRMNTK-JNCRKEHCSA-N 435.531 4.674 50 10 IJGE Cc1c(C(=O)N2CCCCCC2)oc2c1C(=NNC(=O)c1ccc3ccccc3n1)CCC2 1772751717 XBPPHOCWGHGWNW-UHFFFAOYSA-N 444.535 4.623 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2cccc(F)c2)c1 1865694439 VGDFXFRPVAYTAA-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE CC(C)[C@@H]1C[C@@H]([C@H](CBr)NC(=O)OC(C)(C)C)CN1Cc1ccccc1 1880755940 RJWDDVIDVRYIPQ-QYZOEREBSA-N 425.411 4.821 50 10 IJGE Brc1cc(OCc2ccccc2)ccc1[C@H](Br)[C@H]1COCCO1 1899860541 ONRFXHPGDMHXDX-MSOLQXFVSA-N 442.147 4.880 50 10 IJGE CC[C@@H]1C[C@H]1CCOC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1902773302 HMSPAGAFQULRMM-HUUCEWRRSA-N 437.362 4.644 50 10 IJGE CC[C@H]1CN(C(=O)OC(C)(C)C)[C@@H](CC)CN1CC(C)(C)CI 1904651433 PMWOVRGYABTUQR-GJZGRUSLSA-N 438.394 4.558 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1ccc(Br)cn1 1915774017 MKPRMQIKHXIWKC-UHFFFAOYSA-N 426.152 4.660 50 10 IJGE Cc1c([C@H](Br)c2sccc2Br)nn(C)c1Br 1980170847 RICYNULUXGJCSK-ZETCQYMHSA-N 428.975 4.799 50 10 IJGE CN(CC1CN(C(=O)OCc2ccccc2)C1)CC1(CBr)CCCCCC1 1999496091 DRVBDBRJJPYMNE-UHFFFAOYSA-N 437.422 4.922 50 10 IJGE BrC[C@H]1CCCCN1Cc1cc(Br)ccc1Br 2006502082 XHJIKSOZCCHMSY-GFCCVEGCSA-N 425.990 4.961 50 10 IJGE Cc1cc(F)c(F)cc1[C@H](Br)c1cc(I)sn1 2024718419 VALCTURMJREJNE-NSHDSACASA-N 430.055 4.819 50 10 IJGE C[C@@H]1C[C@H](C(F)(F)F)N(CC(C)(C)CBr)CCN1C(=O)OC(C)(C)C 2058049372 MLULFDXEINGJCC-CHWSQXEVSA-N 431.337 4.670 50 10 IJGE O=S(=O)(c1ccc(F)c(CBr)c1)N(Cc1ccccc1)CC1CCC1 2059267696 QZVICGBKTRWVPZ-UHFFFAOYSA-N 426.351 4.712 50 10 IJGE C[C@H]1CCc2c1c(CBr)nn2-c1cc(Br)cc(C(F)(F)F)n1 2080669082 YUNIPDMPXRRNDS-ZETCQYMHSA-N 439.073 4.993 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](Br)C(F)(F)F)[C@@H](c2ccccc2)C1 2106785249 NYXGDJJROSLZFS-CABCVRRESA-N 437.300 4.606 50 10 IJGE CC(C)(C)OC(=O)N1CCN(Cc2ccc(CBr)cc2)C[C@H]1CC(F)F 2126472468 VEBCKXHHMNZLLP-MRXNPFEDSA-N 433.337 4.658 50 10 IJGE CC(C)(C)OC(=O)NCCCN(C(=O)[C@H](Br)C1CCCC1)c1ccccc1 2167033370 NHDNPBVDLVTWLP-GOSISDBHSA-N 439.394 4.888 50 10 IJGE Cc1nn(C)c([C@@H](Cl)c2c(F)cc(F)c(Br)c2F)c1Br 2236112968 XXGMPNCZLSCJPU-JTQLQIEISA-N 432.465 4.999 50 10 IJGE Cc1cc(N(C)Cc2ccc(I)cc2)cc(CBr)n1 2272792415 LOEXCOCAFDTLQH-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@@H](Br)[C@@H]1C1CC1 2282967960 QCWZHQUQBRWJGL-RNCFNFMXSA-N 425.523 4.630 50 10 IJGE CS(=O)(=O)c1cscc1C[C@@H](CBr)c1ccccc1Br 2288490159 CONVDALADKETIV-JTQLQIEISA-N 438.206 4.635 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1Cc1ccc(Cl)c(I)c1 2300238556 MFQBZVNXNGOEAH-GXFFZTMASA-N 428.539 4.692 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)C(C)(C)CCCl 2306218864 FQQAKZQUOBBNMT-UHFFFAOYSA-N 430.555 4.893 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cc(Cl)c(F)cc1F 2320356778 RDTWLKYQCGWWBQ-CYBMUJFWSA-N 432.692 4.718 50 10 IJGE C[C@@](CI)(OC[C@H]1C[C@H](F)C1)c1ccccc1Br 2327347897 FMUMOMSVGCVQMP-MJVIPROJSA-N 427.095 4.864 50 10 IJGE CC[C@H]1[C@@H](CBr)CCN1Cc1cc(I)ccc1Cl 2327398967 KXBOOXVGLYNKFQ-YGRLFVJLSA-N 442.566 4.940 50 10 IJGE CCn1c(SCC(=O)NN=Cc2ccc(OCc3ccccc3)cc2)nc2ccccc21 1742828 BCMMACJDOHITCF-UHFFFAOYSA-N 444.560 4.878 50 10 IJGE Cc1ccccc1COc1ccc(/C=C(/C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2O)cc1 35214241 KYMXBBPVLOHMTG-UNOMPAQXSA-N 429.432 4.734 50 10 IJGE N#C/C(=C\c1c[nH]nc1-c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(C(F)(F)F)c1 35516551 OBOQAYDHHWKOPQ-NTUHNPAUSA-N 427.342 4.549 50 10 IJGE CCOc1ccc(/C=C2/C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)cc1OCC 38608456 KGXSXTDLGMMZPW-FYJGNVAPSA-N 430.504 4.585 50 10 IJGE Cc1ccc(C(=O)N/N=C2\C(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)cc1 59471806 ACSLRFBXTOQRLK-QLYXXIJNSA-N 438.314 4.983 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N[C@H](C)c2nc(-c3ccc(F)cc3)no2)c(C)n1CC(C)C 109554789 WSBREFDKMQVKSV-IWEBCOIVSA-N 435.503 4.734 50 10 IJGE O=C(NC[C@H]1CCC[C@@H]1Br)c1cc(Br)c(Br)s1 124332110 VRPZWHFWJSDCHT-RQJHMYQMSA-N 446.002 4.567 50 10 IJGE CCOc1ccc(N/C=C(/C#N)C(=O)N[C@@H](C)c2cc(C)ccc2OCC)cc1OCC 217184891 MMTIHIYSYATMJQ-ORKPOYISSA-N 437.540 4.888 50 10 IJGE Cc1cc(C)n(Cc2ccc(C(=O)NN=Cc3ccccc3OCc3ccccc3)cc2)n1 254628399 XSNMKCCEEXUXTF-UHFFFAOYSA-N 438.531 4.891 50 10 IJGE CCN(C[C@](C)(CI)O[C@H]1CC[C@@H](C)C1)C(=O)OC(C)(C)C 721535859 NPTTWALUUPWSIT-KEYYUXOJSA-N 425.351 4.642 50 10 IJGE Cc1ccc(-n2c(C)cc(C=NNC(=O)C(=O)Nc3cccc4ccccc34)c2C)cc1C 725428778 UBTHFXCABCVXKF-UHFFFAOYSA-N 438.531 4.953 50 10 IJGE O=S(=O)(Nc1cccc(-c2nc[nH]n2)c1)c1ccc(S(F)(F)(F)(F)F)cc1 782912974 NKOLDWPBRSDXAI-UHFFFAOYSA-N 426.392 4.930 50 10 IJGE CCOC(=O)/C(C(=O)CCl)=C1/Nc2ccccc2C(c2ccccc2)(c2ccccc2)N1 1081088290 HCLWDAXMEVVUTB-VHXPQNKSSA-N 446.934 4.576 50 10 IJGE N#C/C(=C/c1ccc(OCc2ccccc2Cl)cc1)C(=O)NCc1ccc2c(c1)OCO2 1084133316 YARZFTUIKIXPJZ-JAIQZWGSSA-N 446.890 4.871 50 10 IJGE Cc1ccccc1SCC(=O)NN=C1C(=O)N(C/C=C/c2ccccc2)c2ccccc21 1084573665 CUHQAGXZJPLLRX-IKNNHGDSSA-N 441.556 4.668 50 10 IJGE COc1ccc(C(=O)NN(C(=O)c2cc(C)cc(Cl)c2)C(C)(C)C)c2c1OC(C)(C)C2 1088749998 DSTLDVVAIPMUAX-UHFFFAOYSA-N 444.959 4.956 50 10 IJGE Cc1c([C@H]2CN(Cc3ccccc3)C[C@@H]2CI)cccc1[N+](=O)[O-] 1614628010 BHHVQEDPYLAGND-WMZOPIPTSA-N 436.293 4.554 50 10 IJGE Cc1ccc(-n2cc(C(=O)NNc3nc4ccccc4[nH]c3=S)c(C(C)(C)C)n2)cc1 1629911735 ADCGOJHUKKHCDW-UHFFFAOYSA-N 432.553 4.841 50 10 IJGE C=CCOc1c(Br)cc(CNC[C@]2(C)C[C@H]2Br)cc1OCC 1658338099 HFXBXSLHTXAACU-WBVHZDCISA-N 433.184 4.676 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2O)CCC3)cc1C 1772751723 KYJYLLFVBBUAED-UHFFFAOYSA-N 431.492 4.633 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C(C)(C)C 1882801455 WGQDYHJAJJVWCG-ZNMIVQPWSA-N 449.430 4.946 50 10 IJGE Cc1cnc2c(S(=O)(=O)N(Cc3ccccc3)C[C@@H](C)Br)cccc2c1 1914654075 CEZJCVIXOXEXTO-MRXNPFEDSA-N 433.371 4.518 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1cc(Br)ccc1O 1915132551 JHMDFMSAGZPXKU-ZDUSSCGKSA-N 441.163 4.971 50 10 IJGE O=C(N[C@@H](CCCl)C(F)(F)F)c1cc(Br)sc1Br 1918553491 DHKNOIMSLGQQCF-YFKPBYRVSA-N 429.483 4.563 50 10 IJGE BrC[C@@H](NCc1cccc(Br)c1Br)C1CCC1 1943907156 UOWZETARHQCBFE-GFCCVEGCSA-N 425.990 4.865 50 10 IJGE C[C@]1([C@H](Br)c2sc(Br)cc2Br)COCCO1 1992638161 IISFXCVDSRYNAH-NXEZZACHSA-N 434.975 4.515 50 10 IJGE Cc1cc([C@@H](Br)c2cc(I)sn2)cc(C)c1F 2007646440 XXTJHVQRQDHMBR-LLVKDONJSA-N 426.092 4.988 50 10 IJGE C[C@@]1(NC(=O)c2csc(Br)c2Br)CCC[C@@H]1Br 2011549668 UUAYGRIYEWXSLM-WRWORJQWSA-N 446.002 4.709 50 10 IJGE C[C@]1(CCBr)CCN1Cc1ccc(Br)cc1Br 2025221470 CHFUCRYLYSVWSZ-ZDUSSCGKSA-N 425.990 4.961 50 10 IJGE CC1(C)[C@H](Br)CCN1C(=O)c1cccc(Br)c1Br 2031484532 CBMVYYCLQVADDM-SNVBAGLBSA-N 439.973 4.600 50 10 IJGE O=C(NC[C@@H]1CC[C@@H](Br)C1)c1c(Br)cccc1Br 2033093809 KNILKWLWOKKOQH-RKDXNWHRSA-N 439.973 4.505 50 10 IJGE CCOC(C)(C)CO[C@H](CI)c1cccc(Br)c1 2033159936 OUKSPXFIWRZCHD-CYBMUJFWSA-N 427.120 4.757 50 10 IJGE CCC[C@H](CBr)CN1CC[C@@H](C(F)(F)F)[C@@H](NC(=O)OC(C)(C)C)C1 2044695251 BQYJYYPQCMBHKN-MCIONIFRSA-N 431.337 4.575 50 10 IJGE Cc1cc(C(=O)N[C@H](C)CCCCCI)c(Br)s1 2054170728 NWHSYVZSJWVPJH-SECBINFHSA-N 444.176 4.933 50 10 IJGE Clc1cc(C[C@]2(CBr)C[C@@]23CCOC3)ccc1I 2086651618 JRGUJFADHIGCTG-ZIAGYGMSSA-N 441.534 4.679 50 10 IJGE CC1(C)CN(Cc2ccccc2)CCN(c2ccc(CBr)cc2[N+](=O)[O-])C1 2150467989 FVQMATMUSGEGPA-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CC(C)(C)CN1C(=O)c1ccc(CBr)cc1 2162872368 MEACROVBBPIAHD-YOEHRIQHSA-N 439.394 4.735 50 10 IJGE CC(C)(C)[C@H](CBr)CN1CCCC[C@@H]1[C@@H]1CCCN(C(=O)C(F)(F)F)C1 2163064847 WNQYLVAQFUCITB-BZUAXINKSA-N 441.376 4.699 50 10 IJGE CCCC[C@H](C)N(C)S(=O)(=O)c1ccc(CBr)c(Br)c1 2179950124 FPNSIXRVGNUHPS-NSHDSACASA-N 427.202 4.543 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)S(=O)(=O)Cc1cccc(Br)c1 2213761273 TVXBIGOBJHAUKK-GOSISDBHSA-N 430.795 4.799 50 10 IJGE Cc1cc(Br)c([C@@H](Br)C2(C)CS(=O)(=O)C2)c(C)c1Cl 2224309260 ATPPPLCOVRCBAZ-GFCCVEGCSA-N 430.589 4.590 50 10 IJGE CCCN(C[C@H](C)Br)C(=O)c1cc(Br)cc(Br)c1 2259757460 LGAZYNOTCAVYHU-VIFPVBQESA-N 441.989 4.847 50 10 IJGE C[C@H]1CCCN(C(=O)c2ccc(Cl)c(I)c2)[C@@H]1CCCl 2283660257 BWIUSEPHENKKJZ-IINYFYTJSA-N 426.125 4.814 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1CBr)c1cc(Br)c(F)cc1Cl 2285843918 GFXDAOVBMTXDSP-ISVAXAHUSA-N 427.539 4.925 50 10 IJGE Cc1nsc(Br)c1C(=O)N(CCC(C)(C)C)C[C@H](C)Br 2288053516 FDYSWWMCQVTXNA-VIFPVBQESA-N 426.218 4.876 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2ccc(Br)cc2)cc1Br 2296807976 GODOWCNHDPOBSQ-UHFFFAOYSA-N 436.103 4.766 50 10 IJGE Clc1ccc(CN2C[C@@H]3CC[C@]3(CBr)C2)c(I)c1 2318525326 YAZWSWYKGXWFTC-FZMZJTMJSA-N 440.550 4.552 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C)CN(C[C@H](CBr)C(C)(C)C)CC1(F)F 2326651350 ODDCBWPZALQDEK-GUYCJALGSA-N 427.374 4.526 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@H](Br)[C@H]1C1CC1 2327406796 MNLXPKXYCLRNDP-GXTWGEPZSA-N 440.550 4.692 50 10 IJGE Cn1cc(I)c(CC2(CBr)CC3(CCCCC3)C2)n1 2341765795 VQILBEWSJPOCAF-UHFFFAOYSA-N 437.163 4.693 50 10 IJGE CC(C)(C)c1n[nH]c2c1[C@H](c1ccc(OC(=O)c3ccccc3Cl)cc1)C(C#N)=C(N)O2 9861006 NRBAHNGZSAUMSR-GOSISDBHSA-N 448.910 4.798 50 10 IJGE COc1ccc(C(=O)Oc2cc(/C=C(/C#N)C(=O)Nc3ccccc3F)ccc2OC)cc1 96401919 YJKFEUXTHZOPKZ-AQTBWJFISA-N 446.434 4.608 50 10 IJGE O=C1C(Cl)=C/C(=C\NNC(=O)c2cc3c(ccc4ccccc43)o2)C=C1Br 136001084 SYSXVICSESCUPB-KHPPLWFESA-N 443.684 4.689 50 10 IJGE CCCOc1ccc([C@H](Br)[C@H]2CCCCS2(=O)=O)cc1Br 229005229 XZYPMQNCKIMGJB-CABCVRRESA-N 440.197 4.641 50 10 IJGE O=C(N[C@@H]1CCC[C@H]1CBr)c1cc(Br)ccc1Br 231580519 VISUFGCJKICHGV-QPUJVOFHSA-N 439.973 4.505 50 10 IJGE Cc1cccc(C(=O)Oc2ccc(C=NNC(=O)COc3cccc4ccccc34)cc2)c1 254516236 CQUNKUSDSOYFIZ-UHFFFAOYSA-N 438.483 4.897 50 10 IJGE C[C@H](Cl)c1cnnn1-c1c(Br)cc(Br)cc1Br 310173127 LPHTVYIVEFVGQT-YFKPBYRVSA-N 444.352 4.855 50 10 IJGE N#CSc1ccc(NC(=O)Nc2cccc(C(=O)NCCCCN3CCCC3)c2)cc1 586700124 FHVDHECRYSYTBM-UHFFFAOYSA-N 437.569 4.510 50 10 IJGE C[C@@H](Br)[C@@H]1CCN(C(=O)c2scc(Br)c2Br)C1 719869150 HEGDBXJGZUNOJE-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE C[C@H]1CCCC[C@@H]1OC1(CI)CCN(C(=O)OC(C)(C)C)CC1 725343864 BZPJXCKWMUSDIM-GJZGRUSLSA-N 437.362 4.786 50 10 IJGE O=C(NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl)[C@H]1C[C@H]1c1c(F)cccc1F 734861859 BEJSQPGCTKGHJU-ZJUUUORDSA-N 449.832 4.758 50 10 IJGE Cc1ccc(F)c(NNC(=O)c2cccnc2Oc2ccc(F)cc2Br)c1 760148021 YFGPMXGIQRSMPP-UHFFFAOYSA-N 434.240 4.980 50 10 IJGE CCCN(CCc1cccs1)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 768529979 AMFZJMYMKSXZSK-FXBPSFAMSA-N 443.576 4.914 50 10 IJGE C[C@@](O)(CNC(=O)C(=O)Nc1ccc(S(F)(F)(F)(F)F)cc1)C1CCCCC1 773729574 FWEBZEFCTYDZJT-QGZVFWFLSA-N 430.439 4.730 50 10 IJGE O=C(Cc1cccc2ccccc12)NN=Cc1ccc(SCC(=O)Nc2ccccc2)o1 1084156904 ZCDHVSBCFFUBGM-UHFFFAOYSA-N 443.528 4.856 50 10 IJGE Cc1cccc(C(=O)NN=C2C(=O)N(Cc3c(Cl)cccc3Cl)c3ccccc32)c1 1084452172 AYWUUAXEJONWCT-UHFFFAOYSA-N 438.314 4.983 50 10 IJGE C#CCCN(CCOC)C(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1533858991 JYKFJLYBYFUSAN-UYRXBGFRSA-N 444.362 4.806 50 10 IJGE Cc1cc(C)c2nc(-n3ncc(C#N)c3NC(=O)/C(C#N)=C\c3ccccc3)cc(C)c2c1 1613918751 CHEHKPJIPIVPDF-NDENLUEZSA-N 432.487 4.763 50 10 IJGE C=C(C)C[C@H](CO)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1636699388 KLIQMZKXBVLIFB-DAIOKFOQSA-N 432.351 4.751 50 10 IJGE COc1cc(C=NNC(=O)COc2ccccc2C(C)C)ccc1OCCc1ccccc1 1772753747 GVEJRSIQFRHFIU-UHFFFAOYSA-N 446.547 4.969 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(Br)cc2)cc1 1865709422 VHUPNVLGVIMINY-HXUWFJFHSA-N 435.325 4.724 50 10 IJGE O=C(N[C@H](CSCC1CC(Cl)C1)C(=O)O)OCC1c2ccccc2-c2ccccc21 1883648818 HAFCEAKOVUAVSI-ZGDBYOLNSA-N 445.968 4.729 50 10 IJGE C[C@@H](Cl)CN(Cc1ccccc1)C(=O)c1cccc(F)c1I 1914615120 YYLDZFHKEHXJFD-GFCCVEGCSA-N 431.676 4.700 50 10 IJGE COc1cc(C(=O)N(Cc2ccccc2)[C@@H](CBr)C(C)C)ccc1[N+](=O)[O-] 1915271826 HRSXFQPRKISVAR-SFHVURJKSA-N 435.318 4.665 50 10 IJGE CCc1nc(Br)c(Br)n1C[C@H](CBr)C1CCC1 1942155290 XRNSJABKQNMYKA-VIFPVBQESA-N 428.994 4.782 50 10 IJGE CC1([C@@H](CBr)NCc2cc(Cl)ccc2I)CC1 1945358900 ULGNXLGTAKNEKE-GFCCVEGCSA-N 428.539 4.598 50 10 IJGE C[C@H]1C[C@H](CBr)CN1Cc1ccc(Br)cc1Br 1950534776 HJMPIHCREDEHGR-VHSXEESVSA-N 425.990 4.817 50 10 IJGE C[C@H](Cl)CC(=O)Nc1cc(Br)c(Br)c(Br)c1 1982340654 ONLSBYGIQXFUTA-YFKPBYRVSA-N 434.353 4.930 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(OCc2ccccc2)C(=O)[C@@H](Cl)c2ccccc2)C1 1982826904 PAQFRPXELSHZTK-FQEVSTJZSA-N 430.932 4.546 50 10 IJGE CC(C)C(CCO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1I)C(C)C 1988261963 GNACSZPBVQRQAD-JKSUJKDBSA-N 439.378 4.744 50 10 IJGE C[C@H]1Cc2cc([C@H](Br)c3cc(I)sn3)ccc2O1 2056486977 GVZYXSKDALDZON-CPFSXVBKSA-N 436.112 4.555 50 10 IJGE CCCOc1ccc(S(=O)(=O)N(CC)Cc2ccccc2)cc1CBr 2059291383 KNIJDGGDWMUXJW-UHFFFAOYSA-N 426.376 4.581 50 10 IJGE O=C(c1csc(I)c1)N1CCCC[C@H]1CCCBr 2085688504 PXSNZEAHERXCJA-NSHDSACASA-N 442.160 4.523 50 10 IJGE CO[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)N(CCCCCCCCCBr)C1 2106787618 JIMPOULOHNBECE-ROUUACIJSA-N 435.447 4.726 50 10 IJGE CC(C)n1cc(S(=O)(=O)N(Cc2ccccc2)CC2CCC2)cc1CBr 2123270942 PBSZYOYKNXQXAT-UHFFFAOYSA-N 439.419 4.955 50 10 IJGE CC(C)(C)[C@H](CBr)CN1CCC([C@H]2CCCN(C(=O)C(F)(F)F)C2)CC1 2163065184 YDOUFENVEOSMMJ-JKSUJKDBSA-N 441.376 4.557 50 10 IJGE BrCC1(CN2CCC[C@@]3(CCCN(Cc4ccccc4)C3)C2)CCOCC1 2163307068 PSKSRLXEZCONRG-HSZRJFAPSA-N 435.450 4.556 50 10 IJGE CC[C@]1(C)CCCN(S(=O)(=O)c2cc(CBr)sc2Br)C1 2179788330 AZVFDFXBQQFXAP-CYBMUJFWSA-N 445.242 4.606 50 10 IJGE CN(c1ccc(CBr)c([N+](=O)[O-])c1)[C@H]1CN(Cc2ccccc2)C(C)(C)C1 2188575568 AFEPRBPEFPKKHE-LJQANCHMSA-N 432.362 4.979 50 10 IJGE ClC[C@H](CC1CCOCC1)NCc1c(Br)cccc1Br 2195502501 XSYBPLPVBJJSMA-LBPRGKRZSA-N 425.592 4.725 50 10 IJGE C[C@@H]1C[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)[C@@H](C)N(C(=O)OC(C)(C)C)C1 2209050758 TWZCUAFNUVUMFF-APIJFGDWSA-N 435.403 4.556 50 10 IJGE ClCCc1nc2c(Cl)cccc2n1C[C@H]1CC1(Br)Br 2224805721 OCTGNYFAWQFMDE-MRVPVSSYSA-N 426.967 4.977 50 10 IJGE Cc1cc(C(=O)N2C[C@@H](Br)CC23CCCC3)ccc1I 2241042285 ZCXYTGGTQBCGGP-ZDUSSCGKSA-N 448.142 4.522 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([S@@](C)(=O)=NCCCCCCCBr)C1 2263163858 APTSZDWFPMNPJK-IVCQMTBJSA-N 439.460 4.829 50 10 IJGE N#CC(=Cc1ccc(O)cc1)C(=O)Nc1ncc(Cc2ccc(Br)cc2)s1 2296819202 VYGBCPIYUVRJLC-UHFFFAOYSA-N 440.322 4.748 50 10 IJGE BrCCN(Cc1ccsc1)Cc1sccc1I 2301071096 KFZHJWYKRFOMAP-UHFFFAOYSA-N 442.185 4.811 50 10 IJGE COc1cccc(OCc2sccc2I)c1CBr 2316754548 JPWVVAQINOAQPM-UHFFFAOYSA-N 439.112 4.835 50 10 IJGE COc1c(Br)cc(C)c([C@H](Br)[C@@H]2C[C@@H]2OC)c1Br 2317429500 RXHBLHAUFMJJNK-POZPLHJXSA-N 442.973 5.000 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc3nc(Cc4ccccc4)[nH]c3c2)c(OCC)c1 2323721469 YVTRUMFTTVPERZ-UHFFFAOYSA-N 442.519 4.715 50 10 IJGE COc1ccc([C@H](C)NC(=O)C(C#N)=CN(Cc2ccccc2)Cc2ccccc2)cc1 2325055383 DDJPUBYDBNGBSQ-NRFANRHFSA-N 425.532 4.982 50 10 IJGE C[C@H]1C[C@H](CCl)CCN1Cc1ccc(I)c(Br)c1 2325205165 UXJUBBZDSGHIDT-WDEREUQCSA-N 442.566 4.893 50 10 IJGE Cl[C@H]1CCN(Cc2ccc(I)c(Br)c2)[C@H]1C1CC1 2325234537 YUUWROIBNOEDTI-JSGCOSHPSA-N 440.550 4.645 50 10 IJGE CC(C)C[C@@H](CBr)CN=[S@@](C)(=O)C1CCN(C(=O)OC(C)(C)C)CC1 2328521354 NYAVAMUQYWUMOG-MQNRADLISA-N 439.460 4.541 50 10 IJGE CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1ccccc1OCc1ccccc1 2328822703 AMTZCKIZLYFLDH-NRFANRHFSA-N 439.556 4.655 50 10 IJGE CC1(C)CC(CBr)(CN2[C@H](CNC(=O)OC(C)(C)C)C[C@H]3CCC[C@H]32)C1 2345010520 MGDVSLBNKIRCOG-IXDOHACOSA-N 429.443 4.955 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CCCN(C[C@@]3(CBr)CC3(F)F)C2)C1 2351892672 SDXRIMPISIRZGT-MSOLQXFVSA-N 437.369 4.520 50 10 IJGE C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)COc1ccc(-c2ccccc2)cc1 14031684 KLGWTJJMAHTMGX-IBGZPJMESA-N 440.499 4.501 50 10 IJGE COc1ccc(Br)cc1/C=C(/C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 33859373 WCQUMQZMNKJYBI-WDZFZDKYSA-N 436.649 4.565 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)N/N=C\c2ccccc2OCc2ccc(C)cc2)cc1 58895477 HWCJAWXFOTXCSY-AEJDXJHNSA-N 446.547 4.937 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1S[C@H](C)C(=O)N/N=C(\C)CCC 59914985 PCRXBLHZNSTHIL-QKIXXSFTSA-N 434.997 4.502 50 10 IJGE CCCCOc1ccc(C=NNC(=O)CSc2nnc(-c3ccccc3)s2)cc1 256028625 YWNKWKGSAHOQLM-UHFFFAOYSA-N 426.567 4.626 50 10 IJGE C[C@H]1[C@H](n2c(CCCl)nc3cc(Br)cnc32)CCN1Cc1ccccc1 311901629 ALXGBJNVVVBECB-KBXCAEBGSA-N 433.781 4.811 50 10 IJGE CN(Cc1cc(Cl)ccc1I)C[C@@H]1CCC[C@@H]1Br 708342396 RUWHNOFWARTHMX-GWCFXTLKSA-N 442.566 4.940 50 10 IJGE COc1ccccc1Nc1nc2sc(C(=O)NNc3cccnc3Cl)cc2s1 754483487 FZURXSXQVKSBHW-UHFFFAOYSA-N 431.930 4.915 50 10 IJGE C[C@H](OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1)c1cccnc1 781865627 BVRBAFLLZWCCLE-QUYZQLMHSA-N 431.883 4.724 50 10 IJGE Cc1nc(-c2ccccc2NC(=O)NNC(=O)c2cc(-c3ccc(C)c(C)c3)[nH]n2)cs1 797667686 CIXOOLKLEDBLJL-UHFFFAOYSA-N 446.536 4.592 50 10 IJGE N#C/C(=C\c1ccccc1OCc1ccccc1F)C(=O)N1CCN(c2ccccc2)CC1 1083916300 HRMNQAJVMQPMDK-PTGBLXJZSA-N 441.506 4.660 50 10 IJGE COc1ccc(CSCC(=O)NN=Cc2ccc(OCc3ccc(C)cc3)cc2)cc1 1084393550 PALLEBYCTJTFRO-UHFFFAOYSA-N 434.561 4.966 50 10 IJGE C#CC[C@@]1(C(=O)NNc2c(Cl)cc(Cl)cc2Cl)CCCN1C(=O)OC(C)(C)C 1350807095 ZEHLSYUIXMRRTA-IBGZPJMESA-N 446.762 4.883 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C(C)(C)c2ccc(C(F)(F)F)cc2)c1C 1472514741 XNHPADHASMYTPI-UHFFFAOYSA-N 429.446 4.595 50 10 IJGE C=C(Cl)C[C@@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccccc2C)c1C)C(=O)OCC 1535344765 HYWQKEYALNJOIT-NNVROAHOSA-N 439.943 4.500 50 10 IJGE Cc1ccccc1COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccn2)cc1 1865702882 HNLXEHIEPQIIBD-RUZDIDTESA-N 449.514 4.681 50 10 IJGE CCN(CC)Cc1ccc(/C=N\NC(=O)c2ccc(-c3ccc(OC)cc3)nc2C)cc1 1865762135 PHTIBVIRCAJMEH-PKAZHMFMSA-N 430.552 4.671 50 10 IJGE CCCCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(Br)cc2)cc1 1866128683 GAXOBGBINADJRO-GHRIWEEISA-N 427.298 4.952 50 10 IJGE CC(C)COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cccc(Br)c2)cc1 1866131562 BGHCEYIABUYNIJ-LICLKQGHSA-N 427.298 4.808 50 10 IJGE C[C@H](C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)Nc1ccc(SC#N)cc1)C1CCCC1 1867009151 FAGCROFSSFYSTP-AOMKIAJQSA-N 439.556 4.891 50 10 IJGE CC(C)(C)[C@H](CBr)CN1CCC12CCN(C(=O)OCc1ccccc1)CC2 1999500843 MOIBBBDLIWIJNT-LJQANCHMSA-N 437.422 4.921 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC[C@H]2C[C@@H]2C2CCC2)C1 2022600105 VWEQBDSRTYGLNK-GPMSIDNRSA-N 449.373 4.644 50 10 IJGE O=C(NC[C@H]1CC[C@H](Br)C1)c1cccc(Br)c1Br 2031487124 QSZGHBWVURWMEM-IUCAKERBSA-N 439.973 4.505 50 10 IJGE Cc1c(CBr)cccc1S(=O)(=O)N(Cc1ccccc1)CC(F)(F)F 2059266288 DXNKACPCTIBWEN-UHFFFAOYSA-N 436.293 4.643 50 10 IJGE CC(C)(C)OC(=O)NC1(CNC(=O)c2ccc(CBr)cc2)CCCCC1 2106200901 JKBOPAALOGKEAQ-UHFFFAOYSA-N 425.367 4.539 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(CC3(CBr)CCCCC3)C[C@@H]21 2106787574 IZTZDVJIFUCSMY-FGTMMUONSA-N 429.443 4.957 50 10 IJGE CCCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)CC1(CBr)CCOCC1 2163061970 JHVQCMVROOJXJU-GOSISDBHSA-N 447.458 4.680 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CCN(C(=O)[C@@H](Br)C1CCCC1)CC2 2167030549 CNLQRHWNFVDCOW-KRWDZBQOSA-N 443.426 4.580 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC[C@@H](NC(=O)[C@H](Br)C3CCCC3)C2)CC1 2167035009 ZNOBDLQDKFTLNV-IAGOWNOFSA-N 443.426 4.626 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@@]2(F)CCC[C@@]2(CCl)C1 2176640912 QETYARBTZILVIF-OLZOCXBDSA-N 445.579 4.846 50 10 IJGE C[C@@H]1CCN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@H]1CBr 2282976688 VZEPKTGWGIFPGK-BDAKNGLRSA-N 427.539 4.735 50 10 IJGE Cc1ccc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)c(CBr)n1 2287030542 JOHCSSOHEYYGNN-DYQZNNLLSA-N 426.402 4.632 50 10 IJGE CCc1nc(C(=O)N(C[C@H](C)Br)CC(C)(C)C)c(Br)s1 2288050234 VIVZZPMRMYBGPX-VIFPVBQESA-N 426.218 4.740 50 10 IJGE COc1ccc(NC=C(C#N)c2nc(-c3cc4ccccc4oc3=O)cs2)c([N+](=O)[O-])c1 2295956272 SDXDAOKJGSJLSL-UHFFFAOYSA-N 446.444 4.810 50 10 IJGE C[C@H]1CCN(Cc2ccc(Cl)cc2I)C[C@H]1CBr 2318539435 MBFLMGVTGZIJSZ-CMPLNLGQSA-N 442.566 4.798 50 10 IJGE Cn1cc(I)c(C[C@]2(CBr)CCCCC2(C)C)n1 2319144836 KBPWGQKXAFGVRJ-AWEZNQCLSA-N 425.152 4.549 50 10 IJGE CCOc1cc(C=NNC(=O)c2cc3ccccc3n2C)ccc1OCc1ccccc1 2323732967 NKAZCEQUGBRXBG-UHFFFAOYSA-N 427.504 4.920 50 10 IJGE CC1CC(CCl)(N(C)Cc2ccc(I)c(Br)c2)C1 2325219674 ADPFAMIBTLIKRR-UHFFFAOYSA-N 442.566 4.893 50 10 IJGE Cl[C@@H](CCc1ccc(I)c(Br)c1)CN1CCCC1 2325222644 LZWUVCNXVJSOIC-LBPRGKRZSA-N 442.566 4.690 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCN(CC2(CBr)CC2)[C@H](C(F)(F)F)C1 2337585164 JLNJOAQTNHFDTI-KBPBESRZSA-N 443.348 4.719 50 10 IJGE O=S(=O)(N[C@H](CCCl)COCc1ccccc1)c1ccc(Cl)c(F)c1Cl 2343793447 WXFHSKKBEZBLCD-CYBMUJFWSA-N 440.751 4.625 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@](C)(CBr)C(C)(C)C)[C@H](C(F)(F)F)C1 2352076626 JABOTJPOHPBBOF-GUYCJALGSA-N 445.364 4.917 50 10 IJGE CN(Cc1c(Br)c(Br)nn1C)c1cc(Cl)ccc1CCl 2364375987 GQBODSXRCWBDNX-UHFFFAOYSA-N 441.982 4.974 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1OCc1ccccc1 6906951 BHSBRZIRBATWAG-UYRXBGFRSA-N 429.432 4.728 50 10 IJGE O=C(c1ccco1)N(/N=C/c1coc2ccccc2c1=O)c1nc2ccc(F)cc2s1 9149153 ULURAYYQKZMZNB-BHGWPJFGSA-N 433.420 4.816 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc(C)nc2)ccc1OC(=O)c1cccc2ccccc12 33155057 CXZJQCGZNLULMQ-MBTHVWNTSA-N 439.471 4.535 50 10 IJGE CCCOc1ccc(/C=C/C(=O)Oc2ccc(/C=C(/C#N)C(=O)OCC)cc2OCC)cc1 33378282 CVUPJRIXYJAIRS-CFRAVMCGSA-N 449.503 4.963 50 10 IJGE Cc1c(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccco2)oc2ccc(F)cc12 38688515 KDXJXMLDEAUYGG-OAQYLSRUSA-N 430.391 4.911 50 10 IJGE O=C(N/N=C\c1ccc(Cl)cc1)c1cccn(Cc2ccc(Cl)c(Cl)c2)c1=O 169920494 JPRHKNPBVXDDKX-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE CCOCCCOc1c(Br)cc(CBr)cc1Br 233710454 RJKURYSRSKLXOW-UHFFFAOYSA-N 430.962 4.912 50 10 IJGE CCOc1cc(C=NNC(=O)c2cc(-c3cccc(OC)c3)nc3ccccc23)ccc1O 252617950 LCFJJXLTUMXPNS-UHFFFAOYSA-N 441.487 4.779 50 10 IJGE CCCOc1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)NN=C(C)c2ccccc2)cc1 254378198 NNRZWSCTUQJFNN-XYGBNWADSA-N 441.531 4.787 50 10 IJGE CC(=O)[C@H](Br)[C@H](C)c1ccc(Br)c(I)c1 300904559 NERALXQNAKNEJQ-KSBSHMNSSA-N 445.920 4.510 50 10 IJGE O=C(c1cc(Br)cc(Br)c1)N1CCC[C@@H]1CCBr 310724943 KHFPXGIJPAPNBE-GFCCVEGCSA-N 439.973 4.601 50 10 IJGE C[C@@H](Br)c1ccccc1NS(=O)(=O)c1cc(Br)cs1 311566439 AZMQRDYPUGHXDU-MRVPVSSYSA-N 425.167 4.767 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(OC[C@@H]2C[C@H]3CCCC[C@@H]3O2)CC1 380845191 ZLLVWAXURMHKKQ-IKGGRYGDSA-N 432.399 4.515 50 10 IJGE CC[C@@H](C)N(CCBr)C(=O)c1cc(Br)sc1Br 383468643 OXJYTQFGBMIFQA-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1C(=O)c1ccc(Br)cc1Br 384217161 CPKJCZRNDFNPJV-LDYMZIIASA-N 439.973 4.600 50 10 IJGE Clc1ccc(I)c(CN2[C@H]3CC[C@H]2CC(Br)C3)c1 405304592 PMPXPGCDHCIRMT-STQMWFEESA-N 440.550 4.835 50 10 IJGE CC(C)(C)CN(CCBr)c1ncc(Br)cc1Br 690944775 WGTLYBQWLUGTNU-UHFFFAOYSA-N 428.994 4.854 50 10 IJGE CCN(C[C@@H](C)Br)C(=O)c1scc(Br)c1Br 705447352 HQDBRWPWEHPFDY-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C[C@H](C)c2cccc(C(F)(F)F)c2)c1C 738542282 HINGWLAYTPGKAU-ZDUSSCGKSA-N 429.446 4.811 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=O)Cc2csc(-c3ccccc3Cl)n2)cc1 768569351 PPXSQNRITFNNIJ-UHFFFAOYSA-N 427.957 4.765 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)NC3(C(F)(F)F)CCOCC3)c2C)c1 776967103 ASTVCWAJWLVNNL-UYRXBGFRSA-N 431.458 4.537 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc(C)c([N+](=O)[O-])c2)ccc1OCc1ccccc1 1084346083 CCHBZHGQWNDYGH-UHFFFAOYSA-N 433.464 4.645 50 10 IJGE COc1ccccc1NC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12 1086853913 AATCKWYJTBJAHP-UHFFFAOYSA-N 430.439 4.516 50 10 IJGE O=C(Cc1cc2ccccc2c(O)n1)NNc1cc(C(F)(F)F)cc(C(F)(F)F)c1 1159385237 JIQOBPNFDPGDHP-UHFFFAOYSA-N 429.320 4.664 50 10 IJGE C/C(=C/c1ccncc1)C(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12 1463942476 ZFYDYSPQHRMFIC-PEZBUJJGSA-N 442.906 4.815 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2ccc(Cl)cc2Br)cc1)C1CC1 1672448784 LDOAWSNNTHCTAH-UHFFFAOYSA-N 437.725 4.766 50 10 IJGE Cc1cc(Cl)ccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccncc1)CCC2 1772745707 IXWLIAKZMUMPOM-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE N#CSc1ccc(NC(=O)c2ccnc(NC(=O)c3c(F)cccc3Cl)c2)cc1 1860510402 XTFITKBMQNYBKF-UHFFFAOYSA-N 426.860 4.952 50 10 IJGE Cc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699458 UXGYPEJOVMEADC-JOCHJYFZSA-N 429.911 4.603 50 10 IJGE CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1ccccc1OCc1ccccc1 1873794783 AMTZCKIZLYFLDH-AUEUWSLNSA-N 439.556 4.655 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1cc(Br)sn1 1884458863 KSGHHMXRLJEBKV-GFCCVEGCSA-N 432.181 4.722 50 10 IJGE Clc1cc(I)c([C@@H](Br)C2CC3(COC3)C2)s1 1900923656 DJMMCQWXJDQGCT-VIFPVBQESA-N 433.536 4.869 50 10 IJGE CC1(C)OC[C@@H](Cc2c(Br)cccc2Br)[C@H]1Br 1945330433 LEHHXRSWYOUPJC-PRHODGIISA-N 426.974 4.943 50 10 IJGE C[C@@H]1C[C@H](CBr)CN1Cc1ccc(Br)cc1Br 1950534774 HJMPIHCREDEHGR-NXEZZACHSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)NC1CCC2(CC1)CC1(CC[C@@H](CI)O1)C2 1983332051 PQKOKNGKKAGLNT-RVFVAPPNSA-N 435.346 4.587 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@H]([C@]2(C)CC[C@@](C)(CI)O2)CC1 1993736348 WAQQOMDDQRBYFY-USJZOSNVSA-N 437.362 4.833 50 10 IJGE CCCC(CBr)(CCC)CN1CCCO[C@@H](CNC(=O)OC(C)(C)C)C1 2106784427 INRNISJWKLCCRD-KRWDZBQOSA-N 435.447 4.584 50 10 IJGE Brc1ccc([C@H](CI)OCCOCCC2CC2)cc1 2127762056 BOVFJWHXCGTITG-HNNXBMFYSA-N 439.131 4.759 50 10 IJGE Cc1cc([C@H](Br)c2ccc3c(c2)CCS3(=O)=O)sc1Br 2170066676 IYWFUCWUCRJCKE-CYBMUJFWSA-N 436.190 4.633 50 10 IJGE Cc1cc(Br)c(CCl)c(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@H]32)c1 2173452555 GEIAQGCFVVYLRB-FGZHOGPDSA-N 449.820 4.976 50 10 IJGE Fc1cc2c(cc1I)nc(CCCl)n2CC1(Cl)CCC1 2197088344 IWUAIGHBOZEAKX-UHFFFAOYSA-N 427.088 4.723 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(C[C@H](CBr)c3ccccc3)C[C@H]2C1 2206174415 DBGXSTWZSRQNFE-YSTOQKLRSA-N 437.422 4.790 50 10 IJGE COCCO[C@@H]1[C@@H](Br)C[C@H]1Oc1ccc(Cl)c(Cl)c1Br 2206355617 AOMCPXSSFOUFKG-JVQVWZCXSA-N 448.966 4.702 50 10 IJGE COCCO[C@H]1[C@@H](Oc2ccc(Cl)c(Cl)c2Br)C[C@H]1Br 2206355619 AOMCPXSSFOUFKG-LIEFSGRHSA-N 448.966 4.702 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C1CCCN(C(=O)OC(C)(C)C)CCC1 2241586113 QNIMUXGGDCMKNV-HNNXBMFYSA-N 435.403 4.702 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC2(C)CCCCC2)CC1 2244591529 LHSRWCPVUHTDFV-UHFFFAOYSA-N 437.362 4.931 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(CC3(CBr)CC(F)C3)CC2)C1 2280358697 GKJXQZCQNOZISV-XPQZIERPSA-N 447.433 4.859 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@H]1CC(Br)C2 2282983499 QKPUWMLXBDHCGR-IUCAKERBSA-N 425.523 4.772 50 10 IJGE O=C(NC[C@H]1CCC[C@H]1CBr)c1cc(Br)c(F)cc1Cl 2285957445 HPFOJUBSVQNWCA-DTWKUNHWSA-N 427.539 4.783 50 10 IJGE CC(C)C[C@H](CCl)NCc1ccc(I)c(Br)c1 2306220460 XSRGYOVRNUPUKY-LLVKDONJSA-N 430.555 4.797 50 10 IJGE C[C@H]1C[C@H](Br)CCN(Cc2ccc(Cl)c(I)c2)C1 2315554277 CXLJDMYORJXLFQ-CMPLNLGQSA-N 442.566 4.940 50 10 IJGE Clc1ccc(CN2CC3(CC3)C[C@@H]2CBr)c(I)c1 2318516874 XXQMMDRBFQJXDF-GFCCVEGCSA-N 440.550 4.694 50 10 IJGE COc1ccc(C(C#N)=Cc2ccc(OC(=O)c3cccc(NC(C)=O)c3)c(OC)c2)cc1 2320506198 DPMNVCWZMRFEAK-UHFFFAOYSA-N 442.471 4.946 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC(F)(F)C[C@H]1CN(CCCCCCBr)C2 2344057613 XBCPHWWWMKFEEB-YJBOKZPZSA-N 439.385 4.956 50 10 IJGE CC1(C)CC(CBr)(CN2CCCn3ncc(NC(=O)OC(C)(C)C)c32)C1 2345007757 FVRGRVZTJQNHMG-UHFFFAOYSA-N 427.387 4.642 50 10 IJGE C[C@@H](CCl)CS(=O)(=O)Nc1ccc(NC(=O)OC(C)(C)C)c(C(F)(F)F)c1 2367185043 WDHPCNCQQXHRDM-JTQLQIEISA-N 430.876 4.669 50 10 IJGE CC(C)(C)[C@@](C)(CBr)CS(=O)(=O)Cc1cccc(Br)c1 2380274632 HILMCDSYTAWUPT-HNNXBMFYSA-N 426.214 4.811 50 10 IJGE CC[C@@H](C)c1ccc(OCC(=O)NNC(=O)c2ccccc2OCCc2ccccc2)cc1 10509319 JTYOJIRGENKIDN-HXUWFJFHSA-N 446.547 4.662 50 10 IJGE CC[C@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)COc1cc(C)c(Cl)c(C)c1 10682244 PESIEJVUYRUEBC-QRWLVFNGSA-N 446.975 4.854 50 10 IJGE Cc1c(C(=O)Nc2ccc(Cl)cc2)oc2c1/C(=N/NC(=O)c1ccccc1O)CCC2 40826480 AFKOUYARMPXUIM-YZSQISJMSA-N 437.883 4.670 50 10 IJGE CCOc1ccc(NC(=O)[C@@H](C)Sc2nc3ccc(NC(=O)CCl)cc3s2)cc1 59422290 MJIJFPOMYXGDGF-GFCCVEGCSA-N 449.985 4.992 50 10 IJGE Cc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)COc2ccc(C)c(C)c2)cc1 252620868 MOANYRSGBNBHIP-UHFFFAOYSA-N 438.531 4.994 50 10 IJGE CC(=O)Nc1ccc(C(C)=NNC(=O)c2ccc(COc3ccccc3Cl)o2)cc1 252632657 VWASGXKHHQTKLJ-UHFFFAOYSA-N 425.872 4.624 50 10 IJGE CCC(=NNC(=O)c1cc(-c2ccc(OC)cc2)nc2ccccc12)c1cc(O)ccc1O 254875055 VNSMNPRHQMZMIB-UHFFFAOYSA-N 441.487 4.866 50 10 IJGE CC1(C)CN(c2ncc(Br)cc2Br)CC[C@@H]1Br 304491506 CXRJALSKGYIUAS-JTQLQIEISA-N 426.978 4.606 50 10 IJGE FC(F)(F)c1cc(Br)cc(CBr)c1I 575694568 IIYZHJKATGHWKJ-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE CC(C)(C)[Si](C)(C)OCCN1C[C@@H](S(=O)(=O)c2ccccc2)Nc2ccccc21 616582582 AMFFTVKMDLPVEG-OAQYLSRUSA-N 432.662 4.740 50 10 IJGE Cc1ccc(C)c(SCc2cccc(C(=O)NNc3ccc(S(C)(=O)=O)cc3)c2)c1 748157233 YRNKPWQOIHCWGW-UHFFFAOYSA-N 440.590 4.756 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)c(C(F)(F)F)c1 799395622 XGPCIGDCINUDCT-UHFFFAOYSA-N 429.280 4.886 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(OCC3CCOCC3)cc2)c(C(F)(F)F)c1 799402678 XMWCRWYYVOLPET-UHFFFAOYSA-N 434.418 4.531 50 10 IJGE N#Cc1ccc(NNC(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)(F)F)c(C(F)(F)F)c1 799750638 JSHIIQUXWMBHMK-OLZOCXBDSA-N 429.320 4.722 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2ccc(-c3cccc(C(C)=O)c3)o2)cc1 1084358260 BTOPIPAYZRQWRR-HSZRJFAPSA-N 434.492 4.512 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(O)cc2)CCC3)c1C 1772744457 DQZREEZQVRHFDK-UHFFFAOYSA-N 431.492 4.633 50 10 IJGE Cc1cc(Cl)ccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccco1)CCC2 1772747148 LMBWVAMJZDKPBJ-UHFFFAOYSA-N 425.872 4.866 50 10 IJGE CCCCOc1ccc(C=NNC(=O)CSc2nc3ccccc3s2)cc1OC 1772760399 IYLUDVJKNSWLJL-UHFFFAOYSA-N 429.567 4.726 50 10 IJGE N#CSc1ccc(NC(=O)Oc2ccc(CNC(=O)Cc3ccccc3F)cc2)cc1 1858912933 IOBHKKIDOBJYRY-UHFFFAOYSA-N 435.480 4.869 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc(Cl)c2)[C@@H]1c1ccc(F)cc1 1865708261 RQVIXWLMISBIPX-OAHLLOKOSA-N 434.780 4.902 50 10 IJGE COc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2cccc(Cl)c2)c1 1865711931 LPHUHDXNIHVXSI-MRXNPFEDSA-N 446.816 4.771 50 10 IJGE CN(C(=O)c1cc(Br)cc(Br)c1)C1(CBr)CCC1 1915003544 SWQURMJFHUGQAR-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE CSCC[C@@H](Cl)CCNc1ncc(I)cc1Br 2015768782 XWASQSSMRDWRKX-QMMMGPOBSA-N 449.583 4.611 50 10 IJGE C[C@]1([C@H](Br)c2cc(I)cc3c2OCC3)CC1(F)F 2036108004 GPNONSHBDMMIKK-VXGBXAGGSA-N 429.042 4.707 50 10 IJGE ClCC1(Nc2ncc(I)cc2Br)CC2(CCC2)C1 2069538570 ZXHANKMIUWDRJW-UHFFFAOYSA-N 441.538 4.802 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCCO2)C[C@@]2(C1)C[C@]2(CBr)C(F)(F)F 2083259143 GULBALNQZJCQIM-HRCADAONSA-N 428.289 4.510 50 10 IJGE CCC[C@@](C)(CCl)NC(=O)c1ccc(Br)cc1I 2086144553 BGOJLQZNQVSSJN-ZDUSSCGKSA-N 444.538 4.581 50 10 IJGE Cn1ncc(COc2c(Br)cc(Cl)cc2CCl)c1Br 2116619234 FFVCMTISDWOEAI-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE Brc1ccccc1[C@@H](CI)OC[C@@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]32 2134544366 ZOZPKGYYFDPBLG-PMMIMCCCSA-N 433.127 4.844 50 10 IJGE COCC(COC)CC(CBr)(CBr)c1ccccc1Cl 2199388904 GAIUWFGAPILPSX-UHFFFAOYSA-N 428.592 4.667 50 10 IJGE CCN[C@H](c1cc(Br)c(Br)cc1F)[C@H]1C[C@@H]1Br 2213489377 LHNJTMBAEFZNFK-AYVHFIHESA-N 429.953 4.785 50 10 IJGE Cc1sc(C(=O)N2CCC([C@H](F)CBr)CC2)c(Br)c1C 2237619133 BDVYPXCIPYNYNO-LLVKDONJSA-N 427.177 4.713 50 10 IJGE C=CC[C@@]1(CBr)CCCCN1C[C@H]1CC1(Br)Br 2250407544 WNEOFGRVWYPBKL-NEPJUHHUSA-N 430.022 4.688 50 10 IJGE CC(C)(C)OC(=O)N1CCCN(CCCCCCCBr)CC(F)(F)C1 2263162304 KFBJLEODTNHUDI-UHFFFAOYSA-N 427.374 4.910 50 10 IJGE CN(Cc1cccc(I)c1)c1ccc(CBr)cc1C#N 2280258430 SRNUOMBUKFFOHI-UHFFFAOYSA-N 441.110 4.694 50 10 IJGE C[C@H](NC(=O)c1cc(F)c(Br)cc1Cl)[C@H]1CCC[C@H]1Br 2282991168 BTHUEQNIAXFSGZ-QXFUBDJGSA-N 427.539 4.924 50 10 IJGE C[C@H](Br)[C@@H]1CCCN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285844688 PYPIJLNLYHVWQQ-DTWKUNHWSA-N 427.539 4.877 50 10 IJGE C[C@@H]1C[C@H](CBr)CCN1C(=O)c1cc(Br)c(F)cc1Cl 2285846754 RRIKBDTWMAZQBA-RKDXNWHRSA-N 427.539 4.877 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N(C[C@@H](C)Br)CC(C)(C)C 2288055053 NOLZMUIFPRELIJ-SECBINFHSA-N 447.258 4.639 50 10 IJGE ClC[C@H]1CC[C@H](NCc2ccc(I)c(Br)c2)C1 2306223860 KEYMPUOBCSFENO-ONGXEEELSA-N 428.539 4.551 50 10 IJGE CCN(CCCCCl)Cc1ccc(I)c(Br)c1 2306229339 XHQBWOVSVIBSPJ-UHFFFAOYSA-N 430.555 4.895 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2CC[C@H](Br)[C@H]2C1 2308265168 HQIVPTFJPBEFGY-BFVZDQMLSA-N 438.001 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@](C)(CBr)C(C)(C)C)CC(F)(F)C1 2327106509 NLVZERADZDWNBC-QGZVFWFLSA-N 427.374 4.622 50 10 IJGE COc1c(C)cc(C(=O)N[C@@H](CCBr)COCc2ccccc2)cc1Cl 2343411435 FPLKYZHCDOKASW-KRWDZBQOSA-N 440.765 4.757 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1I)C1(CCl)CCSCC1 2365582078 MLJHZLMCRFDTHF-UHFFFAOYSA-N 444.165 4.521 50 10 IJGE C[C@H](Cl)CN(C(=O)c1ccc(Cl)c(I)c1)C1CCCC1 2368842909 BGSXBBWBUPSOKJ-JTQLQIEISA-N 426.125 4.957 50 10 IJGE Cc1cc(Br)c(C(=O)N2CCC[C@H](Br)[C@@H]2C(F)(F)F)s1 2370262502 WOFXBGKCYMFIKD-OIBJUYFYSA-N 435.103 4.749 50 10 IJGE O=C(COc1ccc(C23CC4CC(CC(C4)C2)C3)cc1)NN=Cc1ccc([N+](=O)[O-])cc1 27496229 GJHINQUFMHRRGL-UHFFFAOYSA-N 433.508 4.592 50 10 IJGE O=C(N[C@@H](CBr)Cc1ccccc1)c1ccc(Br)cc1Cl 122472988 BHDQPHBDUQTOAQ-CYBMUJFWSA-N 431.555 4.839 50 10 IJGE O=C(CSc1nc2ccccc2[nH]1)N/N=C\c1ccc(OCCCc2ccccc2)cc1 169886250 KMWFOHHZOMJLBV-ONUIUJJFSA-N 444.560 4.817 50 10 IJGE CCCOc1ccc(/C=C\C(=O)Oc2cccc(/C=C(\C#N)C(=O)OCC)c2)cc1OC 206683859 NMJSMTKFMQGULB-HKKBLDRRSA-N 435.476 4.573 50 10 IJGE CC(=NNC(=O)c1ccc(N(C)C)cc1)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1 252612947 IXOLIFMUYKFGIG-UHFFFAOYSA-N 434.927 4.812 50 10 IJGE COc1ccc(C(=O)Oc2cccc(C=NNC(=O)COc3ccc(C(C)C)cc3)c2)cc1 254749909 UEDBIXGJBLFCAZ-UHFFFAOYSA-N 446.503 4.567 50 10 IJGE C[C@@]1(Cn2c(CCl)nc3cc(Br)cnc32)CCCN1Cc1ccccc1 398128413 ZSOTZHRKEXXVGQ-FQEVSTJZSA-N 433.781 4.987 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)c1ccccc1SCc1cn2ccccc2n1 748219330 FMROMZIXHPOIFQ-UHFFFAOYSA-N 428.439 4.801 50 10 IJGE O=C(NNC(=O)C1CCC(C(F)(F)F)CC1)c1ccccc1OCc1ccc(F)cc1 766343542 XOWOSZZQRRHWSP-UHFFFAOYSA-N 438.421 4.534 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2cc(C)n(-c3ccccc3C(=O)OC(C)C)c2C)cc1 1084605706 GRQDMPUYTHTTLW-UHFFFAOYSA-N 447.535 4.822 50 10 IJGE C#C[C@H]1CCCCN1C(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Br)cc2)c1C 1134915946 QQHJBIHASHIUMU-PHJXOXRPSA-N 436.353 4.778 50 10 IJGE COc1cc(C=NNC(=O)COc2cccc(C)c2C)ccc1OCc1ccccc1C 1772753592 QXZRNUMQBOJAIL-UHFFFAOYSA-N 432.520 4.729 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1cccc(OC)c1)C(C#N)=C(N)O2 1865711721 GPVAPJHKZQZBRR-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)/C=C/c1cccs1 1865759241 PNTRBZHJYGPOLF-WEVVVXLNSA-N 432.332 4.900 50 10 IJGE CC(C)(C)OC(=O)N(C(=O)/C(C#N)=C/c1ccccc1)[C@@H](CN)c1cccc(Cl)c1 1868112719 AXMBXFRPRLCSGE-YWFITGJYSA-N 425.916 4.711 50 10 IJGE C[C@@H]1c2[nH]cnc2CCN1c1cc(Nc2ccc(SC#N)cc2)nc(-c2cccnc2)n1 1868564650 CWLBIOSTYPWBFV-OAHLLOKOSA-N 440.536 4.702 50 10 IJGE COc1ccc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc1OCc1ccc(Cl)cc1 1873498406 KFLNOBADAXOUDA-ZMOGYAJESA-N 439.855 4.600 50 10 IJGE CN(CC1CN(C(=O)OCc2ccccc2)C1)C[C@](C)(CBr)C(C)(C)C 1904846774 YWHIYUAJBXZYSB-NRFANRHFSA-N 425.411 4.634 50 10 IJGE Fc1cc(Br)c2nc(CCCl)n(C[C@H]3CCN3Cc3ccccc3)c2c1 1912674073 JFJGVBJYMUOIKJ-MRXNPFEDSA-N 436.756 4.994 50 10 IJGE Cc1ccnc(C(=O)N(CCCBr)Cc2ccccc2)c1Br 1927122525 PTMBKGVWPWUMSL-UHFFFAOYSA-N 426.152 4.580 50 10 IJGE Brc1cc([C@H](Br)[C@@H]2[C@H]3CCOC[C@@H]32)c(Br)s1 1937556895 BMPRUVOYPXQRCN-ZAQCRPJCSA-N 430.987 4.992 50 10 IJGE Brc1cccc(Br)c1CN1C[C@@H](Br)[C@H](C2CC2)C1 2033087226 USCNBLIFYLWOSM-IINYFYTJSA-N 438.001 4.817 50 10 IJGE O=C(CBr)c1cc(OC(F)(F)F)cc(Br)c1C(F)(F)F 2054797806 KBKVNHAEPNQGPQ-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE Br[C@H](c1ccc2c(c1)CCCO2)c1cc(I)sn1 2056487281 JMQIOOPNMIANGV-CYBMUJFWSA-N 436.112 4.557 50 10 IJGE CN(CCCCCCCCCBr)CCN1CCN(C(=O)OC(C)(C)C)CC1 2163057993 GYPXPUKKHKZQFM-UHFFFAOYSA-N 448.490 4.597 50 10 IJGE CN(Cc1ccccc1CNC(=O)[C@@H](Br)C1CCCC1)C(=O)OC(C)(C)C 2167047663 KJJVYAYVVUTUHE-SFHVURJKSA-N 439.394 4.623 50 10 IJGE CC(C)(C)[C@H]1[C@H](Cl)CCN1C(=O)c1ccc(I)c(Cl)c1 2185112938 GBBJPUXADIONGQ-ZWNOBZJWSA-N 426.125 4.813 50 10 IJGE COC[C@]1([C@H](Br)c2cc(Br)cc(Cl)c2OC)CCCO1 2203013818 YPAXLEHDGZYSBL-KGLIPLIRSA-N 428.548 4.743 50 10 IJGE CCCO[C@H]1[C@@H](Oc2cc(I)ccc2Cl)C[C@H]1Br 2259921224 OHKRVWQKOJCBFU-JIMOISOXSA-N 445.522 4.654 50 10 IJGE O=C(NC[C@H](Br)CC(F)(F)F)c1cc(F)c(Br)cc1Cl 2282982421 DLNVUWJEIGFLLB-RXMQYKEDSA-N 441.444 4.687 50 10 IJGE COc1cccc(NC=C(C#N)c2nc(-c3cc4cc([N+](=O)[O-])ccc4oc3=O)cs2)c1 2295891384 NURRBFUDZVPPBF-UHFFFAOYSA-N 446.444 4.810 50 10 IJGE CC(C)[C@H](Cl)CN(C)Cc1ccc(I)c(Br)c1 2306229428 WSWTVCMDHDJWNQ-GFCCVEGCSA-N 430.555 4.749 50 10 IJGE C=CCc1cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)cc(OCC)c1OCC(=O)OCC 2313571503 XWJKHWRVIOCQRB-UHFFFAOYSA-N 448.519 4.610 50 10 IJGE Br[C@H]1CCC2(CCN(Cc3sccc3I)CC2)C1 2316756811 APJNNTUZWPJFIX-NSHDSACASA-N 440.188 4.882 50 10 IJGE C=CC[C@@]1(CBr)CCCN(Cc2sccc2I)C1 2316760145 QYRCYUQMBKQBLL-AWEZNQCLSA-N 440.188 4.906 50 10 IJGE Cc1c(F)ccc(CO[C@H](CCl)[C@H](I)CCl)c1Cl 2317183799 NJJQHVKSGAFZQB-GHMZBOCLSA-N 425.496 4.954 50 10 IJGE COC[C@@]1(C)C[C@@]1(CBr)Cc1ccc(Cl)cc1I 2318546614 UPFDGTDFYPRGCK-ZIAGYGMSSA-N 443.550 4.925 50 10 IJGE CC(C)N(CC1CCN(C(=O)OC(C)(C)C)CC1)C[C@@]1(CBr)CC1(F)F 2351888816 LBOUVSNKLDLYFJ-SFHVURJKSA-N 439.385 4.764 50 10 IJGE CC(C)c1ccc(O[C@H](C)C(=O)NNC(=O)c2ccccc2OCc2ccccc2)cc1 14040298 DZYHZPMLKADAJW-LJQANCHMSA-N 432.520 4.618 50 10 IJGE Cc1ncc(Cn2c([C@H](C)Cl)nc3cc(I)c(F)cc32)s1 97408891 UEAMCQDDJHJUIL-ZETCQYMHSA-N 435.693 4.893 50 10 IJGE Cc1ccsc1CN(Cc1ccccc1)C(=O)CN(C(=O)C(Cl)Cl)C(C)C 98017116 MTVSOTIAKDLZCV-UHFFFAOYSA-N 427.397 4.626 50 10 IJGE O=C(NC[C@@H]1CCC[C@H]1Br)c1cc(Br)ccc1Br 161223371 ITBFFJIRVKLPNX-GZMMTYOYSA-N 439.973 4.505 50 10 IJGE CC[C@H](CCBr)NC(=O)c1cc(Br)ccc1Br 161241428 VWUQHHRGPADHNQ-SECBINFHSA-N 427.962 4.505 50 10 IJGE CCCCCOc1ccc(/C=N\NC(=O)Cc2ccc3nc(N)sc3c2)cc1OCC 169917165 HGMYSCULYCVENU-MYYYXRDXSA-N 440.569 4.539 50 10 IJGE COc1ccc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccccc4)nc3c2)cc1OC(C)C 169925818 DYEZLCDSGAOCSB-YUMHPJSZSA-N 442.519 4.713 50 10 IJGE CC(=NNC(=O)c1ccc(Br)o1)c1cccc(NC(=O)c2ccc(C)cc2)c1 252595303 BZFXPOQRSFVWBK-UHFFFAOYSA-N 440.297 4.757 50 10 IJGE COc1cc(OC)cc(C(=O)NN=C(C)CC(=O)Nc2ccccc2-c2ccccc2)c1 254671452 UNVXOXVRJNBURG-UHFFFAOYSA-N 431.492 4.505 50 10 IJGE FC(F)Oc1c(Br)cc(I)cc1CBr 575682704 ZKFAJRQRZYDFFQ-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE BrCC(CBr)(c1cccc(Br)c1)[C@H]1CCCO1 686741283 VMOAIUZSLYUCLN-GFCCVEGCSA-N 426.974 4.656 50 10 IJGE CC(C)S(=O)(=O)CCCOc1c(Br)cc(Cl)cc1CBr 708071709 BWQFMWDDXZLBFE-UHFFFAOYSA-N 448.604 4.590 50 10 IJGE CC(C)Oc1ccc(C(=O)N/N=C2\C(=O)N(Cc3ccccc3Cl)c3ccccc32)cc1 1860822757 LZKGXZDMLGLMSS-VYIQYICTSA-N 447.922 4.808 50 10 IJGE CCCc1nn(-c2ccc(OC)cc2)c2c1[C@@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 1865682331 MCVFHHRNSRBNIO-LJQANCHMSA-N 438.890 4.844 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@@H]1c1ccc(F)cc1 1865708215 QSAMRUYIXJHGOF-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE C[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)C1 1881538923 FOAUZGZZQFOFMK-KBUPBQIOSA-N 435.403 4.604 50 10 IJGE CC[C@H]1CN(Cc2ccc(Br)cc2Br)C[C@H]1Br 1943856852 BYWYVCBKQBPXNR-TVQRCGJNSA-N 425.990 4.817 50 10 IJGE CC[C@@H](NC(=O)c1cccc(Br)c1Br)[C@@H](C)Br 1943907975 XVZKVUHZRNZZDD-GMSGAONNSA-N 427.962 4.503 50 10 IJGE CCCOCCCO[C@H](CI)c1cccc(Br)c1 2031753729 BZWLIIABXCUKKP-CQSZACIVSA-N 427.120 4.759 50 10 IJGE Brc1cccc(Br)c1CN1C[C@@H]2CC[C@H](C1)C2Br 2048820729 MQLMJACAAQYLFS-XFLKPENQSA-N 438.001 4.817 50 10 IJGE COCCCCO[C@](C)(CI)c1ccccc1Br 2067245427 SBJQVUKJCMMRCI-CQSZACIVSA-N 427.120 4.543 50 10 IJGE CC(C)N(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2110714120 ANVSGBFTPKKSBO-DLBZAZTESA-N 431.415 4.577 50 10 IJGE COC[C@@H](C)CCO[C@](C)(CI)c1ccccc1Br 2130878671 FEYWDMFKEBUOMO-SWLSCSKDSA-N 441.147 4.789 50 10 IJGE CCN(c1ccc([N+](=O)[O-])c(CBr)c1)C1CCN(Cc2ccccc2)CC1 2143594949 RHPFYMOWFFGYNZ-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE O=C(c1cc(Br)ccc1Cl)N1CC[C@@H](Br)C(F)(F)CC1 2150019308 QPIVKLLNGWEFIS-LLVKDONJSA-N 431.502 4.737 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@H]2OCCN(C(=O)OC(C)(C)C)[C@@H]2C1 2163061906 IQWNKIOYEDSDNN-QZTJIDSGSA-N 447.458 4.678 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@H](CBr)CC2CC2)C[C@H]1c1ccccc1 2169173700 LNYCDXGVVVEQEZ-YSIASYRMSA-N 437.422 4.790 50 10 IJGE CNc1ccc([N+](=O)[O-])c(NCCSSCCNC(=O)OC(C)(C)C)c1Cl 2181742818 GWKSQSUXATUBBR-UHFFFAOYSA-N 436.987 4.608 50 10 IJGE FC(F)C1CC([C@@H](Br)c2cc(I)cc3c2OCC3)C1 2232338868 RDVWMHOFZFGELN-SHVIVCPWSA-N 443.069 4.953 50 10 IJGE CC(C)(C)OC(=O)NCCCN(CCCCI)c1ccccc1 2243585333 ACJZASUEFQMUHV-UHFFFAOYSA-N 432.346 4.623 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@H](CBr)C(C)(C)C)[C@@H](C(F)(F)F)C1 2266272047 JXKBBDFTBUTAJS-BFHYXJOUSA-N 445.364 4.964 50 10 IJGE CC(C)(C)[C@@H](CCCl)NC(=O)Cc1cc(Br)cc(Br)c1 2295314938 FKTMYMPMZGESSI-CYBMUJFWSA-N 425.592 4.914 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C1(C)C 2297077791 AARLRZZRWDBISQ-YJNKXOJESA-N 447.414 4.556 50 10 IJGE CC[C@@H]1CN(Cc2ccc(Cl)cc2I)C[C@@H]1Br 2302327127 WINVVLQEIVGGIC-SKDRFNHKSA-N 428.539 4.550 50 10 IJGE O=S1(=O)C[C@H]2[C@@H](C1)[C@@H]2[C@H](Cl)c1ccc(OCc2ccccc2)cc1Br 2314442393 BGFRUXVTGLZILK-KCITZHQASA-N 441.774 4.599 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=C3C(=O)N([C@@H](C)CC)C(=O)C(C#N)=C3C)o2)cc1 2314610474 ISWGCTDWMRYHAF-HNNXBMFYSA-N 432.476 4.514 50 10 IJGE Clc1ccc(I)cc1CN1CCC2CC1(CBr)C2 2327396287 AGZYIPFKXAHANP-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE ClC[C@@]1(Cc2ccc(I)c(Br)c2)O[C@H]2CC[C@H]1C2 2327563691 FVZQMNCFCCOGTN-COPLHBTASA-N 441.534 4.773 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)C(C#N)=Cc1ccc(Br)cc1 2329662126 OGKSZGOTWUCAKT-UHFFFAOYSA-N 427.298 4.952 50 10 IJGE FC(F)(CI)C(F)(F)CNCc1c(Cl)cccc1Cl 2336532757 XHACHTIBPYYHRZ-UHFFFAOYSA-N 430.010 4.789 50 10 IJGE CS(=O)(=O)c1ccc([C@@H](Cl)c2sc(Cl)cc2I)cc1 2338562417 BROHTCGEMMEUFZ-LLVKDONJSA-N 447.146 4.738 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(C[C@H](CBr)c2ccccc2)CC1 2340134870 LGXPALFXWCJXQH-RBUKOAKNSA-N 425.411 4.887 50 10 IJGE N#CC1=C2N=C(N)c3ccccc3N2C2=C(C(=O)C[C@@H](c3ccccc3)C2)[C@H]1c1cccnc1 9590750 GLSSQZYFICLYKJ-DFBJGRDBSA-N 443.510 4.540 50 10 IJGE CCOc1cccc(-c2nn(-c3ccccc3)cc2/C=C(\C#N)C(=O)N2CCCCC2)c1 35446450 KODRSIBAFPGMSH-LTGZKZEYSA-N 426.520 4.857 50 10 IJGE Cc1cccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(F)c2)c1C 38678218 WIPSHVQDCRQJAR-VWLOTQADSA-N 444.462 4.645 50 10 IJGE O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)c1[nH]c(-c2ccccc2)cc1-c1ccccc1 59449441 MHPDQVOHJXHHQG-MFKUBSTISA-N 426.432 4.726 50 10 IJGE Cc1cc([C@H](Br)c2ccc(S(C)(=O)=O)cc2)c(C)cc1Br 70472212 SCILKHKTHMBUAO-MRXNPFEDSA-N 432.177 4.954 50 10 IJGE O=C(NC[C@H]1CCC[C@@H]1Br)c1ccc(Br)cc1Br 232462247 DTCNKDCCAWKDNG-KCJUWKMLSA-N 439.973 4.505 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)CSc2cc(C)nc3c(C)cccc23)c(O)c1 252600437 DRIMBFVGDWORDH-UHFFFAOYSA-N 436.581 4.646 50 10 IJGE CC[C@@H]1CN(C(=O)c2cc(Br)sc2Br)C[C@@H]1Br 400008743 MVSDFKKDXUOHRT-SVRRBLITSA-N 446.002 4.519 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CCCC[C@@H]3c3noc(C)n3)c2C)c1 737622452 GMQBGRHQBKWGCD-LJJBLSSYSA-N 429.524 4.755 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 741285290 YXMARVWHBPOSFY-NWDGAFQWSA-N 449.307 4.759 50 10 IJGE O=C(NNc1ccc(Br)cc1F)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 748191383 MATHMSGTERGVHH-RYUDHWBXSA-N 433.199 4.734 50 10 IJGE COc1ccc(C(=O)NNC(=O)Nc2ccc(S(F)(F)(F)(F)F)cc2)c(OC)c1 752972245 JWQQJRJWTSFXML-UHFFFAOYSA-N 441.378 4.828 50 10 IJGE O=C(NCCOc1ccc(F)cc1F)C(=O)Nc1ccc(S(F)(F)(F)(F)F)cc1 773235604 HAGLDMXLMDYPTD-UHFFFAOYSA-N 446.344 4.756 50 10 IJGE COc1ccc(Br)cc1C=NNC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 1083894240 PGMZQKWOXBFBIT-JTQLQIEISA-N 446.128 4.682 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2cc(C)n(-c3cccc(F)c3)c2C)cc1 1084584557 CQJRNGOBYMLQRL-XMMPIXPASA-N 437.515 4.596 50 10 IJGE C=CCCC[C@@H](C)NC(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1 1230814529 GMNNABKPBWSSIA-QGZVFWFLSA-N 429.948 4.916 50 10 IJGE C#CC[C@@H](CCOC)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1587382703 LPKFYELHIPEWAN-YMFQVDJJSA-N 443.469 4.565 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2cnc(-c3c(Cl)cccc3Cl)s2)c1 1637299018 FUYABUFRGFXDGV-UHFFFAOYSA-N 447.372 4.730 50 10 IJGE C=CCOc1ccc(Br)cc1NC(=O)NNC(=O)c1ccc2ccccc2c1 1672708830 UANJACNJQACSBK-UHFFFAOYSA-N 440.297 4.634 50 10 IJGE Cc1c(C(=O)Oc2cccc3cccnc23)oc2c1C(=NNC(=O)c1ccccc1)CCC2 1772745046 QIGFDNMOMZIAAJ-UHFFFAOYSA-N 439.471 4.826 50 10 IJGE O=C(CSc1nc(-c2ccccc2)cs1)NN=Cc1cc(Br)ccc1O 1772754985 DZZHRBGGSVVAFC-UHFFFAOYSA-N 448.367 4.521 50 10 IJGE CCCCCCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OC)c(OC)c2)cc1 1866130152 DABBDORZSLMRLS-HMMYKYKNSA-N 436.508 4.987 50 10 IJGE COc1ccc(Br)cc1C(=O)N(Cc1ccccc1)C[C@H](C)Br 1914609096 CYTJJNITUOZFBD-ZDUSSCGKSA-N 441.163 4.884 50 10 IJGE CC(C)CN(CCBr)C(=O)c1cc(Br)sc1Br 1948647883 FEQSPJZIPKAHED-UHFFFAOYSA-N 448.018 4.766 50 10 IJGE Clc1cc(CN2CCC[C@H](Br)CC2)ccc1I 2026566865 NJRWZAAWDQFFHD-NSHDSACASA-N 428.539 4.694 50 10 IJGE C[C@@](CCl)(NC(=O)c1cc(Br)c(Br)s1)C(F)(F)F 2043176413 KMXYQYTTZRMDHO-QMMMGPOBSA-N 429.483 4.563 50 10 IJGE CCC[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)CC[C@H]1C(F)(F)F 2044698486 CAOIQAALQZCWAO-KBPBESRZSA-N 431.337 4.671 50 10 IJGE Cc1c(F)cnc(-n2nc(CBr)c(Br)c2C(F)(F)F)c1F 2078914018 TYKWZCKCEDMQNR-UHFFFAOYSA-N 434.988 4.530 50 10 IJGE C[C@@H]1CCN(C[C@H](CBr)c2ccccc2)C[C@@H]1CNC(=O)OC(C)(C)C 2106781274 GMWNAHXLIDOQOZ-NEWSRXKRSA-N 425.411 4.648 50 10 IJGE Cc1cc(Br)c(CCl)c(N2C[C@H]3[C@@H](C2)OCCN3Cc2ccccc2)c1 2116805419 GVKIHBZMWBHGNL-LEWJYISDSA-N 435.793 4.586 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]([S@@](C)(=O)=NCc2ccc(CBr)cc2)C1 2126472898 ZQAKZXBGIXQXJK-WGDIFIGCSA-N 445.423 4.579 50 10 IJGE C[C@H](CCCCCBr)NS(=O)(=O)c1ccc(Cl)c(Br)c1 2174530668 SVFRTJJWKBCMKR-SNVBAGLBSA-N 447.620 4.725 50 10 IJGE CC1(C)CCCN(C(=O)c2cc(Cl)ccc2I)[C@H]1CCl 2185813059 UADBOAPOYGXPQU-ZDUSSCGKSA-N 426.125 4.814 50 10 IJGE Oc1nc(C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)nc(C2CC2)c1CBr 2187326639 VDVRVSLWNVAUDB-AYHJJNSGSA-N 428.374 4.865 50 10 IJGE CC(C)(C)OC(=O)NCCN(CCCCCI)Cc1ccccc1 2208929407 YVEHLTPGQZTBHV-UHFFFAOYSA-N 446.373 4.619 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1sc(C)c(Br)c1C 2226086654 RYIMONCTWRIHQU-SNVBAGLBSA-N 429.243 4.764 50 10 IJGE Cc1sc(C(=O)N2C[C@@]3(CBr)CCC[C@]3(F)C2)cc1Br 2234472767 YFJKFHYNYIYUHI-KBPBESRZSA-N 425.161 4.548 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CCC[C@H](OC)C2)cc1I 2269536277 YNZWCLBEBANWIB-ITDIGPHOSA-N 439.131 4.941 50 10 IJGE C[C@@H](NCc1ccc(I)c(Br)c1)C1(CCl)CC1 2306220339 WREOMZQBQPPANC-SECBINFHSA-N 428.539 4.551 50 10 IJGE Clc1ccc(CN2CC[C@]23C[C@@H](CBr)C3)cc1I 2315546774 LURZYYKRBQHJGX-YEORSEQZSA-N 440.550 4.694 50 10 IJGE CC(C)N(C[C@H](C)Br)C(=O)c1ccc(Cl)cc1I 2317769964 AWTIBDBSEZOCJG-VIFPVBQESA-N 444.538 4.579 50 10 IJGE CC[C@@H](Cl)c1cnn(Cc2ccc(I)c(Br)c2)c1 2325174574 FVDUZVDDJFRPJH-GFCCVEGCSA-N 439.522 4.988 50 10 IJGE C[C@H]1C[C@@H](CCl)CN(Cc2ccc(I)c(Br)c2)C1 2325206299 DBWYRXUTPLEYAZ-JQWIXIFHSA-N 442.566 4.751 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3CC[C@H]2[C@H](Br)C3)c1 2325604705 GCIJJCBVXIXSQO-BHYNMZESSA-N 440.550 4.692 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@@H]1CCCC[C@H]1C(F)(F)F 2343414957 VPBLMEYKWDLHQP-BRWVUGGUSA-N 436.312 4.842 50 10 IJGE COc1cccc(C=NNC(=O)CSc2nc3ccccc3n2Cc2ccc(C)cc2)c1 28351029 DQIJRSDHNAJQOG-UHFFFAOYSA-N 444.560 4.644 50 10 IJGE COc1ccc(CNC(=O)/C(C#N)=C\Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1 216985851 WHBWSMRGQVMBBW-QBFSEMIESA-N 443.347 4.869 50 10 IJGE C[C@H]1CCC[C@](CCl)(NC(=O)c2ccc(I)c(Cl)c2)C1 232348703 JHBBEBXCRWFTAP-BONVTDFDSA-N 426.125 4.862 50 10 IJGE CCOc1cc(C=NNC(=O)CCc2ccccc2)ccc1OC(=O)/C=C\c1ccccc1 252622037 NNGHGWOWEJEUPC-QVWVRNGZSA-N 442.515 4.787 50 10 IJGE Cc1ccc(N=Nc2ccc(O)c(C=NNC(=O)COc3ccccc3[N+](=O)[O-])c2)cc1C 254818959 GPIRTMAWQUWQGR-UHFFFAOYSA-N 447.451 4.862 50 10 IJGE O=S(=O)(c1cc(CCl)c(Cl)cc1Cl)N1CC[C@@H](COCc2ccccc2)C1 384061329 YWXYSHYBNRYJKI-OAHLLOKOSA-N 448.799 4.960 50 10 IJGE Cn1cc([C@H](Br)c2cc(F)c(Br)cc2F)nc1Br 698431911 DKAZZAQSUPZTOE-SNVBAGLBSA-N 444.899 4.708 50 10 IJGE C[C@H](CCCBr)CNC(=O)c1scc(Br)c1Br 705428196 RZCOZKRAZMHBCV-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE O=C(N[C@@H](CCl)CC(F)(F)F)c1cc(Br)sc1Br 717822927 BFIABMLVBFCAEF-SCSAIBSYSA-N 429.483 4.563 50 10 IJGE C[C@H](O[C@@](C)(CI)CNC(=O)OC(C)(C)C)C1CCCCC1 719737158 PYLMBVDLSRSLJB-GUYCJALGSA-N 425.351 4.690 50 10 IJGE O=C(NNc1nc(O)c2ccccc2n1)c1cnc(Nc2ccc(Cl)cc2)c(Cl)c1 792378815 DQJVQLBEYBXMFQ-UHFFFAOYSA-N 441.278 4.538 50 10 IJGE COc1c(N=Cc2ccccc2O)cccc1P(=O)(c1ccccc1)c1ccccc1 1084039036 ZPUODFLYJBETPJ-UHFFFAOYSA-N 427.440 4.791 50 10 IJGE C=CCC[C@@H](CO)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1449422469 IIZDBWJTUZOUEY-RLGUWMIQSA-N 432.351 4.751 50 10 IJGE C=C(CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1c1cccc(Cl)c1 1460009551 SMLNQGGLHZFLSQ-QGZVFWFLSA-N 429.786 4.885 50 10 IJGE C#CCCCC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)C[C@H](C)C2 1558513249 PRKYRPALKOKPIL-HMNTXPNISA-N 427.504 4.515 50 10 IJGE C=CCn1c(SCC(=O)NNc2ccc(Cl)cc2C)nnc1-c1ccc(Cl)cc1 1644396951 UBGLCCOORRMLAN-UHFFFAOYSA-N 448.379 4.982 50 10 IJGE CC(=O)c1ccc(Br)c(NC(=O)NNc2ccc(F)cc2Br)c1 1674419130 UPFKDQWTDBXQOF-UHFFFAOYSA-N 445.086 4.702 50 10 IJGE C=CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2CC(C)C 1865691536 VANRDIVAVGNDKO-JOCHJYFZSA-N 426.520 4.989 50 10 IJGE C[C@@H]1C[C@H]1CCCO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1896107849 DVXRJLHQRJZUOL-RKVPGOIHSA-N 437.362 4.644 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)CCc1c(Cl)cccc1Cl 1905342477 JJGYNLFUVWKNQX-NSHDSACASA-N 427.125 4.986 50 10 IJGE O=C(N[C@@H](CCBr)C1CC1)c1csc(Br)c1Br 1945188989 GFUYKLAXJPPPQP-QMMMGPOBSA-N 446.002 4.567 50 10 IJGE CC[C@H]1CN(Cc2c(Br)cccc2Br)C[C@@H]1Br 1945324147 WFOBAURDAXMIKZ-ZANVPECISA-N 425.990 4.817 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN1C(=O)c1cc(Br)sc1Br 1950506984 FGUAAPKYJRJPSM-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(O)c(Br)c1 1961198452 FIKAZCMEYFFNBH-LBPRGKRZSA-N 427.136 4.581 50 10 IJGE CCN(C[C@@](C)(CI)O[C@@H]1CCCC1(F)F)C(=O)OC(C)(C)C 1991616947 QFSCVHVGCIUVSM-IUODEOHRSA-N 447.304 4.642 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](O[C@@H]2CCC[C@@H]3CCCC[C@H]32)C1 2022999281 SXDJZCXEBNAURT-DMRKSPOLSA-N 449.373 4.785 50 10 IJGE CC(C)(C)N(CCBr)Cc1ccc(I)c(Cl)c1 2026566859 NIPHQNAXWFDZQM-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE CCC[C@H](CCBr)NCc1ccc(I)c(Cl)c1 2026567007 OLILYJAAFYDQNM-LLVKDONJSA-N 430.555 4.988 50 10 IJGE Cc1cc(-n2nc(CBr)c(Br)c2C(F)(F)F)cnc1Cl 2078913812 QMUZIJVPMYMIMB-UHFFFAOYSA-N 433.453 4.905 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(C[C@H](CBr)C(C)(C)C)C[C@@H]21 2106785795 QWVPMCSNFXQLGD-ICUGJSFKSA-N 429.443 4.621 50 10 IJGE CCC1(NC(=O)OC(C)(C)C)CCN(C[C@@H](CBr)c2ccccc2)CC1 2106785823 RBGQJSXUBOELTN-GOSISDBHSA-N 425.411 4.934 50 10 IJGE C[C@@H]1CN(C[C@@H](CBr)c2ccccc2)C(C)(C)CN1C(=O)OC(C)(C)C 2106786375 USIJPYPNWIVTKT-SJLPKXTDSA-N 425.411 4.885 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1Cc2ccccc2N(C[C@@H](CBr)C(C)(C)C)C1 2106787900 LIZLYIJSSFJWPM-SJORKVTESA-N 425.411 5.000 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1[C@H](CCl)C[C@H]2CCC[C@@H]21 2108400130 UJDMSSALWMHSMP-WEDXCCLWSA-N 427.589 4.895 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Cl)c1nn(C)cc1Br 2138239870 FVULFQGANNIZIW-JTQLQIEISA-N 428.939 4.935 50 10 IJGE C[C@]1(CBr)CC(F)(F)CN1C(=O)c1ccc(Cl)c(Br)c1 2159051519 YZPXQXZDADZZBX-GFCCVEGCSA-N 431.502 4.737 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2cc(Cl)ccc2I)C[C@@H]1CCl 2163290392 XTZFSSRYSOXXGS-GXSJLCMTSA-N 438.058 4.794 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@@]2(CBr)CCC[C@]2(F)C1 2176641186 SAECQLNAIZSIRZ-STQMWFEESA-N 445.579 4.893 50 10 IJGE ICCCCCN1CCC[C@@H]1[C@@H]1CCN(Cc2ccccc2)C1 2211187444 UGZBBZUIFXJYKC-WOJBJXKFSA-N 426.386 4.578 50 10 IJGE Fc1cc(F)c2nc(CCCl)n(C[C@@H]3CC3(Br)Br)c2c1 2233040187 ODIBRTWNMNLRJZ-ZETCQYMHSA-N 428.502 4.602 50 10 IJGE CO[C@@H](CSC)Cn1c(CCl)nc2cc(Br)c(Br)cc21 2234171099 JKFSUUXGYVTSPY-MRVPVSSYSA-N 442.604 4.678 50 10 IJGE CC(C)([C@@H](Cl)c1c(F)cc(Br)c(F)c1Br)S(C)(=O)=O 2272854564 QPOSKMHEXARFCL-JTQLQIEISA-N 440.531 4.593 50 10 IJGE Clc1ccc(I)cc1CN1CCC[C@H](CBr)C1 2307325401 YUSTZMDBQJAOQL-SNVBAGLBSA-N 428.539 4.552 50 10 IJGE Cc1cccc(C[C@H](Br)c2c(Br)c(Br)nn2C)c1 2316833778 GNZKMALLVXOJAP-JTQLQIEISA-N 436.973 4.932 50 10 IJGE Clc1ccc(CN2CC[C@@H](CBr)C23CC3)c(I)c1 2318538305 IJBULOWRJAHHIF-NSHDSACASA-N 440.550 4.694 50 10 IJGE N#CC(=Cc1ccccc1)C(=O)N=c1nc2scc(-c3ccc(Cl)cc3Cl)n2[nH]1 2321973028 FLOOIRZNHPQWHI-UHFFFAOYSA-N 440.315 4.732 50 10 IJGE CC(C)(C)OC(=O)Nc1cnn2c1N(C[C@](C)(CBr)C(C)(C)C)CCC2 2352107781 QMKNAMSZMZJZGA-IBGZPJMESA-N 429.403 4.888 50 10 IJGE CC[C@@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C)c(C)c1 10153693 RRKFUUNEEZNTSM-ZWDAVXSWSA-N 426.557 4.589 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(C(=O)NNC(=O)c3cc(Cl)cc(Cl)c3)cc2)c1 10384328 GOYKTPPNJGDZBC-UHFFFAOYSA-N 442.302 4.629 50 10 IJGE CCCCCOc1ccccc1C(=O)NC(=S)NNC(=O)c1ccc(C(C)(C)C)cc1 14036233 ZSNZYHPIUDINJS-UHFFFAOYSA-N 441.597 4.502 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=O)c2cccc(OCCOc3ccccc3)c2)cc1 14040930 WZCHIYAWZZJLSV-UHFFFAOYSA-N 432.520 4.517 50 10 IJGE CCCCCCOc1ccc(Br)cc1C(=O)NNC(=O)c1ccc(C)cc1 14648261 HSFIDIKQVKZVKM-UHFFFAOYSA-N 433.346 4.791 50 10 IJGE COc1cccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(C)cc2)CCC3)c1 40804541 IIGISIWSIXOYBD-NHFJDJAPSA-N 431.492 4.628 50 10 IJGE O=C(N/N=C1/C(=O)N(Cc2ccccc2F)c2ccccc21)c1ccc(Cl)cc1Cl 59166190 WBYFFKLJBZROEI-LHLOQNFPSA-N 442.277 4.813 50 10 IJGE CC(C)(C)S(=O)(=O)CC[C@H](CBr)Cc1ccc(Br)cc1 232677470 MHROFIYWMDAHMZ-ZDUSSCGKSA-N 426.214 4.606 50 10 IJGE CCCCCCCCCCCCCC(=O)NCC(=O)NN=Cc1ccc([N+](=O)[O-])cc1 254490047 CXMXGXOJPPBYEX-UHFFFAOYSA-N 432.565 4.862 50 10 IJGE Cc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CCl)cc1I 382702424 PKJFIBOOAWTCCL-KBPBESRZSA-N 435.733 4.789 50 10 IJGE C[C@@H]1OCC[C@]1(CBr)Cc1cc(Cl)ccc1I 405501594 CDCXTNSBVZFQLL-TVQRCGJNSA-N 429.523 4.677 50 10 IJGE Fc1cc2c(cc1Br)nc(CCl)n2Cc1ncc(Br)s1 714926090 JTYGYDMAXKEPLM-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H](C)c3nc(C)cs3)c3ccccc3n2)cc1 727942281 BHISBNNQELZTSI-MRXNPFEDSA-N 445.548 4.680 50 10 IJGE O=C(NNC(=O)[C@H](Oc1ccc(F)cc1Cl)c1ccccc1)c1cccc2cccnc12 730541244 SSFCHJILNQGQAP-JOCHJYFZSA-N 449.869 4.609 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)OCc2nc(C(C)(C)C)cs2)c(C)n1C[C@@H]1CCCO1 756353580 UXUWWDNFDZYHSU-UDKWZTAFSA-N 427.570 4.688 50 10 IJGE O=C(NN=Cc1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(NC(=O)C2CCCCC2)cc1 1084462721 JWKKLAPRCWCPGD-UHFFFAOYSA-N 428.876 4.531 50 10 IJGE COCCn1c(C)cc(/C=C(/C#N)c2nnc(-c3ccc(Br)cc3)o2)c1C 1322140230 KXWLUNOICYGFDS-BOPFTXTBSA-N 427.302 4.628 50 10 IJGE CCN(CC)[C@@H](C(=O)NNc1nc2ccccc2[nH]c1=S)c1cccc(C(F)(F)F)c1 1585173372 CDKQDIXKCRMHTL-QGZVFWFLSA-N 449.502 4.837 50 10 IJGE CCc1nn(Cc2cc(C)ccc2C)c2c1[C@@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689366 QSKARSOEOFSUGG-NRFANRHFSA-N 434.927 4.688 50 10 IJGE CCCc1nn(-c2ccccc2)c2c1[C@@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865702369 UHWKGSAWXFRANM-QHCPKHFHSA-N 427.552 4.889 50 10 IJGE COc1ccc(C/C(O)=C(\C#N)c2nc(-c3ccc(OC)c(OC)c3)cs2)cc1OC 1872745347 IWIJMCACSPLMLE-VLGSPTGOSA-N 438.505 4.880 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CN(C(=O)OC(C)(C)C)C2(CCCC2)C1 1882088795 UNMYYNUNGLUOSE-CABCVRRESA-N 447.414 4.844 50 10 IJGE C[C@@H](c1cc(F)ccc1Br)[C@@H](CBr)NC(=O)OC(C)(C)C 1885094166 SLRVEVTZSCDBNW-TVQRCGJNSA-N 425.136 4.980 50 10 IJGE CCN[C@@H](c1sc(Cl)cc1I)C1CC(Br)C1 1901028277 JOFBCJJODIZDTH-HNQUHTCLSA-N 434.568 4.830 50 10 IJGE COc1nc(N(Cc2ccccc2)[C@H](CBr)C(C)C)ncc1Br 1915308715 PAWLBDCCQKLAOF-OAHLLOKOSA-N 443.183 4.674 50 10 IJGE CCCOc1c(Br)cc(CNN(C)C(=O)OCc2ccccc2)cc1OC 1941873306 QEIQWXQZVHJXNB-UHFFFAOYSA-N 437.334 4.520 50 10 IJGE CCOc1ccc([C@H](Br)c2cc(I)sn2)s1 1995363700 DYVPANKDMTZUJT-SNVBAGLBSA-N 430.130 4.692 50 10 IJGE C[C@H](Br)[C@H]1CCCN1C(=O)c1cc(Br)c(Br)s1 2018122767 BASOYSWSNXWEHH-POYBYMJQSA-N 446.002 4.661 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1ccc(OCc2ccccc2)cc1 2023034394 SHNZBVDDBAFESQ-DNVCBOLYSA-N 437.321 4.845 50 10 IJGE CCC[C@@](C)(CBr)NC(=O)c1cc(Br)cc(Br)c1 2029944662 KNHQSIYTRIJJJC-ZDUSSCGKSA-N 441.989 4.895 50 10 IJGE O=C(NC1CC(CCBr)C1)c1cc(Br)ccc1Br 2030033557 RDJXERMFLHHCSB-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE F[C@H](CBr)C1CCN(c2ncc(Br)cc2Br)CC1 2044832040 KKSIWHMYOJXVEN-LLVKDONJSA-N 444.968 4.556 50 10 IJGE Brc1cccc(CN2CC[C@@H](Br)[C@H]2C2CC2)c1Br 2067016708 NHJBFLASAMHFSN-TZMCWYRMSA-N 438.001 4.959 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1CN(CC1CC1)C[C@@H](CBr)CC1CC1 2112868852 NPYAOGLSSHXTPY-RTBURBONSA-N 429.443 4.909 50 10 IJGE CCc1cc(Br)c([C@H](Br)c2ccc(S(C)(=O)=O)cc2)s1 2145940512 BUESLHXOMYOWPY-CYBMUJFWSA-N 438.206 4.961 50 10 IJGE CCN(CCCOCc1ccccc1)S(=O)(=O)c1cc(Cl)cc(CCl)c1F 2153181695 PWDQQOYZVMMVBT-UHFFFAOYSA-N 434.360 4.835 50 10 IJGE Cc1sc(Br)c(C(=O)N2CC[C@H](Br)C(F)(F)CC2)c1C 2157250688 GGKMHZLVTONLEM-VIFPVBQESA-N 431.140 4.762 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)c2ccc(CBr)cc2)C2(CCC2)C1 2169197609 BKJIMVWRDNUECQ-QGZVFWFLSA-N 437.378 4.634 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)[C@@]12COC[C@@H]1C2 2213490827 XBJGIHHZZVJCDN-QNRPFLCFSA-N 428.921 4.823 50 10 IJGE Br[C@@H]1CCC[C@H]2CN(Cc3ccc(I)cc3)CC[C@H]12 2225475348 UMUUTYXWLIRBDT-CWRNSKLLSA-N 434.159 4.677 50 10 IJGE CC(C)(C)OC(=O)NCC1CC([S@@](C)(=O)=NCCCCCCCBr)C1 2263156755 YGNWPQQZAHFMNY-ZLWIMJCWSA-N 439.460 4.733 50 10 IJGE Br[C@@H]1C[C@@H]2CCCC[C@H]2N(Cc2ccc(I)cc2)C1 2264828537 ZRHJZYHRCDTVOO-SQWLQELKSA-N 434.159 4.819 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Cl)c(I)c2)C[C@@H]1Br 2300237949 FBCKFNFWEPWEGG-KOLCDFICSA-N 428.539 4.550 50 10 IJGE Clc1ccc(CC2(CBr)CCOCC2)cc1I 2300239851 DQILUBQWQFFRNX-UHFFFAOYSA-N 429.523 4.679 50 10 IJGE CCOC1=NC(=C(C#N)N=Nc2ccc(OC)cc2)NC(=N)[C@@H]1N=Nc1ccc(OC)cc1 2313585841 OZMQFSNQCOMIOT-IBGZPJMESA-N 446.471 4.648 50 10 IJGE Clc1ccc(CN2CCC3CC2(CBr)C3)cc1I 2315551329 PLLJFGDDMVCBKJ-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE COc1c(Br)cc(C)c(C(=O)[C@H]2C[C@@H](Br)C2)c1Br 2317420197 MCWCBXHKPVWFAV-OCAPTIKFSA-N 440.957 4.885 50 10 IJGE CC(C)(C)OC(=O)NC1C[C@@H]2CSC[C@H](C1)C21C[C@@]1(CBr)C(F)(F)F 2318656234 SWZOIETYXZJKTH-MCKZFVMYSA-N 444.357 4.986 50 10 IJGE CC1(C)C[C@H](Br)CN(Cc2cc(I)ccc2Cl)C1 2327406122 RPTLCUGHMPEKEN-NSHDSACASA-N 442.566 4.940 50 10 IJGE CC(C)N(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@]1(CBr)CC1(F)F 2351886834 FGBGYQJSTZBWNR-CRAIPNDOSA-N 439.385 4.764 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H]2CC[C@H](C2)[C@@H]1CBr 2359507862 QALOAQLFQPJNSJ-UJVNDKKSSA-N 425.523 4.630 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(C(=O)c2cc(F)c(Br)cc2Cl)[C@H]1C 2370651736 WPBAWYKMCQBBNY-NRPADANISA-N 427.539 4.876 50 10 IJGE COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)/C=C\c3ccc(C)cc3)ccc21 205641288 XKTDVQKFUKOBGM-VETRKHTQSA-N 438.483 4.841 50 10 IJGE C=CCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccc(F)cc3)c(OCC)c2)C1=O 214356454 VIYHOZLWQYWQHR-BKUYFWCQSA-N 446.478 4.582 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\Nc1ccc(Cl)c([N+](=O)[O-])c1 217240351 TUFJKQOKXNRLHD-YPKPFQOOSA-N 442.859 4.663 50 10 IJGE CC(C)(C)C[C@H](Cl)CNS(=O)(=O)c1cc(Br)ccc1Br 226264507 DQRJDFFHXKTMCB-JTQLQIEISA-N 447.620 4.534 50 10 IJGE CC(C)(C)[C@H](CCBr)NS(=O)(=O)c1c(Cl)cccc1Br 312315194 GJIAMMPPLKSPPB-NSHDSACASA-N 447.620 4.581 50 10 IJGE Cn1ncc([C@@H](Br)c2ccc(F)c(Br)c2F)c1Br 700971894 DFZPSDCWYGYQDN-QMMMGPOBSA-N 444.899 4.708 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@H]1CN(c1cc(CBr)sc1[N+](=O)[O-])C2 702106854 GNUFGDXTCGKOHD-KXBFYZLASA-N 436.375 4.510 50 10 IJGE O=C([C@H](c1cccs1)N(C(=O)CCl)c1cccc(C(F)(F)F)c1)N1CCCC1 725237711 MIPKGVUTFWMUEL-KRWDZBQOSA-N 430.879 4.702 50 10 IJGE CCCN(Cc1ccc(F)cc1)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 745843507 FOBWHWYMRDHXMV-CJLVFECKSA-N 441.510 4.949 50 10 IJGE O=S(=O)(NCC[C@H]1COc2ccccc2O1)c1ccc(S(F)(F)(F)(F)F)cc1 782985557 PDVAHFNYRQYLLH-LBPRGKRZSA-N 445.431 4.852 50 10 IJGE Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)NNc1nc(-c2cccnc2)nc(C)c1C 795113660 QUYKUSRDNAGJDF-UHFFFAOYSA-N 448.527 4.568 50 10 IJGE CCOc1ccc(Br)c(C=NNC(=O)[C@H](C)Oc2cccc3ccccc23)c1 1084178765 LTIDLBUASASKLT-HNNXBMFYSA-N 441.325 4.919 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)COc1ccccc1CC)c1ccc(C(F)(F)F)cc1 1312344172 WLUQNNDNFQOKKU-LJQANCHMSA-N 449.473 4.685 50 10 IJGE C#CCN(C(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C)[C@@H]1CCCc2ccccc21 1463010049 TWAWSPJXNKTCJR-NVJGTTRUSA-N 441.575 4.730 50 10 IJGE CC(=O)CCc1ccc(OCc2cccc(C(=O)NC[C@]3(C)C[C@H]3Br)c2)cc1 1533793625 GVRWQHBFAJPZSR-GGAORHGYSA-N 444.369 4.691 50 10 IJGE C=CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=S)Nc1ccc(CCCC)cc1 1540393262 FIPNWMYCFRBXFJ-LJQANCHMSA-N 448.633 4.596 50 10 IJGE C/C(=C/c1ccc(Br)o1)C(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1 1556338353 JNNMYZAUGHMIBK-YPKPFQOOSA-N 440.297 4.965 50 10 IJGE O=C(NNc1ccccc1Cc1ccccc1)c1ccc2c(c1)nc(O)n2CC(F)(F)F 1583743458 YCGRPEXYIRNHPO-UHFFFAOYSA-N 440.425 4.652 50 10 IJGE CCc1nn(Cc2cccc(F)c2)c2c1[C@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865701456 WACSEOSHRUXTKK-HSZRJFAPSA-N 445.542 4.697 50 10 IJGE CS(=O)(=O)Nc1ccc(/C(O)=C(\C#N)c2nc(-c3cccc(Cl)c3)cs2)cc1 1872748212 NHYQPPNTZZFMAS-VLGSPTGOSA-N 431.926 4.785 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCN(C(=O)OC(C)(C)C)C2(CCC2)C1 1882567123 PBGAZOHXZWGXSQ-CABCVRRESA-N 447.414 4.844 50 10 IJGE Cc1cnc2c(S(=O)(=O)N(CCCBr)Cc3ccccc3)cccc2c1 1914653281 QIYVNPYDYIZYLB-UHFFFAOYSA-N 433.371 4.519 50 10 IJGE O=S(=O)(c1cccc2ncccc12)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915172489 NNDNGJJUNWEZKR-FQEVSTJZSA-N 445.382 4.599 50 10 IJGE CC[C@@H](C[C@H](C)Br)NC(=O)c1csc(Br)c1Br 1945183659 KUHZQTGOBLLJSX-BQBZGAKWSA-N 448.018 4.955 50 10 IJGE Cc1cc(C(F)(F)F)ccc1C[C@@H](Br)CN1C(=O)c2ccccc2C1=O 1994838782 ZFUZPMAVCDTGSE-CQSZACIVSA-N 426.232 4.616 50 10 IJGE CC(C)CN(CCBr)Cc1ccc(I)c(Cl)c1 2026566807 MZVZZUHQWICARW-UHFFFAOYSA-N 430.555 4.798 50 10 IJGE F[C@@H]1CC[C@@H]([C@H](Br)c2cc(I)cc3c2OCC3)C1 2032983176 DNQLSQNZXULSLL-JQEORGNBSA-N 425.079 4.800 50 10 IJGE Brc1cccc(C[C@H]2CN(C3CC3)C[C@H]2Br)c1Br 2039252294 WKPJZLFORHUVLW-GXFFZTMASA-N 438.001 4.612 50 10 IJGE CCOc1c(Br)cc(Br)cc1CNC1CC(Br)C1 2063151981 XUTMJBLTHICVSC-UHFFFAOYSA-N 441.989 4.626 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)C(C)(C)C)[C@@H](C(F)(F)F)C1 2066604214 SRWQPOXWISECEI-QWHCGFSZSA-N 431.337 4.527 50 10 IJGE ClCCc1nc2c(Br)cccc2n1Cc1nccn1Cc1ccccc1 2090020346 AWPQMIMVQGQAPN-UHFFFAOYSA-N 429.749 4.873 50 10 IJGE CCC(CC)(CBr)CN1CCN(C(=O)C(F)(F)F)C2(CCCCC2)C1 2106783683 BYHBGOFQMOUXID-UHFFFAOYSA-N 427.349 4.597 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@H](CBr)C2(CCC2)C1 2115923675 ILOAWSMLBANYJQ-QMMMGPOBSA-N 427.589 4.801 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC2(CCl)CCC1CC2 2122350817 PTJFRMWJHXHLPW-UHFFFAOYSA-N 427.589 4.897 50 10 IJGE Fc1cncc(N2CCC[C@]3(CCCN(Cc4ccccc4)C3)C2)c1CBr 2163305472 DTVDXTQQYYWGQH-QFIPXVFZSA-N 432.381 4.998 50 10 IJGE CCn1cc(Br)c([C@@H](Cl)c2cc(Br)c(F)cc2OC)n1 2181179234 YMKKZYCKQASLSR-LBPRGKRZSA-N 426.511 4.904 50 10 IJGE Cc1cccc(N2CCC[C@@]3(CN(Cc4ccccc4)CCO3)C2)c1CBr 2196796894 UYWABVISWQYSRS-HSZRJFAPSA-N 429.402 4.761 50 10 IJGE COc1ccc([C@H](Br)c2cnn(C)c2I)cc1C(C)C 2233144444 YRBVCSQYDZLFHI-AWEZNQCLSA-N 449.130 4.641 50 10 IJGE C[C@H](COC(F)F)O[C@@H](CI)c1cccc(Br)c1 2253922839 HIMGEKNIHNLMJF-KCJUWKMLSA-N 435.046 4.570 50 10 IJGE Cn1nc(C[C@]2(CBr)CC(F)(F)C23CCC3)c(Br)c1Cl 2280848438 IFHCCQCMGGFJTC-LLVKDONJSA-N 432.534 4.969 50 10 IJGE O=C(N[C@@H](CBr)CC(F)(F)F)c1cc(Br)c(F)cc1Cl 2285844623 PHCUUNVHASCXBV-RXMQYKEDSA-N 441.444 4.687 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@H](Br)[C@@]1(C)COCCO1 2295363053 QYHGJDYRZXRPNK-UONOGXRCSA-N 428.548 4.661 50 10 IJGE Clc1ccc(I)cc1CN[C@H](CBr)C1CCC1 2307327758 FETKMFDWOWZBEN-CYBMUJFWSA-N 428.539 4.598 50 10 IJGE COC[C@]1(C)C[C@@]1(CBr)Cc1ccc(Cl)c(I)c1 2315552407 DQNCOYANLPQURL-UONOGXRCSA-N 443.550 4.925 50 10 IJGE COCCOc1ccc(C=C(C#N)C(=O)N(C)CCC2(c3ccccc3)CCCC2)cc1 2325118465 YDVLMUDRNCBBQG-UHFFFAOYSA-N 432.564 4.979 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@H]2CC[C@@H](Cl)[C@@H]1C2 2330966548 JSEROLMUHDWJFO-QNSHHTMESA-N 427.589 4.895 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@@H]1CC12CCC(F)(F)CC2 2343414822 TYOWYFCIKUAPQX-SJORKVTESA-N 430.333 4.689 50 10 IJGE CCn1nc(C)c(CBr)c1N(C)[C@H]1C[C@@H]2C[C@H](OCc3ccccc3)C[C@H]12 2359251889 QNLLDGHPQMKYTK-IWFBPKFRSA-N 432.406 4.926 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](CC)C(=O)NNC(=O)COc1ccc(Cl)c(C)c1 10682238 GVUPPJVYHLZEOC-MGPUTAFESA-N 432.948 4.546 50 10 IJGE Cc1cc(Br)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 14643304 ZMQFBTSWUXSZMZ-OAHLLOKOSA-N 447.373 4.592 50 10 IJGE CCCCOc1ccc(/C=C(/C#N)C(=O)Nc2sc(C(=O)OCC)c(C)c2C#N)cc1 35263099 SWVJEYFYNIOCQE-ATVHPVEESA-N 437.521 4.829 50 10 IJGE CCCCN1C(=O)C(C#N)=C(C)/C(=C\c2cn(-c3ccccc3)nc2-c2ccccc2)C1=O 101332949 RZIGKISZBZJIMS-XQNSMLJCSA-N 436.515 4.932 50 10 IJGE C[C@H]1CN(C(=O)c2cc(Br)c(Br)s2)CC[C@H]1Br 167821510 YOSRXJCOZXOIOO-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1Br)c1ccc(Br)cc1Br 232459406 YGBRMIBNBXNRAB-JQWIXIFHSA-N 439.973 4.648 50 10 IJGE Cn1ncc([C@@H](Br)c2cccc3ccccc23)c1I 382205095 RQVUJYFFCBJTKN-AWEZNQCLSA-N 427.083 4.662 50 10 IJGE C[C@@H]1[C@@H](CBr)CCN1Cc1cc(Cl)ccc1I 405286365 FBKAUFLQIMUXFZ-NXEZZACHSA-N 428.539 4.550 50 10 IJGE FC(F)Oc1c(I)ccc(Br)c1CBr 575682308 PGYAMWDXQJGOOI-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccc([C@H]2Cc3ccccc3N(S(N)(=O)=O)C2)cc1 616691125 TUYUMONXXOBCCX-FQEVSTJZSA-N 432.662 4.558 50 10 IJGE CC(C)N(C[C@@H](C)Cl)C(=O)c1cc(Br)ccc1I 691348878 FOUKUJFGWGOZBM-SECBINFHSA-N 444.538 4.532 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N(C[C@@H]2CCCO2)c2ccncc2)c(C)n1-c1ccccc1F 733969724 AIHATYLUYITYDK-QFVBLGFASA-N 444.510 4.747 50 10 IJGE Cc1ccccc1CC(=O)NN=Cc1cn(-c2ccc(Br)cc2)nc1C(C)C 763358853 YFODHSGQQIXOHZ-UHFFFAOYSA-N 439.357 4.759 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)N[C@H]1CCC[C@H]1c1ccccc1C(F)(F)F 768714083 JZOPRLHNKGIQQG-LPHOPBHVSA-N 442.441 4.534 50 10 IJGE Cc1nn(-c2ccc([N+](=O)[O-])cc2)c(C)c1C=NNC(=O)[C@@H](C)c1ccc(CC(C)C)cc1 1084309868 SFVGZVGTKCCASZ-KRWDZBQOSA-N 447.539 4.850 50 10 IJGE COc1ccccc1OCC(=O)NN=Cc1cc(C)n(-c2ccc(Cl)c(Cl)c2)c1C 1084336563 QBARCWCRJAZQJA-UHFFFAOYSA-N 446.334 4.939 50 10 IJGE O=C(NNC(=O)[C@H]1C[C@H]2CC[C@H]1C2)c1ccc(CSc2nc3ccccc3s2)cc1 1087068708 WMIVDVOMUFENBJ-SZMVWBNQSA-N 437.590 4.786 50 10 IJGE C=CC1(CC(=O)NNc2ccc(OCc3ccccc3)cc2)CN(C(=O)OC(C)(C)C)C1 1148424520 YZRYVASTBSFWGG-UHFFFAOYSA-N 437.540 4.522 50 10 IJGE C=CCNC(=O)c1ccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(C)cc3)c2C)cc1 1358122767 DZMQOFRSPNEERO-KQWNVCNZSA-N 438.531 4.864 50 10 IJGE CC(=O)c1cccc(OCCCC(=O)NNc2cc(Cl)ccc2Br)c1 1645079005 FPBLWAOXVFUMNI-UHFFFAOYSA-N 425.710 4.607 50 10 IJGE CCOc1ccc(C=NNC(=O)CCCOc2ccc(CC)cc2Br)cc1 1772755326 BBTFMQRGDCURSP-UHFFFAOYSA-N 433.346 4.720 50 10 IJGE CCCOc1ccc(C=NNC(=O)CSc2nc3ccccc3s2)cc1OCC 1772760396 IUQFLIWOYFIMKA-UHFFFAOYSA-N 429.567 4.726 50 10 IJGE Cc1nn(Cc2ccc(F)cc2)c2c1[C@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 1865685554 JZEHSBQPBDRONL-GOSISDBHSA-N 429.282 4.904 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Cl)Cc1cc(Cl)cc(Br)c1F 1887413841 BTQJHHWYFGZQQM-LLVKDONJSA-N 431.088 4.688 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N(CCCCl)Cc2ccccc2)c1Br 1914611793 WVKYRXMIYSVGGD-UHFFFAOYSA-N 436.824 4.947 50 10 IJGE CCCc1nc(Br)c(Br)n1C[C@@H](CBr)C1CC1 1940509279 WBQXTARZDRTYNG-SECBINFHSA-N 428.994 4.782 50 10 IJGE CC1(COc2c(Br)cc(CBr)cc2Br)COC1 2021402777 QEIUSLFMNVVYEG-UHFFFAOYSA-N 428.946 4.522 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1C(=O)c1c(Br)cccc1Br 2033085495 FBIUINUJUYVCIR-IUCAKERBSA-N 439.973 4.600 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN(Cc2cc(Cl)ccc2I)C1 2041568469 XWJOWIMJPPXAKK-PWSUYJOCSA-N 442.566 4.940 50 10 IJGE FC1(F)[C@@H]2COC[C@]21[C@@H](Br)c1cc(Br)ccc1Br 2043521223 PNPOBFVPGYGCTJ-OUAUKWLOSA-N 446.911 4.929 50 10 IJGE C[C@@H]1CC[C@H](CBr)N(Cc2cc(Cl)ccc2I)C1 2048064054 RUEPHGMIKGAGBT-ZWNOBZJWSA-N 442.566 4.940 50 10 IJGE CCn1nnc(Br)c1C[C@@H](Br)c1ccccc1Br 2050534519 BDGACDOEZXFIQT-SNVBAGLBSA-N 437.961 4.502 50 10 IJGE CCC[C@H](CBr)CN=[S@@](=O)(C(C)C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2063272928 HDRADNITVXZJIW-WHEFHEQHSA-N 439.460 4.683 50 10 IJGE C[C@@H]1CCN(Cc2ccc(I)c(Cl)c2)C[C@H]1CBr 2086659012 SFHKLFZPQITKES-ZYHUDNBSSA-N 442.566 4.798 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](Br)C(F)(F)F)[C@@H](c2ccccc2)C1 2106785251 NYXGDJJROSLZFS-HUUCEWRRSA-N 437.300 4.606 50 10 IJGE CCCN(C[C@H](CBr)c1ccccc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2106788990 VIGYTBNNHSMCOS-OALUTQOASA-N 425.411 4.887 50 10 IJGE CC(C)(C)[C@H](CBr)CN1C[C@@H](CCNC(=O)C(F)(F)F)c2ccccc21 2163065098 XJXICJOJJIQZBT-ZIAGYGMSSA-N 435.328 4.716 50 10 IJGE O=C(c1ccc(Br)cc1Br)N1CCC([C@H](F)CCl)CC1 2163238352 MQWTXUBOVVJJDB-CYBMUJFWSA-N 427.539 4.641 50 10 IJGE O=C([C@@H](Br)C1CCCC1)N1CCC[C@@]2(CCCN(Cc3ccccc3)C2)C1 2167030849 AWWSIQXCRLJFKY-JTHBVZDNSA-N 433.434 4.845 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@H]2OCCN(Cc3ccccc3)[C@H]2C1 2185510330 ICOHREUTANNDLF-FCHUYYIVSA-N 437.466 4.943 50 10 IJGE COCCO[C@@H]1[C@@H](Br)C[C@@H]1Oc1c(Cl)cc(Br)cc1Cl 2203012666 UPQKTOISOLOMQE-KPXOXKRLSA-N 448.966 4.702 50 10 IJGE O=C(c1cccc(OCc2ccccc2)c1)N1CCC(OCCCBr)CC1 2207532107 OPOWGININJXQPJ-UHFFFAOYSA-N 432.358 4.672 50 10 IJGE CCOCc1cc(Br)c([C@H](Cl)c2cc(Br)n(C)n2)s1 2224783595 UCVSYXOQYFOBGK-LLVKDONJSA-N 428.577 4.871 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)c(Br)cc2n1C[C@H](C)[S@@](C)=O 2234060237 MEYXQLWPMRXLJQ-DDIDRBJESA-N 442.604 4.628 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@H]2CCC[C@]2(CBr)C1 2264516074 WPPQWHMUUUZYMD-OQPBUACISA-N 427.589 4.801 50 10 IJGE COc1ccc([C@@H](Br)C(C)(C)[C@H]2CCCO2)cc1I 2269555013 ZEQOZRJXQRRLRE-ZIAGYGMSSA-N 439.131 4.941 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@@H](Br)[C@@]1(C)COCCO1 2295363054 QYHGJDYRZXRPNK-ZIAGYGMSSA-N 428.548 4.661 50 10 IJGE C[C@H](Br)CCCN(C)C(=O)c1scc(Br)c1Br 2299510430 YGNBGILTTVGGLY-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE CC[C@H](NCc1ccc(I)c(Br)c1)[C@H](Cl)CC 2306219595 NYJDIJRTHPPBSJ-YPMHNXCESA-N 430.555 4.939 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@@H](Br)[C@@H]1[C@@H]2CCO[C@@H]21 2313272377 NAMSQMASLSWLRX-JCNKXVEKSA-N 446.911 4.961 50 10 IJGE Clc1ccc(CN2C[C@H]3C[C@H](Br)C[C@H]2C3)cc1I 2315553178 OLTMBXHWTAVPSO-SDDRHHMPSA-N 440.550 4.692 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](Br)[C@@H](OCCCCC(F)(F)C(F)(F)F)C1 2315804622 UHHRNFPXWVVPKA-QWRGUYRKSA-N 440.247 4.754 50 10 IJGE Cc1scc(C(=O)N[C@@H](C)CCCCCI)c1Br 2320492890 CVMFHNJELZMMMQ-VIFPVBQESA-N 444.176 4.933 50 10 IJGE Cl[C@@H]1CCC[C@H](CNCc2ccc(I)c(Br)c2)C1 2325224065 SVJWECGUWTZUKK-CMPLNLGQSA-N 442.566 4.941 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1 2328520348 DJVROPFAVCHMKN-KBPBESRZSA-N 431.337 4.527 50 10 IJGE BrC[C@@H]1CN(Cc2sccc2I)Cc2ccccc21 2338750000 OFVAQVSKMMWIDO-GFCCVEGCSA-N 448.167 4.847 50 10 IJGE CCCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccs2)cc1 38656402 NSSYMPKQMLPGBX-JOCHJYFZSA-N 432.501 4.974 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(C)c4)ccc32)cc1 38685592 GAZKANZXCRLKRW-XMMPIXPASA-N 426.472 4.831 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccc(C)c(C)c2)ccc1OCc1ccc(C)cc1 40911157 LQNIZSUBRJTYCE-JFLMPSFJSA-N 432.520 4.729 50 10 IJGE O=C(Cc1cccc2ccccc12)N/N=C/c1ccc(OCc2nc3ccccc3[nH]2)cc1 59501655 IDXUENWKXWAIJR-OGLMXYFKSA-N 434.499 4.988 50 10 IJGE Cc1occc1C(=O)NN=C1C(=O)N(C(c2ccccc2)c2ccccc2)c2ccccc21 254506511 PILGPYJNFZKVLM-UHFFFAOYSA-N 435.483 4.858 50 10 IJGE CCCCOc1ccc(-c2cc(C(=O)NN=Cc3cnn(C)c3C)c3ccccc3n2)cc1 254856916 YEEGEYYUZBZYHN-UHFFFAOYSA-N 441.535 4.887 50 10 IJGE C[C@@]12CC[C@@H](C/C1=N\OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)[C@]2(C)CBr 256020231 XJKXRLUWKUHDCV-RRSYVVBVSA-N 429.698 4.982 50 10 IJGE CCn1c(SCC(=O)NN=Cc2cccc3ccccc23)nnc1-c1ccc(C)cc1 263630013 BTQWUBIPBUBMHX-UHFFFAOYSA-N 429.549 4.669 50 10 IJGE CC(=O)[C@H](Br)[C@H](C)c1ccc(I)c(Br)c1 300892026 FZBGHOVANDXODO-KSBSHMNSSA-N 445.920 4.510 50 10 IJGE C[C@@H](Br)C[C@@H]1CCCCCN1S(=O)(=O)c1cc(Br)cs1 312503989 RAOWCHVCUHCCER-PWSUYJOCSA-N 445.242 4.617 50 10 IJGE C[C@H]1[C@H](CBr)CCN1C(=O)c1cc(Br)sc1Br 385758162 FBQWOLUQNMIOPL-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE FC(F)C1([C@@H](Br)c2cc(I)cc3c2OCC3)CC1 697572082 FJMVBXACDQWHDD-NSHDSACASA-N 429.042 4.707 50 10 IJGE COc1ccccc1Nc1nc2sc(C(=O)NNc3cnc4ccccc4n3)cc2s1 774784590 WKEQPZFGVPGHLA-UHFFFAOYSA-N 448.533 4.810 50 10 IJGE O=C(NNc1cccnc1Cl)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 784837860 LTKHLPYRIYWYNK-UHFFFAOYSA-N 435.698 4.791 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(OC(F)F)c3cccnc23)c(C(F)(F)F)c1 799414889 SFMJQBVELCEACH-UHFFFAOYSA-N 437.328 4.875 50 10 IJGE Cc1ccc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1NC(=O)c1ccccc1 799747842 JKJVXFQYXRQYRA-UHFFFAOYSA-N 438.409 4.895 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2CCC(C3CC3)CC2)c(-c2ccc(Cl)cc2)n1 816904255 FPOVJRQMELWJRV-ZHZULCJRSA-N 433.943 4.673 50 10 IJGE CCOC(=O)c1ccc(OCC(=O)NN=Cc2ccc3c(c2)c2ccccc2n3CC)cc1 1083943373 PRQVBUIWDBHRTN-UHFFFAOYSA-N 443.503 4.520 50 10 IJGE Cc1cccc(C)c1-n1c(C)c(Br)c(C=NNC(=O)c2ccncc2)c1C 1084059913 XCMBAGKXDXXJOM-UHFFFAOYSA-N 425.330 4.632 50 10 IJGE O=C(NN=Cc1ccccc1Oc1ccccc1[N+](=O)[O-])c1cccc(Br)c1 1084512367 WLJGCDWBKBYTHG-UHFFFAOYSA-N 440.253 4.914 50 10 IJGE O=C(NNc1cc(Br)ccc1F)c1cc2ccc(C(F)(F)F)cc2nc1O 1179823179 BFMDZJBUSYRQTP-UHFFFAOYSA-N 444.182 4.618 50 10 IJGE Cc1c(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)oc2c1C(=NNC(N)=O)CCC2 1772750475 BDHQAEKVPAYSCY-UHFFFAOYSA-N 430.468 4.964 50 10 IJGE COc1ccc(C=NNC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)cc1Br 1772756002 JINRNUTXHYYBMW-CQSZACIVSA-N 433.346 4.673 50 10 IJGE CCCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@H]2c1ccccc1OC(C)C 1865704678 BQLRBLWLTTWEIF-JOCHJYFZSA-N 444.535 4.974 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OCC[C@@]23CCC[C@@H]2C3)CC1 1908614977 IOUKTDSNIBEOBY-CRAIPNDOSA-N 449.373 4.788 50 10 IJGE Cc1nc(N(Cc2ccccc2)[C@H](CBr)C2CC2)ncc1Br 1915193796 QUKWGRCAFKEFER-MRXNPFEDSA-N 425.168 4.728 50 10 IJGE O=C(c1ncsc1Br)N(Cc1ccccc1)C1(CBr)CCC1 1915762327 IDLONWPWZNMPKO-UHFFFAOYSA-N 444.192 4.866 50 10 IJGE O=C(c1ncc(Br)cc1Cl)N(CCCBr)Cc1ccccc1 1974521397 NVXDCBCXIJWUAY-UHFFFAOYSA-N 446.570 4.925 50 10 IJGE Cc1ccc(C[C@@H](Br)CN2C(=O)c3ccccc3C2=O)cc1C(F)(F)F 1995361105 UYZOMKIIWLVTEO-CYBMUJFWSA-N 426.232 4.616 50 10 IJGE Clc1nc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)sc1CBr 1999619829 RSOFZFBCWBXFEM-SFHVURJKSA-N 426.811 4.794 50 10 IJGE CC[C@@H]1CN(Cc2cc(Br)ccc2Br)C[C@H]1Br 2006497496 VFRQJBGOZORHMH-NOZJJQNGSA-N 425.990 4.817 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@H]1Cc1c(Br)cccc1Br 2007135896 FADNZKRCBZVRFN-IGJMFERPSA-N 426.974 4.943 50 10 IJGE CCOC(=O)[C@]1(CC2CC(Br)C2)CCCN(C(=O)OCc2ccccc2)C1 2020238063 VZXIIILGNTZBSF-NGICGMGXSA-N 438.362 4.532 50 10 IJGE C[C@@H]1C[C@@H](Br)CN(Cc2ccc(I)c(Cl)c2)C1 2026563455 KFGBRIYDHGQKGZ-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE O=C(N[C@H]1CCC[C@H]1CBr)c1cccc(Br)c1Br 2031485354 HRTWKRXWDOENKN-KWQFWETISA-N 439.973 4.505 50 10 IJGE BrC[C@@H]1[C@@H]2CCN(Cc3ccc(Br)cc3Br)C[C@@H]12 2032221276 YWSMVHCGQUWWMS-YNEHKIRRSA-N 438.001 4.674 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCN(c2cc(CCl)c(Br)cn2)C1 2032235159 QHMXPGZBSNMFGO-UHFFFAOYSA-N 430.724 4.540 50 10 IJGE Cc1cc2occ(CC(=O)OCC(=O)C(C#N)=C3Sc4ccccc4N3C)c2cc1C 2040463818 OOKDAMMPAADJAE-UHFFFAOYSA-N 432.501 4.682 50 10 IJGE CC(C)[C@@H](Br)[C@@H](C)NC(=O)c1c(Br)cccc1Br 2041305135 VXDKTOJJHCAOCM-PRHODGIISA-N 441.989 4.749 50 10 IJGE C[C@@]1(NC(=O)c2ccc(CBr)cc2)CCCN(C(=O)OCc2ccccc2)C1 2044173468 LUBGJIAXUMVOIP-JOCHJYFZSA-N 445.357 4.503 50 10 IJGE CCC[C@@H](Cl)c1cn(-c2ccc(I)c(Br)c2)nn1 2057421470 NZPVOOJUCGZOQS-SNVBAGLBSA-N 440.510 4.714 50 10 IJGE CC(C)n1cc(S(=O)(=O)N(Cc2ccccc2)CC2CC2)cc1CBr 2059313056 SXADITRLGFNVHX-UHFFFAOYSA-N 425.392 4.565 50 10 IJGE Fc1cc(C(F)(F)F)cc(-n2nc(CBr)c(Cl)c2C(F)(F)F)n1 2078913695 GJSCEMWYIVFNBN-UHFFFAOYSA-N 426.517 4.992 50 10 IJGE C[C@@H]1C[C@@H](n2c(CCCl)nc3cncc(Br)c32)CN1Cc1ccccc1 2095436931 LAMLRKMDQVSMAX-GDBMZVCRSA-N 433.781 4.811 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(CC2(CBr)CCCCC2)CCC1(F)F 2106785947 RFTQZRMVYAPWBL-OAHLLOKOSA-N 439.385 4.956 50 10 IJGE O=C(NC[C@@]12CCC[C@@]1(CCl)C2)c1csc(Br)c1Br 2142942536 DTQGSNLVTZRKEL-STQMWFEESA-N 427.589 4.802 50 10 IJGE CCN(CC)CCN(Cc1ccccc1)S(=O)(=O)c1ccc(CCl)cc1Cl 2152214318 CTPNNPNDEGLJOB-UHFFFAOYSA-N 429.413 4.612 50 10 IJGE CN([C@@H]1CC[C@H]1OCc1ccccc1)S(=O)(=O)c1cc(F)c(Cl)c(CCl)c1 2156441239 FFEGKLOHYBIMNL-QZTJIDSGSA-N 432.344 4.586 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)c2ccccc2)[C@@](C)(C2CC2)C1 2163058659 MIOLFIVJJPZBBI-PGRDOPGGSA-N 437.422 4.887 50 10 IJGE O=S(=O)(c1cc(CBr)sc1Br)N1CCC12CCCCC2 2179788056 XJTRZUGDQNDOBR-UHFFFAOYSA-N 443.226 4.503 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(Br)c1 2217402747 ZSEHWRGGFLDVRM-CQSZACIVSA-N 434.758 4.797 50 10 IJGE CC1(C)CCC(S(=O)(=O)N(Cc2ccccc2)[C@H](CBr)C2CC2)CC1 2223526121 WUQMRQHCDAHHAQ-LJQANCHMSA-N 428.436 4.961 50 10 IJGE CC(C)n1c(CBr)nnc1-c1ccc(Cl)c(I)c1 2256332005 RLHSOXWGOQYNLS-UHFFFAOYSA-N 440.510 4.679 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@@]12COC[C@H]1C2 2260000337 YTOPVLAKXXTHJM-VVEMVBODSA-N 446.911 4.962 50 10 IJGE COc1ccc([C@H](Br)[C@@]23CCC[C@H]2OCC3)cc1I 2269556776 RCWCIZPMSGUTEV-QLFBSQMISA-N 437.115 4.695 50 10 IJGE C[C@H](Br)CN(CCC(C)(C)C)S(=O)(=O)[C@H]1C[C@H](OCc2ccccc2)C1 2272427550 BMRZDQAXFFXJGD-WDSOQIARSA-N 446.451 4.586 50 10 IJGE Oc1nc2ccc([C@@H](Br)c3c(F)cccc3I)cc2o1 2282892316 BHULAEBYLTZZQG-CYBMUJFWSA-N 448.029 4.761 50 10 IJGE C[C@H](Br)[C@@H](NC(=O)c1cc(Br)c(F)cc1Cl)C(F)(F)F 2285836051 WLYWSHRXRGSKTF-AJAUBTJJSA-N 441.444 4.686 50 10 IJGE O=C(NCC1(CBr)CCCC1)c1cc(Br)c(F)cc1Cl 2285843788 DNLZSKNSXMYGGS-UHFFFAOYSA-N 427.539 4.927 50 10 IJGE CCOC(=O)C(C#N)=C1S[C@H](Cc2cccc(Cl)c2)C(=O)N1c1ccc(C)cc1 2293039086 BBXIIOBUOSUWJV-LJQANCHMSA-N 426.925 4.638 50 10 IJGE O=S1(=O)C[C@H]2[C@@H](C1)[C@@H]2[C@@H](Cl)c1ccc(OCc2ccccc2)cc1Br 2314442392 BGFRUXVTGLZILK-ISARSNTHSA-N 441.774 4.599 50 10 IJGE COc1ccccc1C1(CNC(=O)C(C#N)=Cc2cccc(Br)c2)CCCC1 2329694506 BBNURAQVESMDEV-UHFFFAOYSA-N 439.353 4.993 50 10 IJGE O=C(COc1ccc(C23CC4CC(CC(C4)C2)C3)cc1)N/N=C\c1ccc([N+](=O)[O-])cc1 33154770 GJHINQUFMHRRGL-YSMPRRRNSA-N 433.508 4.592 50 10 IJGE CC(C)c1ccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3)c2[N+](=O)[O-])cc1 40594658 WOMQHFRWYKDDNU-UHFFFAOYSA-N 426.864 4.662 50 10 IJGE CCOC(=O)N/N=C1\CCCc2oc(C(=O)Nc3ccc(C)cc3Br)c(C)c21 40825642 LKYGYIOIRPBRGU-HZHRSRAPSA-N 448.317 4.698 50 10 IJGE O=C(Cc1ccccc1)N/N=C1/C(=O)N(C(c2ccccc2)c2ccccc2)c2ccccc21 59154003 PPWSMGNCNDNTCJ-TVKQRKNISA-N 445.522 4.886 50 10 IJGE CCCOc1ccccc1/C=C/C(=O)Oc1ccc(/C=C(/C#N)C(=O)OCC)cc1OCC 207003216 JKNUKPRYSBSRJH-NNFMSFPLSA-N 449.503 4.963 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OCc1cccc(Cl)c1 231317552 NKTPYHCHOLHLMV-INIZCTEOSA-N 439.721 4.575 50 10 IJGE COc1cc(C[C@H](Br)C(=O)C(C)C)c(Br)cc1Br 234896519 CRWCMSYFYGYHHM-NSHDSACASA-N 442.973 4.751 50 10 IJGE ClCCc1nc2ccc(Br)cc2n1Cc1cnn(Cc2ccccc2)c1 390369429 DEKMKIQLJXJZAU-UHFFFAOYSA-N 429.749 4.873 50 10 IJGE C[C@@H]1CCN(Cc2cc(Cl)ccc2I)[C@@H]1CBr 405329383 FPNKRXWWMFRMAV-NOZJJQNGSA-N 428.539 4.550 50 10 IJGE ClCc1cc(Br)cnc1N1C[C@H]2CC[C@H]1[C@@H]1CN(Cc3ccccc3)C[C@@H]21 705845724 MJTIVOOVTXBNOW-RCOXNQKVSA-N 446.820 4.930 50 10 IJGE CC[C@H](C[C@H](C)Br)NC(=O)c1cc(Cl)ccc1I 716938015 JOPRUCVTOYEFNJ-WCBMZHEXSA-N 444.538 4.627 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NCCCn2ccc3ccccc32)c(-c2ccccc2)n1 914462633 BCWFAJRMUCOXLQ-PTGBLXJZSA-N 448.530 4.532 50 10 IJGE C=CC[C@@H](CO)CNC(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1152930134 LNSUGFSSXAFGKL-BZMUBCNJSA-N 432.351 4.609 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2nc3ccc(Cl)cc3s2)cc1)[C@@H]1C[C@@H]1C 1218458648 LFBJHEGYILWMBD-APPDUMDISA-N 429.933 4.860 50 10 IJGE COc1ccccc1Nc1ccc(C(=O)NNc2nc(-c3ccccn3)nc(C)c2C)cc1 1641288990 DBGVSTPTKOSHKT-UHFFFAOYSA-N 440.507 4.665 50 10 IJGE CCc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(O)cc2)CCC3)cc1 1772744753 JAXYXKSIHOTUMB-UHFFFAOYSA-N 431.492 4.579 50 10 IJGE Cc1c(C(=O)NC2CCCCC2)oc2c1C(=NNC(=O)c1cccc(Cl)c1)CCC2 1772746481 VXJHRLYEOTXXPL-UHFFFAOYSA-N 427.932 4.774 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccc(Cl)cc2)[C@H]1c1ccccc1F 1865684148 UTYMYQZUJVJJER-HNNXBMFYSA-N 434.780 4.902 50 10 IJGE CCCC[C@H](NC(=O)C[C@H]1CC(=O)c2ccccc21)C(=O)Nc1ccc(SC#N)cc1 1867243860 VNPBHMIDBMAGAN-IERDGZPVSA-N 435.549 4.634 50 10 IJGE COc1cc2c(cc1OC)[C@H](c1cccc(F)c1)N(C(=O)/C(C#N)=C/c1ccccc1)CC2 1868112949 GJCHHFIJSFBNPA-WLDFWAKUSA-N 442.490 4.924 50 10 IJGE CCC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1882088523 RXMCAANCDIWADN-BZUAXINKSA-N 449.430 4.948 50 10 IJGE CC(C)(CI)CN1CCCC[C@@H]1C(C)(C)NC(=O)OC(C)(C)C 1904649886 AKDABXPLPBVNNB-CQSZACIVSA-N 438.394 4.605 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2cc(CBr)sc2[N+](=O)[O-])C1 1921470456 QQHKJIUAIPFJAO-LSDHHAIUSA-N 438.391 4.898 50 10 IJGE CC[C@@H](C)[C@H](Br)CNC(=O)c1scc(Br)c1Br 1942810441 MMWLZLROTVHZMH-RNFRBKRXSA-N 448.018 4.813 50 10 IJGE C[C@]1(CBr)CCN(Cc2c(Br)cccc2Br)C1 1945331398 SCBHOQCOSJXDNB-CYBMUJFWSA-N 425.990 4.819 50 10 IJGE Cc1ccc(Br)c(C(=O)N(Cc2ccccc2)[C@H](C)CCBr)n1 1980428185 AHWJQMAXCNCGBX-CQSZACIVSA-N 440.179 4.968 50 10 IJGE C[C@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1ccc(CCBr)s1 2009639595 DZCBTLXSGKZWNJ-CQSZACIVSA-N 428.417 4.675 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1ccc(Br)c(F)c1 2010825435 LCNRNBNWYLMUBD-UHFFFAOYSA-N 439.416 4.584 50 10 IJGE ClC[C@@H]1CCC[C@@H]1CNc1ncc(I)cc1Br 2015756443 FZGZDCFPRMNWBX-DTWKUNHWSA-N 429.527 4.516 50 10 IJGE Brc1ccc(Br)c(CN2CC[C@@H](Br)[C@@H]2C2CC2)c1 2067010478 BFCYFZQTBLJZEC-KGLIPLIRSA-N 438.001 4.959 50 10 IJGE ClC[C@H](Nc1ncc(I)cc1Br)c1ccccc1 2069526421 VSHFBRKRXSFSBI-LBPRGKRZSA-N 437.506 4.841 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CC2(CBr)CCCC2)CC[C@@H]1C(F)(F)F 2106780835 BWIZRSGYUJFTJO-KBPBESRZSA-N 443.348 4.719 50 10 IJGE CC[C@@]1(NC(=O)OC(C)(C)C)CCCN(C[C@H](CBr)c2ccccc2)C1 2106788319 ORQSSHOTKRWOOJ-GHTZIAJQSA-N 425.411 4.934 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@H](C)CN(C)Cc1ccccc1 2128514143 XGLRLANPUGBOFB-CQSZACIVSA-N 435.797 4.977 50 10 IJGE ClCc1cc(Br)ccc1N1CC[C@H]2OCCN(Cc3ccccc3)[C@H]2C1 2129050224 CNXLZRPFSQRPPM-LEWJYISDSA-N 435.793 4.668 50 10 IJGE CCc1cc(Br)c([C@@H](Br)c2cccc(S(C)(=O)=O)c2)s1 2145940477 BKODFJOMQJPFNE-ZDUSSCGKSA-N 438.206 4.961 50 10 IJGE ClCCCOC1CCN(Cc2cccc(Br)c2Br)CC1 2207529013 MQZDLTPNGKUHLX-UHFFFAOYSA-N 425.592 4.822 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1N(CCCCCI)CCCC1(C)C 2211195443 WZYLAWHEVBNSKA-HNNXBMFYSA-N 438.394 4.607 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)c1cc(Cl)ccc1NC(=O)OC(C)(C)C 2223980757 IHUOMZKIMMUADP-TXEJJXNPSA-N 431.758 4.933 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@H](Br)[C@H]1C1CC1 2282967963 QCWZHQUQBRWJGL-TVQRCGJNSA-N 425.523 4.630 50 10 IJGE C[C@@H](CCl)[C@@H]1CCCCN1C(=O)c1ccc(Cl)c(I)c1 2283670661 UWRXSJFJURNKRY-HZMBPMFUSA-N 426.125 4.814 50 10 IJGE N#CC(=Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(=O)Nc1ccccc1C(=O)O 2297306953 IQFUSZBVWQVKHU-UHFFFAOYSA-N 437.795 4.752 50 10 IJGE C[C@H]1CCCN(Cc2sccc2I)[C@H]1CCBr 2301072789 AVZPSZPRONWYFH-JQWIXIFHSA-N 428.177 4.738 50 10 IJGE CC(C)N(Cc1cc(I)ccc1Cl)C[C@H](C)Br 2307326890 UONXKVIKIWJJBV-JTQLQIEISA-N 430.555 4.938 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)NCc2cccs2)ccc1OCCOc1ccccc1 2313540722 QJMXVHKNBOZOCM-UHFFFAOYSA-N 448.544 4.828 50 10 IJGE C[C@H]1CCC[C@@](CBr)(Cc2nn(C)cc2I)CC1 2319152680 VPDDBDZPIHTMEE-FZMZJTMJSA-N 425.152 4.549 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)[C@@H]3CC(=O)N(C(C)(C)C)C3)n2)cc1Cl 2331398274 BTYOXXZYCAJBMD-CYBMUJFWSA-N 431.945 4.912 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)[C@H](C)Oc4ccccc4F)ccc32)cc1 38649234 APOSYHRWVLVFDU-UPCLLVRISA-N 444.462 4.725 50 10 IJGE O=C(CC[C@@H](O)c1ccccc1)N/N=C\c1ccc(-c2cccc(Br)c2)o1 58891159 UVCHVUGFLVLCOL-JVMBGAFUSA-N 427.298 4.673 50 10 IJGE Cc1nc(COc2ccc(/C=C(/C#N)C(=O)Nc3cccc(C(F)(F)F)c3)cc2)no1 60085697 KMVCMOBNUBTTNH-DHDCSXOGSA-N 428.370 4.522 50 10 IJGE Br[C@H](c1ccc2c(c1)OCCO2)c1ccccc1I 109851437 PFBSQZKYEFZBBW-OAHLLOKOSA-N 431.067 4.547 50 10 IJGE C[C@@H](Br)[C@](Br)(CBr)C(=O)Oc1ccc(Cl)cc1 205782814 KTCDUXGRNCZTMN-RDDDGLTNSA-N 449.364 4.557 50 10 IJGE N#C/C(=C/Nc1cc([N+](=O)[O-])ccc1Cl)C(=O)NC(c1ccccc1)c1ccccc1 216974707 YMYKQTHJVMJATI-SDXDJHTJSA-N 432.867 4.973 50 10 IJGE CCOC[C@@H](C)O[C@](C)(CI)c1ccccc1Br 233766635 YLCZEADFTXDHBY-BXUZGUMPSA-N 427.120 4.541 50 10 IJGE O=C(c1cc(Cl)cc(Br)c1)N1CCC(F)(F)[C@@H](CBr)C1 403966820 LYKNHPYTQGDWNK-VIFPVBQESA-N 431.502 4.595 50 10 IJGE C[C@H](CCCC(F)(F)F)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 757642853 BUZRWHAJWWKVEN-OKSBFYSISA-N 429.446 4.608 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)N(C)C)cc(Cl)c1OCc1ccc(Br)cc1 1084494263 JLBXSOHRSCWNTO-OVCLIPMQSA-N 449.732 4.685 50 10 IJGE C=COc1ccc(NC(=O)NNC(=O)c2ccc(COc3ccc(OCC)cc3)cc2)cc1 1562927537 ZDNRTTCHYRXBBW-UHFFFAOYSA-N 447.491 4.653 50 10 IJGE C#CCN(C(=O)[C@@H](Br)C(C)(C)C)[C@H]1CCOc2ccc(Br)cc21 1617600636 MTHSSTVXQKJLCK-GOEBONIOSA-N 443.179 4.544 50 10 IJGE C=CC[C@@H]1CCCC[C@H]1NC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl 1636883802 VXPTXFICJXMMBB-RHSMWYFYSA-N 428.360 4.618 50 10 IJGE Cn1cccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2Cc1cccc(Cl)c1 1865699371 RXCFWALSLURUHC-OAQYLSRUSA-N 441.922 4.808 50 10 IJGE CCCc1nn(Cc2cccc(F)c2)c2c1[C@@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865700404 SCDRKUVDAFMEQK-JOCHJYFZSA-N 427.483 4.722 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(-c3ccc(N(C)C)cc3)cc2)cc1OC 1866130352 PUPHOPSIAPFBRD-RCCKNPSSSA-N 427.504 4.982 50 10 IJGE C[C@@H]1[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)[C@@H]1C 1892778170 WTQUVVRYYPFNGN-GBJTYRQASA-N 435.403 4.556 50 10 IJGE CCCN(CC(C)(C)CI)C1CCN(Cc2ccccc2)CC1 1904654197 VAMDGSLEQORDRN-UHFFFAOYSA-N 428.402 4.824 50 10 IJGE Cc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)CBr)c2cccnc12 1914341223 IMXSZRDELBFZIL-INIZCTEOSA-N 433.371 4.518 50 10 IJGE Cl[C@@H]1CCCC[C@@H]1CNc1ncc(I)cc1Br 2015756618 INIFFQQLKQNPJB-LDYMZIIASA-N 429.527 4.658 50 10 IJGE BrC[C@@H]1C[C@@H]2CCC[C@@H]2N1c1ncc(Br)cc1Br 2046154709 LVOBCBPYPZIUAW-PEXQALLHSA-N 438.989 4.749 50 10 IJGE Cc1cc(Br)c([C@@H](Br)[C@@]2(C)COCCO2)cc1Br 2078515404 CCWVSHHVRQIUTJ-CHWSQXEVSA-N 442.973 4.762 50 10 IJGE C[C@H]1CCc2c1c(CBr)nn2Cc1cc(F)ccc1I 2080702493 FCQBMIATNDWNLV-VIFPVBQESA-N 449.105 4.620 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCCCCN(C[C@@H](CBr)c2ccccc2)C1 2106784154 GOGAWZWGYQICLX-RTBURBONSA-N 425.411 4.934 50 10 IJGE C[C@@H](c1nscc1Br)N(C)c1ncc(Br)cc1CCl 2130019977 XDLSPDFMEMJBQD-ZETCQYMHSA-N 425.577 4.999 50 10 IJGE Fc1cc(Br)c2nc(CCCl)n([C@]34C[C@H]3CN(Cc3ccccc3)C4)c2c1 2155873726 QYDJKBRNYGVEKC-BTYIYWSLSA-N 448.767 4.950 50 10 IJGE CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)N2C(=O)c1ccc(CBr)cc1 2163056037 NPKFCMHOQNHZFV-AYHJJNSGSA-N 437.378 4.632 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CCC([C@H](F)CCl)CC1 2163246243 PPNFITOQKNDNEZ-GFCCVEGCSA-N 427.539 4.641 50 10 IJGE Cn1cc(CC(CBr)(CBr)c2ccc(Cl)cc2)c(Cl)n1 2168231770 ODOMWFLWVXFALA-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE ClCCC[C@H]1CCCN(c2ncc(I)cc2Br)C1 2218756981 AUZTZHBPJXZHFS-JTQLQIEISA-N 443.554 4.684 50 10 IJGE BrC[C@]12CCCC[C@H]1CN(Cc1ccc(I)cc1)C2 2230624058 QQEAUMLPPLYMGF-HOCLYGCPSA-N 434.159 4.678 50 10 IJGE CCOCc1cc(Br)c([C@H](Br)[C@@]2(COC)CCCO2)s1 2233033828 RTXRUHFHVVEGFY-KBPBESRZSA-N 428.186 4.679 50 10 IJGE Cn1nc(C(=O)Nc2ccc(Cl)cc2CBr)c(Br)c1Cl 2239633869 UODVKYIJHNPXBT-UHFFFAOYSA-N 441.938 4.637 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CCS[C@@H](CCBr)C1 2253553096 UBPNAOJNEZOHDP-ZETCQYMHSA-N 433.618 4.507 50 10 IJGE COc1cc(N(C)Cc2cccc(I)c2)ccc1CBr 2280262846 CKZVTAQEOQIMDG-UHFFFAOYSA-N 446.126 4.831 50 10 IJGE CC1(C)C[C@H](CBr)N(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282986112 MOXKFVOPCLPOLX-MRVPVSSYSA-N 427.539 4.877 50 10 IJGE COc1ccc([C@H](Br)[C@H]2CCCCS2(=O)=O)c(Br)c1Cl 2283561112 FKCKLBJFSNYCMC-MNOVXSKESA-N 446.588 4.514 50 10 IJGE C[C@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@@H](C)[C@@H]1Br 2285959033 OHYSGQDYIWOYOK-BWPRHRIFSA-N 427.539 4.733 50 10 IJGE FC1(F)[C@H]2C[C@](CBr)(Cc3sccc3I)C[C@H]21 2301052800 KMVVHOAFJXQNEE-VROVMSAKSA-N 433.099 4.952 50 10 IJGE CN(Cc1ccc(Cl)cc1I)C1(CBr)CCC1 2302321591 YYOBGKVTZUMTKR-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1Cc1ccc(Cl)cc1I 2302326757 SPDNBSMZWNFVBW-KOLCDFICSA-N 428.539 4.692 50 10 IJGE Cc1ccc(NC(=O)C(C#N)=Cc2cc(Cl)c(OCC#N)c(Br)c2)cc1 2313568175 PBNKCFXGSFGKKV-UHFFFAOYSA-N 430.689 4.859 50 10 IJGE Cc1ccc(S(=O)(=O)C(C#N)=Cc2cn(-c3ccccc3)nc2-c2ccncc2)cc1 2314457907 NTWYLYNRVHHVMT-UHFFFAOYSA-N 426.501 4.581 50 10 IJGE CCOc1ccc(CCNC=C(C#N)C(=O)Nc2cc(Cl)ccc2C)cc1OCC 2325145508 LIQFKVRYDVSMSA-UHFFFAOYSA-N 427.932 4.624 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@H]2CC[C@H](Cl)[C@@H]1C2 2330962918 HZQAYYJCQHGBND-JEZHCXPESA-N 427.589 4.895 50 10 IJGE COc1cc(CBr)cc(N(C)[C@H]2C[C@@H]3C[C@@H](OCc4ccccc4)C[C@H]23)n1 2364761521 IGTIUADAMJVDFB-YRPNKDGESA-N 431.374 4.805 50 10 IJGE CC(C)(C)OC(=O)N1CCOC2(CCN(C[C@@](C)(CBr)C(C)(C)C)CC2)C1 2380185770 FPYSPMNPIIRFEO-HXUWFJFHSA-N 447.458 4.536 50 10 IJGE C/C(=C\C#N)N1C(=O)c2ccc(C(=O)Nc3ccc(-c4nc5ccccc5o4)cc3)cc2C1=O 20981883 YLOIFHLCWLFBFE-NTCAYCPXSA-N 448.438 4.770 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCc2ccco2)ccc1OCCOc1cc(C)ccc1C 35419061 TVHZVKXQTRDPSG-STZFKDTASA-N 446.503 4.586 50 10 IJGE CCCCOc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)OCC)CCC3)cc1 40825542 BFADQZNROIDNLM-XIEYBQDHSA-N 427.501 4.806 50 10 IJGE CCOC(=O)c1ccc(OCC(=O)N/N=C(\C)C(c2ccccc2)c2ccccc2)cc1 66202625 NYMDUKSSYXSAHP-ZXVVBBHZSA-N 430.504 4.566 50 10 IJGE COc1cc(/C=C2\C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(C)cc1 214253352 TXROESRRJGCYSE-MTJSOVHGSA-N 430.504 4.583 50 10 IJGE CCC[C@H](CCBr)CNC(=O)c1cccc(C)c1I 227502905 OVCZBDGQDKCWDO-GFCCVEGCSA-N 438.147 4.531 50 10 IJGE Cc1nn(-c2ccccc2)c(C)c1C=NNC(=O)CCn1c2c(c3ccccc31)CCCC2 245238246 HGNUELSGAGHNBQ-UHFFFAOYSA-N 439.563 4.863 50 10 IJGE CCCCN1C(=O)C(=NNC(=O)COc2cccc3ccccc23)c2cc(Cl)ccc21 245284269 RDFKUAWRKJYZTF-UHFFFAOYSA-N 435.911 4.539 50 10 IJGE COc1ccc(C(C)=NNC(=O)c2cc(-c3cccc(OCc4ccccc4)c3)n[nH]2)cc1 254498290 ABRNRBNNWZJRBO-UHFFFAOYSA-N 440.503 4.818 50 10 IJGE CCOc1ccccc1C=NNC(=O)COc1cc(C)c(Br)cc1C(C)C 254565782 BMXQLHZRWHBCHP-UHFFFAOYSA-N 433.346 4.809 50 10 IJGE N#C/C(=C/c1ccccc1)C(=O)N=C1N=C2C=CC(Br)=CN2Cc2ccccc21 254566757 MBYPKLKLWSLERW-FYJHPUIUSA-N 443.304 4.587 50 10 IJGE CC[C@@H](Cl)CCCNC(=O)c1cc(I)ccc1Br 398455099 FXSKXUJLVABBFA-SECBINFHSA-N 444.538 4.581 50 10 IJGE Clc1cccc(CBr)c1N1CCO[C@H]2CCN(Cc3ccccc3)C[C@H]21 404182627 KRTPCJIPJXHQGM-UXHICEINSA-N 435.793 4.715 50 10 IJGE CC(C)N(C[C@H](C)Br)C(=O)c1cc(Br)c(Br)s1 691357956 RUOGNDBEDBAMDG-ZETCQYMHSA-N 448.018 4.907 50 10 IJGE CCC[C@H](CCBr)NC(=O)c1cc(Br)c(Br)s1 716963758 YDHQOEMQUFFILT-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE O=C(NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)[C@@H]1C[C@@H]1c1cccc2ccccc12 734259814 CIBRPJHNJCKVJG-QZTJIDSGSA-N 449.436 4.957 50 10 IJGE CC(C)(C)OC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2nc(-c3ccncc3)cs2)cc1 764888532 RBIGUGSQCQDJOS-LDADJPATSA-N 432.505 4.706 50 10 IJGE O=C(NNc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 773638651 HJBWGAKHTVOUNC-UHFFFAOYSA-N 445.262 4.650 50 10 IJGE CCOc1cc(C=NNC(=O)CC[C@@H](O)c2ccccc2)ccc1OCc1cccc(C)c1 1084459171 GMDRFAQCMYQOHP-XMMPIXPASA-N 446.547 4.937 50 10 IJGE C#CCSCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1465292143 VNPWLBIWIHWLSE-SFQUDFHCSA-N 432.376 4.791 50 10 IJGE Cc1cc(NNC(=O)CSCc2nc(O)c3c4c(sc3n2)CCCC4)ccc1Cl 1645077052 VOVYLPDECUIVMI-UHFFFAOYSA-N 449.001 4.614 50 10 IJGE CCCCCN1C(=O)C(=NNC(=O)COc2ccc3ccccc3c2)c2cc(C)ccc21 1772720168 FBXOJPJPISRWRF-UHFFFAOYSA-N 429.520 4.584 50 10 IJGE O=C(Nc1ncccc1OCC(=O)c1ccc(Cl)cc1)Oc1ccc([N+](=O)[O-])cc1F 1858695863 ZOZUEVWOUNDWSE-UHFFFAOYSA-N 445.790 4.655 50 10 IJGE CCOC(=O)c1cnn(-c2ccc(Cl)cc2)c1NC(=O)/C(C#N)=C/c1ccc(C)cc1 1866127074 HDHJSLZHPKKFDQ-SFQUDFHCSA-N 434.883 4.557 50 10 IJGE C[C@H]1c2[nH]cnc2CCN1c1cc(Nc2ccc(SC#N)cc2)nc(-c2cccnc2)n1 1868564648 CWLBIOSTYPWBFV-HNNXBMFYSA-N 440.536 4.702 50 10 IJGE CC(C)[C@H](/C(O)=C(\C#N)c1nc(-c2cccs2)cs1)N1C(=O)c2ccccc2C1=O 1872750980 WDXASLLLWOVMFS-UFSZVFTQSA-N 435.530 4.985 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@@H](O[C@@H]2CCC3(CCCC3)C2)C1 1902886349 SFMJKHLZLGRUMF-ILXRZTDVSA-N 435.346 4.539 50 10 IJGE N#C[C@@H]1CN(c2ccc(Br)cc2CBr)CCN1Cc1ccccc1 1914890969 KHJCSSGPHMUONC-GOSISDBHSA-N 449.190 4.558 50 10 IJGE C[C@H]1CN(Cc2ccc(Br)cc2Br)CC[C@@H]1Br 1943841945 FZBQDYRVNIQVOW-CABZTGNLSA-N 425.990 4.817 50 10 IJGE O=C(c1cc(I)ccc1F)N(CCCCl)Cc1ccccc1 1961213629 HKSHZIYGLKXCNB-UHFFFAOYSA-N 431.676 4.702 50 10 IJGE CCCC(CBr)(CCC)CN1CCN(C(=O)OCc2ccccc2)CC1 1977959876 BDLYXVHCLCHGOA-UHFFFAOYSA-N 425.411 4.922 50 10 IJGE CCn1cc(Br)c([C@@H](Br)c2ccc(Br)s2)n1 1985208157 AWUJGCYLGGVCSJ-VIFPVBQESA-N 428.975 4.974 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@H](CI)O2)C[C@H]1C1CC1 1990238800 GTDNOYDBPHDUCD-RLFYNMQTSA-N 435.346 4.539 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCCC[C@H](Br)C1 2003408864 AFAVBAKVMITFQM-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE CC1(C)C[C@@H](Br)CN1C(=O)c1cc(Br)cc(Br)c1 2037329917 XCWLHIHSABLPDM-LLVKDONJSA-N 439.973 4.600 50 10 IJGE Cc1nc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)sc1CBr 2066627229 KJHIPIGZNXXKNO-OAHLLOKOSA-N 434.325 4.600 50 10 IJGE O=C(N[C@H]1C[C@@H](CCBr)C1)c1ccc(Br)cc1Br 2078346520 JIZUVPQSIITTQT-WAAGHKOSSA-N 439.973 4.505 50 10 IJGE CC(C)N(C)C[C@@H](Br)CCc1ccc(I)c(Cl)c1 2086647686 BVYFKVKRLHUUOO-LBPRGKRZSA-N 444.582 4.981 50 10 IJGE Brc1ccc([C@@H](CI)OC[C@@H]2CCCCCO2)cc1 2096323528 ZJQSQJMKKXDYLJ-LSDHHAIUSA-N 439.131 4.901 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H]3CC[C@@H](CN3C[C@H](CBr)C(C)(C)C)[C@H]2C1 2106788886 UHIGIMVZKLBFDX-AVEIZBFRSA-N 429.443 4.621 50 10 IJGE C[C@H](N(Cc1ccccc1)S(=O)(=O)N1CCC[C@H](CCBr)C1)C(C)(C)C 2123368101 BDDQILOQNQLOKJ-PKOBYXMFSA-N 445.467 4.665 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](Cl)C2 2134124757 NSXXKTSYBRKJCV-BNJNZJEJSA-N 431.552 4.596 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@H](Cl)c2cc(Br)c(Br)s2)C1 2137228866 QKXJNNFMNWUTHX-HNBZJPLGSA-N 448.629 4.768 50 10 IJGE CC(C)(C)OC(=O)Nc1cnn2c1N(C[C@@H](CBr)c1ccccc1)CCC2 2163064700 VQKGYTMHKLJVBH-MRXNPFEDSA-N 435.366 4.619 50 10 IJGE CCCC[C@@H](C)N(C)S(=O)(=O)c1cc(CBr)ccc1Br 2179861741 LVYGZMVRGKFKPN-LLVKDONJSA-N 427.202 4.543 50 10 IJGE Cc1c(Br)csc1C(=O)NC[C@@]1(CBr)C[C@H]1C(F)(F)F 2234514002 HDLKOEXBSVOUDS-KCJUWKMLSA-N 435.103 4.512 50 10 IJGE O=C(c1ccccc1I)N1C[C@@H](Br)CC12CCCCC2 2241033636 ZXQQROFJDKTCBR-LBPRGKRZSA-N 448.142 4.604 50 10 IJGE CC1CC(CBr)(CN2CCC23CCN(C(=O)OCc2ccccc2)CC3)C1 2246843142 RZTYMWRTDWYKIH-UHFFFAOYSA-N 435.406 4.675 50 10 IJGE COc1ccc([C@H](Br)C[C@@H]2CC[C@@H](C)O2)cc1I 2257353793 IWANRXZLKQXHHW-ADEWGFFLSA-N 425.104 4.693 50 10 IJGE CCCN(CC1CCN(C(=O)OC(C)(C)C)CC1)CC1(CBr)CC(F)C1 2265631359 CAYNSEPPEDYOCI-UHFFFAOYSA-N 435.422 4.859 50 10 IJGE C[C@]12CO[C@](CO[C@H](CI)c3cccc(Br)c3)(C1)C2 2266257604 WSWBVARHYDVHDI-KFWWJZLASA-N 437.115 4.511 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@@H](Br)CCC12CC2 2282987329 BYPFUJPKGINZTB-QMMMGPOBSA-N 425.523 4.774 50 10 IJGE O=C(N[C@H](CCBr)C(F)(F)F)c1cc(F)c(Br)cc1Cl 2282990290 PWCDBLQKTKFJJY-SECBINFHSA-N 441.444 4.687 50 10 IJGE N#CC(=Cc1cccc(NC(=O)c2ccccc2Cl)c1)C(=O)Nc1ccccc1C(=O)O 2297663224 PDPOEBMOANRCEV-UHFFFAOYSA-N 445.862 4.836 50 10 IJGE CCN(C)C[C@H](Br)CCc1cc(I)ccc1Cl 2307330954 TXMIPMKVUJDNDP-LLVKDONJSA-N 430.555 4.592 50 10 IJGE N#CC(=Cc1cc(Br)c(N2CCOCC2)o1)c1ccc(Br)cc1 2313565230 OHRPQKYRTWUXFA-UHFFFAOYSA-N 438.119 4.705 50 10 IJGE CCCOc1ccccc1C=CC(=O)NNC(=O)c1ccc(-c2ccc(C)c(C)c2)nc1C 2321103708 LCTBVFXKJYDXLP-UHFFFAOYSA-N 443.547 4.937 50 10 IJGE CC(C)(C)OC(=O)N1CC(OC2CCN(C[C@@](C)(CBr)C(C)(C)C)CC2)C1 2380166348 YSBJQYOMCDCPCG-OAQYLSRUSA-N 447.458 4.534 50 10 IJGE CCCCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccco1 38657575 ABFMHXDGEGRMCQ-QHCPKHFHSA-N 430.460 4.896 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(C)c4)ccc32)c1 38684831 TVKUYNIEHVCLBY-XMMPIXPASA-N 426.472 4.831 50 10 IJGE CCCCc1ccc(NC(=O)/C(C#N)=C\NCCc2ccc(Br)cc2)cc1 217171348 HGVFTYTUKRGCBR-MNDPQUGUSA-N 426.358 4.970 50 10 IJGE CCCCCCCCCCCCCC(=O)NCC(=O)NN=Cc1cccc(OC)c1O 254560217 QWYUMPLNSLDNJQ-UHFFFAOYSA-N 433.593 4.668 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CI)[C@H](c2ccc(Cl)c(F)c2)C1 382738644 YLGBHXMTISRGIP-RYUDHWBXSA-N 439.696 4.865 50 10 IJGE CCN(C[C@H](C)Br)C(=O)c1cc(Br)sc1Br 691308777 ZYLRJEMUAPBRLI-LURJTMIESA-N 433.991 4.519 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1[C@H]1CN(Cc2ccccc2)C[C@@H]1CI 725418563 QICHPAZBIHGYDP-LPHOPBHVSA-N 436.293 4.554 50 10 IJGE CCC[C@H](Cc1ccccc1)NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 727810681 CIHBQYFHFNAEMW-JNCRKEHCSA-N 437.547 4.898 50 10 IJGE O=C(NNc1ccc(OC(F)(F)F)cc1)C1CCN(c2nc3ccccc3s2)CC1 761599963 NBODZIQKJDFEAG-UHFFFAOYSA-N 436.459 4.555 50 10 IJGE CSc1ccc(NNC(=O)CNc2nc(C)nc3sc(-c4ccccc4)cc23)cc1 1141076762 ARBCRUNBYCLKGM-UHFFFAOYSA-N 435.578 4.944 50 10 IJGE C=CCNC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccccc2F)c1C 1531504998 QXFAISURRWXRKI-HMMYKYKNSA-N 442.494 4.695 50 10 IJGE C#CC[C@H](NC(=O)NNc1ccc(Br)cc1C(F)(F)F)c1ccccc1 1680515213 KUVWJTJVPGJBDP-HNNXBMFYSA-N 426.236 4.859 50 10 IJGE Cc1ccc(O)c([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(Cl)c(Cl)c2)c1 1865685905 OEIWDTGWWPNXNT-HXUWFJFHSA-N 441.318 4.779 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccccc2F)cc1 1865694317 SXCFDCVJCYGSEZ-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1cccc(F)c1 1865702619 CCOAQWBYLOGASR-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE C[C@H]([C@H]1CCCN(C(=O)OC(C)(C)C)C1)[C@H](CBr)NC(=O)OC(C)(C)C 1880760292 FPNHVPCILULRSL-ILXRZTDVSA-N 435.403 4.558 50 10 IJGE Fc1ccc2nc(CCl)n(-c3csnc3Br)c2c1Br 1926867542 DWONMLYRJMGZAR-UHFFFAOYSA-N 425.508 4.885 50 10 IJGE Cc1c([C@H](Br)c2ccc(Br)s2)nn(C)c1Br 1980169697 CJOPKTDLWXYIJW-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE Cc1cc(Br)ccc1S(=O)(=O)N(Cc1ccccc1)[C@H](CCl)C1CC1 2085732566 UHNFYWKYEIJZJI-GOSISDBHSA-N 442.806 4.966 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CCCN(C[C@H](CBr)CC3CC3)C2)C1 2112868325 IRBAGDXEOAZZAM-RXVVDRJESA-N 429.443 4.911 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@H](Br)C(F)(F)CC1 2115928349 HPXFXZBMTLFJFS-QMMMGPOBSA-N 437.531 4.799 50 10 IJGE CCCC(CBr)(CCC)CN1CCC[C@@H](N(CCO)C(=O)OC(C)(C)C)C1 2163063672 QVVOCCZOGIDDQC-GOSISDBHSA-N 449.474 4.662 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2CCN(C[C@@H](CBr)c3ccccc3)CC[C@H]2C1 2163065186 YDZFEIDKXWPIOK-SLFFLAALSA-N 437.422 4.744 50 10 IJGE O=C(c1ccc(OCc2ccccc2)cc1)N1C[C@@]2(CBr)CCC[C@]2(F)C1 2176639645 IXIVHEYPOLNKHZ-VXKWHMMOSA-N 432.333 4.995 50 10 IJGE CC1(C)CN(C(=O)c2cc(Cl)ccc2I)C[C@@H]1CCCl 2238449937 NCDLAVPFYLPLPH-JTQLQIEISA-N 426.125 4.672 50 10 IJGE O=C(c1cccc(I)c1)N1C[C@@H](Br)CC12CCCCC2 2241030855 MAFJQWJALOPLMX-ZDUSSCGKSA-N 448.142 4.604 50 10 IJGE COc1ccc([C@@H](Br)Cc2ccccc2OC)cc1I 2284999670 QWHJACAVEVDWJB-ZDUSSCGKSA-N 447.110 4.987 50 10 IJGE C[C@@H]1C[C@@H](Cl)CN(Cc2ccc(I)c(Br)c2)C1 2306220156 UQYMSSZWACLUAJ-MWLCHTKSSA-N 428.539 4.503 50 10 IJGE CC(=O)N(C=C(C#N)C(=O)Nc1ccccc1Sc1ccccc1)c1cccc(N)c1 2325339327 WKXFDHJHEMRIDL-UHFFFAOYSA-N 428.517 4.819 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1c(OCc2ccccc2)ccc2ccccc12 2328818703 PYCZHTCVGGBTHO-SFHVURJKSA-N 447.535 4.782 50 10 IJGE CC(=O)Nc1ccc2nc(NC(=O)C(C#N)=Cc3ccc(Br)cc3)sc2c1 2329663455 BEVKTFSRFPXCNP-UHFFFAOYSA-N 441.310 4.563 50 10 IJGE COc1c(Br)cc(Br)cc1C=C(C#N)c1ncccc1[N+](=O)[O-] 2331059262 AJSALKKARDWCJB-UHFFFAOYSA-N 439.063 4.588 50 10 IJGE FC(F)(CBr)C(F)(F)CNCc1cccc(Br)c1Cl 2336541008 ILPFABIGMVEWHC-UHFFFAOYSA-N 427.461 4.858 50 10 IJGE Cn1nc(C(F)(F)F)c(CBr)c1N(Cc1ccccc1)[C@H]1COC(C)(C)C1 2365280875 BBJKMHUWSPFARE-CQSZACIVSA-N 446.311 4.908 50 10 IJGE O=C(c1ccc(OCc2ccccc2)cc1)N(CCCBr)C1CCOCC1 2381013045 YYPGYTACINZGFJ-UHFFFAOYSA-N 432.358 4.672 50 10 IJGE Cc1ccccc1[C@@H](C(=O)NC1CCCCC1)N(CCc1ccccc1)C(=O)CCl 4672304 UWGAGALUDHWFNG-DEOSSOPVSA-N 426.988 4.795 50 10 IJGE COc1ccc(/C=N/NC(=O)Cc2ccc(Cl)cc2)cc1CSc1ccccn1 27520750 DKEXAVOUSPSTOE-AFUMVMLFSA-N 425.941 4.729 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)NCc2ccco2)ccc1OC(=O)/C=C/c1ccccc1 40926698 AGHMINXCIRTTDA-DTXJCZLISA-N 442.471 4.520 50 10 IJGE CNC(=O)/C(C#N)=C1\S[C@H](Cc2ccccc2Cl)C(=O)N1c1ccc(C(C)C)cc1 101240526 DSTMRUIZPMYUSH-SEDGDDRASA-N 439.968 4.636 50 10 IJGE COc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4Cl)nc3c2)c(OC)c1 169926782 HGSYPAWWOAWXLN-DHRITJCHSA-N 434.883 4.664 50 10 IJGE CCOc1c(Br)cc(C=NNC(=O)c2oc3ccccc3c2C)cc1OC 254671937 XEKSZQWZGNDKIH-UHFFFAOYSA-N 431.286 4.675 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2ccc(Cl)c(F)c2)[C@@H](CI)C1 382738643 YLGBHXMTISRGIP-NWDGAFQWSA-N 439.696 4.865 50 10 IJGE C[C@@H]1[C@@H](Br)C[C@H]2CC[C@H]1N2c1ncc(Br)cc1Br 686175221 DPFFOHBFKAUJBZ-ZIYJGFGOSA-N 438.989 4.747 50 10 IJGE CC[C@@H](C[C@H](C)Cl)NC(=O)c1cc(Br)ccc1I 716924911 LRXBJTDFUKLOBX-WPRPVWTQSA-N 444.538 4.580 50 10 IJGE CC[C@@H](Oc1ccccc1C(C)C)C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1 729968260 LNWRTYNMHSZOAL-GOSISDBHSA-N 437.462 4.517 50 10 IJGE O=C(NNc1ccc([N+](=O)[O-])cc1)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 775621944 XEUMVDHPQWWXNT-UHFFFAOYSA-N 433.346 4.950 50 10 IJGE O=S(=O)(NCC[C@H]1COc2ccccc2O1)c1cccc(S(F)(F)(F)(F)F)c1 777999522 CEDUIRFCOUNAAG-LBPRGKRZSA-N 445.431 4.852 50 10 IJGE O=C(NNc1cccc(F)c1F)N[C@@H](Cc1ccccn1)c1ccc(Br)cc1 788870277 NAOUKTZHNCSHJH-SFHVURJKSA-N 447.283 4.732 50 10 IJGE O=C(NN=Cc1ccc(-c2ccc(F)cc2[N+](=O)[O-])o1)c1ccccc1Br 1084529058 RBAFMYOCQSCDOS-UHFFFAOYSA-N 432.205 4.520 50 10 IJGE C=CCCC1(CNC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)CCCC1 1683823340 KADUONATESCYPT-UHFFFAOYSA-N 439.531 4.875 50 10 IJGE Cc1cccnc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccc1Cl)CCC2 1772743746 HBCXDVVJOWCPFC-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE CCc1cc(Br)ccc1OCC(=O)NN=Cc1c(OC)ccc2ccccc12 1772755992 XBECQUYCIALYLU-UHFFFAOYSA-N 441.325 4.702 50 10 IJGE Cn1cccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2Cc1ccccc1Cl 1865698983 HTMZTVATVNROHV-OAQYLSRUSA-N 441.922 4.808 50 10 IJGE COc1ccc2c(c1)c(/C=N\NC(=O)c1ccc(-c3ccc(C)c(C)c3)nc1C)cn2C 1865761558 MWRLNZJHUGFRJW-VYYCAZPPSA-N 426.520 4.938 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1sncc1Br 1915126039 MGEZQRSPXZLQHF-GFCCVEGCSA-N 432.181 4.722 50 10 IJGE O=C(c1ccc(Br)o1)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915315611 XNKMYLMQBKNGDC-CQSZACIVSA-N 427.136 4.858 50 10 IJGE Clc1ccc(I)c(CN[C@@H](CBr)CC2CC2)c1 1942808071 NUTJYKURWUSLLA-GFCCVEGCSA-N 428.539 4.598 50 10 IJGE CC(C)(C)OC(=O)N[C@H](Cc1ccc(Br)cc1)[C@@H](F)CBr 1951578146 VHJJOQPSOWWTCM-QWHCGFSZSA-N 425.136 4.618 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1C(=O)c1c(Br)cccc1Br 2033089869 YKNNHRIVHXLXDX-RKDXNWHRSA-N 439.973 4.600 50 10 IJGE CC1([C@@H](CBr)NC(=O)c2c(Br)cccc2Br)CC1 2033130752 UOOLNUHXDQVWMF-SNVBAGLBSA-N 439.973 4.505 50 10 IJGE CC(C)[C@H](Cl)c1cn(-c2cc(I)ccc2Br)nn1 2057426208 BOMDNZZFTNXUBW-LBPRGKRZSA-N 440.510 4.570 50 10 IJGE Cc1nn(C)c(C[C@@H](Br)c2cccc(Br)c2)c1Br 2072279739 LYRREEORBHYQLK-LLVKDONJSA-N 436.973 4.932 50 10 IJGE Clc1cc(CN2CC[C@H](Br)C3(CC3)C2)ccc1I 2086658707 PSGAZFAKEBYLCL-ZDUSSCGKSA-N 440.550 4.694 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CC2(CBr)CCCC2)CC[C@H]1C(F)(F)F 2106780838 BWIZRSGYUJFTJO-ZIAGYGMSSA-N 443.348 4.719 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2CN(CC3(CBr)CCCCCC3)C[C@@H]2C1 2112471608 HBVJXUVXVNFIEP-ZWKOTPCHSA-N 429.443 4.911 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC2(CCl)CCC1CC2 2122355259 YTUKKFWVVGYEBK-UHFFFAOYSA-N 427.589 4.897 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC2(CCC(Cl)CC2)C1 2124669251 MDNDKSPHTWCZMH-UHFFFAOYSA-N 427.589 4.897 50 10 IJGE Clc1cccc(N2CC[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1CBr 2129053540 NNDWVVPQESMCDL-NHCUHLMSSA-N 435.793 4.715 50 10 IJGE Brc1ccc([C@H](Br)[C@H]2CCn3ncnc3C2)c(Br)c1 2138874466 WNFDRFCNOZNGDM-ISVAXAHUSA-N 449.972 4.502 50 10 IJGE Clc1cnn2c1CN(c1c(CBr)ccc(Br)c1Cl)CC2 2154355832 CYPPNROTWBTITR-UHFFFAOYSA-N 439.966 4.868 50 10 IJGE CN(Cc1ccccc1)[C@@]1(Cn2c(CCl)nc3ccc(Br)cc32)CCOC1 2155116206 QYWMCWNXUHGDRN-OAQYLSRUSA-N 448.792 4.829 50 10 IJGE O=[N+]([O-])c1cc(CBr)ccc1N1CC[C@]2(CCN(Cc3ccccc3)C2)C1 2163333406 HFTLCPXUGSGPTB-NRFANRHFSA-N 430.346 4.592 50 10 IJGE CCCc1nc(C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)nc(O)c1CBr 2187324273 HIXCQYLFWHQTFB-AYHJJNSGSA-N 430.390 4.940 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@@H]1C[C@H](C(C)(C)C)CN(C(=O)OC(C)(C)C)C1 2196908332 XFGRECCYHAZLPH-GMRIPVOYSA-N 445.442 4.538 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CCN(CCCCCI)C2 2214705417 ROMHANBRYIZSLT-UHFFFAOYSA-N 444.357 4.997 50 10 IJGE Fc1ccc([C@H](CI)O[C@@H]2CCN(Cc3ccccc3)C2)cc1 2244771415 LYLOIEAXECLVRO-MOPGFXCFSA-N 425.285 4.593 50 10 IJGE CC1=C(C#N)C(=O)N(CC(C)C)C(=O)C1=Cc1ccc(-c2ccc(Br)cc2)o1 2294005062 WMRHOXJJWOKTRF-UHFFFAOYSA-N 439.309 4.957 50 10 IJGE C[C@@]1(CBr)CCCN1Cc1ccc(Cl)c(I)c1 2300241591 ACHRMZKZAZATKT-ZDUSSCGKSA-N 428.539 4.694 50 10 IJGE C[C@@]1(CCl)CCN(Cc2ccc(I)c(Br)c2)C1 2306220507 YGVDVNCIMIBDGH-ZDUSSCGKSA-N 428.539 4.505 50 10 IJGE C[C@@H]1OCC[C@@]1(CCl)Cc1ccc(I)c(Br)c1 2306221172 FEYQRTKQIDZWHX-ZANVPECISA-N 429.523 4.630 50 10 IJGE CCOc1ccc(Br)cc1C=C(C#N)C(=O)NCCc1c[nH]c2ccccc12 2313556984 PYZHGPPXQKTYIW-UHFFFAOYSA-N 438.325 4.595 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)Nc2ccc(F)cc2)cc(Br)c1OCC 2313630329 GGGRYJDPOXTYFL-UHFFFAOYSA-N 433.277 4.931 50 10 IJGE COc1ccc(CNC(=O)C(C#N)=Cc2ccc(OCc3ccccc3)c(OC)c2)cc1 2313676912 XSDVTHIZHKUOTI-UHFFFAOYSA-N 428.488 4.506 50 10 IJGE N#CC(=Cc1ccc(OCc2ccc(Cl)cc2)cc1)C(=O)NCc1ccc2c(c1)OCO2 2313738904 XSCJXCSKELYZRU-UHFFFAOYSA-N 446.890 4.871 50 10 IJGE COC[C@]1(C)C[C@]1(CBr)Cc1ccc(Cl)c(I)c1 2315552405 DQNCOYANLPQURL-KBPBESRZSA-N 443.550 4.925 50 10 IJGE N#CC(=CNCCc1ccc(Br)cc1)C(=O)Nc1cccc(Cl)c1Cl 2324381403 MGLSKBJWPWVASI-UHFFFAOYSA-N 439.140 4.934 50 10 IJGE CCOc1ccc(CCNC=C(C#N)C(=O)Nc2cccc3c(O)cccc23)cc1OCC 2324915518 JJZSXAMTDUZAPF-UHFFFAOYSA-N 445.519 4.521 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C2)C1 2345012091 YJTQBFBHYZKAST-QWHCGFSZSA-N 443.348 4.575 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@H]2CC[C@H]1[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]21 2353832320 YIYXKVWNFBMQHU-GFEQUFNTSA-N 429.443 4.621 50 10 IJGE CCOC(=O)c1ccc(OCC(=O)N/N=C/c2ccc3c(c2)c2ccccc2n3CC)cc1 14027051 PRQVBUIWDBHRTN-JVWAILMASA-N 443.503 4.520 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(=O)Nc1ccccc1[N+](=O)[O-] 33423595 YRYOBBCFQSDLSO-XFXZXTDPSA-N 438.783 4.962 50 10 IJGE C=CCOc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccs2)cc1 38656431 SUSPUCMBQUWDPI-QFIPXVFZSA-N 430.485 4.750 50 10 IJGE CC[C@H](C)NC(=O)c1oc2c(c1C)/C(=N/NC(=O)Cc1coc3cc(C)cc(C)c13)CCC2 40826821 DYOUNARCJSUTLE-QROGEYBXSA-N 449.551 4.879 50 10 IJGE O=C(CCCSc1nc2ccc([N+](=O)[O-])cc2s1)N/N=C/C=C/c1ccccc1 58989844 HFFKTEDUCDDMQT-FBOXBXQOSA-N 426.523 4.892 50 10 IJGE CCOc1cc(/C=N\NC(=O)Cc2ccc(N)cc2)ccc1OCc1cccc(Cl)c1 169900487 YJCNXAKCCPASKV-DICXZTSXSA-N 437.927 4.593 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3cccs3)n2-c2ccccc2)cc1 254294653 YCYBRBCOUDBWOB-UHFFFAOYSA-N 433.562 4.547 50 10 IJGE COc1ccc(C=NNC(=O)COc2ccc(C(C)(C)CC(C)(C)C)cc2)c(OC)c1 254451737 LPDIPLLAHCYTOJ-UHFFFAOYSA-N 426.557 4.947 50 10 IJGE CC[C@@H]1CCC[C@H](O[C@](C)(CI)CNC(=O)OC(C)(C)C)C1 299983380 WIFIBBPYTSMREM-JKIFEVAISA-N 425.351 4.690 50 10 IJGE Cc1cc(NNC(=O)c2cc(-c3ccccc3)nc3cc(Br)ccc23)ncn1 734255625 HAFYWWLLUZLAKI-UHFFFAOYSA-N 434.297 4.520 50 10 IJGE CC1(C)CN(C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)C[C@@]2(CCOC2)O1 797612150 QUJPNCCMLLMTIC-WMLDXEAASA-N 438.899 4.708 50 10 IJGE Cc1cc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)ccc1N1CCSCC1 799394881 LWKYLDCCHOCFDQ-UHFFFAOYSA-N 435.475 4.587 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2-n2cccc2)ccc1OCc1ccc(F)cc1 1084122673 GMRNGGVIYDWXSQ-UHFFFAOYSA-N 443.478 4.968 50 10 IJGE C=CCNC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(C)cc3)c2C)cc1 1358122768 DZMQOFRSPNEERO-XQNSMLJCSA-N 438.531 4.864 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)Nc3cccc(-n4ccnc4O)c3)c2C)cc1 1534563486 CPPHDLIFHWTSJB-KGENOOAVSA-N 437.503 4.840 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1 1608521054 YLVRCMLUCAZDFI-JLHYYAGUSA-N 446.359 4.910 50 10 IJGE C=CCCC[C@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)c1ccccc1 1651058082 VMHKKKTUHMJQKB-QFIPXVFZSA-N 442.563 4.871 50 10 IJGE C=CCCC1(CNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)CCCC1 1683823043 AZWCUASKLMAFHC-UHFFFAOYSA-N 435.568 4.513 50 10 IJGE Cc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865698686 AIXHYSKCYBHDRF-NRFANRHFSA-N 433.874 4.732 50 10 IJGE N#C/C(=C(/O)CN1C(=O)COc2ccc(Cl)cc21)c1nc(-c2ccc(F)cc2)cs1 1872753324 RHWLNVOVCSORGC-SDXDJHTJSA-N 441.871 4.821 50 10 IJGE CC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1[C@@H](CBr)NC(=O)OC(C)(C)C 1880767772 SBAICNRSXNAYJK-RBSFLKMASA-N 435.403 4.558 50 10 IJGE O=C(N[C@@H](CCl)[C@H]1CC=CCC1)c1scc(Br)c1Br 1885059520 AYUNOEWCKJQSKB-WPRPVWTQSA-N 427.589 4.967 50 10 IJGE Brc1cccc([C@@H](CI)O[C@@H]2COC3(CCC3)C2)c1 1889722798 QATHZMCDRNBSSU-UONOGXRCSA-N 437.115 4.653 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@]1(CCC[C@@H](CI)O1)C2 1949545466 AGKZDVKFMWUETI-HNAYVOBHSA-N 449.373 4.931 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)c1cc(Br)sc1Br 2020192611 PJNNAJKXRMTLBE-LJGSYFOKSA-N 446.002 4.519 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc([S@@](C)(=O)=NC[C@H](Br)C(F)(F)F)cc1 2044703116 QYOCEGNFFPPMOW-UOXLDJKESA-N 445.301 4.816 50 10 IJGE C[C@H](CCBr)CCN1CC[C@@H](C(F)(F)F)[C@@H](CNC(=O)OC(C)(C)C)C1 2106784951 MGLONUUWGYATDE-QLFBSQMISA-N 445.364 4.823 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CCC[C@@H](CN(C[C@@H](CBr)CC3CC3)C1)C2 2135002296 VMNGYLDVIJLLTC-OPYAIIAOSA-N 429.443 4.815 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@H]1CN(C(=O)[C@H](Br)C1CCCC1)C1CC1 2167033872 POAQZVOOEJCTNH-ZWKOTPCHSA-N 443.426 4.721 50 10 IJGE CCN(CCCCCI)C[C@@H]1CCCCN1C(=O)OC(C)(C)C 2211186927 RAMOSQGGGNURQU-INIZCTEOSA-N 438.394 4.703 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CCC[C@]23CC[C@@](C)(CI)O3)C1 2213351908 DOTMMIBUZMOBDZ-LTDCPUDJSA-N 449.373 4.786 50 10 IJGE CCC[C@H](CCBr)CNC(=O)c1cc(C)ccc1I 2232157573 REBKDXBPPVRZAN-GFCCVEGCSA-N 438.147 4.531 50 10 IJGE CCN[C@@H](Cc1cc(Br)cc(Br)c1)C1CC(Br)C1 2263519523 SQANLMRKDWJQGL-DBRPNBKGSA-N 440.017 4.906 50 10 IJGE CS(=O)(=O)C1CC([C@H](Br)c2cc(Br)c(Cl)cc2F)C1 2269762835 WBJCNZQKEMRKCX-FOEZSWGGSA-N 434.552 4.501 50 10 IJGE CNC(=O)C(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc(OCCC(C)C)c(C)c1 2296539107 BXWJETBMMHVCJX-UHFFFAOYSA-N 428.536 4.926 50 10 IJGE Cc1ccc(C=CC(=O)NN=C2C(=O)N(Cc3ccccc3Cl)c3ccccc32)cc1 2326841481 JKUCNZWNOSKZNL-UHFFFAOYSA-N 429.907 4.729 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]1C(F)(F)F 2353827466 ZFSSLSKUUYEUHC-ZNMIVQPWSA-N 445.364 4.916 50 10 IJGE Cc1scc(C(=O)N2CC[C@@H](Br)C[C@H]2C(F)(F)F)c1Br 2369596636 QXBHMZWIXMCVJQ-APPZFPTMSA-N 435.103 4.749 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@H](CCNC(=O)C(F)(F)F)c2ccccc21 2382184205 IQQVIXMCFWAIAM-CABCVRRESA-N 435.328 4.716 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccs4)ccc32)cc1 38650637 TXHZBMNHUKBPMD-JOCHJYFZSA-N 432.501 4.974 50 10 IJGE CCCCCCCOc1ccc(C(=O)NNC(=O)c2ccccc2Br)cc1 100153804 YGQYCPHUBVRTMH-UHFFFAOYSA-N 433.346 4.873 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NC(C)C)ccc1OC(=O)CCc1ccc(C(C)(C)C)cc1 207163997 WVGZVYINHJWHJZ-QNGOZBTKSA-N 448.563 4.962 50 10 IJGE COc1ccccc1C(=O)NN=Cc1ccccc1OCc1cccc(Br)c1 252485812 AKFACTXZBAQARU-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE O=C(COc1ccc(Cl)cc1Cl)NN=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 252612907 IWYRBPSBZVTNJS-UHFFFAOYSA-N 434.235 4.691 50 10 IJGE CCCCN(CC)c1ccc([N+](=O)[O-])cc1C=NNC(=O)COc1cccc2ccccc12 254385504 DYSXGTXFIZNRKP-UHFFFAOYSA-N 448.523 4.904 50 10 IJGE CC(=O)C(=O)CCC[C@H]1C[C@@]2(C)C(=CC1=O)[C@H](Cl)C[C@H]1[C@@H]3CC[C@H](O)[C@@]3(C)CC[C@@H]12 328578073 WFQUYBYCFZVLQH-WWQQHJLRSA-N 435.004 4.651 50 10 IJGE CC1(C)C[C@H](Cl)C[C@@H](NC(=O)c2ccc(I)c(Cl)c2)C1 703341852 QDUAMDVJHJGYEA-GHMZBOCLSA-N 426.125 4.861 50 10 IJGE C[C@@H](CCCBr)NC(=O)c1scc(Br)c1Br 705510808 KYHAUHBHLCLVNF-LURJTMIESA-N 433.991 4.567 50 10 IJGE CC(C)C[C@H](C)OC1(CI)CCN(C(=O)OC(C)(C)C)CC1 725343867 FXBDDXPECWDMTE-AWEZNQCLSA-N 425.351 4.642 50 10 IJGE COc1ccc(C(=O)NN=Cc2c(C(C)(C)C)nn(-c3ccccc3)c2Cl)c(OC)c1 758120117 ITEMJUXSZJUPIT-UHFFFAOYSA-N 440.931 4.604 50 10 IJGE COc1ccc(C(=O)NN=Cc2ccc(Br)cc2SC(C)C)c(OC)c1 779777181 SFOOKPCQPXWHNU-UHFFFAOYSA-N 437.359 4.731 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1ccc(Br)c(C(F)(F)F)c1 1557584001 IKPLEJTWJKDHEO-UHFFFAOYSA-N 443.248 4.831 50 10 IJGE C#C[C@@H](CCC)NC(=O)NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1 1683680748 GOBRDLUVJLXIMQ-QHCPKHFHSA-N 441.531 4.679 50 10 IJGE CCCCCN1C(=O)C(=NNC(=O)[C@H](C)Oc2ccc(Cl)cc2C)c2cc(C)ccc21 1772720098 CGAUEPWWTWYLIW-KRWDZBQOSA-N 441.959 4.781 50 10 IJGE Cc1ccnc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(Cl)cc2)CCC3)c1 1772743464 BUVNJIIFVRFVAH-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE CCCOc1c(OC)cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2-c1ccccc1 1865694418 YAKDQDXHHRGTQK-JOCHJYFZSA-N 444.535 4.840 50 10 IJGE CC(C)(NC(=O)[C@@H](c1ccc(Cl)cc1)C1CC1)C(=O)Nc1ccc(SC#N)cc1 1866995575 KNASOBGBCXPXNH-LJQANCHMSA-N 427.957 4.940 50 10 IJGE O=C(NCC1CC2(CC[C@@H]2Cl)C1)c1scc(Br)c1Br 1882856110 PQLHSZCFONNAKE-GAAAAHHMSA-N 427.589 4.801 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1Cc1cccc(Br)c1Br 1943884215 PBJBCEDPBMNCOB-KOLCDFICSA-N 425.990 4.959 50 10 IJGE CN(Cc1cc(Br)ccc1Br)C1(CBr)CCC1 2006501515 WWNFAZOEPUUBAA-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1F 2008321096 DWOMTEGJLMMMDF-UHFFFAOYSA-N 434.758 4.844 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)C[C@H]1C[C@@H](Br)C1 2026583247 JQSYTRYKZFVORN-PHIMTYICSA-N 428.539 4.550 50 10 IJGE CCC[C@@](C)(CBr)NC(=O)c1cc(Cl)ccc1I 2029944887 LJXTYTLQSHNODG-ZDUSSCGKSA-N 444.538 4.628 50 10 IJGE C[C@@H]1CN(Cc2cc(Cl)ccc2I)[C@H](C)C[C@@H]1Br 2032205019 VZCRQCQLVGHMSV-BREBYQMCSA-N 442.566 4.938 50 10 IJGE C[C@H]1OCC[C@H]1COc1c(Br)cc(Br)cc1CBr 2057465937 VEQMJOAGZTWMGA-BDAKNGLRSA-N 442.973 4.910 50 10 IJGE FC(F)(F)c1cc(I)ccc1NCC1CC(Br)C1 2076166174 XIAUDQPAJMPQJO-UHFFFAOYSA-N 434.037 4.895 50 10 IJGE CC[C@@H](C)N(CCCl)C(=O)c1ccc(Br)cc1I 2086147494 NTVVQLMQLZHWDH-SECBINFHSA-N 444.538 4.533 50 10 IJGE CC(C)c1nc(Br)c(Br)n1CCc1nc(CCl)cs1 2087651007 RUFPZGZKWULUKX-UHFFFAOYSA-N 427.593 4.970 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)C2CCS(=O)(=O)CC2)cc1Br 2089856223 BYGCPZHYBKALMV-ZDUSSCGKSA-N 430.589 4.625 50 10 IJGE CCC[C@@]1(CNC(=O)[C@@H](Br)C2CCCC2)CCCN1C(=O)OC(C)(C)C 2110720097 BEONVKSVOQMOTD-JXFKEZNVSA-N 431.415 4.626 50 10 IJGE Cc1cc(Br)c(CCl)c(N2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1 2116805421 GVKIHBZMWBHGNL-RTWAWAEBSA-N 435.793 4.586 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@H](Cl)C2(CCCC2)C1 2117755845 JTSYHGNUWJXYHP-VIFPVBQESA-N 427.589 4.897 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)[C@@H](Br)C2CCCC2)c2ccccc21 2167035464 YZUDAVMROBUMOF-AEFFLSMTSA-N 437.378 4.943 50 10 IJGE Clc1ccc(C[C@]23CO[C@](CI)(C2)C3)cc1Br 2216263017 TXGYBEMDZBHHQC-BETUJISGSA-N 427.507 4.629 50 10 IJGE COc1ccc([C@@H](Cl)c2csnc2Br)cc1I 2248883589 UGKRWAGGSPGNQH-SNVBAGLBSA-N 444.519 4.847 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@@H](Br)[C@H]1C[C@H](S(C)(=O)=O)C1 2269776402 NULBWHAAYBKYOS-RVBZMBCESA-N 430.589 4.670 50 10 IJGE Cc1c(Br)ccc([C@H](Cl)[C@H]2C[C@H](S(C)(=O)=O)C2)c1Br 2269777925 YQHPPHQWPSMLFF-JRKPZEMJSA-N 430.589 4.623 50 10 IJGE C[C@H]1OCC[C@@]1(CBr)Cc1cc(I)ccc1Cl 2307274152 JZZRDPGBIXWART-RNCFNFMXSA-N 429.523 4.677 50 10 IJGE COc1ccc(NC(=O)C(C#N)=Cc2cc(Br)c(OC(C)C)c(OC)c2)cc1 2313681207 UCMNFCAEVFRADN-UHFFFAOYSA-N 445.313 4.799 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@H](Cc2cccc(C)c2)C(=O)N1c1ccc(C(C)C)cc1 2314592735 ARJHFUCZLOQMEL-HSZRJFAPSA-N 445.588 4.847 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCCc2ccccc2)ccc1OCCc1ccccc1 2314739990 PDDQKMNISXONKX-UHFFFAOYSA-N 426.516 4.583 50 10 IJGE CC[C@@H]1[C@H](CBr)CCN1Cc1ccc(Cl)cc1I 2318526367 IUMAXGBHBHRXTJ-IINYFYTJSA-N 442.566 4.940 50 10 IJGE O=C(CSc1nc2ccccc2[nH]1)NN=Cc1ccc(OCCCc2ccccc2)cc1 2323081419 KMWFOHHZOMJLBV-UHFFFAOYSA-N 444.560 4.817 50 10 IJGE C[C@@]12CN(Cc3ccc(I)c(Br)c3)C[C@@]1(CCl)C2 2325226068 LRKNFBOAFQDZRR-KGLIPLIRSA-N 440.550 4.505 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H](Br)[C@H](C2CC2)C1 2327406983 XKWIXBAXPQPORB-QWHCGFSZSA-N 440.550 4.550 50 10 IJGE Fc1ccc(C(F)F)c(CO[C@@H](CCl)[C@H](I)CCl)c1 2338247945 AZFKVDRPYPOUKG-MNOVXSKESA-N 427.031 4.930 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccccc1C(F)(F)F 2343414075 KKDSHWGKSOBSGZ-OAHLLOKOSA-N 430.264 4.806 50 10 IJGE C=CCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccc(C)cc3)c(OCC)c2)C1=O 38607773 YBKHYWTURJJCRB-HYARGMPZSA-N 442.515 4.751 50 10 IJGE Cc1cccc(NC(=O)/C(C#N)=C\c2c(Oc3ccccc3)nc3c(C)cccn3c2=O)c1 39858505 CAMOBSARGCSFBG-CYVLTUHYSA-N 436.471 4.649 50 10 IJGE CC(CBr)(CBr)Cc1cc(Br)cc2c1OCC2 228557004 GVPHWWZZWWJZOZ-UHFFFAOYSA-N 426.974 4.723 50 10 IJGE CC[C@@H]1CCCC[C@@H]1O[C@@](C)(CI)CNC(=O)OC(C)(C)C 231311143 LGSLTZSJOZMFRC-KEYYUXOJSA-N 425.351 4.690 50 10 IJGE CCOc1cccc(-c2cc(C(=O)NN=Cc3ccccc3[N+](=O)[O-])c3ccccc3n2)c1 252629786 UNQRQDWFADROFS-UHFFFAOYSA-N 440.459 4.973 50 10 IJGE CCCC[C@H](CC)CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1I 299983303 VXSXVTQFBVRSGL-RRFJBIMHSA-N 425.351 4.642 50 10 IJGE Oc1ccc(Br)c([C@H]2CN(Cc3ccccc3)C[C@@H]2CBr)c1 382681070 BATZFQIYUFOEGO-YOEHRIQHSA-N 425.164 4.765 50 10 IJGE FC(F)(F)c1cc(Br)c(CBr)c(I)c1 575696095 RVNPYKNCJUURSF-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE CCC[C@@H](CCBr)NC(=O)c1scc(Br)c1Br 716817416 HMJCHUZUJUHVNU-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE Cc1cc(Br)cc(C)c1CNC(=O)NNC(=O)c1c(Cl)cccc1Cl 727843925 QQNLRROCMWQUFV-UHFFFAOYSA-N 445.144 4.517 50 10 IJGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 798048558 GCUYYGNNQNGQRS-SAABIXHNSA-N 440.956 4.662 50 10 IJGE O=C(NNC(=O)c1ccc(COc2ccccc2)o1)N[C@@H]1C[C@H]1c1ccc2ccccc2c1 798048695 MLRARDDIMNYULT-XZOQPEGZSA-N 441.487 4.512 50 10 IJGE Cc1ccc(OCc2ccccc2)c(NC(=O)NNC(=O)c2cccc3cccnc23)c1 799515012 PRZZZXXLCPIRAG-UHFFFAOYSA-N 426.476 4.589 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(C(=O)NN=Cc3cc([N+](=O)[O-])ccc3Cl)cc2)c1 1084230554 DENPPQWPQCLTFL-UHFFFAOYSA-N 436.855 4.573 50 10 IJGE C/C(=C/C(=O)NNc1ccccc1I)c1cccc(C(F)(F)F)c1 1636930584 WQACZUAUXMBWKJ-LUAWRHEFSA-N 446.210 4.857 50 10 IJGE CCc1nn(CC)c2c1[C@@H](c1cccc(OC)c1OCc1cccc(C)c1)C(C#N)=C(N)O2 1865706557 ZGXWGBZKVZHPSR-QFIPXVFZSA-N 444.535 4.580 50 10 IJGE COCCOc1ccc(/C=C(\C#N)C(=O)N(C)CCC2(c3ccccc3)CCCC2)cc1 1866386413 YDVLMUDRNCBBQG-BSYVCWPDSA-N 432.564 4.979 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1cc(OC)c(OC)c(OC)c1 1915099078 OMFFRKKQGLXNEL-KRWDZBQOSA-N 436.346 4.528 50 10 IJGE C[C@H]1CCN(Cc2ccc(Br)cc2Br)C[C@@H]1Br 1943851830 TWJYGIRAXKRUMB-ZANVPECISA-N 425.990 4.817 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@H]1CC[C@H]1NC(=O)OCc1ccccc1 1999516121 XTMPRXKSWGPYNT-HBMCJLEFSA-N 431.374 4.554 50 10 IJGE CC1(C)CN(Cc2cc(Br)ccc2Br)C[C@@H]1Br 2006496757 LXCYCHHPLGSAQW-LBPRGKRZSA-N 425.990 4.817 50 10 IJGE CC(C)(CCl)CCCNc1ncc(I)cc1Br 2015757672 AVXHUMQNWCPPPC-UHFFFAOYSA-N 431.543 4.906 50 10 IJGE CC1(C)[C@@H](Br)CCN1Cc1ccc(I)c(Cl)c1 2026560615 LJCHLJPUOAKSDR-LBPRGKRZSA-N 428.539 4.692 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)C1CC(CBr)C1 2026563649 LYYOEGBIRJBCHL-UHFFFAOYSA-N 428.539 4.550 50 10 IJGE C[C@H]1CCO[C@@H]1COc1c(Br)cc(Br)cc1CBr 2034995994 QTCVYCQOQOLTBS-QPUJVOFHSA-N 442.973 4.910 50 10 IJGE FC(F)C1CC(O[C@H](CI)c2ccccc2Br)C1 2035655297 QDAYRLBMPBTUFZ-SHVIVCPWSA-N 431.058 4.986 50 10 IJGE Clc1cc(C[C@@H](CBr)C2CCOCC2)ccc1I 2086664564 JFKLNGKLTVWRKJ-LBPRGKRZSA-N 443.550 4.925 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CC2(CBr)CCCC2)C[C@@H]1C(F)(F)F 2106784126 GGPNROBYGBDZCD-KBPBESRZSA-N 443.348 4.577 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1 2107029678 JTKHPDXVGMZSOG-LJQANCHMSA-N 436.375 4.654 50 10 IJGE BrCCCN(Cc1ccccc1)C[C@@H]1CC1(Br)Br 2208936571 AJCDNPYOXGXASU-ZDUSSCGKSA-N 440.017 4.780 50 10 IJGE CC(C)(C)OC(=O)NCC[S@](=O)(=NCCCCCCBr)c1ccccc1 2231091359 IPEIUVMKZBDZEU-AREMUKBSSA-N 447.439 4.994 50 10 IJGE C[C@@H](c1nncs1)n1c(CCl)nc2cc(Br)c(Br)cc21 2234072143 NOHFFHMCVDTXCZ-LURJTMIESA-N 436.560 4.761 50 10 IJGE C=CC[C@]1(CBr)CCCCN1C[C@H]1CC1(Br)Br 2250407547 WNEOFGRVWYPBKL-VXGBXAGGSA-N 430.022 4.688 50 10 IJGE COc1ccc([C@@H](Br)C2(C)CCOCC2)cc1I 2257373960 PEAFJQLLMNIEBV-CYBMUJFWSA-N 425.104 4.553 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)s1 2301086073 KNSVWDFOLQYMSV-HFFULBPTSA-N 445.547 4.866 50 10 IJGE Cc1cccc(C)c1-n1c(C)cc(C=C(C#N)C(=O)N2CCN(c3ccccc3)CC2)c1C 2313567136 HEOCNVPXSNMBMV-UHFFFAOYSA-N 438.575 4.967 50 10 IJGE CCCNC(=O)C(C#N)=Cc1ccc(OC(=O)c2ccc(Cl)c(Cl)c2)c(OC)c1 2314741373 XZRPZGUAVQMUFG-UHFFFAOYSA-N 433.291 4.654 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC(F)(F)C[C@H]1CN(CCCCCBr)C2 2320884466 LAHBCSAYTNSNNW-YOEHRIQHSA-N 425.358 4.566 50 10 IJGE O=C(NN=Cc1c(Cl)ccc(Cl)c1Cl)c1cc(-c2cccs2)nc(O)n1 2323701433 MTUIHJBTLQUGGD-UHFFFAOYSA-N 427.700 4.635 50 10 IJGE C[C@H](Cl)C1CCN(Cc2ccc(I)c(Br)c2)CC1 2325214003 XHCVUAPHKXOOJD-JTQLQIEISA-N 442.566 4.893 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cc(F)ccc1C(F)F 2343412931 CHWKMOYZHAXRGZ-OAHLLOKOSA-N 430.264 4.864 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3C[C@@H](NC(=O)OC(C)(C)C)CC[C@H]3C2)C1 2345010864 OQZCMEBPRXWNLY-BBWFWOEESA-N 429.443 4.813 50 10 IJGE CCOc1ccc([C@@H](Cl)c2c(Br)c(Br)nn2C)c(F)c1 2367475563 ZUPYZKFFOWYUOY-LLVKDONJSA-N 426.511 4.811 50 10 IJGE N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@H]1c1ccc(OC(=O)c2ccccc2)cc1 9860999 DMZGCXBWVICBCO-NRFANRHFSA-N 434.455 4.514 50 10 IJGE C=CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4F)ccc32)c1 38684588 QKUFVVNDRRNJFQ-XMMPIXPASA-N 442.446 4.828 50 10 IJGE COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(C)o2)cc1Cl 38688699 UDJQEHIQIDQQKS-OAQYLSRUSA-N 436.851 4.687 50 10 IJGE Cc1nn(C)c(Cl)c1CC(CBr)(CBr)c1cccc(F)c1 167849946 GDPLSXOFUVZRDP-UHFFFAOYSA-N 438.566 4.791 50 10 IJGE Cc1nc(COc2ccc(/C=C(\C#N)C(=O)Nc3cccc(C(F)(F)F)c3)cc2)no1 207651119 KMVCMOBNUBTTNH-OQLLNIDSSA-N 428.370 4.522 50 10 IJGE N#C/C(=C/NC1CCN(Cc2ccccc2)CC1)C(=O)Nc1cc(Cl)ccc1Cl 217136011 RCDMYQNJIXSPAA-VKAVYKQESA-N 429.351 4.594 50 10 IJGE O=C(NCCCCCCI)c1cc(Cl)ccc1Br 236055318 JVSRWEMBYNXIQW-UHFFFAOYSA-N 444.538 4.828 50 10 IJGE CC[C@H](C)c1ccc(OCC(=O)NNC(=O)[C@@H](C)Oc2ccccc2[C@H](C)CC)cc1 251372923 RCXUKSVJHCWPPQ-IPMKNSEASA-N 426.557 4.707 50 10 IJGE C[C@H]1C[C@@H](C)C[C@H](O[C@@](C)(CI)CNC(=O)OC(C)(C)C)C1 299983888 YCUQZFYPUPFWLH-CFAJVAMVSA-N 425.351 4.546 50 10 IJGE CC[C@@H](C)N(CCBr)C(=O)c1ccc(I)c(Cl)c1 385032592 HJUMKIYQSVJKLF-SECBINFHSA-N 444.538 4.580 50 10 IJGE CCN(C[C@@](C)(CI)OC[C@H](C)C1CCC1)C(=O)OC(C)(C)C 398383424 NYKJDKDIRUFGGH-KBXCAEBGSA-N 439.378 4.890 50 10 IJGE C=CCOc1c(Br)cc(/C=C(/C#N)C(=O)N(C)Cc2ccccc2)cc1OC 787151222 ZWTBORJPYGUFKA-WQRHYEAKSA-N 441.325 4.588 50 10 IJGE CCOC(=O)c1cccc(-c2ccc(C=NNC(=O)c3ccccc3Br)o2)c1 1083986205 XLMLNOUNYNRELF-UHFFFAOYSA-N 441.281 4.650 50 10 IJGE O=C(COc1ccc2ccccc2c1Br)NN=Cc1c(O)ccc2ccccc12 1084421672 OILGGBJMBALSPD-UHFFFAOYSA-N 449.304 4.990 50 10 IJGE CC1(C)CC(=O)c2cc(C(=O)N3CCC[C@@H](O[Si](C)(C)C(C)(C)C)C3)c(O)nc2C1 1141846447 YNBSODLZJHNAQY-OAHLLOKOSA-N 432.637 4.569 50 10 IJGE C=CCCc1ccccc1NC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1 1676884935 KLFNHCFMWWIZPG-UHFFFAOYSA-N 433.483 4.990 50 10 IJGE CCN1CCN(c2cc(Nc3ccc(SC#N)cc3)nc(-c3cccc(C)c3)n2)CC1 1859833757 JDOOAQHOJGGJDB-UHFFFAOYSA-N 430.581 4.911 50 10 IJGE COc1cc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3CC(C)C)ccc1OCc1ccccc1 1865687678 XTFZJCVKGJRZOE-DEOSSOPVSA-N 444.535 4.653 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccccc2)cc1 1865690630 XPEJIMQVDYZLBU-HSZRJFAPSA-N 428.536 4.891 50 10 IJGE CCCOc1ccc(/C=N\NC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)cc1OC 1865760788 OUOZSLNNGRSVSJ-VYYCAZPPSA-N 439.462 4.897 50 10 IJGE CC(C)C[C@H](CNC(=O)OC(C)(C)C)[C@@H]1CC[C@@](C)(CI)O1 1931099598 QHFPIFAWHCJHEL-KEYYUXOJSA-N 425.351 4.546 50 10 IJGE CC[C@H](C)[C@@H](Br)CNC(=O)c1cc(Br)sc1Br 1942803851 SBPVWAFOUSKZOW-XPUUQOCRSA-N 448.018 4.813 50 10 IJGE BrCC[C@@H]1CCN(Cc2ccc(Br)cc2Br)C1 1943846830 MJEHKHMAQMSEGI-SNVBAGLBSA-N 425.990 4.819 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1Cc1ccc(Br)cc1Br 1943860917 ZNZLZCNEOVRLTP-JOYOIKCWSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1C[C@]1(C)CCC[C@@H](CI)O1 1979567886 RXORHTWRONTICE-VKJFTORMSA-N 437.362 4.929 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1Cc1cc(Br)ccc1Br 2006508120 OUOHOCDLVXDSAR-SKDRFNHKSA-N 425.990 4.959 50 10 IJGE Clc1ccc(I)c(CN2[C@H]3CC[C@H]2[C@@H](CBr)C3)c1 2039483236 RGBDXNHZQHLZEL-LQJRIPTKSA-N 440.550 4.692 50 10 IJGE Brc1cccc(Br)c1CN1C[C@@H]2C[C@H](C[C@@H]2Br)C1 2045154732 RGIPIERHXFRDBS-BFVZDQMLSA-N 438.001 4.817 50 10 IJGE Clc1cc(CN2CCCC[C@@H](CBr)C2)ccc1I 2086658380 MYDAJXGIKDUUEF-LBPRGKRZSA-N 442.566 4.942 50 10 IJGE Clc1cc(CN2C[C@@H]3CC[C@H](C2)C3Br)ccc1I 2086661499 MZNDPMGFDYZAGK-BVUQATHDSA-N 440.550 4.550 50 10 IJGE O=C(c1scc(Br)c1Br)N1[C@H](CCl)C[C@@H]2CCC[C@@H]21 2108397731 VYDJWGORGYUBEX-NRPADANISA-N 427.589 4.895 50 10 IJGE Cn1cc(COc2c(Br)cc(CCl)cc2Br)c(Cl)n1 2111945673 CFIHDGDTBBVAKZ-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE Brc1ccc([C@@H](CI)O[C@H]2C[C@H](n3cccn3)C2)cc1 2183664603 JCPWYXUSTDHFDR-RBSFLKMASA-N 447.114 4.542 50 10 IJGE CN(CC1CC(Br)C1)C(=O)C1(c2ccc(NC(=O)OC(C)(C)C)cc2)CC1 2196906431 DRWRTGQMYVWRKS-UHFFFAOYSA-N 437.378 4.697 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2Cc1nc(Cl)cs1 2197075766 FRMNUXNEGVWYPU-UHFFFAOYSA-N 442.084 4.677 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@@H](Cl)c2ccc(Br)cc2Br)C1 2203682409 HRKXWPFYRPOADW-HERUPUMHSA-N 442.600 4.706 50 10 IJGE ICCCCCN1[C@H]2CCC[C@H]1CN(Cc1ccccc1)CC2 2211183844 IRUZBPOEGBMVRY-PMACEKPBSA-N 426.386 4.721 50 10 IJGE CN[C@H](c1cc(Br)c(Br)cc1F)[C@H]1C[C@H](Br)C1 2213490345 QSDACTGOASFQRX-WSFZALMZSA-N 429.953 4.785 50 10 IJGE C[C@@](CI)(O[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1F 2250387490 PNDLOEOIRGLOPF-PXNSSMCTSA-N 439.312 4.767 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@@H](Br)C(F)(F)CC1 2264505591 AAQOOIQYQJUOGT-SSDOTTSWSA-N 437.531 4.799 50 10 IJGE BrCCCC1CCN(Cc2sccc2I)CC1 2301076893 QXWBCSJTUBWTAZ-UHFFFAOYSA-N 428.177 4.740 50 10 IJGE COc1cccc2c1O[C@@H](C)C(C=C(C#N)S(=O)(=O)c1ccc(Br)cc1)=C2 2314450750 PUESKNXKXCVKTA-ZDUSSCGKSA-N 446.322 4.503 50 10 IJGE N#CC(=Cc1ccc(-c2ccc(S(N)(=O)=O)cc2)o1)c1nc(-c2ccccc2)cs1 2314482790 VZNNXOMXALTDNW-UHFFFAOYSA-N 433.514 4.782 50 10 IJGE CN(C[C@](C)(CBr)C(C)(C)C)[C@@H](CNC(=O)OC(C)(C)C)C(F)(F)F 2327107416 VUUFRUMPLIXEDM-LRDDRELGSA-N 433.353 4.821 50 10 IJGE C[C@H]1C[C@@H](CBr)CCN1Cc1cc(I)ccc1Cl 2327401056 LXNTVYFJRKUQFE-QWRGUYRKSA-N 442.566 4.940 50 10 IJGE CCOC(=O)N1CCc2cc(NC(=O)C(C#N)=Cc3ccc(Br)cc3)ccc21 2329662909 NAGMWBIUXMOUCX-UHFFFAOYSA-N 440.297 4.514 50 10 IJGE N#CC(=C(O)c1cc2ccccc2oc1=O)c1nc(-c2ccc3c(c2)OCCO3)cs1 2331330872 KWUOKPTWOYSXEA-UHFFFAOYSA-N 430.441 4.638 50 10 IJGE Cn1nc(C(F)(F)F)c(CBr)c1N(Cc1ccccc1)CC1CCOCC1 2365282261 YQAMYKIBCPTULM-UHFFFAOYSA-N 446.311 4.767 50 10 IJGE COc1ccc(NC(=S)NNC(=O)c2ccc(-c3ccc(Cl)cc3Cl)o2)cc1 39892591 FFROXKBJJXFWRJ-UHFFFAOYSA-N 436.320 4.893 50 10 IJGE Cc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4ccc(Cl)cn4)c(C)c32)c1 40811376 GRGZYTKDXSGHPO-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE Cc1cccnc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1cccc(Cl)c1)CCC2 40813269 TXPFPHCMDBCFBP-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2cccc(Cl)c2)cc1 98084260 AOMVWQVUZBDLRG-MRXNPFEDSA-N 446.816 4.771 50 10 IJGE C[C@H]1CCc2sc(C(=O)NNC(=O)c3ccc(SCc4cccnc4)cc3)cc2C1 106307902 ASWLSEVJSOYDTG-HNNXBMFYSA-N 437.590 4.635 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)COc2ccc(C(C)(C)C)cc2)cc1 207139745 IBOGHITVAPWRIF-SILNSSARSA-N 434.536 4.792 50 10 IJGE O=C(N[C@@H]1CCC[C@H]1CBr)c1cc(Br)cc(Br)c1 231548439 JDDLGYWLIDIMCA-QPUJVOFHSA-N 439.973 4.505 50 10 IJGE O=C(CSc1nc2ccccc2n1Cc1ccccc1)NN=C/C=C\c1ccccc1 254400732 PBDCGUDVGHORBP-FIJTXPHGSA-N 426.545 4.992 50 10 IJGE ClCc1ccc(Br)cc1N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21 404140988 FUMMNFMIXLGDHS-LEWJYISDSA-N 435.793 4.668 50 10 IJGE CC(C)(CC(CBr)(CBr)C1CCCCC1)CS(C)(=O)=O 692757946 VHIFLYZVXMTROB-UHFFFAOYSA-N 432.262 4.804 50 10 IJGE O=C(N[C@@H]1CCC[C@H](Br)C1)c1cc(Br)cc(Br)c1 694505955 MJJIVRHYXYXBDE-JOYOIKCWSA-N 439.973 4.648 50 10 IJGE O=C(N[C@H](CBr)C1CCC1)c1ccc(Br)cc1Br 717613818 QAVXRQSCEDJUAT-GFCCVEGCSA-N 439.973 4.505 50 10 IJGE N#Cc1cccc(CC(=O)NNC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)c1 749309140 TXUVYPCWMZBXGN-UHFFFAOYSA-N 435.936 4.508 50 10 IJGE Cc1ccc(/C=C/C(=O)NNc2ccc(S(=O)(=O)c3ccc(C(C)C)cc3)cc2)cn1 754013554 IMGPARNQGDNZNM-GIDUJCDVSA-N 435.549 4.503 50 10 IJGE CN(Cc1ccc(Cl)s1)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 914463872 HWGWUVMETCVBPS-ATVHPVEESA-N 435.940 4.744 50 10 IJGE O=C(CCCNc1ccc(Br)cc1)NN=Cc1c(O)ccc2ccccc12 1084125956 VZCXLABAPMKCEH-UHFFFAOYSA-N 426.314 4.650 50 10 IJGE Cc1cc(C=NNC(=O)C(=O)Nc2cccc3ccccc23)c(C)n1-c1cccc(Cl)c1 1084566702 PTMNGXDWLSVHAI-UHFFFAOYSA-N 444.922 4.990 50 10 IJGE Cc1c(COC(C)(C)C)cccc1NC(=O)NNC(=O)c1ccc(Br)cc1 1320131457 RQMKADHTVUKWSZ-UHFFFAOYSA-N 434.334 4.539 50 10 IJGE C=C(C)[C@@H](NC(=O)NNC(=O)c1cc2c(s1)CCCCCC2)c1ccc(F)c(F)c1 1478471287 SRVQAXDUODWICT-HXUWFJFHSA-N 433.524 4.947 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(\C#N)C(=O)Nc3ccc4nc(O)n(C)c4c3)c2C)c1 1567943143 RDDQADIQKMOBEX-XDHOZWIPSA-N 425.492 4.541 50 10 IJGE C[C@H](Oc1ccccc1Cc1ccccc1)C(=O)NNc1nc2ccccc2[nH]c1=S 1640943522 RLMHDWLPTLLHKM-INIZCTEOSA-N 430.533 4.794 50 10 IJGE CC(=O)c1ccc(NC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)cc1C 1668040622 VTHVZTBNVOGFGJ-UHFFFAOYSA-N 438.311 4.516 50 10 IJGE CC[C@H](Oc1cccnc1NC(=O)Oc1ccc([N+](=O)[O-])cc1)C(=O)OC1CCCCC1 1858689753 XXPFOTZPVGMKRR-SFHVURJKSA-N 443.456 4.634 50 10 IJGE CC(=O)Nc1cccc(C(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)c1 1860391773 UJXDWOFKUMIJKW-UHFFFAOYSA-N 429.501 4.602 50 10 IJGE CCCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1cccn1C)C(C#N)=C(N)O2 1865699063 KBFHAVIVYIUHMP-SFHVURJKSA-N 428.323 4.688 50 10 IJGE Cc1ccc(-n2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2cn(C)c3ccccc23)cc1 1865699162 MTIVJDDEFNWNGK-IBGZPJMESA-N 449.436 4.909 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C[C@H](CBr)NC(=O)OC(C)(C)C)cc1 1880768341 WQNBRTQWAXLGSH-OAHLLOKOSA-N 429.355 4.864 50 10 IJGE C[C@@H]([C@H](Cl)c1c(Br)sc(Br)c1Cl)S(C)(=O)=O 1923049785 NQSJLHXMNFCFER-UCORVYFPSA-N 430.998 4.640 50 10 IJGE O=S1(=O)CCC[C@@H]1[C@@H](Br)c1c(Cl)sc(Br)c1Cl 1925619143 YDUFVKMGFHJSPW-INEUFUBQSA-N 443.009 4.831 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@@]23CC[C@@](C)(CI)O3)C1 1950282314 ZOIIRDQSXDTGBV-IPMKNSEASA-N 449.373 4.931 50 10 IJGE CC[C@H](CCBr)CNC(=O)c1c(Br)cccc1Br 2033092398 BCMVROULXDCLMB-SECBINFHSA-N 441.989 4.753 50 10 IJGE Cn1nc(CC(CBr)(CBr)C2CCCC2)cc1Br 2049250985 OESYHGXLQSWPQX-UHFFFAOYSA-N 443.021 4.692 50 10 IJGE ClC1C[C@@H]2CCC[C@H](C1)N2c1ncc(I)cc1Br 2069532420 ASOFPUKHRKODGC-UQPYNNQESA-N 441.538 4.577 50 10 IJGE COC[C@@H]1C[C@@H](Br)[C@@H](Cc2ccc(I)c(Cl)c2)C1 2086664019 GXEKCRDDYSUYBJ-SDDRHHMPSA-N 443.550 4.923 50 10 IJGE CCN1CCC[C@@H]([C@H](Br)c2ccccc2OCc2ccccc2)S1(=O)=O 2089514391 KQJWGZRUZBDRNK-VQTJNVASSA-N 438.387 4.516 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H]1n1c(CCCl)nc2cncc(Br)c21 2095447765 MMQSNYGIMACYSD-KSSFIOAISA-N 433.781 4.668 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@H]2CCC[C@]2(CCl)C1 2103173919 XRJXQZHXOMBVJT-OQPBUACISA-N 427.589 4.754 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@H]1CCN(C[C@H](CBr)c2ccccc2)C1 2139885929 WLVWRXYXAKDJJV-ROUUACIJSA-N 425.411 4.790 50 10 IJGE C[C@@]1(CBr)CC(F)(F)CN1C(=O)c1ccc(Br)c(Cl)c1 2159050908 WEFLYJZXBOYBDZ-LBPRGKRZSA-N 431.502 4.737 50 10 IJGE C[C@@H]1CCCN(C(=O)c2ccc(CBr)cc2)[C@H]1CCNC(=O)OC(C)(C)C 2163053585 ORAIENQOOKTILC-QAPCUYQASA-N 439.394 4.737 50 10 IJGE O=C(N[C@@H](CBr)Cc1ccccc1)c1cc(Br)c(Cl)s1 2172565616 WTUMPEZBYGUHOK-SNVBAGLBSA-N 437.584 4.900 50 10 IJGE Br[C@@H]1CCCCCC[C@@H]1OCCOCCOCCOCc1ccccc1 2227779679 OQCBGBOPWXMBET-RTWAWAEBSA-N 429.395 4.739 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@H]1Br)c1scc(Br)c1Cl 2279183756 NUBQQYHZRWKZBW-BXKDBHETSA-N 435.568 4.955 50 10 IJGE CC1(C)CC(CBr)(NC(=O)c2cc(F)c(Br)cc2Cl)C1 2282988047 MDWJMTXYAZAOLE-UHFFFAOYSA-N 427.539 4.925 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 2286083591 IZDLNUOSSDXFQK-QVDMIQRCSA-N 446.776 4.849 50 10 IJGE Cc1ccc(NC(=O)C(C#N)=Cc2c(Oc3ccccc3C)nc3ccccn3c2=O)cc1 2296846442 MZNNLCLQAKAYKU-UHFFFAOYSA-N 436.471 4.649 50 10 IJGE C[C@@]1(CBr)CCCN1Cc1cc(I)ccc1Cl 2307319254 ICPQYMFNCPHUPV-ZDUSSCGKSA-N 428.539 4.694 50 10 IJGE COc1ccc(-c2ccc(C(=O)NN=Cc3ccc(Cl)cc3F)c(C)n2)cc1OC 2321248617 UJESWILASPIOIB-UHFFFAOYSA-N 427.863 4.631 50 10 IJGE COc1ccc(OC[C@@H](CBr)CC(C)C)cc1I 2328535987 GEPHBZFHOBHWTI-LLVKDONJSA-N 427.120 4.736 50 10 IJGE CN(Cc1ccc(I)cc1)CC1(CBr)CC(C)(C)C1 2345004177 HEMGNSVQXYAUQS-UHFFFAOYSA-N 436.175 4.924 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CN(C[C@]2(CBr)CC2(F)F)c2ccccc21 2379986454 RMEVYPDIFDNBIC-AUUYWEPGSA-N 445.348 4.925 50 10 IJGE CCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2OC)c1 38650062 GFJDMKSILRFXHE-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@H]2C)oc2c1/C(=N/NC(=O)Cc1ccccc1)CCC2 40815727 DGVNGPQEJHHBDB-QPGLCGFSSA-N 441.531 4.579 50 10 IJGE CCCNC(=O)c1cc2ccc(OC(=O)/C(C#N)=C/c3ccc(C(C)C)cc3)cc2oc1=O 40894310 PWONUUMLMJCPSA-UDWIEESQSA-N 444.487 4.569 50 10 IJGE CCCCN(CCBr)C(=O)c1cc(Br)c(Br)s1 122588281 SPNDAWUXCNWTRY-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE CCOc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4)nc3c2)c(OCC)c1 169926919 HEYISFTULPYWCL-WGOQTCKBSA-N 428.492 4.791 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)/C=C\c4ccccc4)ccc32)c1 205659955 HQNUVXDWHKDHMD-RDQNCKLBSA-N 438.483 4.922 50 10 IJGE CC(=NNC(=O)COc1ccccc1Cl)c1ccc(NC(=O)c2ccc(F)cc2)cc1 252598446 DAUDDHGSMVXPGR-UHFFFAOYSA-N 439.874 4.651 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3ccc(C)o3)n2C2CCCCC2)cc1 254533703 RYXHTNFZVKJFFD-UHFFFAOYSA-N 437.569 4.903 50 10 IJGE Clc1ccc(C(CBr)(CBr)CO[C@H]2CCCOC2)cc1 313029744 YSLHNUKTLISSET-AWEZNQCLSA-N 426.576 4.563 50 10 IJGE Cc1ccccc1[C@H]1CN(C(=O)OCc2ccccc2)C[C@@H]1CI 382684308 GLXQMGUOMQAZFQ-HKUYNNGSSA-N 435.305 4.782 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1C(=O)c1cc(Br)sc1Br 384540825 LPZPUUJGPMXDCS-XPUUQOCRSA-N 446.002 4.661 50 10 IJGE FC(F)Oc1c(CBr)cc(I)cc1C(F)(F)F 575723718 USVGWXIGTJZBTQ-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE FC(F)(F)COCCOc1c(Br)cc(Cl)cc1CBr 708088750 IZITXNQSPGLJPX-UHFFFAOYSA-N 426.454 4.955 50 10 IJGE CN(CC1CCN(Cc2ccccc2)CC1)c1ccc(CBr)cc1[N+](=O)[O-] 720016977 PSAIHKGSWVQWFD-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE CCOc1ccc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)cc1OC 725446994 MTAMEOVTIYGAPT-OALUTQOASA-N 448.357 4.841 50 10 IJGE CCN(CCC(F)(F)F)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 748183334 HZTBGEZQBUMMQR-FOWTUZBSSA-N 449.864 4.825 50 10 IJGE O=C(Nc1cc(F)ccc1C(=O)NNc1c(Cl)cc(F)cc1Cl)c1ccoc1 768011905 RLNRMFRLUUUKHF-UHFFFAOYSA-N 426.206 4.874 50 10 IJGE CN(C)CC1CCC(NC(=O)C(=O)Nc2ccc(S(F)(F)(F)(F)F)cc2)CC1 773428750 IZAPYPLDQXUBNQ-UHFFFAOYSA-N 429.455 4.519 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)OCCSc2ccccc2)c(-c2ccccc2)n1 781846068 GBEUPWVMBSKBAQ-CAPFRKAQSA-N 428.517 4.706 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccc(Br)c(Cl)c2F)c(C(F)(F)F)c1 799750073 URKKOZOGXSAZPN-UHFFFAOYSA-N 436.590 4.889 50 10 IJGE O=C(NNc1cccc(F)n1)c1cc(-c2ccccc2)nc2cc(Br)ccc12 804770664 MUCGERJEWBBFPK-UHFFFAOYSA-N 437.272 4.955 50 10 IJGE CCOc1ccc(C=NNC(=O)CCCSc2nc3ccc([N+](=O)[O-])cc3s2)cc1 1084061293 VXJHOKJLZRGDJV-UHFFFAOYSA-N 444.538 4.626 50 10 IJGE O=C(NN=Cc1ccc(OCc2ccccc2Cl)cc1)C(=O)Nc1cccc(Cl)c1 1084342456 UNOTVTACFGYUSA-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE O=C(CCCC(=O)Nc1ccc(Br)cc1)NN=Cc1cccc2ccccc12 1084381205 UEYJTYLWMKKEMA-UHFFFAOYSA-N 438.325 4.861 50 10 IJGE CC(=O)CCc1ccc(OCc2cccc(C(=O)NNc3c(F)cc(F)cc3F)c2)cc1 1304445559 BWWZRTIWMXPFLF-UHFFFAOYSA-N 442.437 4.961 50 10 IJGE C#CCCCC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(F)cc1)CCC2 1456190438 YISZSUOPBAWUTO-HTXNQAPBSA-N 441.506 4.815 50 10 IJGE COc1ccc(-c2nn(Cc3ccc(C)cc3)c3c2[C@H](c2cccnc2)C(C#N)=C(N)O3)cc1 1865700350 QPSCOVAWZHIBIQ-HSZRJFAPSA-N 449.514 4.529 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1ccc(OC)cc1)C(C#N)=C(N)O2 1865714389 JAMQJMLKCLGZQM-OAQYLSRUSA-N 434.927 4.764 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)OCc1ccccc1 1865759382 XNDJIPXYVUTPSJ-UHFFFAOYSA-N 430.291 4.935 50 10 IJGE O[C@H](c1c(Br)sc(Br)c1Cl)[C@@H]1C[C@H]1Br 1877356716 UWZVKAPYZTWNHI-SAMGZKJBSA-N 425.367 4.743 50 10 IJGE O=S(=O)(c1cc(Br)cs1)N(Cc1ccccc1)C1(CCl)CCC1 1915759206 AZSMIUSKTYYESX-UHFFFAOYSA-N 434.808 4.863 50 10 IJGE CC(C)n1cc(S(=O)(=O)N(Cc2ccccc2)C(C)(C)C)cc1CBr 2059313424 YJSNPMABFITVPD-UHFFFAOYSA-N 427.408 4.953 50 10 IJGE CCN(C[C@@H](CBr)c1ccccc1)C[C@@H]1CCCN1C(=O)OC(C)(C)C 2106782945 VKSGQJUQIZMCHN-MOPGFXCFSA-N 425.411 4.887 50 10 IJGE Cc1nc(N2C[C@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)sc1CBr 2108213376 LIRGRYKNRSRQRM-NHCUHLMSSA-N 432.431 4.839 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)CC2CC2)C[C@H]1CC(F)(F)F 2119510941 BIXFIICJRRGCGC-LSDHHAIUSA-N 443.348 4.671 50 10 IJGE CC(C)[C@@H](CBr)CN1CCC(c2n[nH]cc2NC(=O)OC(C)(C)C)CC1 2129060770 QTONIJPWJYGVGP-HNNXBMFYSA-N 429.403 4.603 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Br)c1cc(Cl)n(C)n1 2138254386 GTXBTOCJDTWEAW-LLVKDONJSA-N 428.939 4.982 50 10 IJGE CCCC(CBr)(CCC)CN1CCC(O)(CCNC(=O)OC(C)(C)C)CC1 2163065203 YIBFKNBZACKFTP-UHFFFAOYSA-N 449.474 4.710 50 10 IJGE CCC(C)(C)CCN(C)S(=O)(=O)c1cc(CBr)sc1Br 2179791019 LRHSQZBCVPGVRH-UHFFFAOYSA-N 447.258 4.852 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CC[C@@H](C(F)(F)CCl)C1 2197756247 LJICULZYRBEPMJ-MRVPVSSYSA-N 431.502 4.548 50 10 IJGE C[C@@H]1C[C@@H](CCNC(=O)OC(C)(C)C)CCN1CCCCCI 2211188181 YQPKSAZTWFKYRF-CVEARBPZSA-N 438.394 4.607 50 10 IJGE F[C@H]1C[C@@H](Br)CN(Cc2ccc(Br)cc2Br)C1 2213901139 PRGXSFMUPFEPRX-MNOVXSKESA-N 429.953 4.519 50 10 IJGE CCC(CC)(CBr)CNC(=O)c1cc(C)ccc1I 2232167657 VONJTNNKABSZOY-UHFFFAOYSA-N 438.147 4.531 50 10 IJGE Cc1sc(C(=O)N2CC[C@](CBr)(C(F)(F)F)C2)cc1Br 2234471734 UCFQHCJZAYCGKV-LLVKDONJSA-N 435.103 4.609 50 10 IJGE COC[C@@]1(C)C[C@]1(CBr)Cc1ccc(I)c(Cl)c1 2257085894 QJTQMUITIUZRFV-KGLIPLIRSA-N 443.550 4.925 50 10 IJGE CCOC1CC([C@H](Br)c2ccc(OC)c(I)c2)C1 2257359144 XFYRNUOOUYYDCU-QIMFLAQGSA-N 425.104 4.551 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2Cc1nccn1Cc1ccccc1 2286084411 PPYPSZCNOYRHFG-UHFFFAOYSA-N 445.748 4.839 50 10 IJGE CC(C)[C@]1(NC(=O)c2ccc(CBr)cc2)CCCN(C(=O)OC(C)(C)C)C1 2289940515 RIYIFMSXRWODHZ-NRFANRHFSA-N 439.394 4.737 50 10 IJGE Cc1ccc(NC(=O)COc2cccc(C=C(C#N)C(=O)NC3CCCCC3)c2)cc1C 2297559832 NHNSRMHPZMCYLQ-UHFFFAOYSA-N 431.536 4.677 50 10 IJGE O=S1(=O)C[C@H]2[C@@H](C1)[C@@H]2[C@H](Cl)c1cc(Br)ccc1OCc1ccccc1 2314439270 GKAQSVDDISJPDZ-KCITZHQASA-N 441.774 4.599 50 10 IJGE BrC[C@@]12CC[C@@H](C1)N(Cc1ccc(Br)cc1Br)C2 2314908469 PVOXSSFGHSUPON-GXTWGEPZSA-N 438.001 4.961 50 10 IJGE Clc1ccc(COc2ncccc2CBr)c(I)c1 2317809014 GMFQOVVQYNSZSL-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE Clc1ccc(CN2C[C@@H](Br)CCC23CC3)c(I)c1 2318537967 GUCBSWOZDXWLBC-NSHDSACASA-N 440.550 4.837 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)c3cc4ccccc4oc3=O)n2)c(OC)c1 2331386830 RSMFDUXCDLTOKK-UHFFFAOYSA-N 432.457 4.884 50 10 IJGE Cl[C@H](c1cc2c(cc1Br)OCCO2)c1cnsc1Br 2337304786 XQDMWMBGCRFMCZ-LLVKDONJSA-N 425.529 4.768 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN(C[C@@]2(CBr)CC2(F)F)C1 2351886689 CLWRLQLZCWIWAB-RKVPGOIHSA-N 437.369 4.518 50 10 IJGE CCO[C@@H]1CN(CC2(CBr)CCCCCC2)C[C@H]1CNC(=O)OC(C)(C)C 2354609199 XJQGSTKVOMDASW-QZTJIDSGSA-N 447.458 4.584 50 10 IJGE O=C(CSc1nc2ccccc2s1)N/N=C(/c1ccccc1)[C@@H](O)c1ccccc1 32519868 COGXMSGESSQJQK-UPMFUBJASA-N 433.558 4.643 50 10 IJGE N#C/C(=C/c1cn(Cc2ccc(Cl)cc2Cl)c2ccccc12)C(=O)N1CCOCC1 33342692 HMXNJSURESSWRA-BOPFTXTBSA-N 440.330 4.762 50 10 IJGE Cc1cccn2c(=O)c(/C=C(\C#N)c3nc4ccccc4[nH]3)c(Oc3ccccc3F)nc12 33584187 DCFYUJAYSGMJPO-DTQAZKPQSA-N 437.434 4.875 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2ccc(C(C)C)c(C)c2)c(OC)c1 40876886 AACUBEHBZGNYGD-XDHOZWIPSA-N 437.492 4.582 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)cc(OC)c1 59146970 NMCPMNWIDCDLID-WPWMEQJKSA-N 432.520 4.559 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\N[C@H](CC)c1ccc2c(c1)CCCC2 217154859 NEJGLLCPCMQIEI-FLVWFLKISA-N 431.536 4.829 50 10 IJGE CC(CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)=NNC(=O)c1cccc(C)c1O 252599206 DGVNBGQUBOXLRJ-UHFFFAOYSA-N 427.810 4.507 50 10 IJGE Nc1ccc(Cl)cc1[C@H]1CN(Cc2ccccc2)C[C@@H]1CI 382734209 WDLWWXSTQSCRJY-YOEHRIQHSA-N 426.729 4.573 50 10 IJGE C[C@H]1CN(c2nc3sccn3c2CBr)[C@H](C)[C@H](C)N1Cc1ccccc1 404295729 WZWNLWBSRJJDBV-HRCADAONSA-N 433.419 4.778 50 10 IJGE CCN(C[C@](C)(CI)O[C@H](C)CC(C)C)C(=O)OC(C)(C)C 725343885 VNSWBFAULCWVQD-PBHICJAKSA-N 427.367 4.888 50 10 IJGE Cc1ccc(F)c(NC(=S)NNC(=O)[C@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)c1 732576993 IESQSNXYRKNRBJ-RTWAWAEBSA-N 449.551 4.834 50 10 IJGE CCc1cccc(CC)c1NC(=O)/C(C#N)=C/c1ccc(OC)c2oc(C(=O)OC)cc12 748994100 FTROKHWLAVFPCJ-LDADJPATSA-N 432.476 4.898 50 10 IJGE Cc1cccc(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)c1O 759721650 AJGMLGGBNVPVOS-SFQUDFHCSA-N 431.883 4.677 50 10 IJGE CC(=O)c1cc2c(cc1NC(=O)/C(C#N)=C\c1cc(C)n(-c3ccccc3C)c1C)OCO2 1350272884 ZDHLLWOCKAZHDC-JMIUGGIZSA-N 441.487 4.880 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)[C@@]2(Cc3ccc(Cl)cc3)C[C@H]3CC[C@H]2C3)c1 1455417857 TZSPNFMCHPCRQR-JXQFQVJHSA-N 437.996 4.688 50 10 IJGE C=CCOc1ccc(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)cc1OC 1628466835 CLTCDPPDTRTWBI-QGZVFWFLSA-N 442.581 4.547 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc(Oc3cccc(Cl)c3)cn2)c1C 1648578214 PAGASJLTIFAHNO-UHFFFAOYSA-N 446.898 4.753 50 10 IJGE CCCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@@H]2c1cc(Cl)ccc1O 1865689112 KBVKNSOMRUQYDP-IBGZPJMESA-N 436.899 4.546 50 10 IJGE CCCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@H]2c1ccc(OCC)cc1 1865695023 HZTQXDILSBSSHQ-OAQYLSRUSA-N 430.508 4.586 50 10 IJGE COc1ccc(-c2nn(Cc3ccc(C)cc3)c3c2[C@H](c2ccccn2)C(C#N)=C(N)O3)cc1 1865700573 XQRQOBOPFJJQMM-QHCPKHFHSA-N 449.514 4.529 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(C(=O)NC[C@@H]2C[C@@H]2Br)cc1C(F)(F)F 1887785009 XUDQMKGSKSUMMQ-JQWIXIFHSA-N 437.256 4.566 50 10 IJGE CN(C(=O)c1csc(Br)c1Br)[C@H]1CCC[C@H]1Br 1945186469 HZUCKNGTFFBNNM-SFYZADRCSA-N 446.002 4.661 50 10 IJGE CCN(C[C@](C)(CI)O[C@H]1CCCC12CC2)C(=O)OC(C)(C)C 1986117873 CLMBGZCKBIMQFE-YOEHRIQHSA-N 437.362 4.786 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@@](C)(CI)O2)C[C@H]1C1CC1 1990240815 MCQSNYUQGYIWMC-JCGIZDLHSA-N 435.346 4.539 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)C[C@H](Br)C1CC1 2026564571 UWOGKAGBCQJCNV-NSHDSACASA-N 428.539 4.550 50 10 IJGE CC[C@H](Br)[C@@H](CC)NC(=O)c1cccc(Br)c1Br 2031476277 AFIAKTKKXSYYGA-GXSJLCMTSA-N 441.989 4.894 50 10 IJGE CC[C@@](C)(CCBr)NC(=O)c1c(Br)cccc1Br 2033094074 MLTNYGGYMMLKQN-ZDUSSCGKSA-N 441.989 4.895 50 10 IJGE COc1sc([C@@H](Cl)c2nn(C)c(Cl)c2Br)cc1Br 2048155730 LXNGAPNEGAYMFO-SSDOTTSWSA-N 434.968 4.997 50 10 IJGE O=C(CCl)c1ccc(OC(F)(F)F)c(I)c1C(F)(F)F 2055119494 NXPHXOKXUPEVGV-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE C[C@@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)ccc1F 2059264409 FOGBXYIEXIJERJ-AWEZNQCLSA-N 426.351 4.710 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1CC[C@]2(CCN(Cc3ccccc3)C2)C1 2107029677 JTKHPDXVGMZSOG-IBGZPJMESA-N 436.375 4.654 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)C2(S(C)(=O)=O)CCC2)cc1Br 2110396276 DTLYJWUKVJUXKJ-GFCCVEGCSA-N 430.589 4.767 50 10 IJGE Fc1ccc2nc(CCCl)n([C@@]34C[C@H]3CN(Cc3ccccc3)C4)c2c1Br 2155870770 BYDMDNUPGNTXIO-YCRPNKLZSA-N 448.767 4.950 50 10 IJGE CN(CC[C@@H]1CCCCN1CCCCCI)C(=O)OC(C)(C)C 2211186512 POIZFKPCKSAUNR-INIZCTEOSA-N 438.394 4.703 50 10 IJGE CCOCc1cc(Br)c([C@H](Cl)c2cn(C)nc2Br)s1 2224792954 WYXDWFLJUWEVNG-SNVBAGLBSA-N 428.577 4.871 50 10 IJGE COc1ccc([C@@H](Br)c2cnn(C)c2I)cc1C(C)C 2233144451 YRBVCSQYDZLFHI-CQSZACIVSA-N 449.130 4.641 50 10 IJGE Cn1nc([C@H](Cl)c2ccc3c(c2Br)CCO3)c(Br)c1Cl 2238061297 VOVVEYABWHILAZ-LLVKDONJSA-N 440.950 4.862 50 10 IJGE COc1ccc(CBr)c(N(C)C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)n1 2239873926 CVUMIAPOELUUPC-YOFSQIOKSA-N 430.390 4.617 50 10 IJGE C[C@H]1[C@H](Br)C[C@H]2CC[C@H]1N2C(=O)c1scc(Br)c1Cl 2264510440 UIWYLGARXOLUCY-OKJYPTKPSA-N 427.589 4.941 50 10 IJGE C[C@H]1C[C@H](Br)CCN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282977528 CXJDJEDVPSJWJQ-DTWKUNHWSA-N 427.539 4.877 50 10 IJGE C[C@]1(CNC(=O)c2cc(F)c(Br)cc2Cl)CCC[C@H]1Br 2286879678 JEOLXTSIXURXGN-TZMCWYRMSA-N 427.539 4.925 50 10 IJGE CCc1ccc([C@H](Br)c2c(Br)c(Br)nn2C)cc1 2316717514 JTQZXPYQBUCVMH-JTQLQIEISA-N 436.973 4.992 50 10 IJGE CCOc1ccc([C@@H](Br)c2cc(I)sn2)c(F)c1 2319129999 SQVIZJTWTNMMRQ-GFCCVEGCSA-N 442.091 4.770 50 10 IJGE CC1(C)CC(CBr)(CN(CCNC(=O)OC(C)(C)C)CC(F)(F)F)C1 2321757770 XZSMDZDPCUQQES-UHFFFAOYSA-N 431.337 4.577 50 10 IJGE O=C(NN=Cc1ccc(OCc2ccccc2)cc1)c1nn(-c2ccccc2)c2c1CCC2 2323759288 HKYAJZDIQJNZJY-UHFFFAOYSA-N 436.515 4.704 50 10 IJGE CCOc1ccc(CCNC=C(C#N)C(=O)Nc2ccc(Cl)c(Cl)c2)cc1OCC 2324265912 AWCIQIZURGQKOD-UHFFFAOYSA-N 448.350 4.969 50 10 IJGE COC[C@@H]1C[C@@H](Cl)[C@@H](Cc2ccc(I)c(Br)c2)C1 2325204648 QOKMUTWKFDTFCA-GMXVVIOVSA-N 443.550 4.876 50 10 IJGE CCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2326919583 OPCUADYXTRPFGG-PBHICJAKSA-N 425.358 4.518 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)[C@H]3CC(=O)N(Cc4ccccc4)C3)n2)cc1C 2331259263 IKPZUTDCSJIBND-IBGZPJMESA-N 445.544 4.969 50 10 IJGE Cc1cnc(N(C)Cc2cccc(I)c2)cc1CBr 2352279261 HEHIWERDTBWDHO-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE COc1ccc(CBr)c(N(C)[C@H]2C[C@@H]3C[C@H](OCc4ccccc4)C[C@H]23)n1 2358915783 BEQCAULSAXHUSB-MUGJNUQGSA-N 431.374 4.805 50 10 IJGE CC(C)[C@H](Br)C(C)(C)CN(C)S(=O)(=O)c1ccc(Br)s1 2365906939 FOQAEJJTTXCQDM-LBPRGKRZSA-N 447.258 4.577 50 10 IJGE Cc1c(CBr)ccc(NS(=O)(=O)c2cc(Br)cs2)c1C 2367944172 WVGWYZOWSXGBEG-UHFFFAOYSA-N 439.194 4.823 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(C(=O)c2cc(Br)c(F)cc2Cl)[C@H]1C 2370657270 AZEFQCSBBBJAJE-NRPADANISA-N 427.539 4.876 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1-n1c(C)cc(/C=C(/C#N)C(=O)N2CCc3ccccc3C2)c1C 97636047 BRGNSCAFRMHRKP-UCQKPKSFSA-N 440.503 4.803 50 10 IJGE CCCOc1ccccc1/C=N\NC(=O)c1cccn(Cc2ccc(C(C)(C)C)cc2)c1=O 169921193 TYKARSCGTGRLCJ-VEILYXNESA-N 445.563 4.747 50 10 IJGE COc1ccc(Br)cc1/C=N\NC(=O)Cc1cc(Cl)ccc1SC 169922630 GJYOZOQYRGJAHQ-JMIUGGIZSA-N 427.751 4.526 50 10 IJGE C=CC[C@@]1(C(=O)OC)C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 688653179 DWWQFLFXOGTKEW-XXBNENTESA-N 433.621 4.907 50 10 IJGE O=S1(=O)CC[C@@H](CCC(CBr)(CBr)C2CCCCC2)C1 697119566 NIKYOMSOYQNIOH-CYBMUJFWSA-N 430.246 4.558 50 10 IJGE O=C(Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1)NNc1ccc(F)c(F)c1F 728713622 BJADQQVZRIRACS-UHFFFAOYSA-N 439.393 4.788 50 10 IJGE O=C(NNc1nnc(-c2ccccn2)s1)c1csc(-c2cccc3ccccc23)n1 788562811 UDAZYUPVGJUZOY-UHFFFAOYSA-N 430.518 4.634 50 10 IJGE O=C1C(=NNC(=O)C23CC4CC(CC(C4)C2)C3)c2ccccc2N1Cc1ccccc1Cl 1084000995 AXNDVLFLOJJNBV-UHFFFAOYSA-N 447.966 4.924 50 10 IJGE Cc1ccc(S(=O)(=O)Oc2ccccc2C=NNC(=O)c2cccc3ccccc23)cc1 1084004806 HRKNLKDISRNNSY-UHFFFAOYSA-N 444.512 4.680 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNc2nc3ccccc3[nH]c2=S)s1 1167430917 XSEYKOSILYUJTL-UHFFFAOYSA-N 438.003 4.588 50 10 IJGE Cc1nc(NCC(=O)NNc2c(F)cc(F)cc2F)c2cc(-c3ccccc3)sc2n1 1179827051 KUMNPZIJYZCITI-UHFFFAOYSA-N 443.454 4.639 50 10 IJGE CC(=O)c1cc(F)c(O)c(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(F)cc3)c2C)c1 1646056381 UDRLJDLNDCKVDC-NVMNQCDNSA-N 435.430 4.826 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccc(OC)cc2)cc1 1865709520 XETQDANYYQTSRL-GOSISDBHSA-N 440.425 4.680 50 10 IJGE CCCc1nn(-c2cccc(Cl)c2)c2c1[C@@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865710296 UJMFCJBOKQFHOE-IBGZPJMESA-N 435.871 4.605 50 10 IJGE CC[C@H](NC(=O)[C@H](c1ccc(Cl)cc1)C1CC1)C(=O)Nc1ccc(SC#N)cc1 1866999945 CPZOWEGYRHKHDV-PMACEKPBSA-N 427.957 4.940 50 10 IJGE C[C@@H](Oc1cccc(Cl)c1)C(=O)N(C)C[C@H](Br)COCc1ccccc1 1916346363 BVGSCWVOUYIGPL-WBVHZDCISA-N 440.765 4.546 50 10 IJGE Cc1cc(Br)sc1[C@@H](Br)c1cnn(C)c1Br 1939449939 GBPOGYMQLANITE-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE CC[C@H](NC(=O)c1cccc(Br)c1Br)[C@@H](C)Br 1943907977 XVZKVUHZRNZZDD-XCBNKYQSSA-N 427.962 4.503 50 10 IJGE Brc1cccc(Br)c1CN1CCCC[C@H](Br)C1 2003418520 YMAZTDKTCNBPGV-JTQLQIEISA-N 425.990 4.961 50 10 IJGE CC[C@@H](Br)[C@@H](CC)NC(=O)c1cccc(Br)c1Br 2031476279 AFIAKTKKXSYYGA-MWLCHTKSSA-N 441.989 4.894 50 10 IJGE CC(C)[C@@H](Br)CCNC(=O)c1cccc(Br)c1Br 2031482434 RWZKEODRKUVOPZ-JTQLQIEISA-N 441.989 4.751 50 10 IJGE CC(C)[C@@H](Br)CN(C)C(=O)c1cccc(Br)c1Br 2048727766 JTLRVZFUSWWJIP-NSHDSACASA-N 441.989 4.703 50 10 IJGE FC(F)c1cc(CBr)cc(Br)c1I 2054781612 PNRHTHLXZYZPPC-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE Clc1ccc(I)c(CN2CC[C@H](Br)[C@@H]2C2CC2)c1 2067022572 WXQGATGZAUUAMG-JSGCOSHPSA-N 440.550 4.692 50 10 IJGE COc1ccc(Cn2nc(CBr)c(Br)c2C(F)(F)F)cc1F 2079229649 JITDQADXFITKTI-UHFFFAOYSA-N 446.036 4.755 50 10 IJGE CC(C)(C)OC(=O)NC1(C2CCN(C[C@H](CBr)CC3CC3)CC2)CCC1 2112862956 GBZCWSMIVRKBMR-KRWDZBQOSA-N 429.443 4.957 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1CCCl)c1ccc(I)c(Cl)c1 2146741766 ZGTOTBDCYAJNTD-HZMBPMFUSA-N 426.125 4.862 50 10 IJGE C[C@@H]1C[C@@H](C)N(C(=O)c2ccc(CBr)cc2)C[C@@H]1CNC(=O)OC(C)(C)C 2163055164 DTDVORDKJNXTJX-RKVPGOIHSA-N 439.394 4.593 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@H](CBr)CC2CC2)C[C@@H]1c1ccccc1 2169173699 LNYCDXGVVVEQEZ-MISYRCLQSA-N 437.422 4.790 50 10 IJGE CC[C@@H](Br)[C@@H]1CCCCN1S(=O)(=O)c1cc(C)c(Br)s1 2170612128 GSHWBNCSKFGWHI-MNOVXSKESA-N 445.242 4.536 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2[C@@]12C[C@H]1CN(Cc1ccccc1)C2 2202302272 YDQGLZKXJFWAPY-YCRPNKLZSA-N 446.776 4.777 50 10 IJGE COCCO[C@@H]1[C@@H](Br)C[C@H]1Oc1c(Cl)cc(Br)cc1Cl 2203012668 UPQKTOISOLOMQE-XXILOJSOSA-N 448.966 4.702 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCC(OCCCCl)CC1 2207528568 NPWYGDLJELWPBE-UHFFFAOYSA-N 445.604 4.523 50 10 IJGE CC(C)(C)OC(=O)N1CC2(CCCC[C@@]23CC[C@@](C)(CI)O3)C1 2211826474 SYLXDBAQHKRGOQ-FUHWJXTLSA-N 435.346 4.540 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@@H]1CC2(CCCC2)CCN1C(=O)OC(C)(C)C 2237000482 DFMUNNQMUSCUJB-BBWFWOEESA-N 443.426 4.578 50 10 IJGE C[C@@H]1C[C@H]([C@@H](Br)Cc2cc(Br)cc(Br)c2)CO1 2252834150 GVNHUQLIPHKEBR-DVYJOKAKSA-N 426.974 4.943 50 10 IJGE Fc1cc(Br)cc(F)c1CO[C@H]1CCCC[C@H]1I 2259042308 PKVDLXVVLCXXQD-OLZOCXBDSA-N 431.058 4.990 50 10 IJGE CC1(C)CCN(C(=O)c2ccc(Cl)c(I)c2)C[C@H]1CCl 2283652424 UYHNXHTWQQRZPB-LLVKDONJSA-N 426.125 4.672 50 10 IJGE O=C(NC[C@@H]1CCC[C@H]1CBr)c1cc(Br)c(F)cc1Cl 2285957448 HPFOJUBSVQNWCA-IUCAKERBSA-N 427.539 4.783 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@@H](Br)[C@@]12COC[C@@H]1C2 2298020138 XBJGIHHZZVJCDN-GHGOGRRBSA-N 428.921 4.823 50 10 IJGE C[P@]1(=O)C[C@@H](Cl)[C@H](Cc2ccc(I)c(Br)c2)C1 2306223935 LBEHZVHGRLASRW-CINOJJQCSA-N 447.478 4.826 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H]2C[C@@H](Br)C3)cc1I 2315553725 WDVBATLSBNXPMU-CNDDSTCGSA-N 440.550 4.835 50 10 IJGE CCCOc1ccc(C=CC(=O)NNC(=O)c2ccc(-c3ccc(C)cc3)nc2C)cc1 2321124199 GEKYIZJTVKWXHG-UHFFFAOYSA-N 429.520 4.629 50 10 IJGE COc1ccc(CCNC(=O)C(C#N)=CNc2ccc(Oc3ccccc3)cc2)cc1OC 2324709150 HXYNTMUGXZTBEO-UHFFFAOYSA-N 443.503 4.674 50 10 IJGE ClC[C@]1(Cc2ccc(I)c(Br)c2)O[C@H]2CC[C@H]1C2 2327563692 FVZQMNCFCCOGTN-MJVIPROJSA-N 441.534 4.773 50 10 IJGE O=C(N/N=C/c1cc2c(cc1Br)OCO2)c1sc2ccccc2c1Cl 13966374 FDOJJAALWSEXQK-IFRROFPPSA-N 437.702 4.810 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\Nc1ccc(Br)cc1 217240057 FCLGREAMHIERTK-PFONDFGASA-N 442.313 4.864 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2)ccc1OCCCOc1ccc(C)c(C)c1 254378818 KMOMSWAWXNLDEP-UHFFFAOYSA-N 432.520 4.924 50 10 IJGE CC(=NNC(=O)CSCc1ccccc1Cl)c1ccc(NC(=O)C(F)(F)F)cc1 254593907 QKNLYKOZMWDPKS-UHFFFAOYSA-N 443.878 4.614 50 10 IJGE CCCCN(CC)c1ccc([N+](=O)[O-])cc1C=NNC(=O)COc1ccc2ccccc2c1 254873970 LZRKINKIKRRCCY-UHFFFAOYSA-N 448.523 4.904 50 10 IJGE CC[C@@H](C)N(CCCl)C(=O)c1cc(Br)ccc1I 310920152 JQFOXLKARAZVFQ-SECBINFHSA-N 444.538 4.533 50 10 IJGE Cc1cc([C@@H](Br)c2cnn(C)c2I)c(Cl)cc1F 379225265 WGHQOWBQABFKIQ-LLVKDONJSA-N 443.485 4.610 50 10 IJGE CCn1cc([C@@H](Cl)c2sc(COC)cc2Br)nc1Br 688130815 NTTRQDIUVFEJNN-SNVBAGLBSA-N 428.577 4.964 50 10 IJGE C[C@@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1ccccc1Oc1ccccc1 726273192 YTWLXAFRUVLHNF-QGZVFWFLSA-N 426.476 4.732 50 10 IJGE O=C(NNc1ccc(F)cc1F)c1cccnc1Oc1ccc(F)cc1Br 729280785 RGQCFHUXKALTSS-UHFFFAOYSA-N 438.203 4.811 50 10 IJGE O=C(NNc1c(F)cc(F)cc1Br)c1cnc(-c2ccc(F)c(F)c2)s1 779921914 DVDQGJHXVOUORB-UHFFFAOYSA-N 446.223 4.886 50 10 IJGE COC(=O)c1ccccc1-c1ccccc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799752301 DFGYDGRHZYKFPS-UHFFFAOYSA-N 439.393 4.788 50 10 IJGE Cc1cccc(C)c1NC(=O)CSc1ccc(C=NNC(=O)c2ccc(F)cc2)o1 1084156974 ZNRZLUPOLPOEFB-UHFFFAOYSA-N 425.485 4.530 50 10 IJGE O=C(CCCSc1nc2ccc([N+](=O)[O-])cc2s1)NN=Cc1ccccc1Cl 1084344509 YYWCFLLMZLOHHD-UHFFFAOYSA-N 434.930 4.881 50 10 IJGE Cc1ccc(-n2c(C)c(Br)c(C=NNC(=O)c3ccncc3)c2C)c(C)c1 1084600426 WMCMMYHZPOZFQW-UHFFFAOYSA-N 425.330 4.632 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1ccc(Sc2ccccc2Cl)nn1 1167430710 OHMDXGNFDOZFKB-UHFFFAOYSA-N 440.941 4.644 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@H](OCC2CCCC2)c2ccccc2)c1C 1472514501 NDQVNVIMAHIYHJ-JOCHJYFZSA-N 431.540 4.547 50 10 IJGE Cc1cc([C@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)ccc1[N+](=O)[O-] 1614641139 IDQWQYQQGNGPFB-QZTJIDSGSA-N 433.302 4.650 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccc(Cl)cc2)[C@H]1c1ccncc1 1865699914 GGHFIOLWNGCOGV-FQEVSTJZSA-N 425.879 4.806 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)N/N=C\c1ccc(Cl)c([N+](=O)[O-])c1 1865760693 KWACSJSXXUHPLM-VROXFSQNSA-N 430.798 4.661 50 10 IJGE COc1ccccc1-c1ccc(C(=O)N/N=C(\C)c2ccc(Br)cc2)c(C)n1 1865764485 PBDSJRREWUYYMK-AFUMVMLFSA-N 438.325 4.982 50 10 IJGE CCCC[C@@H](NC(=O)c1cc(C)n(-c2ccccc2)n1)C(=O)Nc1ccc(SC#N)cc1 1866837870 ITSGFYBBIRGASG-OAQYLSRUSA-N 447.564 4.681 50 10 IJGE Brc1ccccc1[C@H](CI)O[C@H]1COC2(CCC2)C1 1889723590 UAKVVYQXRRJQSP-RISCZKNCSA-N 437.115 4.653 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(Br)c(O)c1 1914607960 NKBDVJRLIHSLRY-GFCCVEGCSA-N 427.136 4.581 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(F)c(CBr)c2)c1I 1924877050 SKXIGPGUHBWXFM-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE C[C@H]1CCN(Cc2cc(Br)ccc2Br)C[C@H]1Br 2006503570 PUWZRSLUMJVFPO-TVQRCGJNSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](OC[C@@H]2C[C@@H]2C2CCCCC2)C1 2022594683 LRSYEJWNDGURFI-VVLHAWIVSA-N 449.373 4.642 50 10 IJGE CC[C@H](Br)c1cn(Cc2c(Br)cccc2Br)nn1 2033089519 UKTCDCFSUOYTIZ-VIFPVBQESA-N 437.961 4.697 50 10 IJGE CCCN1CC[C@H]([C@@H](Br)c2cscc2OCc2ccccc2)S1(=O)=O 2038675865 BMAQRCBDIYNFJO-MSOLQXFVSA-N 444.416 4.577 50 10 IJGE COc1cc(C=C(C#N)c2nnc3n2CCCCC3)ccc1OC(=O)c1ccc(C)cc1 2042453504 MYNURCNZRZAWRT-UHFFFAOYSA-N 428.492 4.605 50 10 IJGE Brc1cccc(CN2C[C@@H]3C[C@H](C[C@@H]3Br)C2)c1Br 2045155014 UGMKOHFVPOAYHK-CDMKHQONSA-N 438.001 4.817 50 10 IJGE CCOc1cc(-n2nc(CBr)c(Br)c2C(F)(F)F)cc(C)n1 2078913555 FQAICKWMURDTFJ-UHFFFAOYSA-N 443.061 4.651 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC13CCOCC3)C[C@@]2(CBr)C(F)(F)F 2083260603 PTPKIBXOKGGUNE-HOCLYGCPSA-N 428.289 4.510 50 10 IJGE CCCN1CC[C@@H]([C@H](Br)c2ccccc2OCc2ccccc2)S1(=O)=O 2089515874 TUDGOGYSCQWWNE-VQTJNVASSA-N 438.387 4.516 50 10 IJGE CN(c1ncc(Br)c(CCl)n1)[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2094894319 JTHFKWCDWCTCNN-FVQHAEBGSA-N 435.797 4.610 50 10 IJGE Cn1nc(COc2cccc(Cl)c2CBr)c(Br)c1Cl 2096687945 DLSFXJJOUJZFRT-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC2(CC[C@@H]1CCl)CC2 2097876446 FCOXOBJYVQXGPG-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE Cc1cc(C(=O)N[C@H](C)CCCCCBr)ccc1I 2142140049 FFWINFOIHIACDP-GFCCVEGCSA-N 438.147 4.673 50 10 IJGE CC1(C)COC[C@@H](COc2c(Br)cc(CCl)cc2Br)O1 2145714534 OBTHBKQCLZBJIB-JTQLQIEISA-N 428.548 4.523 50 10 IJGE O=C(NC1(CCCl)CCSCC1)c1cccc(Br)c1Br 2148750973 OHKYJOPADRYVDR-UHFFFAOYSA-N 441.616 4.836 50 10 IJGE CN(Cc1ccccc1)[C@H](Cn1c(CCCl)nc2cncc(Br)c21)C1CC1 2151793740 QQAVTZQQEBNEQW-LJQANCHMSA-N 447.808 4.886 50 10 IJGE CC(C)[C@H]1CN(c2cc([N+](=O)[O-])ccc2CBr)CCN1Cc1ccccc1 2176905041 QWCOXDYAIQSRGP-OAQYLSRUSA-N 432.362 4.837 50 10 IJGE Cc1nc(C2(C)CCN(Cc3ccccc3)CC2)nc2c1C[C@H](CBr)CC2 2187368226 LRKZOUMHUSILOA-LJQANCHMSA-N 428.418 4.839 50 10 IJGE CCC[C@H]1CN(C(=O)c2ccc(I)c(Cl)c2)C[C@@H]1CCl 2205698768 SQUVYYUNGYAGKO-RYUDHWBXSA-N 426.125 4.672 50 10 IJGE F[C@@H]1C[C@H](Br)CN(Cc2cc(Br)ccc2Br)C1 2213905863 FXTOXDYWYKSJGK-WDEREUQCSA-N 429.953 4.519 50 10 IJGE Clc1nc(N2[C@H]3CCC[C@@H]2CN(Cc2ccccc2)C3)sc1CBr 2213908104 RNWHSDOEZKOBLC-GASCZTMLSA-N 426.811 4.935 50 10 IJGE CCN(CCCCI)[C@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2243591491 VCKSCCAJKSIXFQ-CVEARBPZSA-N 438.394 4.607 50 10 IJGE O=C(NCC1(CBr)CC(F)(F)C1)c1cccc(Br)c1Cl 2281664318 XXFNMGRDPMGTBR-UHFFFAOYSA-N 431.502 4.643 50 10 IJGE O=C(NC[C@@H]1CCCC[C@@H]1Br)c1cc(Br)c(F)cc1Cl 2285957385 GSJJVAOJMUUSJY-WPRPVWTQSA-N 427.539 4.925 50 10 IJGE C[C@H](Br)CN(CCC(C)(C)C)S(=O)(=O)c1sccc1Br 2288046851 DQFCTLZESYRSEO-JTQLQIEISA-N 447.258 4.721 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1Cc1ccc(Cl)cc1I 2302325360 GTWUJEBYBLXQFQ-KOLCDFICSA-N 428.539 4.692 50 10 IJGE CC(C)C[C@H](CCl)NCc1ccc(I)c(Br)c1 2306218208 XSRGYOVRNUPUKY-LLVKDONJSA-N 430.555 4.797 50 10 IJGE CNC(=O)C(C#N)=C1S[C@H](Cc2ccc(Cl)cc2)C(=O)N1c1ccc(C(C)C)cc1 2314593981 WXVDGBVENXTEGK-HXUWFJFHSA-N 439.968 4.636 50 10 IJGE C[C@@]12CN(Cc3ccc(Cl)cc3I)C[C@@]1(CBr)C2 2318557593 MTFFCAWCDQNIBZ-KGLIPLIRSA-N 440.550 4.552 50 10 IJGE CCn1cc(C=C2Oc3cc(OC(=O)C(Cl)Cl)ccc3C2=O)c2cc(OC)ccc21 2323758748 ZAWOTJXLFFVUES-UHFFFAOYSA-N 446.286 4.995 50 10 IJGE COc1cc(NC=C(C#N)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)c(OC)cc1Cl 2325118563 MLWIFTPHSSWOHK-OAHLLOKOSA-N 439.943 4.933 50 10 IJGE ClC[C@@]12CC[C@@H](C1)N(Cc1ccc(I)c(Br)c1)C2 2325213037 INMYHVVTLFXOGH-SMDDNHRTSA-N 440.550 4.647 50 10 IJGE FC1(F)[C@@H]2CC[C@@H](O[C@H](CI)c3cccc(Br)c3)[C@@H]21 2333884485 SYDVBOGKIHDCOG-FDYHWXHSSA-N 443.069 4.986 50 10 IJGE CC(C)(CBr)CN1CC[C@@H](CCNC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2337588285 WOUHHHWZYVYFGR-KGLIPLIRSA-N 445.364 4.965 50 10 IJGE COCC(C)(C)N(Cc1ccccc1)c1c(CBr)c(C(F)(F)F)nn1C 2339772964 CGIBQTZHQNDGHM-UHFFFAOYSA-N 434.300 4.765 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1CN(C[C@@]1(CBr)CC1(F)F)C1CC1 2351887628 BBRKVRRRRXPJSM-QAPCUYQASA-N 437.369 4.661 50 10 IJGE CC(C)(C)[C@@H]1CC[C@H](Br)[C@H](Cc2ncc(I)cn2)C1 2353065762 QVGYTFIAQAGOST-LOWVWBTDSA-N 437.163 4.850 50 10 IJGE C[C@H]1[C@@H](C)N(c2nccc(N(C)C)c2CBr)C[C@@H](C)N1Cc1ccccc1 2377484542 IOAFYGIGQPXDKF-FGTMMUONSA-N 431.422 4.530 50 10 IJGE CCOc1ccc(/C=N/NC(=O)COc2cc(C)c(Br)cc2C(C)C)cc1 40910489 REJWCQYOCCDNJX-FSJBWODESA-N 433.346 4.809 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2ccc(-c3cccc(C(C)=O)c3)o2)cc1 58894777 BTOPIPAYZRQWRR-IPLHSMHLSA-N 434.492 4.512 50 10 IJGE CCCC/C(C)=N/NC(=O)CSc1nnc(CNc2ccccc2)n1-c1ccccc1 59915296 FUXIUIOZVZREEK-XIEYBQDHSA-N 436.585 4.654 50 10 IJGE CCCC[C@H](CC)CC(CBr)(CBr)[C@H]1CCS(=O)(=O)C1 118875330 VRHAHKUEDKMAGX-KBPBESRZSA-N 432.262 4.804 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2ccc(OC)cc2)sc2c1CC[C@@H](CC)C2 209406483 NFTPQYXLHDZGNG-UHVIJJLKSA-N 438.549 4.994 50 10 IJGE O=C(CSc1nnc(SCc2ccccc2)s1)NN=Cc1c[nH]c2ccccc12 254382148 QJXZWTJGKKYBCR-UHFFFAOYSA-N 439.591 4.554 50 10 IJGE N#C/C(=C\c1ccccc1)C(=O)N=C1N=C2C=CC(Br)=CN2Cc2ccccc21 254566761 MBYPKLKLWSLERW-JWOXPMACSA-N 443.304 4.587 50 10 IJGE CCOc1cc(C=NNC(=O)COc2c(C)cccc2C)ccc1OCc1ccccc1 254622421 BCOYXWIBVZIBDM-UHFFFAOYSA-N 432.520 4.810 50 10 IJGE C[C@@H]1CC[C@H](O[C@](C)(CI)CNC(=O)OC(C)(C)C)C[C@H]1C 299978897 JYYHURNHODTVMS-VWPFQQQWSA-N 425.351 4.546 50 10 IJGE COc1cc([C@@H]2CN(Cc3ccccc3)C[C@@H]2CI)ccc1Cl 382683378 CNGNDUZHGULHOV-IRXDYDNUSA-N 441.740 4.999 50 10 IJGE O=C(CBr)c1cc(Br)c(OC(F)F)cc1OC(F)(F)F 575679703 CSGWVKHBYRYBQD-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE Cn1cc([C@H](Br)c2ccc(F)c(Br)c2)nc1Br 698415218 CQQXVYLWPJSXNZ-SNVBAGLBSA-N 426.909 4.569 50 10 IJGE COc1ccc([C@@H](Br)c2cccc(F)c2I)s1 721671414 FWMJQLNDCVTOQU-NSHDSACASA-N 427.076 4.985 50 10 IJGE O=C(NNc1nc(-c2ccc(Cl)cc2)no1)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 741220007 OSSUTURYNGWBOS-ZIAGYGMSSA-N 438.793 4.535 50 10 IJGE Cc1ccnc(Oc2cc(NC(=O)NNC(=O)c3cccc4cccnc34)ccc2C)c1 756779621 UNBBNCKDDDTPTA-UHFFFAOYSA-N 427.464 4.505 50 10 IJGE Cc1cccc(COc2ccc(/C=C(\C#N)C(=O)N3CCN(c4ccccc4)CC3)cc2)c1 1083888476 AWELGQZKHPCMPU-NCELDCMTSA-N 437.543 4.830 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3cccc(-n4ccnc4O)c3)c2C)c1 1125333397 WPUGYJDYWAOCEY-STZFKDTASA-N 437.503 4.840 50 10 IJGE CC(=O)N1CCCc2cc(NC(=O)NNc3cc(Cl)ccc3Br)ccc21 1476084041 HMRSVWZFGRKNNZ-UHFFFAOYSA-N 437.725 4.550 50 10 IJGE C=CCn1c(SCC(=O)NNc2c(C)cccc2Cl)nnc1-c1ccc(Cl)cc1 1636833416 OSMVRSMAAIPJDC-UHFFFAOYSA-N 448.379 4.982 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1ccc(C(F)(F)F)cc1N1CCCC1 1641877293 KBTCVRWIMIYGCN-UHFFFAOYSA-N 433.459 4.668 50 10 IJGE O=C(CCCl)Nc1ccc(Oc2ccc(NC(=O)[C@H]3CCCC[C@@H]3C(=O)O)cc2)cc1 1859505291 UQADGEIBVOTZBJ-PMACEKPBSA-N 444.915 4.876 50 10 IJGE Cc1ccc(O)c([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2cccc(Cl)c2)c1 1865686888 DLEFQWQYEDYPEG-INIZCTEOSA-N 446.816 4.777 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3-c2ccccc2)cc1OCC 1865690800 BISBNUHOAYKBQM-HSZRJFAPSA-N 444.535 4.840 50 10 IJGE Cc1ccc(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2sccc2C)cc1 1865699034 JAZZYUKPXWMORR-HNNXBMFYSA-N 430.455 4.847 50 10 IJGE CCCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccccn1)C(C#N)=C(N)O2 1865700064 KHUMXEWRSFCVNX-IBGZPJMESA-N 440.334 4.804 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccc(Cl)cc2)[C@H]1c1ccccn1 1865700599 YKZVNLFWRACXJQ-OAQYLSRUSA-N 439.906 4.865 50 10 IJGE C[C@@H]1C[C@H]1CCCO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1896107848 DVXRJLHQRJZUOL-IIDMSEBBSA-N 437.362 4.644 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)C(=O)c1ccc(I)cc1 1915091409 WZZJAZQOVBXJNH-INIZCTEOSA-N 427.713 4.951 50 10 IJGE C[C@H](CCCl)N(Cc1ccccc1)C(=O)Cc1ccccc1I 1915137058 JPARSZFJPJVGJB-OAHLLOKOSA-N 441.740 4.880 50 10 IJGE COc1cc([N+](=O)[O-])ccc1C(=O)N(Cc1ccccc1)[C@H](CBr)C(C)C 1915270225 CZARFZJDFIJNDX-GOSISDBHSA-N 435.318 4.665 50 10 IJGE Cc1cc(Br)c(C(=O)N2CC(F)(F)C[C@H]2CBr)cc1Cl 2159045986 FYOFRXOYLXWDMO-QMMMGPOBSA-N 431.502 4.656 50 10 IJGE Cc1cc(Br)c(C(=O)NCC2(F)CC(CBr)C2)cc1Cl 2168562607 LCCMJJLNZSJXAQ-UHFFFAOYSA-N 427.539 4.654 50 10 IJGE CCC[C@@H](CC)N(C)S(=O)(=O)c1ccc(Br)c(CBr)c1 2193558791 YPLHBDCFZMRADK-GFCCVEGCSA-N 427.202 4.543 50 10 IJGE CCN(CCCCCI)[C@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C 2211184541 DUILBHGCFXDUQH-CVEARBPZSA-N 438.394 4.607 50 10 IJGE FC1(F)[C@@H]2[C@@H](O[C@H](CI)c3ccc(Br)cc3)CC[C@H]21 2230422052 WGWBXMWFQKVSDR-XQHKEYJVSA-N 443.069 4.986 50 10 IJGE FC1CC(CBr)(COc2cc(I)ccc2Cl)C1 2250721566 XEWGUALGAMNPRG-UHFFFAOYSA-N 433.486 4.837 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCC[C@H](CCBr)C1 2282973058 XSTCPXGBXKIBRE-SECBINFHSA-N 427.539 4.879 50 10 IJGE CC[C@H](Br)CN(CC)Cc1ccc(Cl)c(I)c1 2300243440 WAIDSKMGCAVXRP-NSHDSACASA-N 430.555 4.940 50 10 IJGE COc1ccc(OCc2sccc2I)c(CBr)c1 2316756855 IDLQZGHSOJNQBX-UHFFFAOYSA-N 439.112 4.835 50 10 IJGE CCOC(=O)c1ccc(NC=C(C#N)C(=O)N[C@@H](CC)c2ccc3c(c2)CCCC3)cc1 2325079273 RYXYSYOVCWKATR-DEOSSOPVSA-N 431.536 4.829 50 10 IJGE ClCc1cc(OCc2ccc(I)c(Br)c2)ccn1 2325385673 DUWGZMQCRZLAEV-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE CCCN(C[C@]1(CBr)CC1(F)F)C1CCN(C(=O)OC(C)(C)C)CC1 2326919854 RSQDUZDOMUDNIX-QGZVFWFLSA-N 425.358 4.518 50 10 IJGE Clc1ccc(I)cc1CN1C2CCC1(CBr)CC2 2327402518 HMBAHNZCVQLRKS-UHFFFAOYSA-N 440.550 4.837 50 10 IJGE Cc1csc(C(=O)N2CC[C@H](Br)C[C@@H]2C(F)(F)F)c1Br 2361457896 GSUUIEPIFSMVHP-JGVFFNPUSA-N 435.103 4.749 50 10 IJGE O=C(CBr)Nc1ccc(Cl)cc1C(=O)c1ccccc1Br 10152058 RYYQCATXMDZEDC-UHFFFAOYSA-N 431.511 4.667 50 10 IJGE CCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cccc(OC)c1 38650239 YEYPTDATPAREMQ-XMMPIXPASA-N 442.471 4.531 50 10 IJGE N#CSc1ccc(NC(=O)c2ccc(CNC(=O)CCOc3ccccc3)cc2)cc1 96458771 UBOGTHZMYKZQQP-UHFFFAOYSA-N 431.517 4.597 50 10 IJGE Cc1ccccc1[C@@H](C(=O)NC1CCCCC1)N(Cc1ccc(F)cc1)C(=O)CCl 97914449 POYRUHCPVZTGCI-QHCPKHFHSA-N 430.951 4.892 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1cc(C(F)(F)F)ccc1Br 159886796 PAIRMDCLVIWHJS-UHFFFAOYSA-N 429.074 4.713 50 10 IJGE CCO[C@H]1[C@@H](Oc2c(Br)cccc2Br)C[C@H]1Br 229342636 CSFWSAAYDONJIV-JFGNBEQYSA-N 428.946 4.531 50 10 IJGE CCC(CC)[C@@H](Br)CNC(=O)c1cccc(C)c1I 230659573 IGDQQKJMQNRHNX-ZDUSSCGKSA-N 438.147 4.529 50 10 IJGE C[C@H](Br)C1CCN(Cc2cc(Cl)ccc2I)CC1 405307851 RMJPSLUPQXKHRN-JTQLQIEISA-N 442.566 4.940 50 10 IJGE CCN(C(=O)c1ccc(Br)cc1Br)C(C)(C)CBr 688360738 KVBWOYKRIJVTGS-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE CC(C)(C)[C@H](CBr)NC(=O)c1scc(Br)c1Br 705426696 OFHKYGUNQUAUAZ-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE Clc1cc(N2CC[C@@]3(CN(Cc4ccccc4)CCO3)C2)ccc1CBr 717591123 IGAXSZQEHJZUNV-OAQYLSRUSA-N 435.793 4.716 50 10 IJGE Clc1cccc(CBr)c1N1CC[C@]2(CN(Cc3ccccc3)CCO2)C1 717593702 PIKOHSTVDGEYBK-NRFANRHFSA-N 435.793 4.716 50 10 IJGE CC[C@@H](Cl)c1noc(-c2ccc(I)c(Br)c2)n1 721576220 DEEYYNXYVNZXAH-MRVPVSSYSA-N 427.467 4.794 50 10 IJGE CC(C)[C@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1cccc(C(F)(F)F)c1 726614068 QMVIRSSKLSGQBK-SFHVURJKSA-N 430.430 4.595 50 10 IJGE O=C(NN=Cc1cnn2cccnc12)c1ccc(COc2ccccc2-c2ccccc2)cc1 755491166 NJIJAULSTSDLTK-UHFFFAOYSA-N 447.498 4.739 50 10 IJGE C=COc1ccc(NC(=O)NNc2c(Br)cccc2Br)cc1 1219080342 ZAUBQNNMKTZSIV-UHFFFAOYSA-N 427.096 4.883 50 10 IJGE C=CC1(CC(=O)NNC(=O)c2ccc(COc3ccc(OCC)cc3)cc2)CCCCC1 1352319432 YELIEANDWPEXLA-UHFFFAOYSA-N 436.552 4.952 50 10 IJGE Cc1cc(NNC(=O)[C@@H](C)SCc2nc(O)c3c(C)c(C)sc3n2)ccc1Cl 1471776213 QPBZLLFJJLTIBA-GFCCVEGCSA-N 436.990 4.741 50 10 IJGE CCc1nn(-c2ccc(OC)cc2)c2c1[C@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 1865686635 YHQMFJCODPIQKB-LJQANCHMSA-N 441.318 4.968 50 10 IJGE CCN(CC)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc(Cl)c2)cc1 1865702239 QELPXSUCHHMKOS-QFIPXVFZSA-N 433.943 4.899 50 10 IJGE CCCc1nn(-c2ccccc2)c2c1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706310 SRNSQKWTENOAIY-IBGZPJMESA-N 435.871 4.605 50 10 IJGE CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)/C(C#N)=C/c3cccc(F)c3)c2C(N)=O)C1 1866131045 DSWQIWTWUFEHLG-AAWPKVBNSA-N 425.529 4.683 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)Cc1scc(Br)c1Br 1880731402 AJLJUUBHAVOTCM-ZETCQYMHSA-N 433.593 4.948 50 10 IJGE Brc1cnccc1C[C@@H](Br)c1ncsc1Br 1924070508 KYOAOHBJGZMXMC-SSDOTTSWSA-N 426.959 4.742 50 10 IJGE C[C@@H](Br)CCOc1c(Br)cc([N+](=O)[O-])cc1Br 2006333677 UTJMLFYTXLOBRL-ZCFIWIBFSA-N 431.906 4.672 50 10 IJGE CC[C@@H](Br)CCCNC(=O)c1cccc(Br)c1Br 2031479176 VSYVRECKAMELDI-SECBINFHSA-N 441.989 4.895 50 10 IJGE CC1([C@H](CBr)NC(=O)c2cccc(Br)c2Br)CC1 2033128310 ZNFAXKPCQZQXCJ-JTQLQIEISA-N 439.973 4.505 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1cc(Cl)cc(Cl)c1O 2061264047 KTJDGJFVWOVELY-UHFFFAOYSA-N 427.419 4.695 50 10 IJGE BrC[C@H]1CCC2(CCC2)N1c1ncc(Br)cc1Br 2084959766 HDBUNRRSEQRMHQ-SNVBAGLBSA-N 438.989 4.893 50 10 IJGE CN(c1nc2sccn2c1CBr)[C@H]1CN(Cc2ccccc2)C(C)(C)C1 2098605711 NESRANJESHQCPV-MRXNPFEDSA-N 433.419 4.780 50 10 IJGE Clc1ccc(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)c(CBr)c1 2129059174 YJQLHRCYMCVORV-SFTDATJTSA-N 435.793 4.715 50 10 IJGE Fc1cncc(N2C[C@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)c1CBr 2153340618 GYHSWWAGELRZAF-FGZHOGPDSA-N 430.365 4.608 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H](Br)CCC23CC3)c1 2220275697 XBNWCWCHLSACML-NSHDSACASA-N 440.550 4.837 50 10 IJGE CCc1nn(C)c([C@H](Br)c2cc(Br)c(OC)s2)c1Cl 2232174156 UPXBUZSYJLSOEC-SECBINFHSA-N 428.577 4.953 50 10 IJGE CN(C[C@H](F)[C@H]1CCOC1)c1c(CBr)ccc(Br)c1Cl 2238357293 IDGANBVHLAUUGT-JQWIXIFHSA-N 429.555 4.808 50 10 IJGE CC1CC(CBr)(CN2CCC([C@H]3CCCN3C(=O)OC(C)(C)C)CC2)C1 2265312520 VGKYILDEDYNFKT-NCYVPVAZSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1CN(CC1CC1)CC1(CBr)CC(F)C1 2265632325 MFJBTPVSUHAHSR-GNZRSQJKSA-N 433.406 4.611 50 10 IJGE Cc1ccc(CBr)cc1NS(=O)(=O)c1cscc1Br 2278725346 MCGASNMCFHEHFR-UHFFFAOYSA-N 425.167 4.515 50 10 IJGE C[C@@H](Br)[C@@H]1CCCN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285844690 PYPIJLNLYHVWQQ-RKDXNWHRSA-N 427.539 4.877 50 10 IJGE CC[C@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@@H]1Br 2300237888 DKCPJRLZGAKZQI-QWRGUYRKSA-N 428.539 4.550 50 10 IJGE C[C@H](CBr)[C@H]1CCCCN1Cc1sccc1I 2301076167 IQPFYEVLNXZXNZ-ZYHUDNBSSA-N 428.177 4.738 50 10 IJGE C[C@H](Br)C[C@H]1CCCCN1Cc1sccc1I 2301076975 RPCVRBNMWAIZIG-WDEREUQCSA-N 428.177 4.881 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@H]1COCCO1 2317395527 JGSNJZXITGNGSJ-PSASIEDQSA-N 446.936 4.511 50 10 IJGE C[C@@H]1CCC[C@H](CO[C@H](CI)c2cccc(Br)c2)O1 2338704612 FLBQMECFUHCNDM-KCPJHIHWSA-N 439.131 4.899 50 10 IJGE Cc1ccc(-n2c(SCC(=O)NN)nc(-c3ccccc3)c2-c2ccccc2)c(C)c1 35666767 UFPAFBDZNKXJPV-UHFFFAOYSA-N 428.561 4.905 50 10 IJGE COc1ccccc1/C=N/NC(=O)c1ccccc1OCc1cccc(Br)c1 96095862 RJCNQYKXWQFKOC-ZVHZXABRSA-N 439.309 4.801 50 10 IJGE O=C([C@@H](Br)Cc1ccccc1Cl)N1CCN(C/C=C/c2ccccc2)CC1 96574458 QVXGCPCDYGKHNF-ZGBFETHSSA-N 447.804 4.504 50 10 IJGE O=C(c1ccc([N+](=O)[O-])o1)[C@H](Br)[C@H](Br)c1ccc(Cl)cc1 106866685 SCPVKHUTGFKSOJ-VXGBXAGGSA-N 437.471 4.924 50 10 IJGE C[C@@](CI)(OCC1CCOCC1)c1ccccc1Br 162319329 JJKVCGHCBWWPOR-HNNXBMFYSA-N 439.131 4.543 50 10 IJGE C[C@@H]1C[C@H](O[C@@](C)(CI)CNC(=O)OC(C)(C)C)CC(C)(C)C1 231313279 CMQDLGHMLAEVLC-GLJUWKHASA-N 439.378 4.936 50 10 IJGE O=S(=O)(Nc1cccc(CBr)c1)c1ccc(Cl)c(Br)c1 236057419 CXEVWTWLVBTXTN-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE CCn1c2ccccc2c2cc(NC(=O)CC(C)=NNC(=O)Cc3ccccc3)ccc21 254741016 BLZJGPDWVNSELZ-UHFFFAOYSA-N 426.520 4.878 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](O[C@@H]2CCCc3ccccc32)C1 303741192 JAMLKWUCFSKNJN-GVDBMIGSSA-N 443.325 4.504 50 10 IJGE O=C(OCc1ccccc1)N1C[C@H](c2ccc(F)cc2)[C@@H](CI)C1 382708943 WGXAVPCSASKOSJ-FUHWJXTLSA-N 439.268 4.613 50 10 IJGE FC1(F)CC([C@H](Br)c2cc(I)cc3c2OCC3)C1 383349127 DEMXJOAGPHBWNQ-NSHDSACASA-N 429.042 4.707 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1C(=O)c1cc(Br)c(Br)s1 705503161 VSUPQEIHGOKQEU-BQBZGAKWSA-N 446.002 4.661 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1C(=O)c1cc(Br)cc(Br)c1 705610513 DDFUWQGADIAAHR-PSASIEDQSA-N 439.973 4.600 50 10 IJGE O=C(N[C@H](CBr)C1CCC1)c1cc(Br)ccc1Br 717610988 ACPUSJMQABKAAS-GFCCVEGCSA-N 439.973 4.505 50 10 IJGE C[C@@H](NC(=O)NNC(=O)c1ccc(C(C)(C)C)cc1)c1ccc(F)c(Br)c1 731048954 IXJFZBRXRFSVFL-GFCCVEGCSA-N 436.325 4.591 50 10 IJGE C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1c(Cl)cc(F)cc1Cl 1137988725 ZJBOQUWICDERAU-LBPRGKRZSA-N 426.703 4.612 50 10 IJGE C=CCC[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(=O)OCC 1158280875 LXFBMNOYUZJFHM-DJAVKIJBSA-N 439.943 4.669 50 10 IJGE C#CCCCC(=O)NNC(=O)Nc1ccc(Sc2ccc(Br)cc2)cc1 1197351399 HZFJSJIHQLGDAL-UHFFFAOYSA-N 432.343 4.557 50 10 IJGE C/C(=C/C1CCC(C)CC1)C(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1 1354024238 YQRUNKIKIVFCTA-SILNSSARSA-N 436.552 4.564 50 10 IJGE C#CCCCC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(F)cc1)CCC2 1456190442 YISZSUOPBAWUTO-ZPHPHTNESA-N 441.506 4.815 50 10 IJGE CC(=O)N(Cc1ccc(NC(=O)NNc2ccc(Br)cc2C)cc1)C(C)C 1476148196 HUYCJHBXVBEVSF-UHFFFAOYSA-N 433.350 4.663 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)c3ccc(C(F)(F)F)cc3)c(C)n2)cc1 1865758810 SFBSXNOWILPAET-UHFFFAOYSA-N 427.426 4.713 50 10 IJGE O=C(N[C@@H](CCl)[C@@H]1CC=CCC1)c1cc(Br)sc1Br 1885066659 CTWUHTAYYSVJDT-SCZZXKLOSA-N 427.589 4.967 50 10 IJGE O=S(=O)(c1ccccc1Cl)N(Cc1ccccc1)C1(CBr)CCC1 1915751702 WHTZZKSNJUSCPV-UHFFFAOYSA-N 428.779 4.849 50 10 IJGE Cc1ccc(S(=O)(=O)N(Cc2ccccc2)C2(CBr)CCC2)c(F)c1 1915755282 LNNXJWWVXZLIMC-UHFFFAOYSA-N 426.351 4.643 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCCC[C@H](Br)C1 2003411230 ZQVUCOSRCDSFHD-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE O=C(CBr)c1ccc(C(F)F)c(C(F)(F)F)c1I 2060393528 HRVMDGJIZXZHAR-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE FC(F)(F)c1cc(Br)nc(-n2nc3c(c2CBr)[C@H]2C[C@H]2C3)c1 2080648136 OERORICAVKLHCA-XPUUQOCRSA-N 437.057 4.603 50 10 IJGE Cc1cc(Br)c(F)c(C(=O)NCCCCCCI)c1 2089377654 GNHWZBDBMPKGGM-UHFFFAOYSA-N 442.110 4.622 50 10 IJGE CC[C@@H]1CCOC[C@H]1O[C@H](CI)c1ccc(Br)cc1 2096206485 IHWRSSDSJJDEMW-KCPJHIHWSA-N 439.131 4.757 50 10 IJGE CC(C)(C)CN(C(=O)c1ccc(CBr)cc1)C1CN(C(=O)OC(C)(C)C)C1 2162870310 WWFHYIKVVFWDJD-UHFFFAOYSA-N 439.394 4.689 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 2196915573 ZOJIILFLKJWHCV-OAGGEKHMSA-N 437.378 4.547 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)cc1I 2269554880 UQOGYWBLLHJWQD-DAYMJXMFSA-N 439.131 4.795 50 10 IJGE CCCN[C@@H](c1ccc(OC)c(I)c1)[C@H]1C[C@@H](Br)C1 2269589484 XNFLLBRMQBLSIG-ZOWXZIJZSA-N 438.147 4.514 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H]2C[C@H](Br)C3)cc1I 2315553726 WDVBATLSBNXPMU-ZSBIGDGJSA-N 440.550 4.835 50 10 IJGE CCCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccccc3F)c(OC)c2)C1=O 38603728 YFQZRWHHYXBKLQ-DEDYPNTBSA-N 448.494 4.806 50 10 IJGE Cc1cccc(Cn2cc(/C=N\NC(=O)CC[C@@H](O)c3ccccc3)c3ccccc32)c1 58888516 BKDLQPJGXQKYQF-GPMZVODXSA-N 425.532 4.962 50 10 IJGE O=C(F)C(F)(F)O[C@](F)(OC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F 198781764 SHJLDESSUGWECW-QMMMGPOBSA-N 448.053 4.720 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@H](C)c2nc(-c3ccc(F)cc3)no2)c(C)n1CC(C)C 212247788 WSBREFDKMQVKSV-MBTVCVBTSA-N 435.503 4.734 50 10 IJGE CC(=O)N(C(=O)/C(C#N)=C\Nc1ccccc1Sc1ccccc1)c1ccc(N)cc1 216924648 QQUQJWARVKTAFI-VLGSPTGOSA-N 428.517 4.819 50 10 IJGE O=C(NCCCCCCBr)c1ccc(Br)cc1Br 232472749 OLVVASBJGGYAJV-UHFFFAOYSA-N 441.989 4.897 50 10 IJGE CCCCOc1ccc(-c2cc(C(=O)NN=Cc3c(O)ccc4ccccc34)[nH]n2)cc1 254296446 XTBRGDPLHFRMSY-UHFFFAOYSA-N 428.492 4.878 50 10 IJGE CC(C)(C)OC(=O)NCCN1CCNC[C@H]1c1ccc(CO[Si](C)(C)C(C)(C)C)cc1 616636510 UZKRYWHEJBOQGP-NRFANRHFSA-N 449.712 4.679 50 10 IJGE O=C(NC1CCC1)[C@@H](c1cccs1)N(C(=O)CCl)c1cccc(C(F)(F)F)c1 725237413 GHPLNSLTJOOHNP-QGZVFWFLSA-N 430.879 4.749 50 10 IJGE O=C(NNC(=S)Nc1cc(C(F)(F)F)ccc1Cl)[C@@H]1C[C@H]1c1c(F)cccc1F 734861856 BEJSQPGCTKGHJU-NXEZZACHSA-N 449.832 4.758 50 10 IJGE O=C(NNc1ccc(Br)cc1F)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 748191382 MATHMSGTERGVHH-NWDGAFQWSA-N 433.199 4.734 50 10 IJGE O=C(NN=Cc1cc(Cl)ccc1O)c1ccc(NC(=O)c2cccc(Cl)c2)cc1 1082753878 UUWBGKPXVNGRDV-UHFFFAOYSA-N 428.275 4.715 50 10 IJGE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=O)c1c(Cl)cccc1Cl 1528035682 HMDYFYWCWBXMMS-KTKRTIGZSA-N 433.213 4.757 50 10 IJGE COc1ccc2ccccc2c1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1cccc(F)c1 1865688344 PVQMGQPOKHMELI-DEOSSOPVSA-N 440.478 4.759 50 10 IJGE CCCCOc1ccc(/C=N/NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1OCC 1873794928 JSDDXHMWVQOHLB-PTFSYIGCSA-N 449.592 4.654 50 10 IJGE CC(C)[C@@H](C)[C@H](C)OC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1901489472 BLMDYCRCFHTXKS-CABCVRRESA-N 439.378 4.888 50 10 IJGE Cc1ccc(S(=O)(=O)N(Cc2ccccc2)C(C)(C)CBr)c2cccnc12 1915770436 CMSTZVKECJUBQO-UHFFFAOYSA-N 447.398 4.908 50 10 IJGE CN(Cc1cccc(Br)c1Br)CC(F)(F)CBr 1945724224 MEPROGOZWIOKQB-UHFFFAOYSA-N 435.932 4.674 50 10 IJGE CCC[C@@](C)(CBr)NC(=O)c1ccc(I)c(Cl)c1 2029945680 QERXBOFZDVDEKK-ZDUSSCGKSA-N 444.538 4.628 50 10 IJGE C[C@H](Cl)[C@@H](NC(=O)c1cc(Br)sc1Br)C(F)(F)F 2074732938 BDFJQRVPRFFHST-BBIVZNJYSA-N 429.483 4.561 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)[C@@H](Br)C2CCCC2)n1 2082962914 SGBYXMVSNYXTQT-GWCFXTLKSA-N 432.384 4.621 50 10 IJGE O=S(=O)(C[C@H](Br)c1cccc(OCc2ccccc2)c1)N1CCCCC1 2089398447 RASDRFBNMBQHNE-FQEVSTJZSA-N 438.387 4.517 50 10 IJGE C[C@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1nc(CCl)ccc1Br)C2 2120532095 QPGABURLJHZGHZ-NHCUHLMSSA-N 434.809 4.931 50 10 IJGE CCC(CC)N(CCBr)C(=O)c1ccc(I)c(C)c1 2142107749 RXXRXMNKGRLDBW-UHFFFAOYSA-N 438.147 4.625 50 10 IJGE CC(C)N(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)CC1(CBr)CCOCC1 2163065113 XPFVBSHIZVLGRF-GOSISDBHSA-N 447.458 4.536 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1C1CCN(C[C@@H](CBr)CC2CC2)CC1 2185498998 ALVUPLFRVXMQJT-OAHLLOKOSA-N 441.414 4.747 50 10 IJGE O=C(c1cccc(Br)c1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Cl)C2 2190688717 YFRQTAWZOUIQAG-HKDSHFDBSA-N 425.523 4.534 50 10 IJGE CN(C(=O)c1scc(Br)c1Cl)[C@@H](CCBr)C(F)F 2253552589 RUXFOYUHXPHDBM-LURJTMIESA-N 425.520 4.655 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@@H](Br)CC2(CC2)C1 2285956914 CAZANNFOGAAOOH-QMMMGPOBSA-N 425.523 4.631 50 10 IJGE N#CC(C(=O)Nc1ccccc1)=C1S[C@H](Cc2ccccc2)C(=O)N1c1ccc(F)cc1 2293039037 WJVVHEGFWMXKEO-JOCHJYFZSA-N 443.503 4.891 50 10 IJGE Brc1cnc(N2CC[C@H]3CC[C@@H](Br)[C@@H]2C3)c(Br)c1 2310077608 QXOPQLBMMQPVIN-UISBYWKRSA-N 438.989 4.749 50 10 IJGE Cc1cc(OCC(=O)NNC(=O)C=Cc2ccc(Cl)cc2Cl)cc(C)c1Cl 2314716793 OUDAZQAHWRGXEK-UHFFFAOYSA-N 427.715 4.503 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(Cc2ccc(I)c(Cl)c2)[C@H]1C 2321326629 RLRGQJCSMFRDCP-NHCYSSNCSA-N 442.566 4.938 50 10 IJGE Cc1nn(Cc2ccccc2)c2c1[C@@H](NC(=O)C(C#N)=Cc1cccc(Cl)c1)CCC2 2329676811 WSXABTDNDSNEEF-QFIPXVFZSA-N 430.939 4.994 50 10 IJGE CC1(C)COC[C@@H]1CO[C@@H](CI)c1ccccc1Br 2339010113 IXCJLQNWQNTTLB-RISCZKNCSA-N 439.131 4.614 50 10 IJGE Cn1cc(I)c(C[C@@H]2C[C@H](C(C)(C)C)CC[C@H]2Br)n1 2341856362 JUHBKNYQFMLHHD-QJPTWQEYSA-N 439.179 4.793 50 10 IJGE O=[N+]([O-])c1cc(CBr)ccc1OCc1cccc(I)c1 2367529840 PBQISQSSTQRANK-UHFFFAOYSA-N 448.054 4.673 50 10 IJGE O=C(CCSc1ccc(F)cc1)NNc1nc2c(Br)cccc2s1 10045936 XVDFCAKMNLPGLK-UHFFFAOYSA-N 426.336 4.823 50 10 IJGE Cc1nn(-c2ccccc2)c2sc(C(=O)N/N=C\c3ccc(Br)cc3)cc12 33154966 ULTGKPCVLUYPCS-UUYOSTAYSA-N 439.338 4.922 50 10 IJGE CCN(c1ccccc1)c1ncnc(NNC(=O)c2ccc(Cl)cc2Cl)c1[N+](=O)[O-] 40573487 ACBIWNJWWLAOTJ-UHFFFAOYSA-N 447.282 4.607 50 10 IJGE O=C(CSc1nc(-c2ccc(Cl)cc2)cs1)N/N=C/c1ccc([N+](=O)[O-])cc1 40924684 XNGCDCYVAKEDFC-AWQFTUOYSA-N 432.914 4.614 50 10 IJGE C=CCc1cccc(/C=N/NC(=O)c2cccc(NC(=O)c3ccc(Cl)cc3)c2)c1O 96095850 OQJDOZNDTSWQIH-CVKSISIWSA-N 433.895 4.790 50 10 IJGE COc1ccc([C@H](Br)c2ccc(I)cc2)cc1OC 109840060 KBHXPMHIRVYFBN-OAHLLOKOSA-N 433.083 4.793 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1Br)c1ccc(Br)c(C(F)(F)F)c1 123003525 LTZCKBYRXMMYFO-RYUDHWBXSA-N 429.074 4.904 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)cc(Cl)c1OC 169891215 JTBPTXBGZVVKCO-QOWQLIIWSA-N 425.916 4.727 50 10 IJGE COc1ccc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccccc4)nc3c2)c(Cl)c1OC 169925806 YUCIDCSDCJJYLP-WGARJPEWSA-N 448.910 4.588 50 10 IJGE Cn1nc(-c2ccccc2)c(-c2ccccc2)c(C(=O)Nc2nc(CCl)cs2)c1=O 170507763 LXUPERXJAQOTTC-UHFFFAOYSA-N 436.924 4.562 50 10 IJGE CCOc1ccc(CCN/C=C(/C#N)C(=O)Nc2cccc3c(O)cccc23)cc1OCC 217074176 JJZSXAMTDUZAPF-ZPHPHTNESA-N 445.519 4.521 50 10 IJGE Cc1cc(I)ccc1NC(=O)/C(C#N)=C\Nc1ccc(Cl)cc1 217253905 XCYGWQAGDQDUGS-BENRWUELSA-N 437.668 4.711 50 10 IJGE C[C@@H]1CCC[C@H](CO[C@@](C)(CI)CNC(=O)OC(C)(C)C)C1 300795843 VKVFUHHVOWKRAF-KEYYUXOJSA-N 425.351 4.548 50 10 IJGE CC(C)[C@@H]1CN(c2nc3ccccn3c2CBr)CCN1Cc1ccccc1 704736218 GABJUZOYAJHYDP-FQEVSTJZSA-N 427.390 4.576 50 10 IJGE CC[C@H](NC(=O)c1scc(Br)c1Br)[C@H](Br)CC 705438836 LSZUGILNOSKDNF-SVRRBLITSA-N 448.018 4.955 50 10 IJGE Cc1cccc(C)c1-n1c(C)cc(C=NNC(=O)C(=O)Nc2ccc(C(C)C)cc2)c1C 725396302 UPGWHVDINMBOMB-UHFFFAOYSA-N 430.552 4.923 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)n2ccc(=NCC(F)(F)F)cc2)c(C)n1-c1ccccc1F 775493074 GNJBBBXACUGDRF-LDADJPATSA-N 442.416 4.745 50 10 IJGE Cc1c(Br)ccc(C(=O)NNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1F 789867127 LPJMUGNFKIBTNZ-UHFFFAOYSA-N 436.159 4.581 50 10 IJGE Cc1cc(C)n(-c2ccc(NC(=O)NNc3ccc(C#N)cc3C(F)(F)F)cc2F)n1 799387198 IERDBTUJNQTOMB-UHFFFAOYSA-N 432.381 4.667 50 10 IJGE C[C@H](OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)c1ccc(F)cc1F 920155667 BPEADYPLAWORAJ-IQFISFIMSA-N 432.430 4.953 50 10 IJGE Cn1cc(C(=O)Nc2cc(Br)ccc2CO[Si](C)(C)C(C)(C)C)nc1O 1523274737 YOCUHCXPOCMPAW-UHFFFAOYSA-N 440.414 4.662 50 10 IJGE CCOc1ccc(Br)cc1C=NNC(=O)COc1cc(Cl)ccc1Cl 1772753728 FONMXSZMOIKUNU-UHFFFAOYSA-N 446.128 4.684 50 10 IJGE Cc1ccc(O)c([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(Cl)c(Cl)c2)c1 1865684975 BQMPKQLVFMLXHA-LJQANCHMSA-N 427.291 4.720 50 10 IJGE Cc1nn(Cc2ccc(F)cc2)c2c1[C@@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 1865685558 JZEHSBQPBDRONL-SFHVURJKSA-N 429.282 4.904 50 10 IJGE Cn1cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2Cc1ccc(Cl)cc1 1865698694 AODGEBMPEFYVBK-NRFANRHFSA-N 441.922 4.808 50 10 IJGE Brc1ccc(OCc2ccccc2)c([C@H](Br)[C@@H]2COCCO2)c1 1899856845 MEQASXNYTRTATK-ROUUACIJSA-N 442.147 4.880 50 10 IJGE Brc1cccnc1C[C@@H](Br)c1sncc1Br 1924877835 WOUZAARYTKJEBJ-SSDOTTSWSA-N 426.959 4.742 50 10 IJGE C[C@@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1ccc(CCBr)s1 2009639594 DZCBTLXSGKZWNJ-AWEZNQCLSA-N 428.417 4.675 50 10 IJGE O=S(=O)(c1ccc(Cl)cc1F)N(Cc1ccccc1)[C@H](CBr)C1CC1 2057408405 RQVXCARBICBOAY-QGZVFWFLSA-N 446.769 4.844 50 10 IJGE F[C@@H]1CCO[C@H]1COc1c(Br)cc(CBr)cc1Br 2058657253 XRMGIIKQHPYGJB-MNOVXSKESA-N 446.936 4.612 50 10 IJGE ClC[C@H]1CCCC[C@H]1CNc1ncc(I)cc1Br 2069526180 RMWGSFZLHKQHSI-ZJUUUORDSA-N 443.554 4.906 50 10 IJGE C[C@H](Cl)[C@@H](NC(=O)c1csc(Br)c1Br)C(F)(F)F 2074720876 PUWRTPRCGUCFPN-BBIVZNJYSA-N 429.483 4.561 50 10 IJGE Cc1cc(Br)c(C)c([C@@H](Br)[C@@H]2COCCO2)c1Br 2081072677 XAGCOUZLOHJPBK-GWCFXTLKSA-N 442.973 4.680 50 10 IJGE CS(=O)(=O)c1csc([C@H](Br)c2ccc(Br)c(F)c2)c1 2093075163 UDGIVEXZRRZUFI-GFCCVEGCSA-N 428.142 4.538 50 10 IJGE CN(Cc1ccccc1)[C@H](Cn1c(CCl)nc2cncc(Br)c21)C1CC1 2095436157 GSWJQLWTYFPDBH-GOSISDBHSA-N 433.781 4.843 50 10 IJGE CC(C)(C)OC(=O)NC1[C@H]2CC[C@H]1CN(CC1(CBr)CCCCCC1)C2 2106783694 BZLCKVOBLYCDST-IRXDYDNUSA-N 429.443 4.957 50 10 IJGE C[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)CN1C[C@@H](CBr)c1ccccc1 2106787121 YBLPQONEBSHBKR-ZHALLVOQSA-N 425.411 4.790 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCC([C@H](F)CCl)CC1 2106949466 CJDSIUYEUHLKJQ-SECBINFHSA-N 433.568 4.702 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@@]2(CCC[C@@H]2Br)C1 2115924459 LSKICXCDCTZACQ-GWCFXTLKSA-N 427.589 4.944 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CCC([C@@H](F)CBr)CC1 2115939385 DBBVUARNJSILIN-VIFPVBQESA-N 433.568 4.749 50 10 IJGE Clc1ccc(C(CBr)(CBr)C[C@@H]2COCCCO2)cc1 2154016236 YWLOZPLFRQQRJD-CQSZACIVSA-N 426.576 4.563 50 10 IJGE CN(C[C@@H](Cl)C1CCCC1)C(=O)c1ccc(I)c(Cl)c1 2167648489 WJSYBIBRFOHVND-CYBMUJFWSA-N 426.125 4.814 50 10 IJGE O=[N+]([O-])c1cc(CBr)ccc1N1[C@H]2CCC[C@H]1CN(Cc1ccccc1)C2 2182303151 GORUOKCOZRYYOO-OALUTQOASA-N 430.346 4.733 50 10 IJGE FC(F)(F)[C@H]1C[C@@]1(CCl)CNCc1cc(Cl)ccc1I 2192573355 QHTIJTLCOYZJRT-NWDGAFQWSA-N 438.058 4.842 50 10 IJGE CCCN(CCCCCI)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2211187431 UFECNMOPYOFTOY-INIZCTEOSA-N 438.394 4.703 50 10 IJGE Cc1cc(Cl)cc(C(=O)NC[C@H]2C[C@H](Br)C2)c1NC(=O)OC(C)(C)C 2224048993 ZEEIREPLHDHGFV-HAQNSBGRSA-N 431.758 4.899 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2C1[C@@H]2CN(Cc3ccccc3)C[C@@H]12 2286083588 IZDLNUOSSDXFQK-HUUCEWRRSA-N 446.776 4.849 50 10 IJGE COc1ccc2nc(C(C#N)=Cc3ccccc3OCc3ccc(C(=O)O)cc3)[nH]c2c1 2297377666 WQJBGWYYHQZNKU-UHFFFAOYSA-N 425.444 4.913 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1Cc1cc(I)ccc1Cl 2307328506 NZCVMOWLFWNZIE-GXSJLCMTSA-N 428.539 4.692 50 10 IJGE CCOC(=O)C(C#N)=C1C(=O)N2c3c1cc(CC)cc3[C@@](C)(c1ccccc1)CC2(C)C 2313676852 PVJCWBMUANSRIN-HHHXNRCGSA-N 428.532 4.924 50 10 IJGE CC1=C(C#N)C(=O)N(C2CCCC2)C(=O)C1=Cc1ccc(OCc2ccccc2F)cc1 2314616662 GRGCANSDNQRDKH-UHFFFAOYSA-N 430.479 4.940 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4Cl)[nH]c3c2)cc1[N+](=O)[O-] 2323744183 FHBJMNYSIGWRLB-UHFFFAOYSA-N 449.854 4.564 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2COC3(C)CC2C3)cc1I 2337680681 SCOSUPAKLAPCAC-VOOMFWRJSA-N 437.115 4.551 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cc(C(F)(F)F)ccc1F 2369431473 RJOMAYLEAAHSFJ-HNNXBMFYSA-N 448.254 4.945 50 10 IJGE Clc1nccc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)c1CBr 2370824609 LCKOKICTIHSVCQ-GTAWCEEGSA-N 446.820 4.977 50 10 IJGE CSc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccccc4)ccc32)cc1 38682621 VDLLRXYFBRQDOW-DEOSSOPVSA-N 428.513 4.775 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2ccc([N+](=O)[O-])cc2)sc2c1CC[C@@H](C)C2 102957798 ZRMGYWLPGWARAM-LKKYZFDUSA-N 439.493 4.503 50 10 IJGE COc1ccccc1/C=C(/C#N)C(=O)N(c1ccc(C)cc1)S(=O)(=O)c1ccc(C)cc1 207132714 NQZDTJVYNCGBAQ-PGMHBOJBSA-N 446.528 4.641 50 10 IJGE CC(C)C[C@H](Br)CNC(=O)c1cc(Br)sc1Br 232639349 JUNDFCLNQMUNNN-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc3ccccc3c2C=NNC(=O)c2cccnc2)cc1 254644336 IVZUICIVKCMRNK-UHFFFAOYSA-N 439.471 4.617 50 10 IJGE CCCCCCCCCCCCCC(=O)NCC(=O)NN=Cc1ccc(C(=O)OC)cc1 263628388 ORVIZAKQWSDJRB-UHFFFAOYSA-N 445.604 4.741 50 10 IJGE C[C@H]([C@H](Br)c1cc(I)cc2c1OCC2)C(C)(F)F 385681716 CSQPCJXJIDQDLK-HQJQHLMTSA-N 431.058 4.953 50 10 IJGE ClCCc1nc2ccc(Br)cc2n1[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 398447882 MFRNJAKMRYCCIP-LFUKPOHLSA-N 430.777 4.883 50 10 IJGE O=C(Nc1ccc(S(F)(F)(F)(F)F)cc1)C(=O)N1CCN(Cc2ccccc2)CC1 772926417 DGPLWDATJZFQHL-UHFFFAOYSA-N 449.445 4.627 50 10 IJGE CC(=O)N(c1ccc(C)cc1)c1nc(/C=C(\C#N)C(=O)N(C)Cc2ccccc2)cs1 787151004 XUBIOPVXCWFOSJ-DEDYPNTBSA-N 430.533 4.702 50 10 IJGE CCOC(=O)O[C@]1(C(=O)OCCl)CC[C@@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]21C 1082546915 FVOOBFFVLCZGIJ-OEGGEXCMSA-N 448.943 4.866 50 10 IJGE C#CCOc1cccc(OC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(OC)cc3)c2C)c1 1352969653 RJQQFESQIUIACR-RCCKNPSSSA-N 426.472 4.627 50 10 IJGE C/C(=C\c1ccc(Br)o1)C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1 1538859725 BJAUSEUCSNUSKF-ZHACJKMWSA-N 449.301 4.774 50 10 IJGE CN1C[C@@H](CI)[C@H](c2cc(C(F)(F)F)ccc2Br)C1 1614693935 MMVPUZUZJIKCFL-LDYMZIIASA-N 448.064 4.548 50 10 IJGE Cc1ccc(Cn2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2ccccc2O)cc1 1865707783 GDMPEWBAKNIRAK-QHCPKHFHSA-N 434.499 4.831 50 10 IJGE COc1ccc(/C=N/NC(=O)c2ccncc2)cc1OCc1ccc(Cl)cc1Cl 1873499364 RJPOOOZRXRUSSW-BRJLIKDPSA-N 430.291 4.740 50 10 IJGE N#C/C(=C(/O)[C@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2cccc([N+](=O)[O-])c2)cs1 1873941179 ZYAFBVHBGPPYLN-UBZKEQBWSA-N 446.488 4.560 50 10 IJGE CCCCN(CCBr)C(=O)c1csc(Br)c1Br 1945189677 XJHNLZYEPVVPEK-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE C[C@@H]1CN(Cc2c(Br)cccc2Br)CC[C@H]1Br 1945333218 MYHHRYYXLMLRDI-MWLCHTKSSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC[C@](C)(CI)O2)C12CCCCC2 1989553208 SEPMXSCCPPPNKU-SJLPKXTDSA-N 435.346 4.683 50 10 IJGE BrCC[C@@H]1CCCN(c2ncc(Br)cc2Br)CC1 2032377076 BPQDRFBHPHFHDN-JTQLQIEISA-N 441.005 4.998 50 10 IJGE CC[C@@H](Br)[C@@H](CC)NC(=O)c1c(Br)cccc1Br 2033085669 FVVWBIIESYCJPH-LDYMZIIASA-N 441.989 4.894 50 10 IJGE CC(C)N(C[C@@H]1CCCN(C[C@@H](Br)C(F)(F)F)C1)C(=O)OC(C)(C)C 2044698088 ZGHZXFPCYIWBGT-ZIAGYGMSSA-N 431.337 4.670 50 10 IJGE Cc1cc(O)ccc1Cn1nc(CBr)c(Br)c1C(F)(F)F 2079232550 ZATTZKUYHWXYMS-UHFFFAOYSA-N 428.046 4.622 50 10 IJGE ClCc1cc(Br)c(OCCS[C@@H]2CCOC2)c(Br)c1 2092690089 RICNVVFVVDRMHZ-SNVBAGLBSA-N 430.589 4.851 50 10 IJGE CN(CC1CCN(C(=O)OC(C)(C)C)CC1)C[C@H](CBr)c1ccccc1 2106789509 YYHCGYODMNBENB-IBGZPJMESA-N 425.411 4.744 50 10 IJGE Cc1ccc(C(=O)N[C@H](C)CCCCCI)cc1Br 2117896350 ZTBNVFHVLVIMAR-GFCCVEGCSA-N 438.147 4.871 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]([S@](C)(=O)=NCc2ccc(CBr)cc2)C1 2126472897 ZQAKZXBGIXQXJK-QUGAMOGWSA-N 445.423 4.579 50 10 IJGE Cc1sc(Br)c(C(=O)N2CCC(F)(F)[C@H](CBr)C2)c1C 2157248266 JSBRIRLJNLBIOS-SECBINFHSA-N 431.140 4.620 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@]2(F)CCC[C@]2(CCl)C1 2176634433 CMQUZBPWVDEINZ-QWHCGFSZSA-N 445.579 4.846 50 10 IJGE COc1cc(Cl)c([C@@H](Br)[C@@H]2OCCOC2(C)C)cc1Br 2202353969 SRGDNGBLVJQJFQ-OLZOCXBDSA-N 428.548 4.741 50 10 IJGE ClCCc1nc2cc(Br)c(Br)cc2n1Cc1nccs1 2234055421 BHSUIBLOCFWDBB-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CCCN(C[C@@H](C)Cl)C(=O)c1cc(I)ccc1Br 2259753856 HCFABTYNCCHBAN-SECBINFHSA-N 444.538 4.533 50 10 IJGE CN(Cc1ccccc1I)c1ccc(F)cc1CBr 2265544082 IMHXPWDBWAIILN-UHFFFAOYSA-N 434.090 4.962 50 10 IJGE Cc1cc(Br)c([C@@H](Br)[C@H]2CCCCS2(=O)=O)c(C)c1F 2279145133 VDNJECLKUPSOQJ-YPMHNXCESA-N 428.161 4.608 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCS[C@@H](CCBr)C1 2282974143 FPEIUJPVRAMUNL-QMMMGPOBSA-N 445.579 4.584 50 10 IJGE O=C(CCCCl)Nc1cc(Cl)ccc1N1CCN(C(=O)C=Cc2ccccc2)CC1 2296474128 ARDLMLMYLPTHSF-UHFFFAOYSA-N 446.378 4.660 50 10 IJGE CS(=O)(=O)C1([C@H](Cl)c2ccc(OCc3ccccc3)cc2Br)CC1 2299499552 YNPFMSFAESEIFX-QGZVFWFLSA-N 429.763 4.885 50 10 IJGE N#CC(=CNC1CCCCCCCCCCC1)C(=O)Nc1cccc(S(=O)(=O)O)c1 2324197301 IUYJHXBOJWYWRK-UHFFFAOYSA-N 433.574 4.542 50 10 IJGE CC[C@H](NC(=O)C(C#N)=CNCCc1c[nH]c2ccccc12)c1ccc2c(c1)CCCC2 2325092694 OIIRPNJLLLWIGY-VWLOTQADSA-N 426.564 4.854 50 10 IJGE CN(C[C@]1(CBr)CC1(F)F)[C@@H]1CCCC[C@H]1N(C)C(=O)OC(C)(C)C 2326920464 ZZUJMAASZYKGFT-CKEIUWERSA-N 425.358 4.517 50 10 IJGE CC1(C)COC[C@@]1(CBr)Cc1cc(I)ccc1Cl 2327404915 XZQMKGHFSFBKRO-AWEZNQCLSA-N 443.550 4.925 50 10 IJGE COc1ccc(CC(O)=C(C#N)c2nc(-c3ccc(OC)c(OC)c3)cs2)c(OC)c1 2331241438 JARGVVORIZORFP-UHFFFAOYSA-N 438.505 4.880 50 10 IJGE COc1cccc(-c2csc(C(C#N)=C(O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3)n2)c1 2331249171 YMFBBDDQSMFLBA-UHFFFAOYSA-N 438.421 4.893 50 10 IJGE Cc1sc(C(=O)NCC(F)(F)C(F)(F)CBr)c(C)c1Br 2361672523 QJMADZZHJUFHBU-UHFFFAOYSA-N 441.082 4.523 50 10 IJGE CC(C)(C)[C@](C)(CBr)CN1CCC[C@]2(CN(Cc3ccccc3)CCO2)C1 2380175697 LZXADVYEONFSLJ-PKTZIBPZSA-N 437.466 4.801 50 10 IJGE Cc1ccc(OCCn2cc(/C=C(/C#N)C(=O)NC[C@H]3CCCO3)c3ccccc32)cc1C 33932573 PVIOAMSCDGCXBW-HVUZKSCUSA-N 443.547 4.539 50 10 IJGE Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(C)c(C)c4)ccc32)cc1 38649256 NUONXRQWLNMIPP-AREMUKBSSA-N 440.499 4.814 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4cccc(C)c4C)ccc32)cc1 38649259 VCTCKJCMDWUHNX-SANMLTNESA-N 440.499 4.814 50 10 IJGE Cc1ccccc1C(=O)NNc1ncnc(Nc2ccc(Oc3ccccc3)cc2)c1N 40784395 PGDRIUVNKVSQEX-UHFFFAOYSA-N 426.480 4.660 50 10 IJGE C=CCc1cc(/C=N/NC(=O)Nc2ccc(Br)c(C)c2)cc(OCC)c1O 59249947 MYGULKQLDPLZSQ-WSDLNYQXSA-N 432.318 4.746 50 10 IJGE Cc1c(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)c2ccccc2n1Cc1ccc(Cl)cc1 59396278 VDCQQTAPNQSDBC-YMFQVDJJSA-N 433.939 4.854 50 10 IJGE CN(Cc1ccc(Cl)s1)S(=O)(=O)c1cc(CCl)ccc1Br 91269649 VEOYJDSBTGJQCO-UHFFFAOYSA-N 429.188 4.724 50 10 IJGE ClCc1c(I)cc2ccsc2c1I 306609370 KEEJFSMDCZWWJX-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE Cn1ncc([C@H](Br)c2ccc(C(C)(C)C)cc2)c1I 393630591 CEUKCOBDKRHOJF-CYBMUJFWSA-N 433.131 4.807 50 10 IJGE C[C@H](CBr)[C@H](C)Nc1ncc(C(F)(F)F)cc1I 686109204 PRBBXHWNSJIAPX-RQJHMYQMSA-N 437.041 4.536 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)c1C 743462563 JSOCEPZATHFBBS-ROUUACIJSA-N 428.323 4.709 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccn(-c3cccc(C(F)(F)F)c3)n2)c(C(F)(F)F)c1 799752646 BTHAPHCWZBZQGD-UHFFFAOYSA-N 439.319 4.538 50 10 IJGE C=CCOc1ccccc1CNC(=O)NNc1ccc(Br)cc1C(F)(F)F 1221984269 DTDNEDIVBVBMET-UHFFFAOYSA-N 444.251 4.859 50 10 IJGE C=CCn1nc(C)c(-c2cc(C(=O)NNc3ccccc3Oc3ccccc3)n[nH]2)c1C 1469847003 NQTKINSJMXWLLG-UHFFFAOYSA-N 428.496 4.625 50 10 IJGE CCCc1nn(Cc2cc(C)ccc2C)c2c1[C@@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865712581 CBMPPDLBNOJVHU-QFIPXVFZSA-N 443.507 4.627 50 10 IJGE CC[C@@H](NC(=O)Cc1nc(-c2cccc(C)c2)oc1C)C(=O)Nc1ccc(SC#N)cc1 1866647256 HUEDEWMEWSXCQJ-HXUWFJFHSA-N 448.548 4.608 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CC[C@]23CCC[C@H](CI)O3)C1 1986986357 QRUAJJYWYACJHK-FHLIZLRMSA-N 435.346 4.540 50 10 IJGE C[C@H]1C[C@H](Br)CN(Cc2ccc(I)c(Cl)c2)C1 2026563456 KFGBRIYDHGQKGZ-ONGXEEELSA-N 428.539 4.550 50 10 IJGE O=C(CBr)c1c(Br)cc(C(F)(F)F)cc1OC(F)(F)F 2054797946 PPXNYEAAYFFDBZ-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE COc1cc(Cl)c([C@@H](Br)c2cc(Br)n(C)n2)cc1Cl 2094083150 XWFTXNWWLJFEPR-GFCCVEGCSA-N 428.939 4.982 50 10 IJGE Cn1nc([C@@H](Cl)c2cc(I)cc3c2OCC3)c(Cl)c1Cl 2150719291 XVXIDSKARQHPOV-VIFPVBQESA-N 443.499 4.595 50 10 IJGE C[C@@H]1CCCN(C(=O)[C@@H](Br)C2CCCC2)[C@@H]1CCCNC(=O)OC(C)(C)C 2167031939 HBEKSKWGUBEQQI-NXHRZFHOSA-N 445.442 4.872 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H](C)N(c2cc([N+](=O)[O-])ccc2CBr)C1 2176909024 PXHQLBZJHGIPSX-IRXDYDNUSA-N 432.362 4.837 50 10 IJGE CC(C)[C@@H]1CN(c2ccc(CBr)c([N+](=O)[O-])c2)CCN1Cc1ccccc1 2188576287 GISXNDOKSDGTNZ-NRFANRHFSA-N 432.362 4.837 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CCC[C@]23CC[C@](C)(CI)O3)C1 2213351914 DOTMMIBUZMOBDZ-RGCFKVTRSA-N 449.373 4.786 50 10 IJGE COC1(CO[C@@H](CI)c2cccc(Br)c2)CCC1 2254979758 VXFRVKSFRJTCGH-ZDUSSCGKSA-N 425.104 4.511 50 10 IJGE C[C@H](CCCCBr)NC(=O)c1ccc(Cl)c(I)c1 2256389798 MQKNKVLXFKQYRQ-SECBINFHSA-N 444.538 4.628 50 10 IJGE COc1cc(C=CC(=O)Cl)cc(I)c1OCc1ccccc1F 2293940990 SRXGCEBELYLJNW-UHFFFAOYSA-N 446.643 4.797 50 10 IJGE COc1cc(NC=C(C#N)c2nc(-c3ccc4c(c3)OCO4)cs2)cc(OC)c1OC 2296033227 PYIUZZOZHBSICV-UHFFFAOYSA-N 437.477 4.541 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=C(C#N)C(=O)Nc3ccc([N+](=O)[O-])cc3)o2)cc1 2297551609 ULKHKRXGOAHJGM-UHFFFAOYSA-N 431.404 4.577 50 10 IJGE Clc1cc(CN2[C@H]3CC[C@H](C3)[C@H]2CBr)ccc1I 2312137803 ROZBHFLWOJEIQS-UHIISALHSA-N 440.550 4.692 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)cc1OCC 2321215872 INETVUYIMZCXMS-UHFFFAOYSA-N 439.462 4.897 50 10 IJGE CCCCCCCOc1ccccc1C=NNC(=O)c1cc(-c2ccccc2)nc(O)n1 2323693594 GGKRALZDAOPFTI-UHFFFAOYSA-N 432.524 4.962 50 10 IJGE COC(=O)c1ccc2c(O)nc(C(C#N)=Cc3ccccc3OCc3ccccc3)nc2c1 2331045427 PGKDJXJQHKHYRV-UHFFFAOYSA-N 437.455 4.765 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Cl)c1c(Br)ncn1C 2337274467 IHBXEKWGLUEHRO-SECBINFHSA-N 428.939 4.935 50 10 IJGE COc1ccc([C@H](Br)C23CC(C[C@H](C)O2)C3)cc1I 2342244792 UOGAYOLPCKPSHU-SWNPZRGKSA-N 437.115 4.693 50 10 IJGE C[C@H](Cl)CN(C(=O)c1cc(Cl)ccc1I)C1CCCC1 2368857312 GYQOJIHMPZWHIR-JTQLQIEISA-N 426.125 4.957 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)[C@]1(C(=O)O)CCC(C)(C)C[C@@H]1OCc1ccccc1 2378156732 QPUWQBALYRUTLC-LMVRJCEZSA-N 438.406 4.711 50 10 IJGE Cc1ccc[n+]([C@@H]2C(=O)N(CCc3ccccc3)C(O)=C(C#N)[C@H]2c2ccc(Cl)cc2)c1 20407930 YBZMNNWTJUAKIP-RPWUZVMVSA-O 444.942 4.639 50 10 IJGE CC[C@H](C)/C(C)=N\NC(=O)c1cccc(S(=O)(=O)Nc2cc(Cl)ccc2Cl)c1 34847241 DUXBPCCFFRCYKO-CJVAQADSSA-N 442.368 4.946 50 10 IJGE CCc1ccc(Oc2nc3ccccn3c(=O)c2/C=C(/C#N)c2nc3ccccc3[nH]2)cc1 35549716 QZHQLAZSFWBCSS-SDXDJHTJSA-N 433.471 4.990 50 10 IJGE COc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)Oc4ccc(C)cc4)c(C)c32)c1 40822440 JNPXVFKRCHAFRD-LHLOQNFPSA-N 432.476 4.595 50 10 IJGE O=C(NC1(CBr)CCCC1)c1cc(Br)ccc1Br 161219934 NWQSPZCDDGUTJL-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE CC[C@@H](NC(=O)/C(C#N)=C\Nc1ccc(Br)cn1)c1ccc2c(c1)CCCC2 217193743 KKZFYLUFYNAVGX-MTGKDYNDSA-N 439.357 4.810 50 10 IJGE O=C(NC[C@H]1CC[C@H](Br)C1)c1ccc(Br)cc1Br 227668694 YWVLFVJEOJTQBV-IUCAKERBSA-N 439.973 4.505 50 10 IJGE COc1ccc2cccc(CI)c2c1CI 309205505 BYSQOZTUZZAMOX-UHFFFAOYSA-N 438.046 4.718 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1C(=O)c1ccc(Br)cc1Br 705610453 CXOXSLKCRLLTMU-PSASIEDQSA-N 439.973 4.600 50 10 IJGE CC(C)Oc1ccc(Br)cc1C=NNC(=O)c1ccccc1Br 1083969323 SLQRICJZXXBTNV-UHFFFAOYSA-N 440.135 4.763 50 10 IJGE CCOc1ccc(Br)cc1C=NNC(=O)COc1cccc2ccccc12 1084439161 FJIIUPKZXZGDIQ-UHFFFAOYSA-N 427.298 4.530 50 10 IJGE CC(=O)c1cc(C(=O)NNc2ccc(-c3ccc(Cl)s3)nn2)ccc1OC(C)C 1161586843 LWRBKFPYBKYFOW-UHFFFAOYSA-N 430.917 4.605 50 10 IJGE C#C[C@@H](NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1)c1ccccc1 1557178499 OTWPEIUVZRUTGP-QFXGEWDLSA-N 439.906 4.515 50 10 IJGE COc1cc(C=NNC(=O)COc2c(C)ccc(C)c2C)ccc1OCc1ccccc1 1772753173 OCHZDIYYCNXRAM-UHFFFAOYSA-N 432.520 4.729 50 10 IJGE COc1cc(-c2csc(/C(C#N)=C(\O)[C@H]3CC(=O)N(C(C)C)C3)n2)c(OC)cc1Cl 1872754883 NFDKCPRUUKYDFO-SXPRPLFSSA-N 447.944 4.530 50 10 IJGE CCC[C@@H]1C[C@H]1CO[C@@](C)(CI)CN(CC)C(=O)OC(C)(C)C 1897635052 IQJQNSKHZURTIS-VKJFTORMSA-N 439.378 4.890 50 10 IJGE COCCOc1ccc([C@H](Br)C2(Br)CC2)cc1Br 2049222601 FDXJNIIPRSIASQ-LBPRGKRZSA-N 442.973 4.838 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3C[C@H](Br)C[C@H]3C2)c1 2065404231 RTMUOWYFXYLCLG-IWIIMEHWSA-N 438.001 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CCCCN(C[C@H](CBr)C2CCC2)CC(F)(F)C1 2108601610 GRDCYPOPJSUXCE-INIZCTEOSA-N 439.385 4.766 50 10 IJGE CCN(c1ccccc1)S(=O)(=O)c1cc(CBr)sc1Br 2179787700 SNUKJTKOGUEHMN-UHFFFAOYSA-N 439.194 4.621 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Br)C1(S(C)(=O)=O)CCC1 2202996165 DYGKRUOAUNJIQH-LBPRGKRZSA-N 446.588 4.514 50 10 IJGE CC1CC(CBr)(CN(CCNC(=O)OC(C)(C)C)Cc2ccccc2)C1 2241343041 XCCPKTZVLFPMFL-UHFFFAOYSA-N 425.411 4.825 50 10 IJGE CCN(C[C@](C)(CI)OC[C@@H]1CC[C@@H](C)C1)C(=O)OC(C)(C)C 2243467586 OQUXXRPDKHEUMC-RKVPGOIHSA-N 439.378 4.890 50 10 IJGE CC[C@@H]1OCC[C@H]1[C@H](Br)c1ccc(OC)c(I)c1 2257368515 HYCZZOSFQFKUEG-SCDSUCTJSA-N 425.104 4.551 50 10 IJGE O=S1(=O)CCC[C@@H]([C@H](Br)c2cc3sc(Br)cc3s2)C1 2278111617 LKXPAKKZIMLABC-KRTXAFLBSA-N 444.235 4.986 50 10 IJGE COc1cc(C=C2C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)ccc1OCCC(C)C 2314617997 FMPNKUBWSPSGPU-UHFFFAOYSA-N 434.492 4.506 50 10 IJGE CCC[C@H](Br)CCNC(=O)c1ccc(Cl)cc1I 2317776579 XUAFUJOOBRWIIH-VIFPVBQESA-N 444.538 4.628 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)cc2I)[C@H](C)C[C@H]1Br 2318557841 OXDIJHNSAVKFTR-GIPNMCIBSA-N 442.566 4.938 50 10 IJGE COC[C@@]1(C)C[C@@]1(CCl)Cc1ccc(I)c(Br)c1 2325224247 VOPWILIXJUTKQY-ZIAGYGMSSA-N 443.550 4.878 50 10 IJGE C=CC[C@@H](Cl)[C@@H]1CCN1Cc1ccc(I)c(Br)c1 2325230216 RJTIXYRCIUQDPB-OCCSQVGLSA-N 440.550 4.812 50 10 IJGE CC(C)C[C@H](CBr)CN1CC[C@@H](NC(=O)OC(C)(C)C)C(F)(F)CC1 2328520990 LMXIJDGQHMPAMW-HUUCEWRRSA-N 427.374 4.668 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Cl)c1ccc([C@H]2CCOC2)s1 2364049005 ALGQIAHTXCBLNW-WRWORJQWSA-N 440.588 4.839 50 10 IJGE CN(Cc1cscc1Br)c1c(CBr)c(C(F)F)nn1C 2365330793 UCCSYCYRBHQQKN-UHFFFAOYSA-N 429.128 4.713 50 10 IJGE N#C/C(=C/c1ccc(Cl)cc1)C(=O)Nc1nc2c(s1)CN(Cc1ccccc1)CC2 33248384 RHXRRXREDCWMAW-PDGQHHTCSA-N 434.952 4.900 50 10 IJGE COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(Cl)cc2)cc1 38651286 NIISXUSFKQRENF-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3cccs3)ccc21 38681462 GLGKJPPNWDUUFH-JOCHJYFZSA-N 432.501 4.974 50 10 IJGE Cc1ccc(Nc2ncnc(NNC(=O)c3cccc(Cl)c3)c2[N+](=O)[O-])cc1Cl 40591054 RHQKXDYOXNTMMO-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE C[C@H](CBr)COc1c(Br)cc([N+](=O)[O-])cc1Br 96869852 GQHAGABTCIBECE-ZCFIWIBFSA-N 431.906 4.530 50 10 IJGE COc1ccc(/C(C)=N\NC(=O)c2ccc(N/N=C(/C)c3ccc(OC)cc3)cc2)cc1 97991580 MPHTYFWWYSGCFX-HXNKFHKOSA-N 430.508 4.694 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccccc2N)ccc1OCc1c(Cl)cccc1Cl 169893749 CGKVGFKMDWKITE-ZRGSRPPYSA-N 444.318 4.927 50 10 IJGE O=C(CCCCCCC(=O)NN=C/C=C/c1ccccc1)NN=C/C=C/c1ccccc1 254753917 UVOGTJZFSNQHRF-CVLMJRQYSA-N 430.552 4.958 50 10 IJGE C[C@@H](Cl)c1nc2ccc(Br)cc2n1C[C@@H]1CN(Cc2ccccc2)CCO1 312616749 HFEDOQMFEIFQOU-QAPCUYQASA-N 448.792 5.000 50 10 IJGE Clc1ccc(I)c(COc2ccc(CBr)nc2)c1 405309499 SGEDOIIHSPXWCY-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@@H]1C(C)(C)[C@]21CC[C@](C)(CI)O1 686237118 OGJSKSYHNJEXQC-OHHBCXFOSA-N 449.373 4.785 50 10 IJGE CCCCCCn1c(=O)c(C(=O)NN=Cc2cccc(Cl)c2)c(O)c2ccccc21 725325931 CSPWNDZRTYCTJK-UHFFFAOYSA-N 425.916 4.705 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)c1C 736694218 QUHBVPYXAGPAMM-HZPDHXFCSA-N 428.323 4.709 50 10 IJGE O=C(NNc1cccnc1Cl)c1cccnc1Oc1ccc(F)cc1Br 754477928 MWFHEVINSVBVIN-UHFFFAOYSA-N 437.656 4.581 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F 768714088 JZOPRLHNKGIQQG-QFBILLFUSA-N 442.441 4.534 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2ccc(OCc3ccccn3)c(F)c2)c(C(F)(F)F)c1 799403616 NGBORMQTKSAAMV-UHFFFAOYSA-N 445.376 4.839 50 10 IJGE COc1ccc(C(=O)NN=C2C(=O)N(Cc3cccc4ccccc34)c3ccccc32)cc1 1084038835 GFGWLFVFJCAQRC-UHFFFAOYSA-N 435.483 4.529 50 10 IJGE COc1ccc(C(C)=NNC(=O)CCCSc2nc3ccccc3s2)c(OC)c1 1084127239 DLVYSBIGZSQHBU-UHFFFAOYSA-N 429.567 4.726 50 10 IJGE O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)NNc1nc2ccccc2[nH]c1=S 1585174145 XFLRPHBAEIZGKH-UHFFFAOYSA-N 425.901 4.677 50 10 IJGE C=CCOc1ccc(/C=C/C(=O)NNC(=S)Nc2ccc(CCCC)cc2)cc1OC 1624319657 MUHYBPUGUAVJMF-RVDMUPIBSA-N 439.581 4.634 50 10 IJGE C#C[C@H](NC(=O)NNc1c(Cl)cc(F)cc1Cl)c1ccc(Br)cc1 1683507366 BXRWTEMAOBNGLO-AWEZNQCLSA-N 431.092 4.896 50 10 IJGE CC(=O)[C@H](Br)c1ccc(SC(F)(F)F)c(I)c1 1848425912 RBWAVJHUTWCBRW-VIFPVBQESA-N 439.034 4.928 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2F)[C@@H]1c1cccc(Cl)c1 1865683389 KQZLZYRMHJXNNV-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)NNC(=O)/C=C/c1ccc(C(C)C)cc1 1865757348 YRBMCKJIYYRAHI-AWNIVKPZSA-N 435.474 4.933 50 10 IJGE C[C@H](Cl)C(=O)N(c1ccc(N2CCCC2)cc1)C1CCN(Cc2ccccc2)CC1 1865854635 CCQLZCIWWGVAKK-FQEVSTJZSA-N 426.004 4.912 50 10 IJGE CCOc1ccc(OCC)c(-c2csc(/C(C#N)=C(\O)[C@@H]3CC(=O)N(C(C)C)C3)n2)c1 1872754603 AHMSJDCFEOZWTG-VGLIXDPASA-N 441.553 4.657 50 10 IJGE CC1(C)C[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)CN(C(=O)OC(C)(C)C)C1 1880760552 HLZQJGQNYXHUOL-ZIAGYGMSSA-N 435.403 4.558 50 10 IJGE CN(Cc1sccc1I)C[C@@H](Cl)COCc1ccccc1 1888203809 RVOXGJRJICJGET-CQSZACIVSA-N 435.758 4.609 50 10 IJGE COCC(C)(C)N(Cc1ccccc1)S(=O)(=O)c1cc(F)c(Cl)c(CCl)c1 1915488934 YXQPOSZUBLGFIP-UHFFFAOYSA-N 434.360 4.834 50 10 IJGE C[C@@H](c1ccncc1Br)[C@@H](Br)c1c(Br)cnn1C 1924055627 HIXWUESUDRHNKC-WRWORJQWSA-N 437.961 4.580 50 10 IJGE CCc1nc(C(=O)N(CCBr)Cc2ccccc2)c(Br)s1 1956719477 IMRHRBGVACOVNH-UHFFFAOYSA-N 432.181 4.505 50 10 IJGE C[C@@H](Br)[C@H]1CCN(Cc2cc(Br)ccc2Br)C1 2006501897 WMFZPCHNMQSUOA-ZJUUUORDSA-N 425.990 4.817 50 10 IJGE CCCC(CBr)(CCC)CN=[S@@](C)(=O)CCN(C)C(=O)OC(C)(C)C 2044704411 CKVRHRNRNSGHFL-VWLOTQADSA-N 441.476 4.933 50 10 IJGE Cc1cc(O)cc(C)c1-n1nc(CBr)c(Br)c1C(F)(F)F 2079235381 VDVCSEYEAVBMDM-UHFFFAOYSA-N 428.046 4.871 50 10 IJGE ClCc1cc(Br)cnc1N1CC[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1 2092525357 YSLGWLBBOLKBOL-PKOBYXMFSA-N 434.809 4.931 50 10 IJGE COCC1(CO[C@@]2(CBr)CCCN(C(=O)OC(C)(C)C)C2)CCCCC1 2094486671 KBVWIQNHAVMKRX-HXUWFJFHSA-N 434.415 4.765 50 10 IJGE CCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2110714095 AGQXGFCPZKMARN-IAGOWNOFSA-N 431.415 4.578 50 10 IJGE Cn1cnc(Cl)c1COc1c(Br)cc(CCl)cc1Br 2111947160 QOHZRTKJJNFIPV-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE C[C@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)n(C2CC2)c1 2123267135 DGRWQIBVHRXQPC-OAHLLOKOSA-N 437.403 4.707 50 10 IJGE O=C(Nc1ccc2c(c1)CN(C[C@@H](CBr)c1ccccc1)C2)C(F)(F)F 2163058507 KZZZELMLRGRKSZ-MRXNPFEDSA-N 427.264 4.682 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCN(C[C@@H](CBr)c3ccccc3)C2)CC1 2163324865 HNZVGNXJPYQZDB-LJQANCHMSA-N 437.422 4.888 50 10 IJGE CC[C@H](N)Cc1cc(Cl)cc(Br)c1OC[C@H]1C[C@H](Br)C1 2196937896 MJRXZYMFDDKESM-GAFUQQFSSA-N 425.592 4.935 50 10 IJGE COc1ccc([C@@H](Br)c2cc(Cl)n(C)n2)c(Br)c1Cl 2268280094 QQPRSAPBBWCSOD-SNVBAGLBSA-N 428.939 4.982 50 10 IJGE CCOc1cccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3cccc(C(=O)OC)c3)c2C)c1 2294193479 SSUCHGGQSZDVPH-UHFFFAOYSA-N 443.503 4.825 50 10 IJGE CCCCOc1ccc(C=C(C#N)c2nc3cc(Br)cnc3[nH]2)cc1OC 2297558821 JCFPECLZUUNMOF-UHFFFAOYSA-N 427.302 4.972 50 10 IJGE CC1([C@@H](CBr)NCc2cc(I)ccc2Cl)CC1 2307332490 PNPBJLLEUSBVOD-GFCCVEGCSA-N 428.539 4.598 50 10 IJGE CC[C@H]1CN(Cc2ccc(Cl)cc2I)C[C@@H]1CBr 2318542325 WKBVQODTUSQORY-JQWIXIFHSA-N 442.566 4.798 50 10 IJGE ClCc1ccncc1OCc1cc(I)ccc1Br 2318981334 AKVKNRBQKBNYAN-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)NN=Cc1ccc(Cl)c([N+](=O)[O-])c1 2321215898 QMTJPQBHMKASFH-UHFFFAOYSA-N 430.798 4.661 50 10 IJGE CCCCCOc1ccc(C=NNC(=O)c2ccc3nc(S)[nH]c3c2)cc1OCC 2323603596 XOAIFCHBVVLEBY-UHFFFAOYSA-N 426.542 4.583 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2CC[C@H]1C[C@@H]2Br 2327398839 JHGQVNGHEXKPEN-ICCXJUOJSA-N 440.550 4.692 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@H](CN(C[C@H](CBr)CC3CC3)C1)C2 2332631999 VMNGYLDVIJLLTC-BBTUJRGHSA-N 429.443 4.815 50 10 IJGE CC(F)(F)c1ccc(C(=O)N[C@H](CCBr)COCc2ccccc2)cc1 2343417730 ZEUADCKCRJRVRQ-GOSISDBHSA-N 426.301 4.899 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@@H]1CCC[C@]2(C1)CC2(F)F 2343419444 ZVABWCUJHVWNDV-LMMKCTJWSA-N 430.333 4.689 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@]2(CBr)CC2(F)F)c2ccccc21 2351889299 SZYIIDYOYGRWBU-RDTXWAMCSA-N 431.321 4.883 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCC[C@@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2353830369 CLFOCWYLXVGZPG-WMLDXEAASA-N 445.364 4.965 50 10 IJGE CC(C)(C)OC(=O)N1CCOCC12CCN(C[C@](C)(CBr)C(C)(C)C)CC2 2380179401 IFQZXDCTPDKRIQ-FQEVSTJZSA-N 447.458 4.536 50 10 IJGE CC(C)(C)OC(=O)N1CCO[C@]2(CCCN(C[C@](C)(CBr)C(C)(C)C)C2)C1 2380192448 QGJQVAWFPGEXRH-SFTDATJTSA-N 447.458 4.536 50 10 IJGE Cc1ccc(-n2nc(C)c(/C=N/NC(=O)c3cccc(Br)c3)c2C)cc1C 59159407 NPLPICDRRCPACI-FSJBWODESA-N 425.330 4.632 50 10 IJGE C[C@@H]1CCCC[C@@H]1NC(=O)[C@H](c1ccccc1Cl)N(Cc1ccco1)C(=O)CCl 230275345 QZISYCZGFXOATA-JJXUHFIVSA-N 437.367 4.937 50 10 IJGE CCCCCCCCO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1I 231314198 OPFVRCSZBZUERI-HUUCEWRRSA-N 425.351 4.786 50 10 IJGE BrCC(CBr)(c1ccccc1Br)[C@H]1CCCO1 686741542 YBRADEJYJKQSPE-GFCCVEGCSA-N 426.974 4.656 50 10 IJGE CC[C@H](NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)c1ccc(F)cc1F 737934612 FOOHWQKBIINOSS-HKRNCWMRSA-N 445.473 4.916 50 10 IJGE O=C(NCc1ccnc(OC(F)F)c1)C(=O)Nc1ccc(S(F)(F)(F)(F)F)cc1 793101371 OQHLVNSJMLVSLF-UHFFFAOYSA-N 447.332 4.595 50 10 IJGE Cc1ccc(Oc2ccc(NC(=O)NNc3ccc(C#N)cc3C(F)(F)F)cc2)nn1 799401532 RAGWRLRITXKZSX-UHFFFAOYSA-N 428.374 4.616 50 10 IJGE N#Cc1ccc(NNC(=O)NCc2ccc(Oc3cccnc3)c(F)c2)c(C(F)(F)F)c1 799558801 NKFVXLHAOIVXCO-UHFFFAOYSA-N 445.376 4.730 50 10 IJGE CCCn1c(C)cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N[C@@H](C)c2cc3ccccc3o2)c1C 855635137 BWTXOSHWYVTJEP-OSGBQDRZSA-N 447.535 4.977 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc3ccccc23)c1C)C1CCOCC1 1532934029 JBYDNQFPOWMGMC-ASSGYOTOSA-N 437.543 4.699 50 10 IJGE C=CCn1c(SCC(=O)NNc2c(C)cccc2CC)nnc1-c1ccc(Cl)cc1 1556325781 RIYJKRVFCRYKLG-UHFFFAOYSA-N 441.988 4.891 50 10 IJGE Cc1ccc(C(C)C)c(OCC(=O)NN=Cc2cccc(OC(=O)c3cccs3)c2)c1 1565517851 SLIMFRZXAGCVGX-UHFFFAOYSA-N 436.533 4.928 50 10 IJGE Cc1c(C(=O)Nc2cccc(Cl)c2)oc2c1C(=NNC(=O)Cc1ccccc1)CCC2 1772747601 DKOXISOBQYTLFD-UHFFFAOYSA-N 435.911 4.893 50 10 IJGE CCCc1nn(-c2ccccc2Cl)c2c1[C@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865702223 PSAGMDCACORWRE-LJQANCHMSA-N 426.854 4.975 50 10 IJGE C[C@@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1Cl 1914349825 CVCLTHLCOXTETL-LBPRGKRZSA-N 437.186 4.921 50 10 IJGE CN(N[C@@H]1[C@H](CNC(=O)OC(C)(C)C)CCCC12CCC2)C(=O)OCc1ccccc1 1924832730 SRFXOQHXWYPTPP-VQTJNVASSA-N 431.577 4.623 50 10 IJGE C[C@@]1(CBr)CCN(Cc2cccc(Br)c2Br)C1 1943883534 JUAMYILMUOHKKG-ZDUSSCGKSA-N 425.990 4.819 50 10 IJGE Br[C@@H](c1csc(I)c1)c1ncn2ccsc12 1994412970 DJOIQGSUXJMTBV-QMMMGPOBSA-N 425.114 4.546 50 10 IJGE CS(=O)(=O)C1([C@@H](Br)c2c(Cl)sc(Br)c2Cl)CC1 2002553350 YKXHYDLJUBXIEG-LURJTMIESA-N 443.009 4.831 50 10 IJGE Brc1cnc(N2C[C@@H]3CCC[C@@H](Br)[C@H]3C2)c(Br)c1 2033547417 SILUMFLRJOFODQ-INTQDDNPSA-N 438.989 4.606 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CCC([C@H](F)CBr)CC1 2044829375 FYHODJIQEXJMOI-QGZVFWFLSA-N 426.351 4.912 50 10 IJGE C[C@H](N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)ccn1)C(C)(C)C 2059277911 QZTDLLXPBJAIIZ-HNNXBMFYSA-N 425.392 4.602 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1[C@]12C[C@@H]1CN(Cc1ccccc1)C2 2099678708 KZRSSKLEQKXOPV-AGKSTNPPSA-N 431.765 4.725 50 10 IJGE CC(C)[C@@H](Br)C(=O)N1CCCC12CCC(N(C)C(=O)OC(C)(C)C)CC2 2111604061 BYMWFPAZPBAMKS-LFDOHDQPSA-N 431.415 4.577 50 10 IJGE COC1(CBr)CCN(Cc2cc(Cl)c(C)c(Br)c2)CC1 2167383858 FVIFRMLIIOCNQS-UHFFFAOYSA-N 425.592 4.787 50 10 IJGE BrC[C@H]1CN(Cc2ccc(I)cc2)Cc2ccccc21 2176214929 BVLWELUEYJRBMQ-HNNXBMFYSA-N 442.138 4.786 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H]3CC[C@@H](CN3Cc3ccc(CBr)cc3)[C@H]2C1 2182845569 RRZPJQGSWUSJKA-NMLBUPMWSA-N 435.406 4.659 50 10 IJGE CO[C@H]1C[C@H](Oc2c(Br)cc(Cl)cc2CBr)C[C@H]1OC 2187174756 YPUQKYLHRYLREB-UOJUARBOSA-N 428.548 4.569 50 10 IJGE O=C(c1cc(Br)ccc1Cl)N1CC[C@H](C(F)(F)CBr)C1 2197765076 ZAKLFQBYPFLOGQ-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE Cl[C@@H]1COC[C@@H]1c1sc(Br)c(Br)c1Br 2209977224 QAHSQHZNAAOIHI-IUYQGCFVSA-N 425.367 4.757 50 10 IJGE C[C@H](Br)[C@@H](NC(=O)c1cc(F)c(Br)cc1Cl)C(F)(F)F 2282966605 HHSANAZDQUHLRF-AJAUBTJJSA-N 441.444 4.686 50 10 IJGE C=CC[C@]1(CBr)CCCCN1C(=O)c1cccc(I)c1 2287793001 PUCWGQGYAACDJA-MRXNPFEDSA-N 448.142 4.627 50 10 IJGE CCn1c(SCC(=O)NN=CC(C)=Cc2ccco2)nnc1-c1ccc(Cl)cc1 2293744212 XIOCCMLHDHXSSQ-UHFFFAOYSA-N 429.933 4.509 50 10 IJGE Cl[C@@H]1CCCN(Cc2ccc(I)c(Br)c2)CC1 2306219389 LMZKKJYAQMFWJY-LLVKDONJSA-N 428.539 4.647 50 10 IJGE C[C@H]1C[C@@H](Cl)CN(Cc2ccc(I)c(Br)c2)C1 2306220154 UQYMSSZWACLUAJ-GXSJLCMTSA-N 428.539 4.503 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)C[C@@H]1CCC[C@H]1Br 2315551292 PDAWWMSQVKAPDG-NWDGAFQWSA-N 442.566 4.940 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)ccc1OC 2321215882 LNIPTQDHBMSHKJ-UHFFFAOYSA-N 425.435 4.506 50 10 IJGE FC1(CBr)CCN(Cc2cc(I)ccc2Cl)CC1 2327403201 AYJCAEYNMJLHMK-UHFFFAOYSA-N 446.529 4.644 50 10 IJGE CCOc1ccc(-c2csc(C(C#N)=C(O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)n2)cc1 2331305970 TURYLEHGHBNMSB-UHFFFAOYSA-N 438.421 4.975 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccc(C(F)(F)F)cc1O 2369748450 WEKKEQQPUOOLMZ-OAHLLOKOSA-N 446.263 4.511 50 10 IJGE O=[N+]([O-])c1cc(Cl)cc(Br)c1OC[C@]1(CBr)CC1(F)F 2379915948 KRZNLXKVAUQFAL-SNVBAGLBSA-N 435.446 4.810 50 10 IJGE CC[C@H](C)c1nc(N2CCN(C(=O)[C@H](C)Cl)CC2)c2c3c(sc2n1)CCCCC3 35892447 CXMQCXPXPCXWFC-GJZGRUSLSA-N 435.037 4.750 50 10 IJGE Cc1ccc(Cl)cc1Nc1ncnc(NNC(=O)c2ccc(Cl)cc2Cl)c1N 40704994 GTYWVAHVVNPFMR-UHFFFAOYSA-N 437.718 4.828 50 10 IJGE CCc1ccc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)Cc2ccccc2)CCC3)cc1 40815908 KGGHGTNKELUNBU-SZXQPVLSSA-N 430.504 4.769 50 10 IJGE CC(C)Cc1ccc([C@@H](C)C(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)cc1 66199275 LLTGOVZLJRSFSW-CABCVRRESA-N 437.367 4.910 50 10 IJGE COc1cc(/C=C2/C(=O)N(Cc3ccccc3)C(=O)C(C#N)=C2C)ccc1OCCC(C)C 101335108 GWKIXNYURHEHKF-HYARGMPZSA-N 444.531 4.913 50 10 IJGE COc1ccc([C@H](Br)c2cccc(I)c2)c(OC)c1 109852145 SRSSSDPPRUAUBR-OAHLLOKOSA-N 433.083 4.793 50 10 IJGE O=S1(=O)CC[C@@H](C(CCl)(CCl)Cc2ccc(Br)cc2Cl)C1 168964580 PMQCOVOBOBGTFX-LLVKDONJSA-N 434.610 4.544 50 10 IJGE O=C1COc2ccc([C@@H](Cl)c3cc(Br)sc3Br)cc2N1 236047927 SAXMLFWZQJKVCM-GFCCVEGCSA-N 437.540 4.932 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)NN=Cc3ccc(C)s3)n2-c2ccccc2)cc1 254482886 ZHBIOIQOWZPISA-UHFFFAOYSA-N 447.589 4.855 50 10 IJGE C[C@@H](Br)C[C@@H]1CCCN1c1ncc(Br)cc1Br 304588313 RPGRCOFSYHAZLY-SCZZXKLOSA-N 426.978 4.749 50 10 IJGE Nc1cc([C@@H]2CN(Cc3ccccc3)C[C@@H]2CI)ccc1Cl 382710512 GYAUUSMNOKRUQV-HOTGVXAUSA-N 426.729 4.573 50 10 IJGE C/C(NCCSSCCN/C(C)=C1/C(=O)C[C@@H]2[C@@H]1C2(C)C)=C1/C(=O)C[C@@H]2[C@@H]1C2(C)C 503976549 SZFRXFHQDNKSIE-QUDQXUAOSA-N 448.698 4.585 50 10 IJGE FC(F)c1cc(Br)c(I)cc1CBr 575683577 BRHASKAQPRLVTH-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE CC(C)S(=O)(=O)CCC(CBr)(CBr)C1CCCCCC1 696865519 IXSMPIKNFRLJKT-UHFFFAOYSA-N 432.262 4.946 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NNc2cccc(C(F)(F)F)n2)c(C)n1-c1ccc(F)cc1 740127647 FFVWUCKGPGJELT-WJDWOHSUSA-N 443.404 4.697 50 10 IJGE COc1cccc(-c2nn(Cc3ccccc3)cc2C(=O)NNc2cccc(F)c2F)c1 743725935 WQQKSRVIPRTRNG-UHFFFAOYSA-N 434.446 4.642 50 10 IJGE CN1CCOc2ccc(NS(=O)(=O)c3cccc(S(F)(F)(F)(F)F)c3)cc21 777669043 DQCCSMFYMFAUNX-UHFFFAOYSA-N 430.420 4.973 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 823684118 QTEDWILNVCWPQN-UHFFFAOYSA-N 435.402 4.559 50 10 IJGE CC(C)(C)c1nc(COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cs1 915364986 CMCUXNIMRBNUSC-PDGQHHTCSA-N 445.548 4.868 50 10 IJGE Cc1ccc(C=NNC(=O)c2cc(-c3ccccc3)n(-c3ccccc3)n2)cc1[N+](=O)[O-] 1084263878 CFXMQMCWJYVRRQ-UHFFFAOYSA-N 425.448 4.520 50 10 IJGE COc1cc(C=NNC(=O)Nc2ccc(C)cc2C)ccc1OCc1cccc(C(=O)O)c1 1084334574 WMAZFOORMASMFL-UHFFFAOYSA-N 447.491 4.745 50 10 IJGE C#CCN(C[C@H](CBr)C1CC1)[C@@H]1CCOc2ccc(Br)cc21 1473168328 OCUQRFINBVKEAB-WMLDXEAASA-N 427.180 4.629 50 10 IJGE C=CC[C@]1(C(=O)NNc2c(Cl)cc(F)cc2Cl)CCCN1C(=O)OC(C)(C)C 1584026160 WNLAQTMMITZDQY-LJQANCHMSA-N 432.323 4.921 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H](CCC(=O)NC[C@H]1C[C@@H](Br)C1)C(C)(C)C 1887795110 XLCMQLSYKMWMEA-HRCADAONSA-N 433.431 4.633 50 10 IJGE Brc1ccc(OCc2ccccc2)c([C@H](Br)[C@H]2COCCO2)c1 1899856843 MEQASXNYTRTATK-MSOLQXFVSA-N 442.147 4.880 50 10 IJGE C[C@@H]1C[C@@H](Br)CN(Cc2cccc(Br)c2Br)C1 1943906359 PKYYXNGJVALJME-MWLCHTKSSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@H]2CC[C@@H]3CC[C@H]2C3)C1 1947121235 RLGDHLKHQCFEJR-IUVQAAGXSA-N 449.373 4.786 50 10 IJGE C[C@@]1(NC(=O)c2cc(Br)sc2Br)CCC[C@H]1Br 2011553899 AMZDSRUOCYZBBX-RDDDGLTNSA-N 446.002 4.709 50 10 IJGE CC1([C@@H](CBr)NC(=O)c2ccc(Br)cc2Br)CC1 2033130436 QSEQKOVKBHAPQO-LLVKDONJSA-N 439.973 4.505 50 10 IJGE BrC[C@@]12CC[C@@H]1CN(Cc1ccc(Br)cc1Br)C2 2078136075 XOLJILJODADAIK-BXUZGUMPSA-N 438.001 4.819 50 10 IJGE ClCc1nc2cncc(Br)c2n1C[C@@H]1CCCCN1Cc1ccccc1 2095437905 QHUXHXVGEPXULV-INIZCTEOSA-N 433.781 4.987 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N[C@H]2CCCCC[C@H]2Br)c1Br 2143909772 CRLHSXHNQPXRLS-MNOVXSKESA-N 445.242 4.502 50 10 IJGE Cc1c(Br)c(COc2c(F)cc(Br)cc2CCl)nn1C 2150232997 FUNWGNCWPIMPIH-UHFFFAOYSA-N 426.511 4.710 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)c2ccc(CBr)cc2)CC12CCCC2 2162591575 MDBOSDLXKGDGDK-KRWDZBQOSA-N 437.378 4.634 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1C[C@@]1(Br)CC1(F)F 2202501900 AWFAGTAJKBGKLC-KGFZYKRKSA-N 429.490 4.666 50 10 IJGE C[C@H](CBr)CC1CN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285847999 IJEUAEQMPXZQNM-QMMMGPOBSA-N 427.539 4.735 50 10 IJGE CC(C)[C@@H](Br)CN(C)Cc1ccc(Cl)c(I)c1 2300243140 RXRBWZVJUIYFGY-NSHDSACASA-N 430.555 4.796 50 10 IJGE CC(C)[C@H](Br)C(=O)Nc1nc([C@@H](NC(=O)OC(C)(C)C)C(C)C)cs1 2315749219 UWZIHQLOGNGUCZ-STQMWFEESA-N 434.400 4.723 50 10 IJGE COc1ccc(C(C#N)=Cc2ccc(OC(=O)Cc3ccccc3)c(OC)c2)cc1OC 2320506462 KETVEHONOSATIQ-UHFFFAOYSA-N 429.472 4.925 50 10 IJGE COc1cc(C=NNC(=O)c2ccc3nc(S)[nH]c3c2)ccc1OCc1ccc(C)cc1 2323603098 NQAARIIGBRSWTA-UHFFFAOYSA-N 446.532 4.512 50 10 IJGE N#CC(=Cc1ccc(Br)cc1)C(=O)Nc1c(Cl)cc(Cl)cc1C(=O)O 2329660641 FOVHRTOTONSYBL-UHFFFAOYSA-N 440.080 5.000 50 10 IJGE Fc1c(Br)cc(Cl)c([C@H](Cl)[C@@H]2CO[C@H]3COC[C@@H]23)c1Br 2362230951 CGCKSJGRCGDCIN-IOHMESMBSA-N 448.941 4.945 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCC(c2n[nH]cc2NC(=O)OC(C)(C)C)CC1 2382185283 WLWATXUEGDNEMC-HNNXBMFYSA-N 443.430 4.993 50 10 IJGE Cc1ccc(NC(=O)COc2ccc(/C=C(\C#N)c3nc(O)c4ccccc4n3)cc2)cc1 34988223 NVVPYRNJEZZKRW-XMHGGMMESA-N 436.471 4.726 50 10 IJGE COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccs2)cc1Cl 38688434 TXDDHOXQFHEWCP-FQEVSTJZSA-N 438.892 4.847 50 10 IJGE Cc1ccc(Sc2ncnc(NNC(=O)C(c3ccccc3)c3ccccc3)c2N)cc1 40783391 RIRZBQKOKPYVHF-UHFFFAOYSA-N 441.560 4.794 50 10 IJGE CC[C@H](C)NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(Cl)cc1Cl)CCC2 40813652 WULWUAKWNZTRTC-NGHVNIJNSA-N 436.339 4.894 50 10 IJGE COc1ccccc1Oc1nc2c(C)cccn2c(=O)c1/C=C(/C#N)c1nc2ccccc2[nH]1 50567190 RPKCVDBHCKXICI-VKAVYKQESA-N 449.470 4.744 50 10 IJGE CC(C)Oc1c(Cl)cc(/C=N\NC(=O)CCc2nc3ccccc3nc2O)cc1Cl 169887188 HBEDFJUJMOWTJE-MYKKPKGFSA-N 447.322 4.512 50 10 IJGE CC(C)Oc1c(Cl)cc(/C=N/NC(=O)c2cc(-c3ccccc3)nc(O)n2)cc1Cl 169923241 VXLGFNVEJDKJGL-BHGWPJFGSA-N 445.306 4.707 50 10 IJGE Cc1cc([C@@H](Br)c2ccc3c(c2)C(=O)NCCC3)sc1Br 228228828 ISPMVPUZFKSUIY-AWEZNQCLSA-N 429.177 4.979 50 10 IJGE O=C(N[C@@H]1CCC[C@H]1CBr)c1cc(Br)sc1Br 231543456 BXPOXWDCXFDWLN-POYBYMJQSA-N 446.002 4.567 50 10 IJGE CC[C@@H](Cl)[C@@H](CC)NC(=O)c1cc(I)ccc1Br 313087029 CFOIEXDZUFMYCF-VXGBXAGGSA-N 444.538 4.580 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CI)[C@@H](c2ccc(F)cc2Cl)C1 382698209 MHYCZJPFNBNGNO-MFKMUULPSA-N 439.696 4.865 50 10 IJGE C[C@H](CCBr)CCNCc1cc(Cl)ccc1I 405292786 ITBHXHVCTBMISJ-SNVBAGLBSA-N 430.555 4.845 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@@H]1C(C)(C)[C@]21CC[C@@](C)(CI)O1 686237124 OGJSKSYHNJEXQC-QZCPTFHJSA-N 449.373 4.785 50 10 IJGE CN(C[C@@H]1CCC[C@@H]1Br)c1ncc(Br)cc1Br 689282546 UZSWPJLQFAHQTE-WPRPVWTQSA-N 426.978 4.606 50 10 IJGE Cc1cccc([C@@H]2CN(Cc3ccccc3)C[C@@H]2CI)c1[N+](=O)[O-] 725427260 JOIAJLUHFWJDSS-FUHWJXTLSA-N 436.293 4.554 50 10 IJGE CCc1cccc(C)c1NC(=S)NNC(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 741298711 GTDRERLFZUKJTC-CVEARBPZSA-N 437.487 4.577 50 10 IJGE CC(C)(C)OC(=O)NCCCn1ccc2cc(C(=O)NNc3cccc(F)c3F)ccc21 751392888 PVADNUZMEYUIJS-UHFFFAOYSA-N 444.482 4.591 50 10 IJGE C#CCOc1ccc(C=NNC(=O)c2ccccc2OCCCCC)cc1Br 1084214736 MTFJYVVNMDCHMF-UHFFFAOYSA-N 443.341 4.794 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCCCc2nc3ccccc3s2)c(C)n1C[C@@H]1CCCO1 1087661255 TYVLARLRIBOMGC-URBQWANRSA-N 448.592 4.550 50 10 IJGE O=C(NNc1nc2ccc(Cl)cc2s1)c1cc(O)nc2c(Br)cccc12 1454083856 BNKJBQUIWPIUOM-UHFFFAOYSA-N 449.717 4.723 50 10 IJGE C#CCOc1cccc(NC(=O)NNc2cc(C(F)(F)F)ccc2Br)c1 1623086304 DKURXFVNRZUDHG-UHFFFAOYSA-N 428.208 4.629 50 10 IJGE COc1ccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4cccc(C)c4C)c(C)c32)cc1 1772745765 KHXUPHBJDJRXDV-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2F)[C@H]1c1ccc(O)cc1 1865684689 VVHNFWDNSRCHBI-QFIPXVFZSA-N 438.462 4.661 50 10 IJGE COc1ccc(C)cc1-c1csc(/C(C#N)=C(\O)[C@@H](C)N2C(=O)c3ccccc3C2=O)n1 1873920764 JUSMKNSNHNSDKQ-WVCJAJDESA-N 445.500 4.605 50 10 IJGE CC(C)[C@H](C)[C@@H](C)O[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1901527237 SMRFVCWQMLUNEX-DAYGRLMNSA-N 439.378 4.888 50 10 IJGE CC(C)(CI)Cn1ccc2cc(I)ccc21 1904646716 MHDSHRXQDCVLBW-UHFFFAOYSA-N 439.078 4.707 50 10 IJGE Cc1ccc(Br)c(N(C)C[C@@H](Br)COCc2ccccc2)n1 1916343684 WBIQBLCCFWAAJR-OAHLLOKOSA-N 428.168 4.569 50 10 IJGE C[C@@H]1C[C@@H](Br)CCN1Cc1ccc(Br)cc1Br 1943855103 ZUFQYOXOFLPYOA-SKDRFNHKSA-N 425.990 4.959 50 10 IJGE CC[C@H](NC(=O)c1csc(Br)c1Br)[C@H](Br)CC 1945184143 WCJBDRHTERCXPO-SFYZADRCSA-N 448.018 4.955 50 10 IJGE CC1([C@H](CBr)NC(=O)c2cc(Br)sc2Br)CC1 1945361173 JDZJYZRLONJPEP-ZETCQYMHSA-N 446.002 4.567 50 10 IJGE Cc1c([C@H](Br)c2ccc(Br)s2)c(Br)nn1C 1987720467 BXPUWQSCXINNPB-SECBINFHSA-N 428.975 4.799 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CCCC1(F)F)C(=O)OC(C)(C)C 1991616946 QFSCVHVGCIUVSM-DOMZBBRYSA-N 447.304 4.642 50 10 IJGE COC1(COc2c(Br)cc(CBr)cc2Br)CC1 2002508089 XBNIRTQLWZBLEN-UHFFFAOYSA-N 428.946 4.664 50 10 IJGE Brc1cnc(N2CC[C@@H]3C[C@@H](Br)CC[C@H]32)c(Br)c1 2027435468 OQEINYHFWQOWIS-VDDIYKPWSA-N 438.989 4.749 50 10 IJGE O=C(NCCC1(CBr)CC1)c1cccc(Br)c1Br 2031480588 XARGPVIJZIEYAB-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE BrCC1CC2(C1)CN(Cc1cc(Br)ccc1Br)C2 2066489670 WANRZZWCCKBNBL-UHFFFAOYSA-N 438.001 4.819 50 10 IJGE Brc1ccc([C@@H](CI)OC[C@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)cc1 2134539238 KAVAGYWYUXTZBU-YSHXYTTRSA-N 433.127 4.844 50 10 IJGE C[C@@]12CC[C@@](CBr)(C1)N(C(=O)c1cc(Br)c(Cl)s1)C2 2134802236 FZEBXJNQBFVMKX-OLZOCXBDSA-N 427.589 4.944 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)c(Br)c2F)C[C@H](CBr)O1 2166829375 CKRPJNQJXZRFOC-JTQLQIEISA-N 429.555 4.616 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@H](Cl)c2cc(Br)ccc2Br)C1 2201887652 XMPIOPZXAUPVHH-FZZIBODNSA-N 442.600 4.706 50 10 IJGE ClCCc1nc2cc(Br)c(Br)cc2n1Cc1cscn1 2234056666 JHKXTNKPYUGJOP-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE Cc1cc(Br)c(C(=O)N2CC[C@](CBr)(C(F)(F)F)C2)s1 2237630475 WBVSEEHFJAVIEJ-LLVKDONJSA-N 435.103 4.609 50 10 IJGE C[C@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)CC[C@H]1CBr 2282980196 KOLNCDZWQOSONJ-IUCAKERBSA-N 427.539 4.735 50 10 IJGE O=C(N[C@@H]1CC[C@@H]2C[C@]21CBr)c1cc(F)c(Br)cc1Cl 2282990570 SYXAJEBDIATXIG-PYSYBHHASA-N 425.523 4.535 50 10 IJGE CC1(C)C[C@@H](Cl)CCN(C(=O)c2ccc(Cl)c(I)c2)C1 2283671740 ZVASQRHEYDDBDA-NSHDSACASA-N 426.125 4.814 50 10 IJGE CCOC(=O)c1c(-c2ccc(F)cc2)csc1NC(=O)C(C#N)=Cc1ccccc1O 2295979453 WHZDAYAPWKMWAN-UHFFFAOYSA-N 436.464 4.982 50 10 IJGE CC(C)N(CCCBr)Cc1cc(I)ccc1Cl 2307334975 XIVAXJFCYHIGHG-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2cn(C)c3ccccc23)sc2c1CCCC2 2314717324 CBTUKWOECCBIAY-UHFFFAOYSA-N 433.533 4.841 50 10 IJGE Cc1ccccc1OCCCC(=O)Oc1ccc(C=C(C#N)C(=O)NCc2ccco2)cc1 2314760693 XSYMDSWMCDUVQQ-UHFFFAOYSA-N 444.487 4.576 50 10 IJGE CC(C)N1C[C@H](Br)[C@H](Cc2ccc(Cl)c(I)c2)C1 2315549979 YEQNCKFFDKMCRI-NEPJUHHUSA-N 442.566 4.591 50 10 IJGE COc1cc(C=NNC(=O)c2cccc(N)c2)ccc1OCc1ccc(Cl)c(Cl)c1 2323211482 FBXSSECWAFVAQE-UHFFFAOYSA-N 444.318 4.927 50 10 IJGE CN(C[C@]1(CBr)CC1(F)F)[C@@H]1CCCC[C@H]1N(C)C(=O)OC(C)(C)C 2326923918 ZZUJMAASZYKGFT-CKEIUWERSA-N 425.358 4.517 50 10 IJGE CCN(C[C@](C)(CBr)OCC1CC2(C1)CC(OC)C2)C(=O)OC(C)(C)C 2353035444 GJGQMGHYKSJOLV-PUFPBPQXSA-N 434.415 4.619 50 10 IJGE COc1ccc(CCCCO[C@@H](CCl)[C@@H](I)CCl)cc1 2370109838 CQZGPSUQERFXSR-GJZGRUSLSA-N 431.141 4.684 50 10 IJGE CC(C)[C@@H]1C[C@@H](Br)CN1C(=O)c1cc(Br)c(F)cc1Cl 2370882777 GWFNXKRNSFPZJG-OQPBUACISA-N 427.539 4.876 50 10 IJGE CCCC(=O)Nc1ccc(C(=O)NNC(=O)[C@@H](CC)Oc2ccccc2[C@H](C)CC)cc1 10683370 NRCQEHMKZYSOQL-DYESRHJHSA-N 439.556 4.557 50 10 IJGE CCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C/c2ccccc2OCCC)c(OC)c1 40950490 QPQSETPZWGSAEL-CSEDCYJQSA-N 448.519 4.536 50 10 IJGE CN(C)c1ccc([C@@H](C(=O)NC2CCCCC2)N(Cc2ccccc2)C(=O)CCl)cc1 97914625 SVODMJREPVBQRN-DEOSSOPVSA-N 442.003 4.510 50 10 IJGE CN1C(=O)C(C)(C)c2cc(-c3csc(NC(=O)/C(C#N)=C/c4ccccc4)n3)ccc21 170518061 HYWUTSYPPJOLLW-GZTJUZNOSA-N 428.517 4.610 50 10 IJGE O=C(NC[C@@H]1CC[C@H](Br)C1)c1cc(Br)ccc1Br 227672427 SMNWVWINOSMCHL-BDAKNGLRSA-N 439.973 4.505 50 10 IJGE CC(=O)C(=O)CCC[C@H]1C[C@@]2(C)C(=CC1=O)[C@@H](Cl)C[C@H]1[C@@H]3CC[C@H](O)[C@@]3(C)CC[C@@H]12 328578072 WFQUYBYCFZVLQH-SWRBIPKUSA-N 435.004 4.651 50 10 IJGE CC(C)[C@@H](CBr)CNC(=O)c1ccc(Br)cc1Br 394183947 KUFSQVHMWYBVGT-VIFPVBQESA-N 441.989 4.609 50 10 IJGE CCOC(=O)c1c(I)c(CBr)cc2sccc12 725283842 WPKLZPJHNDSCTD-UHFFFAOYSA-N 425.085 4.578 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=O)C(=O)Nc2cccc(Sc3ccccc3)c2)cc1 763799048 HEWYTLAOIVLCCK-UHFFFAOYSA-N 447.560 4.535 50 10 IJGE Cc1ccc(F)c(NNC(=O)C(=O)Nc2ccc(-c3nc4ccc(C)cc4s3)cc2)c1 784883714 BTFJBGWGGBIGNG-UHFFFAOYSA-N 434.496 4.801 50 10 IJGE BrC[C@H](CN1Cc2cc(Br)ccc2OC2(CCC2)C1)C1CC1 1460801425 LXDDUFAXQXPJRF-OAHLLOKOSA-N 429.196 4.987 50 10 IJGE Cc1cccc(Br)c1NNC(=O)c1cc2cccc(C(F)(F)F)c2nc1O 1644538885 AJDBGBSOQUNPOW-UHFFFAOYSA-N 440.219 4.787 50 10 IJGE CC(=O)c1cc(F)c(O)c(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(F)cc3)c2C)c1 1646056380 UDRLJDLNDCKVDC-GIJQJNRQSA-N 435.430 4.826 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865683364 KBFJFWFWKSVNHY-DEOSSOPVSA-N 435.531 4.872 50 10 IJGE CCc1nn(Cc2cccc(Cl)c2)c2c1[C@@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865700415 SLBDWNFYOQZDKA-OAQYLSRUSA-N 429.911 4.847 50 10 IJGE CCN(CC)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2cccc(Cl)c2)cc1 1865701690 BWVJZMVRRMTDAI-HSZRJFAPSA-N 447.970 4.958 50 10 IJGE CCCc1nn(CCC)c2c1[C@H](c1ccc(OC(=O)c3ccccc3)cc1)C(C#N)=C(N)O2 1865705322 SBULDXISDBMKCH-JOCHJYFZSA-N 442.519 4.683 50 10 IJGE COc1cccc(-c2ccc(C(=O)N/N=C(/C)c3ccc(Br)cc3)c(C)n2)c1 1865763346 HKKLWHOKMFMPHN-QFEZKATASA-N 438.325 4.982 50 10 IJGE C[C@H](c1cc(F)ccc1Br)[C@@H](CBr)NC(=O)OC(C)(C)C 1885094164 SLRVEVTZSCDBNW-NOZJJQNGSA-N 425.136 4.980 50 10 IJGE CC(C)CNCC1(C[C@@H]2C[C@@H]2Br)C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 1887901874 SUHAIIUCIPODDX-KHYATNAISA-N 429.443 4.954 50 10 IJGE CCCN(CC(C)(C)CI)CC(C)(C)CNC(=O)OC(C)(C)C 1904654677 ZUEACOILGGCZNO-UHFFFAOYSA-N 440.410 4.711 50 10 IJGE Cc1csc(C)c1S(=O)(=O)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915177267 SWVKXCNYXPEHAE-KRWDZBQOSA-N 428.417 4.729 50 10 IJGE CC[C@@H](Br)CN(C)C(=O)c1cc(Br)sc1Br 1977843336 PNHNSYQIANDFBC-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE Cl[C@@H]1CCCCC[C@@H]1Nc1ncc(I)cc1Br 2015757139 PCSAHTVZDXFZLU-MNOVXSKESA-N 429.527 4.801 50 10 IJGE C=CCC[C@@H](CBr)NC(=O)c1cc(Br)sc1Br 2019475179 KSWBLQCBCMQICB-ZETCQYMHSA-N 446.002 4.733 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1Br)c1cccc(Br)c1Br 2031486279 MGLKXGMFYIXLSH-KOLCDFICSA-N 439.973 4.648 50 10 IJGE CCOc1cc(C=C(C#N)S(=O)(=O)c2ccc(Cl)cc2)cc(Br)c1O 2040461145 ASIXZNNJIYFIAP-UHFFFAOYSA-N 442.718 4.545 50 10 IJGE Clc1cc(CN2CCC[C@@H](CBr)CC2)ccc1I 2086657785 IEFOCWXEGRCROI-LLVKDONJSA-N 442.566 4.942 50 10 IJGE CCc1nsc(COc2c(Br)cc(Cl)cc2CBr)n1 2102672930 SIOPNCJRWKTLTH-UHFFFAOYSA-N 426.561 4.990 50 10 IJGE Cc1sc(Br)c(C(=O)NC2(CCBr)CCSCC2)c1C 2157246595 FIBBMBQBDREMGJ-UHFFFAOYSA-N 441.254 4.908 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CCCCCCBr)C[C@H]1C(F)(F)F 2223283106 PAKRGWKXINRPSS-ZIAGYGMSSA-N 431.337 4.577 50 10 IJGE CC1(C)CC[C@H](CCl)N(C(=O)c2ccc(Cl)c(I)c2)C1 2283670595 UOXPVKDQBHUCAN-LLVKDONJSA-N 426.125 4.814 50 10 IJGE C[C@H](Br)[C@H]1CCCN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285844689 PYPIJLNLYHVWQQ-IUCAKERBSA-N 427.539 4.877 50 10 IJGE ClCc1csc(OCc2cc(I)ccc2Br)n1 2302645520 ADQHOWWSDYPQSF-UHFFFAOYSA-N 444.519 4.828 50 10 IJGE CC1(C)OC[C@@H](Cc2ccc(I)c(Br)c2)[C@H]1Cl 2306216491 GUCCHFWBQQXDIB-BXKDBHETSA-N 429.523 4.629 50 10 IJGE CC1(C)CC(CBr)(CN2CC[C@@H]3CCN(C(=O)OC(C)(C)C)C[C@H]3C2)C1 2345004702 NXVJZPTUFNPFDQ-IAGOWNOFSA-N 429.443 4.767 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]1C(F)(F)F 2353827460 ZFSSLSKUUYEUHC-KFWWJZLASA-N 445.364 4.916 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)c3nn(-c4ccccc4)c(N)c3C#N)o2)cc1 33247433 KJYXDRRGMHIQLT-RGEXLXHISA-N 449.470 4.827 50 10 IJGE CCOc1cc(/C=N/NC(=O)CCc2ccccc2)ccc1OC(=O)/C=C/c1ccccc1 33347756 NNGHGWOWEJEUPC-YCPQVAJXSA-N 442.515 4.787 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccc(Cl)c2)CCC3)nc1 40813380 XRMSPLCEKFCRIO-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE COc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)Oc4cc(C)cc(C)c4)c(C)c32)c1 40822175 QTEXMRMZZSKVDY-SZXQPVLSSA-N 446.503 4.903 50 10 IJGE COc1ccccc1/C=C(\C#N)C(=O)N(c1cccc(C)c1C)S(=O)(=O)c1ccccc1 40977771 COXRNFPVHRABBY-LTGZKZEYSA-N 446.528 4.641 50 10 IJGE CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)cc1I 59335290 ZHXJCGLUQZLLEM-GDNBJRDFSA-N 432.261 4.544 50 10 IJGE CSC(C)(C)Cn1c(CCCl)nc2cc(I)c(F)cc21 156983422 RJZPUYWTHPLHEX-UHFFFAOYSA-N 426.726 4.703 50 10 IJGE CCCCCCCCCOc1ccc(/C=N\NC(=O)c2cccn(CC)c2=O)cc1OC 169918356 KZKOIJGHKXJCKE-XHPQRKPJSA-N 441.572 4.770 50 10 IJGE N#C/C(=C/NCCc1ccc(Br)cc1)C(=O)Nc1ccc(Cl)cc1Cl 217178392 NLENWOMVAFLSLZ-QBFSEMIESA-N 439.140 4.934 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CCl)c1Cl)N1CCCN(Cc2ccccc2)CC1 323895664 GQCALPLFVOQZEP-UHFFFAOYSA-N 447.815 4.629 50 10 IJGE Fc1cccc([C@@H](Br)c2cc(I)cc3c2OCC3)c1 388491344 ZMJFPFTURGNRSP-CQSZACIVSA-N 433.058 4.850 50 10 IJGE Cl[C@@H](c1cc2c(cc1Br)OCCO2)c1nscc1Br 404804321 MCHKBOJGSLVHSK-NSHDSACASA-N 425.529 4.768 50 10 IJGE Cc1cc(I)cc(SC(F)(F)F)c1C(=O)CBr 575708514 IATAQVRDBYZAPU-UHFFFAOYSA-N 439.034 4.789 50 10 IJGE N#CSc1ccc(NC(=O)c2ccc(NC(=O)NCc3ccc4c(c3)OCO4)cc2)cc1 586614273 SAZSZLZZIKMAJE-UHFFFAOYSA-N 446.488 4.562 50 10 IJGE Cn1cc(C(=O)NNC(=O)NCc2ccccc2-c2ccc(Cl)cc2)c2ccccc21 726797279 BWILHEMGGBWYCA-UHFFFAOYSA-N 432.911 4.643 50 10 IJGE Cc1nn(CCCl)c(C)c1C(=O)N1CCC(c2nc(-c3ccccc3)cs2)CC1 746235929 ANESPESSGMDFDS-UHFFFAOYSA-N 428.989 4.882 50 10 IJGE Cc1cc(C)c(S(=O)(=O)Nc2cc(C(=O)NNc3ccccc3C)ccc2C)c(C)c1 746682990 XWBWCJYHDSHKEA-UHFFFAOYSA-N 437.565 4.786 50 10 IJGE COc1ccc(CCC(C)=NNC(=O)c2ccccc2OCc2ccc(F)cc2)cc1O 754910339 MIIQZWUBQZATHB-UHFFFAOYSA-N 436.483 4.857 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cccc(-c3c(F)cccc3F)c2)c1C 757894307 IHGBWJAMOXHHBG-UHFFFAOYSA-N 431.446 4.858 50 10 IJGE CC(C)[C@H](NC(=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F)C(F)(F)F 787960912 VFJVDEGHAURBET-GXFFZTMASA-N 436.805 4.548 50 10 IJGE N#Cc1ccc(NNC(=O)c2cccc(COc3ccccc3C#N)c2)c(C(F)(F)F)c1 799750558 IJXIAQUMUYYHKL-UHFFFAOYSA-N 436.393 4.785 50 10 IJGE CC(=NNC(=O)c1ccc(CSc2nncn2C)cc1)c1ccc(F)c2ccccc12 814702255 PKUQHXHNNUJPMR-UHFFFAOYSA-N 433.512 4.554 50 10 IJGE COc1ccc(C(C)=NNC(=O)CCCOc2ccc(Cl)cc2Cl)c(OC)c1 1084571662 HUCLNEAPFFABSW-UHFFFAOYSA-N 425.312 4.710 50 10 IJGE Cc1cc(C)cc(-n2c(C)cc(C(=O)NNc3nc(-c4ccccn4)nc(C)c3C)c2C)c1 1160812604 KLPRHAJTBLYRKP-UHFFFAOYSA-N 440.551 4.937 50 10 IJGE CC(=O)C1CCN(C(=O)/C(C#N)=C\c2cc(C)n(-c3cccc4ccccc34)c2C)CC1 1177212087 RKAVMFDLMYNOSA-JLPGSUDCSA-N 425.532 4.982 50 10 IJGE C#C[C@@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc3ccccc23)c1C)C1CCOCC1 1532934031 JBYDNQFPOWMGMC-KDSDTBODSA-N 437.543 4.699 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2c(C)cccc2Br)cc1)[C@H]1C[C@H]1C 1662058830 MSDSSUIYSHZUGD-ACJLOTCBSA-N 431.334 4.667 50 10 IJGE CCCn1nc(C)c2c1OC(N)=C(C#N)[C@H]2c1ccc(N(CC)Cc2ccccc2)cc1 1865707027 MDHBCEPGYVEOTH-XMMPIXPASA-N 427.552 4.846 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)N/N=C\c1ccc2c(c1)OCO2 1865760897 VDBCANMDXYBBQN-VROXFSQNSA-N 428.275 4.856 50 10 IJGE Cc1ccc2nc(/C(C#N)=C/c3cc(Br)c(O)c(Br)c3O)[nH]c2c1 1872728352 YIBVDJWAHZPUCA-BJMVGYQFSA-N 449.102 4.872 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(Br)c(O)c1 1915080117 IYVUQYMZYSSVRR-HNNXBMFYSA-N 441.163 4.971 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1cc(Br)ccc1O 1915132550 JHMDFMSAGZPXKU-CYBMUJFWSA-N 441.163 4.971 50 10 IJGE CC(C)C1CC(O[C@@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)C1 1987764471 UKNLZVXOJJFBHI-JTTJXQCZSA-N 437.362 4.642 50 10 IJGE CC(C)C[C@@H](Br)CNC(=O)c1cccc(Br)c1Br 2031487107 QLOKKJSIUMQVEF-SECBINFHSA-N 441.989 4.751 50 10 IJGE COc1ccc(C[C@H](Br)c2cc(I)sn2)cc1F 2056486644 CMLLPWCJGKXGBB-QMMMGPOBSA-N 442.091 4.574 50 10 IJGE C[C@@H]1CC[C@@H](CBr)N(Cc2ccc(I)c(Cl)c2)C1 2086651388 HMLLESSCWWOZEI-PWSUYJOCSA-N 442.566 4.940 50 10 IJGE CC(C)[C@@H](CBr)CN1CCOc2ccc(CNC(=O)OC(C)(C)C)cc21 2106785969 RORQCSAGHZISHQ-INIZCTEOSA-N 427.383 4.577 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@@H]2CCC[C@@H](Br)[C@H]2C1 2115923577 HUKFNEWHVZUKHS-XHNCKOQMSA-N 427.589 4.800 50 10 IJGE CCN(CCCOCc1ccccc1)S(=O)(=O)c1ccc(CBr)cc1C 2123200402 HLFZYXFKLQGKCT-UHFFFAOYSA-N 440.403 4.507 50 10 IJGE Clc1ccc(N2CC[C@H]3COC[C@@H](C2)N3Cc2ccccc2)c(CBr)c1 2139651507 CYKYISPUUZTCPI-VQTJNVASSA-N 435.793 4.715 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)c2ccccc2)[C@@H](CC(F)F)C1 2183407161 GRXJTOHRKLUBBK-IRXDYDNUSA-N 447.364 4.742 50 10 IJGE Cc1cc(C(=O)N2C[C@@H](Br)CCC23CCC3)ccc1I 2207106287 WTVSGQVXNJFOLJ-ZDUSSCGKSA-N 448.142 4.522 50 10 IJGE O=S(=O)(Cc1ccccc1Br)N(Cc1ccccc1)[C@H](CCl)C1CC1 2218983601 MTKMHQKKXRXAIB-LJQANCHMSA-N 442.806 4.799 50 10 IJGE C[C@H](Cn1c(CCl)nc2cc(Br)c(Br)cc21)OC(F)F 2234067297 DKMSIZALPSNHFY-ZCFIWIBFSA-N 432.490 4.928 50 10 IJGE O=S1(=O)CCC[C@H]([C@@H](Br)c2cc3sc(Br)cc3s2)C1 2278111616 LKXPAKKZIMLABC-JVXZTZIISA-N 444.235 4.986 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCC[C@@](F)(CBr)C1 2282979114 VPRYLGFMROPNOC-CYBMUJFWSA-N 431.502 4.581 50 10 IJGE BrC[C@]12C[C@H](CCN1Cc1cccc(Br)c1Br)C2 2314957806 HUNDDUBLZLXHHD-WJONMLJTSA-N 438.001 4.961 50 10 IJGE CC1(CBr)CCN(Cc2ccc(Cl)c(I)c2)CC1 2315551040 LGFFOVOAEYWDLQ-UHFFFAOYSA-N 442.566 4.942 50 10 IJGE C[C@@H]1C[C@@H](Cl)[C@@H](C)N(Cc2ccc(I)c(Br)c2)C1 2325227849 FABXNCDPWHGFCD-GIPNMCIBSA-N 442.566 4.891 50 10 IJGE CCCN(C[C@@]1(CBr)CC1(F)F)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2326918528 AEICGJDQWJKPAB-PBHICJAKSA-N 425.358 4.518 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)Nc2ccccc2Cc2ccccc2)cc1 22562205 FQVLLBMHSZBYDF-SNAUHIFDSA-N 440.499 4.763 50 10 IJGE CCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cccc(F)c1 38678336 SCKXPYVHJHCTFB-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE O=C(Nc1ccc(CCBr)cc1)c1ccc(F)cc1I 236172595 CREXDNRQLGYPKB-UHFFFAOYSA-N 448.073 4.620 50 10 IJGE C[C@H](Br)C[C@H]1CCCCN1C(=O)c1csc(I)c1 310731189 MYFOCKBPRUVFLY-GXSJLCMTSA-N 442.160 4.521 50 10 IJGE C[C@@H](C1CC1)N(Cc1ccccc1)S(=O)(=O)c1cc(CCl)oc1Br 385374352 SLQUJOKZJBYVSZ-LBPRGKRZSA-N 432.767 4.770 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1C(=O)c1cc(Br)c(Br)s1 395261205 RBMDCMAHXNYWGQ-BQBZGAKWSA-N 446.002 4.661 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)c1C 736694216 QUHBVPYXAGPAMM-CVEARBPZSA-N 428.323 4.709 50 10 IJGE C=CCCC[C@@H](NC(=O)NNC(=O)Nc1cc(OC)c(Cl)cc1OC)c1ccccc1 1471203206 JAZDEJXYZQTAPR-QGZVFWFLSA-N 446.935 4.791 50 10 IJGE O=C(N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21)c1cc2ccccc2[nH]1 1860822419 DBXQGUZCLIVNTA-QYQHSDTDSA-N 428.879 4.502 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865709869 IZBMVFJMTHGTHM-HXUWFJFHSA-N 449.898 4.664 50 10 IJGE N#C/C(=C\c1cccc(Br)c1)C(=O)Nc1ccccc1C(=O)NC1CCCC1 1866131609 DSXXSKGXSKZINE-FOWTUZBSSA-N 438.325 4.667 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)CN3C(=O)c4ccccc4C3=O)n2)c(C)c1C 1872753605 FZUCKGIPEQLBPS-ZZEZOPTASA-N 445.500 4.524 50 10 IJGE CC(C)(C)OC(=O)NCC1CC2(C1)CC([C@H](CBr)NC(=O)OC(C)(C)C)C2 1882088277 PUXAQAPQHXETGN-SGLHQCCPSA-N 447.414 4.606 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)C(=O)Cc1ccc(Br)cc1F 1914227160 IXQWDNJUKYTLIU-CYBMUJFWSA-N 443.154 4.943 50 10 IJGE CN(C(=O)c1csc(Br)c1Br)C1(CBr)CCC1 1914993262 WQTFXDAIJVTNRC-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE CC[C@@H](C)[C@@H](Br)CNC(=O)c1cc(Br)sc1Br 1942803850 SBPVWAFOUSKZOW-SVRRBLITSA-N 448.018 4.813 50 10 IJGE BrC[C@@H](NCc1ccc(Br)cc1Br)C1CCC1 1943850645 RIHJHXOKRMHDFK-CYBMUJFWSA-N 425.990 4.865 50 10 IJGE CC(C)(C)OC(=O)N(CC1CC1)C1CCN(C[C@H](CBr)C2CCC2)CC1 1966286110 TWHGYAJNWFCKFV-SFHVURJKSA-N 429.443 4.909 50 10 IJGE CCOc1c(Br)cc(Br)cc1C=C(CBr)OC 2004765887 MLRSVPVMYBPZTN-UHFFFAOYSA-N 428.946 4.993 50 10 IJGE Cc1cc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)C2CC2)sc1CBr 2009647255 SLGPPCCEVWJNOM-AWEZNQCLSA-N 428.417 4.941 50 10 IJGE CN(CC1CC(Br)C1)c1ccc(Br)cc1CBr 2020226849 OIVILPYWWAYHNT-UHFFFAOYSA-N 425.990 4.954 50 10 IJGE CN[C@H](c1ccc(Br)c(C)c1Br)[C@H]1C[C@H](Br)C1 2024281152 CSJYJIRSJLKOTG-RVBZMBCESA-N 425.990 4.954 50 10 IJGE C[C@H](Cl)c1nc2cc(I)ccc2n1CC1(Br)CC1 2049229503 CUNNVKLOYSRJTD-QMMMGPOBSA-N 439.522 4.868 50 10 IJGE FC(F)(F)c1cc(I)c(CCl)cc1I 2060237382 KLUKEQDLOUJIPS-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE ClCc1ccc(N2CCCN(Cc3ccccc3)CCOCC2)cc1Br 2088628446 NZVCYQLHUVZYCH-UHFFFAOYSA-N 437.809 4.917 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1[C@@]12C[C@H]1CN(Cc1ccccc1)C2 2099678489 JAOOCDSFRQWAPN-ZQGRQUNCSA-N 431.765 4.725 50 10 IJGE C[C@]1(CCl)CC(F)(F)CN1C(=O)c1scc(Br)c1Br 2102794644 KFGSPGTWUNDSRE-SNVBAGLBSA-N 437.531 4.752 50 10 IJGE CC(C)CNCc1cc(Br)cc(Br)c1OC[C@H]1C[C@@H]1Cl 2196897177 VTVQZXSOVIGYQK-RISCZKNCSA-N 425.592 4.963 50 10 IJGE Cc1cc(C(=O)NCCCCCCI)cc(C)c1Br 2227419039 ZWNYJKIKUOQDKV-UHFFFAOYSA-N 438.147 4.791 50 10 IJGE Cc1cc(Br)c(CN(C)c2ncc(Br)c(CCl)n2)s1 2229408989 JDCBWMAUWARRNI-UHFFFAOYSA-N 425.577 4.747 50 10 IJGE CCOC1CC([C@@H](Br)c2ccc(OC)c(I)c2)C1 2257359143 XFYRNUOOUYYDCU-MGULZYLOSA-N 425.104 4.551 50 10 IJGE Cc1c(CBr)cccc1NS(=O)(=O)c1ccc(Br)s1 2268334898 ZUGLBOALBPCRJP-UHFFFAOYSA-N 425.167 4.515 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCC[C@H](CBr)CC1 2282982718 LNOODWZOMDPNSS-VIFPVBQESA-N 427.539 4.879 50 10 IJGE CC1(C)OCCO[C@@H]1[C@@H](Cl)c1c(F)cc(Br)c(F)c1Br 2288358241 NCROVOIRBGVSFS-CMPLNLGQSA-N 434.502 4.964 50 10 IJGE N#CC(C(=O)Nc1ccccc1)=C1S[C@@H](Cc2ccccc2)C(=O)N1c1ccc(F)cc1 2293039038 WJVVHEGFWMXKEO-QFIPXVFZSA-N 443.503 4.891 50 10 IJGE NNC(=O)C=Cc1cc(Cl)c(OCc2cccc3ccccc23)c(Br)c1 2314019549 OFJSVUFROIGZRL-UHFFFAOYSA-N 431.717 4.838 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H](C3)[C@H]2CBr)cc1I 2315546156 DIDHXYCCMBPUHU-COPLHBTASA-N 440.550 4.692 50 10 IJGE CCOc1ccc2ccccc2c1C=NNC(=O)c1cccn(Cc2cccc(C)c2)c1=O 2323619969 CHJQIRZWPANBOT-UHFFFAOYSA-N 439.515 4.521 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)C(C#N)=CNc1ccccc1Br 2325075876 GXTWFRDIGVGUEU-OAHLLOKOSA-N 428.330 4.853 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCN(CC2(CBr)CC2)[C@H](C(F)(F)F)C1 2337585165 JLNJOAQTNHFDTI-KGLIPLIRSA-N 443.348 4.719 50 10 IJGE CCOc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2)CCC3)cc1 40804259 BVONELXQEQSWCJ-NHFJDJAPSA-N 431.492 4.709 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@@H]1Br)c1ccc(Br)c(Cl)c1 123770804 KEMNOWGWOCPAHI-ZFWWWQNUSA-N 429.539 4.893 50 10 IJGE CC(C)Oc1c(Cl)cc(/C=N\NC(=O)CSc2nc3ccccc3[nH]2)cc1Cl 169886292 MSKIQZPKDMQSFG-AFPJDJCSSA-N 437.352 4.899 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NC(C)C)ccc1OC(=O)/C=C\c1ccc(C(C)C)cc1 206432334 GTSPNMLJSXMCGN-BUXVXYNSSA-N 432.520 4.869 50 10 IJGE O=C(NCCCCCCBr)c1cc(Br)cc(Br)c1 232472476 QGHWZWFNTFGUSI-UHFFFAOYSA-N 441.989 4.897 50 10 IJGE CCCCOc1ccc(-c2cc(C(=O)NN=Cc3cn(C)nc3C)c3ccccc3n2)cc1 254429407 UJUYHIPJDNEXPU-UHFFFAOYSA-N 441.535 4.887 50 10 IJGE C[C@H](Br)C[C@H]1CCCCCN1S(=O)(=O)c1ccc(Br)s1 312913617 AVXNUSNYZOZZGB-WDEREUQCSA-N 445.242 4.617 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CI)[C@H](c2ccc(F)c(Cl)c2)C1 394705323 DVVOWMNCNFMPFC-NEPJUHHUSA-N 439.696 4.865 50 10 IJGE C[C@@H]1C[C@@H](Br)CN(C(=O)c2cc(Br)c(Br)s2)C1 401884279 DPULGXTZYWNBKB-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE Cn1nc(CC(CBr)(CBr)c2cccc(Cl)c2)cc1Cl 706182006 DLSLUXWVVDOJAL-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE Cc1cccc(COc2ccc([C@@H](C)NC(=O)NNC(=O)c3ccc(Cl)cc3)cc2)c1 727944351 NDNIODAAMFACDS-QGZVFWFLSA-N 437.927 4.933 50 10 IJGE Cc1nn(-c2ccccc2)c(Oc2cccc(F)c2)c1C=NNC(=O)CNc1ccccc1 766682500 LDTJHWIDIVTCPF-UHFFFAOYSA-N 443.482 4.674 50 10 IJGE CC(=C\c1cccc(C(F)(F)F)c1)/C=C(\C#N)C(=O)Nc1ccc(C(=O)N(C)C)cc1 806571394 UROAHFUVQAFCMI-KFGDLTOCSA-N 427.426 4.899 50 10 IJGE C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@]2(c3ccccc3)C[C@@H]2Br)cc1 1142298646 POODPCIZWCAOJL-REWPJTCUSA-N 439.353 4.545 50 10 IJGE Cc1ccccc1COc1cccc(C=NNC(=O)CSc2nc3ccccc3[nH]2)c1 1772760544 UFPHQCVCRTZSQU-UHFFFAOYSA-N 430.533 4.693 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1cc(C)ccc1O)C(C#N)=C(N)O2 1865686820 BQFCUYIBCHJNEG-NRFANRHFSA-N 434.927 4.770 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(OC)cc2)cc1 1865692016 HJGVBFPCTSUYSX-HSZRJFAPSA-N 430.508 4.586 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2cccc(Cl)c2)c1 1865693709 QGGMHHIOSWXZSE-JOCHJYFZSA-N 434.927 4.900 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)Cc1cc(Br)c(Br)s1 1880740412 CQRSLOQCSLEJHH-ZETCQYMHSA-N 433.593 4.948 50 10 IJGE O=C(NCC1CC2(CC[C@@H]2Cl)C1)c1csc(Br)c1Br 1882885865 AWCPLRCHBPCEDU-GAAAAHHMSA-N 427.589 4.801 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](O[C@@H]2CCC3(CCCC3)C2)C1 1902886351 SFMJKHLZLGRUMF-QLFBSQMISA-N 435.346 4.539 50 10 IJGE C[C@@H](c1ccncc1Br)[C@H](Br)c1ccsc1S(C)(=O)=O 1924062672 HHVDUEPVPOVCBW-UFBFGSQYSA-N 439.194 4.549 50 10 IJGE CC1(C)CC[C@]2(CC[C@@H](CI)O2)[C@H](CNC(=O)OC(C)(C)C)C1 1927121583 JTHSQUZVHBNOLG-SUNYJGFJSA-N 437.362 4.690 50 10 IJGE C[C@@H]1C[C@H](Br)CN(Cc2cc(Br)ccc2Br)C1 2006497156 QJYUCIKZJWERBG-SKDRFNHKSA-N 425.990 4.817 50 10 IJGE CC(C)[C@H](CCBr)NC(=O)c1c(Br)cccc1Br 2033092473 BHAOXXUQRKVBJU-NSHDSACASA-N 441.989 4.751 50 10 IJGE CCC[C@H](Cl)c1cn(-c2ccc(I)cc2Br)nn1 2057420375 HEJLOCIMQJPERM-JTQLQIEISA-N 440.510 4.714 50 10 IJGE CC(C)CN(Cc1ccccc1)S(=O)(=O)c1cc(CBr)cc(F)c1F 2059313020 SHTJFNSVYHCUJJ-UHFFFAOYSA-N 432.330 4.707 50 10 IJGE C[C@@]1(CCl)CC(F)(F)CN1C(=O)c1cccc(Br)c1Br 2159049228 MDQKDXITCMZFEK-LBPRGKRZSA-N 431.502 4.690 50 10 IJGE CC(C)(C)OC(=O)NCCCOC1CCN(CC2(CBr)CCCCC2)CC1 2163057834 FOCVODBOVXEAIC-UHFFFAOYSA-N 447.458 4.728 50 10 IJGE CC(C)(C)OC(=O)N1CCO[C@@H]2CCN(CCCCCCCCCBr)C[C@H]21 2163064506 UUKSCLHJPBZZPL-RTBURBONSA-N 447.458 4.822 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2[C@H]3CC[C@@H]([C@H]2C1)N(Cc1ccc(CBr)cc1)C3 2182845568 RRZPJQGSWUSJKA-MUGJNUQGSA-N 435.406 4.659 50 10 IJGE CCN(CC1CCN(CCCCCI)CC1)C(=O)OC(C)(C)C 2211185982 MAIMRLILVREPDG-UHFFFAOYSA-N 438.394 4.561 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)C1(C)CC2(CC(F)(F)C2)C1 2230582947 POHWOFXBXGFSOI-INIZCTEOSA-N 430.333 4.641 50 10 IJGE COCCCCCO[C@@](C)(CI)c1ccccc1Br 2271415060 IUASDVUPLVEUEO-HNNXBMFYSA-N 441.147 4.933 50 10 IJGE COc1ccnc(Oc2cccc(C)c2I)c1CBr 2277897367 QCWXLCXPBDWWAN-UHFFFAOYSA-N 434.071 4.690 50 10 IJGE CN(C(=O)c1cc(F)c(Br)cc1Cl)[C@H](CCBr)C(F)F 2282986938 XHLJQXZJYRYUPE-SNVBAGLBSA-N 437.481 4.732 50 10 IJGE O=C(NC[C@H](CBr)C1CCC1)c1cc(Br)c(F)cc1Cl 2285846671 QQIGASBFPPRIMD-VIFPVBQESA-N 427.539 4.783 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccc(F)cc2)c([N+](=O)[O-])cc1OCc1ccccc1 2294193038 JQVBQTQUQAIZON-UHFFFAOYSA-N 447.422 4.867 50 10 IJGE CCN(C)C[C@@H](Br)CCc1ccc(Cl)cc1I 2302327538 ZYZYZXBPWUFHOB-NSHDSACASA-N 430.555 4.592 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccccc2)c([N+](=O)[O-])cc1OCc1ccccc1 2313510918 DEJDMXULRKBDKR-UHFFFAOYSA-N 429.432 4.728 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccc(F)cc2)cc(Br)c1OC(C)C 2313630587 ORRPLAVIQZRXBY-UHFFFAOYSA-N 433.277 4.930 50 10 IJGE Clc1ccc(CN2[C@H](CBr)[C@H]3CC[C@@H]2C3)cc1I 2315548138 DIDHXYCCMBPUHU-MISXGVKJSA-N 440.550 4.692 50 10 IJGE COc1cc(C=NNC(=O)Nc2ccccc2)cc([N+](=O)[O-])c1OCc1ccccc1C 2323063596 MVCBXIRJGBGQBY-UHFFFAOYSA-N 434.452 4.646 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2[C@@H](Br)CC[C@H]2C1 2327404268 UAALJRBJBCTIKW-BIMULSAOSA-N 440.550 4.550 50 10 IJGE CCCN1C[C@@H](Br)[C@@H](Cc2cc(I)ccc2Cl)C1 2327407591 SNYJNVLJCLDGJE-WCQYABFASA-N 442.566 4.592 50 10 IJGE CCCN(CC1CCN(C(=O)OC(C)(C)C)CC1)C[C@@]1(CBr)CC1(F)F 2351887995 SPPSOGRHFNQHKR-SFHVURJKSA-N 439.385 4.766 50 10 IJGE O=C(CCl)N1CCN(c2nc(C3CCCCC3)nc3sc4c(c23)CCCC4)CC1 35849021 YJHSSXWCPUGVAC-UHFFFAOYSA-N 433.021 4.505 50 10 IJGE Cc1c(C(=O)Oc2cccc3ccccc23)oc2c1/C(=N/NC(=O)c1ccccn1)CCC2 40814337 OPFLFOLJBWPVML-TURZUDJPSA-N 439.471 4.826 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccc(C(C)C)cc2)ccc1OCc1ccccc1 40846806 AMYYAPNWWKGPIV-JVWAILMASA-N 432.520 4.927 50 10 IJGE Cc1cc(/C=N/NC(=O)Cc2cccc(C(F)(F)F)c2)c(C)n1-c1cccc([N+](=O)[O-])c1 59136476 HZEQTBSILJPLMG-LGJNPRDNSA-N 444.413 4.714 50 10 IJGE CCOC(=O)/C(C#N)=C\c1cc(Br)c(OCc2ccc(F)cc2)c(OC)c1 98035270 HOZNIONPMXXYKQ-NVNXTCNLSA-N 434.261 4.646 50 10 IJGE CCC(CC)(CBr)NC(=O)c1cc(Br)c(Br)s1 125304964 GKHPEOMOALPIGH-UHFFFAOYSA-N 448.018 4.957 50 10 IJGE CCCOc1ccccc1/C=C\C(=O)Oc1ccc(/C=C(\C#N)C(=O)OCC)cc1OCC 207003125 JKNUKPRYSBSRJH-JZBWGPSGSA-N 449.503 4.963 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC(=O)/C(C#N)=C\Nc1ccc(Nc2ccccc2)cc1 217230698 UVTWHLVEOPPNSU-NXVVXOECSA-N 429.436 4.805 50 10 IJGE C/C(C=NNC(=O)CCCCC(=O)NN=C/C(C)=C/c1ccccc1)=C/c1ccccc1 254747130 RTQBUBOGZYYOFB-XYSQTUTESA-N 430.552 4.958 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1Cc1cc(Cl)ccc1I 405305833 QFKHXFSZJIXGPU-GXSJLCMTSA-N 428.539 4.692 50 10 IJGE Cc1ccc(CCNC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)cc1 734816871 GCUJUNUKDXTFNT-RCCKNPSSSA-N 443.938 4.691 50 10 IJGE O=C(NNc1ccc(Br)cc1F)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 748191384 MATHMSGTERGVHH-VXGBXAGGSA-N 433.199 4.734 50 10 IJGE COc1cccc(-c2nn(C(C)(C)C)cc2C=NNC(=O)c2cccc3cccnc23)c1 759654263 YRJBRPROWJVFSK-UHFFFAOYSA-N 427.508 4.626 50 10 IJGE Cc1ccc(F)c(NNC(=O)C2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)c1 760140959 GAMYOPWUOQAEAG-UHFFFAOYSA-N 430.833 4.561 50 10 IJGE CCS(=O)(=O)c1cccc(C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)c1 762463139 NPXKUFBDOCDCIT-MRXNPFEDSA-N 437.892 4.952 50 10 IJGE Cn1c(=O)ccc2ccc(NC(=O)C(=O)Nc3ccc(S(F)(F)(F)(F)F)cc3)cc21 787590033 MCVJIIUPWGEXNQ-UHFFFAOYSA-N 447.385 4.773 50 10 IJGE Cc1ccc(C(=O)NN=C2CCCc3oc(C(=O)N4c5ccccc5C[C@@H]4C)c(C)c32)cc1 1772744693 GORWIEYORMIFTF-KRWDZBQOSA-N 441.531 4.958 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3CCC)c1 1865694091 PHOWCPNJAKSQFA-JOCHJYFZSA-N 444.535 4.976 50 10 IJGE CCc1nn(Cc2ccccc2F)c2c1[C@@H](c1ccc(N(CC)CC)cc1)C(C#N)=C(N)O2 1865700657 AKNZARGKSCLKGQ-QHCPKHFHSA-N 445.542 4.697 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1ccccc1OC)C(C#N)=C(N)O2 1865710360 WJVJRUZMZYRPHU-NRFANRHFSA-N 434.927 4.764 50 10 IJGE CCOc1ccc(-c2csc(/C(C#N)=C/c3cc4c(cc3[N+](=O)[O-])OCCO4)n2)cc1 1872790484 LQAULSCBIWGMKM-CXUHLZMHSA-N 435.461 4.952 50 10 IJGE CN(CC1(CBr)CC1)C(=O)c1cc(Br)c(Br)s1 1915530347 AYRSBOUPKFJCQR-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE O=C(N[C@H]1CC[C@@H](CBr)C1)c1csc(Br)c1Br 1945189759 ZDMOCNPKJLZXAF-RQJHMYQMSA-N 446.002 4.567 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)O[C@@H]1CCCC(F)(F)CC1 1995216102 BSCOYCVJOSUQRL-DOMZBBRYSA-N 447.304 4.689 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)c1cc(Br)c(Br)s1 2020192112 ICUKKXPKBVJZTG-LJGSYFOKSA-N 446.002 4.519 50 10 IJGE CC[C@@H](C)N(CCBr)Cc1ccc(I)c(Cl)c1 2026559517 BAIDJZOXZNNBFW-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2[C@H]1CN(Cc2ccccc2)C[C@@H]1C 2096803841 TXHOZPNGXRLCOH-UGSOOPFHSA-N 433.781 4.934 50 10 IJGE ClCCc1nc2cc(Br)ccc2n1[C@]12C[C@H]1CN(Cc1ccccc1)C2 2099678422 IMNHTUUCJQLMRY-KKSFZXQISA-N 430.777 4.811 50 10 IJGE ClCCc1nc2cccc(Br)c2n1[C@]12C[C@H]1CN(Cc1ccccc1)C2 2099679992 WKGBABOMPMAGDN-KKSFZXQISA-N 430.777 4.811 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CC2(CBr)CCCC2)CC[C@@H]1C(F)(F)F 2106780837 BWIZRSGYUJFTJO-UONOGXRCSA-N 443.348 4.719 50 10 IJGE CCCC(CBr)(CCC)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1COC 2106781829 LLVBHHHTBGYXRB-KRWDZBQOSA-N 435.447 4.536 50 10 IJGE C[C@@H]1CCCC[C@@]1(CNC(=O)OC(C)(C)C)NC(=O)[C@H](Br)C1CCCC1 2110723286 NFYUJJKAALLQKS-KKVAFCGZSA-N 431.415 4.530 50 10 IJGE Fc1cc(CBr)cc(F)c1N1CCCN(Cc2ccccc2)CCOCC1 2144876530 ODAUKOMFZVAFEG-UHFFFAOYSA-N 439.344 4.589 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2CCN(C[C@H](CBr)c3ccccc3)C[C@@H]2C1 2163062276 KPULMVCZAXAOTJ-SLFFLAALSA-N 437.422 4.744 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1CN(C(=O)[C@H](Br)C1CCCC1)C1CC1 2167033870 POAQZVOOEJCTNH-QZTJIDSGSA-N 443.426 4.721 50 10 IJGE O=C(c1c(Cl)cccc1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Br)C2 2190671293 RDZJFVJFFRRGEV-PYEWSOSRSA-N 425.523 4.581 50 10 IJGE COc1cc2c(cc1Br)nc(CCCl)n2C[C@@H]1CCN1Cc1ccccc1 2202310581 YVDCVCOVGAINPD-INIZCTEOSA-N 448.792 4.863 50 10 IJGE ICCCCCN1C[C@@]23CCC[C@@]2(C1)CN(Cc1ccccc1)C3 2214705321 QFICAVMLHHYZTB-NHCUHLMSSA-N 438.397 4.580 50 10 IJGE COC1CC(CO[C@](C)(CI)c2ccccc2Br)C1 2230120298 UHOXTQKETWMMDK-KOHJWAIASA-N 439.131 4.541 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)C(=O)c1cccc(Cl)c1Br 2248086119 BWYOHPFTXQBCPE-AWEZNQCLSA-N 431.157 4.999 50 10 IJGE COc1ccc([C@H](Br)C2(S(C)(=O)=O)CCC2)c(Br)c1Cl 2283557415 CLOTVTRSMLYAJO-LBPRGKRZSA-N 446.588 4.514 50 10 IJGE CC1([C@@H](Cl)c2cc(Br)ccc2OCc2ccccc2)CS(=O)(=O)C1 2299525216 LQEWUHARSXUQAY-KRWDZBQOSA-N 429.763 4.743 50 10 IJGE COc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(C)cc2)cc1 2314634251 NFBLGNZWRPZJSE-SANMLTNESA-N 438.483 4.841 50 10 IJGE CN(c1c(CBr)c(C(F)(F)F)nn1C)[C@H]1CC[C@@H]1OCc1ccccc1 2339772983 CRVQBWWJRUOHIC-GJZGRUSLSA-N 432.284 4.518 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@H]1CCC[C@]2(C1)CC2(F)F 2343419445 ZVABWCUJHVWNDV-SCTDSRPQSA-N 430.333 4.689 50 10 IJGE CN(c1nc(C(F)(F)F)ccc1CBr)[C@@H]1CCN(Cc2ccccc2)C1 2343787552 HWHASDHATFVFCH-MRXNPFEDSA-N 428.296 4.706 50 10 IJGE CN(Cc1ccccc1I)CC1(CBr)CC(C)(C)C1 2345004825 PRWKOMKYWBENMS-UHFFFAOYSA-N 436.175 4.924 50 10 IJGE CC(C)C[C@H](CBr)CN1CCCC[C@H]1[C@H]1CCCN(C(=O)C(F)(F)F)C1 2382185445 YQQFEDYGYRPDNX-IKGGRYGDSA-N 441.376 4.699 50 10 IJGE O=C(NNC(=O)c1cccc2ccccc12)c1ccnc(C23CC4CC(CC(C4)C2)C3)c1 35553562 GMUJXKYCUHCINE-UHFFFAOYSA-N 425.532 4.777 50 10 IJGE CCc1sc2nc(CCBr)[nH]c(=O)c2c1-c1ccc(Br)cc1 36306405 BAYQYANEICCHIE-UHFFFAOYSA-N 442.176 4.914 50 10 IJGE CC(C)COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccco2)cc1 38657463 PYMBCMLTQOMDNT-HSZRJFAPSA-N 430.460 4.752 50 10 IJGE CC(C)(C)c1cc(/C=N\NC(=O)Cc2ccc3nc(N)sc3c2)cc(C(C)(C)C)c1O 169917080 ULNVWVBULCMXNJ-ZMFRSBBQSA-N 438.597 4.872 50 10 IJGE N#C/C(=C/NCCc1ccc(Br)cc1)C(=O)Nc1cccc(C(F)(F)F)c1 217148040 GZTWDCLUYGAYOU-OWBHPGMISA-N 438.247 4.646 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1Br)c1ccc(Br)cc1Br 232486527 YGBRMIBNBXNRAB-PWSUYJOCSA-N 439.973 4.648 50 10 IJGE CCOc1ccc(-n2c(C)cc(C=NNC(=O)c3c(C)nc4cc(C)ccn34)c2C)cc1 252588409 ACFKYBHFUSWZHN-UHFFFAOYSA-N 429.524 4.521 50 10 IJGE COc1cc(C=NNC(=O)c2csc(C(C)C)c2)ccc1OCCN1CCCCC1 254815298 ODPQBUDUHNFVFD-UHFFFAOYSA-N 429.586 4.509 50 10 IJGE ClCCc1nc2cc(Br)cnc2n1CC1CCN(Cc2ccccc2)CC1 397562643 YORBUZQOFOSUAE-UHFFFAOYSA-N 447.808 4.887 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@H]2C[C@@H](Cl)CC[C@H]2C1 398668294 GWHNQCVGIYFIOW-YIZRAAEISA-N 427.589 4.753 50 10 IJGE O=C(N[C@H](CBr)C1CCC1)c1cc(Br)sc1Br 717614971 DZYRAIWWKMCNNQ-MRVPVSSYSA-N 446.002 4.567 50 10 IJGE CC[C@@H](O[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1)C1CCC1 719658315 UFZDGUUHXFTUTN-QAPCUYQASA-N 437.362 4.786 50 10 IJGE CC[C@H](Cl)CCCNC(=O)c1ccc(I)c(Br)c1 721615077 QVDPMGKQXOTCPC-JTQLQIEISA-N 444.538 4.581 50 10 IJGE Cc1ccc([N+](=O)[O-])c([C@@H]2CN(Cc3ccccc3)C[C@@H]2CI)c1 725388269 KZECZYDFOKUHAI-FUHWJXTLSA-N 436.293 4.554 50 10 IJGE C=CCc1cc(C=NNC(=O)COc2ccc(-c3ccccc3)cc2)cc(OCC)c1O 1084187553 DWUPKVMSVCCCOP-UHFFFAOYSA-N 430.504 4.716 50 10 IJGE O=C(NN=Cc1ccccc1O)c1cn(Cc2ccc(Br)cc2)c2ccccc12 1084224509 XXZCSSOEMBHCIX-UHFFFAOYSA-N 448.320 4.922 50 10 IJGE CCOc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)Cc2ccccc2)CCC3)cc1 1772749760 ZEIVYAKCXIOVDN-UHFFFAOYSA-N 445.519 4.638 50 10 IJGE CCCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccc[nH]1)C(C#N)=C(N)O2 1865709374 ATZSOPFSFSLMAQ-GOSISDBHSA-N 428.323 4.737 50 10 IJGE CCOC(=O)c1c(NC(=O)[C@H](C)Cl)sc(C(=O)Nc2ccc(Cl)cc2)c1C 1865768564 HYFMKIITKDCVDW-JTQLQIEISA-N 429.325 4.705 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@@H](CCBr)C(F)(F)F)cc1Cl 1918561727 WYJNIOUWUJFSQT-JTQLQIEISA-N 437.481 4.857 50 10 IJGE O=C(c1csc(Br)c1Br)N(CCBr)C1CCC1 1945189054 HPYANAPMNYARMF-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE Cc1csc(CBr)c1S(=O)(=O)N(Cc1ccccc1)CC(F)(F)F 2009640865 YMFOXDNNNYNLGG-UHFFFAOYSA-N 442.322 4.705 50 10 IJGE COC[C@H]1C[C@H]1COc1c(Br)cc(CBr)cc1Br 2069753633 OSDMVPNAEHSFOH-ZJUUUORDSA-N 442.973 4.768 50 10 IJGE Fc1cc(F)cc(Cn2nc(CCl)c(I)c2C(F)(F)F)c1 2079211926 FNCFQRWGXSCVPR-UHFFFAOYSA-N 436.549 4.572 50 10 IJGE CN(C[C@]1(Br)CC1(F)F)c1cc(Br)ccc1CBr 2082521473 HYVHBXKIVJQYNM-LLVKDONJSA-N 447.943 4.953 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@@H]2C[C@@H](Cl)CC[C@@H]21 2087663186 HVZZYQREJPNWBP-WEDXCCLWSA-N 427.589 4.895 50 10 IJGE CCC(CC)(CBr)CN1CCC([C@@H]2CCCN(C(=O)C(F)(F)F)C2)CC1 2163065040 WXUFXFDCQROZLQ-MRXNPFEDSA-N 441.376 4.701 50 10 IJGE CN(C(=O)c1cc(Br)ccc1Cl)C1(CBr)CCSCC1 2171182629 SMUVGJVFTZRKOL-UHFFFAOYSA-N 441.616 4.835 50 10 IJGE Cc1cc(Br)c(C)c([C@@H](Cl)[C@@H]2CCCS(=O)(=O)C2)c1Br 2201071233 QBJJJFBLYXVJGS-YGRLFVJLSA-N 444.616 4.933 50 10 IJGE CCCN(C[C@H](C)Cl)C(=O)c1cc(Br)ccc1I 2259762482 MFEUETGLWFMWIQ-VIFPVBQESA-N 444.538 4.533 50 10 IJGE COc1ccnc(N(C)C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c1CBr 2281103280 QPLKMUYAORJUQW-DFNIBXOVSA-N 430.390 4.617 50 10 IJGE CC1(C)CN(C(=O)c2cc(F)c(Br)cc2Cl)CC[C@H]1Br 2282983894 UCWOBPQQAIQLRA-GFCCVEGCSA-N 427.539 4.877 50 10 IJGE CS(=O)(=O)c1cscc1C[C@@H](CBr)c1cccc(Br)c1 2288494070 BGEUKUCDRVKIKK-NSHDSACASA-N 438.206 4.635 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC[C@@H]2C[C@@H]3CC[C@H]2C3)C1 2298751493 MGJUTUZILHAWSG-PASDCYSWSA-N 449.373 4.644 50 10 IJGE C[C@H]1[C@H](Br)CCCN1Cc1cc(I)ccc1Cl 2307325697 CUXYIVOXAKIUAA-JOYOIKCWSA-N 428.539 4.692 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)NCc2cccs2)ccc1OCc1ccccc1C#N 2313540760 SCXGRONUPKZDAJ-UHFFFAOYSA-N 443.528 4.821 50 10 IJGE C[C@H](CBr)CN1CC[C@@H](CCNC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2315864887 WQTDTASGPSHVMA-MGPQQGTHSA-N 431.337 4.575 50 10 IJGE Clc1ccc(CN2C[C@H](CBr)C3(CC3)C2)c(I)c1 2318529309 OOMLKRGFXYQUAA-NSHDSACASA-N 440.550 4.552 50 10 IJGE CCN(CC)c1ccc(NC=C(C#N)C(=O)N[C@@H](C)c2ccc(OC)c(OC)c2)c(C)c1 2320906743 PXUSCKUERGJOLL-SFHVURJKSA-N 436.556 4.555 50 10 IJGE COc1cc(C=NNC(=O)c2ccc3nc(Cc4ccccc4)[nH]c3c2)ccc1OC(C)C 2323721372 NZVKUWYNHCLBPY-UHFFFAOYSA-N 442.519 4.713 50 10 IJGE Clc1ccc(I)cc1CN1CCC[C@H](CBr)CC1 2327397891 WVDCQDJCMXHVGN-NSHDSACASA-N 442.566 4.942 50 10 IJGE COc1cc2nc(C(C#N)=Cc3cccc(OCc4ccccc4)c3)nc(O)c2cc1OC 2331039490 IHSRDVCHBNRROU-UHFFFAOYSA-N 439.471 4.996 50 10 IJGE COc1ccc(CCO[C@@H](CCl)[C@H](Br)CCl)c(Br)c1 2339258308 SIQAKDKYFICKNQ-OLZOCXBDSA-N 434.983 4.627 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H](NC(=O)OC(C)(C)C)CC3(CCC3)C2)C1 2345005385 XWSSQQBJBLCHSC-INIZCTEOSA-N 429.443 4.957 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Cl)[C@@H]1CCCS(=O)(=O)C1 2365226428 UTFWCBFFXUTRRX-PELKAZGASA-N 448.579 4.764 50 10 IJGE CC1(C)C[C@@](C)(CCl)CN1C(=O)c1ccc(Cl)cc1I 2365588442 JJGLJXJHMMPSEI-HNNXBMFYSA-N 426.125 4.814 50 10 IJGE Cc1csc(C(=O)N2CCC[C@H](Br)[C@H]2C(F)(F)F)c1Br 2370253289 VSGILXMSDYXOJB-XVKPBYJWSA-N 435.103 4.749 50 10 IJGE Cc1ccccc1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(Cl)cc1 38651318 HPMUBUKKKHPNIG-DEOSSOPVSA-N 446.890 4.851 50 10 IJGE Cc1c(C(=O)N2CCCC[C@H]2C)oc2c1/C(=N/NC(=O)c1ccc(Cl)cc1)CCC2 40811589 AQWIGQBAFNMJMW-HUEFVVPSSA-N 427.932 4.726 50 10 IJGE CCCOc1ccccc1/C=C/C(=O)Oc1ccc(/C=C(\C#N)C(=O)OCC)cc1OCC 40950451 JKNUKPRYSBSRJH-VIQQRITCSA-N 449.503 4.963 50 10 IJGE CCCOc1ccc(/C=N/NC(=O)CCCOc2ccc(C)cc2Br)cc1 40951159 PQYOCFUPJNIOMF-HZHRSRAPSA-N 433.346 4.856 50 10 IJGE CC/C(=N/NC(=O)C1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1 98064218 FSFTZOZAYCQDHK-FLFQWRMESA-N 428.374 4.592 50 10 IJGE O=S(=O)(Nc1cc(Br)ccc1Cl)c1ccc(CBr)cc1 115919056 CGTDXVUDKLRCAL-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE CCCOCCO[C@](C)(CI)c1ccccc1Br 162335140 WRKAJYJMVZHVPW-CQSZACIVSA-N 427.120 4.543 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C\Nc1cccc(Br)c1)C12CC3CC(CC(C3)C1)C2 217049612 VEPOWYNJPYNKGU-ZTNMFLNZSA-N 428.374 4.990 50 10 IJGE Cc1ccc2nc(-c3ccc(N/C=C(/C#N)C(=O)N4C[C@H](C)O[C@H](C)C4)cc3)sc2c1 217196855 QEULCJZEPLBXKE-XLSLOCCASA-N 432.549 4.727 50 10 IJGE COc1cc([N+](=O)[O-])ccc1NC(=O)/C(C#N)=C\Nc1ccc(Oc2ccccc2)cc1 217230307 XHNXHLWMMDHTDH-NXVVXOECSA-N 430.420 4.854 50 10 IJGE C[C@H](Cl)c1nnc(-c2cc(Br)ccc2I)s1 235500889 UETQSFJYPIRTFH-YFKPBYRVSA-N 429.508 4.872 50 10 IJGE C[C@H]1C[C@H](O[C@H](CI)c2cccc(Br)c2)C[C@@H](C)O1 253123721 KCMDHBIQMFYPCF-BAESOJJISA-N 439.131 4.898 50 10 IJGE CCCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3ccccc3F)cc2)cc1 254489713 GBTQDMCWQDFCRI-UHFFFAOYSA-N 434.467 4.988 50 10 IJGE Cc1ccc(C(=O)Oc2ccc(C=NNC(=O)COc3ccc4ccccc4c3)cc2)cc1 254837883 ZHZVKPRPKGXMDZ-UHFFFAOYSA-N 438.483 4.897 50 10 IJGE COc1ccc(Br)c([C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CBr)c1 382685640 ILUNRTCHHYNWNV-SMDDNHRTSA-N 449.183 4.803 50 10 IJGE O=C(NNc1ccnc(F)c1)c1cc(-c2ccccc2)nc2cc(Br)ccc12 781363872 PMKQUANQNZSNPC-UHFFFAOYSA-N 437.272 4.955 50 10 IJGE CN(C)NC(=O)Nc1cccc(NC(=O)/C=C(/c2ccc(Cl)cc2)C(F)(F)F)c1 788253188 GNWHPCYLGNTMTH-WJDWOHSUSA-N 426.826 4.523 50 10 IJGE CSCc1ccc(CNC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cc1 804701276 DSDMGPRGQRQRII-HYARGMPZSA-N 441.560 4.550 50 10 IJGE C=CCC(C)(C)CNC(=O)NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1 1312762644 XTYWSVPJNRWLPN-UHFFFAOYSA-N 429.586 4.871 50 10 IJGE O=C(NN=Cc1cccc(OCc2ccc(F)cc2)c1)C(F)(F)C(F)(F)C(F)(F)F 1565518769 BNAOQXVCERKYJN-UHFFFAOYSA-N 440.290 4.688 50 10 IJGE CCCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1cccnc1)C(C#N)=C(N)O2 1865699875 FMTZXMIMMBYDJR-SFHVURJKSA-N 426.307 4.745 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)ccc1OC 1865762070 LNIPTQDHBMSHKJ-ZMFRSBBQSA-N 425.435 4.506 50 10 IJGE C[C@@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(Br)c1 1914350043 FRYHPKPPUJZDHH-LBPRGKRZSA-N 437.186 4.921 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1cc(O)cc(Br)c1 1915107678 WIJOHFZFULHCGO-ZDUSSCGKSA-N 441.163 4.971 50 10 IJGE O=S(=O)(N[C@H](CBr)CC1CCCCC1)c1sccc1Br 1926736081 KVDLVPYBLXPYIN-NSHDSACASA-N 445.242 4.523 50 10 IJGE C[C@@H]1[C@@H](CBr)CCN1Cc1ccc(Br)cc1Br 1943858577 INMVUCYWQDLNQX-NXEZZACHSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@H](CI)O2)C[C@H]1C1CCC1 1990242578 UJKSWCHSZXJMSD-RVKKMQEKSA-N 435.346 4.539 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](OCc2cc(Cl)cc(Cl)c2)[C@H](Br)C1 1992070466 BHFJZLIEIMWCPP-KGLIPLIRSA-N 425.150 4.893 50 10 IJGE CN(CC(=O)C(C#N)=C1NC(c2ccc(Br)cc2)=CS1)C1CCCCC1 2042453430 IUTJHCQFMFFGSA-UHFFFAOYSA-N 432.387 4.653 50 10 IJGE F[C@]1(CBr)CCCN(Cc2cc(Br)ccc2Br)C1 2054716746 FEWYPFRKZVDBHF-ZDUSSCGKSA-N 443.980 4.911 50 10 IJGE O=C(CBr)c1c(C(F)F)cc(I)cc1C(F)(F)F 2060394638 PEVUHIYBJMJWQT-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE CCCc1cccc(-n2nc(CCl)c(I)c2C(F)(F)F)n1 2078881530 YTAYPRVCRQLXSE-UHFFFAOYSA-N 429.611 4.582 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C(F)(F)F)N(C[C@@H](CBr)C2CCC2)CC1 2106786980 WVGOPAOENYQNGZ-HUUCEWRRSA-N 443.348 4.671 50 10 IJGE BrCC1(CN2CC[C@H]3OCCN(Cc4ccccc4)[C@H]3C2)CCCCCC1 2185497215 OXODOBMXACLULM-FCHUYYIVSA-N 435.450 4.697 50 10 IJGE O=S(=O)(Nc1ccc(Br)c(Br)c1)c1ccccc1CCl 2185907029 IHOISCUDQMASFM-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE C[C@H]1[C@@H](C)N(c2ccc(CBr)c([N+](=O)[O-])c2)C[C@@H](C)N1Cc1ccccc1 2188578577 YFEUVJUFYAAGKE-IXDOHACOSA-N 432.362 4.977 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1COC(C)(C)CN1CC1(CBr)CCCCCC1 2194647609 CSWHWZAAIUMRPH-QGZVFWFLSA-N 447.458 4.726 50 10 IJGE CS[C@@H]1COC[C@@H]1n1c(CCl)nc2cc(Br)c(Br)cc21 2234076126 UWLRJUNIPSAQHZ-NWDGAFQWSA-N 440.588 4.603 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=C(C#N)C(=O)Nc3cc([N+](=O)[O-])ccc3C)o2)cc1 2296964422 QESCJCNUBFGGLW-UHFFFAOYSA-N 445.431 4.886 50 10 IJGE CC1(C)C[C@@H](Cl)CN(Cc2ccc(I)c(Br)c2)C1 2325218507 PLRLWGWPHAGEFO-LLVKDONJSA-N 442.566 4.893 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CC(F)(F)CN1C[C@](C)(CBr)C(C)(C)C 2327075390 GOSHZTLDOKJQSV-GUYCJALGSA-N 427.374 4.668 50 10 IJGE CC(=O)c1ccc(-c2ccc(C=NNC(=O)CCCCCNC(=O)OC(C)(C)C)o2)cc1 2328800006 XXVKIFHXLFOGKH-UHFFFAOYSA-N 441.528 4.684 50 10 IJGE CC(C)[C@@H](CBr)CN1CC[C@H](C(F)(F)F)C[C@@H]1CNC(=O)OC(C)(C)C 2329542858 NYTWBLDNRSSMGB-SOUVJXGZSA-N 445.364 4.821 50 10 IJGE Brc1ccc([C@@H](CI)OC[C@@H]2O[C@H]3CC[C@H]2C3)cc1 2352572415 GEZZTYTXNBMFAY-MHEUCROKSA-N 437.115 4.509 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H](OCC)[C@H](CNC(=O)OC(C)(C)C)C1 2354609026 RWFJJPRQPVMAMQ-QZTJIDSGSA-N 449.474 4.830 50 10 IJGE C[C@H](Oc1ccc(F)cc1)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cccc(F)c1 38678120 VMTRYLSBLADRHY-PSLXWICFSA-N 448.425 4.556 50 10 IJGE COc1cc(/C=N/NC(=O)c2cc3cc(Br)ccc3o2)ccc1OC(C)C 59305298 TUEKBIHFLSKPAS-SSDVNMTOSA-N 431.286 4.755 50 10 IJGE O=C1NCCc2ccc([C@@H](Cl)c3cc(Br)c(Br)s3)cc21 128567337 OBZMUJKYHNNTGR-GFCCVEGCSA-N 435.568 4.887 50 10 IJGE Cc1cccc(C(=O)N[C@@H](CCBr)C(C)(C)C)c1I 231171885 JLWPCMUDKHXFCF-LBPRGKRZSA-N 438.147 4.529 50 10 IJGE CC(C)(CCBr)NC(=O)c1ccc(Br)cc1Br 232520207 IQVRBUQTSDGUAS-UHFFFAOYSA-N 427.962 4.505 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(CBr)cc2)c1I 235909700 FFNNTKMPMZBGAJ-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE C[C@H](Cl)c1nc2ccc(Br)cc2n1C[C@@H]1CN(Cc2ccccc2)CCO1 312616769 HFEDOQMFEIFQOU-YJBOKZPZSA-N 448.792 5.000 50 10 IJGE CC[C@H](Br)CCCNC(=O)c1ccc(Br)cc1Br 398526385 ABFHDNDMOQVKLN-VIFPVBQESA-N 441.989 4.895 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2cc(C)n(-c3ccc(F)cc3)c2C)cc1 725441646 JBPUETPDNZAQML-XMMPIXPASA-N 437.515 4.596 50 10 IJGE CN1CCC[C@@H](CNC(=O)NNc2nc(Cl)c(Cl)cc2Cl)[C@H]1c1cccs1 745850329 WUUGDDPHKPSJNB-HZMBPMFUSA-N 448.807 4.813 50 10 IJGE Cc1cc(C=NNC(=O)C(=O)Nc2ccccc2F)c(C)n1-c1ccc(Cl)c(Cl)c1 1084180842 ZKKJSGCYIUWISJ-UHFFFAOYSA-N 447.297 4.629 50 10 IJGE COc1cc(C=NNC(=O)c2ccccc2)ccc1OCc1ccc(Br)cc1 1084346811 SKEOUDLIFLPCTJ-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N[C@@H](C)c2ccc3nc(O)oc3c2)c(C)n1-c1ccccc1F 1534335199 YWMFPDVSENTWTE-VUQQOUJSSA-N 444.466 4.864 50 10 IJGE O=C(NNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc2c(c1)nc(O)n2C1CC1 1641402474 PVFYDHPSTVGCBZ-UHFFFAOYSA-N 444.335 4.871 50 10 IJGE Cc1ccc(OCC(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)nc2C)c(C(C)(C)C)c1 1865757924 AXQGOKHHLPQTOP-UHFFFAOYSA-N 449.526 4.642 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Br)Cc1ccsc1 1900969090 GLJBLMFMJOKXAT-ZETCQYMHSA-N 428.975 4.685 50 10 IJGE C[C@H](Br)C(C)(C)CNC(=O)c1cc(Br)cc(Br)c1 1913838016 OAHGSUPYAZFXDK-QMMMGPOBSA-N 441.989 4.751 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1cc(O)cc(Br)c1 1915107677 WIJOHFZFULHCGO-CYBMUJFWSA-N 441.163 4.971 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)OC(C)(C)C 1917431650 CNVKOIXZDYYZHY-ADAWSYLGSA-N 437.362 4.642 50 10 IJGE C[C@@H](NC(=O)c1scc(Br)c1Br)C(C)(C)CBr 1942913375 LEAJWCVAJAQCNJ-ZCFIWIBFSA-N 448.018 4.813 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]([C@@]2(C)CCC[C@H](CI)O2)CC1 1993734189 BAOHDOCTKBLTHA-BASYENTBSA-N 437.362 4.833 50 10 IJGE Brc1cccc(CN2CCCC[C@@H](Br)C2)c1Br 2003417220 LKCFEMGDMCTZBS-LLVKDONJSA-N 425.990 4.961 50 10 IJGE C[C@@](CBr)(NC(=O)c1cc(Br)ccc1Br)C1CC1 2029958205 YPADVZULKGXRFI-ZDUSSCGKSA-N 439.973 4.505 50 10 IJGE CCCN(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C[C@@H](Br)C(F)(F)F 2044700372 QAXHQFDYNUHLPX-UONOGXRCSA-N 431.337 4.814 50 10 IJGE Cc1ccc(C)c(Cn2nc(CCl)c(I)c2C(F)(F)F)c1 2079211513 UAOVXGYULRSLLR-UHFFFAOYSA-N 428.623 4.910 50 10 IJGE Brc1ccc([C@H](CI)OC[C@H]2CCCCCO2)cc1 2096323525 ZJQSQJMKKXDYLJ-CABCVRRESA-N 439.131 4.901 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H]3CC[C@@H](CN3C[C@@H](CBr)C(C)(C)C)[C@H]2C1 2106788889 UHIGIMVZKLBFDX-TZNCUMHOSA-N 429.443 4.621 50 10 IJGE O=C(NC[C@]12CCC[C@]1(CBr)C2)c1cc(Br)c(Cl)s1 2142949500 KHRLEAMAKLPWJM-CHWSQXEVSA-N 427.589 4.849 50 10 IJGE CCc1sc(Br)cc1[C@H](Br)c1cccc(S(C)(=O)=O)c1 2146828558 SPFXMKZMDNGQQY-CQSZACIVSA-N 438.206 4.961 50 10 IJGE CN(Cc1ccccc1)[C@H]1CCN(S(=O)(=O)c2ccc(Cl)c(CCl)c2Cl)C1 2152157782 DVJYULIPTCCYQR-HNNXBMFYSA-N 447.815 4.627 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)[C@@H](Br)C2CCCC2)CC12CCCCC2 2167034744 YATJRCIJLBNTKL-IRXDYDNUSA-N 443.426 4.769 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CCC[C@@H](CN1C[C@@H](CBr)c1ccccc1)C2 2200724489 WIZIUALGNWMGRR-JUXOCIIHSA-N 437.422 4.934 50 10 IJGE COc1cc(N2C[C@]3(C)CN(Cc4ccccc4)C[C@@]3(C)C2)ccc1CBr 2204547710 KZGZWAGARIEJOS-GOTSBHOMSA-N 429.402 4.939 50 10 IJGE F[C@@H]1C[C@H](Br)CN(Cc2c(Br)cccc2Br)C1 2213904186 QVEMLNSWHXBWKD-DTWKUNHWSA-N 429.953 4.519 50 10 IJGE CC(C)(C)[C@H]1C[C@@H](S(=O)(=O)N(Cc2ccccc2)[C@H](CBr)C2CC2)C1 2223706875 GBIYCVVYSOXATC-CEXWTWQISA-N 428.436 4.817 50 10 IJGE O=C(Nc1ccc(OCC2CC(Br)C2)cc1C(=O)O)OCc1ccccc1 2248251246 WEZQBQWBXCJMCM-UHFFFAOYSA-N 434.286 4.686 50 10 IJGE C[C@@H]1CC[C@@](CBr)(NC(=O)c2cc(Br)c(F)cc2Cl)C1 2285962930 JNRMBRPVYHXRBG-XLKFXECMSA-N 427.539 4.925 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=Cc2c(-c3ccccc3)nc3ccccn23)cc1 2296791889 LXGQOIRUMYLSAZ-UHFFFAOYSA-N 436.471 4.724 50 10 IJGE Cl[C@H]1CCOCC[C@@H]1Cc1ccc(I)c(Br)c1 2306200135 UHBQXCZLFLFIPD-PWSUYJOCSA-N 429.523 4.630 50 10 IJGE N#CC(=Cc1cc(Br)ccc1OCc1ccc(Cl)c(Cl)c1)C(N)=O 2313730347 RGHKTEHMDDKIDX-UHFFFAOYSA-N 426.097 4.727 50 10 IJGE CCOc1ccc(C=C(C#N)c2nc(O)c3cc(Br)ccc3n2)cc1OC 2314499164 SLEUXVSOKNBGHL-UHFFFAOYSA-N 426.270 4.569 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)C=Cc2ccccc2Cl)c(OC)c1 2314777174 RMIJEIPJLFPAQH-UHFFFAOYSA-N 438.911 4.791 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)c(Cl)c1OC 2323168917 NCTGXHKWMCTNND-ZDUSSCGKSA-N 425.916 4.727 50 10 IJGE CCCCCCOc1ccc(C=NNC(=O)c2cc(-c3ccccc3)nc(O)n2)cc1OC 2323700314 ISGDMGMVDRJZSP-UHFFFAOYSA-N 448.523 4.581 50 10 IJGE CC(C)(C)OC(=O)NCCN(CC(F)(F)F)C[C@@](C)(CBr)C(C)(C)C 2327079346 ZETNDELITITAOC-MRXNPFEDSA-N 433.353 4.823 50 10 IJGE COC(=O)c1c(NC(=O)CCCOc2ccc(OC)cc2)sc(C(C)=CC#N)c1C 2331558925 SLMQGMUSTMCXJH-UHFFFAOYSA-N 428.510 4.576 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cccc(C(F)(F)F)c1 2343416128 LSYANMWFFXBZKD-KRWDZBQOSA-N 430.264 4.806 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H](NC(=O)OC(C)(C)C)[C@H](C(F)(F)F)C2)C1 2345012089 YJTQBFBHYZKAST-CHWSQXEVSA-N 443.348 4.575 50 10 IJGE FC1(F)C[C@@]1(CBr)CN1CCC[C@@]2(CCCN(Cc3ccccc3)C2)C1 2351892433 PAFQFSNMWWBAIL-WOJBJXKFSA-N 427.377 4.785 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C)CN(C[C@@](C)(CBr)C(C)(C)C)CC1(F)F 2352107320 MXWBFVBKHHPCNS-MSOLQXFVSA-N 441.401 4.916 50 10 IJGE CC(C)[C@H](Br)C(C)(C)CN(C)S(=O)(=O)c1sccc1Br 2366076156 DROOMDWGXYLNGC-NSHDSACASA-N 447.258 4.577 50 10 IJGE CC(C)[C@H]1C[C@@H](Br)CN1C(=O)c1cc(F)c(Br)cc1Cl 2370880529 WUHQBDOZULQYNP-AMIZOPFISA-N 427.539 4.876 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCc2ccccc2N(C[C@]2(CBr)CC2(F)F)C1 2379985834 LMFGJUBIVXKWKE-DNVCBOLYSA-N 445.348 4.753 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccc2)c(Br)cc1OC 59281681 UJRDRPMHOUQAJB-FBJMNJBLSA-N 429.314 4.641 50 10 IJGE C[C@H]1CN(C(=O)c2ccc(Br)c(C(F)(F)F)c2)CC[C@H]1Br 167753663 YXDZJCVAIVJALK-GZMMTYOYSA-N 429.074 4.713 50 10 IJGE CCCOc1ccc(C=NNC(=O)COc2ccc(Br)cc2)c(OCCC)c1 252636134 XEYFLYPGMVKCNQ-UHFFFAOYSA-N 449.345 4.556 50 10 IJGE Cc1cc(SCC(=O)NN=Cc2ccc(OC(F)F)cc2)c(C)cc1Br 254905251 JEQOQOMNLYYJPW-UHFFFAOYSA-N 443.313 4.910 50 10 IJGE Brc1cc([C@H]2CCC[C@H](CI)O2)oc1Br 306180377 JLXIVQSLWAROJR-HTRCEHHLSA-N 449.908 4.850 50 10 IJGE C[C@@H]1CCN(Cc2cc(Cl)ccc2I)C[C@@H]1Br 405345555 PWQOHZCAJDYLTA-SKDRFNHKSA-N 428.539 4.550 50 10 IJGE FC(F)Oc1cc(I)c(Br)c(CBr)c1 575681795 BFCMGIZVTGIYMX-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE O=C(CSCc1ccccc1)NN=C1C(=O)N(C/C=C/c2ccccc2)c2ccccc21 1084358187 DGJLTZVDEHXVQX-PTSNJRLZSA-N 441.556 4.500 50 10 IJGE C=CCc1cc(C=NNC(=O)CC[C@H](O)c2ccccc2)ccc1OCc1ccccc1 1084470100 QFDYVSCEWOULOS-VWLOTQADSA-N 428.532 4.958 50 10 IJGE N#CSc1ccc(NC(=O)c2c3c(nc4ccc(Br)cc24)CCOC3)cc1 1859616732 BSSUPWGNWQPBHV-UHFFFAOYSA-N 440.322 4.895 50 10 IJGE CCCc1nn(Cc2ccc(F)cc2)c2c1[C@H](c1ccc(OCC)cc1)C(C#N)=C(N)O2 1865694432 UYGYRLMPYZYJMZ-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE COc1ccc([C@H](C(=O)N[C@@H](C)C(=O)Nc2ccc(SC#N)cc2)C2CCCC2)cc1 1867003358 FHFDMOUNRYHHQY-KSFYIVLOSA-N 437.565 4.686 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CC[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]1C2 1882087058 HCJLIVFGFRFNAQ-JONQDZQNSA-N 447.414 4.700 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](Br)[C@H](OCc2cccc(Cl)c2Cl)C1 1901218497 MRVYWXMIXDUAKW-DGCLKSJQSA-N 425.150 4.893 50 10 IJGE CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)C[C@H](Br)C(F)(F)F 1953584785 ORMURBSSTTVWDY-HNNXBMFYSA-N 439.316 4.729 50 10 IJGE C[C@]1([C@H](Br)c2cc(Br)sc2Br)COCCO1 1992639926 YQQAQYIJISOQIY-PSASIEDQSA-N 434.975 4.515 50 10 IJGE CC[C@@H](C)[C@H](CBr)NC(=O)c1scc(Br)c1Br 2023038790 ACYKXZXZZUBRBT-SVRRBLITSA-N 448.018 4.813 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc([S@](C)(=O)=NC(=O)CCCCBr)cc1 2044530245 FHBNSMJIHWVJQS-VWLOTQADSA-N 433.368 4.582 50 10 IJGE C[C@H](NC(=O)[C@H](Br)C1CCCC1)c1csc(NC(=O)OC(C)(C)C)n1 2051203799 JPIWLELBWVIGFT-GXFFZTMASA-N 432.384 4.621 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)[C@H](Br)C2CCCC2)n1 2082962915 SGBYXMVSNYXTQT-GXFFZTMASA-N 432.384 4.621 50 10 IJGE Clc1cc(CN2CC[C@H](Br)[C@H]3CC[C@@H]32)ccc1I 2086656017 SHTGRVROTYVGOM-SUNKGSAMSA-N 440.550 4.692 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCCCC2)C[C@H](Br)C(F)(F)F)C1 2106783838 CYIGYHMMLRKSST-HNNXBMFYSA-N 443.348 4.814 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(C)CN(CC3(CBr)CCCCC3)C[C@]2(C)C1 2106785518 PGZMIOOXWQHKQE-BGYRXZFFSA-N 429.443 4.911 50 10 IJGE C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C)[C@H](C)N1C[C@H](CBr)c1ccccc1 2106788813 SVYYGBOWSDMZMZ-BMFAXAFESA-N 425.411 4.883 50 10 IJGE COc1ccc(Br)cc1CN[C@H](C)CCCCCI 2117884194 FHDMWHJKESAGKZ-GFCCVEGCSA-N 440.163 4.931 50 10 IJGE CC(C)n1cc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)C2CC2)cc1CBr 2123272064 WAVQXECIUYIQBF-INIZCTEOSA-N 439.419 4.953 50 10 IJGE CCCN(C(=O)c1ccc(CBr)cc1)C1CCN(C(=O)OC(C)(C)C)CC1 2162915632 MDJDQGINRPIEMI-UHFFFAOYSA-N 439.394 4.833 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CN(C[C@@H](CBr)c3ccccc3)CC[C@@H]21 2163062390 LAYMKFRTRNRVAS-AQNXPRMDSA-N 437.422 4.887 50 10 IJGE CCCN(CCCCCI)C[C@@H]1CCCN1C(=O)OC(C)(C)C 2211186842 QNYXRNUNHCBVQA-INIZCTEOSA-N 438.394 4.703 50 10 IJGE CCOCc1cc(Br)c([C@@H](Br)[C@@H]2OCCOC2(C)C)s1 2233019575 PGDYGBOHWJYZBA-YPMHNXCESA-N 428.186 4.677 50 10 IJGE O=S(=O)(Nc1ccc(Cl)cc1CBr)c1cccc(Br)c1 2239457053 CKOFWCFVSNWFNS-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE CC1CC(CBr)(CN2CCC(C3(NC(=O)OC(C)(C)C)CCC3)CC2)C1 2265304440 PDFBBLNMXVQDDR-UHFFFAOYSA-N 429.443 4.957 50 10 IJGE COc1ccc([C@@H](Br)C[C@@H]2CCCOCC2)cc1I 2269545036 LHNOESDXTWNGQN-YPMHNXCESA-N 439.131 4.943 50 10 IJGE C[C@H](Br)COCc1cn(-c2c(Cl)cc(Cl)cc2Br)nn1 2295832411 DNXVXSJKVICISV-ZETCQYMHSA-N 443.954 4.637 50 10 IJGE CCCCOc1ccc(C=C(C#N)C(=O)Nc2sc(C)c(C)c2C(=O)OC)cc1OC 2296818058 DANIUCHIFXYJAF-UHFFFAOYSA-N 442.537 4.885 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](O)C1CC(Br)C1 2301511158 CFGPTMKCKVGBTD-LBVLNNNDSA-N 430.937 4.866 50 10 IJGE COc1ccc(NC(=O)C(C#N)=Cc2ccc(OCc3ccccc3C#N)c(OC)c2)cc1 2313510962 GNVBUSHFWBUNSR-UHFFFAOYSA-N 439.471 4.700 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl 2314332562 ZCXSBFOQXCCYTF-TXEJJXNPSA-N 431.758 4.933 50 10 IJGE C[C@H](Br)[C@H]1CCCN(Cc2ccc(Cl)c(I)c2)C1 2315551477 RIYNGMFCEPXCMP-JQWIXIFHSA-N 442.566 4.940 50 10 IJGE O=C(COc1cccc(Br)c1)N/N=C/c1ccc(OCc2ccccc2)cc1 3184719 RRNRBHNJMIXQGY-ZVHZXABRSA-N 439.309 4.557 50 10 IJGE CC(C)CCOc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1 14021786 VYTCZAJEZWMXAP-CQSZACIVSA-N 439.339 4.647 50 10 IJGE Cc1ccccc1NC(=O)/C(C#N)=C\N1CCN(C(c2ccccc2)c2ccccc2)CC1 216995542 FHFKKEJSOGYWNM-DAFNUICNSA-N 436.559 4.748 50 10 IJGE Cc1cccc(N2CCN(/C=C(/C#N)C(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)CC2)c1 217250395 ZZNIPRYOZOTSTI-PEZBUJJGSA-N 448.876 4.835 50 10 IJGE CC(C)[C@H](CCBr)NC(=O)c1cc(Br)cc(Br)c1 231122737 BJAQTFIHTTWJNG-LBPRGKRZSA-N 441.989 4.751 50 10 IJGE CC[C@H](Br)c1nnc(-c2ccc(I)c(Cl)c2)o1 232377188 LYIROBAAXHSIBH-ZETCQYMHSA-N 427.467 4.841 50 10 IJGE O=C(CCCC[C@H]1CCSS1)N1CC[C@H](Oc2ccc(Br)cn2)C1 238880067 PAKFIFACLCZADJ-GJZGRUSLSA-N 431.421 4.538 50 10 IJGE CC(=O)Nc1cccc(C(C)=NNC(=O)CSc2cc(C)c(Br)cc2C)c1 254414332 HNMTZMJQERVLNJ-UHFFFAOYSA-N 448.386 4.657 50 10 IJGE COc1cc(Br)c([C@H]2CCC[C@@H](CI)O2)cc1OC 382199632 FSXCUUUQBRHBPC-JOYOIKCWSA-N 441.103 4.512 50 10 IJGE Fc1cc2nc(CCl)n(Cc3ccn(Cc4ccccc4)n3)c2cc1Br 389613307 PIPARRSRFLWMND-UHFFFAOYSA-N 433.712 4.970 50 10 IJGE Clc1ccc(I)c(CN(CCBr)C2CCC2)c1 405340068 MJATUFPSAHKOKS-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE CCO[C@H](CO[C@@H](CI)c1cccc(Br)c1)C1CC1 703468118 CALJHLMQQRILRR-LSDHHAIUSA-N 439.131 4.757 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)Nc3nc4c(s3)C(=O)CCC4)c2C)cc1 727714310 ZGBRMCQQVUQVCT-ATVHPVEESA-N 446.532 4.624 50 10 IJGE CCc1ccc(O)c(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)c1 759741260 CMSKTPRSDMRQBP-AQTBWJFISA-N 445.910 4.931 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2C[C@H]3[C@H]4CC[C@@H](C4)[C@H]3C2)c(-c2ccc(Cl)cc2)n1 818447623 AUVZHJNHQNBHBI-KBABBXQZSA-N 445.954 4.529 50 10 IJGE Cc1ccc(C(=O)Nc2ccccc2C(=O)NN=Cc2cccc(Br)c2)cc1 1083942509 HQDNDKAYVNDAJP-UHFFFAOYSA-N 436.309 4.774 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NC2CCCCC2)c(C)n1-c1ccc(C(=O)O)c(Cl)c1 1084296122 YFINZUGVOBDTPQ-GZTJUZNOSA-N 425.916 4.802 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@@H]1CCN(C(=O)CCSCc2nc(O)c3ccccc3n2)C1 1557689864 NYABEQUSWYYVOM-MRXNPFEDSA-N 447.677 4.581 50 10 IJGE O=C(CCl)ON=C1C(=O)N(Cc2ccc(Cl)c(Cl)c2)c2ccc(Cl)cc21 1848352817 RVKASSIILVXNFJ-UHFFFAOYSA-N 432.090 4.680 50 10 IJGE CC(C)Oc1ccc(C(=O)Nc2cccc(C(=O)Nc3ccc(SC#N)cc3)n2)cc1 1860566247 KOSZWTAJYFFALE-UHFFFAOYSA-N 432.505 4.947 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccc(Cl)cc2)[C@@H]1c1ccncc1 1865699915 GGHFIOLWNGCOGV-HXUWFJFHSA-N 425.879 4.806 50 10 IJGE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 1873794632 RQYGPYSBIDWKBP-VSQKZVHOSA-N 439.556 4.655 50 10 IJGE O=S(=O)(c1cc(CCl)c(Cl)cc1Cl)N(Cc1ccccc1)[C@@H]1CCOC1 1915472813 VYEOYOAJMWXBIA-OAHLLOKOSA-N 434.772 4.712 50 10 IJGE CC(C)(C)OC(=O)N1CCCC2(C1)CC1(CCC[C@@H](CI)O1)C2 1986987487 XASYZUQLXVEFHK-NNGSBXSVSA-N 435.346 4.540 50 10 IJGE CO[C@H](C)CCOc1c(Br)cc(Br)cc1CBr 2001107134 XJKQORUMDPOAAF-MRVPVSSYSA-N 430.962 4.910 50 10 IJGE FC(F)C[C@H](CBr)NCc1cc(Br)ccc1Br 2006498250 BVOUYUPHSSDNKG-SECBINFHSA-N 435.932 4.720 50 10 IJGE O=C(NC1(CCBr)CCC1)c1cc(Br)cc(Br)c1 2029626884 YBKKHCZLNSWTSU-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE CC[C@H](Br)CN(CC)C(=O)c1cc(Br)cc(Br)c1 2044551358 SVMJAFSYBFZCAX-JTQLQIEISA-N 441.989 4.847 50 10 IJGE FCC1([C@@H](Br)c2cc(I)cc3c2OCC3)CCC1 2047700322 ICCPIRHSUBCZNA-ZDUSSCGKSA-N 425.079 4.802 50 10 IJGE C[C@H]1COc2ccc([C@H](Br)c3cc(I)sn3)cc21 2056489770 GRBNTOMTNNDPBC-CPFSXVBKSA-N 436.112 4.728 50 10 IJGE CN(C(=O)c1scc(Br)c1Br)[C@@H](CCCl)C(F)F 2058229431 PGTCSBPANKXBCU-LURJTMIESA-N 425.520 4.608 50 10 IJGE O=S(=O)([C@@H]1CC[C@H](CBr)C1)N(Cc1ccccc1)CC1CCCCC1 2059288532 ILARRYIARXMPMH-VQTJNVASSA-N 428.436 4.962 50 10 IJGE C[C@H](Cl)[C@@H](NC(=O)c1cc(Br)c(Br)s1)C(F)(F)F 2074737982 NFCFSBNQZAMSRI-BBIVZNJYSA-N 429.483 4.561 50 10 IJGE O=C(NC12CCC(CBr)(CC1)C2)c1cc(Br)c(Cl)s1 2132807458 DJDYUTKFXBGEIE-UHFFFAOYSA-N 427.589 4.992 50 10 IJGE Cc1ccc(CBr)c(N2CCC[C@@]3(CN(Cc4ccccc4)CCO3)C2)c1 2151738811 KGOIOZBAKLXHND-HSZRJFAPSA-N 429.402 4.761 50 10 IJGE CC[C@@H](Cl)[C@H]1CCCCN1C(=O)c1ccc(I)c(Cl)c1 2170618723 REUWDICRJBZZQC-BXUZGUMPSA-N 426.125 4.957 50 10 IJGE Clc1c(Br)ccc(CBr)c1-n1ccnc1Br 2211312587 NAEXSAPCMWCLQL-UHFFFAOYSA-N 429.337 4.946 50 10 IJGE Oc1nc2ccc([C@H](Br)c3c(F)cccc3I)cc2o1 2282892317 BHULAEBYLTZZQG-ZDUSSCGKSA-N 448.029 4.761 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(Br)c(F)cc2Cl)CC[C@H]1CBr 2285845701 DSNKRDHEGZBFLD-BDAKNGLRSA-N 427.539 4.735 50 10 IJGE C[C@H](CCCl)CCNCc1ccc(I)c(Br)c1 2306219287 KHQZCCAHXFDFDD-SNVBAGLBSA-N 430.555 4.798 50 10 IJGE BrC[C@]12CCCC[C@@H]1CN(Cc1sccc1I)C2 2316760762 XVXCKBPGEICPBH-RISCZKNCSA-N 440.188 4.740 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC=C(C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 2325254932 HWJLABUHHZEJFW-CQSZACIVSA-N 428.876 4.652 50 10 IJGE BrC1CCC([C@H]2CCN(C[C@@H]3CC3(Br)Br)C2)CC1 2327998293 DSVRYJXTLWCHNQ-ZFQMDJOTSA-N 444.049 4.768 50 10 IJGE CCOC(=O)c1sc(N(Cc2ccccc2)C(=O)C(C#N)=Cc2ccccc2)nc1C 2329740442 HBOIUNHLQBSTDL-UHFFFAOYSA-N 431.517 4.769 50 10 IJGE CC(C)(CCl)[C@@H]1CCCN1C(=O)c1ccc(Cl)cc1I 2365596583 WSBXHBDNLKQCIC-ZDUSSCGKSA-N 426.125 4.814 50 10 IJGE C[C@@H]1CCc2c(sc3nc(/C(C#N)=C/c4ccc(Cl)c([N+](=O)[O-])c4)[nH]c(=O)c23)C1 9539491 NHCVKLXKKQOAMP-CEXMDJMXSA-N 426.885 4.735 50 10 IJGE CCCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccc(F)cc3)c(OC)c2)C1=O 38603734 ZPEPWYJAJDUEAC-FYJGNVAPSA-N 448.494 4.806 50 10 IJGE Cc1ccc2[nH]c(-c3ccccn3)c(CCCC(=O)NNC(=O)c3cccc(Cl)c3)c2c1 39852561 DWRRTCVGMOTRQB-UHFFFAOYSA-N 446.938 4.976 50 10 IJGE Cc1c(C(=O)N2CCCc3ccccc32)oc2c1/C(=N/NC(=O)c1ccccc1)CCC2 40804204 OIWQAXLJCJLERB-NHFJDJAPSA-N 427.504 4.651 50 10 IJGE CCCCCN1C(=O)/C(=N\NC(=O)c2ccccc2Cl)c2cc(Br)ccc21 40840324 UKTFBERFQGKSSJ-NKFKGCMQSA-N 448.748 4.773 50 10 IJGE COC(=O)c1cc(OC)c(OC)cc1N/C=C(/C#N)c1nc(-c2ccc(C)cc2)cs1 102415960 TYFQMPGBHAFBQZ-VBKFSLOCSA-N 435.505 4.899 50 10 IJGE Brc1ccc([C@@H](CI)OC[C@@H]2CCCCO2)cc1 161961243 QYFTYLQVKMRDJE-UONOGXRCSA-N 425.104 4.511 50 10 IJGE O=C(N/N=C\c1cccc(Cl)c1)c1cccn(Cc2ccc(Cl)c(Cl)c2)c1=O 169920531 JXUXSJCYQAUMEK-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE CC[C@@H](C)N1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccccc3F)c(OC)c2)C1=O 214269359 MRWNDAGWSXQUNC-SDLDRHLBSA-N 448.494 4.804 50 10 IJGE COc1ccc([C@H](C)NC(=O)/C(C#N)=C\N(Cc2ccccc2)Cc2ccccc2)cc1 217179282 DDJPUBYDBNGBSQ-QFBZFQIZSA-N 425.532 4.982 50 10 IJGE CCOC(=O)c1ccccc1N/C=C(/C#N)C(=O)N[C@@H](CC)c1ccc2c(c1)CCCC2 217188521 GLISEPXPHOWBKK-RVQWUSFHSA-N 431.536 4.829 50 10 IJGE CC[C@H](NC(=O)/C(C#N)=C\Nc1cc(Br)ccn1)c1ccc2c(c1)CCCC2 217193787 WYAQDPMUVQMYKB-BXWQOUMASA-N 439.357 4.810 50 10 IJGE CCCO[C@@H]1[C@@H](Cl)C[C@H]1Oc1cc(Br)c(OC)cc1Br 300470746 JZYBJJGWXSOCJC-ZLKJLUDKSA-N 428.548 4.774 50 10 IJGE FC(F)Oc1cc(CBr)c(Br)cc1I 575682506 UFULBPKQLGXGHX-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@@H]1CCC[C@@]12CC[C@@H](CI)O2 686242770 SZQKDQKGSHMYJB-YIOZNXECSA-N 449.373 4.929 50 10 IJGE O=C(N[C@H]1CCC[C@H](Br)C1)c1cc(Br)c(Br)s1 694586179 IENJNWOIPRWDMN-BQBZGAKWSA-N 446.002 4.709 50 10 IJGE Fc1cccc([C@H](Br)c2ccc3c(c2)COC3)c1I 721685694 WUMMKRLGGFGUMH-CQSZACIVSA-N 433.058 4.945 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=S)Nc2ccc(OC(F)F)c(Cl)c2)cc1 735621489 KZHKZAIMEOGAIV-UHFFFAOYSA-N 427.904 4.870 50 10 IJGE COc1ccccc1-c1ccc([C@H](C)NC(=O)NNC(=O)c2cn(C)c3ccccc23)cc1 743508724 RPURXICCUVDUJS-KRWDZBQOSA-N 442.519 4.559 50 10 IJGE CCc1cccc(CC)c1NC(=O)/C(C#N)=C/c1ccc(C(=O)OC)cc1Br 789126384 GDXIHQUREKLAKN-WOJGMQOQSA-N 441.325 4.906 50 10 IJGE Cc1cccc(C(=O)NNC(=O)Nc2cccc(Oc3cccc(C(F)(F)F)c3)c2)n1 797647522 HMXXMEWJLCVXGQ-UHFFFAOYSA-N 430.386 4.668 50 10 IJGE C#CCC1(O)CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3cccc4ccccc34)c2C)CC1 1175853861 KCDBKZVSQNVUHF-HKOYGPOVSA-N 437.543 4.531 50 10 IJGE C#CCOc1ccccc1CNC(=O)NNc1c(Cl)cc(Br)cc1Cl 1477915915 OEXOVYIDYXHSCH-UHFFFAOYSA-N 443.128 4.594 50 10 IJGE C=CCOc1cc(OC)ccc1C(=O)NNc1ccc(Br)cc1C(F)(F)F 1542884377 KMGFQYRWIJTOBY-UHFFFAOYSA-N 445.235 4.798 50 10 IJGE FC(F)Oc1ccccc1[C@@H]1CN(Cc2ccccc2)C[C@H]1CI 1614623375 CVEIPZQVFJEYQT-NVXWUHKLSA-N 443.275 4.939 50 10 IJGE C[C@@H]1[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 1882087940 NGMLOKVVBLHXRC-OXGONZEZSA-N 447.414 4.699 50 10 IJGE CC[C@H]1CN(CC(C)(C)CI)[C@H](CC)CN1C(=O)OC(C)(C)C 1904651432 PMWOVRGYABTUQR-CABCVRRESA-N 438.394 4.558 50 10 IJGE C[C@H]1CN(Cc2cccc(Br)c2Br)CC[C@@H]1Br 1943881447 QYEYUKDANHDIMY-ONGXEEELSA-N 425.990 4.817 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@@H]1Cc1ccc(Br)cc1Br 2007138521 WLPPINZIOQJACR-UFGOTCBOSA-N 426.974 4.943 50 10 IJGE ClC[C@H]1CCCC[C@@H]1Nc1ncc(I)cc1Br 2015756818 LDUDJUXEPOTEPJ-KCJUWKMLSA-N 429.527 4.658 50 10 IJGE C[C@@H]1CCCN(C(=O)[C@@H](Br)C2CCCC2)[C@H]1CCCNC(=O)OC(C)(C)C 2167031937 HBEKSKWGUBEQQI-NJAFHUGGSA-N 445.442 4.872 50 10 IJGE ClCc1nc2cc(Cl)c(Br)cc2n1Cc1cc(Br)no1 2169015204 JHOFHMGFJLGYMD-UHFFFAOYSA-N 439.922 4.990 50 10 IJGE CC(C)[C@@H](Cl)c1cn(-c2ccc(Br)cc2I)nn1 2223626183 GXMSRTRDPWZNEN-GFCCVEGCSA-N 440.510 4.570 50 10 IJGE COc1ccc([C@@H](Br)C(F)(F)C(F)(F)F)cc1I 2257368562 ILSOYVRPWNROIV-MRVPVSSYSA-N 444.963 4.933 50 10 IJGE CC1(C)CN(C(=O)c2ccc(Cl)c(I)c2)C[C@H]1CCCl 2283661417 GNSHABJWHIHZHH-LLVKDONJSA-N 426.125 4.672 50 10 IJGE C[C@H]1C[C@H](Cl)CN(Cc2ccc(I)c(Br)c2)C1 2306220157 UQYMSSZWACLUAJ-ONGXEEELSA-N 428.539 4.503 50 10 IJGE C[C@H](NCc1ccc(I)c(Br)c1)C(C)(C)CCl 2306222724 XYCDVNPTQGGLDR-VIFPVBQESA-N 430.555 4.797 50 10 IJGE ClC[C@@]1(Cc2ccc(I)c(Br)c2)CC=CCO1 2306230783 BFUDMWGAZNTXON-ZDUSSCGKSA-N 427.507 4.550 50 10 IJGE CCOc1ccc(C=NNC(=O)Cc2cc(Cl)ccc2SC)cc1Br 2318417638 AGOGXMURYRBJMQ-UHFFFAOYSA-N 441.778 4.916 50 10 IJGE Cl[C@@H]1CCN(Cc2ccc(I)c(Br)c2)C2(CC2)C1 2325205571 YZXOLFBQUSNWKW-LLVKDONJSA-N 440.550 4.790 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CC[C@H]2[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]32)C1 2371133521 NZYCJPFZSKPZJN-BDXSIMOUSA-N 441.454 4.765 50 10 IJGE CC(C)(C)[C@](C)(CBr)CN1CCOCC12CCN(Cc1ccccc1)CC2 2380207493 YVTCXKNVJFGDMK-JOCHJYFZSA-N 437.466 4.801 50 10 IJGE COc1cccc(O[C@@H](C)C(=O)N/N=C/c2ccc(OCc3ccccc3C)c(OC)c2)c1 40960834 HDTXGQQVKUSGRN-FQNOVECQSA-N 448.519 4.509 50 10 IJGE O=C(CSc1nc2ccccc2s1)N/N=C\c1ccc(OC(=O)c2ccccc2)cc1 137804269 IGSHOLDAEKBVSP-OYKKKHCWSA-N 447.541 4.758 50 10 IJGE CCC[C@H](C)CO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 233338342 QWSASFXCRXBKPI-YOEHRIQHSA-N 425.351 4.644 50 10 IJGE COc1cc(OC)c(C=NNC(=O)c2ccc(-c3ccccc3)cc2)cc1Br 252462235 QWLXWXWMVFFLCM-UHFFFAOYSA-N 439.309 4.897 50 10 IJGE CCn1c(SCC(=O)NN=Cc2ccc(F)cc2)nnc1-c1ccc(C(C)(C)C)cc1 254623673 GOAQMZOZCJAAFV-UHFFFAOYSA-N 439.560 4.644 50 10 IJGE O=S(=O)(Nc1ccc(Br)cc1Br)c1cccc(CCl)c1 312585218 UIZRGJLTTHYDFS-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE O=C(NC[C@]12CCC[C@@H]1CN(Cc1ccccc1)C2)c1ccc(CBr)cc1 312894528 XHUYYRGMCWQIDS-GGAORHGYSA-N 427.386 4.614 50 10 IJGE O=S(=O)(c1cc(CCl)c(Cl)cc1Cl)N1CC[C@H](OCc2ccccc2)C1 383912176 PQWIKGGYHJWDLY-HNNXBMFYSA-N 434.772 4.712 50 10 IJGE CC[C@H]1[C@H](CBr)CCN1c1ncc(Br)cc1Br 385841489 VXSLLNCODAHWFY-KWQFWETISA-N 426.978 4.606 50 10 IJGE C[C@@H](Br)CC(C)(C)CNS(=O)(=O)c1ccc(Br)cc1Cl 393583540 MOAFBCOKXLBNFL-SECBINFHSA-N 447.620 4.581 50 10 IJGE Cc1ccc(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1NC(=O)OC(C)(C)C 742474657 JHVVRCCMGSKBNL-UHFFFAOYSA-N 425.529 4.714 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)c2ccc(C(F)(F)F)cc2)c1C 791191749 WVVNOKHADKRHBZ-SMLKNPDNSA-N 448.441 4.664 50 10 IJGE N#C/C(=C/c1cc(I)cc([N+](=O)[O-])c1)C(=O)c1cc2ccccc2o1 811626401 HMFNNOVZGDPYLO-ACAGNQJTSA-N 444.184 4.735 50 10 IJGE Cc1cc(C=NNC(=O)Cc2cccc(C(F)(F)F)c2)c(C)n1-c1cccc([N+](=O)[O-])c1 1084137898 HZEQTBSILJPLMG-UHFFFAOYSA-N 444.413 4.714 50 10 IJGE O=C(NN=C1C(=O)N(C/C=C/c2ccccc2)c2ccccc21)c1cc2ccccc2cc1O 1084657480 LQQOPYNRFCPSTG-XZPZTTNGSA-N 447.494 4.740 50 10 IJGE C=CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccc(Cl)cc1Br 1454090961 WLRXXOLSCJJZGX-HNNXBMFYSA-N 446.773 4.795 50 10 IJGE COc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccc(Cl)c(Cl)c1 1865710098 OEGAMXLKXVLOGF-FQEVSTJZSA-N 441.318 4.773 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)Cc1nn(C)c(Cl)c1Br 1914337421 NQSOYOHCNSMSLO-NSHDSACASA-N 435.591 4.622 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)c1ccccc1S(=O)(=O)C(F)F 1915086004 CCHDMGXDXQWBSH-CQSZACIVSA-N 432.330 4.863 50 10 IJGE CCC[C@](C)(CBr)NC(=O)c1csc(Br)c1Br 1945189367 OXZTZLNYCPXIGL-LLVKDONJSA-N 448.018 4.957 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OCc2cccc(F)c2)C1 2024642779 VZTYPVIZMOIGMY-GOSISDBHSA-N 449.304 4.547 50 10 IJGE CC1(C)[C@@H](Br)CCN1C(=O)c1cccc(Br)c1Br 2031484531 CBMVYYCLQVADDM-JTQLQIEISA-N 439.973 4.600 50 10 IJGE O=C(CCl)c1cc(I)c(OC(F)(F)F)cc1C(F)(F)F 2055118476 PHVBNVBDMUCLHY-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1cc(Cl)c(F)cc1F 2058880493 VFLVTXGEJWRHIE-ZDUSSCGKSA-N 432.692 4.671 50 10 IJGE CC[C@@H]1CCOC[C@H]1O[C@@H](CI)c1cccc(Br)c1 2096207825 QNGNAVZQOBDORP-BYCMXARLSA-N 439.131 4.757 50 10 IJGE O=[N+]([O-])c1ccc(CBr)c(Oc2ccc(I)cc2)c1 2120384724 OAMKNAHOFFUNQE-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE CCOc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)CC)cc1CBr 2123246383 LWPLKPCGARNNMM-INIZCTEOSA-N 440.403 4.970 50 10 IJGE Oc1nc2ccc([C@H](Br)Cc3ccccc3I)cc2[nH]1 2143868982 USYFNASXFKOULI-LLVKDONJSA-N 443.082 4.552 50 10 IJGE CC(C)(C)OC(=O)N(CC1CC1)C1CCN(C(=O)[C@H](Br)C2CCCC2)CC1 2167033040 PJIJZGABTWBWKS-GOSISDBHSA-N 443.426 4.578 50 10 IJGE C[C@H](CCCCCCl)NS(=O)(=O)c1cc(Br)ccc1Br 2174524561 UDCOSPOJRLZPDE-SNVBAGLBSA-N 447.620 4.678 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1nc(-c2ccccc2)cs1 2181745446 CCNNWXYEXRVFIT-UHFFFAOYSA-N 425.645 4.806 50 10 IJGE C[C@]1(CCOCc2ccccc2)CCN1S(=O)(=O)c1ccc(CCl)c(Cl)c1 2197754626 QGTBFCOZXJLMTN-HXUWFJFHSA-N 428.381 4.839 50 10 IJGE Cc1c([C@H](Cl)c2c(F)cc(F)c(Br)c2F)c(Br)nn1C 2236109179 MCPACJWJUWEXMW-JTQLQIEISA-N 432.465 4.999 50 10 IJGE O=C(c1scc(Br)c1Cl)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Br)C2 2264500972 IASDRTJLIAUWJS-CVUIIHQFSA-N 431.552 4.643 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CCCOC2(C)C)cc1I 2269551548 ABLLCMYCZVMHMD-FZMZJTMJSA-N 439.131 4.941 50 10 IJGE COc1ccc([C@H](Br)C[C@H]2CC(C)(C)CO2)cc1I 2269557319 UFEMUXNSOJQAAY-NWDGAFQWSA-N 439.131 4.941 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1Cc1ccc(Cl)c(I)c1 2300238293 JDXRLXHALCYFLZ-MWLCHTKSSA-N 428.539 4.692 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1Cc1ccc(Cl)cc1I 2302316569 XADUHQGSFJQNIK-BXKDBHETSA-N 428.539 4.692 50 10 IJGE C[C@@H]1C[C@H](Cl)CCN1Cc1ccc(I)c(Br)c1 2306221633 KNNBADUSWQKFFA-MWLCHTKSSA-N 428.539 4.645 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H](Br)[C@H]2CC3)cc1I 2315548985 MWVNVKOVWUMCCD-MISXGVKJSA-N 440.550 4.835 50 10 IJGE C[C@H]1C[C@@H](Br)[C@H](C)CN1Cc1ccc(Cl)c(I)c1 2315552325 CSDXDQCUWYWFNR-JFGNBEQYSA-N 442.566 4.938 50 10 IJGE Clc1ccc(CN2C[C@H]3[C@@H](Br)CC[C@H]3C2)c(I)c1 2318529451 QJFAYBZCIZGCDR-BIMULSAOSA-N 440.550 4.550 50 10 IJGE CCCCOC(=O)c1ccccc1NC=C(C#N)C(=O)Nc1cc(Cl)ccc1OC 2324454249 UFSTWVPVWLGHNL-UHFFFAOYSA-N 427.888 4.764 50 10 IJGE ClC[C@]12C[C@H]1CC[C@H]2NCc1ccc(I)c(Br)c1 2325209030 KVRNKEGNJZKJAN-LERXQTSPSA-N 440.550 4.551 50 10 IJGE CC(C)(C)[C@H]1CCc2c(sc(NC(=O)C(C#N)=Cc3cccc(F)c3)c2C(N)=O)C1 2329674473 DSWQIWTWUFEHLG-HNNXBMFYSA-N 425.529 4.683 50 10 IJGE C[C@H](CC1CCN(C[C@]2(CBr)CC2(F)F)CC1)N(C)C(=O)OC(C)(C)C 2351892753 TXNRFEVAXKVJFS-RDTXWAMCSA-N 439.385 4.764 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@H]2C[C@]1(CBr)C2 2361923721 SYLNATLNWCVBKJ-XZWHAEGMSA-N 425.523 4.631 50 10 IJGE Cc1nc(C(=O)N(C)CC(C)(C)[C@@H](Br)C(C)C)c(Br)s1 2365908622 PVTUFUXOFCZDSH-NSHDSACASA-N 426.218 4.732 50 10 IJGE Cc1cc(OCC(=O)N/N=C/c2cccc3cccnc23)c(C(C)C)cc1Br 20344577 IBDAFOHZLVWRMN-BRJLIKDPSA-N 440.341 4.958 50 10 IJGE CCOC(=O)/C(C#N)=C\c1c(Oc2ccc(Cl)cc2Cl)nc2c(C)cccn2c1=O 33888993 DZASQUBWQQBHIF-LCYFTJDESA-N 444.274 4.572 50 10 IJGE CCCCCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(C(=O)OCC)cc2)cc1OC 34829502 LLEFENWYPQYMMJ-HKWRFOASSA-N 436.508 4.987 50 10 IJGE Cc1ccc(C)c(OCCCC(C)(C)C(=O)NNC(=O)COc2ccccc2C(C)C)c1 66201380 GKXYBWXVSFRXMI-UHFFFAOYSA-N 440.584 4.838 50 10 IJGE CCOC(=O)/C(C#N)=C\c1cccc(OC(=O)COc2ccccc2-c2ccccc2)c1 206747323 PDUUGRHHKUNENJ-QNGOZBTKSA-N 427.456 4.808 50 10 IJGE CCOc1ccc(N/C=C(/C#N)C(=O)N[C@H](C)c2cc(C)ccc2OCC)cc1OCC 217184897 MMTIHIYSYATMJQ-UGDGIKRESA-N 437.540 4.888 50 10 IJGE COc1cc([N+](=O)[O-])ccc1N/C=C(/C#N)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 217249481 WSHCIOHKEOOAAO-KTKRTIGZSA-N 440.765 4.734 50 10 IJGE C[C@@H]1CCN(C(=O)c2cc(Br)sc2Br)C[C@@H]1Br 235334353 UDWRGNICOHUIJA-SVRRBLITSA-N 446.002 4.519 50 10 IJGE COC1(C[C@@H](Br)c2cc(I)cc3c2OCC3)CCC1 302507185 MLUQVQIFTFCZCS-CYBMUJFWSA-N 437.115 4.621 50 10 IJGE FC(F)Oc1c(CBr)ccc(Br)c1I 575682231 LGIAKABCYOVXGN-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE CC(C)N(C[C@@H](C)Br)C(=O)c1cc(Br)sc1Br 691354671 CTARRWBJQFFEJU-SSDOTTSWSA-N 448.018 4.907 50 10 IJGE O=S(=O)(N[C@@H](CCBr)C1CCCCC1)c1sccc1Br 725075688 AIWGDLGNUZZSDH-LBPRGKRZSA-N 445.242 4.523 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cnc(-c3ccccc3Cl)s2)c1C 736694694 CIDXUWNIUZJYLG-UHFFFAOYSA-N 436.928 4.689 50 10 IJGE O=C(NNc1cccc(F)c1F)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1 743720881 DHDAWEHLGJZNDB-DVECYGJZSA-N 435.474 4.588 50 10 IJGE Cc1ccnc(C2CCN(C(=O)/C(C#N)=C/c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)n1 754541814 SRDGPDAVAYABHM-PXLXIMEGSA-N 443.526 4.645 50 10 IJGE Cc1cc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)ccc1NC(=O)c1cccs1 758108798 WKJFXBYTMWTETQ-UHFFFAOYSA-N 448.331 4.690 50 10 IJGE O=C(Nc1ccccc1S[C@@H](Cl)C(F)(F)F)N1CCN(c2ccc(F)cn2)CC1 775293074 BAUGHMZSLRZHJY-MRXNPFEDSA-N 448.873 4.794 50 10 IJGE CCCCOc1cc(OCCC)ccc1C(=O)NNc1nc(-c2cccnc2)nc(C)c1C 792343407 LLZMNLUBDQROPS-UHFFFAOYSA-N 449.555 4.880 50 10 IJGE COc1ccccc1NC(=O)NN=Cc1cc(C)n(-c2ccc(C(=O)O)c(Cl)c2)c1C 1083943287 DFUDWCCXJHAGQL-UHFFFAOYSA-N 440.887 4.610 50 10 IJGE N#C/C(=C\c1cc(Br)c(N2CCOCC2)o1)c1ccc(Br)cc1 1084319602 OHRPQKYRTWUXFA-UKTHLTGXSA-N 438.119 4.705 50 10 IJGE Cc1ccccc1SCC(=O)NN=Cc1ccccc1OCc1ccc(C(=O)O)cc1 1084468496 WFNZXTIPCBLLNO-UHFFFAOYSA-N 434.517 4.515 50 10 IJGE O=C(CCSCc1nc(O)c2ccccc2n1)NNc1ccccc1Cc1ccccc1 1300355651 ZYQVXIBWQKCCEX-UHFFFAOYSA-N 444.560 4.693 50 10 IJGE C#C[C@H](NC(=O)NNc1cc(Cl)ccc1Br)c1ccc(Cl)cc1F 1565002876 OXGFIKSMEGUUET-AWEZNQCLSA-N 431.092 4.896 50 10 IJGE CC(=O)N(c1ccc(NC(=O)NNc2ccc(Br)cc2C)cc1)[C@H]1C[C@@H]1C 1625067206 YSSOOWUPSLWPPP-DJJJIMSYSA-N 431.334 4.667 50 10 IJGE Cc1cc(Cl)ccc1NNC(=O)CCSCc1nc(O)c2c3c(sc2n1)CCC3 1645075131 VGZDAFCOMUOZAE-UHFFFAOYSA-N 449.001 4.614 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(F)c2)[C@H]1c1ccc(Cl)cc1 1865683124 GMSDVLVGNGYZRU-INIZCTEOSA-N 448.807 4.961 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3)n2)cc1 1872746223 YNDDHFOJCVNVMD-CYVLTUHYSA-N 438.421 4.893 50 10 IJGE CCn1ncc(Br)c1CN(Cc1ccccc1)[C@@H](C)CCBr 1915091818 CDTJVGGPXYCIHM-AWEZNQCLSA-N 429.200 4.841 50 10 IJGE O=C(c1cnccc1C(F)(F)F)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915272283 NOSZHAZBFWBMDS-QGZVFWFLSA-N 427.264 4.916 50 10 IJGE C=CC[C@H](CBr)CNC(=O)c1csc(Br)c1Br 2023511710 OCZYBUXYINYLDZ-SSDOTTSWSA-N 446.002 4.590 50 10 IJGE Cc1nc(Cl)ccc1-n1nc(CBr)c(Br)c1C(F)(F)F 2078914810 XQDCZNOHJNXKTJ-UHFFFAOYSA-N 433.453 4.905 50 10 IJGE O=C(c1cc(Br)sc1Br)N1[C@H](CCl)C[C@@H]2CCC[C@H]21 2108400764 ZMAOCJZCAUCFQH-OYNCUSHFSA-N 427.589 4.895 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2C[C@H]1CCN(Cc2ccccc2)C1 2128516536 AEINDAJXAWNZIU-INIZCTEOSA-N 433.781 4.763 50 10 IJGE CCCN(C1CCN(Cc2ccccc2)CC1)S(=O)(=O)c1ccc(CCl)s1 2143615379 RYGOBLBPVLXFSM-UHFFFAOYSA-N 427.035 4.552 50 10 IJGE CCCCN([C@@H](C)CC)S(=O)(=O)c1cc(CBr)oc1Br 2179774455 FSJCTTJAPZUYSN-JTQLQIEISA-N 431.190 4.526 50 10 IJGE C[C@H](Br)CCc1cn(Cc2ccc(Cl)c(Br)c2F)nn1 2189278723 QENGXQCUBGDGFI-QMMMGPOBSA-N 425.527 4.597 50 10 IJGE CCC(C)(C)[C@H](C)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2193155367 HHWKBGIINSMERK-VIFPVBQESA-N 447.258 4.851 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)C1C[C@@H]2CCC[C@H](C1)C2(F)F 2233648958 IYORMYVGIDFYTQ-IPQPSQTFSA-N 444.360 4.887 50 10 IJGE COc1ccc([C@@H](Br)[C@]2(C)CCCOC2)cc1I 2257365980 WXPXCAILQQVOGB-ZIAGYGMSSA-N 425.104 4.553 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1C[C@@H]2CN(C(=O)OC(C)(C)C)C[C@]2(C)C1 2297085856 PMEYSZZCTATQBV-DSEONOSFSA-N 447.414 4.558 50 10 IJGE N#CC(=Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1nc2cc(Br)cnc2[nH]1 2297368182 OYEUHPVQEJYJAN-UHFFFAOYSA-N 436.225 4.953 50 10 IJGE C[C@@H](Br)CN(Cc1ccc(Cl)cc1I)C1CC1 2302325106 DIHXRUADFRCEPK-SECBINFHSA-N 428.539 4.692 50 10 IJGE Clc1ccc(I)c(CN2[C@H]3CC[C@H](C3)[C@H]2CBr)c1 2310106767 XNHHFPULAGYWGZ-LJWDBELGSA-N 440.550 4.692 50 10 IJGE CCCNC(=O)C(C#N)=Cc1ccc(OC(=O)C=Cc2ccccc2OCCC)c(OC)c1 2314774572 QPQSETPZWGSAEL-UHFFFAOYSA-N 448.519 4.536 50 10 IJGE CCC[C@](C)(CBr)NC(=O)c1ccc(Cl)cc1I 2317772709 GMVNNVZSCCMWRE-CYBMUJFWSA-N 444.538 4.628 50 10 IJGE CC(C)[C@@H]1C[C@H](Br)CN1Cc1ccc(I)c(Cl)c1 2321367406 DMBRTMZCTWZEEY-FZMZJTMJSA-N 442.566 4.938 50 10 IJGE CCOc1cc(C=NNC(=O)Cc2ccc(O)cc2)ccc1OCc1cccc(Cl)c1 2323341453 ZZECLTGKALOEAR-UHFFFAOYSA-N 438.911 4.716 50 10 IJGE N#CC(=C(O)C=Cc1ccc2c(c1)OCCO2)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 2331281059 CDLZOSUBTZXVSJ-UHFFFAOYSA-N 433.445 4.996 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@]12CCC[C@@H](CN(C[C@@]3(CBr)CC3(F)F)C1)C2 2351885272 HSWMQASPWRITLO-FHLIZLRMSA-N 437.369 4.518 50 10 IJGE CC[C@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)COc1ccc2ccccc2c1 10682921 VTTATCKEERUFMV-JPYJTQIMSA-N 434.536 4.737 50 10 IJGE CCOc1ccccc1NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc([N+](=O)[O-])c2)c1C 24226358 KVTZETCYMQTDHG-CPNJWEJPSA-N 430.464 4.947 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3[N+](=O)[O-])ccc2[C@@H]1c1ccc(Cl)cc1 38651346 CJNPTYQYSRMNAO-NRFANRHFSA-N 447.834 4.686 50 10 IJGE Cc1c(C(=O)Nc2ccc(F)cc2F)oc2c1/C(=N/NC(=O)c1ccccc1F)CCC2 40812507 XNSDXCWKRGZJCV-MTDXEUNCSA-N 441.409 4.728 50 10 IJGE Cc1c(C(=O)NC2CCCCC2)oc2c1/C(=N/NC(=O)c1ccccc1Cl)CCC2 40812645 IKMXKBNGOBGRFA-NLRVBDNBSA-N 427.932 4.774 50 10 IJGE O=C(CCCSc1nc2ccc([N+](=O)[O-])cc2s1)N/N=C/c1c[nH]c2ccccc12 58988854 ZLWXJCLOZHDERO-WSDLNYQXSA-N 439.522 4.708 50 10 IJGE CCOc1cccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc([N+](=O)[O-])cc3)c2C)c1 97578146 MPJUGKPXKBTFDV-CPNJWEJPSA-N 430.464 4.947 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2cn(CCC#N)c3ccccc23)sc(C)c1C 102957793 ZIJJAXWLIVWHGJ-ATVHPVEESA-N 446.532 4.956 50 10 IJGE O=c1c(Br)cc(Br)cn1C[C@@H](CBr)c1ccccc1 128484083 LRGAEKRJUFBRDR-LLVKDONJSA-N 449.968 4.552 50 10 IJGE Cc1cc2c(c(C)c1Cl)C(=O)CC1(CCN(C(=O)/C(C#N)=C/c3ccccc3)CC1)O2 170523159 LOFOWVGPEKUJKI-CPNJWEJPSA-N 434.923 4.890 50 10 IJGE CC(C)c1ccccc1OCC(=O)Oc1ccc(/C=C(/C#N)C(=O)NCc2ccco2)cc1 206738057 UPNDKTFRRQDUEK-ZHZULCJRSA-N 444.487 4.611 50 10 IJGE N#C/C(=C/N1CCN(c2ccc(F)cc2)CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1 217210396 QMXQSSJZVDFEMI-VXPUYCOJSA-N 442.494 4.786 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N(CCCl)CC(F)(F)F 231565083 JYWVQTSTCKICCV-UHFFFAOYSA-N 429.483 4.516 50 10 IJGE C[C@@H](Br)C(=O)c1cccc(I)c1SC(F)(F)F 514251036 COCODFBIPPGJCJ-RXMQYKEDSA-N 439.034 4.869 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)Nc2ccc3c(c2)C(=O)CCC3)c(-c2ccccc2)n1 750086394 COVPDHFRNNNONE-ZHZULCJRSA-N 435.487 4.528 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2nnc(C(C)(C)C)s2)c(C)n1-c1ccc(F)cc1 758626648 BDPGBFFZOFWVMO-BOPFTXTBSA-N 437.544 4.606 50 10 IJGE Cc1cc(Br)cc(C)c1NC(=O)CCCOC(=O)/C(C#N)=C/c1ccccc1 785350889 KACPYVSLEOUEBZ-QGOAFFKASA-N 441.325 4.935 50 10 IJGE Cc1ccccc1CC(=O)NNC(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1 797667247 BPLUYGIPOJVBMR-UHFFFAOYSA-N 434.443 4.533 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)N(C)C)c(Br)cc1OCc1ccccc1Cl 1083972467 ITWXQMXHYJHASM-OVCLIPMQSA-N 449.732 4.685 50 10 IJGE C#CCOc1c(Br)cc(C=NNC(=O)c2cc3ccccc3o2)cc1CC=C 1084371251 UYOJHLMKDITLKK-UHFFFAOYSA-N 437.293 4.700 50 10 IJGE O=C(Cc1cccc2ccccc12)NN=Cc1cc(Br)c2cccnc2c1O 1084375816 BGBFMYAJIUMMNM-UHFFFAOYSA-N 434.293 4.549 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNc1nc(-c2ccccn2)nc2c1CCC2 1654315672 AWQROEJDMGOGFA-OUKQBFOZSA-N 440.334 4.881 50 10 IJGE CCc1nn(Cc2ccccc2Cl)c2c1[C@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865700314 PPRYIAFLQKXECF-NRFANRHFSA-N 429.911 4.847 50 10 IJGE CCCc1nn(-c2ccc(Cl)cc2)c2c1[C@@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865705620 AETBVHBYAXRUAQ-IBGZPJMESA-N 435.871 4.605 50 10 IJGE O=C(Oc1cccc2c1C(=O)OC2=O)c1ccc(COc2ccc3c(c2)CCCC3)cc1 1865790692 VKMZTCBJSFDEBH-UHFFFAOYSA-N 428.440 4.674 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CNC(=O)/C(C#N)=C/c1ccccc1)c1cccc(Cl)c1 1868026108 KHGOINZXNYQTPW-VOMPUTFMSA-N 425.916 4.629 50 10 IJGE Clc1ccc(I)c(CN2C[C@H](C3CC3)[C@@H](Br)C2)c1 2030226632 LUZHZLVCTIKPHD-OLZOCXBDSA-N 440.550 4.550 50 10 IJGE C[C@](CCl)(NC(=O)c1cc(Br)sc1Br)C(F)(F)F 2043177088 QWMBXOBIRBWPRI-MRVPVSSYSA-N 429.483 4.563 50 10 IJGE Brc1ccc(Br)c(CN2CC[C@H](Br)[C@H]3CC[C@@H]32)c1 2070006759 HCWAMOSDOWKNGD-XBFCOCLRSA-N 438.001 4.959 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1cc(Cl)cc(Br)c1 2081235041 AJIJJVVBLBTFPH-UFBFGSQYSA-N 444.538 4.682 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)c1cccc(NC(=O)N2CCC(Br)CC2)c1 2106201275 VCZGBCDFZCZGDY-CYBMUJFWSA-N 426.355 4.664 50 10 IJGE CCC(CC)(CBr)CN1C[C@H]2CC[C@H]1[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]21 2106788017 MFZNLYYGKOTNNM-OWSLCNJRSA-N 429.443 4.765 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1CN(CC1CC1)C[C@@H](CBr)CC1CC1 2112868849 NPYAOGLSSHXTPY-MOPGFXCFSA-N 429.443 4.909 50 10 IJGE FC1(F)C[C@]12C[C@@H]2[C@@H](Br)c1cc(I)cc2c1OCC2 2115294690 MPFJZIOYQPZMNO-MDZLAQPJSA-N 441.053 4.707 50 10 IJGE C[C@@]1(CC(CBr)(CBr)c2ccc(Cl)cc2)COCCO1 2174172920 ZLOWVEAABXRNHK-CQSZACIVSA-N 426.576 4.563 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)Cc1ccc(Br)cc1Cl 2237448408 LBTSENUHEHFISH-NSHDSACASA-N 443.632 4.668 50 10 IJGE Cc1cc(Br)c(C(=O)NC[C@]2(CBr)C[C@H]2C(F)(F)F)s1 2237621436 HMKSZNOOWWOHOK-LDYMZIIASA-N 435.103 4.512 50 10 IJGE COc1ccc([C@H](Br)C2(OC)CC(CF)C2)cc1I 2269555586 XPQCYTHHTDHUTI-IMXVTNBVSA-N 443.094 4.501 50 10 IJGE CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(CC3(CBr)CC(F)C3)C2)CC1 2280359146 JYWJMQUOBGRULM-MPQSDHOMSA-N 447.433 4.859 50 10 IJGE COc1ccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3ccc(C)c([N+](=O)[O-])c3)c2C)cc1 2294193360 IKCSEFWEFZBCNR-UHFFFAOYSA-N 430.464 4.865 50 10 IJGE CCOC(=O)c1ccccc1NC=C(C#N)c1nc(-c2ccc(OC)c(OC)c2)cs1 2296790181 UWWZZOIIHIKQAU-UHFFFAOYSA-N 435.505 4.981 50 10 IJGE C[C@H](Br)CN(Cc1sccc1I)C1CCCC1 2303327310 KDEMJPOHYSTGCK-JTQLQIEISA-N 428.177 4.881 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(C)C[C@H]2CC[C@H]1C[C@@]21CCC[C@@H](CI)O1 2307493731 XVMSBJAXCXCSOF-XMMKGJGBSA-N 449.373 4.833 50 10 IJGE COCCCN1C(=O)C(=Cc2ccc(-c3ccc(Cl)cc3Cl)o2)C(C)=C(C#N)C1=O 2314618700 RZZBIDUQVBJDBM-UHFFFAOYSA-N 445.302 4.882 50 10 IJGE CC[C@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@@H]1CBr 2315548978 MWGFVAHWOHDOAU-RYUDHWBXSA-N 442.566 4.798 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2ccc(Nc3nc(O)c4ccccc4n3)cc2)cc1 2323766038 CZDKYORWHIOUAP-UHFFFAOYSA-N 441.491 4.632 50 10 IJGE C[C@H](NCc1ccc(I)c(Br)c1)[C@@H]1CCC[C@H]1Cl 2325203711 ICZWEOLJISFWKB-XHVZSJERSA-N 442.566 4.939 50 10 IJGE Cl[C@H]1CCC[C@H](CNCc2ccc(I)c(Br)c2)C1 2325224066 SVJWECGUWTZUKK-JQWIXIFHSA-N 442.566 4.941 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3CC[C@H]2[C@@H](Br)C3)c1 2325470281 UUCFPGSWDBAIOX-HERUPUMHSA-N 438.001 4.959 50 10 IJGE COc1cc(Cl)c([C@H](Br)c2c(Br)ncn2C)cc1Cl 2337272027 DBUSVNYQGSBYGY-JTQLQIEISA-N 428.939 4.982 50 10 IJGE Brc1ccccc1[C@H](CI)OC[C@@H]1O[C@H]2CC[C@H]1C2 2352572132 FHJBFOQEMCNFQI-GVARAGBVSA-N 437.115 4.509 50 10 IJGE CCOc1cccc(N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1CBr 2367565084 IWXUEVJRWPNPPZ-UXHICEINSA-N 429.402 4.939 50 10 IJGE COc1ccc(C(=O)N/N=C/c2ccc(OCc3ccccc3)cc2)cc1Br 12579598 UUPKOYRQVGIRTA-ZVHZXABRSA-N 439.309 4.801 50 10 IJGE Cc1cc(Br)c(NC(=O)[C@@H](Br)C(C)C)c(Br)c1 20487715 APXMFZJILHDFBO-JTQLQIEISA-N 427.962 4.878 50 10 IJGE Cc1c(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccco2)oc2ccc(F)cc12 38688516 KDXJXMLDEAUYGG-NRFANRHFSA-N 430.391 4.911 50 10 IJGE CCc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(O)cc2)CCC3)cc1 40812034 JAXYXKSIHOTUMB-NHFJDJAPSA-N 431.492 4.579 50 10 IJGE Fc1cc2c(cc1I)nc(CCCl)n2C[C@H]1CCCCS1 156555619 FCULFFIXBJZBGT-SNVBAGLBSA-N 438.737 4.847 50 10 IJGE COc1cc(/C=N\NC(=O)Cc2ccc(Cl)cc2)cc(Br)c1OC(C)C 169902051 YKQXFRJFRGOLGF-JJFYIABZSA-N 439.737 4.591 50 10 IJGE Cc1[nH]c2ccccc2c1/C=N/NC(=O)c1cc(-c2ccccc2)nc(N2CCCCC2)n1 169927477 RZKMOASMSQSTJQ-WPWMEQJKSA-N 438.535 4.688 50 10 IJGE CCOc1ccc(/C=C(/C#N)C(=O)Nc2nc(-c3ccccc3OC)cs2)cc1OC 207131511 XCLPMHGFIGSROD-WJDWOHSUSA-N 435.505 4.772 50 10 IJGE C[C@H](CBr)CCCNC(=O)c1cc(Br)cc(Br)c1 228283208 QSCJRGRXBJMTTE-VIFPVBQESA-N 441.989 4.753 50 10 IJGE CCCCCCCCCC(=O)NCC(=O)NN=Cc1cccc(OCc2ccccc2)c1 254525093 SYPHBKPACAWLHL-UHFFFAOYSA-N 437.584 4.973 50 10 IJGE Cc1ccc(-n2c(SCC(=O)NN=Cc3cccc(F)c3)nnc2-c2ccccc2)cc1 254769394 MCCWRRGXXDZJFF-UHFFFAOYSA-N 445.523 4.624 50 10 IJGE Cc1cc(C=NNC(=O)C(O)(c2ccccc2)c2ccccc2)c(C)n1C1CCCCC1 254845205 JTWLTKLFGQSOTK-UHFFFAOYSA-N 429.564 4.996 50 10 IJGE BrCc1cc(Br)cc(Br)c1OC[C@H]1CCOC1 310324317 YJZFROAXXCCKNU-QMMMGPOBSA-N 428.946 4.522 50 10 IJGE COC[C@H](O[C@@H](CI)c1ccccc1Br)C(C)C 404098850 CETVZCLLSJIIMQ-KBPBESRZSA-N 427.120 4.613 50 10 IJGE O=C(CBr)c1ccc(Br)c(OC(F)(F)F)c1OC(F)F 575681248 UQVRRZWDKGHIMS-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE C[C@H](Br)[C@@H]1CCCN(Cc2cc(Cl)ccc2I)C1 689037948 PMSMULUVYXYBFY-WDEREUQCSA-N 442.566 4.940 50 10 IJGE O=C(N[C@@H]1CCC[C@@H](Br)C1)c1cc(Br)c(Br)s1 694586181 IENJNWOIPRWDMN-RNFRBKRXSA-N 446.002 4.709 50 10 IJGE C[C@H](CCl)[C@H]1CCCCN1C(=O)c1ccc(I)c(Cl)c1 696714635 POUUULKOJJGAHW-QMTHXVAHSA-N 426.125 4.814 50 10 IJGE BrCc1c(N2CC[C@@H]3CC[C@H](C2)N3Cc2ccccc2)nc2sccn12 717413436 SVHNKZMVCWSGEK-DLBZAZTESA-N 431.403 4.534 50 10 IJGE CC(=O)N(c1nc(C=NNC(=O)CCC2CCCCC2)cs1)c1ccc(F)cc1F 727260053 KJOHMAOGPQBAMJ-UHFFFAOYSA-N 434.512 4.917 50 10 IJGE COc1ccccc1OCc1ccc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)o1 799752891 HPAIZUFXTHNQKM-UHFFFAOYSA-N 431.370 4.515 50 10 IJGE CCOC(=O)O[C@]1(C(=O)OCCl)CC[C@@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4(C)C3=CC[C@@]21C 1082546914 FVOOBFFVLCZGIJ-JIMAVHPASA-N 448.943 4.866 50 10 IJGE Cc1ccc(S(=O)(=O)Oc2ccc(C=NNC(=O)c3cccc4ccccc34)cc2)cc1 1084229089 DOVLFJQUOYIMPF-UHFFFAOYSA-N 444.512 4.680 50 10 IJGE N#CC1=C(N)N(c2c(Cl)cc(Cl)cc2Cl)NC1(C(F)(F)F)C(F)(F)F 1088722806 JPTLUHYYSQBZIL-UHFFFAOYSA-N 425.547 4.529 50 10 IJGE C/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12 1264241236 RONVZPCNPGYUOI-ICFOKQHNSA-N 425.463 4.905 50 10 IJGE Cc1cc(/C=C(/C#N)c2nnc(-c3cn(C)c4ccccc34)o2)c(C)n1C[C@@H]1CCCO1 1341502958 CUYIUQKCMVZABO-CBXNMNPBSA-N 427.508 4.890 50 10 IJGE Cc1cc(Cl)ccc1NNC(=O)CCc1nc(O)c2c3c(sc2n1)C[C@@H](C)CC3 1644396497 DGVUGPPZTYWMJY-NSHDSACASA-N 430.961 4.559 50 10 IJGE CCc1nn(-c2ccc(C)cc2)c2c1[C@H](c1cccc(Br)c1)C(C#N)=C(N)O2 1865683817 ITLUQDJXQTYRHM-LJQANCHMSA-N 435.325 4.724 50 10 IJGE COc1ccc2ccccc2c1[C@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2CC(C)C 1865688416 RLAARZVVFKVKLF-GOSISDBHSA-N 442.441 4.938 50 10 IJGE Cn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(OCc2ccccc2)cc1 1865690231 MBMWINAXBCHVLM-QHCPKHFHSA-N 434.499 4.884 50 10 IJGE CCCc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1cccs1)C(C#N)=C(N)O2 1865697849 CXSHJIHLXXOZDD-SFHVURJKSA-N 428.920 4.956 50 10 IJGE Cc1ccc(C)c(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)c1 1865708070 NICUYNHKUKGLOJ-GOSISDBHSA-N 442.416 4.924 50 10 IJGE COc1ccc(C/C(O)=C(\C#N)c2nc(-c3ccc4c(c3)OCCO4)cs2)cc1OC 1872750768 KUDCUCOONSKGKF-VLGSPTGOSA-N 436.489 4.634 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)O[C@@H]1CCCC(F)(F)CC1 1995216103 BSCOYCVJOSUQRL-IUODEOHRSA-N 447.304 4.689 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@H](CI)O2)C[C@@H]1C1CCC1 2018371871 PGNLCWWHODEIAI-FRQCXROJSA-N 449.373 4.929 50 10 IJGE C[C@H](CCBr)CCN1CC[C@H](C(F)(F)F)[C@@H](NC(=O)OC(C)(C)C)C1 2044695753 GNTDZIBCFACSTL-RDBSUJKOSA-N 431.337 4.575 50 10 IJGE CC(C)(C)OC(=O)N(CC(F)F)[C@@H]1CCCN(CC2(CBr)CCC2)C1 2044698691 DRDRZXARTQMIDT-CQSZACIVSA-N 425.358 4.518 50 10 IJGE CC(C)(C)CN(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(CBr)c1 2059268243 WQVQQLYQGAFSRV-UHFFFAOYSA-N 428.367 4.958 50 10 IJGE COc1ccc(Cn2nc(CBr)c(Br)c2C(F)(F)F)cc1C 2079231743 DKEDSRJPPGRAJS-UHFFFAOYSA-N 442.073 4.925 50 10 IJGE ClCc1cc(Br)cnc1N1CC[C@H]2CCN(Cc3ccccc3)C[C@H]2C1 2092525356 YSLGWLBBOLKBOL-MJGOQNOKSA-N 434.809 4.931 50 10 IJGE CCn1ncc(Br)c1[C@@H](Cl)c1sc(COC)cc1Br 2094274029 HZPIJABSQYVBQC-SNVBAGLBSA-N 428.577 4.964 50 10 IJGE CC(C)(C)OC(=O)N(CC1CC1)C1CCN(C[C@H](CBr)CC2CC2)CC1 2112868535 KPKILGIUTFIRBD-SFHVURJKSA-N 429.443 4.909 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2C[C@]1(Br)CC1(F)F 2232913563 FTZRUYNUCIQFNT-LLVKDONJSA-N 432.465 4.849 50 10 IJGE Cc1nc(-c2ccc(I)cc2)nc(C)c1C[C@@H](C)CBr 2237092204 FXOWCMPCAYYGJJ-SNVBAGLBSA-N 445.142 4.939 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@@H]2CCCC23CCC3)C1 2250323840 XKZSFBCMWVIVCM-BEFAXECRSA-N 449.373 4.931 50 10 IJGE O=C(NCC1(CCl)CC(F)(F)C1)c1scc(Br)c1Br 2266913910 OUDJMXLEPNLBFZ-UHFFFAOYSA-N 437.531 4.657 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)C2CC(S(C)(=O)=O)C2)cc1Br 2269788246 IUDQTVPFJZJSHF-RPTIHFLNSA-N 430.589 4.623 50 10 IJGE CC[C@H]1CN(Cc2ccc(I)c(Br)c2)C[C@@H]1Cl 2306219932 RLFQXMYCFOUYCD-JQWIXIFHSA-N 428.539 4.503 50 10 IJGE N#CC(=CNCc1ccc(Br)cc1)C(=O)Nc1ccc(Cl)cc1Cl 2324494553 AMFVSDDEZOLBLR-UHFFFAOYSA-N 425.113 4.892 50 10 IJGE FC1(F)C[C@@]1(CBr)Cn1ccc2cc(I)ccc21 2326886482 HVIKUXPONULHDK-GFCCVEGCSA-N 426.042 4.666 50 10 IJGE COc1cc(C(O)=C(C#N)c2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc(OC)c1OC 2331232200 CODQQENJYDFWMW-UHFFFAOYSA-N 439.449 4.694 50 10 IJGE CCOc1cccc(-c2nn(-c3ccccc3)cc2/C=C(/C#N)C(=O)NCc2ccco2)c1 33561143 UAYIKRWXNMTGMT-ZHZULCJRSA-N 438.487 4.754 50 10 IJGE COc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccccc1Cl 38650961 TUCHLZZQJWEMNO-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE CCN(Cc1ccccc1)c1ccc(/C=N\NC(=O)Cc2ccc3nc(N)sc3c2)cc1 169917022 ISYDJLJXOUIFQB-YUMHPJSZSA-N 443.576 4.598 50 10 IJGE Cc1cc(C)c(NC(=O)/C(C#N)=C\Nc2ccc(I)cc2C)c(C)c1 217222171 YAVSPRGNYNLGQY-WJDWOHSUSA-N 445.304 4.983 50 10 IJGE O=C(NN=Cc1ccc(-c2ccccc2)o1)C(=O)Nc1ccc(Oc2ccccc2)cc1 254671016 ZLJWHWCHEAOMNH-UHFFFAOYSA-N 425.444 4.828 50 10 IJGE Cc1ccc(Cn2c(SCC(=O)NN=Cc3ccccc3F)nc3ccccc32)cc1 254908186 PMOCQGDLFGMMMN-UHFFFAOYSA-N 432.524 4.775 50 10 IJGE CC[C@H](CBr)N(C)C(=O)c1cc(Br)c(Br)s1 379045642 FZTSJIKTCJQPOZ-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CC[C@H](C)C1)C(=O)OC(C)(C)C 721535860 NPTTWALUUPWSIT-VBQJREDUSA-N 425.351 4.642 50 10 IJGE O=C(NNC(=O)c1occc1-c1ccccc1)c1ccccc1OCc1ccc(F)cc1 732968705 XACNUTFEDMYPCC-UHFFFAOYSA-N 430.435 4.740 50 10 IJGE Cc1ccc(-n2c(C)cc(C=NNC(=O)C(=O)Nc3ccc(Cl)cc3C)c2C)cc1C 1084169195 ARLCNYGAWUZLNM-UHFFFAOYSA-N 436.943 4.762 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)[C@H](C#N)c2ccc3ccccc3n2)c(-c2ccccc2)n1 1341867304 DGPMMSYCYKGXCY-JDCXBEBJSA-N 442.482 4.795 50 10 IJGE CC(=O)c1nc(NC(=O)NNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)sc1C 1466606091 CMQUVCAABGMTTD-UHFFFAOYSA-N 426.342 4.840 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNC(=O)c1ccc(Br)s1 1540418094 LMSCDKNNVNTJHY-BQYQJAHWSA-N 434.142 4.682 50 10 IJGE Cc1cc(C(=O)NNc2nc3ccccc3[nH]c2=S)ccc1NC(=O)OC(C)(C)C 1557583832 AVAXJMCAZOIHBV-UHFFFAOYSA-N 425.514 4.705 50 10 IJGE CC(=O)c1ccc(CNC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(Cl)cc3)c2C)nc1C 1636439468 NEFUYUNJTYSLMI-NDENLUEZSA-N 446.938 4.877 50 10 IJGE COc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)Nc3cccc(C)c3C)c(C)c21 1772745609 CNXMPTSZRHQNDJ-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccc(C)cc2)c1 1865694665 YURHBZBHEWYVHJ-QHCPKHFHSA-N 428.536 4.809 50 10 IJGE N#CSc1ccc(NC(=O)CNC(=O)[C@@H](c2ccc(Cl)cc2)C2CCCC2)cc1 1868158536 ZYVKLYOOEBAJDU-OAQYLSRUSA-N 427.957 4.942 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1ccccc1C(F)(F)F 1914341677 NGDSTUPRAPFNSL-ZDUSSCGKSA-N 436.293 4.680 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1cncc(Br)c1 1915110561 OKHRUEGZNDPPJT-CYBMUJFWSA-N 426.152 4.660 50 10 IJGE Cc1nn(C)c([C@H](Br)c2sccc2Br)c1Br 1989610629 WCRXVUDFBUDPCK-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE C[C@H]1C[C@@H](Br)[C@H](C)CN1Cc1cc(Cl)ccc1I 2032205023 VZCRQCQLVGHMSV-GBIKHYSHSA-N 442.566 4.938 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)C(C)(C)C)[C@H](CC(F)F)C1 2063525292 TXOJGSMPEQCZOH-UONOGXRCSA-N 427.374 4.620 50 10 IJGE Cc1cc(Cn2nc(CCl)c(I)c2C(F)(F)F)cc(C)c1O 2079211318 OVPDADGJORSSNU-UHFFFAOYSA-N 444.622 4.616 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@H](Cl)C(F)(F)CC1 2093942058 JMFXNXBRWROCDS-ZETCQYMHSA-N 437.531 4.752 50 10 IJGE CCCN(C[C@@H](CBr)c1ccccc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2106788992 VIGYTBNNHSMCOS-RTBURBONSA-N 425.411 4.887 50 10 IJGE Clc1cccc(CBr)c1N1CC[C@H]2OCCN(Cc3ccccc3)[C@H]2C1 2129050437 DGVJHUSIRJJOJQ-VQTJNVASSA-N 435.793 4.715 50 10 IJGE O=C(N[C@H]1C[C@H]2CC[C@H]1[C@@H](Br)C2)c1cc(Br)c(Cl)s1 2139707341 RTHYQZQPDOGATD-GHCJXIJMSA-N 427.589 4.846 50 10 IJGE CC[C@]12CO[C@]([C@@H](Br)c3cc(I)cc4c3OCC4)(C1)C2 2205190327 GDBVVRLMARAQTR-HRCADAONSA-N 449.126 4.621 50 10 IJGE FC(F)(F)c1cnc(N2CCSC[C@H]2CCBr)c(Br)c1 2240938937 NHOXFYYZYSEKGG-SECBINFHSA-N 434.119 4.570 50 10 IJGE C[C@H](Br)CN(c1ncc(Br)cc1Br)C(C)(C)C 2250593042 UTUFQEYOWDRVKC-QMMMGPOBSA-N 428.994 4.995 50 10 IJGE COc1ccc([C@@H](Br)CC[C@@H]2CCOC2)cc1I 2257367815 ODVPGGDUDBWSAM-PWSUYJOCSA-N 425.104 4.553 50 10 IJGE O=C(c1cccc(Cl)c1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Br)C2 2283142359 JDDXYLMQHYZERX-ZVJCDOFWSA-N 425.523 4.581 50 10 IJGE O=C(NCC1CCC(CCl)CC1)c1ccc(Cl)c(I)c1 2283657529 CBJNPDOFOWSYGR-UHFFFAOYSA-N 426.125 4.720 50 10 IJGE N#CC(=CNc1ccc2c(c1)OCCO2)c1nc(-c2cc3ccccc3oc2=O)cs1 2295945922 WVGAKMZIBVJTIA-UHFFFAOYSA-N 429.457 4.664 50 10 IJGE N#CC(=Cc1ccc(-c2ccc(Cl)cc2Cl)o1)C(=O)NNC(=O)Cc1ccccc1 2296706012 LMXPHXBRGQLWOO-UHFFFAOYSA-N 440.286 4.550 50 10 IJGE CCN(C)C[C@@H](Br)CCc1ccc(Cl)c(I)c1 2300236066 GIPQKEWTLPOMLK-NSHDSACASA-N 430.555 4.592 50 10 IJGE Cc1cccn2c(=O)c(C=C(C#N)c3nc4ccccc4[nH]3)c(Oc3ccccc3F)nc12 2314436784 DCFYUJAYSGMJPO-UHFFFAOYSA-N 437.434 4.875 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN(Cc2ccc(Cl)cc2I)C1 2318540164 QKHGSNJYESXTBR-MNOVXSKESA-N 442.566 4.798 50 10 IJGE Cc1nc(-c2ccc(F)cc2)ccc1C(=O)NN=Cc1ccc(Br)cc1F 2321248240 ATFXWVUSPOQTKW-UHFFFAOYSA-N 430.252 4.862 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)c3ccc(N(C)C)c([N+](=O)[O-])c3)n2)cc1F 2331337625 NQHIJTNUFUTEKG-UHFFFAOYSA-N 440.456 4.882 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCN(CC2CC(Br)C2)[C@H](C(F)(F)F)C1 2337544377 BGHUALQPXGHHBK-PPWQZUPISA-N 443.348 4.718 50 10 IJGE COc1cc(CBr)cc(Oc2cccc(C)c2I)n1 2339287008 WDTSFFIUPXNALH-UHFFFAOYSA-N 434.071 4.690 50 10 IJGE O=C(c1ccc(Cl)cc1I)N1CCC[C@H](CCCCl)C1 2365593091 RWRDBIIDGHIUSC-NSHDSACASA-N 426.125 4.816 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccc(OC(F)(F)F)cc1 2369430692 HGFUFAQZESMFMI-INIZCTEOSA-N 446.263 4.685 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)CCC12CCOCC2 2382175007 XVFLMFDWCXRXHA-MSOLQXFVSA-N 447.458 4.582 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1Cl)c1cccc(OCCc2ccccc2)c1 10330981 ZPWWZVLEEOTMRX-UHFFFAOYSA-N 429.303 4.690 50 10 IJGE C=CCn1c2c(s/c1=N\NC(=O)c1cccc(Br)c1)CCc1ccccc1-2 26507984 VBMGIKJYFCCWER-FLFQWRMESA-N 440.366 4.509 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C\c1c[nH]nc1-c1ccc(Br)cc1)c1ccc(F)cc1 96993739 CZRAEMMJAVSIDG-YDRQLGOLSA-N 439.288 4.763 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1ccc(Br)c(C(F)(F)F)c1 124691648 XCFZBFCFIQOVBK-UHFFFAOYSA-N 429.074 4.713 50 10 IJGE CCC(CBr)(CBr)NC(=O)c1cc(SC)ccc1Cl 232855455 QLEZTNJTUCJITH-UHFFFAOYSA-N 429.605 4.730 50 10 IJGE C[C@@]1(Cn2c(CCl)nc3cc(Br)cnc32)CCN(Cc2ccccc2)C1 388452349 YOVUPKDJNPPHHU-HXUWFJFHSA-N 433.781 4.845 50 10 IJGE C[C@H](Br)C[C@H](C)CNC(=O)c1cc(Br)ccc1Br 397850830 SAVVIMXSLLFYKO-IUCAKERBSA-N 441.989 4.751 50 10 IJGE O=C(Nc1ccccc1S[C@H](Cl)C(F)(F)F)C(=O)N[C@H]1CCCC(F)(F)C1 768757101 PQJACTULUKPCHM-XPTSAGLGSA-N 430.826 4.539 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(C)c1C=NNC(=O)c1cc(F)c(F)cc1Cl 1084624716 VAHJZUHICHRILS-UHFFFAOYSA-N 437.277 4.897 50 10 IJGE C=C[C@H](C(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1)c1ccccc1 1540396020 NKIDKADHLMOZHF-QFIPXVFZSA-N 434.923 4.958 50 10 IJGE CSc1ccc(NNC(=O)[C@H](C)SCc2nc(O)c3c(C)c(C)sc3n2)cc1 1636990897 MRJHJHUXKMHKDM-LBPRGKRZSA-N 434.612 4.501 50 10 IJGE CC(=O)c1ccc(O[C@@H](C)C(=O)NNC(=O)Nc2ccc(C)c(-c3ccsc3)c2)cc1 1674685535 BQWGKTPCEWRHMK-INIZCTEOSA-N 437.521 4.546 50 10 IJGE CCCOc1ccc(C=NNC(=O)COc2ccc(CCC)cc2Br)cc1 1772756178 MUXRJMSSGVYDKH-UHFFFAOYSA-N 433.346 4.720 50 10 IJGE CC(=O)C(=O)CCC[C@H]1C[C@]2(C)C(=CC1=O)[C@@H](Cl)C[C@H]1[C@H]2CC[C@@]2(C)[C@H](O)CC[C@H]12 1857787854 WFQUYBYCFZVLQH-BFKHWOFTSA-N 435.004 4.651 50 10 IJGE C[C@@H](Br)C(=O)N1CCC2(C=Cc3ccc(OCc4ccccc4)cc3O2)CC1 1859497980 RFHHKZAVKLYVTL-QGZVFWFLSA-N 442.353 4.816 50 10 IJGE Cc1ccc(S(=O)(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)cc1C 1860405706 UGUDPAQEVHPRCX-UHFFFAOYSA-N 436.558 4.808 50 10 IJGE CCOc1cc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3CC)ccc1OCc1ccc(C)cc1 1865689602 UDABNYIOOFAPBC-DEOSSOPVSA-N 444.535 4.716 50 10 IJGE CCCc1nn(Cc2ccc(C)cc2)c2c1[C@H](c1cccc(OCC)c1)C(C#N)=C(N)O2 1865690056 HTTMIRYSAVUKLX-HSZRJFAPSA-N 428.536 4.809 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2cccc(Cl)c2)[C@H]1c1cccnc1 1865700328 PYAYQRQOWJGOQH-NRFANRHFSA-N 439.906 4.865 50 10 IJGE C[C@@H]1C[C@H]1CCCOC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1896108430 LJJLTEUSYVGDOT-HUUCEWRRSA-N 437.362 4.644 50 10 IJGE C[C@H]1OCC[C@]1(CBr)Cc1cc(Br)ccc1Br 2006502108 XPXBMFWAWUBHDO-NOZJJQNGSA-N 426.974 4.944 50 10 IJGE CC[C@H](Br)[C@@H]1CCCCN1C(=O)c1csc(I)c1 2051077544 FRBBJSFJCSPMTK-QWRGUYRKSA-N 442.160 4.521 50 10 IJGE O=S(=O)(c1cc(F)ccc1CBr)N(Cc1ccccc1)CC1CCC1 2059266547 HCSVPRCWYSOHIU-UHFFFAOYSA-N 426.351 4.712 50 10 IJGE Clc1cc(COc2ccc(CBr)nc2)ccc1I 2086654069 CPNNPQXDBPEOBB-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE CCC(CC)(CBr)CN1C[C@H]2[C@@H]3CC[C@@H](CN3C(=O)OC(C)(C)C)[C@H]2C1 2106787553 ZUDZFKBLUNFTIZ-MLHJIOFPSA-N 429.443 4.765 50 10 IJGE CN(Cc1cc(Cl)cs1)S(=O)(=O)c1cc(CCl)sc1Br 2150407892 IDMPEJBKYZHBBF-UHFFFAOYSA-N 435.217 4.785 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@H](NC(=O)c2ccc(CBr)cc2)C1 2162592883 YPBIXVRGYWDDSG-YJBOKZPZSA-N 439.394 4.785 50 10 IJGE O=C(c1cc(Cl)ccc1Br)N1CCC([C@H](F)CBr)CC1 2163244779 ITCOBJGSZLTCOR-CYBMUJFWSA-N 427.539 4.688 50 10 IJGE C[C@H](Br)CCCc1cn(-c2ccc(Br)c(Cl)c2F)nn1 2189276937 ABUSCZGNIOLVOE-QMMMGPOBSA-N 425.527 4.928 50 10 IJGE Cc1cc(Br)c(C(=O)NC2CC([C@@H](F)CBr)C2)cc1Cl 2199059215 QSLSPHPFRSHONL-RPTIHFLNSA-N 427.539 4.652 50 10 IJGE COc1ccc(Br)c(CCl)c1OCc1ncc(Br)s1 2227747272 YBXXODLRMPZQTK-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE O=S1(=O)C[C@H]2[C@@H](C1)[C@@H]2[C@@H](Cl)c1c(Br)cc(Cl)c(Cl)c1Cl 2232511181 JSQHBMGVQHJOFY-HSJIAEGWSA-N 438.985 4.980 50 10 IJGE Cc1nc(-c2ccc(I)cc2)nc2c1C[C@H](CBr)CC2 2237093964 QEVVWRPGZPHOLY-LLVKDONJSA-N 443.126 4.556 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@H]2CCCC3(CC3)C2)C1 2302706017 DGYQZEQJDBGJQC-HNAYVOBHSA-N 449.373 4.931 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3CC[C@H]2C[C@@H]3Br)c1 2315503234 HOUXYHNVJFYNCZ-LQJRIPTKSA-N 438.001 4.959 50 10 IJGE Cc1cc(NC=C(C#N)C(=O)Nc2ccc(Br)cc2)ccc1Br 2324090717 AJIPNNIXYPUVOD-UHFFFAOYSA-N 435.119 4.978 50 10 IJGE Cc1cc(I)ccc1NC(=O)C(C#N)=CNc1c(C)cccc1C 2325409339 AGVFHEAVTVQTFM-UHFFFAOYSA-N 431.277 4.675 50 10 IJGE Cl[C@@H]1C[C@H]2CC[C@H]1N(Cc1ccc(I)c(Br)c1)C2 2325468739 FZKTYAPJCFMGOX-MPKXVKKWSA-N 440.550 4.645 50 10 IJGE Clc1cc(Br)c(CN2CCC3(CC2)C[C@H](Br)CO3)s1 2345962123 SBMRSGJEXJKJNC-VIFPVBQESA-N 429.605 4.682 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)N/N=C/c2cccc(F)c2F)c(Br)c1 14017955 DCFIAWAHICAJFF-AUEPDCJTSA-N 425.273 4.554 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)cc2/C=N/NC(=O)Cc2ccc(Cl)cc2)cc1 48573753 MBSCXPDFNKWTAT-JVWAILMASA-N 444.922 4.894 50 10 IJGE O=S(=O)(Nc1cccc(CBr)c1)c1cc(Cl)c(Br)s1 137103200 CWEACHZWHXQLNJ-UHFFFAOYSA-N 445.585 4.860 50 10 IJGE Cc1cc(Br)c(S(=O)(=O)N(CCCCl)C(C)C)cc1Br 155817682 KQQRMXDHPHTNCG-UHFFFAOYSA-N 447.620 4.548 50 10 IJGE O=C(N/N=C\c1cccc(Cl)c1Cl)c1cccn(Cc2cccc(Cl)c2)c1=O 169920679 LSWVCSXXEDDIBG-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE CCOc1ccc2nc(Sc3ccc(C=NNC(=O)c4ccccc4O)o3)sc2c1 254347179 AEOPDKPJWHREDO-UHFFFAOYSA-N 439.518 4.909 50 10 IJGE COc1cc(C=NNC(=O)CSc2nc3ccccc3o2)ccc1OCc1ccccc1 254822931 BDOWAGQQSIRUNQ-UHFFFAOYSA-N 447.516 4.658 50 10 IJGE O=C(c1ccc(C(Br)Br)cc1)C(Br)Br 306753472 MEKAVMCHNOSPSS-UHFFFAOYSA-N 449.762 4.774 50 10 IJGE CC[C@@](C)(CO[C@H](CI)c1ccccc1Br)OC 319061831 HPUWMUSDAXZJIJ-KGLIPLIRSA-N 427.120 4.757 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@H](c2ccc(Br)c(O)c2)C1 382673323 GEWMQEMTOOHNRI-NEPJUHHUSA-N 435.156 4.500 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@]12CCC[C@H]1OCC2 687346519 TVPXXMXOYVUYFU-BMFZPTHFSA-N 449.126 4.621 50 10 IJGE C[C@@H]1[C@@H](CBr)CCN1C(=O)c1scc(Br)c1Br 705426897 PFTLELSNUNDROA-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE O=C(NC1(CCCl)CCSCC1)c1scc(Br)c1Br 719645769 IINPFDFFAJJGCD-UHFFFAOYSA-N 447.645 4.898 50 10 IJGE C[C@@H](Br)[C@H]1CCN(Cc2cc(Cl)ccc2I)C1 719749186 UZFHSLYGYKKARK-ZJUUUORDSA-N 428.539 4.550 50 10 IJGE O=C(NNC(=O)N1CCC(c2c[nH]c3ccccc23)CC1)c1c(Cl)cccc1Cl 727846626 HBWKELUASMBLLH-UHFFFAOYSA-N 431.323 4.709 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NCc2ccc3sccc3c2)c(-c2ccccc2)n1 752948671 ADVOTLQTSDYTMJ-KGENOOAVSA-N 437.528 4.902 50 10 IJGE O=C(NNC(=O)c1ccc(Cl)cc1)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1 756165280 OENDNXBKJHPNHA-UHFFFAOYSA-N 449.338 4.522 50 10 IJGE O=S(=O)(NCC[C@@H]1COc2ccccc2O1)c1cccc(S(F)(F)(F)(F)F)c1 777999521 CEDUIRFCOUNAAG-GFCCVEGCSA-N 445.431 4.852 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)c1C 779206918 VHTJWXNWPBLRMY-UHFFFAOYSA-N 446.942 4.973 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2C[C@H]3[C@H]4CC[C@@H](C4)[C@H]3C2)c(-c2ccc(Cl)cc2)n1 818447625 AUVZHJNHQNBHBI-LYMTVVMVSA-N 445.954 4.529 50 10 IJGE Cc1nn(-c2ccc([N+](=O)[O-])cc2)c(C)c1C=NNC(=O)[C@H](C)c1ccc(CC(C)C)cc1 1084309869 SFVGZVGTKCCASZ-QGZVFWFLSA-N 447.539 4.850 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@H]1CCN(C(=O)c2ccc3nc(O)n(CC(F)(F)F)c3c2)C1 1301523042 ADQAYGISIKPGAS-AWEZNQCLSA-N 443.542 4.541 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)COc1ccccc1CC)c1ccc(C(F)(F)F)cc1 1312344170 WLUQNNDNFQOKKU-IBGZPJMESA-N 449.473 4.685 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccn2)[C@H]1c1cccc(Cl)c1 1865683166 HPGQEUYKWDKXRW-FQEVSTJZSA-N 425.879 4.806 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865684292 VYHQNIHLQNZRHW-QFIPXVFZSA-N 447.970 4.821 50 10 IJGE Cc1nn(-c2ccc(Cl)cc2)c2c1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865705646 AVCZVYSXGXYYBM-GOSISDBHSA-N 442.262 4.614 50 10 IJGE CCOc1ccc(/C=N\NC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)cc1OCC 1865760584 FOPFJSFHQOMZIM-VYYCAZPPSA-N 439.462 4.897 50 10 IJGE COCCOc1ccc(/C=C(\C#N)C(=O)NC2CCC(c3c[nH]c4ccccc34)CC2)cc1 1866214197 WOVJNKIBEGYAGW-LTGZKZEYSA-N 443.547 4.943 50 10 IJGE C[C@H](NCc1cc(Br)ccc1Br)c1nnc(CCl)s1 1877557998 JKUTZMQARVZLAE-ZETCQYMHSA-N 425.577 4.653 50 10 IJGE CC(C)C[C@@H](CNC(=O)OC(C)(C)C)C[C@H](CBr)NC(=O)OC(C)(C)C 1880731269 ZMQLZBNXJMVEKL-HUUCEWRRSA-N 437.419 4.852 50 10 IJGE C[C@@H]1CCN(C(=O)OC(C)(C)C)CC[C@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1881376153 ODPQXSWOBMRZOS-KFWWJZLASA-N 435.403 4.558 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C1[C@H]2CCC[C@H]1CN(Cc1ccccc1)C2 1882087115 HLKJUVQNNAZPMN-GBESFXJTSA-N 437.422 4.823 50 10 IJGE O=C(c1c(Cl)cc(Br)c(F)c1Br)[C@H]1C[C@@H]1Br 1900377022 RDNWSSYTKVZBIF-IMJSIDKUSA-N 435.312 4.970 50 10 IJGE O=C(c1sncc1Br)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915264727 SSCBLZXGCXMJDN-CQSZACIVSA-N 444.192 4.722 50 10 IJGE O=C(Nc1ccc(F)c(CBr)c1)c1ccc(I)cc1 1924856713 VXFDDODKWHVWOL-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE CN(CCN(Cc1ccccc1)C[C@@H](Br)C(F)(F)F)Cc1ccccc1 1931962069 OPSDFRLOPRDBCH-LJQANCHMSA-N 429.324 4.946 50 10 IJGE IC[C@H]1CCCC2(O1)[C@H]1CCC[C@H]2CN(Cc2ccccc2)C1 1979905191 KVGZFOLGAHJZAV-GBESFXJTSA-N 425.354 4.661 50 10 IJGE Fc1cc(Br)cc(N2CCN(Cc3ccccc3)CC2)c1CBr 1980878066 TWEITGLDBIHNNN-UHFFFAOYSA-N 442.170 4.805 50 10 IJGE O=C(NC[C@@H](Br)C1CCC1)c1c(Br)cccc1Br 2033086263 KHSKIBTZSABBAF-LLVKDONJSA-N 439.973 4.505 50 10 IJGE CCCN(CC1CCN(C(=O)OC(C)(C)C)CC1)C[C@@H](Br)C(F)(F)F 2044701056 UAYGHXBRXOEDOP-CQSZACIVSA-N 431.337 4.671 50 10 IJGE CC(C)n1cc(S(=O)(=O)N(Cc2ccccc2)C2CCC2)cc1CBr 2059312601 NHFYIZDIHSBONT-UHFFFAOYSA-N 425.392 4.707 50 10 IJGE CC1(C)OCCO[C@H]1[C@H](Br)c1cc(Br)ccc1Br 2066691193 SYNQYXXINFVGGU-NEPJUHHUSA-N 442.973 4.842 50 10 IJGE C[C@H](Cl)C[C@H]1CCCCN1c1ncc(I)cc1Br 2069526372 VFRNGUHKWCDXFN-GXSJLCMTSA-N 443.554 4.825 50 10 IJGE O=S1(=O)CCC[C@@H]([C@H](Br)c2cc(Br)c(Cl)cc2F)C1 2097823900 KQHIYUAEDIECNU-KRTXAFLBSA-N 434.552 4.502 50 10 IJGE C[C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CN1CC1(CBr)CCCCCC1 2106787500 ZIIBZOARZZZJIQ-SQNIBIBYSA-N 429.443 4.909 50 10 IJGE C[C@@H]1C[C@@H](O[C@@](C)(CI)c2ccccc2Br)CCO1 2140602270 MILFGSDVHVDHBZ-XUJVJEKNSA-N 439.131 4.683 50 10 IJGE O=C(c1cc(Cl)cc(Br)c1)N1CC[C@@H](Br)C(F)(F)CC1 2150019963 WQFSXFQWYYXWLW-LLVKDONJSA-N 431.502 4.737 50 10 IJGE Cc1ccc(N2CCC[C@@]3(CN(Cc4ccccc4)CCO3)C2)c(CBr)c1 2151740551 SKFBUJPDZSMLRU-HSZRJFAPSA-N 429.402 4.761 50 10 IJGE CC1(C)C[C@@H](NC(=O)c2ccc(CBr)cc2)CCN(C(=O)OC(C)(C)C)C1 2162494024 DCCIUAOPAANDRC-KRWDZBQOSA-N 439.394 4.737 50 10 IJGE CCCC(CBr)(CCC)CN1CC[C@@H]2OCCN(C(=O)OC(C)(C)C)[C@@H]2C1 2163061905 IQWNKIOYEDSDNN-MSOLQXFVSA-N 447.458 4.678 50 10 IJGE Oc1nc2ccc([C@@H](Br)c3cc(I)ccc3F)cc2o1 2169669033 WXELLNKWSFUHID-CYBMUJFWSA-N 448.029 4.761 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Br)[C@H]1CCCCS1(=O)=O 2203005492 XAJHNOFWQZXOAH-NEPJUHHUSA-N 446.588 4.514 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1Cc1cc(Cl)ccc1I 2251035270 FLKYKMQSHTUVPJ-DGCLKSJQSA-N 428.539 4.692 50 10 IJGE CCN(CC1(CBr)CC(F)C1)[C@@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2265637971 HOLXGSFCGBWRQG-RPTYLJJZSA-N 435.422 4.905 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)[C@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 2274219764 ICCPFUBNWXOVFU-MSOLQXFVSA-N 425.411 4.742 50 10 IJGE CCn1nc(C)c(CBr)c1N(C)[C@@H]1C[C@@H]2C[C@@H](OCc3ccccc3)C[C@@H]21 2281304020 QNLLDGHPQMKYTK-YOUFYPILSA-N 432.406 4.926 50 10 IJGE O=C(N[C@H](CCBr)C(F)(F)F)c1cc(Br)c(F)cc1Cl 2285845954 HYKCHJLVPRQWHZ-SECBINFHSA-N 441.444 4.687 50 10 IJGE N#CC(=Cc1cc2c(cc1Br)OCO2)C(=O)Nc1cccc(C(F)(F)F)c1 2295326955 OSFFUFNKKURLIA-UHFFFAOYSA-N 439.187 4.742 50 10 IJGE CCCc1cc(C(=O)OC)c(NC(=O)C(C#N)=Cc2ccc(Cl)c([N+](=O)[O-])c2)s1 2295669942 PBOXTJIZQGCPBT-UHFFFAOYSA-N 433.873 4.594 50 10 IJGE CC1CCN(C(=O)C(C#N)=Cc2cn(-c3ccccc3)nc2-c2cccc([N+](=O)[O-])c2)CC1 2296701045 FBOANOUDXVJAGU-UHFFFAOYSA-N 441.491 4.613 50 10 IJGE O=S1(=O)CCC[C@@H]1[C@@H](Cl)c1cc(Br)ccc1OCc1ccccc1 2299535625 REMBCTNSMVZDLK-MSOLQXFVSA-N 429.763 4.885 50 10 IJGE Cc1cc(CCl)nc(Oc2cc(Br)cc(I)c2)n1 2316719742 IBVHNAIMHBCNLC-UHFFFAOYSA-N 439.478 4.683 50 10 IJGE COc1c(Br)cc(C)c([C@@H](Cl)[C@]2(C)COCCO2)c1Br 2365232760 RALKKOWLZWSVSN-KGLIPLIRSA-N 428.548 4.614 50 10 IJGE Clc1ccc(CN(CCCBr)C2CCOCC2)c(Br)c1 2381144668 UEWMDKGYZDTKBS-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)cc(Br)c1OC(C)C 35189919 CHWFTMUAYFOCQW-DHDCSXOGSA-N 445.313 4.886 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccco2)C(=O)/C1=C/c1ccc(OCc2ccc(C)cc2)cc1 38606958 WTAPMZJGSJGLRO-ZVHZXABRSA-N 438.483 4.960 50 10 IJGE CC(C)Oc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccs2)cc1 38656425 CYWDYPUDXIECAN-QFIPXVFZSA-N 432.501 4.973 50 10 IJGE Cc1cc(Oc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2N)ccc1Cl 40793451 SXNOHWUHRZLYBK-UHFFFAOYSA-N 438.702 4.877 50 10 IJGE C=CCc1cc(/C=N\NC(=O)CC[C@@H](O)c2ccccc2)cc(Br)c1OCC 58891924 OWMRSHNPBCYXQQ-ZOLHPDHPSA-N 445.357 4.540 50 10 IJGE CO[C@@H]1CCC[C@H](O[C@@H](CI)c2cccc(Br)c2)C1 162370278 GJJVZRINFUIIAB-ILXRZTDVSA-N 439.131 4.899 50 10 IJGE O=C(N/N=C\c1ccc(Br)cc1)c1ccc2[nH]c(Cc3ccccc3)nc2c1 169925889 WVSRMOITTHVEQX-OYKKKHCWSA-N 433.309 4.680 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@@H]1Br)c1cccc(Br)c1Cl 228459414 YFKIDHVUDWKJBJ-DZGCQCFKSA-N 429.539 4.893 50 10 IJGE O=C(NCCCCCCI)c1ccc(Cl)cc1Br 236044096 JPHOVVYOUBMNKS-UHFFFAOYSA-N 444.538 4.828 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc(C)s2)cc1COc1ccc(C)cc1[N+](=O)[O-] 252629142 TZFVWELAHBMFOV-UHFFFAOYSA-N 439.493 4.625 50 10 IJGE Cc1nn(-c2ccccc2)c(N2CC[C@H](OCc3ccccc3)C2)c1CBr 383865844 VMENIHNGFWRPEY-FQEVSTJZSA-N 426.358 4.871 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1C(=O)c1ccc(Br)cc1Br 399433205 SJOGBINNPLDCJK-SCZZXKLOSA-N 439.973 4.600 50 10 IJGE CCN(Cc1c[nH]c2ccccc12)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 785792023 GOQHUYXHZRCSOC-QNGOZBTKSA-N 448.530 4.901 50 10 IJGE Cc1nc(-c2ccc(NC(=O)/C(C#N)=C\c3cn(CCC#N)nc3-c3ccccc3)cc2)co1 918013502 IEGUEUUDUFCYOD-STZFKDTASA-N 448.486 4.973 50 10 IJGE Cc1cc(C=NNC(=O)[C@H]2COc3ccccc3O2)c(C)n1-c1cc(Cl)cc(Cl)c1 1084114535 MGEIAOFOZDQJSC-OAQYLSRUSA-N 444.318 4.691 50 10 IJGE C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 1087433623 DORICNQCXRLSNI-PNHOKKKMSA-N 442.437 4.577 50 10 IJGE C=CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1ccc(Br)cc1CC 1295571264 CQEYBVPVCITRGB-KRWDZBQOSA-N 440.382 4.704 50 10 IJGE O=C(NNc1nc2ccc(Cl)cc2s1)c1cc2c(C(F)(F)F)cc(O)nc2o1 1585728154 RIGFANXZIUITAU-UHFFFAOYSA-N 428.779 4.572 50 10 IJGE Cc1c(C(=O)N2CCCC2)oc2c1C(=NNC(=O)c1ccc(-c3ccccc3)cc1)CCC2 1772746433 FMONWGIYHNCURI-UHFFFAOYSA-N 441.531 4.961 50 10 IJGE Cc1ccn2c(C(=O)NNC(=O)c3ccc(-c4ccc5ccccc5c4)s3)c(C)nc2c1 1860391441 HCNVMXVVIHFMET-UHFFFAOYSA-N 440.528 4.908 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNC(=O)/C=C/c2ccc(C(C)C)cc2)c(C)n1 1865760179 KTDLSEDYPDACTL-LFIBNONCSA-N 429.520 4.663 50 10 IJGE Cc1c(C(=O)OC2CCCCC2)sc2ncnc(Oc3cccc4c3C(=O)OC4=O)c12 1865789041 PJAIIPRSGRYQNQ-UHFFFAOYSA-N 438.461 4.592 50 10 IJGE C[C@H](C(=O)NC(C)(C)C(=O)Nc1ccc(SC#N)cc1)c1ccc(Br)cc1 1866942858 ULKVHOUGDNCPOE-ZDUSSCGKSA-N 446.370 4.659 50 10 IJGE O=S(=O)(c1cccc2ncccc12)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915172490 NNDNGJJUNWEZKR-HXUWFJFHSA-N 445.382 4.599 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@](C)(CI)O2)CC12CCC2 1986113213 YSHUGQVKNUZYDU-SJLPKXTDSA-N 435.346 4.683 50 10 IJGE C[P@@]1(=O)C[C@H](Cc2cc(Cl)ccc2I)[C@@H](Br)C1 2005165375 SBEQROXFSKMNLP-LTHLMHMASA-N 447.478 4.873 50 10 IJGE CCCN(Cc1ccccc1)S(=O)(=O)c1cc(F)c(Cl)c(CBr)c1 2009659030 XKPHLAYTYWRTMP-UHFFFAOYSA-N 434.758 4.975 50 10 IJGE C[C@](CBr)(NC(=O)c1c(Br)cccc1Br)C1CC1 2033091464 REOOCKBGMOPFCL-CYBMUJFWSA-N 439.973 4.505 50 10 IJGE C[C@@H]1[C@@H]([C@H](Br)c2cc(I)cc3c2OCC3)C1(F)F 2036071421 MXOHZRFKGVLELC-LIEZGIJOSA-N 429.042 4.563 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[S@@](=O)(=NCCCCCCCCCBr)C1 2044700202 PODMSVFBHAQTLD-CPJLOUKISA-N 439.460 4.877 50 10 IJGE FC(F)Oc1c(I)cc(OC(F)(F)F)cc1CBr 2060220300 SPFDKVLMFYSTET-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@H](CCl)C(F)(F)C1 2090181431 FAJVYJKSKVALBQ-ZCFIWIBFSA-N 437.531 4.609 50 10 IJGE CCC[C@@H](Br)c1cn(-c2ccc(CC)c(I)c2)nn1 2128670767 ILTOXJLONQZSMB-GFCCVEGCSA-N 434.119 4.670 50 10 IJGE O=C(c1cc(Br)sc1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Cl)C2 2134132028 XYEHSMSCYDLAQZ-RXHUMLQZSA-N 431.552 4.596 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C(=O)[C@H](Br)C2CCCC2)C2(CCCCC2)C1 2167034999 ZMNZFBVDZKSSHH-DLBZAZTESA-N 443.426 4.769 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2N1C(=O)OC(C)(C)C 2196906338 CNCQUVONXAFDIT-WCUWXVSDSA-N 443.426 4.577 50 10 IJGE Cc1sc(C(=O)N2CC(F)(F)C[C@]2(C)CBr)c(C)c1Br 2234476878 YOVXYSVYOAHFTH-GFCCVEGCSA-N 431.140 4.762 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)[C@@H](C)CBr)c(Cl)c1OC 2256279385 HSRJYMHQJFRMHF-ZDUSSCGKSA-N 426.738 4.783 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@]23COC[C@H](C2)C3)c1 2263513628 PZMBYTFYPQUJSN-BPNCWPANSA-N 438.985 4.944 50 10 IJGE CC1(C)C[C@@H](CBr)CN1C(=O)c1cc(F)c(Br)cc1Cl 2282968851 XYYMKXOEBSGSSZ-QMMMGPOBSA-N 427.539 4.877 50 10 IJGE O=C(c1cccc(Cl)c1Br)N1CCC([C@@H](F)CBr)CC1 2283198646 VTUNZXFHRPOURT-LBPRGKRZSA-N 427.539 4.688 50 10 IJGE Clc1cc(I)c([C@@H](Br)[C@H]2C[C@@H]3O[C@H]2[C@H]2C[C@@H]32)s1 2301086072 KNSVWDFOLQYMSV-ADILSVFCSA-N 445.547 4.866 50 10 IJGE CCC[C@H](CCBr)NCc1ccc(Cl)cc1I 2302317191 FBWPTOSJFDXTSM-GFCCVEGCSA-N 430.555 4.988 50 10 IJGE CCN(CCCCBr)Cc1ccc(Cl)cc1I 2302326027 LZFYOXPECROIEZ-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE Cc1ccc(S(=O)(=O)NCC(O)=C(C#N)c2nc(-c3ccc(C)cc3C)cs2)cc1 2331311243 HUOYVSAZCIMIOU-UHFFFAOYSA-N 439.562 4.507 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@H]3CCN(C(=O)OC(C)(C)C)C[C@H]32)C1 2345011179 QRLCKLAMQTXHGC-DLBZAZTESA-N 429.443 4.909 50 10 IJGE CC(C)(C)[C@@](C)(CBr)CN1CCCN(Cc2ccccc2)CCOCC1 2352089292 QPHUHXTWZWZGDR-QFIPXVFZSA-N 425.455 4.658 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2cc(I)ccc2Cl)C[C@@H]1CCl 2380521645 IYIOLAHOXYXDEP-ONGXEEELSA-N 438.058 4.794 50 10 IJGE O=C(N/N=C/c1ccccc1O)c1cn(Cc2ccc(Br)cc2)c2ccccc12 20494498 XXZCSSOEMBHCIX-DHRITJCHSA-N 448.320 4.922 50 10 IJGE COc1cc(/C=C(/C#N)c2cccc(Cl)c2)ccc1OC(=O)CNC(=O)c1ccccc1 31902382 VYYMDZAHIXIFOD-NDENLUEZSA-N 446.890 4.748 50 10 IJGE COc1cccc(/C=N/NC(=O)COc2ccc(-c3ccccc3)cc2Br)c1 40851917 MSFIGNAGKJBNNW-ZVHZXABRSA-N 439.309 4.654 50 10 IJGE CCCCCCOc1c(OC)cc(/C=N\NC(=O)c2ccccc2Cl)cc1[N+](=O)[O-] 169886087 NCEIRTNJADBWGG-UCQKPKSFSA-N 433.892 4.980 50 10 IJGE O=C(NC[C@@H]1CC[C@@H](Br)C1)c1cc(Br)c(Br)s1 227667762 LFMPBAQMCLFNSU-RNFRBKRXSA-N 446.002 4.567 50 10 IJGE CC(C)C[C@@H](CBr)NC(=O)c1ccc(Br)cc1Br 232589149 HSDXRNJLFXBWQD-JTQLQIEISA-N 441.989 4.751 50 10 IJGE COc1cc(NC(=O)[C@H](Br)C(C)C)c(Br)cc1Br 234882199 PFHCVUZTIFSGQE-LLVKDONJSA-N 443.961 4.578 50 10 IJGE O=S(=O)(Nc1cc(Br)ccc1Br)c1ccccc1CCl 312480541 WKRREUUCQHMOPH-UHFFFAOYSA-N 439.556 4.751 50 10 IJGE C[C@H](Br)C[C@@H]1CCCCCN1S(=O)(=O)c1sccc1Br 312932754 FVYRHELYXXKIBG-QWRGUYRKSA-N 445.242 4.617 50 10 IJGE C[C@@H]1CCCC[C@H]1O[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 725343869 LGQMFVQUMSCBDO-IIDMSEBBSA-N 437.362 4.786 50 10 IJGE C[C@@H](NC(=O)NNc1nc(Cl)c(Cl)cc1Cl)c1ccc(-n2cccn2)cc1 745925045 BQPTWMIRPJDMME-SNVBAGLBSA-N 425.707 4.615 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)C1CCC(NC(=O)CC2CCCCC2)CC1 751072170 VFBXHOKTXLJJCB-UHFFFAOYSA-N 428.529 4.874 50 10 IJGE Cc1ncsc1COC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 776381769 BWUFPVPYBWMKKG-CXUHLZMHSA-N 437.912 4.532 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Nc2cccc(-c3nnco3)c2)c(C)n1-c1ccc(F)cc1 914573497 CTZJANOHKRYIGH-YBFXNURJSA-N 427.439 4.829 50 10 IJGE CCCCCCCCOc1ccc(C=NNC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 1084300516 MMUJPUONSSFFIM-UHFFFAOYSA-N 427.501 4.863 50 10 IJGE C#CCOc1ccc(C=NNC(=O)[C@@H](C)c2ccc(CC(C)C)cc2)cc1Br 1084603565 LASFMARCWQNLCZ-KRWDZBQOSA-N 441.369 4.913 50 10 IJGE Cc1cc(OCC(=O)NN=Cc2c[nH]c3ccccc23)c(C(C)C)cc1Br 1772754020 MCBUJXXMQRCGGO-UHFFFAOYSA-N 428.330 4.891 50 10 IJGE Cc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1ccccc1Cl)C(C#N)=C(N)O2 1865686265 SVVMWFFRQAHZAX-LJQANCHMSA-N 429.282 4.904 50 10 IJGE CCOc1ccc(-c2csc(/C(C#N)=C(\O)[C@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1 1872747582 JTJOFCNHPTVQGE-MPHHAOFMSA-N 445.500 4.686 50 10 IJGE C[C@H](/C(O)=C(\C#N)c1nc(-c2ccc(F)cc2F)cs1)N1C(=O)c2ccccc2C1=O 1872818290 VXQSVOWKCKBUPC-HBTZSIKTSA-N 437.427 4.566 50 10 IJGE FC(F)(F)c1cnc(N[C@@H](CCCl)C(F)(F)F)c(I)c1 1918533478 QTKPKMDQZBXSKR-ZETCQYMHSA-N 432.533 4.677 50 10 IJGE CC(C)[C@H](CBr)CN(Cc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 1953584377 KERMGLPOIUGYBM-GOSISDBHSA-N 425.411 4.775 50 10 IJGE C[C@H]1C[C@H]1CCCOC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1985940442 LJJLTEUSYVGDOT-LSDHHAIUSA-N 437.362 4.644 50 10 IJGE C[C@@H](N(Cc1ccccc1)S(=O)(=O)CCC(F)(F)CBr)C(C)(C)C 2009713212 XMZTXGMJWCJHED-CQSZACIVSA-N 426.367 4.673 50 10 IJGE C[C@@H](Cl)CC(C)(C)CNc1ncc(I)cc1Br 2015758447 HXRVFWPPZNLZKO-MRVPVSSYSA-N 431.543 4.904 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1cc(Br)sc1Br 2023028191 IUGWOKGGXDRCRD-POYBYMJQSA-N 448.018 4.813 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H](C2CC2)[C@@H](Br)C1 2033087234 USCNBLIFYLWOSM-YGRLFVJLSA-N 438.001 4.817 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2C[C@@H]1CCCN1Cc1ccccc1 2096812057 MCVOTISWWDORHC-INIZCTEOSA-N 433.781 4.906 50 10 IJGE Cc1nc(N2C[C@@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)sc1CBr 2108213377 LIRGRYKNRSRQRM-OYRHEFFESA-N 432.431 4.839 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@@H]2CC[C@H](Br)C[C@H]2C1 2115941151 XGEJREGYESSHSH-CIUDSAMLSA-N 427.589 4.800 50 10 IJGE CCOCCOCCC(CBr)(CBr)c1ccccc1Cl 2143825485 FGJROSYRCMZHHP-UHFFFAOYSA-N 428.592 4.811 50 10 IJGE NNC(=O)c1cc(Br)cc(CN(Cc2ccccc2)CC2CCCCC2)c1 2152163803 YVOXPFSECCTVJF-UHFFFAOYSA-N 430.390 4.635 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(NC(=O)c3ccc(CBr)cc3)CCC[C@@H]12 2162588705 IYSMJZXKHJLYMQ-UTKZUKDTSA-N 437.378 4.634 50 10 IJGE CO[C@H]1C[C@@H]([C@H](Br)Cc2ccc(Br)cc2Cl)C[C@H]1OC 2237443320 INZPGAIWBBCWQU-WAZAZEMKSA-N 426.576 4.849 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1Cc1cccc(Br)c1Br 2251035885 AILKASXZBYKHFN-CMPLNLGQSA-N 425.990 4.959 50 10 IJGE CC(C)(C)[C@H](Cl)CNCc1ccc(I)c(Br)c1 2306220471 XXBYZLUZUGLCCK-GFCCVEGCSA-N 430.555 4.797 50 10 IJGE C=CC[C@@H](Br)[C@H]1CCN1Cc1ccc(I)c(Cl)c1 2314255347 SXHICLSCQXDKQW-BXUZGUMPSA-N 440.550 4.859 50 10 IJGE N#CC(=CNCCc1ccccc1Br)C(=O)Nc1cccc(C(F)(F)F)c1 2324413015 XWMXLFZRVCQMLR-UHFFFAOYSA-N 438.247 4.646 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cc(F)ccc1C(F)F 2343411178 CHWKMOYZHAXRGZ-OAHLLOKOSA-N 430.264 4.864 50 10 IJGE C=CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(C)c4)ccc32)cc1 38657993 JWEDXNBETYHIMX-VWLOTQADSA-N 438.483 4.997 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(O)cc2)CCC3)c1C 40812010 DQZREEZQVRHFDK-NHFJDJAPSA-N 431.492 4.633 50 10 IJGE Brc1cccc([C@H](CI)OC[C@@H]2CCCCO2)c1 161965656 IOYSQNLTBJJTES-KBPBESRZSA-N 425.104 4.511 50 10 IJGE CCc1ccc(C(C)=NNC(=O)CCCCC(=O)NN=C(C)c2ccc(CC)cc2)cc1 254292124 HWRGWPVMWCSOJK-UHFFFAOYSA-N 434.584 4.752 50 10 IJGE O=C(NN=Cc1ccc(OC(=O)c2ccccc2F)cc1)c1cc2ccccc2cc1O 254401747 ANRLILFCBPJGIO-UHFFFAOYSA-N 428.419 4.668 50 10 IJGE COc1cc(C=NNC(=O)CNc2cccc3ccccc23)ccc1OCc1ccccc1 254526188 NLWSYMCBAVHCLJ-UHFFFAOYSA-N 439.515 4.990 50 10 IJGE C[C@H](Cl)C[C@H]1CCCCN1C(=O)c1ccc(I)c(Cl)c1 380181167 AFHRDGXYSCRRNC-CMPLNLGQSA-N 426.125 4.957 50 10 IJGE C[C@@H]([C@@H](Br)c1cc(I)cc2c1OCC2)C(C)(F)F 385682525 CSQPCJXJIDQDLK-WRWORJQWSA-N 431.058 4.953 50 10 IJGE CC[C@H](Br)[C@H](C)NC(=O)c1cc(Br)c(Br)s1 395374465 QIPFMVROOYPFTI-WDSKDSINSA-N 433.991 4.565 50 10 IJGE Brc1cnc(N2C[C@@H]3CC[C@@H](Br)C[C@H]3C2)c(Br)c1 398719437 YDKYUJKLPTWCRF-LPEHRKFASA-N 438.989 4.606 50 10 IJGE CC(C)(C)S(=O)(=O)CCC[C@H](CBr)c1ccc(Br)cc1 718766880 WNBFUAIYYMWLRV-CYBMUJFWSA-N 426.214 4.921 50 10 IJGE CC(=O)N(C)c1ccccc1NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccccc2F)c1C 735640325 VAYIGGZMUQQJMS-XSFVSMFZSA-N 430.483 4.762 50 10 IJGE CC(=O)N(C)c1cccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(F)cc3)c2C)c1 744771245 GXGSUIOPFXCCLR-MOSHPQCFSA-N 430.483 4.762 50 10 IJGE CS(=O)(=O)c1ccc(-c2nc(COC(=O)CCCC[C@H]3CCSS3)co2)cc1 761361596 FVNFJLIZDKGBPY-INIZCTEOSA-N 441.596 4.502 50 10 IJGE C[C@@H](OC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1)c1cccnc1 781865612 BVRBAFLLZWCCLE-BKAYVGFPSA-N 431.883 4.724 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)C(Cc2ccccc2)Cc2ccccc2)c1C 799099935 IVBIBTNOHZPCKC-UHFFFAOYSA-N 437.547 4.700 50 10 IJGE O=C(CCSc1ccccc1)NN=Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1 1084277068 IKOIMDLVASOLAZ-UHFFFAOYSA-N 435.505 4.806 50 10 IJGE C=CCOc1cn(-c2ccccc2)nc1C(=O)N1CC[C@@H](O[Si](C)(C)C(C)(C)C)C1 1641426484 OJPGIUIKBNCXIR-LJQANCHMSA-N 427.621 4.673 50 10 IJGE CC(=O)c1cc(NC(=O)NNc2cc(C(F)(F)F)ccc2Br)ccc1F 1661626563 WWKRZODRVDATTR-UHFFFAOYSA-N 434.187 4.958 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2O)CCC3)c1C 1772751826 NLGNIMXHDKTTDX-UHFFFAOYSA-N 431.492 4.633 50 10 IJGE Cn1cccc1[C@@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2-c1cccc(Cl)c1 1865699086 KIVVECPZARYHJK-FQEVSTJZSA-N 427.895 4.749 50 10 IJGE Cn1cccc1[C@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2-c1cccc2ccccc12 1865699398 SRLABIZWWXKJFI-GOSISDBHSA-N 435.409 4.601 50 10 IJGE Cc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccc(F)cc1)C(C#N)=C(N)O2 1865708297 SSZGNKTYMLYWAS-LJQANCHMSA-N 429.282 4.904 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)c3ccccc3Br)c(C)n2)cc1C 1865756373 VEAGFUSNZMJPIL-UHFFFAOYSA-N 438.325 4.511 50 10 IJGE CC(C)(C)OC(=O)N(C(=O)/C(C#N)=C/c1ccccc1)[C@H](CN)c1cccc(Cl)c1 1868112718 AXMBXFRPRLCSGE-VOMPUTFMSA-N 425.916 4.711 50 10 IJGE N#C/C(=C(O)\C=C\c1cccc([N+](=O)[O-])c1)c1nc(-c2ccc3c(c2)OCCO3)cs1 1872751040 QWLHDSQZJNMNMH-BWHYBYEUSA-N 433.445 4.996 50 10 IJGE CCN[C@@H](c1sc(Cl)cc1I)[C@H]1C[C@H](Br)C1 1900961458 JOFBCJJODIZDTH-BRDIYROLSA-N 434.568 4.830 50 10 IJGE O=S(=O)(c1ccc(Br)cc1F)N(Cc1ccccc1)[C@H](CCl)C1CC1 1915143101 KCYHPEHDFKFLNP-QGZVFWFLSA-N 446.769 4.797 50 10 IJGE CC[C@@H](NC(=O)c1csc(Br)c1Br)[C@H](C)Br 1937736916 BOCYIXMWEDQGAF-CAHLUQPWSA-N 433.991 4.565 50 10 IJGE CCC[C@H](Br)CNC(=O)c1cccc(Br)c1Br 1943886598 JUVCRSFRGADUAT-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CC[C@@](C)(CI)O2)CC12CCC2 1986113212 YSHUGQVKNUZYDU-FUHWJXTLSA-N 435.346 4.683 50 10 IJGE BrC[C@H](NCc1cc(Br)ccc1Br)C1CCC1 2006502324 ZSYZBANOYXHJSD-ZDUSSCGKSA-N 425.990 4.865 50 10 IJGE C[C@H]1C[C@H](C(F)(F)F)N(CCCCCBr)CCN1C(=O)OC(C)(C)C 2058048110 BDORDEALMATYHR-UONOGXRCSA-N 431.337 4.814 50 10 IJGE CN(C[C@@]1(Br)CC1(F)F)c1ccc(Br)cc1CBr 2082522486 YMBRLXNWKNIZGY-NSHDSACASA-N 447.943 4.953 50 10 IJGE COC[C@]1([C@@H](Br)c2ccc(Br)cc2Br)CCCO1 2083317481 GSZNPULJLKRXLK-STQMWFEESA-N 442.973 4.843 50 10 IJGE CC(C)(C)OC(=O)NCCCC[S@](C)(=O)=NC[C@H](CBr)c1ccccc1 2110302294 IBTSWBJYBMNEKD-QLXKLKPCSA-N 447.439 4.568 50 10 IJGE Clc1cc(CBr)ccc1N1CC[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2129054974 QODNIQRYVZTZMY-NHCUHLMSSA-N 435.793 4.715 50 10 IJGE O=C(N[C@@H]1CN(Cc2ccccc2)CC2(CCC2)C1)c1ccc(CBr)cc1 2151129165 YPYMCDVVBCBWKH-NRFANRHFSA-N 427.386 4.756 50 10 IJGE O=C(NC[C@H]1CCCC[C@@H](Cl)C1)c1cc(Cl)ccc1I 2163753134 FXVYDARRJQNUMY-WDEREUQCSA-N 426.125 4.862 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@H](CBr)CC(F)(F)F)cc1Br 2167384494 OMPCCFJECSDRHS-QMMMGPOBSA-N 437.481 4.857 50 10 IJGE BrCc1c(N2[C@H]3CCC[C@@H]2CN(Cc2ccccc2)C3)nc2sccn12 2226318663 ILAQUCZICMKAOP-CALCHBBNSA-N 431.403 4.534 50 10 IJGE C[C@H](Br)CN(CC(C)(C)C)C(=O)c1cccc(I)c1 2272438857 NUVHFTKZMFRVRN-NSHDSACASA-N 438.147 4.563 50 10 IJGE Cc1ccc(I)c(C(=O)N(C[C@@H](C)Br)C(C)(C)C)c1 2272458502 YFHTZMRCJZDRMM-LLVKDONJSA-N 438.147 4.624 50 10 IJGE CCc1nc(C(=O)N(C[C@@H](C)Br)CC(C)(C)C)c(Br)s1 2288050233 VIVZZPMRMYBGPX-SECBINFHSA-N 426.218 4.740 50 10 IJGE Cn1cc(I)c(C[C@H]2CCCCCCC[C@H]2Br)n1 2319223064 JGKIONGHLUQFTK-VXGBXAGGSA-N 425.152 4.691 50 10 IJGE C[C@H](Br)CN(C(=O)c1sccc1I)C1CCCC1 2320012405 KLCIEXXDDJMEJV-VIFPVBQESA-N 442.160 4.521 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3C)n2)cc1 2331276519 JCNUQLYKWNNHRD-UHFFFAOYSA-N 438.421 4.893 50 10 IJGE FC(F)(CBr)C(F)(F)CNCc1ccc(Cl)cc1Br 2336537560 YDSXBQGBSNCTMX-UHFFFAOYSA-N 427.461 4.858 50 10 IJGE CCCOc1ccc(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1Br 14647363 DXMCJSUNIUGBBQ-UHFFFAOYSA-N 433.346 4.610 50 10 IJGE CCOc1cc(Br)c(/C=C(\C#N)C(=O)Nc2ccccc2F)cc1OCC 59117179 CQYLKNLTBBAMFY-NTEUORMPSA-N 433.277 4.931 50 10 IJGE C=CCNC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccc(OCCC)c(C)c1 102859510 VUSPGMLRWBYKLC-PGMHBOJBSA-N 426.520 4.846 50 10 IJGE C[C@@H]1C[C@H](Br)CN(C(=O)c2cc(Br)c(Br)s2)C1 401884282 DPULGXTZYWNBKB-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE CCC[C@H](NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1cccc(C(F)(F)F)c1 726798199 ZVASEKKLPIGHDR-SFHVURJKSA-N 432.446 4.683 50 10 IJGE O=C(NNc1ccc(Br)c(F)c1)c1cc2c(Br)cccc2[nH]1 771678789 LWOYPKPEGVFOJY-UHFFFAOYSA-N 427.071 4.589 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)O[C@H]([C@@H]2CCOC2)C(F)(F)F)c(C)n1-c1ccc(F)cc1 778021179 DKANOAVUZYSBQW-YBBBUGGBSA-N 436.405 4.651 50 10 IJGE CN(C[C@@H]1CC=CCC1)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 784316495 ASXPKPPGLVYRIZ-WRDGEJPTSA-N 433.943 4.839 50 10 IJGE C[C@H](NC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)c1cc2ccccc2o1 786270835 RKRMHBCFFLEGLG-INIZCTEOSA-N 447.466 4.856 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1S[C@@H](C)C(=O)NN=C(C)CCCC 1084303898 SRVZZPFQXNNDHA-INIZCTEOSA-N 449.024 4.893 50 10 IJGE CCc1ccc(OCC(=O)NN=Cc2cccc(C(F)(F)F)c2)c(Br)c1 1084352250 GBMYVARLQRGHAR-UHFFFAOYSA-N 429.236 4.559 50 10 IJGE C/C(=C\C(=O)NNc1nc2ccccc2c(=O)n1-c1ccc(C(C)C)cc1)c1ccco1 1293481954 WBLZFUGPLLSRFA-BMRADRMJSA-N 428.492 4.649 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNc2ncc(Br)cc2C)cc1 1451970725 TVQXKCMXFQLZJC-UHFFFAOYSA-N 439.313 4.856 50 10 IJGE C#C[C@@H](NC(=O)NNc1cc(C(F)(F)F)ccc1F)c1ccc(Br)cc1 1683508434 SKGJWKGTWKZULD-CQSZACIVSA-N 430.199 4.608 50 10 IJGE COc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc(C)cc1)CCC2 1772745076 RORABKUFRWKZKG-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE CCN(CC)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(C)cc2)cc1 1865702339 TTXUNIWHYCWLGP-XMMPIXPASA-N 427.552 4.613 50 10 IJGE CCc1nn(C)c2c1[C@@H](c1c(OCc3ccccc3)ccc3ccccc13)C(C#N)=C(N)O2 1865704131 OBNBOPYUQFNQBU-XMMPIXPASA-N 436.515 4.933 50 10 IJGE CCn1nc(C(F)(F)F)c2c1OC(N)=C(C#N)[C@@H]2c1cccc(OCc2ccccc2)c1 1865712219 SLKBUZVDODSWTG-SFHVURJKSA-N 440.425 4.719 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](OCc2cccc(Cl)c2Cl)[C@H](Br)C1 1901218499 MRVYWXMIXDUAKW-YPMHNXCESA-N 425.150 4.893 50 10 IJGE COc1ccc(Br)c(C(=O)N(Cc2ccccc2)[C@@H](C)CBr)c1 1914228665 OBMJSYHJKUZKBB-ZDUSSCGKSA-N 441.163 4.884 50 10 IJGE FC(F)(F)[C@H](CBr)NCc1cccc(Br)c1Br 1943883992 NIZQFMNNBWJVLN-QMMMGPOBSA-N 439.895 4.627 50 10 IJGE C[C@@H]1CN(Cc2ccc(CBr)cc2)C[C@@H](C)N1C(=O)OCc1ccccc1 2011641014 MWVJBFKXXQHUFR-QZTJIDSGSA-N 431.374 4.813 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1cccc(OCc2ccccc2)c1 2023034521 VNNWEXSJDHXSKE-HNAYVOBHSA-N 437.321 4.845 50 10 IJGE COc1c(C)cc([C@H](Br)c2cc(I)sn2)cc1C 2056488628 XHNSWNBZENKXCF-LBPRGKRZSA-N 438.128 4.857 50 10 IJGE BrC[C@@H]1[C@H]2CC[C@H](C2)N1Cc1c(Br)cccc1Br 2058365661 BOKPGIFLSKRLLJ-IMSIIYSGSA-N 438.001 4.959 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@@]1(C)CBr 2086658265 LYGXXIJSFMADQY-IINYFYTJSA-N 442.566 4.798 50 10 IJGE CC1(C)C[C@@H](NC(=O)OC(C)(C)C)CN(C[C@H](CBr)c2ccccc2)C1 2106787361 IKVJCLLUXOXBEO-ZWKOTPCHSA-N 425.411 4.790 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@]12C[C@H]1CN(Cc1ccccc1)C2 2155872536 JWIKGTZHSLESFV-KKSFZXQISA-N 445.792 4.515 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(c2ccccc2)CCN(C[C@@H](CBr)CC2CC2)C1 2169167156 UQJZLNFMWKDYJN-XMSQKQJNSA-N 437.422 4.924 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2[C@]12C[C@@H]1CN(Cc1ccccc1)C2 2202302271 YDQGLZKXJFWAPY-VFNWGFHPSA-N 446.776 4.777 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@@H](Br)[C@H]1[C@H]2COC[C@H]21 2213488774 ICCPIPVVMUGZFA-HBNNVMOKSA-N 428.921 4.679 50 10 IJGE F[C@@H]1COCC[C@H]1n1c(CCl)nc2cc(Br)c(Br)cc21 2234073221 JEGSJHGWRRJIIF-MWLCHTKSSA-N 426.511 4.600 50 10 IJGE Cc1c(Br)cccc1CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1Br 2243596334 HWSXCAXEWKASPF-LSDHHAIUSA-N 449.183 4.657 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2C(F)(F)C23CC3)cc1I 2257359083 WNWZEQKMXQMWJA-GHMZBOCLSA-N 429.042 4.781 50 10 IJGE CCO[C@@H]1CC[C@H]([C@@H](Br)c2ccc(OC)c(I)c2)C1 2269535966 XLNIHQDJUFWZHF-JVLSTEMRSA-N 439.131 4.941 50 10 IJGE Cc1cccc(O[C@@H]2C[C@H](Br)[C@@H]2OCC(C)C)c1I 2277946472 CGCURKNDODTQLK-LNSITVRQSA-N 439.131 4.555 50 10 IJGE C[C@H](Br)[C@H](NC(=O)c1cc(F)c(Br)cc1Cl)C(F)(F)F 2282966614 HHSANAZDQUHLRF-IGJIYHIXSA-N 441.444 4.686 50 10 IJGE Cc1cc(F)c(CBr)c(N2CC[C@H]3COC[C@@H](C2)N3Cc2ccccc2)c1 2283376564 JVUQNYUAUPCLTK-RBUKOAKNSA-N 433.365 4.509 50 10 IJGE CC(C)CCN(CCCl)C(=O)Cc1cc(Br)cc(Br)c1 2295310500 XQKROGRLQWOHQG-UHFFFAOYSA-N 425.592 4.868 50 10 IJGE CC1(C)C[C@](C)(CBr)CN1Cc1sccc1I 2301068319 KLLVOSCRAJDOGD-CYBMUJFWSA-N 428.177 4.738 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1Cc1cc(I)ccc1Cl 2307325698 CUXYIVOXAKIUAA-SKDRFNHKSA-N 428.539 4.692 50 10 IJGE BrC[C@H]1C[C@@H]2CC[C@H]1N2Cc1cc(Br)ccc1Br 2309796172 MZYRRXFRWMTFOW-LJWDBELGSA-N 438.001 4.959 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cc(Cl)cc(Cl)c1O 2320558351 NTHVTTZQIUZASV-CQSZACIVSA-N 447.156 4.799 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NN=Cc1ccc2c(c1)OCO2 2321242368 VDBCANMDXYBBQN-UHFFFAOYSA-N 428.275 4.856 50 10 IJGE O=C1C(=Cc2ccc(Br)cc2)Oc2cc(OC(=O)C(Cl)Cl)ccc21 2323752227 KGJBTUHKSVHFNH-UHFFFAOYSA-N 428.065 4.774 50 10 IJGE C[C@H]1CC[C@H](CCl)N(Cc2ccc(I)c(Br)c2)C1 2325226316 NHOUTCWKVCWZPN-CMPLNLGQSA-N 442.566 4.893 50 10 IJGE ClC[C@@H](CNCc1ccc(I)c(Br)c1)C1CCC1 2325226491 PDQPBODHJXNMLT-LBPRGKRZSA-N 442.566 4.798 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2CCN(C[C@H](CBr)c3ccccc3)C[C@H]21 2361359785 DOZGHCKPDULXKU-HSALFYBXSA-N 437.422 4.887 50 10 IJGE COc1c(Br)cc(C)c([C@H](Cl)[C@@H]2OCCO[C@@H]2C)c1Br 2365176958 VFGIHRPNCXTFSB-OXHMUOHRSA-N 428.548 4.612 50 10 IJGE FC(F)(F)[C@@]1(CCl)CCN(Cc2cc(I)ccc2Cl)C1 2380521950 JNCKWHWBCGKHBE-GFCCVEGCSA-N 438.058 4.938 50 10 IJGE N#C/C(=C\c1ccccc1)C(=O)/N=C1\N=C2C=CC(Br)=CN2Cc2ccccc21 3167109 MBYPKLKLWSLERW-XAMYHVALSA-N 443.304 4.587 50 10 IJGE COc1ccc(CNC(=O)/C(C#N)=C\c2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)o2)cc1 6645148 WEBLOQSIAVQSFD-YBEGLDIGSA-N 437.839 4.740 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](CC)C(=O)NNC(=O)COc1ccccc1C(C)C 10682351 CSLVROZOCBEZMT-GHTZIAJQSA-N 426.557 4.707 50 10 IJGE O=C(CSc1nc2ccccc2s1)N/N=C(/c1ccccc1)[C@H](O)c1ccccc1 32519867 COGXMSGESSQJQK-GRKCXVTJSA-N 433.558 4.643 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccco4)ccc32)cc1OCC 38679164 CWEVJSSVSRLELP-HSZRJFAPSA-N 446.459 4.514 50 10 IJGE CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)OCCC(C)C)cc2)cc1OC 40858354 XJAFNHQITCYHKX-XSFVSMFZSA-N 436.508 4.842 50 10 IJGE COc1cccc(/C=N/NC(=O)c2cc(Br)ccc2OCc2ccccc2)c1 96095901 GBRHOYLCGXYFCH-ZVHZXABRSA-N 439.309 4.801 50 10 IJGE CCCOc1ccc(/C=C(/C#N)C(=O)Nc2sc3c(c2C(=O)OC)CC[C@@H](C)C3)cc1 108861714 QAZWLLKETFBKJL-WIZMWCRPSA-N 438.549 4.994 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C/c2cn(-c3ccccc3)nc2-c2ccc(C)cc2)C1=O 214216560 MJTWKPVDLODIFQ-HAHDFKILSA-N 436.515 4.850 50 10 IJGE CC(C)[C@H](CCBr)NC(=O)c1cc(Br)sc1Br 231122329 XTGVONKXZRDKAZ-QMMMGPOBSA-N 448.018 4.813 50 10 IJGE CC(C)(C)C[C@H](CBr)NS(=O)(=O)c1ccc(Cl)c(Br)c1 393462080 AHCMFAMTAHSZSC-SECBINFHSA-N 447.620 4.581 50 10 IJGE ClCCc1nc2c(Br)cccc2n1[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 398461389 RWNOGRNXURRPPZ-JIPZTSHUSA-N 430.777 4.883 50 10 IJGE BrCC1C[C@@H]2CC[C@H](C1)N2c1ncc(Br)cc1Br 719151049 WXRLOHHQUVULAD-UQPYNNQESA-N 438.989 4.749 50 10 IJGE C=CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NNc1nc2cc(Cl)ccc2cc1C 1546169301 QHBHDNHGXJIPDZ-KRWDZBQOSA-N 432.952 4.889 50 10 IJGE C/C(=C/c1ccc(F)cc1)C(=O)NNc1c(Br)cccc1Br 1568131096 SBEVMBTZXJSQQF-KTKRTIGZSA-N 428.099 4.897 50 10 IJGE CCOc1ccc(OCC(=O)NNC(=O)c2ccc(-c3ccc4ccccc4c3)s2)cc1 1860391606 QTALHWJWVNFBHV-UHFFFAOYSA-N 446.528 4.807 50 10 IJGE COc1ccc2ccccc2c1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccc(C)cc1 1865687814 AYDZEUALCNWONJ-RUZDIDTESA-N 436.515 4.928 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNC(=O)c2ccccc2SCC(C)C)c(C)n1 1865759984 AXBSOVXJOCXPDZ-UHFFFAOYSA-N 449.576 4.889 50 10 IJGE C[C@H](c1ccc(F)cc1Br)[C@@H](CBr)NC(=O)OC(C)(C)C 1885095653 CPUPHWLPTCEMSQ-NOZJJQNGSA-N 425.136 4.980 50 10 IJGE C[C@@H](CCCl)N(Cc1ccccc1)C(=O)c1ccc(I)cc1 1915079277 AFHSIWKVBZPHMA-AWEZNQCLSA-N 427.713 4.951 50 10 IJGE CN(C[C@]1(C(C)(C)C)CC[C@@](C)(CI)O1)C(=O)OC(C)(C)C 1929974650 KJBZKPUYMUXCCM-IRXDYDNUSA-N 425.351 4.642 50 10 IJGE CCO[C@@H](C)C(CBr)(CBr)c1ccc(Br)cc1 1941147730 DTAJKMYLVGACRT-JTQLQIEISA-N 428.990 4.902 50 10 IJGE C[C@@H]1C[C@@H]1N(CCBr)Cc1cccc(Br)c1Br 2002027624 VHJIVPKVHRNLDM-SKDRFNHKSA-N 425.990 4.817 50 10 IJGE C[C@H]1[C@@H](C)N(C(=O)OC(C)(C)C)C[C@@H](C)N1C[C@@H](CBr)c1ccccc1 2106788816 SVYYGBOWSDMZMZ-SFNKJDCFSA-N 425.411 4.883 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN(C[C@@H](CBr)CC2CC2)C1 2112870045 ZGLHYTBCQUCLKP-CEXWTWQISA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCN(C[C@H](CBr)c3ccccc3)C2)C1 2163324582 HPBZFSRDRXZHOG-UGKGYDQZSA-N 437.422 4.888 50 10 IJGE O=C(c1c(Cl)cccc1Br)N1CCC([C@@H](F)CBr)CC1 2169466660 RWLCSMMYJFKHEV-LBPRGKRZSA-N 427.539 4.688 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](OCc2ccc(Cl)cc2Cl)[C@H](Br)C1 2212516491 ODMSPLISTHWROF-OCCSQVGLSA-N 425.150 4.893 50 10 IJGE CN(C[C@@H]1CC1(Br)Br)C1(CBr)CC2(CCC2)C1 2213092443 VLEJTPIAPPAFNY-JTQLQIEISA-N 430.022 4.522 50 10 IJGE O=[N+]([O-])c1cc(Br)c(Br)cc1NC[C@H]1C[C@H](Br)C1 2218662141 QITJUVAEXBIVJG-LJGSYFOKSA-N 442.933 4.705 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)c2nn(C)nc2Br)c(C)c1Cl 2226973833 DKPKOPGGHKRHDQ-SNVBAGLBSA-N 427.955 4.939 50 10 IJGE CC1CC(CBr)(CN2CCCC[C@@H](C3CN(C(=O)OC(C)(C)C)C3)C2)C1 2265304402 OVILUZKRMVWBIN-BQIYRTECSA-N 429.443 4.767 50 10 IJGE COc1ccc(Br)cc1C=NNC(=O)COc1ccc(C(C)(C)C)cc1C 2297707889 WFBBANQQEBFYJB-UHFFFAOYSA-N 433.346 4.593 50 10 IJGE O=C(CSCc1cccc(Br)c1)NN=Cc1ccccc1C(F)(F)F 2297709341 OPIDCNBDAGJLOZ-UHFFFAOYSA-N 431.277 4.851 50 10 IJGE O=S1(=O)C[C@@H]2[C@H]([C@H](Cl)c3cc(Br)ccc3OCc3ccccc3)[C@@H]2C1 2314488988 GKAQSVDDISJPDZ-UKBAYJJMSA-N 441.774 4.599 50 10 IJGE C[C@@H]1CCCN(Cc2ccc(Cl)cc2I)[C@H]1CBr 2318529892 WFQLNXRNJQCLIR-YGRLFVJLSA-N 442.566 4.940 50 10 IJGE Clc1ccc(I)cc1COc1ccnc(CBr)c1 2327237189 IHOVPKVNXCFIOI-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE O=C(NCC(F)(F)C(F)(F)CBr)c1scc(Br)c1Cl 2336530440 WKGHDDSXQHXJBQ-UHFFFAOYSA-N 447.473 4.559 50 10 IJGE O=C(N[C@H]1C[C@@H]2C[C@H]1C[C@@H]2Br)c1cc(F)c(Br)cc1Cl 2359286122 JUORDSVHTGFGKE-LOSGYTSQSA-N 425.523 4.533 50 10 IJGE CC(C)CO[C@@H]1[C@@H](Cl)C[C@@H]1OCc1cc(I)ccc1Cl 2380343036 OWBMMHKZDWFKQE-SOUVJXGZSA-N 429.125 4.882 50 10 IJGE COc1ccc([C@@H](C(=O)NC2CCCCC2)N(C(=O)CCl)c2ccc(C)cc2)cc1 3035299 CZIXLHOOLIYHDR-QHCPKHFHSA-N 428.960 4.766 50 10 IJGE aggregator Cc1ccc([C@@H](C(=O)NC2CCCCC2)N(CCc2ccccc2)C(=O)CCl)cc1 4672252 AARGQCWCSZUQJV-DEOSSOPVSA-N 426.988 4.795 50 10 IJGE CCCCCCOc1ccc(/C=N\NC(=O)c2ccc3nc(N)sc3c2)cc1OC 169916926 DVBIRLJPRHLRSM-OYKKKHCWSA-N 426.542 4.610 50 10 IJGE O=C(NC[C@@]12CCC[C@H]1CN(Cc1ccccc1)C2)c1ccc(CBr)cc1 312894531 XHUYYRGMCWQIDS-JTHBVZDNSA-N 427.386 4.614 50 10 IJGE C[C@@H]1C[C@H](CBr)CN(Cc2cc(Cl)ccc2I)C1 405311053 TWZOESHBFIOMKV-GHMZBOCLSA-N 442.566 4.798 50 10 IJGE FC(F)Oc1cc(C(F)(F)F)cc(I)c1CBr 575723815 YGYYAQUQUMQWFC-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE C[C@@H](NC(=O)c1cc(Br)cc(Br)c1)C1(CBr)CC1 696076754 QMIGYVRDPZGLLC-MRVPVSSYSA-N 439.973 4.505 50 10 IJGE CCOc1ccc(/C=C(/C#N)C(=O)N2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1 726536924 IWNMZEVJNAZBCB-PQDCBLBRSA-N 446.482 4.588 50 10 IJGE CC[C@H](C)c1ccc([C@@H](NC(=O)NNC(=O)c2ccc(OC)cc2OC)C(C)C)cc1 730021026 GMOCITROQKTEGF-AOMKIAJQSA-N 427.545 4.559 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])cc1Br)c1cccc(OCc2cscn2)c1 739300075 GXSQXQKBCNRIBS-UHFFFAOYSA-N 435.255 4.612 50 10 IJGE CC(C)C[C@H]1CCN(C(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)C1 744639744 GIRDZDNTYQMUBG-JZQBQCRLSA-N 435.959 4.919 50 10 IJGE Cc1cc(C)nc(NNC(=O)Nc2ccc(Oc3nncc4ccccc34)c(Cl)c2)n1 770074319 VPLFORNFXHIKLR-UHFFFAOYSA-N 435.875 4.631 50 10 IJGE Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NNc1ccc(C#N)cc1C(F)(F)F 799751900 UYXDANYSRMROGQ-UHFFFAOYSA-N 447.848 4.719 50 10 IJGE N#Cc1ccc(NNC(=O)C(=O)Nc2ccc3oc4ccccc4c3c2)c(C(F)(F)F)c1 799840873 PMUILJFTZAWINP-UHFFFAOYSA-N 438.365 4.558 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)CCCSc2nc3ccccc3n2CC)cc1 1083891751 KQBGPILBPDQQSV-UHFFFAOYSA-N 437.613 4.925 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2cc(C)ccc2Oc2ccccc2)cc1 1310400077 MJCTYZMCAWWSAH-GOSISDBHSA-N 447.491 4.610 50 10 IJGE C=CCn1c(SCC(=O)NNc2cccc(Cl)c2C)nnc1-c1ccc(Cl)cc1 1446473735 YYKOUQDNEVVFRQ-UHFFFAOYSA-N 448.379 4.982 50 10 IJGE O=C(N/N=C1\O[C]2C=Cc3ccccc3C2=C[C@H]1C(=O)Nc1ccccc1)c1ccccc1 1615016779 SAHGUMOFHCEFTJ-DQHMDIJASA-N 434.475 4.657 50 10 IJGE COc1ccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4ccc(C)c(C)c4)c(C)c32)cc1 1772746452 VCQRPOHCCUMTQX-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE O=C(NNC(=O)c1ccc(-c2ccc3ccccc3c2)s1)c1ccc(Br)o1 1860391763 TWGJFZQXSOFBRS-UHFFFAOYSA-N 441.306 4.999 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2)[C@H]1c1ccccc1Cl 1865685541 KEEYYFNXPMNJGQ-INIZCTEOSA-N 430.817 4.822 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)c3c2[C@@H](c2cccs2)C(C#N)=C(N)O3)cc1 1865697755 AXIAPNRSYIZOJV-HXUWFJFHSA-N 426.501 4.828 50 10 IJGE N#C/C(=C(/O)CNC(=O)c1ccccc1)c1nc(-c2ccc(Br)cc2)cs1 1872746382 FLGCTCIGBGQREI-VLGSPTGOSA-N 440.322 4.795 50 10 IJGE CC(C)[C@@H](CCNC(=O)OC(C)(C)C)CCC(=O)N(C)CC1CC(Br)C1 1887828811 AZRJJIMFZSVWPH-AQFXKWCLSA-N 433.431 4.586 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]3(CCC[C@@H](CI)O3)CC[C@H]21 1935705001 BJUPSZIDYHZWDY-FSZRXZPDSA-N 435.346 4.539 50 10 IJGE C[C@H]1CO[C@](CBr)(Cc2c(Br)cccc2Br)C1 1945328215 ZUPKTDPCKNBPBE-RNCFNFMXSA-N 426.974 4.944 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]2(CC[C@](C)(CI)O2)C12CCCCC2 1989553206 SEPMXSCCPPPNKU-AEFFLSMTSA-N 435.346 4.683 50 10 IJGE CC(C)[C@H](Br)[C@@H](C)NC(=O)c1scc(Br)c1Br 1997062660 JHZJOJPMMJIBJY-SVRRBLITSA-N 448.018 4.811 50 10 IJGE COc1ccc([C@@H](Br)C2(Br)CC2)c(OC)c1Br 2002807385 UCEPJLJUXQJKEN-LLVKDONJSA-N 428.946 4.830 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1Br)c1cccc(Br)c1Br 2031486281 MGLKXGMFYIXLSH-MWLCHTKSSA-N 439.973 4.648 50 10 IJGE C[C@H](CCCBr)CNC(=O)c1c(Br)cccc1Br 2033086269 KIVNFONOOCPUBL-SECBINFHSA-N 441.989 4.753 50 10 IJGE O=C(NCC1CCN(C[C@H](CBr)c2ccccc2)CC1)OCc1ccccc1 2044706605 VNPLQRMMLLDIFZ-QFIPXVFZSA-N 445.401 4.804 50 10 IJGE Brc1cccc(Br)c1CN1CC[C@@H](Br)[C@@H]1C1CC1 2067014902 FENHIIRXWTXIOA-KGLIPLIRSA-N 438.001 4.959 50 10 IJGE COC[C@H](C)CCO[C@H](CI)c1cccc(Br)c1 2067237643 NEWSXHSNHXGODG-BXUZGUMPSA-N 427.120 4.614 50 10 IJGE Clc1cc(CN2CCC[C@@H](CCBr)C2)ccc1I 2086659845 ZHWKWTHINQTJHR-NSHDSACASA-N 442.566 4.942 50 10 IJGE ClCc1ccc(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)cc1Br 2129055642 RSNYEAPEDALTIK-SFTDATJTSA-N 435.793 4.668 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CCNC(=O)[C@H](Br)C1CCCC1)c1ccccc1 2167049219 VSZWFIWCTSEHBM-ZWKOTPCHSA-N 439.394 4.712 50 10 IJGE C[C@@H](c1nscc1Br)N(C)c1cc(CBr)sc1[N+](=O)[O-] 2186580482 JUBKXACYEXYEAY-LURJTMIESA-N 441.170 4.968 50 10 IJGE C[C@@H](c1nscc1Br)n1c(CCl)nc2cc(Br)cnc21 2186646387 KSSCLBZEVUDMLC-LURJTMIESA-N 436.560 4.761 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Br)[C@]12COC[C@H]1C2(F)F 2202999826 RPAAAVVQTOAOLF-USWWRNFRSA-N 432.486 4.829 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)S(=O)(=O)Cc1ccc(Br)cc1 2213761180 RPFFERPYTIYXHC-GOSISDBHSA-N 430.795 4.799 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@]2(F)CCC[C@]2(CBr)C1 2279176821 XTDIEIXQHWWQSD-QWHCGFSZSA-N 445.579 4.893 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@H]2C[C@H](Br)C[C@H]1C2 2282974230 GCDDMSLKLLKZMI-XHNCKOQMSA-N 425.523 4.630 50 10 IJGE Cc1cc(F)c(CBr)c(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)c1 2283531299 JQFNTUHXFIVVCF-VXKWHMMOSA-N 433.365 4.509 50 10 IJGE CS(=O)(=O)c1cscc1[C@H](Br)c1cc(F)c(Br)cc1F 2288501987 WSDAQQIYEKOKOP-GFCCVEGCSA-N 446.132 4.677 50 10 IJGE CC(=O)Nc1cccc(Oc2cc(C)nc(C3CCN(C(=O)[C@H](Cl)C(C)C)CC3)n2)c1 2296578202 NMYDBQVMMMYKCZ-OAQYLSRUSA-N 444.963 4.505 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=C(C#N)C(=O)Nc3cc([N+](=O)[O-])ccc3F)o2)cc1 2297551640 WHNDJRMKBNBGTK-UHFFFAOYSA-N 449.394 4.716 50 10 IJGE FC1(F)[C@H]2C[C@@](CBr)(Cc3sccc3I)C[C@H]21 2301052798 KMVVHOAFJXQNEE-AKZRSSKFSA-N 433.099 4.952 50 10 IJGE CC1(C)COC[C@@]1(CBr)Cc1ccc(I)c(Cl)c1 2314642723 GQBVXFQEQPSWLM-AWEZNQCLSA-N 443.550 4.925 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)cc2I)C[C@@H]1CBr 2318541434 TVTSSTJNDQPGAZ-NSHDSACASA-N 442.566 4.798 50 10 IJGE O=C([C@@H](Br)Cc1ccccc1Cl)N1CCN(CC=Cc2ccccc2)CC1 2329368645 QVXGCPCDYGKHNF-FQEVSTJZSA-N 447.804 4.504 50 10 IJGE CCC[C@H](NC(=O)C=C(CC)c1ccc(OC)cc1)C(=O)Nc1ccc(SC#N)cc1 2329548381 OTHODYGKDMIJBB-QFIPXVFZSA-N 437.565 4.985 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@@H]1CCC[C@@]2(C1)CC2(F)F 2343419447 ZVABWCUJHVWNDV-ZHALLVOQSA-N 430.333 4.689 50 10 IJGE Cc1cc(OC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccncc2)CCC3)ccc1Cl 40814056 NNTNAFISXVTXTN-NLRVBDNBSA-N 437.883 4.634 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@@H]2C)oc2c1/C(=N/NC(=O)Cc1ccccc1)CCC2 40815725 DGVNGPQEJHHBDB-ZCZMWGMNSA-N 441.531 4.579 50 10 IJGE O=C(CCCNc1ccc(Br)cc1)N/N=C/c1c(O)ccc2ccccc12 59507565 VZCXLABAPMKCEH-ZVHZXABRSA-N 426.314 4.650 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1Br)c1cc(Br)c(Br)s1 122898450 KKLKHICNKNHMPV-POYBYMJQSA-N 446.002 4.709 50 10 IJGE CCC[C@H](Br)CNC(=O)c1cc(Br)ccc1Br 161242068 UVLQXOJDPUUTAY-VIFPVBQESA-N 427.962 4.505 50 10 IJGE CC[C@@H](NC(=O)/C(C#N)=C\N1CCN(c2cccc(C)c2)CC1)c1ccc2c(c1)CCCC2 217192374 AMNIGJUDPRMYRK-QKJHWXITSA-N 442.607 4.671 50 10 IJGE Cc1ccc(OCC(=O)NN=Cc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c([N+](=O)[O-])c1 254483670 MGAIPRFZCQWDSG-UHFFFAOYSA-N 441.528 4.733 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CI)[C@@H](c2ccc(Cl)c(F)c2)C1 382738645 YLGBHXMTISRGIP-VXGBXAGGSA-N 439.696 4.865 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CCl)c1Cl)N1CC[C@@H](OCc2ccccc2)C1 383887082 IDAJMMLCEJHCBL-MRXNPFEDSA-N 434.772 4.712 50 10 IJGE CC(C)(C)[C@@H](CBr)NC(=O)c1ccc(Br)cc1Br 393955803 ILGLGNDYPVDOJT-LLVKDONJSA-N 441.989 4.751 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@@H]1C(C)(C)[C@]21CCC[C@@H](CI)O1 686236029 GMRUYJCMOIJXDX-HRLGVUPISA-N 449.373 4.785 50 10 IJGE Cc1ccc(NNC(=O)N[C@@H](C)c2nc(-c3ccc(Br)cc3)cs2)nc1 763718518 XDMNBAIFVHBPGB-LBPRGKRZSA-N 432.347 4.663 50 10 IJGE N#Cc1ccc(NNC(=O)C23C[C@H]4C[C@@H](CC(Br)(C4)C2)C3)c(C(F)(F)F)c1 799746785 QOOSRYGVKSDVGS-LGBHXNNWSA-N 442.279 4.754 50 10 IJGE CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N1CCC[C@@H](O[Si](C)(C)C(C)(C)C)C1 1275312953 BZBRXLNCZNYHAP-IRLDBZIGSA-N 430.665 4.535 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(Oc3cccc(C)c3)cc2)cc1 1562123748 YIGSOTJQEKAOML-GOSISDBHSA-N 447.491 4.610 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@]23CCC[C@@H](CI)O3)C1 1918346846 NZJDOOKFNPRUBB-BMGDILEWSA-N 435.346 4.540 50 10 IJGE CC(C)N1C[C@@H](Br)[C@H](Cc2c(Br)cccc2Br)C1 2039261357 GWOGMNADIGZCIV-QMTHXVAHSA-N 440.017 4.858 50 10 IJGE Brc1ccc(Br)c(CN2C[C@@H]3C[C@H](C[C@@H]3Br)C2)c1 2054722240 PUKRVIMVBFMDBH-BFVZDQMLSA-N 438.001 4.817 50 10 IJGE COc1cccc(F)c1Cn1nc(CBr)c(Br)c1C(F)(F)F 2079233362 TVTWPYPFKYRNHW-UHFFFAOYSA-N 446.036 4.755 50 10 IJGE Cl[C@@H]1C[C@H]2CC[C@H]1[C@H](Nc1ncc(I)cc1Br)C2 2084033126 AXHPTANUXYYODA-COYOAVQYSA-N 441.538 4.657 50 10 IJGE Clc1cc(CN2C[C@@H]3C[C@H](C[C@@H]3Br)C2)ccc1I 2086662247 STBODYRACSFOMK-WOPDTQHZSA-N 440.550 4.550 50 10 IJGE CN(Cc1ccccc1)C(C)(C)Cn1c(CCCl)nc2cncc(Br)c21 2095440537 ZEBNUSBWJOBZHV-UHFFFAOYSA-N 435.797 4.886 50 10 IJGE CCC[C@@H](CBr)CN1CC[C@](NC(=O)OC(C)(C)C)(c2ccccc2)C1 2106783141 XFNARTGVMCBXKB-LAUBAEHRSA-N 425.411 4.924 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@H]1CCCCN1C[C@H](CBr)CC1CC1 2128727782 ZDMFFFOIEASYIU-JKSUJKDBSA-N 439.385 4.812 50 10 IJGE Brc1ccc([C@@H](Br)[C@H]2CCn3ncnc3C2)c(Br)c1 2138874468 WNFDRFCNOZNGDM-SDBXPKJASA-N 449.972 4.502 50 10 IJGE O=C(N[C@@H]1CCCN(C[C@@H](CBr)c2ccccc2)C1)OCc1ccccc1 2253195066 NSEBIJXSQXJURZ-NHCUHLMSSA-N 431.374 4.556 50 10 IJGE COc1ccc([C@H](Br)C[C@H]2CCO[C@@H]2C)cc1I 2257356996 MLLNLTDNCOVDGB-CKYFFXLPSA-N 425.104 4.551 50 10 IJGE CN(Cc1ccccc1I)c1c(F)cccc1CBr 2265528897 FZMXDAKDJMZQLH-UHFFFAOYSA-N 434.090 4.962 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1CN(CC1CC1)CC1(CBr)CC(F)C1 2265632326 MFJBTPVSUHAHSR-OHTSDLOESA-N 433.406 4.611 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(O[C@H]2C[C@H]3CC[C@H](C3)C2)C1 2299587479 RFFHPKYENXLARC-RCJHGTSTSA-N 449.373 4.786 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@H](Cc2ccc(C)cc2)C(=O)N1c1ccc(C(C)C)cc1 2314593253 KEYVVOBFMOIQSP-HSZRJFAPSA-N 445.588 4.847 50 10 IJGE COC[C@]1(C)C[C@@]1(CBr)Cc1ccc(Cl)cc1I 2318546613 UPFDGTDFYPRGCK-UONOGXRCSA-N 443.550 4.925 50 10 IJGE C=CC[C@@](C)(CCl)CNCc1ccc(I)c(Br)c1 2325212757 PZEPHAYYZYCQHQ-AWEZNQCLSA-N 442.566 4.965 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)C(C#N)=CNc1cccc2c(O)cccc12 2325306855 CKKWURJIWLPYTE-UHFFFAOYSA-N 429.476 4.960 50 10 IJGE CC(C)C[C@@H](CBr)CN=[S@]1(=O)CCN(C(=O)OC(C)(C)C)CC1(C)C 2328518708 JDDRLQOEWILHEM-MQNRADLISA-N 439.460 4.541 50 10 IJGE CN(Cc1ccc(Cl)cc1I)[C@H](CCCl)C(F)(F)F 2341042879 OYYKHLNMGRLVQH-LLVKDONJSA-N 426.047 4.936 50 10 IJGE FC1(F)C[C@]12C[C@@H]2CO[C@H](CI)c1ccc(Br)cc1 2352459480 QRHZDLJSLKNEGN-RTXFEEFZSA-N 443.069 4.987 50 10 IJGE ClCCCN(Cc1ccc(Cl)cc1I)C1CCOCC1 2381145826 FGWZDVYPYMWTBD-UHFFFAOYSA-N 428.141 4.555 50 10 IJGE C=CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccs4)ccc32)cc1 38658090 RCQXJYVTGRADHZ-QFIPXVFZSA-N 430.485 4.750 50 10 IJGE Oc1nc2ccc([C@H](Br)c3ccc(I)cc3)cc2o1 40285817 WFBZVWOYXIANED-CYBMUJFWSA-N 430.039 4.622 50 10 IJGE C/C(CC(=O)Nc1cccc(Cl)c1Cl)=N\NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 100981251 IPOTWRJIIMIPQL-LSFURLLWSA-N 443.674 4.690 50 10 IJGE O=[N+]([O-])c1ccc(C[C@H](Br)c2cccc(I)c2)cc1 104185112 DEFVDILNMXBXGN-AWEZNQCLSA-N 432.055 4.878 50 10 IJGE O=C(Nc1cccc(CCCBr)c1)c1ccc(I)cc1 139439501 ULRCGJZIUKZHNH-UHFFFAOYSA-N 444.110 4.871 50 10 IJGE CCCOc1c(OC)cc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)cc1OC 169890024 IADPAECWPJVHEW-YSMPRRRNSA-N 435.524 4.617 50 10 IJGE COc1ccc(Cc2nc3cc(C(=O)N/N=C\c4ccccc4Cl)ccc3[nH]2)cc1OC 169925460 WADBYWNACIGBIB-WGARJPEWSA-N 448.910 4.588 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)COc2cc(C)ccc2C(C)C)cc1 207135807 ZPMVDCXLJZCGLE-QNGOZBTKSA-N 434.536 4.926 50 10 IJGE O=C(NCCCCCCCl)c1cc(Br)ccc1I 236014733 PWGPSOWVSAQAQH-UHFFFAOYSA-N 444.538 4.583 50 10 IJGE O=C(CCCC[C@@H]1CCSS1)N1CC[C@H](Oc2ccc(Br)cn2)C1 238880069 PAKFIFACLCZADJ-LSDHHAIUSA-N 431.421 4.538 50 10 IJGE COc1ccc(Cl)cc1[C@@H]1CN(Cc2ccccc2)C[C@@H]1CI 382685134 FAUYSQJURSLDAN-MAUKXSAKSA-N 441.740 4.999 50 10 IJGE Cc1cc(CCl)cc(S(=O)(=O)N(Cc2ccccc2)C2CC2)c1Br 383530516 AUGJOQTUYJDCTG-UHFFFAOYSA-N 428.779 4.850 50 10 IJGE BrCc1cc(Br)c(OCC[C@@H]2CCOC2)c(Br)c1 400546728 MLOHOUWRGKNFQV-VIFPVBQESA-N 442.973 4.912 50 10 IJGE C[C@H]1CCN(Cc2cc(Cl)ccc2I)C[C@@H]1Br 405345549 PWQOHZCAJDYLTA-CABZTGNLSA-N 428.539 4.550 50 10 IJGE FC(F)c1cc(Br)c(CBr)cc1I 575685033 IVSAVLBGPROCPA-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE C#Cc1ccc(NC(=O)NNc2cccc(OC(F)F)c2Br)c(Cl)c1 1209905827 PENZJIRQLCMYDT-UHFFFAOYSA-N 430.636 4.834 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNC(=O)Cc2cccc3ccccc23)cc1 1290485696 DSGPHWMFMPEXDI-UHFFFAOYSA-N 437.499 4.790 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNc2cccc3c2OC(F)(F)O3)cc1 1300741668 FUXNMMXITVXSLO-UHFFFAOYSA-N 425.391 4.711 50 10 IJGE Cc1c([C@@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CBr)cccc1[N+](=O)[O-] 1614630302 QATJJLYVXRCVBI-SJLPKXTDSA-N 433.302 4.650 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2c(-c3ccc(Cl)c(Cl)c3)noc2C)c1 1651317939 YHKSTQWLJVYBOH-UHFFFAOYSA-N 445.331 4.570 50 10 IJGE CC(=O)c1cccc(NC(=O)[C@H](Br)Cc2ccccc2Br)c1 1858181656 XWBAYYKCLZQDHY-MRXNPFEDSA-N 425.120 4.596 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2F)[C@H]1c1cccc(O)c1 1865681387 LZRHXISQMXYRLQ-QFIPXVFZSA-N 438.462 4.661 50 10 IJGE CCCOc1c(OC)cccc1[C@H]1C(C#N)=C(N)Oc2c1c(CC)nn2-c1ccc(C)cc1 1865694311 WMUTUARWJLWZCI-QFIPXVFZSA-N 444.535 4.759 50 10 IJGE C[C@H](NC(=O)c1ccccc1OCc1ccccc1)c1nnc(CBr)s1 1877571371 OHLUBGLSLGRBGK-ZDUSSCGKSA-N 432.343 4.503 50 10 IJGE O[C@H](c1c(Br)sc(Br)c1Cl)[C@H]1C[C@@H]1Br 1893036705 UWZVKAPYZTWNHI-XCXIMHFFSA-N 425.367 4.743 50 10 IJGE Cn1nc(Br)c(Br)c1[C@@H](Br)Cc1cccs1 1900972204 VQGCELFPHGTXSI-ZETCQYMHSA-N 428.975 4.685 50 10 IJGE C[C@@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1c(Cl)cccc1Br 1914664284 QXLINPUWLRIRRK-GFCCVEGCSA-N 437.186 4.921 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)S(=O)(=O)c1cc(F)ccc1Cl 1915094890 OSTWIJXOYOFZRS-CYBMUJFWSA-N 434.758 4.844 50 10 IJGE C[C@@H](CCBr)N(C)C(=O)c1scc(Br)c1Br 1917083389 BHPQKZQDBJMSPU-LURJTMIESA-N 433.991 4.519 50 10 IJGE O=C(NCCCCCBr)c1csc(Br)c1Br 1937739060 XXDBJAYFWCGPBT-UHFFFAOYSA-N 433.991 4.568 50 10 IJGE CC[C@H](C)[C@H](Br)CNC(=O)c1cc(Br)c(Br)s1 1942802875 HMRCODBNKSTQPO-POYBYMJQSA-N 448.018 4.813 50 10 IJGE O=C(NC[C@H]1CCC[C@@H]1Br)c1csc(Br)c1Br 1945189508 RYEOCAKRGNQBDK-SVRRBLITSA-N 446.002 4.567 50 10 IJGE CC[C@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@H]1Br 2026563380 JOBNCRMMKBCHIK-WDEREUQCSA-N 428.539 4.550 50 10 IJGE ClCCN(c1ncc(I)cc1Br)C1CCCCC1 2069526610 YFTDQOMXCSLZFM-UHFFFAOYSA-N 443.554 4.827 50 10 IJGE CCN1CCC[C@@H]([C@H](Br)c2cccc(OCc3ccccc3)c2)S1(=O)=O 2089516901 ZSKHJEQLCAPDAB-VQTJNVASSA-N 438.387 4.516 50 10 IJGE CCc1nn(-c2c(F)cccc2CBr)c(CC)c1I 2093914792 FUYSVKYMAGKLPQ-UHFFFAOYSA-N 437.094 4.636 50 10 IJGE CC(C)[C@@H](Br)C(=O)N1C[C@@H](C)N(C(=O)OC(C)(C)C)Cc2ccccc21 2106773345 RQKJUKQHGWUIRX-RHSMWYFYSA-N 425.367 4.578 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1cccc(OC(F)F)n1 2125359614 PJOHSLQZLTXLDY-MRXNPFEDSA-N 427.289 4.745 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCN(C[C@@H](CBr)c2ccccc2)C1 2163059728 WBOHJCZUIAFWPK-VAMGGRTRSA-N 437.422 4.887 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCN(C[C@H](CBr)c3ccccc3)C2)CC1 2163324863 HNZVGNXJPYQZDB-IBGZPJMESA-N 437.422 4.888 50 10 IJGE Fc1cc(Br)cc(F)c1CO[C@H](CCl)[C@@H](Br)CCl 2259032465 ODBSTDOFKINZQN-GZMMTYOYSA-N 426.910 4.854 50 10 IJGE CCCN(C[C@H](C)Cl)S(=O)(=O)c1cc(Br)c(C)cc1Br 2288052264 LPLYHWWXCAHDGC-JTQLQIEISA-N 447.620 4.548 50 10 IJGE Clc1ccc(CN(CCBr)CC2CC2)cc1I 2300241457 ZMSOYRFTAUIKJI-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE Clc1ccc(CN[C@H](CCBr)C2CC2)c(I)c1 2302337654 ZLGOWOLGYBJYIP-CYBMUJFWSA-N 428.539 4.598 50 10 IJGE CO[C@@H]1C[C@@H](Cl)C[C@H]1Cc1ccc(I)c(Br)c1 2306199756 PPFCXQBDAFPXJS-GBIKHYSHSA-N 429.523 4.629 50 10 IJGE CCC[C@@H](CCCl)NCc1ccc(I)c(Br)c1 2306224498 QWYRTTUAKLVQIS-NSHDSACASA-N 430.555 4.941 50 10 IJGE FC(F)(F)[C@@H](Br)COCc1cc(I)ccc1Cl 2307218292 AXOZMDPUBQFJSW-VIFPVBQESA-N 443.428 4.787 50 10 IJGE CC(C)[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]1C(F)(F)F 2309540102 MHVPIROERSSLMB-IHRRRGAJSA-N 431.337 4.526 50 10 IJGE CC[C@@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@@H]1CBr 2315548976 MWGFVAHWOHDOAU-NEPJUHHUSA-N 442.566 4.798 50 10 IJGE CCCO[C@@H]1[C@H](Cl)C[C@H]1Oc1cc(Br)cc(I)c1 2316756542 FYLPXYGNKMRONM-JHJVBQTASA-N 445.522 4.607 50 10 IJGE O=[N+]([O-])c1cc(OCc2cccc(I)c2)ccc1CBr 2367526336 IYDKFRCHMKLECH-UHFFFAOYSA-N 448.054 4.673 50 10 IJGE CCCOc1ccc(/C=C2/C(=O)N(Cc3ccccc3)C(=O)C(C#N)=C2C)cc1OCC 38605965 DPJBLJICCQZSHZ-KGENOOAVSA-N 430.504 4.667 50 10 IJGE COc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(Cl)cc1 38651288 BWALUABXMCYCFR-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE Cc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)NCc3ccccc3Cl)c(C)c21 40811448 IBUKFUBHTPLELJ-VFCFBJKWSA-N 449.938 4.950 50 10 IJGE O=C(CSc1nc(-c2ccc(Cl)cc2)cs1)N/N=C/c1ccccc1[N+](=O)[O-] 40924690 PKCULTIFQDFPNG-AWQFTUOYSA-N 432.914 4.614 50 10 IJGE CCc1cc(Br)ccc1OCC(=O)N/N=C/c1ccc(Cl)cc1Cl 40959775 CSOIUITXPWBJEQ-ZVBGSRNCSA-N 430.129 4.847 50 10 IJGE O=C(Oc1ccc(/C=N/NC(=O)C2CCCCC2)cc1)c1cccc(Br)c1 48572400 HCRBHTUGLFMEBL-OEAKJJBVSA-N 429.314 4.699 50 10 IJGE CC(=NNC(=O)[C@]1(C)CC1(Br)Br)c1ccc(Cl)cc1Cl 263627778 YSOJURILHBNSTH-LBPRGKRZSA-N 442.966 4.730 50 10 IJGE COc1ccc([C@@H](Br)c2sccc2I)cc1OC 311199746 HNBVJXUVPNCNPB-GFCCVEGCSA-N 439.112 4.854 50 10 IJGE O=C(NC[C@H](Br)C1CCC1)c1cc(Br)ccc1Br 315926732 WQHHFMOPBCHBJX-LBPRGKRZSA-N 439.973 4.505 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc3c(F)cc(Br)cc3[nH]2)c(C(F)(F)F)c1 799749632 WNGSRDAGTCFXDJ-UHFFFAOYSA-N 441.182 4.717 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] 1148231795 WJUCHSSLRBNDEJ-UHFFFAOYSA-N 447.476 4.536 50 10 IJGE Cc1cc(Cl)ccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccn1)CCC2 1772746994 KBGGPMWEFGQRAD-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE COc1cccc(-c2ccc(C(=O)N/N=C\c3c(Cl)nc4scc(C)n34)c(C)n2)c1 1865761687 QJVDWFWTOGVMOL-RMORIDSASA-N 439.928 4.501 50 10 IJGE O=C(Oc1cccc2c1C(=O)OC2=O)c1cccc(COc2ccc3c(c2)CCCC3)c1 1865790452 JGHUVXFWMPXUTC-UHFFFAOYSA-N 428.440 4.674 50 10 IJGE Cc1ccc(-c2csc(/C(C#N)=C(\O)c3ccc(NS(C)(=O)=O)cc3)n2)c(C)c1 1872748543 BSYMVDYFVUIWRV-ZZEZOPTASA-N 425.535 4.748 50 10 IJGE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1cccc(OCc2ccccc2)c1 1873793224 DGZWDAUXGMARBL-VSQKZVHOSA-N 439.556 4.655 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Cl)CCc1cccc(Br)c1Cl 1905406110 RKUKMIYCVWVFGP-GFCCVEGCSA-N 427.125 4.939 50 10 IJGE O=C(CBr)c1c(Br)sc(Br)c1Br 1924568843 MNJZQYIZHUBCGC-UHFFFAOYSA-N 441.764 4.613 50 10 IJGE CN(C[C@@]1(C(C)(C)C)CCC[C@H](CI)O1)C(=O)OC(C)(C)C 1929975170 PCISIVFRMKTFOE-CXAGYDPISA-N 425.351 4.642 50 10 IJGE CN(C(=O)c1csc(Br)c1Br)C(C)(C)CBr 1937737908 MYVAUCGKWRRWEU-UHFFFAOYSA-N 433.991 4.519 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CCS[C@@H](CCBr)C1 1950317009 VLOYPFWASJFLCT-HNNXBMFYSA-N 426.401 4.670 50 10 IJGE CN(Cc1cc(Br)ccc1Br)C[C@H]1C[C@H](Br)C1 2020202030 WKNVMXHDCAPPPR-OTCDBFHCSA-N 425.990 4.817 50 10 IJGE O=S(=O)(c1cc(F)c(Cl)c(CCl)c1)N(Cc1ccccc1)CC(F)(F)F 2095874768 ZKEGKHLRUOKANL-UHFFFAOYSA-N 430.250 4.971 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(C[C@@H](CBr)c2ccccc2)C1 2106783966 DZAIFUQVHXZPOU-QXAKKESOSA-N 425.411 4.790 50 10 IJGE CCOc1ccc(S(=O)(=O)N(Cc2ccccc2)C(C)(C)C)cc1CBr 2123246021 KPXUDPPBFMYQCL-UHFFFAOYSA-N 440.403 4.970 50 10 IJGE ClCc1ccc(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c(Br)c1 2129057291 UTAIQQYQKWMFPW-RTWAWAEBSA-N 435.793 4.668 50 10 IJGE CC[C@H](CBr)CN1C[C@@H](CNC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2129068459 QVYIODQJSIMUPT-QRQLOZEOSA-N 425.411 4.648 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@H](CBr)c2ccccc2)CC12CCC2 2163059444 SZYYKGOAPVAJAM-RBUKOAKNSA-N 437.422 4.792 50 10 IJGE C[C@]1([C@H](Br)c2cc(Br)c(Br)cc2F)COCCO1 2218602503 FXUNIPMIFSCJRI-VXGBXAGGSA-N 446.936 4.592 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2[C@@]12C[C@H]1CN(Cc1ccccc1)C2 2224708268 HNVQFSXSHRBAHW-VBKZILBWSA-N 434.740 4.908 50 10 IJGE CC(C)(C)OC(=O)N1[C@@H](CNC(=O)c2ccc(CBr)cc2)CCC12CCC2 2233850207 LNCQZSPRXCRGCT-QGZVFWFLSA-N 437.378 4.634 50 10 IJGE Cc1sc(C(=O)N2[C@H]3CC[C@H]2[C@@H](F)[C@@H](Br)C3)c(C)c1Br 2234464364 NHZQBBQMKMMKPM-GMOBBJLQSA-N 425.161 4.606 50 10 IJGE C[C@H]1CC[C@H](CBr)N(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282987912 KQVZLCZGCGKEHN-DTWKUNHWSA-N 427.539 4.877 50 10 IJGE CC(C)[C@H](CBr)N(C)Cc1cc(Cl)ccc1I 2302482746 NIVNFGUDFSMGAH-ZDUSSCGKSA-N 430.555 4.796 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NCc1cc(I)ccc1Cl 2307330056 JJTFRSHPEZBXJQ-NOZJJQNGSA-N 430.555 4.844 50 10 IJGE O=C(Cc1ccc(Br)cc1Cl)N[C@H](CCCl)COCc1ccccc1 2320559166 UUQOURJNONKAFD-QGZVFWFLSA-N 445.184 4.976 50 10 IJGE CCCOc1c(Cl)cc(C=NNC(=O)Cc2cc(OC)ccc2Cl)cc1OCC 2323676424 VARXAZPRXWRCHN-UHFFFAOYSA-N 439.339 4.882 50 10 IJGE FC(F)(F)c1cccc(CO[C@@H](CCl)[C@@H](I)CCl)c1 2353210948 OLTPSQLTNRCYJW-QWRGUYRKSA-N 427.031 4.872 50 10 IJGE COc1c(F)cc([C@H](Cl)c2c(Br)c(Br)nn2C)cc1F 2370447326 BONVEUPBYXUPSC-VIFPVBQESA-N 430.474 4.560 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=O)c2ccc(C)cc2)cc1Br 14640671 AVRALCPKPBJFPA-UHFFFAOYSA-N 433.346 4.791 50 10 IJGE CC(/C=C/c1ccccc1)=N\NC(=O)c1cc(Br)cc(Br)c1O 33391159 LWXGXGIPOQABBW-PLOBCEGZSA-N 438.119 4.736 50 10 IJGE CC(C)c1ccc(Nc2ncnc(NNC(=O)c3cccc(Cl)c3)c2[N+](=O)[O-])cc1 40594688 GUUZZYZLTKZXQV-UHFFFAOYSA-N 426.864 4.662 50 10 IJGE CC(C)Oc1ccc(C=NNC(=O)C(O)(c2ccccc2)c2ccccc2)c(OC(C)C)c1 254490479 TYYVVTKFVWPPJE-UHFFFAOYSA-N 446.547 4.647 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@H](c2cccc(Br)c2F)C1 382699834 XJJCVKPFXOJCRT-ZYHUDNBSSA-N 437.147 4.934 50 10 IJGE CCOc1ccc(/C=C(/C#N)C(=O)N2CCC([C@H]3C(=O)Nc4cc(Cl)ccc43)CC2)cc1 727413374 NCXOTTRJUGFDAI-IUZFBFHQSA-N 449.938 4.620 50 10 IJGE CCc1c(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cnn1-c1ccccc1Cl 799752785 TZORXHCPFIUWIX-UHFFFAOYSA-N 433.821 4.735 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)c1cc2c(s1)CCC2)c1ccc(C(F)(F)F)cc1 1224643853 VZQVYOTWRGHTLT-INIZCTEOSA-N 437.487 4.907 50 10 IJGE Cc1cc([C@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)ccc1[N+](=O)[O-] 1614641144 IDQWQYQQGNGPFB-ZWKOTPCHSA-N 433.302 4.650 50 10 IJGE C=CCNC(=S)NNC(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1 1628566451 XLOKISOQCDEJJL-UHFFFAOYSA-N 426.394 4.581 50 10 IJGE Cc1c(C(=O)Oc2cccc3ccccc23)oc2c1C(=NNC(=O)c1cccnc1)CCC2 1772746335 AMXFCWLYDLQMDD-UHFFFAOYSA-N 439.471 4.826 50 10 IJGE COc1cc(C=NNC(=O)COc2cccc(Cl)c2)ccc1OCc1ccccc1C 1772754408 UXKACIUQVRCJBC-UHFFFAOYSA-N 438.911 4.765 50 10 IJGE COc1cc(C=NNC(=O)CSc2nc(-c3ccccc3)cs2)ccc1OC(C)C 1772755241 WMWHNIHNNPADIV-UHFFFAOYSA-N 441.578 4.848 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)Cc1c(Cl)cc(F)cc1Cl 1886328511 QLQOHZHAKMBKGL-VIFPVBQESA-N 431.088 4.735 50 10 IJGE Clc1nc(Cl)n(Cc2cccc(I)c2)c1CBr 2007031500 PMJGNTFZYOFOPM-UHFFFAOYSA-N 445.913 4.738 50 10 IJGE CC(C)[C@@H](Br)CN(C)C(=O)c1c(Br)cccc1Br 2048728461 QQDGELSCPKCFIU-NSHDSACASA-N 441.989 4.703 50 10 IJGE O=S(=O)([C@@H]1CC[C@@H](CBr)C1)N(Cc1ccccc1)CC1CCCCC1 2059288533 ILARRYIARXMPMH-WOJBJXKFSA-N 428.436 4.962 50 10 IJGE C[C@]1(CBr)C[C@H](NC(=O)c2cccc(Br)c2Br)C1 2059453183 PDQOWSSQOAIUSH-XCSCGOTBSA-N 439.973 4.505 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3C[C@@H](Br)C[C@H]3C2)c1 2065397131 MBGFNMKKEMSYOC-PEGIJTEDSA-N 440.550 4.550 50 10 IJGE O=C(N[C@H]1C[C@@H](CCBr)C1)c1c(Br)cccc1Br 2078363159 DMAAYIMYTWSOTB-DTORHVGOSA-N 439.973 4.505 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1c(Br)sc(C)c1C 2081237675 ZMHWKONJPPWLRO-XVKPBYJWSA-N 444.176 4.707 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Cl)c2)CC[C@H]1CBr 2086661469 MRAFYMYFESKFHE-PWSUYJOCSA-N 442.566 4.798 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@@H](C)CN(C)Cc1ccccc1 2128514142 XGLRLANPUGBOFB-AWEZNQCLSA-N 435.797 4.977 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@@H](CBr)CC(C)(F)F)cc1Br 2169536022 QWULGUAQJQSQEI-SECBINFHSA-N 433.518 4.950 50 10 IJGE C[C@]1(CC(CBr)(CBr)c2cccc(F)c2)CSCCO1 2201227333 LZAMOXXVTVCKNM-AWEZNQCLSA-N 426.189 4.766 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@]2([C@@H](Cl)c2cc(Br)ccc2Br)C1 2201887656 XMPIOPZXAUPVHH-HERUPUMHSA-N 442.600 4.706 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Cl)c1cn(C)c(Br)n1 2264356454 MPHSMABPFDGXEG-JTQLQIEISA-N 428.939 4.935 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CCC[C@](F)(CBr)C1 2282979115 VPRYLGFMROPNOC-ZDUSSCGKSA-N 431.502 4.581 50 10 IJGE Cc1c(CBr)cccc1NC(=O)c1cccc(F)c1I 2283560165 QSEUEHFWNDNNQE-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE C[C@H](Br)C1CCN(C(=O)c2cc(Br)c(F)cc2Cl)CC1 2285843966 GTDNWIVKLWCGJA-QMMMGPOBSA-N 427.539 4.877 50 10 IJGE N#CC(=Cc1ccc(-c2ccccc2F)o1)C(=O)Nc1sc2c(c1C(N)=O)CCCC2 2296825652 OOVIRPVMISCUMT-UHFFFAOYSA-N 435.480 4.671 50 10 IJGE C[C@@H](CCBr)CCNCc1ccc(Cl)cc1I 2302325774 KBEVUJVEVDCIBB-JTQLQIEISA-N 430.555 4.845 50 10 IJGE CN(Cc1ccc(Cl)cc1I)[C@H]1CCC[C@@H]1Br 2302326662 RMIVGSBIMLAOMC-AAEUAGOBSA-N 428.539 4.692 50 10 IJGE Clc1ccc(CN2CCCC[C@@H](CBr)C2)cc1I 2315551210 NZJPUMYMYHTPBB-LBPRGKRZSA-N 442.566 4.942 50 10 IJGE CC(C)COc1cccc(C=NNC(=O)c2ccc3nc(Cc4ccccc4)[nH]c3c2)c1 2323723693 BETBGFNZSXXWAH-UHFFFAOYSA-N 426.520 4.952 50 10 IJGE CC(C)[C@H]1[C@H](Cl)CCN1Cc1ccc(I)c(Br)c1 2325210070 VBKPYQXIKBEIDX-OCCSQVGLSA-N 442.566 4.891 50 10 IJGE N#CC(=CNc1ccc(N2CCCCC2)cc1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 2325216064 YRFNACCBCKECSM-UHFFFAOYSA-N 425.876 4.697 50 10 IJGE C=CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(C)cc4)ccc32)cc1 38657986 OTUGFROPIIFLNK-RUZDIDTESA-N 438.483 4.997 50 10 IJGE COc1cc(/C=N/NC(=O)COc2cccc(C)c2C)ccc1OCc1ccc(C)cc1 40888539 XWWHXEYRMNLOBA-JFLMPSFJSA-N 432.520 4.729 50 10 IJGE O=C(N/N=C1\C(=O)N(Cc2c(Cl)cccc2Cl)c2ccccc21)c1cccs1 59154882 APVQAYMWZVMTHD-NKFKGCMQSA-N 430.316 4.736 50 10 IJGE CC(C)Cc1ccc([C@@H](C)C(=O)NNC(=O)COc2ccc(-c3ccccc3)cc2)cc1 66199335 ABIRAJFVCWRKNX-HXUWFJFHSA-N 430.548 4.882 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Cl)c3cc(Br)ccc3F)cc2[nH]1 109883915 RRRKGMIACPKZBT-ZDUSSCGKSA-N 434.490 4.849 50 10 IJGE COc1cc(C[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc(OC)c1OC 116114333 PGDHRRZSKKRHBS-UHFFFAOYSA-N 444.511 4.939 50 10 IJGE CC[C@@H](NC(=O)/C(C#N)=C\NCCc1c[nH]c2ccccc12)c1ccc2c(c1)CCCC2 217192498 OIIRPNJLLLWIGY-IVNHJSRESA-N 426.564 4.854 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OCC2CCCCC2)CC1 231315649 HHGMZRVVORNXBD-UHFFFAOYSA-N 437.362 4.788 50 10 IJGE CC(C)(C)CN(CCBr)S(=O)(=O)c1ccc(Br)cc1Cl 690941969 CGTWECMZTPMPQK-UHFFFAOYSA-N 447.620 4.534 50 10 IJGE CCCS(=O)(=O)CCC(CBr)(CBr)C1CCCCCC1 711296727 FEPOEJQMXDZPQL-UHFFFAOYSA-N 432.262 4.948 50 10 IJGE CCCCCCOc1ccc(C(=O)NN=Cc2cc(Br)c(O)c(OC)c2)cc1 1084467435 KJHQNUQBSBQEMT-UHFFFAOYSA-N 449.345 4.886 50 10 IJGE Cc1ccc(NNC(=O)CSCc2nc(O)c3c4c(sc3n2)CCCC4)c(Cl)c1 1140945311 OHERCEYASVRERK-UHFFFAOYSA-N 449.001 4.614 50 10 IJGE Cc1ccc([N+](=O)[O-])cc1[C@H]1CN(C(=O)OCc2ccccc2)C[C@H]1CBr 1614639735 TVRWHKOEACMCCP-APWZRJJASA-N 433.302 4.650 50 10 IJGE Cc1sc2nc(CCC(=O)N3CC[C@H](O[Si](C)(C)C(C)(C)C)C3)nc(O)c2c1C 1642394909 OIAPJSCNEZBCSZ-HNNXBMFYSA-N 435.666 4.569 50 10 IJGE CC(=O)c1c(C)cc(NC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cc1C 1672800793 RXIUMXWIWONEPB-UHFFFAOYSA-N 442.475 4.781 50 10 IJGE Cc1nc(-c2ccccc2)cc(N2CCC(C(=O)Nc3ccc(SC#N)cc3)CC2)n1 1859707919 ARGJSWCVPAEWDO-UHFFFAOYSA-N 429.549 4.880 50 10 IJGE CCCOc1ccc(/C=C(\C#N)c2nc(O)c3cc(OC)c(OC)cc3n2)cc1OCC 1872727588 LXCVASSSMWUGAE-MHWRWJLKSA-N 435.480 4.604 50 10 IJGE C[C@H]([C@@H]1CC[C@H](NC(=O)OC(C)(C)C)C1)[C@H](CBr)NC(=O)OC(C)(C)C 1877876789 FOAUZGZZQFOFMK-KBXIAJHMSA-N 435.403 4.604 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cccc2ncccc12 1915076665 DBTPNKIMLMSREW-KRWDZBQOSA-N 433.371 4.599 50 10 IJGE BrC[C@H]1CSCCN1Cc1cccc(Br)c1Br 1943880598 HQHAKDJCVTXGLI-JTQLQIEISA-N 444.030 4.524 50 10 IJGE CC(C)C(CCO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1I)C(C)C 1988261960 GNACSZPBVQRQAD-CVEARBPZSA-N 439.378 4.744 50 10 IJGE CCS(=O)(=O)C[C@H](Cl)c1c(Br)sc(Br)c1Cl 1988339821 POTSJXPAGCGMAP-BYPYZUCNSA-N 430.998 4.641 50 10 IJGE FC(F)(F)c1c(I)c(CCl)nn1-c1ccc(C2CC2)nc1 2078880460 ABOUEXVYUPXFTK-UHFFFAOYSA-N 427.595 4.507 50 10 IJGE Clc1cc(CN2CC[C@H](Br)[C@H]3CC[C@H]32)ccc1I 2086656018 SHTGRVROTYVGOM-UHIISALHSA-N 440.550 4.692 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@@H](Cl)C(F)(F)CC1 2093614049 NAYSCPPHCJPWLC-SSDOTTSWSA-N 437.531 4.752 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCC(F)(F)[C@H](CCl)C1 2093942622 WNBFFDURCBTIND-ZCFIWIBFSA-N 437.531 4.609 50 10 IJGE CN(CC[C@@H]1CCCCN1C(=O)[C@H](Br)C1CCCC1)C(=O)OC(C)(C)C 2110716095 UJEHDKSWXGHQSL-DLBZAZTESA-N 431.415 4.578 50 10 IJGE Fc1cccc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)c1CBr 2130158599 BGJNJPYGVXPWCW-SFHVURJKSA-N 431.271 4.974 50 10 IJGE O=C1C=C2CN(c3c(CBr)ccc(Br)c3Cl)CC[C@H]2S1 2171117444 LWFWDUWFPJSMRF-LLVKDONJSA-N 437.584 4.776 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2cc([N+](=O)[O-])ccc2CBr)C1 2176909023 PXHQLBZJHGIPSX-IAGOWNOFSA-N 432.362 4.837 50 10 IJGE Cc1c(N2C[C@@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)ccnc1CBr 2205638215 SALYZDUBQULDFU-ZRZAMGCNSA-N 426.402 4.777 50 10 IJGE CC(C)(C)OC(=O)NCCN(CCCCCI)C1CCCCC1 2211190359 MKOLHNWRZAWWMW-UHFFFAOYSA-N 438.394 4.751 50 10 IJGE CC1(CO[C@H](CCl)[C@@H](I)CCl)CC2(CC(F)(F)C2)C1 2230633481 KHAGJNDVGJLWKD-VHSXEESVSA-N 427.100 4.868 50 10 IJGE Cc1ccc([C@H](Br)c2ccc3c(c2)OCCO3)cc1I 2232834932 XMPPVZJOLMVYFL-INIZCTEOSA-N 445.094 4.855 50 10 IJGE C[C@@H](Br)CN(CCC(C)(C)C)S(=O)(=O)c1ccc(Br)s1 2288021490 ZMIBNUAPKHZNEG-SNVBAGLBSA-N 447.258 4.721 50 10 IJGE Cc1ccccc1[C@H](C)NC(=O)C(C#N)=Cc1c[nH]nc1-c1ccc(Br)cc1 2297435330 DHOWSVPAUOLUNY-HNNXBMFYSA-N 435.325 4.932 50 10 IJGE CC(C)[C@@H](CBr)N(C)C(=O)c1c(Br)cccc1Br 2318854564 OJISFPYBGPUHET-LLVKDONJSA-N 441.989 4.703 50 10 IJGE O=C(NN=Cc1ccc(OCCCc2ccccc2)cc1)c1ccc2nc(S)[nH]c2c1 2323603221 AZDGYKQTBONIEB-UHFFFAOYSA-N 430.533 4.627 50 10 IJGE Cc1ccc(C=C(C#N)C(=O)Nc2c(Br)cc(C#N)cc2Br)cc1 2329629396 CWWPMSJXTPHMSU-UHFFFAOYSA-N 445.114 4.937 50 10 IJGE O=C(CSc1nc2ccccc2[nH]1)N/N=C/c1ccccc1OCc1ccccc1F 32520587 DPGUPXLTUSTCGJ-DHRITJCHSA-N 434.496 4.523 50 10 IJGE COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3cccc(Cl)c3)ccc21 38650072 HFOKUNBRNCAJDJ-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE Cc1nn(-c2ccc([N+](=O)[O-])cc2)c(C)c1/C=N/NC(=O)[C@@H](C)c1ccc(CC(C)C)cc1 59147892 SFVGZVGTKCCASZ-AEIQVQRHSA-N 447.539 4.850 50 10 IJGE Cc1ccc2nc(-c3ccc(N/C=C(/C#N)C(=O)NCc4cccnc4)cc3)sc2c1 216852010 UAXZZZJQDXJBIQ-CYVLTUHYSA-N 425.517 4.803 50 10 IJGE C[C@H]1CCN(C(=O)c2cc(Br)c(Br)s2)[C@@H]1CBr 227178011 SQTDOBWPLOZDSV-POYBYMJQSA-N 446.002 4.519 50 10 IJGE CC(C)(C)[C@H](CCBr)NS(=O)(=O)c1ccc(Cl)c(Br)c1 231189329 BSHBVHOMQQXJFM-LBPRGKRZSA-N 447.620 4.581 50 10 IJGE CCCS(=O)(=O)CCC(CBr)(CBr)c1ccccc1Cl 233257897 PNTBHCPLEVOOTD-UHFFFAOYSA-N 446.632 4.583 50 10 IJGE Cc1ccc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CI)s1 382723990 PCJYJGUYAHIUJS-JKSUJKDBSA-N 441.334 4.844 50 10 IJGE Clc1ccc(CBr)c(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@H]32)c1 404140897 FRZMKWZBIOKUCK-RTWAWAEBSA-N 435.793 4.715 50 10 IJGE O=C(CBr)c1c(OC(F)(F)F)ccc(OC(F)F)c1Br 575687505 SSGNFYHJMJQGJJ-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1cccc([C@H]2Cc3ccccc3N(S(N)(=O)=O)C2)c1 616689679 JVALJXHXDDJOHO-FQEVSTJZSA-N 432.662 4.558 50 10 IJGE O=C(N[C@@H]1CCCC[C@H]1Br)c1scc(Br)c1Br 707811808 PQTMEJHTKNJEPA-HTRCEHHLSA-N 446.002 4.709 50 10 IJGE COCc1nc(-c2ccc(I)c(Br)c2)oc1CCl 721323302 LGCBABMLKWGDMP-UHFFFAOYSA-N 442.478 4.594 50 10 IJGE O=C(NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1cc(C2CCCCC2)[nH]n1 804209679 IYCRROWLIXFNSI-UHFFFAOYSA-N 430.434 4.690 50 10 IJGE Cc1cccc(C)c1-n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(c3ccccc3)CC2)c1C 1083984706 HEOCNVPXSNMBMV-XIEYBQDHSA-N 438.575 4.967 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@H]1C[C@H]1c1ccccc1C(F)(F)F 1087457736 UNBOXUFZONZSJQ-RYUDHWBXSA-N 433.308 4.879 50 10 IJGE C/C(=C/C(=O)NNc1c(F)cc(F)cc1Br)c1ccccc1OC(F)F 1136982625 OQBSZDRNXGJIDW-TWGQIWQCSA-N 433.199 4.875 50 10 IJGE Cc1c([C@@H](NC(=O)NNC(=O)c2ccc(Br)cc2)C(C)C)oc2ccccc12 1338942328 JILGPCUTHGZRIC-SFHVURJKSA-N 444.329 4.845 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(CCC)nn3Cc2ccccc2)c1 1865693250 IPKCYIWAYBPWGE-QHCPKHFHSA-N 428.536 4.891 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@@H](c1ccc(C(=O)O)cc1)C(C#N)=C(N)O2 1865708727 DVVFUMVWUXKWAP-QFIPXVFZSA-N 436.471 4.504 50 10 IJGE Cc1ccc(S(=O)(=O)NC/C(O)=C(\C#N)c2nc(-c3ccc(C)cc3C)cs2)cc1 1872748663 HUOYVSAZCIMIOU-VZCXRCSSSA-N 439.562 4.507 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](C2CCN(CC3(CBr)CCCC3)CC2)C1 1879198938 RUYJGPBDMSQCLH-GOSISDBHSA-N 429.443 4.911 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CC[C@H]2[C@H](CCN2C(=O)OC(C)(C)C)C1 1882086690 DKDNOIRHHSBGMX-FPCVCCKLSA-N 447.414 4.700 50 10 IJGE BrC[C@@H](CC1CC1)NCc1ccc(Br)cc1Br 1943840223 CQYWWGZUXQGHGW-GFCCVEGCSA-N 425.990 4.865 50 10 IJGE FC(F)(F)[C@@H](CBr)NCc1cc(Br)ccc1Br 2006501133 SFBGJBCTPYNUSF-SECBINFHSA-N 439.895 4.627 50 10 IJGE C[C@]1(NC(=O)c2cc(Br)c(Br)s2)CCC[C@H]1Br 2011556958 VMVAAXMPVNLRNL-KCJUWKMLSA-N 446.002 4.709 50 10 IJGE C[C@@H]1CO[C@@](CBr)(Cc2ccc(I)c(Cl)c2)C1 2026563465 KIDUIYOPAFYDLC-TVQRCGJNSA-N 429.523 4.677 50 10 IJGE Cc1sc([C@@H](Br)c2ccsc2S(C)(=O)=O)cc1Br 2033136137 PEDYKCQHHDHLOP-JTQLQIEISA-N 430.208 4.768 50 10 IJGE CCC[C@@H](CBr)CNC(=O)c1c(Br)cccc1Br 2057116250 AIFSHQBCLJZXCK-VIFPVBQESA-N 441.989 4.753 50 10 IJGE COCC1(CO[C@]2(CBr)CCCN(C(=O)OC(C)(C)C)C2)CCCCC1 2094486670 KBVWIQNHAVMKRX-FQEVSTJZSA-N 434.415 4.765 50 10 IJGE CCC[C@@H](CBr)CN1CC[C@@](NC(=O)OC(C)(C)C)(c2ccccc2)C1 2106783143 XFNARTGVMCBXKB-UWJYYQICSA-N 425.411 4.924 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]1(C(F)(F)F)CCCN1CC1(CBr)CCCC1 2106787192 HSIQWNUNCUNBED-QGZVFWFLSA-N 443.348 4.863 50 10 IJGE CN(C(=O)OC(C)(C)C)C1CCC2(CCCN2C[C@@H](Br)C(F)(F)F)CC1 2111602796 KWBXVGHUDLTAFR-XOYHFGRZSA-N 443.348 4.956 50 10 IJGE Clc1ccc(CBr)c(N2CC[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1 2129053628 NSBLYIFLBWEXJK-NHCUHLMSSA-N 435.793 4.715 50 10 IJGE CC[C@@H]1CC[C@H]([C@@H](Br)c2cc(I)cc3c2OCC3)O1 2136704934 BPYCWLKWAILPJM-BNOWGMLFSA-N 437.115 4.620 50 10 IJGE CN(c1ccc(CBr)cc1[N+](=O)[O-])[C@@H]1CN(Cc2ccccc2)C(C)(C)C1 2154833919 YLTUOJWXXYPYEK-SFHVURJKSA-N 432.362 4.979 50 10 IJGE Cn1nc([C@@H](Br)c2ccc3c(c2Br)CCO3)c(Cl)c1Cl 2238063299 OAIOFSCGEUMXEE-JTQLQIEISA-N 440.950 4.909 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)C2CCOCC2)c1 2252836210 ZLSYWIWYWASWIS-ZDUSSCGKSA-N 426.974 4.944 50 10 IJGE COCC1([C@H](Br)Cc2cc(Br)cc(Br)c2)CC1 2252836895 HYLVRHGJWVIVHN-GFCCVEGCSA-N 426.974 4.944 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)c1cc(F)c(NC(=O)OC(C)(C)C)cc1F 2268190963 QXRXZIWFDLLOCT-XYPYZODXSA-N 433.293 4.557 50 10 IJGE COc1ccc([C@H](Br)C2CC3(CCCO3)C2)cc1I 2269538256 CBHXFQZSRYCHQJ-WPBUFGDCSA-N 437.115 4.695 50 10 IJGE COc1ccc(C=C(C#N)C(=O)C(C)(C)C)cc1Cn1nc(C)c(Br)c1C 2295727138 CMFDRQJLCKZETQ-UHFFFAOYSA-N 430.346 4.842 50 10 IJGE O=S1(=O)CCC[C@@H]1[C@H](Cl)c1cc(Br)ccc1OCc1ccccc1 2299535626 REMBCTNSMVZDLK-QZTJIDSGSA-N 429.763 4.885 50 10 IJGE COc1cccc(-c2nn(-c3ccccc3)cc2C=C(C#N)C(=O)NCc2ccccc2)c1 2314476104 IVLCIWCWHZUHPR-UHFFFAOYSA-N 434.499 4.771 50 10 IJGE Clc1ccc(CN2C[C@H]3CC[C@H]2C[C@H]3Br)cc1I 2315551281 PBBVSDYPIQYGNX-GRYCIOLGSA-N 440.550 4.692 50 10 IJGE C[C@H](c1ccccn1)[C@@H](Br)c1c(Br)c(Br)nn1C 2316718525 USXNRZFXXBFURM-VXNVDRBHSA-N 437.961 4.580 50 10 IJGE CC(C)[C@@H]1C[C@H](Br)CN1Cc1cc(Cl)ccc1I 2321506975 FBUZEEVHNMTZHN-FZMZJTMJSA-N 442.566 4.938 50 10 IJGE Cl[C@@H]1C[C@@H]2C[C@H]1C[C@H]2NCc1ccc(I)c(Br)c1 2325231835 XGUNBOJZCMPMPQ-BQSGVUBFSA-N 440.550 4.549 50 10 IJGE N#CC(=Cc1cc(Br)c(O)c(Br)c1O)c1ccccc1[N+](=O)[O-] 2331066154 QUOYBOMTVRYUGX-UHFFFAOYSA-N 440.047 4.595 50 10 IJGE COc1cc(Cl)c(C)cc1-c1csc(C(C#N)=C(O)[C@@H]2CC(=O)N(C(C)C)C2)n1 2331390427 KSFQYNPKFNJPIU-CYBMUJFWSA-N 431.945 4.830 50 10 IJGE CCOc1ccc(CCC(=O)Nc2sc(C(C)=CC#N)c(C)c2C(=O)OC)cc1OC 2331562110 GQHBLOWUWVAYHC-UHFFFAOYSA-N 442.537 4.749 50 10 IJGE CCCCC(=O)Nc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2[C@H](C)CC)cc1 9873990 NWCMILZYRUSGCF-QZTJIDSGSA-N 439.556 4.557 50 10 IJGE CC[C@H](C)c1nc(N2CCN(C(=O)CCCl)CC2)c2c3c(sc2n1)C[C@H](C)CC3 35865715 YPNDOAIXAOVHJE-CABCVRRESA-N 435.037 4.607 50 10 IJGE CCn1nc(C)c2nc(CCl)n(-c3ccc(Br)cc3Br)c21 98042313 AQPHBMZUYVCPGS-UHFFFAOYSA-N 432.547 4.814 50 10 IJGE CC1=C(C#N)C(=O)N([C@@H](C)c2ccccc2)C(=O)/C1=C/Nc1ccc(Br)cc1 101232594 VXZNAFIPCBDSAV-NPRIEWAGSA-N 436.309 4.715 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)/C(C#N)=C\NCc1ccccc1Br 217187495 AGSCIJKIDCIKNH-IYWFSZBXSA-N 442.357 4.531 50 10 IJGE CC(C)S(=O)(=O)CCC(CBr)(CBr)c1cccc(Cl)c1 232696822 XLYNNMJXBZRWFD-UHFFFAOYSA-N 446.632 4.581 50 10 IJGE CC(=NNC(=O)CSc1nnc(-c2ccccc2)n1-c1ccccc1)c1cccs1 254312691 PFPGXBMCWLFUDN-UHFFFAOYSA-N 433.562 4.628 50 10 IJGE CCCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)COc3ccccc3C)cc2)cc1 254905194 SIOTUDNWSAQWKY-UHFFFAOYSA-N 446.503 4.532 50 10 IJGE CC[C@H](NC(=O)c1cc(I)ccc1Br)[C@H](Cl)CC 313086558 CFOIEXDZUFMYCF-NEPJUHHUSA-N 444.538 4.580 50 10 IJGE C[C@@H](CCCBr)CNC(=O)c1cc(Br)ccc1Br 384363485 IEFVMKDMRVFUQF-VIFPVBQESA-N 441.989 4.753 50 10 IJGE FC(F)(F)c1c(Br)ccc(I)c1CBr 575696321 UMIVXVXEAAFGRU-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE Cc1ccccc1NC(=O)C(=O)NN=Cc1cc(C)n(-c2ccc(Cl)cc2Cl)c1C 725422309 LTDJADAMHAIOSF-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCc2cc(Cl)ccc2OCC#N)c1C 735333367 YROHSDKIMGSFRR-JJLFXSABSA-N 441.915 4.519 50 10 IJGE O=C(NNc1nc(O)c2ccccc2n1)c1sc2cc(Br)ccc2c1Cl 758310525 GIWBRQJINISSPG-UHFFFAOYSA-N 449.717 4.723 50 10 IJGE O=C(NCc1ccc(-c2ccc(Cl)cc2)cc1F)NNC(=O)c1cccc2cccnc12 767137894 LWOZTIOLVNYRRN-UHFFFAOYSA-N 448.885 4.839 50 10 IJGE Cc1ccsc1CCNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1 773668401 DZRUMGHFFODGMS-AQTBWJFISA-N 449.967 4.753 50 10 IJGE O=C(Nc1ccc2c(c1)OC1(CCCC1)O2)C(=O)NN(c1ccccc1)c1ccccc1 782820754 FXDRYPBGHYBTML-UHFFFAOYSA-N 429.476 4.536 50 10 IJGE CCOCCOc1c(Cl)cccc1NC(=O)NNc1ccc(C#N)cc1C(F)(F)F 799394753 HWCYOVKMWOZZMQ-UHFFFAOYSA-N 442.825 4.794 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)Oc2ccc(-c3nnco3)cc2)c(C)n1-c1ccc(F)cc1 904536838 DKQXIRSBBSTFKU-XDHOZWIPSA-N 428.423 4.796 50 10 IJGE CCOc1cccc(C=NNC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)c1O 1084141126 LYWFEZRDNZSWQJ-UHFFFAOYSA-N 432.520 4.646 50 10 IJGE CCOc1ccc2ccccc2c1C=NNC(=O)COc1cccc(Br)c1 1772754265 UMUUJHHQYFYGHT-UHFFFAOYSA-N 427.298 4.530 50 10 IJGE C[C@H](Br)C(=O)c1cc(I)cc(SC(F)(F)F)c1 1848425878 LVELSUPFBWRAQL-YFKPBYRVSA-N 439.034 4.869 50 10 IJGE Cc1ccc(CCCC(=O)NNC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)c(C)c1 1865756882 BMQXNSKNNXQDFB-UHFFFAOYSA-N 437.490 4.736 50 10 IJGE C[C@H](Br)CN(C(=O)c1csc(Br)c1Br)C1CC1 1945187114 RMCKHMXCUQXUBT-LURJTMIESA-N 446.002 4.661 50 10 IJGE Cc1nn(C)c([C@@H](Br)c2ccc(Br)s2)c1Br 1989610876 ZEZIDXABVROURX-VIFPVBQESA-N 428.975 4.799 50 10 IJGE Brc1cccc(Br)c1C[C@@H]1CCOCC[C@@H]1Br 2001024586 TUDTUGKQUXOYNZ-ONGXEEELSA-N 426.974 4.944 50 10 IJGE Cc1cc(Br)ccc1S(=O)(=O)N(Cc1ccccc1)[C@H](C)CCCl 2025939315 OPXVYKRRDAYCJR-OAHLLOKOSA-N 430.795 4.966 50 10 IJGE C[C@H]1OCC[C@]1(CBr)Cc1ccc(I)c(Cl)c1 2026569922 ODKKYBPNSDMUSJ-NOZJJQNGSA-N 429.523 4.677 50 10 IJGE CC[C@H](Br)[C@H]1CCCCN1C(=O)c1csc(I)c1 2051077545 FRBBJSFJCSPMTK-WDEREUQCSA-N 442.160 4.521 50 10 IJGE Fc1cscc1[C@H](Br)c1cc(I)cc2c1OCC2 2055674297 ASQWVTFDIJUGRW-GFCCVEGCSA-N 439.087 4.911 50 10 IJGE FC(F)Oc1c(CBr)cc(I)cc1OC(F)(F)F 2060220858 GBGUMQMNBVEMTM-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE CC[C@H](C)[C@@H](CBr)NC(=O)c1cc(Br)ccc1Br 2081236859 SUFHBTFZCIJLGP-QPUJVOFHSA-N 441.989 4.751 50 10 IJGE C[C@@H]1CCN(CCCCCCCCCBr)[C@H](C)[C@H]1NC(=O)C(F)(F)F 2106781288 GRBYZIQDTRJVBD-OAGGEKHMSA-N 429.365 4.889 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@]23CCC[C@@]2(CN(C[C@H](CBr)CC2CC2)C3)C1 2112867113 UZYGOTNILHDMDF-DZFGPLHGSA-N 427.427 4.521 50 10 IJGE CC1(CC(CBr)(CBr)C2CCCCCC2)CS(=O)(=O)C1 2153386243 MSDCHTFBHJACDC-UHFFFAOYSA-N 430.246 4.558 50 10 IJGE CN(C(=O)c1ccc(I)c(Cl)c1)[C@H](CCCl)C(F)(F)F 2178514282 AWUGKJFDYOOSDG-SNVBAGLBSA-N 440.030 4.576 50 10 IJGE O=C(NC[C@@]12CCC[C@@H]1CCN2Cc1ccccc1)c1ccc(CBr)cc1 2197370471 QSKHWXXYIBNLBJ-GGAORHGYSA-N 427.386 4.756 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CC[C@@H](C(F)(F)CCl)C1 2197757850 XCLCBBKFYDRUSE-MRVPVSSYSA-N 431.502 4.548 50 10 IJGE C[C@@H](Cl)c1nc2cc(I)ccc2n1C[C@@]1(Cl)CC1(F)F 2205572243 KRGDUHVTYOEVOI-KRTXAFLBSA-N 431.051 4.957 50 10 IJGE Cc1c(Br)csc1C(=O)N1C[C@@]2(F)CCC[C@@]2(CBr)C1 2234508772 WXEJUKRRGJOQPR-KGLIPLIRSA-N 425.161 4.548 50 10 IJGE Cn1nc(CN2C[C@@H](Br)CC23CCCCC3)c(Br)c1Cl 2241053242 ARMVCLWFUDUYTG-JTQLQIEISA-N 425.596 4.508 50 10 IJGE CCOc1cc(C=C(C#N)c2nc3cc(C)c(C)cc3[nH]2)ccc1OCC(=O)N1CCCC1 2297380195 PYAVLCYUVLGXMU-UHFFFAOYSA-N 444.535 4.644 50 10 IJGE Cc1cccn2c(=O)c(C=C(C#N)c3nc4ccccc4s3)c(N3CCCCC3)nc12 2297461749 RHWOKQHQEQZJBH-UHFFFAOYSA-N 427.533 4.667 50 10 IJGE FC(F)(F)[C@@H](Br)COCc1ccc(Cl)cc1I 2301810108 IBJCLYSGKLNDIZ-VIFPVBQESA-N 443.428 4.787 50 10 IJGE BrC[C@H]1[C@@H]2CC[C@@H](C2)N1Cc1ccc(Br)cc1Br 2310100066 YWDCFVZHITUXKP-LQJRIPTKSA-N 438.001 4.959 50 10 IJGE Cc1ccc(COc2ccc(C=C(C#N)C(=O)N3CCN(c4ccccc4)CC3)cc2)cc1 2313566795 AMHQPTAKWDHROL-UHFFFAOYSA-N 437.543 4.830 50 10 IJGE FC1(F)CC[C@H]1CO[C@@H](CI)c1ccccc1Br 2313738098 WYJWAKBSWKZMPU-CABZTGNLSA-N 431.058 4.987 50 10 IJGE CCN1C(=O)C(=Cc2ccc(OCc3ccccc3Cl)c(OC)c2)C(C)=C(C#N)C1=O 2314610392 HNUORLRKNNOHBH-UHFFFAOYSA-N 436.895 4.540 50 10 IJGE CCc1ccc([C@@H](Br)c2c(Br)c(Br)nn2C)cc1 2316717515 JTQZXPYQBUCVMH-SNVBAGLBSA-N 436.973 4.992 50 10 IJGE C[C@H](Br)[C@@H]1CCCN(Cc2cc(I)ccc2Cl)C1 2327403116 LVGWVNVVWKCSGB-WDEREUQCSA-N 442.566 4.940 50 10 IJGE CC[C@H](C)c1ccccc1OCC(=O)NNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 13980334 YBVNWALWQPDDRT-UONOGXRCSA-N 439.339 4.501 50 10 IJGE C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)C(c1ccccc1)c1ccccc1 14665730 GZKMZAPMWXBWNK-LJQANCHMSA-N 430.548 4.731 50 10 IJGE COC(=O)c1ccc(C)c(-n2c(C)cc(/C=N/NC(=O)c3cc4ccccc4o3)c2C)c1 59305083 LRDGUBRQKGQAGX-VULFUBBASA-N 429.476 4.699 50 10 IJGE c1ccc(P(c2ccccc2)[C@H]2CNC[C@H]2P(c2ccccc2)c2ccccc2)cc1 108866612 YMRKZKDKJJCIHH-HNRBIFIRSA-N 439.479 4.593 50 10 IJGE COc1cc(C[C@@H](Br)C(=O)C(C)C)c(Br)cc1Br 234893849 CRWCMSYFYGYHHM-LLVKDONJSA-N 442.973 4.751 50 10 IJGE Cc1ccccc1C(=O)Nc1ccc(C(=O)NN=Cc2cc([N+](=O)[O-])ccc2Cl)cc1 252462595 UPQIADXSAJFCIV-UHFFFAOYSA-N 436.855 4.573 50 10 IJGE ClCc1cc2cc(I)sc2cc1I 306606945 HRRQESFCUPSHHE-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE O=C(c1c(F)cc(Br)cc1F)N(CCBr)Cc1ccccc1 309836333 MBNKDLZILXQTEW-UHFFFAOYSA-N 433.090 4.765 50 10 IJGE C[C@@]1(CBr)CCN(C(=O)c2cc(Br)sc2Br)C1 381348544 HJKZMGAMURPISR-NSHDSACASA-N 446.002 4.520 50 10 IJGE Fc1ccc([C@H](Br)c2cc(I)cc3c2OCC3)cc1 388582053 WLTLXEMADDOMRQ-AWEZNQCLSA-N 433.058 4.850 50 10 IJGE O=C(NNC(=S)Nc1cccc(Br)c1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 731232093 FPPBPAZUJFTOKP-RBUKOAKNSA-N 440.366 4.724 50 10 IJGE C/C(=C\C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)c1ccccc1C(F)(F)F 742057010 GYEACUHQTGZBRG-FMIVXFBMSA-N 445.363 4.658 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)NC2(C(F)(F)F)CCOCC2)c1C 776970453 QKILIQIDNIXILC-UYRXBGFRSA-N 431.458 4.537 50 10 IJGE CCN(Cc1c[nH]c2ccccc12)C(=O)/C(C#N)=C/c1cc(C)n(C[C@H]2CCCO2)c1C 785803667 YJHNLSNLYHAMSC-FJWZAKCXSA-N 430.552 4.721 50 10 IJGE BrC[C@H](CN1CCc2nc[nH]c2[C@@H]1c1ccc(Br)cc1)C1CC1 1660254931 LYKWDHALISAPTQ-KDOFPFPSSA-N 439.195 4.541 50 10 IJGE COc1ccc(-n2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2ccccc2Cl)cc1 1865686581 YAKNNYIKQFJIRQ-MRXNPFEDSA-N 446.816 4.771 50 10 IJGE CCOC(=O)c1c(NC(=O)[C@@H](C)Cl)sc(C(=O)Nc2ccc(Cl)cc2)c1C 1865768565 HYFMKIITKDCVDW-SNVBAGLBSA-N 429.325 4.705 50 10 IJGE N#C/C(=C\c1cccc(Br)c1)C(=O)Nc1cccc(-c2cccc(C(=O)O)c2)n1 1866131638 GJCQDKAKFLRNKW-LICLKQGHSA-N 448.276 4.755 50 10 IJGE CN(Cc1ccc(Br)s1)C[C@H](Br)COCc1ccccc1 1916350234 XUEZHRHEFABSLJ-AWEZNQCLSA-N 433.209 4.923 50 10 IJGE C[C@H](CCl)C(=O)Nc1cc(Br)c(Br)c(Br)c1 1938593499 FMFSMKNSGAEPQI-RXMQYKEDSA-N 434.353 4.788 50 10 IJGE BrC[C@@]1(Cc2cc(Br)ccc2Br)C[C@@]12CCOC2 2054720903 ZYXFZFAZPQZGMP-ZIAGYGMSSA-N 438.985 4.946 50 10 IJGE O=C(NC[C@@H](Cl)CC(F)(F)F)c1scc(Br)c1Br 2055500323 XDWWXZOJSYCNGI-BYPYZUCNSA-N 429.483 4.563 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1Cc2ccccc2N(C[C@@H](Br)C(F)(F)F)C1 2106783718 CCIZRRGJNGKJPC-SWLSCSKDSA-N 437.300 4.516 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(C)CN(CC3(CBr)CCCCC3)C[C@]2(C)C1 2106788392 PGZMIOOXWQHKQE-BGYRXZFFSA-N 429.443 4.911 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Cn1c(CCCl)nc2cncc(Br)c21 2151793940 TUUMCCUJGAMVNK-NVXWUHKLSA-N 447.808 4.743 50 10 IJGE O=S(=O)(CCC(CCl)CCl)Nc1c(Cl)cc(Br)cc1Cl 2160948053 GRPSTYHMDDCPPV-UHFFFAOYSA-N 444.005 4.982 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)C1(CNC(=O)OC(C)(C)C)CCCCC1 2163056019 NJWDSNIFNVZMIW-UHFFFAOYSA-N 439.394 4.881 50 10 IJGE CC(CBr)(CBr)NC(=O)c1ccc(C(F)(F)F)cc1Cl 2179250714 WOJVIOGMXHJOJG-UHFFFAOYSA-N 437.481 4.637 50 10 IJGE CC(C)(C)OC(=O)NCCCc1cccc(NC(=O)N2CCC(Br)CC2)c1 2204091564 AZEKUMPNCSRJPS-UHFFFAOYSA-N 440.382 4.535 50 10 IJGE ICCCCCN1CC[C@@]2(CCCN(Cc3ccccc3)C2)C1 2211186212 NUQPMUASBOXYLU-FQEVSTJZSA-N 426.386 4.580 50 10 IJGE FC(F)(F)C(F)(F)CCCO[C@@H](CCl)[C@@H](I)CCl 2223707394 MKQGGCCZWSDLFN-BQBZGAKWSA-N 428.994 4.631 50 10 IJGE CCO[C@@H]1C[C@@H]1[C@H](Br)Cc1cc(Br)cc(Br)c1 2252837342 OAVMJGQZSWJZCA-JHJVBQTASA-N 426.974 4.943 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@@H](Br)c1nn(C)cc1Br 2264361311 RWSYOZMOVFRRTN-LLVKDONJSA-N 428.939 4.982 50 10 IJGE Cc1cc(N(C)Cc2ccccc2I)cc(CBr)n1 2272797366 VFPKULNDKLAYLZ-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE CCCN(c1nccc(OC)c1CBr)C1CCN(Cc2ccccc2)CC1 2281104603 YQZSXUOATPJXKF-UHFFFAOYSA-N 432.406 4.866 50 10 IJGE O=C(COc1ccc(Cl)cc1Cl)NN=CC(Br)=Cc1ccccc1 2294162134 KUCJIXKPUMZUKM-UHFFFAOYSA-N 428.113 4.910 50 10 IJGE CC(F)(F)C[C@H](CCl)NC(=O)Cc1cc(Br)cc(Br)c1 2295312649 ZTAHCPSDKZZLCK-LLVKDONJSA-N 433.518 4.523 50 10 IJGE CN(Cc1ccc(Cl)cc1I)C[C@H]1C[C@@H](Br)C1 2302315350 IITQFRHCYCSZFK-JGZJWPJOSA-N 428.539 4.550 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@H]2CCCC3(CC3)C2)CC1 2302706831 LKXHIBBLXUNTOH-HNNXBMFYSA-N 449.373 4.931 50 10 IJGE Cl[C@@H]1CCC[C@H](NCc2ccc(I)c(Br)c2)C1 2306223119 AUBGWXCYEIFJDD-MNOVXSKESA-N 428.539 4.693 50 10 IJGE Clc1ccc(I)cc1CC1(CBr)CCOCC1 2307333876 JLDAROZJUNWDIP-UHFFFAOYSA-N 429.523 4.679 50 10 IJGE CNC(=O)C(C#N)=C1S[C@@H](Cc2ccc(C(C)C)cc2)C(=O)N1c1ccc(C)c(C)c1 2314593855 UWXZJTWEJZXHRD-QFIPXVFZSA-N 433.577 4.599 50 10 IJGE CC(C)[C@H]1C[C@@H](Br)CN1Cc1cc(Cl)ccc1I 2321506974 FBUZEEVHNMTZHN-BXUZGUMPSA-N 442.566 4.938 50 10 IJGE CCOc1cc(C=NNC(=O)Cc2ccc(N)cc2)ccc1OCc1cc(C)ccc1C 2323323532 NFMNZISEYMWZCA-UHFFFAOYSA-N 431.536 4.556 50 10 IJGE CC(C)(C)OC(=O)NCCCCCC(=O)NN=Cc1ccccc1OCc1ccccc1 2328835246 SPNNXJAVCPSODN-UHFFFAOYSA-N 439.556 4.801 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=Cc2cccc(Br)c2)c(Cl)c1 2329698940 MOCDLWAAKCPSCC-UHFFFAOYSA-N 433.689 4.825 50 10 IJGE FC(F)(CBr)C(F)(F)CNCc1cc(Cl)cc(Br)c1 2336540831 HALSITUIKXUZGM-UHFFFAOYSA-N 427.461 4.858 50 10 IJGE CCn1nc(C)c(CBr)c1N(C)[C@H]1C[C@@H]2C[C@@H](OCc3ccccc3)C[C@H]12 2359251890 QNLLDGHPQMKYTK-JTJHWIPRSA-N 432.406 4.926 50 10 IJGE CN(Cc1c(Br)c(Br)nn1C)c1c(Cl)cccc1CCl 2364332549 FTMYPSGNZKTAQA-UHFFFAOYSA-N 441.982 4.974 50 10 IJGE CC[C@H]1CCCCN1/C=C(/C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 216497878 AWXWFHVZAFSZBD-YRBSCUOSSA-N 442.607 4.592 50 10 IJGE CCCCCCO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 231314034 RCWBWABNQPCFSP-QGZVFWFLSA-N 425.351 4.788 50 10 IJGE O=C(NC[C@H]1CCC[C@@H]1Br)c1cc(Br)sc1Br 232462179 OIXCRWNNSIBCNG-SVRRBLITSA-N 446.002 4.567 50 10 IJGE Cc1cc(C=NNC(=O)Cc2cccc(C(F)(F)F)c2)c(C)n1-c1ccc2c(c1)OCO2 254799377 WCEAAKVVKGVKHK-UHFFFAOYSA-N 443.425 4.534 50 10 IJGE BrC[C@H]1CCCCN(c2ncc(Br)cc2Br)C1 696787202 CFACDMRCCPNARH-SECBINFHSA-N 426.978 4.608 50 10 IJGE C=CCc1cc(C=NNC(=O)CC[C@H](O)c2ccccc2)cc(Br)c1OCC 725401737 OWMRSHNPBCYXQQ-FQEVSTJZSA-N 445.357 4.540 50 10 IJGE O=C(NNc1ccc(Cl)cc1Cl)c1cc(O)nc2ccc(Br)cc12 748017639 HYSAJHBJLWYZSX-UHFFFAOYSA-N 427.085 4.767 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NC3(C(F)(F)F)CCOCC3)c2C)cc1 776967747 NTPMIJQXQCIETH-CPNJWEJPSA-N 431.458 4.537 50 10 IJGE C=CCc1cccc(C=NNC(=O)c2ccc(NC(=O)c3ccc(Cl)cc3)cc2)c1O 1082753707 AZWMHOFRBFYKOO-UHFFFAOYSA-N 433.895 4.790 50 10 IJGE O=C(NNc1c(Cl)cc(F)cc1Cl)c1ccc2nc(O)n(CC(F)(F)F)c2c1 1153317004 CHSVZYDDAROPBK-UHFFFAOYSA-N 437.180 4.507 50 10 IJGE CC(=O)CCc1ccc(OCCC(=O)NNc2cc(Cl)ccc2Br)cc1 1651622525 ONJDPINFZASFSQ-UHFFFAOYSA-N 439.737 4.536 50 10 IJGE Cc1ccc(O)c([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3Cc2ccccc2)c1 1865687254 NEGRCZWVQMHYTN-HSZRJFAPSA-N 434.499 4.831 50 10 IJGE CCCc1nn(-c2ccc(Br)cc2)c2c1[C@@H](c1cccs1)C(C#N)=C(N)O2 1865698051 IVRBXVUXLVZKOU-QGZVFWFLSA-N 441.354 4.867 50 10 IJGE CCOC(=O)c1sc(NC(=O)/C(C#N)=C/c2ccccc2)nc1-c1ccc(OC)cc1 1873697685 GVVFMMNMJUVWSW-GHRIWEEISA-N 433.489 4.541 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CCl)Cc1cc(Br)cc(Br)c1 1882074305 KGLZCVBZKLAYSF-LBPRGKRZSA-N 427.564 4.886 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)c1cc(Br)sn1 1909914016 BBJFPNDXHBCCAJ-CQSZACIVSA-N 446.208 4.968 50 10 IJGE CC(C)[C@H](c1nc(CCl)cs1)n1ccnc1CCCN1C(=O)c2ccccc2C1=O 1912990901 INRDKXFSLJVMCB-LJQANCHMSA-N 442.972 4.553 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)C(=O)Cc1cccc(Br)c1 1914217220 YJJMLXKXKZQABF-AWEZNQCLSA-N 425.164 4.804 50 10 IJGE Cc1ncnc(N(Cc2ccccc2)[C@@H](CBr)C(C)C)c1Br 1915255798 RJRFSFPAMBDQCE-HNNXBMFYSA-N 427.184 4.974 50 10 IJGE CN(C(=O)c1csc(Br)c1Br)C(C)(C)CCBr 1945190705 RSTSEERBHNFKIR-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE C[C@H](Br)C(C)(C)NC(=O)c1c(Br)cccc1Br 1945333206 MQTDCKCDLLBDMP-ZETCQYMHSA-N 427.962 4.503 50 10 IJGE CC(C)(C)OC(=O)N(CC(F)F)[C@H]1CCCN(C[C@H](CBr)C2CCC2)C1 1966430714 PHXYRYRIJCZVOE-HOTGVXAUSA-N 439.385 4.764 50 10 IJGE O=Cc1cc(Br)cc(Br)c1OC[C@H]1C[C@H](Br)C1 2020215743 DZCWOAHMVGLTRD-XWEPSHTISA-N 426.930 4.576 50 10 IJGE CN(CC(C)(C)CBr)C(=O)c1cc(Br)ccc1Br 2033567431 UYTSGUWJTJMEJA-UHFFFAOYSA-N 441.989 4.705 50 10 IJGE O=C(CCl)c1cc(I)cc(OC(F)(F)F)c1C(F)(F)F 2055118045 FKVYVQVELGEDDD-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE C[C@@H](Br)[C@@H](NC(=O)c1cc(Br)c(Cl)s1)C(F)(F)F 2074719964 KDXCLAURBWOSEI-AWFVSMACSA-N 429.483 4.608 50 10 IJGE COCCOc1ccc([C@H](Br)[C@H]2C[C@@H]2Br)cc1Br 2076168624 ALBVFINHVCAWDX-KWBADKCTSA-N 442.973 4.694 50 10 IJGE CCCN(C(=O)[C@@H](Br)C1CCCC1)C1CCN(C(=O)OC(C)(C)C)CC1 2110716590 ZDYSVJPVJAHQOU-KRWDZBQOSA-N 431.415 4.578 50 10 IJGE COc1ccc([C@@H](Cl)c2nn(C)c(Cl)c2Br)c(Br)c1 2110722916 LSQWIPIEORTWQP-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE CC(C)(C)OC(=O)NCCO[C@@H]1CCN(CCCCCCCCCBr)C1 2112695298 FWUYZMCLIJZEID-GOSISDBHSA-N 435.447 4.728 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC2(CCC2)C[C@H]1CBr 2115922312 BUKCZIOOVOUFNF-QMMMGPOBSA-N 427.589 4.944 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC2(CCC(Br)CC2)C1 2124673737 WIKAGZUIORJFNZ-UHFFFAOYSA-N 427.589 4.944 50 10 IJGE CCN(CCCl)CCC[C@H](C)Nc1ncc(Br)cc1Br 2204134016 ZADJTDSUZIJPDN-NSHDSACASA-N 427.612 4.748 50 10 IJGE FC1(F)C[C@@H]1Cn1c(CCCl)nc2cc(Br)c(Br)cc21 2234066436 MDXMDHFKBPEOPT-SSDOTTSWSA-N 428.502 4.998 50 10 IJGE Cc1cc(Br)c(C(=O)NC[C@]2(F)CC[C@@H](CBr)CC2)s1 2237613006 XLSSCSGOWQWRGI-WJONMLJTSA-N 427.177 4.842 50 10 IJGE C[C@H](COC(F)F)O[C@H](CI)c1ccccc1Br 2253912358 AMDMUCJMAWFAHM-LDYMZIIASA-N 435.046 4.570 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)C23COCC(C2)C3)c1 2263515576 PZMBYTFYPQUJSN-AWAWDMARSA-N 438.985 4.944 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@H](Br)[C@H]2CC[C@@H]21 2282990863 XTXXMDROSCBPGS-CERSQZSQSA-N 425.523 4.630 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H](C)OC2(C1)CN(C(=O)OC(C)(C)C)C2 2288472677 SDEQDRZBXJRLQY-KRWDZBQOSA-N 447.458 4.678 50 10 IJGE CO[C@H]1C[C@H]([C@H](Cl)Cc2cc(Br)cc(Br)c2)C[C@H]1OC 2295332508 XSMUUHUUSDRZCL-QZKOUSHUSA-N 426.576 4.802 50 10 IJGE Cc1cc(Oc2cccc(C(F)(F)F)c2)nc(C2CCN(C(=O)[C@H](C)Cl)CC2)n1 2296572701 TYKNZMNNTIBZBP-ZDUSSCGKSA-N 427.854 4.929 50 10 IJGE CC(C)(CI)CN1CCc2c(cccc2NC(=O)OC(C)(C)C)C1 2306809776 MQKLRLCUIPGBEG-UHFFFAOYSA-N 444.357 4.853 50 10 IJGE C=CCc1cc(C=C(C#N)C(=O)N(C)C)cc(Br)c1OCc1ccc(F)cc1 2313567629 JFHBHQBKVQUTMV-UHFFFAOYSA-N 443.316 4.891 50 10 IJGE CC(C)[C@H]1C[C@H](Cl)CN1Cc1ccc(I)c(Br)c1 2325206178 BWAINYNBTBIPNO-SMDDNHRTSA-N 442.566 4.891 50 10 IJGE FC1(CNCc2ccc(I)c(Br)c2)CC(CCl)C1 2325228501 CUWJFVQFRQSJCR-UHFFFAOYSA-N 446.529 4.500 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H](C2CC2)[C@@H](Br)C1 2327406981 XKWIXBAXPQPORB-OLZOCXBDSA-N 440.550 4.550 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CBr)OCc1cccc(C(F)(F)F)c1 2327977003 ARZOEBVTKRZDMR-INIZCTEOSA-N 426.273 4.900 50 10 IJGE CCOC(=O)/C(C#N)=C\c1[nH]c(C)c(C(=O)OCC)c1Cc1cc(Cl)ccc1Cl 3330717 YPODRJXANRSPEA-UVTDQMKNSA-N 435.307 4.868 50 10 IJGE Cc1ccc[n+]([C@@H]2C(=O)N(CCc3ccccc3)C(O)=C(C#N)[C@@H]2c2ccc(Cl)cc2)c1 20407926 YBZMNNWTJUAKIP-ZEQRLZLVSA-O 444.942 4.639 50 10 IJGE COc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(Cl)c4)ccc32)c1 38650225 JMEQVOSTURDEBO-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)Cc3ccccc3)ccc2[C@H]1c1c(F)cccc1Cl 38680730 XFLJELHSGPKUSQ-JOCHJYFZSA-N 434.854 4.845 50 10 IJGE CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2ccc(Cl)c(C)c2)c(OCC)c1 40867274 IEDUURLPNNJKRU-GZTJUZNOSA-N 443.883 4.502 50 10 IJGE CCCC/C(CC)=N/NC(=O)COc1c(C)cc(Br)cc1Br 66202323 CUNLTUJBVQAXRX-CPNJWEJPSA-N 434.172 4.971 50 10 IJGE O=S(=O)(NC[C@H]1CCCC[C@H]1Cl)c1c(Cl)cc(Br)cc1Cl 96873179 FHEPLKSZQNGDRC-PSASIEDQSA-N 435.598 4.832 50 10 IJGE C[C@H](N/C=C(/C#N)C(=O)Nc1ccc(Br)cc1)C12CC3CC(CC(C3)C1)C2 216778356 VZOQWTUJJRQFLM-ZTNMFLNZSA-N 428.374 4.990 50 10 IJGE O=C1COc2ccc([C@H](Br)c3cccc(Br)c3Cl)cc2N1 228452673 GCXCJXYZQGIFHG-AWEZNQCLSA-N 431.511 4.918 50 10 IJGE CC(=NNC(=O)c1cc(-c2cccc(OCc3ccccc3)c2)n[nH]1)c1ccccc1O 254507636 CHCSZLLCQVEENA-UHFFFAOYSA-N 426.476 4.515 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@@H](O[C@@H]2CCCc3ccccc32)C1 303741191 JAMLKWUCFSKNJN-BBWFWOEESA-N 443.325 4.504 50 10 IJGE Brc1cc(Br)cc([C@H]2CC[C@@H](CI)O2)c1 307601035 UFHIKHJTQVNFOD-WDEREUQCSA-N 445.920 4.867 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1C(=O)c1cc(Br)c(Br)s1 399471285 MOXIEHQGSQFOFR-NKWVEPMBSA-N 446.002 4.661 50 10 IJGE CCOc1cc(/C=C\C(=O)Oc2ccc([N+](=O)[O-])cc2)cc(Br)c1OCC 1082441490 NFPMKZLONZSRFP-YHYXMXQVSA-N 436.258 4.774 50 10 IJGE C=CCn1c(CNc2cccc3ccccc23)nnc1SCC(=O)NN=C(C)CCC 1084523616 LJNBPRZKFLEILG-UHFFFAOYSA-N 436.585 4.614 50 10 IJGE Cc1ccccc1C(=O)NN=C1CCCc2oc(C(=O)N(C)Cc3ccccc3)c(C)c21 1772744264 VIBAMILPAWHVIO-UHFFFAOYSA-N 429.520 4.639 50 10 IJGE Cc1ccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4cccc([N+](=O)[O-])c4)c(C)c32)cc1 1772744393 CTFPAJWUTMGERI-UHFFFAOYSA-N 446.463 4.527 50 10 IJGE O=C(CCBr)c1cccc(SC(F)(F)F)c1I 1848425909 QYGGCDQJTYWQDE-UHFFFAOYSA-N 439.034 4.871 50 10 IJGE CCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccn2)c1 1865690623 XDSRPOATHCMGDU-QFIPXVFZSA-N 435.487 4.551 50 10 IJGE COc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2cccc(F)c2)cc1 1865710734 GQDYUNYCRNBCQD-JOCHJYFZSA-N 438.462 4.905 50 10 IJGE CC1(C)[C@H](Cl)C[C@H]1CNc1ncc(I)cc1Br 2015765348 NOMZLCNKCMRMQT-OIBJUYFYSA-N 429.527 4.514 50 10 IJGE CC(C)[C@H](Br)CCNC(=O)c1cc(Br)cc(Br)c1 2029916956 MWTRMYPAJOFXBM-GFCCVEGCSA-N 441.989 4.751 50 10 IJGE Brc1cccc(CN2CC[C@H](Br)C3(CC3)C2)c1Br 2032267149 VXQONKOJKBZYRV-LBPRGKRZSA-N 438.001 4.961 50 10 IJGE CCCCCC[C@@H]1C=C2[C@@]3(C)CC4=C(C(=O)OC4=O)[C@@H]([C@H]1CCCCCC)[C@@]2(O)OC3=O 2080449540 MOBNKYGKVWHWSM-WDYIOOLWSA-N 444.568 4.751 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1CCN(Cc2ccccc2)C2(CCC2)C1 2097013887 GQIBORVUTJPUHA-UHFFFAOYSA-N 436.375 4.796 50 10 IJGE CC(C)(C)OC(=O)NC[C@H](NC(=O)[C@H](Br)C1CCCC1)C1CCCCC1 2110721777 IPBVEGHJZVBBFH-DLBZAZTESA-N 431.415 4.530 50 10 IJGE COCCCCN(Cc1ccccc1)S(=O)(=O)c1ccc(CBr)c(C)c1 2123198655 GXGDFBYKHFHWQJ-UHFFFAOYSA-N 440.403 4.507 50 10 IJGE Clc1cc(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)ccc1CBr 2129050500 DILVKKWYZPUBOQ-RTWAWAEBSA-N 435.793 4.715 50 10 IJGE CC1(C)CCCCN(S(=O)(=O)c2cc(CBr)sc2Br)C1 2179788737 GWFKELHWWAIYFD-UHFFFAOYSA-N 445.242 4.606 50 10 IJGE CC1(C)CN(Cc2ccccc2)CCN(c2ccc(CBr)c([N+](=O)[O-])c2)C1 2188572052 MJBSCTCTUIUSQP-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE CCN(CCCCCI)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2211186980 ROOKIAZONPUYPN-MRXNPFEDSA-N 438.394 4.561 50 10 IJGE Cc1ccc([C@@H](Br)c2ccc3nc(O)[nH]c3c2)cc1I 2232832735 GIKVZRAHGOXZHH-CQSZACIVSA-N 443.082 4.666 50 10 IJGE CC(C)(C)OC(=O)N1[C@H](CNC(=O)[C@H](Br)C2CCCC2)C[C@@H]2CCCC[C@@H]21 2240973052 RHCOGNIATMOWMG-XLAORIBOSA-N 443.426 4.625 50 10 IJGE COc1csc([C@@H](Br)c2ccc(OC)c(I)c2)c1 2257367611 MVCKRGXAIDAUQC-ZDUSSCGKSA-N 439.112 4.854 50 10 IJGE C[C@@H]1CCCN(CC2(CBr)CC(F)C2)[C@@H]1CCCNC(=O)OC(C)(C)C 2265638705 NPVOZFIWSOMYTQ-NZEHOUKNSA-N 435.422 4.905 50 10 IJGE COC[C@@]1([C@H](Cl)c2c(F)cc(Br)c(F)c2Br)CCCO1 2288481547 XDDJHDQEKDDFMH-CHWSQXEVSA-N 434.502 4.965 50 10 IJGE CC(CC(=O)Nc1ccc(Cl)c(Cl)c1)=NNC(=O)c1ccc(Br)cc1 2297710454 LALZCFICJVRKKP-UHFFFAOYSA-N 443.128 4.890 50 10 IJGE Fc1cc(CBr)cc(OCc2sccc2I)c1 2301071851 RMGBILMUKCIWHK-UHFFFAOYSA-N 427.076 4.966 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](N)C1CC(Br)C1 2301490882 ZLAZINVVLFCLKW-LBVLNNNDSA-N 429.953 4.832 50 10 IJGE CC(C)CN(CCCl)Cc1ccc(I)c(Br)c1 2306221915 NRYFLHHJIWBSCE-UHFFFAOYSA-N 430.555 4.751 50 10 IJGE Cl[C@@H]1CCN(Cc2ccc(I)c(Br)c2)CC12CC2 2325206781 KNMNKBMFANCUAE-CYBMUJFWSA-N 440.550 4.647 50 10 IJGE COC(=O)c1ccc2c(O)nc(C(C#N)=Cc3cccc(OCc4ccccc4)c3)nc2c1 2331045457 UMMMSSOUGKHBOI-UHFFFAOYSA-N 437.455 4.765 50 10 IJGE COc1ccc(C)cc1-c1csc(C(C#N)=C(O)CCN2C(=O)c3ccccc3C2=O)n1 2331322916 ILPPOVNDBRLEAC-UHFFFAOYSA-N 445.500 4.606 50 10 IJGE Cn1nc(C(F)(F)F)c(CBr)c1N1CCC(OCc2ccccc2)CC1 2339772821 DPBZYIKLDZBXPD-UHFFFAOYSA-N 432.284 4.519 50 10 IJGE FC(F)(F)[C@@H]1C[C@H](Br)CCN1Cc1ncc(Br)cc1Cl 2361429920 QROKXFAMQNEEIW-HQJQHLMTSA-N 436.497 4.788 50 10 IJGE CC(C)C[C@H](CBr)CN1CCOc2ccc(CNC(=O)OC(C)(C)C)cc21 2382184710 OVRPIUNMVFGYGG-QGZVFWFLSA-N 441.410 4.967 50 10 IJGE Cc1cccc(C(=O)NNC(=O)c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2)c1 12491970 AGMFCQAKNFLZDV-UHFFFAOYSA-N 429.520 4.620 50 10 IJGE O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)c1ccc(Cl)cc1Cl 12577070 FTSOXAUZRDAUSV-UHFFFAOYSA-N 436.122 4.920 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccc(I)cc1)[C@@H]2Br 26531545 VJQSDLVJNQHEIL-WQVCFCJDSA-N 448.142 4.820 50 10 IJGE N#C/C(=C/c1cc(Br)c(O)c(Br)c1)c1nc(O)c2ccccc2n1 33248173 WSQUMABTRPTOSM-YHYXMXQVSA-N 447.086 4.630 50 10 IJGE Cc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)N4CCc5ccccc5C4)c(C)c32)c1 40811378 ZMSWKOFHWPOABI-XAYXJRQQSA-N 441.531 4.565 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)Cc1ccccc1)CCC2 40815695 YEJWGHIFEBKUFE-TURZUDJPSA-N 445.519 4.557 50 10 IJGE C[C@H]1c2ccsc2CCN1S(=O)(=O)c1cc(CCl)sc1Br 91269525 HQROFSAUVZBFGZ-QMMMGPOBSA-N 426.810 4.619 50 10 IJGE CS[C@@H](C)CCn1c(CCCl)nc2cc(I)c(F)cc21 131091032 WRZBBVQAVXKILL-VIFPVBQESA-N 426.726 4.703 50 10 IJGE CN(CCCCCBr)C(=O)c1cc(Br)ccc1Br 227144837 SGKPBIZMAAIXCM-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE CC[C@H](C)c1ccccc1OCCOc1ccc(C=NNC(=O)c2ccncc2)cc1OC 252622233 NRCCGLWIWBCICC-IBGZPJMESA-N 447.535 4.825 50 10 IJGE Cc1nn(-c2ccccc2)c(C)c1C=NNC(=O)c1cc(-c2cccc3ccccc23)n[nH]1 254520010 QZYZVJDTZPIPGW-UHFFFAOYSA-N 434.503 4.796 50 10 IJGE aggregator CO[C@H](CO[C@H](CI)c1ccc(Br)cc1)C(C)C 311065267 KYGBQYIMHJPQCY-ZIAGYGMSSA-N 427.120 4.613 50 10 IJGE CC[C@@H](NC(=O)c1cc(Br)ccc1Br)[C@@H](C)Br 386650616 BNYUKNCBOBDVLU-RDDDGLTNSA-N 427.962 4.503 50 10 IJGE CC[C@@H](NC(=O)c1cc(Br)ccc1Br)[C@H](C)Br 386650617 BNYUKNCBOBDVLU-WRWORJQWSA-N 427.962 4.503 50 10 IJGE C[C@H](NC(=O)c1cc(Br)c(Br)s1)C1(CBr)CC1 710152917 OKMYAZFUHYOMIS-LURJTMIESA-N 446.002 4.567 50 10 IJGE Cc1cc(C=NNC(=O)CC(=O)NC2CCCCC2)c(C)n1-c1ccc(Cl)cc1Cl 1083930864 NSQQJTKWLFIHEA-UHFFFAOYSA-N 449.382 4.690 50 10 IJGE CCCCCOc1ccccc1C(=O)NN=Cc1c(C)nn(-c2ccc([N+](=O)[O-])cc2)c1C 1084420316 LAFCJIAKJRRKOW-UHFFFAOYSA-N 449.511 4.730 50 10 IJGE CC(=O)c1ccc2c(c1)CN(C(=O)/C(C#N)=C/c1cc(C)n(-c3ccc(F)cc3)c1C)C2 1436692840 VWBXEPXXFLNXOV-WSDLNYQXSA-N 427.479 4.885 50 10 IJGE O=C(NNc1ccc(Br)cc1F)c1cc2ccc(C(F)(F)F)cc2nc1O 1446458254 JDJZQQZLTYOTQQ-UHFFFAOYSA-N 444.182 4.618 50 10 IJGE COc1ccc(/C(C#N)=C/c2cccc(OC(=O)c3ccc([N+](=O)[O-])cc3)c2)cc1OC 1615066830 RWKFCFILIXNLEU-XDHOZWIPSA-N 430.416 4.895 50 10 IJGE O=C(CSc1nc2ccccc2[nH]1)NN=Cc1cccc(OCc2ccc(F)cc2)c1 1772760628 ZOQHIZATGLIPRP-UHFFFAOYSA-N 434.496 4.523 50 10 IJGE CC(C)N1C[C@H](/C(O)=C(\C#N)c2nc(-c3cccc(Br)c3)cs2)CC1=O 1872746114 SNJZBQIUXRTFLY-ZLMULJHYSA-N 432.343 4.622 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)C1 1880762271 UNFPNLMCTYVUDK-QLFBSQMISA-N 435.403 4.606 50 10 IJGE CN(CC[C@@H]1CCCCN1CC(C)(C)CI)C(=O)OC(C)(C)C 1904650584 HVZAAQPPGMMHIV-HNNXBMFYSA-N 438.394 4.559 50 10 IJGE Cc1ncc(Br)c(N(Cc2ccccc2)[C@H](CBr)C(C)C)n1 1915323216 QTWGEBSYLUMFDC-MRXNPFEDSA-N 427.184 4.974 50 10 IJGE Cc1ccnc(C(=O)N(Cc2ccccc2)C[C@@H](C)Br)c1Br 1927120747 DUXQFJRRIYRYGC-CYBMUJFWSA-N 426.152 4.578 50 10 IJGE BrCC1(Cc2c(Br)cccc2Br)CCOCC1 1945331372 SAVCMGWQIHYTAD-UHFFFAOYSA-N 426.974 4.946 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(I)c(CCCBr)c1 1951554593 CVVKBQSYZNVYEK-UHFFFAOYSA-N 440.119 4.966 50 10 IJGE CCN(C[C@](C)(CI)OC1CC(C(C)C)C1)C(=O)OC(C)(C)C 1987764133 QIUNVLDQUTWQIM-JMLCCBQJSA-N 439.378 4.888 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@H]([C@]2(C)CC[C@](C)(CI)O2)CC1 1993736343 WAQQOMDDQRBYFY-DTDBQYNISA-N 437.362 4.833 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1Cc1cc(Br)ccc1Br 2006496678 KXOLIYHGXVLXOC-BXKDBHETSA-N 425.990 4.959 50 10 IJGE O=S(=O)(c1cc(CBr)ccc1Cl)N(Cc1ccccc1)CC1CC1 2009622128 NOIYROCTTAJRNR-UHFFFAOYSA-N 428.779 4.836 50 10 IJGE CC(C)(CBr)CN1CC[C@H](C(F)(F)F)C[C@H]1CNC(=O)OC(C)(C)C 2045432412 UOPHITFVYIRDRB-STQMWFEESA-N 431.337 4.575 50 10 IJGE C[C@@H]1OCC[C@@H]1COc1c(Br)cc(CBr)cc1Br 2057463456 GDODAWVGMLHCGE-WCBMZHEXSA-N 442.973 4.910 50 10 IJGE FC(F)Oc1ccc(OC(F)(F)F)c(CBr)c1I 2060226063 RJIVCVYFEHUHGE-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE CCC[C@H](CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)[C@@H](c2ccccc2)C1 2106784530 JHXQNCDZAXHVAK-BHIYHBOVSA-N 425.411 4.790 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1[C@H](CCl)C[C@@H]2CCC[C@@H]21 2108397560 UJDMSSALWMHSMP-NRPADANISA-N 427.589 4.895 50 10 IJGE COc1ccc(CN[C@@H](C)CCCCCI)cc1Br 2117886742 OFJLXEFUFJMLOE-LBPRGKRZSA-N 440.163 4.931 50 10 IJGE Br[C@@H](Cc1cc2ccccc2cn1)c1cc(I)sn1 2120029947 AEUVREUASPZBOW-LBPRGKRZSA-N 445.123 4.975 50 10 IJGE Clc1ccc(CBr)c(N2CC[C@H]3OCCN(Cc4ccccc4)[C@H]3C2)c1 2129053625 NSBLYIFLBWEXJK-LEWJYISDSA-N 435.793 4.715 50 10 IJGE Brc1cccc([C@@H](CI)OC[C@H]2[C@H]3C[C@@H]4[C@H]2[C@@H]4C3)c1 2134536531 FKOJSISRKQDBLI-ULZMNHICSA-N 433.127 4.844 50 10 IJGE ClCCc1nc2cncc(Br)c2n1C[C@H]1CCCN(Cc2ccccc2)C1 2151785773 YYAZBYCPUNRREI-KRWDZBQOSA-N 447.808 4.887 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C[C@H](CBr)c2ccccc2)CC12CCC2 2163059308 RYUJAABKUJYQMK-OALUTQOASA-N 437.422 4.934 50 10 IJGE CN(CC1CCCCC1)S(=O)(=O)c1cc(CBr)sc1Br 2179791597 TUZWRPKHYJYAJY-UHFFFAOYSA-N 445.242 4.606 50 10 IJGE FC1(F)C[C@@]1(Br)Cn1c(CCCl)nc2cc(Br)ccc21 2202506396 QIJVBTCSGKAQKK-GFCCVEGCSA-N 428.502 4.753 50 10 IJGE Cc1cccc(C(=O)N2C[C@H](Br)CC23CCCC3)c1I 2241032118 UGIFZLVEWWJSBU-GFCCVEGCSA-N 448.142 4.522 50 10 IJGE Cc1nscc1C[C@@H](Br)c1ccc(F)cc1I 2246960703 YRYULGAIMPYREY-LLVKDONJSA-N 426.092 4.874 50 10 IJGE Cc1cc(Oc2cccc(C(F)(F)F)c2)nc(C2CCN(C(=O)[C@@H](C)Cl)CC2)n1 2296572700 TYKNZMNNTIBZBP-CYBMUJFWSA-N 427.854 4.929 50 10 IJGE O=S(=O)(N[C@@H](CCCl)COCc1ccccc1)c1cc(Cl)sc1Cl 2303766484 IYQJQXNXUFAPRA-LBPRGKRZSA-N 428.790 4.548 50 10 IJGE COc1cc(F)c(CO[C@@](C)(CBr)CNC(=O)OC(C)(C)C)c(Cl)c1 2317100871 DEQMXCMZKLRNLQ-KRWDZBQOSA-N 440.737 4.683 50 10 IJGE CCN(CC)Cc1ccc(C=NNC(=O)c2ccc(-c3cccc(OC)c3)nc2C)cc1 2321239430 DEYJXVHHVWEGOC-UHFFFAOYSA-N 430.552 4.671 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@H]1CN(C[C@@H](CBr)c2ccccc2)CC1(C)C 2336372495 CWWJFALXCCSONN-MSOLQXFVSA-N 425.411 4.742 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]3C2)C1 2345010872 OQZCMEBPRXWNLY-IXDOHACOSA-N 429.443 4.813 50 10 IJGE FC(F)(F)c1ccc(CBr)c(N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)n1 2369848829 UWPQPEWZBNQTGW-CALCHBBNSA-N 440.307 4.564 50 10 IJGE O=C(CCCC(=O)N/N=C/c1ccc2ccccc2c1)N/N=C/c1ccc2ccccc2c1 2902706 MDLHALBVLUFVET-UOSOPFLXSA-N 436.515 4.764 50 10 IJGE Cc1ccc(Nc2ncnc(NNC(=O)c3ccccc3Cl)c2[N+](=O)[O-])cc1Cl 40591046 SROMSWXKSSREMV-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccc(C(C)C)cc2)ccc1OCCc1ccccc1 40911655 MVZQXPRJQKJTTL-MTDXEUNCSA-N 446.547 4.969 50 10 IJGE CC1=C(C#N)C(=O)N(C)C(=O)/C1=C/c1ccc(OCc2ccc(Cl)cc2Cl)cc1 101332384 QXYHEYHOKQBWKL-GIJQJNRQSA-N 427.287 4.794 50 10 IJGE COc1ccc(C(=O)[C@H](Br)[C@H](Br)c2ccc(OC)cc2)cc1 105418963 DTAHPGMKUAKDKW-HZPDHXFCSA-N 428.120 4.786 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)/C(C#N)=C\Nc1cc(OC)c(Cl)cc1OC 217186874 OMAOOAIWPRRANU-WSTOHFRZSA-N 443.931 4.761 50 10 IJGE C[C@H](Br)CCCNC(=O)c1cc(Br)sc1Br 227715598 QMCFEEXXPQCEDF-LURJTMIESA-N 433.991 4.567 50 10 IJGE COCCCCOc1c(Br)cc(CBr)cc1Br 234604652 IRUGJPVHIQDZOS-UHFFFAOYSA-N 430.962 4.912 50 10 IJGE CC(=NNC(=O)COc1ccccc1Cl)c1ccc(NC(=O)c2cccc(F)c2)cc1 252625688 QPEXDIQOGUJJKH-UHFFFAOYSA-N 439.874 4.651 50 10 IJGE CC(=NNC(=O)c1ccncc1)c1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 252639338 YJQZAPPULRTGAT-UHFFFAOYSA-N 427.291 4.795 50 10 IJGE COc1ccc(C(=O)NN=C2CCN[C@H]3CCCC[C@@H]23)cc1COc1ccccc1Cl 254527545 MDTKETGJOMDZSA-QUCCMNQESA-N 441.959 4.566 50 10 IJGE CC(=O)[C@H](Br)[C@H](C)c1ccc(I)cc1Br 300916717 VMTGDOVUPIPFMX-KSBSHMNSSA-N 445.920 4.510 50 10 IJGE C[C@H]1C[C@@H](Br)CN(Cc2cc(Cl)ccc2I)C1 405309615 SJWAOCBWKZFLHG-GXSJLCMTSA-N 428.539 4.550 50 10 IJGE CC(=NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)[C@@H](C)C1CCCCC1 747626058 RBUGYPNRJPDPEG-OAHLLOKOSA-N 433.599 4.871 50 10 IJGE O=C(COc1ccc(-c2ccccc2)cc1Br)NN=Cc1ccccc1F 1772754199 LTCJHNHWGBFXSF-UHFFFAOYSA-N 427.273 4.784 50 10 IJGE CCCc1nn(-c2ccccn2)c2c1[C@H](c1c(OC)ccc3ccccc13)C(C#N)=C(N)O2 1865688269 ODKBOLFSGOWBEK-QHCPKHFHSA-N 437.503 4.600 50 10 IJGE CCCc1nn(-c2ccccc2Cl)c2c1[C@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865712765 HIAYZDVXWPGOPE-LJQANCHMSA-N 435.871 4.605 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1nscc1Br 1915256753 CXBCCQWPQWDZPR-AWEZNQCLSA-N 446.208 4.968 50 10 IJGE CC1([C@@H](CBr)NC(=O)c2cc(Br)sc2Br)CC1 1945361172 JDZJYZRLONJPEP-SSDOTTSWSA-N 446.002 4.567 50 10 IJGE CC[C@@H](CCCBr)NC(=O)c1cc(Br)sc1Br 1948445561 RLPZPYQLQBWQMU-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE C[C@H](Br)Cc1cc(I)ccc1NC(=O)OC(C)(C)C 1951696154 PMYZCNVFADRGMN-VIFPVBQESA-N 440.119 4.964 50 10 IJGE CCCC(CBr)(CCC)CN1CC(N(C)C(=O)OCc2ccccc2)C1 1977948712 UZJAJKGBIPIPJF-UHFFFAOYSA-N 425.411 4.921 50 10 IJGE CCN(C[C@@](C)(CI)OCC1CC2(CC2)C1)C(=O)OC(C)(C)C 1989566545 WLPSFSARWAXESK-QGZVFWFLSA-N 437.362 4.644 50 10 IJGE CCC[C@H](CBr)CN=[S@@]1(=O)CC[C@H](CNC(=O)OC(C)(C)C)C1(C)C 2044704294 BMWWOLRVRLWJND-KDCSIKNMSA-N 439.460 4.589 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@@H](Cl)C2(CCCC2)C1 2117755844 JTSYHGNUWJXYHP-SECBINFHSA-N 427.589 4.897 50 10 IJGE O=S1(=O)CCC([C@@H](Br)c2csc3c(Br)cccc23)CC1 2146096164 UKDPENINMSNPDS-CYBMUJFWSA-N 438.206 4.925 50 10 IJGE Cc1cc(S(=O)(=O)NC[C@H](CBr)CC(C)(C)C)sc1Br 2156331783 VOTWGCIRYIDEOC-JTQLQIEISA-N 447.258 4.545 50 10 IJGE CC(C)N(C[C@H]1CCCN1C(=O)OC(C)(C)C)C(=O)c1ccc(CBr)cc1 2162912538 XBUBQJZNTDETGQ-GOSISDBHSA-N 439.394 4.832 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@@H]1CN(C[C@@H](CBr)c1ccccc1)C2 2163058631 MBXOZQKWQCICOG-KNKQGSTJSA-N 437.422 4.792 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1C1CCN(C[C@H](CBr)C2CCC2)CC1 2185503940 VYNRFYBQHYUGRJ-INIZCTEOSA-N 441.414 4.747 50 10 IJGE CCCC1(NC(=O)OC(C)(C)C)CCN(CCCCCI)CC1 2211183893 JLOLRZJPCFSZIA-UHFFFAOYSA-N 438.394 4.751 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCC(F)(CBr)CC1 2285965063 KGCSXRPSRBKLCL-UHFFFAOYSA-N 431.502 4.581 50 10 IJGE CC(C)[C@@H](Cl)C(=O)N1CCC(c2nc(N(C)C)ncc2-c2cccc(Cl)c2)CC1 2296578167 MHFSJJBNRWEEOO-LJQANCHMSA-N 435.399 4.832 50 10 IJGE CC[C@@]1(C)[C@@H](Br)CCN1c1ncc(Br)cc1Br 2299988219 UAOVYLVYUMDXML-JQWIXIFHSA-N 426.978 4.749 50 10 IJGE ClCCC1(NCc2ccc(I)c(Br)c2)CCC1 2306221730 LHZJZUXRKWLHBY-UHFFFAOYSA-N 428.539 4.695 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(C)C[C@H]2CC[C@H]1C[C@]21CCC[C@@H](CI)O1 2307493729 XVMSBJAXCXCSOF-LTFPAQTLSA-N 449.373 4.833 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(Cc2ccc(Cl)cc2I)[C@H]1C 2321306383 YFTBTTSOKDTQCS-KWBADKCTSA-N 442.566 4.938 50 10 IJGE CCOc1ccccc1[C@H]1C(C#N)=C2N=C(N)c3ccccc3N2C2=C1C(=O)CC(C)(C)C2 3654530 GLFZLJCDUPPWOU-QHCPKHFHSA-N 438.531 4.786 50 10 IJGE O=C(O)[C@H]1Nc2ccc(Cl)cc2[C@@H]2[C@H](Cl)[C@H](Sc3ccccc3[N+](=O)[O-])C[C@@H]12 8425367 FWTSKJIRYVHRKV-IKGUUIFCSA-N 439.320 4.999 50 10 IJGE C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)c1ccccc1OCc1ccccc1 14665990 GUMGIRZAAIZXBJ-LJQANCHMSA-N 446.547 4.792 50 10 IJGE O=C(NNc1ncnc(Oc2cccc3ccccc23)c1[N+](=O)[O-])c1ccc(Cl)cc1 40583516 ZPHSTLSIJCFXAF-UHFFFAOYSA-N 435.827 4.741 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C\Nc1cc([N+](=O)[O-])ccc1Cl)C12CC3CC(CC(C3)C1)C2 217036365 CHIWXBDOEPKOKS-LSXFSIBFSA-N 428.920 4.789 50 10 IJGE Cc1nn(-c2ccccc2)c(O)c1C(=NNC(=O)c1ccc(Cl)cc1)c1ccccc1F 252590629 ATWBIYFAUZRIGT-UHFFFAOYSA-N 448.885 4.861 50 10 IJGE COc1cc(Cl)c([C@H](Br)c2cnn(C)c2Br)cc1Cl 379203146 IWOVARIZPQZCLM-NSHDSACASA-N 428.939 4.982 50 10 IJGE CC(C)(C)C[C@H](CBr)NS(=O)(=O)c1ccc(Br)cc1Cl 393484191 KBDSRYOXDQEKQP-SNVBAGLBSA-N 447.620 4.581 50 10 IJGE CN(C[C@H](Br)C1CC1)C(=O)c1cc(Br)sc1Br 690269512 ZEEXJAGSLVRLND-QMMMGPOBSA-N 446.002 4.519 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccn(-c3ccc(Cl)cc3Cl)n2)c(C(F)(F)F)c1 799746782 JDBLFAHAHCAMBM-UHFFFAOYSA-N 440.212 4.826 50 10 IJGE CN(CCCCc1ccccc1)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 918618935 GVKNILYSHBNPBL-LYBHJNIJSA-N 437.547 4.852 50 10 IJGE O=C(COc1ccc(Cl)cc1)NN=Cc1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1 1083850821 CQIHWYFLKPHQRR-UHFFFAOYSA-N 434.235 4.691 50 10 IJGE O=C(CNc1ccc(Cl)cc1)NN=Cc1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1 1083862115 JBNOHJQRTURDPL-UHFFFAOYSA-N 433.251 4.724 50 10 IJGE O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NN=Cc1c(O)ccc2ccccc12 1084420311 JCDPVRNIUFLCNI-UHFFFAOYSA-N 449.410 4.715 50 10 IJGE Cc1cccc(NC(=O)NN=C2c3ccccc3C[C@H]2NC(=O)c2cccc(Cl)c2)c1 1088691994 PFPOAWMPPGDEHO-OAQYLSRUSA-N 432.911 4.529 50 10 IJGE CC(=O)c1cccc(OCc2cc(C(=O)Oc3ccc([N+](=O)[O-])c4ccccc34)no2)c1 1457869270 IRUAMZKSFMRXJN-UHFFFAOYSA-N 432.388 4.737 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNc2nc(-c3ccccn3)nc(C)c2C)s1 1472512795 IGAUTBYEUNXXPM-UHFFFAOYSA-N 431.521 4.649 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cc3oc(O)nc3cc2F)c(C)n1-c1ccccc1F 1629001027 RRXNMMZKVPBANG-NVNXTCNLSA-N 434.402 4.765 50 10 IJGE C=CCN(CC=C)C(=O)c1ccc(NC(=O)NNc2c(C)cccc2Br)cc1 1673819407 DFNPMNBJPJFHDO-UHFFFAOYSA-N 443.345 4.720 50 10 IJGE CCc1cc(Br)cc2c1O[C@]1(C=C2)CCN(C(=O)[C@H](Br)CC)C1 1859497417 GALKTKCYSUTZKY-CRAIPNDOSA-N 443.179 4.562 50 10 IJGE CCc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865699637 YVLQNVSWRSVFQB-QFIPXVFZSA-N 443.938 4.857 50 10 IJGE COc1ccc(-c2ccc(C(=O)N/N=C\c3ccc(F)c(Br)c3)c(C)n2)cc1 1865762256 WMYLJAJFGNZLQG-MSXFZWOLSA-N 442.288 4.731 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CC[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)C1 1880761528 OCWBRWIUAWRKOW-RRFJBIMHSA-N 435.403 4.606 50 10 IJGE C[C@@H]([C@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1)[C@H](CBr)NC(=O)OC(C)(C)C 1884034201 GLUDYOZOFOXJDC-JONQDZQNSA-N 449.430 4.994 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)Cc1nn(C)c(C)c1Br 1915097063 QDSDNDRURMEASQ-OAHLLOKOSA-N 429.200 4.667 50 10 IJGE CN(Cc1cc(Br)cs1)C[C@@H](Br)COCc1ccccc1 1916348380 NOQZMMXPDLPYQK-OAHLLOKOSA-N 433.209 4.923 50 10 IJGE Cc1ccc(C(F)(F)F)cc1C[C@H](Br)CN1C(=O)c2ccccc2C1=O 1994847562 BSERTJCFCUNRHR-AWEZNQCLSA-N 426.232 4.616 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@@H]1Cc1cc(Br)ccc1Br 2007127206 CVIZFQSHBGPERX-UFGOTCBOSA-N 426.974 4.943 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2C[C@@H](Br)C[C@H]1C2 2033094993 RSMDKCFHBFZNQF-HBNTYKKESA-N 438.001 4.959 50 10 IJGE Clc1ccc(I)c(C[C@@]2(CBr)C[C@]23CCOC3)c1 2039014786 GOOJZDNRAMCKSY-KBPBESRZSA-N 441.534 4.679 50 10 IJGE C[C@H](CC1CCN(C[C@H](Br)C(F)(F)F)CC1)N(C)C(=O)OC(C)(C)C 2083282380 LYZHBSBWNMBBRT-OCCSQVGLSA-N 431.337 4.670 50 10 IJGE FC(F)(F)c1ccc(NC[C@H]2C[C@@H](Br)C2)c(I)c1 2083656156 NEZJZEDACMVKPG-OTSSQURYSA-N 434.037 4.895 50 10 IJGE CC[C@@H](C[C@H](C)Cl)NC(=O)c1ccc(Br)cc1I 2086153559 LWMOJSVLACSKGQ-WPRPVWTQSA-N 444.538 4.580 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2CCN(CC3(CBr)CCCCC3)C[C@@H]2C1 2106788796 SPBRRGQCDSSCBC-ZWKOTPCHSA-N 429.443 4.911 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CC[C@H](CCl)C(F)(F)C1 2150504101 SMGBXPRFVUMIIF-MRVPVSSYSA-N 431.502 4.548 50 10 IJGE ICCCCCN1CCC[C@H]1[C@H]1CCN(Cc2ccccc2)C1 2211187441 UGZBBZUIFXJYKC-PMACEKPBSA-N 426.386 4.578 50 10 IJGE CC[C@@H]1CCN(CCCCCI)[C@@H](CNC(=O)OC(C)(C)C)C1 2211188215 YYMMZOZSRWZETA-HZPDHXFCSA-N 438.394 4.607 50 10 IJGE O=C(Nc1ccc(I)cc1)OCCCCCCBr 2220020112 HEVZMJMLAAKVDI-UHFFFAOYSA-N 426.092 4.795 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CBr)OCc1ccc(C(F)(F)F)cc1 2223305086 XKUVVNKMCIASAI-MRXNPFEDSA-N 426.273 4.900 50 10 IJGE CN[C@H](c1c(F)cc(Br)c(F)c1Br)[C@@H]1C[C@H]1Br 2250747371 LFVFLXPKQJPXLK-NWWTUURKSA-N 433.916 4.534 50 10 IJGE C[C@H](Br)[C@H](NC(=O)c1scc(Br)c1Cl)C(F)(F)F 2253534501 AVJYXDOYLPGAQF-NOWQDGDBSA-N 429.483 4.608 50 10 IJGE C[C@H](COC(F)F)O[C@@H](CI)c1ccc(Br)cc1 2253920174 SZBRHLDTLTXVPS-KCJUWKMLSA-N 435.046 4.570 50 10 IJGE CCOc1ccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3ccc4c(c3)OCO4)c2C)cc1 2294168508 OPTFPJYNVCUPER-UHFFFAOYSA-N 429.476 4.767 50 10 IJGE CCOC(=O)c1ccc(-n2c(C)cc(C=C(C#N)C(=O)Nc3ccc(OC)cc3)c2C)cc1 2294741862 QHCNYAMGZWIVMZ-UHFFFAOYSA-N 443.503 4.825 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1cscc1C(F)(F)F 2320356329 KUDPVBHPFGLHFI-CYBMUJFWSA-N 436.293 4.867 50 10 IJGE Cc1cc(Br)ccc1NC=C(C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 2325255481 WINGOIDJHZRAFS-UHFFFAOYSA-N 435.665 4.777 50 10 IJGE CC(C)C[C@H](CBr)CN1CC[C@H](NC(=O)OC(C)(C)C)C(F)(F)CC1 2328520988 LMXIJDGQHMPAMW-CABCVRRESA-N 427.374 4.668 50 10 IJGE CCOC(=O)Oc1ccc(C(=O)Nc2sc(C(C)=CC#N)c(C)c2C(=O)OC)cc1 2331557585 NUBHDAMOMZKJLS-UHFFFAOYSA-N 428.466 4.558 50 10 IJGE O=S(=O)(CCCN(Cc1ccccc1)[C@H](CBr)C1CC1)c1ccccc1 2343341510 LBHBQQHEDAISBZ-OAQYLSRUSA-N 436.415 4.526 50 10 IJGE Cc1sc(C(=O)N2CCC[C@@H](Br)[C@H]2C(F)(F)F)cc1Br 2370254786 ONUVNQYSMMESTR-XCBNKYQSSA-N 435.103 4.749 50 10 IJGE Cc1ccc(NC(=O)COc2ccc(C=NNC(=O)c3ccc(Cl)cc3)cc2)cc1C 695118 RNDNXEANRKBFGP-UHFFFAOYSA-N 435.911 4.738 50 10 IJGE Cc1cc(/C=N/NC(=O)Nc2ccc(F)cc2)c(C)n1-c1ccc(C(=O)O)c(Cl)c1 59248070 VJZKIMJHAOGCJB-BHGWPJFGSA-N 428.851 4.740 50 10 IJGE COc1ccc([C@@H](C)N/C=C(/C#N)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)cc1OC 217200754 JKBSTEFYNKKDKT-DXVIZAFUSA-N 433.552 4.518 50 10 IJGE C[C@H](Br)CCCNC(=O)c1ccc(Br)cc1Br 227712225 QNPOIVOTBXJFHR-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE COCCCOCCC(CBr)(CBr)c1ccccc1Cl 232239969 QLUIVMKXKNTRHS-UHFFFAOYSA-N 428.592 4.811 50 10 IJGE Cc1onc(-c2ccccc2)c1C(=O)NN=Cc1ccc(OC(=O)c2cccs2)cc1 254397410 CLUJYUSBKJGIEG-UHFFFAOYSA-N 431.473 4.695 50 10 IJGE CCC(=NNC(=O)CSc1nnc(SCc2ccccc2)s1)c1ccc(O)cc1 254463168 LHNHVIJPTMTGNG-UHFFFAOYSA-N 444.607 4.559 50 10 IJGE CC1(C)[C@H](Br)CCN1C(=O)c1cc(Br)sc1Br 383842788 KOTFRKJMJZNIEO-SSDOTTSWSA-N 446.002 4.661 50 10 IJGE Fc1cc2c(cc1Br)nc(CCCl)n2C[C@@H]1CCN1Cc1ccccc1 716230430 QUKUAPLKASJXSS-HNNXBMFYSA-N 436.756 4.994 50 10 IJGE COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NNc2ccc(F)c(F)c2F)cc1 728715382 ACTHUKFQBPWEJO-UHFFFAOYSA-N 433.342 4.570 50 10 IJGE C#CCOc1cccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(OC)cc3)c2C)c1 1529312553 IWITZUBQQXMACK-RCCKNPSSSA-N 425.488 4.660 50 10 IJGE C#Cc1ccc(C(=O)NNC(=O)c2cc(-c3ccc(Cl)cc3)nc3ccccc23)cc1 1540181236 LRRIQHNWGGFCNZ-UHFFFAOYSA-N 425.875 4.611 50 10 IJGE C[C@@H](Br)C(=O)c1cccc(SC(F)(F)F)c1I 1848425895 OYSPJSBGAPCHQX-RXMQYKEDSA-N 439.034 4.869 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C1C[C@@H]2CCC[C@H](C1)N2C(=O)OC(C)(C)C 1882086509 CCEUABYPDQVYPW-UYTSQGDYSA-N 447.414 4.843 50 10 IJGE CN(C[C@@H]1C[C@@H]1Br)C(=O)CC[C@@H](CCNC(=O)OC(C)(C)C)C(C)(C)C 1887829441 JOEQOEDYMCONGE-JYJNAYRXSA-N 433.431 4.586 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1ccncc1Br 1915262217 OCYMHFZQBORJIN-KRWDZBQOSA-N 440.179 4.906 50 10 IJGE COC[C@]1([C@H](Br)c2sc(Br)cc2Br)CCCO1 1922895039 QRMSPUHBDBNJJX-MNOVXSKESA-N 449.002 4.905 50 10 IJGE O=C(N[C@@H](CBr)CC1CC1)c1scc(Br)c1Br 1942799927 UTDNRELDWWKRTL-SSDOTTSWSA-N 446.002 4.567 50 10 IJGE Brc1ccc(CN2CCC[C@@H](Br)CC2)c(Br)c1 1943854558 YWKDZXHSCYRRSH-LLVKDONJSA-N 425.990 4.961 50 10 IJGE C[C@@]1(CBr)CCCN1Cc1ccc(Br)cc1Br 1943854582 ZBOCUQVTHLUMAE-ZDUSSCGKSA-N 425.990 4.961 50 10 IJGE C[C@H]1CC[C@H](Br)CN1Cc1c(Br)cccc1Br 1945321267 GABOGEPGENWRBE-UWVGGRQHSA-N 425.990 4.959 50 10 IJGE C[C@H]1CN(C[C@H](CBr)C(C)(C)C)C[C@@H](C)N1C(=O)OCc1ccccc1 1977952908 SSJSABSWMOSKLH-SCTDSRPQSA-N 425.411 4.775 50 10 IJGE CC(C)(C)[C@@H](CBr)CN1CCC(CNC(=O)OCc2ccccc2)CC1 1977959858 AYZFPYCSLCBESM-IBGZPJMESA-N 425.411 4.682 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1C(=O)c1cc(Br)c(Br)s1 2018106067 BASOYSWSNXWEHH-HTRCEHHLSA-N 446.002 4.661 50 10 IJGE CC[C@H](Br)CCCNC(=O)c1c(Br)cccc1Br 2033089464 UBGLAMPFEFMMSZ-VIFPVBQESA-N 441.989 4.895 50 10 IJGE BrC[C@@]1(Cc2ccc(Br)cc2Br)C[C@]12CCOC2 2039024883 PDDSLEBFTQGUAZ-UONOGXRCSA-N 438.985 4.946 50 10 IJGE CCN(CCCCCl)C(=O)c1cc(Br)ccc1I 2041181245 ULMPTCMZWICNOF-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE CC(C)(C)OC(=O)N1CCC([S@@](C)(=O)=NC[C@H](CBr)C(C)(C)C)CC1 2044698445 BUZJIDPTSSVBEI-HWRSSNJWSA-N 439.460 4.541 50 10 IJGE Clc1cc(CN2C[C@H](Br)[C@H](C3CC3)C2)ccc1I 2086651839 LBMHXFOHEUVHRL-RYUDHWBXSA-N 440.550 4.550 50 10 IJGE Clc1cc(CN2C[C@H](Br)C3(CCC3)C2)ccc1I 2086660443 FAXQQORUOWOCEU-ZDUSSCGKSA-N 440.550 4.694 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)CCCCBr)c2ccccc21 2106768778 SYRMVPVHCZYKSM-OAHLLOKOSA-N 425.367 4.597 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(CC3(CBr)CCCCCC3)C[C@@H]21 2106784479 JAOWAYFOTGFQNB-FGTMMUONSA-N 429.443 4.957 50 10 IJGE Brc1cccc([C@@H](CI)OCCOCCC2CC2)c1 2127763311 KFLCDYVPYRXNGB-OAHLLOKOSA-N 439.131 4.759 50 10 IJGE COCc1cc(Br)c([C@@H](Cl)c2c(Br)nn(C)c2C)s1 2131596946 JERFBCRDBPEJAH-JTQLQIEISA-N 428.577 4.790 50 10 IJGE Fc1cccc(CBr)c1N1CCC[C@]2(CN(Cc3ccccc3)CCO2)C1 2151740078 PYZCVPYSKGJMHD-QFIPXVFZSA-N 433.365 4.592 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(C)CN(C[C@H](CBr)c3ccccc3)C[C@]2(C)C1 2163065290 ZBAYZFROZZFFBT-YUXAGFNASA-N 437.422 4.744 50 10 IJGE Cc1cc(Br)c(C(=O)NC[C@H](Br)CC(F)(F)F)cc1Cl 2175691685 ZUIXJTUJVVCZEV-SSDOTTSWSA-N 437.481 4.857 50 10 IJGE CO[C@H]1CN(c2c(CBr)ccc(Br)c2Cl)CC(F)(F)C1 2185157503 FAZGCJCQMRKSLO-SECBINFHSA-N 433.518 4.858 50 10 IJGE COC(=O)[C@@H](Br)C1(Oc2ccc(Cl)c(Cl)c2Br)CCC1 2206359417 MTIQXLFJVOYAMM-LLVKDONJSA-N 446.950 4.994 50 10 IJGE Clc1ccc(CC23COC(CI)(C2)C3)c(Br)c1 2216250707 BXHPWJAPIJNEPP-UHFFFAOYSA-N 427.507 4.629 50 10 IJGE COc1ccc([C@H](Br)[C@@H](C)[C@H]2CCCO2)cc1I 2257373783 ONOGCELSGPSSIX-MRCXROJRSA-N 425.104 4.551 50 10 IJGE O=C(Nc1ccccc1CBr)c1c(F)cccc1I 2267674379 AOLLLYNADSPISI-UHFFFAOYSA-N 434.046 4.578 50 10 IJGE CCn1nc(C)c(CBr)c1N1CC[C@@]2(CCCN(Cc3ccccc3)C2)C1 2281302207 QSPPZBJYKOPKLU-JOCHJYFZSA-N 431.422 4.599 50 10 IJGE Clc1ccc(I)cc1CN1CCC[C@@H]1CCBr 2307333473 CXSDKUKNDWVSTH-GFCCVEGCSA-N 428.539 4.694 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@@H]1Cc1cc(I)ccc1Cl 2307339150 BNZVADWBUOPDAC-OPQQBVKSSA-N 429.523 4.676 50 10 IJGE CC(C)[C@H](Br)C(C)(C)CNC(=O)c1csc(I)c1 2318085260 NISGYALPSZJYHV-NSHDSACASA-N 444.176 4.528 50 10 IJGE Cl[C@@H]1CC[C@@H]2CN(Cc3ccc(I)c(Br)c3)C[C@@H]21 2325206698 JMRVQLIJBAFJBH-NTZNESFSSA-N 440.550 4.503 50 10 IJGE FC1(F)[C@@H]2CC[C@@H](O[C@@H](CI)c3ccccc3Br)[C@@H]21 2333872081 RWLXKDHHXQQTCH-FOUMNBMASA-N 443.069 4.986 50 10 IJGE CCCc1[nH]c(-c2cc(Br)c(Cl)s2)nc(=O)c1CBr 2353852856 RQAKPVQFSYVSID-UHFFFAOYSA-N 426.561 4.762 50 10 IJGE O=C(N[C@@H](CCl)C1CCCCC1)c1ccc(Cl)cc1I 2365587674 AAWOTLPOXGUGJO-AWEZNQCLSA-N 426.125 4.862 50 10 IJGE Cc1cccc(-c2nc(C)c(C(C)C)c(N3CCN(C(=O)C(C)(C)CCl)CC3)n2)c1 6835679 PBZMKROONQHNPG-UHFFFAOYSA-N 429.008 4.797 50 10 IJGE CC[C@H](C)c1ccccc1O[C@H](CC)C(=O)NNC(=O)COc1cccc2ccccc12 10683598 VWCLHBSXQZYSGW-PGRDOPGGSA-N 434.536 4.737 50 10 IJGE CCCCOc1ccc(/C=C2/C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)cc1OCC 38606931 GEBDLGTWQBGASS-DEDYPNTBSA-N 434.492 4.650 50 10 IJGE C=CCN1C(=O)C(C#N)=C(C)/C(=C\c2cn(-c3ccccc3)nc2-c2cc(C)ccc2C)C1=O 38607601 QKVLOWVQCSTTBJ-BUVRLJJBSA-N 448.526 4.934 50 10 IJGE COc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1cccc(C)c1)CCC2 40811384 HOCYBYOYQUOVDK-ZXVVBBHZSA-N 431.492 4.628 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)/C=C\c4ccccc4)ccc32)cc1 205660982 OKQPNENPIVUNBJ-MOSHVUQSSA-N 438.483 4.922 50 10 IJGE Cc1cc(I)ccc1N/C=C(/C#N)C(=O)Nc1ccccc1Cl 217110931 UVSQBENWCXAZJF-BENRWUELSA-N 437.668 4.711 50 10 IJGE O=C(NC[C@H]1CC[C@@H](Br)C1)c1cc(Br)cc(Br)c1 227678398 KCXUKOODNNSTRL-WCBMZHEXSA-N 439.973 4.505 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc(COc3ccccc3Br)cc2)cc1 252616633 KCJCGLUUVIQYDY-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE O=C(N[C@@H](Cc1ccc(CCl)cc1)C(=O)O)OCC1c2ccccc2-c2ccccc21 309708518 IWWNAIKJCKHJQU-QHCPKHFHSA-N 435.907 4.960 50 10 IJGE Cc1cc(Br)c([C@H](Br)c2c(Br)cnn2C)s1 693046211 GQWSFQXPJBKFHG-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE O=C(N[C@H]1c2ccccc2C[C@H]1Cl)c1scc(Br)c1Br 705419657 ORLRPIIJKOTBTM-PWSUYJOCSA-N 435.568 4.908 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1C(=O)c1cc(Br)cc(Br)c1 705610516 DDFUWQGADIAAHR-WPRPVWTQSA-N 439.973 4.600 50 10 IJGE CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 763799895 ZHFZUKAPEAVKKX-UHFFFAOYSA-N 447.988 4.538 50 10 IJGE O=C(NNc1ccc([N+](=O)[O-])cc1)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 768244064 KZFJJRWLIPCYBK-UHFFFAOYSA-N 433.399 4.571 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCCc2cccc(C(F)(F)F)c2)c1C 771734831 JAVIPBXZDQAMNX-UHFFFAOYSA-N 429.446 4.640 50 10 IJGE O=C(NNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(C(F)(F)F)c(O)n1 1636380902 SJCKFSFLGKZANY-UHFFFAOYSA-N 433.230 4.601 50 10 IJGE CC(=O)c1ccc(O[C@H](C)C(=O)NNC(=O)Nc2ccc(C(C)C)cc2C(C)C)cc1 1667461797 XRESAXMHMCCZST-QGZVFWFLSA-N 425.529 4.756 50 10 IJGE CCOc1ccc2ccccc2c1C=NNC(=O)COc1ccc(C)cc1Br 1772754104 OVOKCEZNJCSTPS-UHFFFAOYSA-N 441.325 4.839 50 10 IJGE C[C@H](Br)C(=O)c1ccc(SC(F)(F)F)c(I)c1 1848425898 PAWQVUQEXUNVER-YFKPBYRVSA-N 439.034 4.869 50 10 IJGE COc1ccc(CC(=O)NCc2ccc(OC(=O)Nc3ccc(SC#N)cc3)cc2)cc1 1858898858 FEKGILXOUKPUQU-UHFFFAOYSA-N 447.516 4.738 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]2C[C@H]2c2ccccc2)cc1 1867059925 YMMWUPFIKJPLJD-HJOGWXRNSA-N 441.556 4.729 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)Cc1ccc(Cl)cc1C(F)(F)F 1902483755 IAFKVDXOZPCHDU-NSHDSACASA-N 446.650 4.961 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Cl)CCc1cc(Br)ccc1Cl 1905407544 YZYYGUJHMLGZLJ-CYBMUJFWSA-N 427.125 4.939 50 10 IJGE Cc1cccc(C(=O)N(Cc2ccccc2)C[C@H](C)Cl)c1I 1914638636 PIQSBKLVMRJLSZ-AWEZNQCLSA-N 427.713 4.869 50 10 IJGE O=C(c1cnccc1C(F)(F)F)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915272282 NOSZHAZBFWBMDS-KRWDZBQOSA-N 427.264 4.916 50 10 IJGE C[C@@H](Cl)CN(Cc1ccccc1)C(=O)c1cc(I)ccc1F 1961212447 CIYIAICGOOLZNT-GFCCVEGCSA-N 431.676 4.700 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)C(=O)c1ncc(Br)cc1Cl 1974520609 FAXUNVQTIRLREB-NSHDSACASA-N 446.570 4.923 50 10 IJGE COc1cccc([C@H](CI)OCCCOCc2ccccc2)c1 1983390661 SRHIAQUWMJYYMZ-IBGZPJMESA-N 426.294 4.795 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@H]2C[C@@H]2C2CCC2)CC1 2022600437 ZASOGZGLUKTRAF-HZPDHXFCSA-N 449.373 4.644 50 10 IJGE C[C@H](CCBr)CCN1CCC[C@]1(CNC(=O)OC(C)(C)C)C(F)(F)F 2044704356 BYPPGCDBOPCJDF-CJNGLKHVSA-N 431.337 4.719 50 10 IJGE C[C@@H]1CCCN(C[C@@H](Br)C(F)(F)F)[C@H]1CCCNC(=O)OC(C)(C)C 2044704973 HXTCPTGLCSJPJA-HZSPNIEDSA-N 431.337 4.718 50 10 IJGE BrC[C@@H]1CC2(CC2)CN1Cc1cc(Br)ccc1Br 2054717961 LFXRQJUIWJERTC-LBPRGKRZSA-N 438.001 4.961 50 10 IJGE C[C@@H](CCBr)CCN1CCN(C(=O)OC(C)(C)C)[C@H](CC(F)(F)F)C1 2055947363 HAEYLDVBUHTGNG-UONOGXRCSA-N 431.337 4.671 50 10 IJGE F[C@@H]1CCO[C@@H]1COc1c(Br)cc(Br)cc1CBr 2058656546 SGSHKLRRVUKHCC-GHMZBOCLSA-N 446.936 4.612 50 10 IJGE CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)n(C(C)C)c1 2059313470 YYPMAZIBIGJCSH-INIZCTEOSA-N 427.408 4.953 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCCN1C[C@H](CBr)c1ccccc1 2106786543 VEBMUCKHVKVALD-WDSOQIARSA-N 425.411 4.933 50 10 IJGE CC(C)(CCl)c1cn(-c2c(Br)cc(Cl)cc2Br)nn1 2108757905 KFJVRGRRNJXJCH-UHFFFAOYSA-N 427.955 4.962 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC2(CCl)CCC1CC2 2122354528 NEIXNUFOGGCMMA-UHFFFAOYSA-N 427.589 4.897 50 10 IJGE CC(C)(CCl)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1I 2155827322 AYWNXZDHCFTPSN-ZDUSSCGKSA-N 426.125 4.814 50 10 IJGE C[C@H]1CCC[C@H](N(C)S(=O)(=O)c2cc(CBr)sc2Br)C1 2179786921 HSBNXKSHAHNEJJ-UWVGGRQHSA-N 445.242 4.605 50 10 IJGE CC(C)(C)OC(=O)N1CCCC(C)(C)[C@H]1CNC(=O)c1ccc(CBr)cc1 2184323475 JBENFUCIMAUPSE-QGZVFWFLSA-N 439.394 4.737 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccccc2)CCN1C[C@H](CBr)c1ccccc1 2186713862 ZTKJZKVCJARYFS-PMACEKPBSA-N 441.335 4.914 50 10 IJGE COc1ccc(Br)cc1S(=O)(=O)N(Cc1ccccc1)[C@@H](C)CCCl 2220398596 FFTOCFFKACDWBT-AWEZNQCLSA-N 446.794 4.666 50 10 IJGE Cc1cc(Cl)cc(C(=O)N(C)C[C@@H]2C[C@@H]2Br)c1NC(=O)OC(C)(C)C 2223980524 DJNZTLUDLLMTAW-FZMZJTMJSA-N 431.758 4.851 50 10 IJGE COc1cc(OC)c([C@H](Br)[C@H]2C[C@H]2Br)cc1Br 2252870738 POXXVJRTSXOOMH-BLYIZYRKSA-N 428.946 4.686 50 10 IJGE BrCc1cc(Br)cc(Br)c1OCC[C@H]1CCO1 2253159247 ZPBKEVANLBLWGA-SNVBAGLBSA-N 428.946 4.664 50 10 IJGE CC(C)c1cc(Br)cc(C(=O)N[C@@H](CI)C(C)C)c1 2265984062 SORORXRGWKYKIR-AWEZNQCLSA-N 438.147 4.762 50 10 IJGE CCCCO[C@@H]1[C@@H](Br)C[C@H]1Oc1cccc(C)c1I 2277956190 PSIDCLQMELOBRW-NJZAAPMLSA-N 439.131 4.700 50 10 IJGE CC(C)(C)CCN(CCBr)C(=O)c1ncc(Br)cc1Cl 2289866490 FXTNVUCJEBXGML-UHFFFAOYSA-N 426.580 4.771 50 10 IJGE C[C@@H](CCCCBr)NCc1cc(I)ccc1Cl 2307325473 ADANWUJOSPMLEB-JTQLQIEISA-N 430.555 4.988 50 10 IJGE BrC[C@@H]1C[C@@H]2CC[C@H]1N2Cc1cccc(Br)c1Br 2308524573 JNSYZZFYZKXGAO-GMXVVIOVSA-N 438.001 4.959 50 10 IJGE O=C(N[C@@H](CCCl)COCc1ccccc1)c1c(F)cc(Br)cc1F 2320558544 QSWORDZUABAZHA-AWEZNQCLSA-N 432.692 4.671 50 10 IJGE Cc1cnccc1CO[C@H](CI)c1ccccc1Br 2340086131 YGDKDDHBCIFBKS-OAHLLOKOSA-N 432.099 4.845 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)[C@H]1CCC[C@@]2(C1)CC2(F)F 2343419446 ZVABWCUJHVWNDV-YQVWRLOYSA-N 430.333 4.689 50 10 IJGE CCN(C[C@]1(CBr)CC1(F)F)[C@@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2351888372 WPFBGJDUADTSFN-HDMKZQKVSA-N 439.385 4.812 50 10 IJGE CC(C)[C@H](Br)C(C)(C)NS(=O)(=O)c1c(Cl)cccc1Br 2365957513 TZJDAPQBENMYND-LBPRGKRZSA-N 447.620 4.579 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CN(C[C@@](C)(CBr)C(C)(C)C)CCO2)C1 2380167076 DFDPTOPLZRJNEW-NHCUHLMSSA-N 447.458 4.536 50 10 IJGE CCCC/C(=N\NC(=O)c1ccc(OC)c(I)c1)c1ccccc1 12573957 CLXQUNQOCLUHAR-HEHNFIMWSA-N 436.293 4.624 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@H]1Br)c1cc(Br)ccc1Cl 123833851 DIOSTHVMASKCJU-UKRRQHHQSA-N 429.539 4.893 50 10 IJGE ClC[C@@H](I)[C@@H](CCl)OCc1ccccc1Br 158548770 GRUBIWQEQJOPBV-GHMZBOCLSA-N 437.930 4.616 50 10 IJGE CCCOc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4)nc3c2)cc1OC 169926876 IEHYZMJQLFNHDH-WGOQTCKBSA-N 428.492 4.791 50 10 IJGE CC(=NNC(=O)COc1cccc(C)c1C)c1cccc(NC(=O)c2cccc(C)c2)c1 252600726 DTKKZXZPKRQLQQ-UHFFFAOYSA-N 429.520 4.783 50 10 IJGE CC(=NNC(=O)/C(=C/C(C)=C/c1ccccc1)NC(=O)c1ccccc1)c1ccc(O)cc1 252622241 NRCONHIAHYHNKB-YVWWWAKHSA-N 439.515 4.650 50 10 IJGE O=C(NN=Cc1c(OC(=O)c2ccccc2)ccc2ccccc12)c1cccc([N+](=O)[O-])c1 254383982 FMDPZUTWYUEYNK-UHFFFAOYSA-N 439.427 4.731 50 10 IJGE BrCc1cc(Br)cc(Br)c1OC[C@@H]1CCOC1 310324316 YJZFROAXXCCKNU-MRVPVSSYSA-N 428.946 4.522 50 10 IJGE C[C@@H]1C[C@H](Br)CN(C(=O)c2cc(Br)sc2Br)C1 401899050 MDEMLMQCNHQOFO-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE CN(C(=O)c1cc(Br)cc(Br)c1)[C@H]1CCC[C@H]1Br 709265244 BZOKVKMMKONBCN-NEPJUHHUSA-N 439.973 4.600 50 10 IJGE ClCCc1nc2ccc(Br)cc2n1Cc1cnc(Br)s1 718874791 VPEMBNRFKBKJNH-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE COc1ccc(NNC(=O)c2cccnc2Oc2ccc(F)cc2Br)cc1 729274252 UENALDRWMLMSSZ-UHFFFAOYSA-N 432.249 4.541 50 10 IJGE Cc1ccc(SCC(F)(F)F)c(NC(=O)NNC(=O)c2cn(C)c3ccccc23)c1 756664074 LPWYOBLZZUEYNT-UHFFFAOYSA-N 436.459 4.608 50 10 IJGE O=C(NNc1ccc2ccccc2n1)c1cc(Oc2cccc(Br)c2)ccn1 777465230 FVRVQEHQZXIFEC-UHFFFAOYSA-N 435.281 4.942 50 10 IJGE CC(=NNC(=O)c1sc(-c2ccc(Cl)cc2)cc1N)c1ccc2nc(O)oc2c1 794878992 KBVLBUTZLDPSJQ-UHFFFAOYSA-N 426.885 4.652 50 10 IJGE CSc1ccc([C@H](C)NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cc1 799038049 FHVUMZDHLCJTNX-CQHJRZBDSA-N 441.560 4.970 50 10 IJGE Cc1ccccc1NC(=O)C(=O)NN=Cc1cc(C)n(-c2ccccc2C(F)(F)F)c1C 1084222067 VCRUWBAIZYDOJF-UHFFFAOYSA-N 442.441 4.510 50 10 IJGE C#CCN(C(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(OCC)cc2)c1C)c1nccs1 1126809345 BIXMDPKEPGOQDJ-HMMYKYKNSA-N 430.533 4.523 50 10 IJGE C/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1 1623476958 NXHTWBXPMFMPJK-VLGSPTGOSA-N 440.478 4.543 50 10 IJGE CC(=O)N(C)c1ccc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3cccc(Cl)c3)c2C)cn1 1626948852 DXOHJIMBRSWRHL-ODLFYWEKSA-N 447.926 4.671 50 10 IJGE CCCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@H]2c1cc(Cl)ccc1O 1865689113 KBVKNSOMRUQYDP-LJQANCHMSA-N 436.899 4.546 50 10 IJGE N#C[C@H]1CN(c2ccc(CBr)c(Br)c2)CCN1Cc1ccccc1 1914891209 LSNSXQKKANZFOT-SFHVURJKSA-N 449.190 4.558 50 10 IJGE O=C(c1ccc(C(F)(F)F)nc1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915263932 IXKJOVWHXADFFO-INIZCTEOSA-N 427.264 4.916 50 10 IJGE C[C@H]1[C@H](Br)CCCN1Cc1ccc(Br)cc1Br 1943859444 PCQCZWKMNRZHNC-JOYOIKCWSA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)NCCCN(C[C@H](CBr)C1CCC1)CC(F)(F)F 1966374275 QQFMEKYUVGWHDN-AWEZNQCLSA-N 431.337 4.577 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc([C@]2(C)CC[C@H](CI)O2)cc1 1987516539 ADSVXUJSQKRPMU-QAPCUYQASA-N 431.314 4.541 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)ccc1F 2008321464 IJTYRZWXBLNDEP-ZDUSSCGKSA-N 434.758 4.844 50 10 IJGE Cc1cc(Br)c(NC(=O)[C@H]2C[C@H](Br)C2)c(Br)c1 2020166267 BWEVMXRZXRAOFK-ZKCHVHJHSA-N 425.946 4.632 50 10 IJGE CCCN1C[C@@H](Br)[C@H](Cc2c(Br)cccc2Br)C1 2039264212 BWBBOYYVKFOVAZ-QMTHXVAHSA-N 440.017 4.859 50 10 IJGE CC(C)c1ccccc1NC(=O)COC(=C(C#N)c1nnc2n1CCCCC2)C(F)(F)F 2040430743 PYEJUJIKWMWGCI-UHFFFAOYSA-N 447.461 4.580 50 10 IJGE O=C(N[C@@H]1C[C@H]2CC[C@H]1[C@H](Cl)C2)c1cc(Br)sc1Br 2139718510 IZMLLGPRBABDSL-AKEJEFCPSA-N 427.589 4.799 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC12CCC(NC(=O)c1ccc(CBr)cc1)CC2 2162491239 WXGOPZTVBXZMDD-BQIYRTECSA-N 437.378 4.537 50 10 IJGE CCC[C@]1(CNC(=O)c2ccc(CBr)cc2)CCCN1C(=O)OC(C)(C)C 2162494290 HGBWMAQPQDHFKH-OAQYLSRUSA-N 439.394 4.881 50 10 IJGE CC[C@@]1(CBr)COCCN1Cc1cc(Cl)c(C)c(Br)c1 2169029480 QPYMMYWGCJONSX-OAHLLOKOSA-N 425.592 4.787 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@@H]2CCO[C@]2(CNC(=O)OC(C)(C)C)C1 2175181486 HUVSPNZXADXXCV-LAUBAEHRSA-N 447.458 4.584 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CCCCCCCBr)C[C@H]1C(F)(F)F 2277448912 NJWUKGDKVQTNLB-LSDHHAIUSA-N 445.364 4.967 50 10 IJGE CCO[C@]1(COc2c(Br)cc(Br)cc2CCl)CCOC1 2287069316 LWTQHQFOYHHMGI-CQSZACIVSA-N 428.548 4.525 50 10 IJGE C[C@H](Br)CN(CCC(C)(C)C)S(=O)(=O)c1cc(Br)cs1 2288050477 WTQHVBDNOAVWNB-JTQLQIEISA-N 447.258 4.721 50 10 IJGE CCOC(=O)c1ccsc1NC(=O)C(C#N)=Cc1ccc(COc2ccccc2C)o1 2295672669 MSGCRJOFSKPDQK-UHFFFAOYSA-N 436.489 4.951 50 10 IJGE CCCCN(CCBr)Cc1ccc(Cl)c(I)c1 2300238168 HNGNXCVVJQBKEL-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE BrCCC[C@H]1CCCN(Cc2sccc2I)C1 2301075150 ZNJZEIAINQNXPE-NSHDSACASA-N 428.177 4.740 50 10 IJGE CO[C@@H]1C[C@H](Cl)C[C@H]1Cc1ccc(I)c(Br)c1 2306199757 PPFCXQBDAFPXJS-GIPNMCIBSA-N 429.523 4.629 50 10 IJGE Clc1ccc(CN2C[C@@H]3CC[C@H](Br)[C@H]3C2)cc1I 2315553881 YHFUGLYPNLPBCG-SRVKXCTJSA-N 440.550 4.550 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@](C)(CBr)C(C)(C)C)[C@@H](C(F)(F)F)C1 2352076624 JABOTJPOHPBBOF-DYVFJYSZSA-N 445.364 4.917 50 10 IJGE O=C(NC[C@H]1CC[C@H](CCl)CC1)c1ccc(Cl)cc1I 2365598791 RYNHCKDFAUTRBF-XYPYZODXSA-N 426.125 4.720 50 10 IJGE C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1 14031624 UPTFNBXZHYWZLB-KGLIPLIRSA-N 447.318 4.529 50 10 IJGE COc1cc(/C=C(/C#N)c2nc3ccccc3[nH]2)ccc1OCC(=O)Nc1ccc(C)cc1 33467045 ULGQIIJCZZDFGM-UYRXBGFRSA-N 438.487 4.962 50 10 IJGE Cc1c(C(=O)N2CCC(C)CC2)oc2c1/C(=N/NC(=O)c1ccccc1Cl)CCC2 40812559 DRRKSODBYXYSOW-XIEYBQDHSA-N 427.932 4.584 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)ccc1OC(=O)c1ccc(C)c(C)c1 40869981 NVVMUPYUIOIIDS-OEAKJJBVSA-N 440.499 4.755 50 10 IJGE CCCCCCCCCCCCCC(=O)NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 100443186 GKYKQBFORPWSEI-HSZRJFAPSA-N 443.632 4.884 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\N1CCC(Cc2ccccc2)CC1 217240242 SOAKDKXSIPFPLF-ATJXCDBQSA-N 445.563 4.944 50 10 IJGE N#C/C(=C/N1CCN(c2ccccc2)CC1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 217250488 LTBCYIWQABVLQM-PFONDFGASA-N 434.849 4.527 50 10 IJGE C[C@H]1CCN(C(=O)c2cc(Br)sc2Br)C[C@@H]1Br 235617117 UDWRGNICOHUIJA-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE CC(=NNC(=O)c1ccc(Br)o1)c1cccc(NC(=O)c2cccs2)c1 254417039 PAEWQLQKZWDRIM-UHFFFAOYSA-N 432.299 4.510 50 10 IJGE CCOc1ccc(C=NNC(=O)c2cc(-c3ccc(OC)cc3)nn2-c2ccccc2)cc1 254507414 PSPPLLABDHWWRI-UHFFFAOYSA-N 440.503 4.711 50 10 IJGE CCCC[C@H](CC)CO[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1I 299983305 VXSXVTQFBVRSGL-ZNMIVQPWSA-N 425.351 4.642 50 10 IJGE CC(C)Cc1ccc([C@@H](Br)c2cnn(C)c2I)cc1 379139573 ADWXBKPEEKGJAH-CQSZACIVSA-N 433.131 4.708 50 10 IJGE C[C@@H]1C[C@@H](Br)CN(Cc2cc(Cl)ccc2I)C1 405309626 SJWAOCBWKZFLHG-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE BrCc1cc(Br)cc(Br)c1OC[C@@H]1CCCOC1 690497882 LKSUECBORDBUQY-SECBINFHSA-N 442.973 4.912 50 10 IJGE ClCCc1nc2c(Br)cccc2n1Cc1sncc1Br 722790596 PUTRBLRKSNDQOW-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccc(OCc3ccccc3C#N)cc2)c(C(F)(F)F)c1 799747637 FSXSSYXSZYBLQC-UHFFFAOYSA-N 436.393 4.785 50 10 IJGE N#CSc1ccc(NC(=O)c2c3c(nc4c(Br)cccc24)CCOC3)cc1 1859617592 BIYNZLVNLYBEGV-UHFFFAOYSA-N 440.322 4.895 50 10 IJGE Cc1nn(Cc2cccc(F)c2)c2c1[C@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 1865685159 DWIMJEGKSZHMRH-LJQANCHMSA-N 429.282 4.904 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865713143 RSCCHUOUUUMKKJ-HXUWFJFHSA-N 449.898 4.664 50 10 IJGE CC(C)(NC(=O)[C@@H](Cc1ccncc1)c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1866696753 XKOLQJWYLCZNLW-QFIPXVFZSA-N 444.560 4.515 50 10 IJGE CCC[C@H](NC(=O)C[C@H](C)c1cccc(OC)c1)C(=O)Nc1ccc(SC#N)cc1 1867113358 NRPRKBDOUZXVJC-KKSFZXQISA-N 425.554 4.686 50 10 IJGE CCN(C[C@@](C)(CI)O[C@@H](C)CC1CC1)C(=O)OC(C)(C)C 1917441139 CLQINUIVMWEQNR-SUMWQHHRSA-N 425.351 4.642 50 10 IJGE CC(C)C[C@H](CNC(=O)OC(C)(C)C)[C@H]1CCC[C@@H](CI)O1 1931100231 YHHBILQQZOQXLO-QLFBSQMISA-N 425.351 4.546 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3[C@H](Br)CC[C@H]3C2)c1 2027640888 BYPGQTGSLFPVAN-ZWKOPEQDSA-N 440.550 4.550 50 10 IJGE C=CCc1cc(C=C(C#N)c2nc(O)c3cc(Br)ccc3n2)cc(OC)c1O 2042455126 JWDWIYPLUBBWOF-UHFFFAOYSA-N 438.281 4.605 50 10 IJGE C[C@]1(NC(=O)c2cc(Br)ccc2Br)CCC[C@H]1Br 2062574707 VEMFEXSRPRFZKI-YPMHNXCESA-N 439.973 4.648 50 10 IJGE CC(C)(C)OC(=O)N(C(=O)C(C#N)=Cc1ccccc1)[C@H](CN)c1cccc(Cl)c1 2077614639 AXMBXFRPRLCSGE-HXUWFJFHSA-N 425.916 4.711 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@H](CBr)c2ccccc2)C(C)(C)C1 2132466687 HGZHMSOODNQJJC-AEFFLSMTSA-N 425.411 4.790 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@@H]1[C@H]2C[C@@H]3[C@H]1[C@@H]3C2 2134581734 JNXUHLJRJVSLGQ-RPWZUSHKSA-N 431.111 4.564 50 10 IJGE C[C@@]12CC[C@@](CCl)(C1)N(C(=O)c1cc(Br)c(Br)s1)C2 2134798897 ZRZFDIDMTSYFCB-OLZOCXBDSA-N 427.589 4.897 50 10 IJGE C[C@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)N1CCC(CCCl)CC1 2166879324 BEMHMKFTMSLIFC-QGZVFWFLSA-N 427.035 4.897 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN(C(=O)[C@H](Br)C2CCCC2)C1 2167034577 XHVPXOOVFURZGU-RCCFBDPRSA-N 443.426 4.578 50 10 IJGE C[C@H]1[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)C[C@@H](C)CN1C(=O)OC(C)(C)C 2209050759 TWZCUAFNUVUMFF-CBBWQLFWSA-N 435.403 4.556 50 10 IJGE C[C@@H]1[C@H](NC(=O)OC(C)(C)C)CC(C)(C)CN1CCCCCI 2211183082 BSCZHSKMRRDONF-HUUCEWRRSA-N 438.394 4.605 50 10 IJGE Cc1sc(Br)c(C)c1[C@H](Br)c1nn(C)nc1Br 2214373852 UTCQNFAORUHQKY-ZETCQYMHSA-N 443.990 4.503 50 10 IJGE N[C@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@@H](Br)C1 2250746816 DLTFQLCQBXFKMG-XOGFGSHOSA-N 433.916 4.663 50 10 IJGE COc1cc(C=CC(=O)Cl)cc(I)c1OCc1ccccc1 2293941103 ZXVHFPKFOBLFCD-UHFFFAOYSA-N 428.653 4.657 50 10 IJGE CCCCc1ccc(C[C@H]2SC(=C(C#N)C(=O)NC)N(c3ccc(C)c(C)c3)C2=O)cc1 2314594003 XLASURSBOZBCDV-HSZRJFAPSA-N 447.604 4.818 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(C)CN(CC2(CBr)CCCCC2)CC1(F)F 2315165547 DYJPKXKRLOWQRZ-MRXNPFEDSA-N 425.358 4.566 50 10 IJGE CC[C@@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@H]1CBr 2315548979 MWGFVAHWOHDOAU-VXGBXAGGSA-N 442.566 4.798 50 10 IJGE CC(C)N1C[C@@H](Br)[C@@H](Cc2ccc(Cl)c(I)c2)C1 2315549980 YEQNCKFFDKMCRI-NWDGAFQWSA-N 442.566 4.591 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Br)Cc1ccc(F)cc1 2316702242 XEEMTOHIOFKUHR-SECBINFHSA-N 440.936 4.763 50 10 IJGE N#CC(=Cc1ccc(Br)cc1)C(=O)NCCc1ccc(-c2cccnc2)cc1 2329659699 HHBXILWYVSOFTB-UHFFFAOYSA-N 432.321 4.777 50 10 IJGE Cc1ccc(C23C[C@H]4C[C@@H](CC(NC(=O)N/N=C/c5cccc([N+](=O)[O-])c5)(C4)C2)C3)cc1 100489901 PIKQWKYEPINREY-FNVNHVTFSA-N 432.524 4.827 50 10 IJGE CCCCOc1ccc(/C=N/NC(=O)c2nn(-c3ccccc3)c3c2CCC3)cc1OCC 169927626 REBNGOAGOWAVBH-OVVQPSECSA-N 446.551 4.703 50 10 IJGE COc1ccc([C@@H](C)NC(=O)/C(C#N)=C\N[C@H](C)c2ccc3c(c2)CCCC3)cc1OC 217171644 OPCXVARRIOFILS-DXVIZAFUSA-N 433.552 4.518 50 10 IJGE Cc1cccc(C(=O)NC[C@H](Br)CC(C)(C)C)c1I 235788006 FJJKYCZSSQSXGM-LLVKDONJSA-N 438.147 4.529 50 10 IJGE O=C(NN=Cc1ccc(OC(=O)c2cccc3ccccc23)cc1)c1cccc([N+](=O)[O-])c1 254818447 JANRSJPYVUEKNF-UHFFFAOYSA-N 439.427 4.731 50 10 IJGE Cc1cc(I)cc(NC(=O)c2ccc(CBr)cc2)c1 690586282 RHNCHUHZTDSMMN-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE CCOC(=O)O[C@]1(C(=O)OCCl)CC[C@@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@@]21C 725239822 FVOOBFFVLCZGIJ-OHHYZGJZSA-N 448.943 4.866 50 10 IJGE Cc1nc(-c2ccc(CNC(=O)NNC(=O)c3c(Cl)cccc3Cl)cc2)cs1 727847025 ORLGJQGNTINYFM-UHFFFAOYSA-N 435.336 4.570 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1ccc(OCc2cccc(F)c2)c(F)c1 756381164 XPLQREXIAHTFAY-UHFFFAOYSA-N 448.429 4.559 50 10 IJGE O=C(NNc1ccc(Br)c(F)c1)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 771680459 CNWWJRLZCACAED-NEPJUHHUSA-N 433.199 4.734 50 10 IJGE CCCOc1c(Cl)cc(/C=C(\C#N)C(=O)NCc2ccc([N+](=O)[O-])cc2)cc1OCC 787149257 OKIDGXAIZXOZRZ-LICLKQGHSA-N 443.887 4.659 50 10 IJGE C=CCC[C@H](NC(=O)NNC(=O)Cc1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1 1478272033 HJGHMNGNOVWPJE-SFHVURJKSA-N 439.865 4.939 50 10 IJGE CCOc1cc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CBr)ccc1OC 1614687756 CUZXRDWDRFVMQC-OALUTQOASA-N 448.357 4.841 50 10 IJGE C=C(C)COc1cccc(NC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)c1 1658980319 YJKBIUZDFPRRDO-UHFFFAOYSA-N 449.482 4.826 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CCC)nn2Cc1ccc(C)cc1 1865691160 LAIRHEOEEUVRRU-DEOSSOPVSA-N 440.547 4.975 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1ccccc1Cl 1915291964 UKKQDEQGBHVREK-KRWDZBQOSA-N 430.795 4.950 50 10 IJGE CC[C@@](C)(CBr)NC(=O)c1c(Br)cccc1Br 1945332526 DMDMSMASJTYWNH-LBPRGKRZSA-N 427.962 4.505 50 10 IJGE BrCc1ccc(OCCOCCOCc2ccccc2)cc1Br 1983394436 ANOSFFXMAJURFQ-UHFFFAOYSA-N 444.163 4.956 50 10 IJGE CC(C)(C)N(CCBr)C(=O)c1cccc(Br)c1Br 2031482153 PCQHRNIHGHHROI-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE CC(C)C[C@H](Br)CNC(=O)c1c(Br)cccc1Br 2033094573 PULDWYMQVINDSF-VIFPVBQESA-N 441.989 4.751 50 10 IJGE FC1(F)C(O[C@@H](CI)c2ccc(Br)cc2)C1(F)F 2062573930 NLSIRKULBXQTEH-QMMMGPOBSA-N 438.984 4.595 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1ccc(NC(=O)OC(C)(C)C)c(Cl)c1 2076220993 RINBKNZBUCGLTI-UHFFFAOYSA-N 431.758 4.933 50 10 IJGE CC[C@H]1[C@H](CBr)CCN1Cc1ccc(I)c(Cl)c1 2086658804 QMEAQPQJDJOYGH-FZMZJTMJSA-N 442.566 4.940 50 10 IJGE Cc1cc(Br)cc(C(=O)N[C@H](C)CCCCCI)c1 2117894271 KWTMBFATYLYADC-GFCCVEGCSA-N 438.147 4.871 50 10 IJGE COCc1cc(Br)c([C@H](Cl)c2c(C)nn(C)c2Br)s1 2129268127 RGMXXTSDMHGYBT-SNVBAGLBSA-N 428.577 4.790 50 10 IJGE O=C(NC[C@@H]1CCCC[C@H](Cl)C1)c1cc(Cl)ccc1I 2163753132 FXVYDARRJQNUMY-MNOVXSKESA-N 426.125 4.862 50 10 IJGE FC(F)(F)[C@@]1(CBr)CCN(Cc2ncc(Br)cc2Cl)C1 2183581303 IHPIRWLTNAALSN-LLVKDONJSA-N 436.497 4.647 50 10 IJGE CC(C)(C)OC(=O)NC(C)(C)[C@@H]1CCCCN1CCCCCI 2211187016 YXFXZQCMBJIUSI-HNNXBMFYSA-N 438.394 4.750 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1C(=O)c1cc(Br)c(Br)s1 2251009891 NBAATJIFMHWIRG-HTRCEHHLSA-N 446.002 4.661 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(c2ccccc2)CCN(CC2(CBr)CC(F)C2)C1 2280359913 QBXLDHFEDNAQBR-FBPXKMNZSA-N 441.385 4.626 50 10 IJGE O=C(c1ccc(Cl)c(I)c1)N1CCC[C@@H](CCCl)CC1 2283655891 VZRMIJRYDXEMKJ-NSHDSACASA-N 426.125 4.816 50 10 IJGE CCOC(=O)c1c(-c2ccc(OC)cc2)csc1NC(=O)C(C#N)=Cc1ccc(O)cc1 2296833285 UCQRVKSXVRVIMM-UHFFFAOYSA-N 448.500 4.852 50 10 IJGE CC(=Cc1ccccc1)C=C(NC(=O)c1ccccc1)C(=O)NN=C(C)c1ccc(O)cc1 2297455750 NRCONHIAHYHNKB-UHFFFAOYSA-N 439.515 4.650 50 10 IJGE CC1(C)C[C@@H](CBr)CN(Cc2sccc2I)C1 2301070460 CPDZVBDKASMHBM-JTQLQIEISA-N 428.177 4.596 50 10 IJGE C[C@@H]1[C@H](Br)CCN(c2ncc(Br)cc2Br)[C@@H]1C 2304182219 JUICMIGICUVHSS-QXFUBDJGSA-N 426.978 4.605 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1OCc1ccccc1F 2313730498 XNVLIDHHBLDROR-UHFFFAOYSA-N 447.422 4.867 50 10 IJGE CCOC(=O)C(C#N)=Cc1cccc(OC(=O)C=Cc2ccc(OCC)c(OCC)c2)c1 2314753537 ANRYBALTKYHNEK-UHFFFAOYSA-N 435.476 4.573 50 10 IJGE Cl[C@H]1CCN(Cc2ccc(I)c(Br)c2)CC12CC2 2325206782 KNMNKBMFANCUAE-ZDUSSCGKSA-N 440.550 4.647 50 10 IJGE ClC[C@H]1C[C@@H]2CC[C@H]1N2Cc1ccc(I)c(Br)c1 2325212047 BWLYUSDRDHOPBL-UHIISALHSA-N 440.550 4.645 50 10 IJGE O=S(=O)(CCC(CCl)CCl)Nc1ccc(Cl)c(Br)c1Cl 2362199472 SHKRHSGRFUOHDX-UHFFFAOYSA-N 444.005 4.982 50 10 IJGE CC(C)C[C@H](CBr)CN1CCCC[C@H]1[C@@H]1CCCN(C(=O)C(F)(F)F)C1 2382185447 YQQFEDYGYRPDNX-ZACQAIPSSA-N 441.376 4.699 50 10 IJGE CC[C@H](C)c1ccccc1OCC(=O)NNC(=O)c1cccc(OCCc2ccccc2)c1 10330849 BLVYYBBWQQQHTK-FQEVSTJZSA-N 446.547 4.662 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2ccc(Cl)cc2Cl)c(C)n1C[C@@H]1CCCO1 15303751 YPERKVKIXVEZLX-KYSILRCISA-N 432.351 4.814 50 10 IJGE CCCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(C)o1 38659380 JLLOEPGSAUIQSF-QHCPKHFHSA-N 430.460 4.814 50 10 IJGE Cc1c(C(=O)Oc2cccnc2)oc2c1/C(=N/NC(=O)c1cccc3ccccc13)CCC2 40813624 OIPWYVIFWHLGDN-SGWCAAJKSA-N 439.471 4.826 50 10 IJGE CCOCCCN(C(=O)CCl)[C@H](C(=O)NC1CCCCCC1)c1ccc(Cl)cc1 97914895 GETNWGWXSLBJQV-NRFANRHFSA-N 443.415 4.714 50 10 IJGE COc1cc(N/C=C(/C#N)c2nc(-c3ccc4c(c3)OCO4)cs2)cc(OC)c1OC 102455673 PYIUZZOZHBSICV-UVTDQMKNSA-N 437.477 4.541 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)COc2ccc(C(C)C)cc2)c(OCC)c1 206290000 FTWLTJGAEJLDNB-MOSHPQCFSA-N 437.492 4.663 50 10 IJGE C[C@@H](C[C@@H](C)Br)NC(=O)c1ccc(Br)cc1Br 235188555 CESYWNXRLJFPML-SFYZADRCSA-N 427.962 4.503 50 10 IJGE C[C@]12CCCC[C@@H]1[C@H]2C(=O)NN=Cc1ccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 254750131 MNSBUHVLKZLDLS-AGHHOFFYSA-N 438.440 4.572 50 10 IJGE FC(F)(F)COCCOc1c(Br)cc(Br)cc1CCl 311505241 GDGWSJVIEJXANT-UHFFFAOYSA-N 426.454 4.908 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1C(=O)c1cc(Br)ccc1Br 384244997 JFVXECZQEVDZMJ-KCJUWKMLSA-N 439.973 4.600 50 10 IJGE Clc1ccc(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@H]32)c(CBr)c1 404213540 XTOVHVZCLUCXSY-NHCUHLMSSA-N 435.793 4.715 50 10 IJGE CC(C)S(=O)(=O)CCC[C@H](CBr)Cc1cccc(Br)c1 696943759 UHIMUAZAIJIXRD-AWEZNQCLSA-N 426.214 4.606 50 10 IJGE CCC[C@H](CCBr)NC(=O)c1scc(Br)c1Br 716817409 HMJCHUZUJUHVNU-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE N#Cc1ccc(NNC(=O)CCc2ncc(-c3ccccc3Cl)o2)c(C(F)(F)F)c1 799750868 LXQRZFQHFINJDS-UHFFFAOYSA-N 434.805 4.961 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc3ccccc3n2CC(F)(F)F)c(C(F)(F)F)c1 799751845 SXNIHVHSTBBTDM-UHFFFAOYSA-N 426.320 4.851 50 10 IJGE COc1cc(/C=C\C(=O)Cl)cc(I)c1OCc1ccc(F)cc1 1081475902 LMSMTBIGEGLVNN-DAXSKMNVSA-N 446.643 4.797 50 10 IJGE COc1cccc(C(=O)NN=Cc2ccccc2OCc2ccc(Br)cc2)c1 1084131923 SNHAKTKZEHNONM-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE CCC(=NNC(=O)COc1ccc(Br)cc1Br)c1ccccc1 1084450960 OPZYJLNOCPRIJX-UHFFFAOYSA-N 440.135 4.521 50 10 IJGE CC(C)Oc1ccc(Br)cc1/C=C(/C#N)C(=O)Nc1cccc([N+](=O)[O-])c1 1084499901 ZFVPUZAXUFBHNH-ZSOIEALJSA-N 430.258 4.690 50 10 IJGE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NNc1cc(C#N)ccc1Br 1453046747 RYKIZYDTLYSSKK-FLIBITNWSA-N 440.219 4.766 50 10 IJGE C#C[C@H](NC(=O)NNc1cc(C(F)(F)F)ccc1Br)c1ccc(F)cc1 1686917790 VTATVAAJIIXNDC-AWEZNQCLSA-N 430.199 4.608 50 10 IJGE CCOc1cc(NC(=O)[C@H](Br)CC)c(OCC)cc1NC(=O)c1ccccc1 1859498639 JBGHQYPWVGWJIF-OAHLLOKOSA-N 449.345 4.848 50 10 IJGE Cc1nn(Cc2cccc(F)c2)c2c1[C@@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 1865685192 FKUKDQLTDPOAFH-SFHVURJKSA-N 429.282 4.904 50 10 IJGE CCc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865701804 FWSUKSMEFSHHDU-IBGZPJMESA-N 426.854 4.644 50 10 IJGE Cc1ccc(-c2nc(Nc3ccc(SC#N)cc3)cc(N3CCC[C@H](CO)C3)n2)cc1 1868321125 WATNSYVJMXZABB-SFHVURJKSA-N 431.565 4.978 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)Cc1cnn(Cc2ccccc2)c1 1915130050 GPHBPSXDIDVCSF-QFIPXVFZSA-N 440.385 4.676 50 10 IJGE O=C(N[C@@H]1CC[C@H](CBr)C1)c1scc(Br)c1Br 1942372755 ZKOWEOHTYCJEBM-NKWVEPMBSA-N 446.002 4.567 50 10 IJGE C[C@@H]1CCN(Cc2c(Br)cccc2Br)C[C@@H]1Br 1945333882 WEOZQKCKLPMBID-RNCFNFMXSA-N 425.990 4.817 50 10 IJGE C[C@@](CBr)(NC(=O)c1ccc(Br)cc1Br)C1CC1 2029957744 UKRFEWCHVHREPW-ZDUSSCGKSA-N 439.973 4.505 50 10 IJGE Brc1cc2c(cc1[C@@H](Br)C1(Br)CC1)OCCCO2 2049222974 KBCXXPAKYDHDPK-GFCCVEGCSA-N 440.957 4.974 50 10 IJGE BrC[C@H]1C[C@H]2CC[C@H]1N2Cc1cc(Br)ccc1Br 2054718315 MZYRRXFRWMTFOW-GAJTVXKRSA-N 438.001 4.959 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@H](Cl)CC2(CCC2)C1 2095000374 RNBIMLGARGKWEH-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@@H](CBr)C(F)(F)C1 2115929378 KJXRKTONBFDVBY-LURJTMIESA-N 437.531 4.656 50 10 IJGE CC(C)[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(OCCBr)cc1 2123267721 BBYSOYZIARSODJ-KRWDZBQOSA-N 440.403 4.696 50 10 IJGE CO[C@]1(C(F)(F)F)C[C@H](C(=O)N(Cc2ccccc2)[C@@H](CBr)C2CC2)C1 2125554951 BFZDENBCTCHFBJ-XYJFISCASA-N 434.296 4.546 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CN(C(=O)[C@@H](Br)C1CCCC1)CC2 2167033798 PCMINUMINUPOIG-SFHVURJKSA-N 437.378 4.872 50 10 IJGE Cc1sc(Br)cc1C(=O)N1CC[C@@](CBr)(C(F)(F)F)C1 2167679785 PUAHGMBSOXDMCC-NSHDSACASA-N 435.103 4.609 50 10 IJGE Cc1c([C@H](Cl)c2c(Br)cc(F)c(F)c2F)nn(C)c1Br 2168218978 VLFAYLASRRCCGD-MRVPVSSYSA-N 432.465 4.999 50 10 IJGE C[C@@H](NC(=O)c1ccc(CBr)cc1)[C@H](NC(=O)OC(C)(C)C)c1ccco1 2172878616 VSLFRDHUSPONQW-DYVFJYSZSA-N 437.334 4.559 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1Br)[C@H](CCBr)C(F)(F)F 2178514946 HQDGSIVGZJUMJG-SNVBAGLBSA-N 437.481 4.890 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@]12CCCC[C@H]1N(C(=O)OC(C)(C)C)CCC2 2196908448 XNCUVYRKTWJXTN-WOYCLPQFSA-N 443.426 4.578 50 10 IJGE CC1(C)CCC(CNC(=O)[C@H](Br)C2CCCC2)(NC(=O)OC(C)(C)C)CC1 2201481307 BXKFJSLTWVZEJA-MRXNPFEDSA-N 445.442 4.920 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2Cc1ccn(Cc2ccccc2)n1 2202320439 SILZTFIUEBBGDL-UHFFFAOYSA-N 445.748 4.839 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@@H](Br)c1cn(C)c(Br)n1 2264358328 AOIGFBMUQSHNIH-LLVKDONJSA-N 428.939 4.982 50 10 IJGE CC1(C)C[C@H](CBr)CN1C(=O)c1cc(F)c(Br)cc1Cl 2282968849 XYYMKXOEBSGSSZ-MRVPVSSYSA-N 427.539 4.877 50 10 IJGE O=C(N[C@H](CBr)CC(F)(F)F)c1cc(Br)c(F)cc1Cl 2285844624 PHCUUNVHASCXBV-YFKPBYRVSA-N 441.444 4.687 50 10 IJGE COc1ccc(CCN2C(=O)C(=CNc3ccc4ccccc4c3)C(C)=C(C#N)C2=O)cc1 2314579240 NOCCUESPJQKNAI-UHFFFAOYSA-N 437.499 4.596 50 10 IJGE Clc1ccc(CN2C[C@H]3C[C@H](Br)C[C@H]3C2)c(I)c1 2318521068 DQRJZZMTNDHLSL-GDNZZTSVSA-N 440.550 4.550 50 10 IJGE CC(C)(C)c1ccc(Cn2cccc(C(=O)NN=Cc3c(F)cccc3Cl)c2=O)cc1 2323662205 FSUCHTGSFQLLOO-UHFFFAOYSA-N 439.918 4.751 50 10 IJGE N#CC(=CNc1ccccc1F)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 2324605328 JNAQQNOPHUUFIE-UHFFFAOYSA-N 440.522 4.579 50 10 IJGE CN(C[C@H](CBr)C1CCC1)C1C[C@@H]2C[C@H](C1)CN(C(=O)OC(C)(C)C)C2 2339978666 WFYTWBIBMAVTLO-GKMDZDJDSA-N 429.443 4.765 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@H]1CCC[C@]2(C1)CC2(F)F 2343415234 ZVABWCUJHVWNDV-LNLFQRSKSA-N 430.333 4.689 50 10 IJGE CC(C)(C)OC(=O)N[C@@]12CCC(F)(F)C[C@H]1CN(CC1(CBr)CCC1)C2 2344057431 SOFJWABSVQTVOV-KBXCAEBGSA-N 437.369 4.566 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@]1(F)CN(C[C@](C)(CBr)C(C)(C)C)C2 2352078127 OIRAZTMCNKNQME-UFYCRDLUSA-N 435.422 4.905 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@]34CCC[C@@]3(C2)CN(C(=O)OC(C)(C)C)C4)C1 2371150502 XTDVWFHOEDIFJB-SZPZYZBQSA-N 441.454 4.911 50 10 IJGE Cc1c(Br)cc(NCC(=O)N/N=C2\CCCC[C@@H]2C)cc1Br 33743718 ONZQALYADVSITK-FRKRDKNOSA-N 431.172 4.614 50 10 IJGE Nc1c(NNC(=O)c2cccc3ccccc23)ncnc1Nc1ccccc1C(F)(F)F 40701828 CDEYKUQRNYGYIQ-UHFFFAOYSA-N 438.413 4.731 50 10 IJGE Cc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)N4CCCc5ccccc54)c(C)c32)cc1 40804686 UIVKUCVVGPJFFB-SGWCAAJKSA-N 441.531 4.960 50 10 IJGE CCOc1c(Br)cc(/C=N\NC(=O)Nc2ccc(Cl)cc2)cc1OC 169943179 AMYWHRQGOINGLN-JMIUGGIZSA-N 426.698 4.665 50 10 IJGE N#C/C(=C/N1CCN(c2cccc(Cl)c2)CC1)C(=O)Nc1cccc(Cl)c1Cl 217128895 ZBWODBHTWXUYHI-YPKPFQOOSA-N 435.742 4.815 50 10 IJGE N#C/C(=C/NCc1ccccc1Br)C(=O)Nc1ccc(Cl)cc1Cl 217178238 JLGQNCASQWMSOX-BENRWUELSA-N 425.113 4.892 50 10 IJGE CC(C)(C)[C@@H](CCCl)NS(=O)(=O)c1cc(Br)ccc1Br 231183988 KWUKIXKNJUAPBE-GFCCVEGCSA-N 447.620 4.534 50 10 IJGE CCC[C@@H](Br)CNC(=O)c1cc(Br)cc(Br)c1 233265760 OPFLQNNTYOYGOW-SECBINFHSA-N 427.962 4.505 50 10 IJGE COc1cccc(-c2cc(C(=O)NN=C(C)c3cc(O)cc(O)c3)c3cc(C)ccc3n2)c1 254409343 PKLVCWQZUVNOMV-UHFFFAOYSA-N 441.487 4.784 50 10 IJGE Cc1ccsc1C=NNC(=O)c1ccc([C@@H]2SCC(=O)N2Cc2ccccc2)cc1 254794057 APOOBICBUCUBRB-QHCPKHFHSA-N 435.574 4.595 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@@H]1C=C(I)C(=O)[C@@H]1OCc1ccccc1 309923083 WOQWQMNYYGLQIV-NVXWUHKLSA-N 444.385 4.864 50 10 IJGE ClCc1nc2ccc(Br)cc2n1CC[C@@H]1CN(Cc2ccccc2)CCO1 312579389 UPHZIAXWAVIEAO-GOSISDBHSA-N 448.792 4.829 50 10 IJGE C[C@@H](Br)CC(C)(C)CNS(=O)(=O)c1ccc(Cl)c(Br)c1 393582048 JKVSWAITUJKCMA-SECBINFHSA-N 447.620 4.581 50 10 IJGE C[C@H]1CCCN(C(=O)c2cc(Cl)ccc2I)[C@@H]1CCCl 697192864 FFKMJRMLPNUXFM-IINYFYTJSA-N 426.125 4.814 50 10 IJGE CN(C(=O)c1ccc(Br)cc1Br)[C@@H]1CCC[C@H]1Br 709268706 RVBXEELKOPVBRN-ZYHUDNBSSA-N 439.973 4.600 50 10 IJGE COc1nscc1COc1c(Br)cc(CCl)cc1Br 711623457 MCXBFGOHDIOMNV-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE CN(CCc1ccc(Cl)cc1)C(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 733280215 BFNLMKJJKRWUCX-PGMHBOJBSA-N 443.938 4.725 50 10 IJGE O=C(NNc1ccccc1F)C(=O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1 782714012 SYNXYHOJWJLYNM-UHFFFAOYSA-N 433.361 4.719 50 10 IJGE COc1cc(Cl)c(C=NNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)cc1OC 1084233405 HOBWPEHVCYMUED-JTQLQIEISA-N 431.703 4.582 50 10 IJGE C[C@@H](SCc1ccccc1)C(=O)NN=Cc1ccccc1OCc1ccc(C(=O)O)cc1 1084570506 KYKCQYIWFIUMOB-GOSISDBHSA-N 448.544 4.736 50 10 IJGE C=C(Cl)C[C@@H](NC(=O)/C(C#N)=C\c1cc(C)n(C2CCCCC2)c1C)C(=O)OCC 1132193081 UTXZGTNZHFTGKS-CNSVBDKNSA-N 431.964 4.708 50 10 IJGE C=CCC[C@@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2)c1C)C(=O)OCC 1635699395 VXEDMCFCJZFSRY-DUBROFONSA-N 439.943 4.669 50 10 IJGE C=CCOc1cc(OC)ccc1C(=O)NNc1cc(C(F)(F)F)ccc1Br 1642919777 GCGVVMKPSBPBEE-UHFFFAOYSA-N 445.235 4.798 50 10 IJGE C#Cc1cccc(NC(=O)CN(C)Cc2nc(CO[Si](C)(C)C(C)(C)C)cs2)c1 1657412714 HWISQCMTBNDTJQ-UHFFFAOYSA-N 429.662 4.717 50 10 IJGE Cc1ccc2c(CC(=O)NN=C3CCCc4oc(C(=O)NC(C)(C)C)c(C)c43)coc2c1C 1772751736 LEBDWUVEOCESPY-UHFFFAOYSA-N 449.551 4.879 50 10 IJGE Cc1ccc(C)c(OCC(=O)Nc2cccc(C(=O)Nc3ccc(SC#N)cc3)n2)c1 1860558247 ALBCUYKBUAFMOQ-UHFFFAOYSA-N 432.505 4.541 50 10 IJGE Cc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1ccccc1Cl)C(C#N)=C(N)O2 1865686264 SVVMWFFRQAHZAX-IBGZPJMESA-N 429.282 4.904 50 10 IJGE CCCn1nc(CC)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(OCc2ccc(C)cc2)cc1 1865693845 QYLXXDHWDHNPKY-QHCPKHFHSA-N 428.536 4.961 50 10 IJGE Cc1ccc(C)c(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2cccs2)c1 1865698019 IEYMWCIAVRGLBG-MRXNPFEDSA-N 430.455 4.847 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)[C@H](C)Oc3ccc(Cl)cc3)c(C)n2)cc1 1865758479 CJBWNBILMQGUIW-INIZCTEOSA-N 437.927 4.501 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC2(CCC2)[C@@]12CC[C@@](C)(CI)O2 1924954450 GHVJZAHGBTXEDV-UCLAIMLFSA-N 449.373 4.834 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)C(=O)Cc1ccc(O)c(Br)c1 1980632959 UOOMMUVSWSKTHQ-CYBMUJFWSA-N 441.163 4.509 50 10 IJGE CCC[C@@H]1C[C@@H]1CO[C@@](C)(CI)CN(CC)C(=O)OC(C)(C)C 1993096798 IQJQNSKHZURTIS-RKVPGOIHSA-N 439.378 4.890 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1Cc1c(Br)cccc1Br 2018114921 JXWPCVHTGKYFDE-ZANVPECISA-N 425.990 4.959 50 10 IJGE Clc1cc(CN2CCCC[C@@H]2CBr)ccc1I 2026562085 XZDSFNUFJNIAQA-LLVKDONJSA-N 428.539 4.694 50 10 IJGE CC(C)[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)CC[C@@H]1C(F)(F)F 2044699515 LWTPHWACRTZSMA-UONOGXRCSA-N 431.337 4.527 50 10 IJGE CSCC[C@@H](Cl)CCNC(=O)c1c(Br)cccc1Br 2094100817 WEBSTORNRSTXGY-VIFPVBQESA-N 429.605 4.692 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C(F)(F)F)CCCN1C[C@H](CBr)C(C)(C)C 2106789113 WGNMSRBDYOSJAV-GUYCJALGSA-N 445.364 4.965 50 10 IJGE Fc1c(CN2CCS[C@@H](CCBr)C2)ccc(Cl)c1Br 2110525379 CFAFVSMBKKVDEJ-JTQLQIEISA-N 431.596 4.944 50 10 IJGE O=S(=O)(N(Cc1ccccc1)CC1CCCCC1)N1CCCC[C@@H]1CBr 2123230883 WVDMKTPCCOFBRB-HXUWFJFHSA-N 443.451 4.563 50 10 IJGE O=S(=O)(c1ccc(F)c(CBr)c1F)N(Cc1ccccc1)C1CCCC1 2123271472 RTMKSUKQZQLFDW-UHFFFAOYSA-N 444.341 4.993 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CCC[C@@H](CN(C[C@H](CBr)C3CCC3)C1)C2 2135001991 RCTOKZZPHRPEPT-MMOPVJDHSA-N 429.443 4.815 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCN(C[C@H](CBr)c2ccccc2)C1 2163059726 WBOHJCZUIAFWPK-HSALFYBXSA-N 437.422 4.887 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]1CN(C(=O)c1ccc(CBr)cc1)CC2 2166614085 NCGLQWOVZYYCOL-ROUUACIJSA-N 437.378 4.586 50 10 IJGE CN(C(=O)c1cc(Br)ccc1Cl)[C@H](CCBr)C(F)(F)F 2178514216 AMWDKDIFSPZISU-SNVBAGLBSA-N 437.481 4.890 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@@]12CCC[C@@H](CN(C[C@@H](CBr)CC3CC3)C1)C2 2226553575 LCHGOPKACOOMCW-DBXWQHBBSA-N 429.443 4.909 50 10 IJGE FC(F)(F)c1ccc(CO[C@@H](CCl)[C@H](I)CCl)cc1 2231129898 QRPHEWJYYGFUMF-MNOVXSKESA-N 427.031 4.872 50 10 IJGE C[C@@](CI)(O[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1F 2250385209 PNDLOEOIRGLOPF-PXNSSMCTSA-N 439.312 4.767 50 10 IJGE CN[C@@H](Cc1cc(Br)cc(Br)c1)[C@H]1C[C@H](Br)C1 2252836551 DCDMCNLYSAIZQB-XDTLVQLUSA-N 425.990 4.516 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)C1[C@H]2COC[C@H]12 2260069342 GXHKSPZWQIISJB-PVJDKPRJSA-N 446.911 4.818 50 10 IJGE CC1(C)C[C@@H](Cl)C[C@H](NC(=O)c2ccc(Cl)c(I)c2)C1 2283661212 GFOSPJVTEOFJOW-QWRGUYRKSA-N 426.125 4.861 50 10 IJGE COCc1cccc([C@@H](Br)c2ccc(OC)c(I)c2)c1 2284996162 HHAHLXWMICFXNZ-MRXNPFEDSA-N 447.110 4.931 50 10 IJGE O=C(N[C@@H](CBr)C1CCCC1)c1cc(Br)c(F)cc1Cl 2285844421 MLGNLLYYCNXUNC-ZDUSSCGKSA-N 427.539 4.925 50 10 IJGE COc1ccc(OCCn2cc(C=C(C#N)C(=O)NCc3ccco3)c3ccccc32)cc1 2297551853 UASRIFHXNYNMTD-UHFFFAOYSA-N 441.487 4.545 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)CC(C)(C)CBr 2300240558 NOAFTMLJVGRAKF-UHFFFAOYSA-N 430.555 4.798 50 10 IJGE CC[C@@H](Br)[C@H]1CCCCN1Cc1sccc1I 2301072128 VJXFBYOQNNKJDA-ZYHUDNBSSA-N 428.177 4.881 50 10 IJGE CCCN(Cc1ccc(Cl)cc1I)C[C@H](C)Br 2302320297 MRDVZBMCRDAQLN-JTQLQIEISA-N 430.555 4.940 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@@H]2CCCC[C@@H]3C[C@@H]32)C1 2302671917 NZXLAHCKYVTIQQ-YYAJDYIMSA-N 449.373 4.786 50 10 IJGE CCCCc1ccc(C[C@@H]2SC(=C(C#N)C(=O)NC)N(c3ccc(CC)cc3)C2=O)cc1 2314593869 VDZPAQDSQVQCSM-QHCPKHFHSA-N 447.604 4.764 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1c(F)ccc(Cl)c1F 2320361988 RPRIGHJYZQYPRF-CYBMUJFWSA-N 432.692 4.718 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](CC(F)F)C1 2328522769 JRNYLDOTRIJLSY-CABCVRRESA-N 427.374 4.620 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCN(CC2CC(Br)C2)[C@@H](C(F)(F)F)C1 2337544381 BGHUALQPXGHHBK-XSCHDIRWSA-N 443.348 4.718 50 10 IJGE FC(F)(CCl)C(F)(F)CNCc1cc(I)ccc1Cl 2352418091 QTNJQDOQCHDORO-UHFFFAOYSA-N 430.010 4.544 50 10 IJGE Cc1cccc2c1N(C[C@@]1(CBr)CC1(F)F)CCN2C(=O)OC(C)(C)C 2352965781 XTNMFYVBDIBJGE-SFHVURJKSA-N 431.321 4.977 50 10 IJGE CC(C)COc1ccc(/C=C(/C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2Br)cc1 35306253 OQJKPTMSAVSDPJ-DHDCSXOGSA-N 444.285 4.938 50 10 IJGE CCOC(=O)COc1ccc(/C=C(/C#N)c2nc(-c3ccc(F)cc3)cs2)cc1OC 35519883 OTFZFYFGTRHAHE-YVLHZVERSA-N 438.480 4.964 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4cccc(C)c4)ccc32)cc1 38649215 FKZMJPXHLSHVHR-VWLOTQADSA-N 426.472 4.506 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1cccs1)CCC2 40823665 ABJDPWYJOHHACR-MFKUBSTISA-N 437.521 4.689 50 10 IJGE CCOc1ccc(/C=C(\C#N)C(=O)Nc2nc(-c3cccc(OC)c3)cs2)cc1OC 40927281 LDUOBKVECWONMT-LICLKQGHSA-N 435.505 4.772 50 10 IJGE N#C/C(=C/Nc1ccc(Br)cn1)C(=O)NC(c1ccccc1)c1ccccc1 216980516 IOSHNMGHQKEFES-JXAWBTAJSA-N 433.309 4.569 50 10 IJGE COc1ccc([C@H](C)NC(=O)/C(C#N)=C\N(Cc2ccccc2)c2ccccc2)cc1OC 217173593 ADDDTXPBRXKUEU-ZNCVUUBVSA-N 441.531 4.995 50 10 IJGE N#C/C(=C/Nc1ccc(N2CCCCC2)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 217234501 SOJYOBLBCTULQR-PFONDFGASA-N 425.876 4.697 50 10 IJGE C[C@]1(c2ccc(I)cc2)CCC[C@H](CI)O1 394499455 ORRGXQHZERSXDM-CHWSQXEVSA-N 442.078 4.511 50 10 IJGE O=C(CBr)c1cc(OC(F)(F)F)c(Br)cc1OC(F)F 575680958 QUTVQVFLWOAMPW-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE CC(C)(C)C(=O)[C@H](Br)Cc1cc(Cl)ccc1I 689761725 MGOKGRZOMKDQEK-SNVBAGLBSA-N 429.523 4.866 50 10 IJGE CC(C)(C)N(CCCBr)S(=O)(=O)c1ccc(Cl)c(Br)c1 691005708 BLQZQQOKVDLFAO-UHFFFAOYSA-N 447.620 4.677 50 10 IJGE ClCc1nc2cnccc2n1CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 705863905 HFELNDKKTNQINX-UHFFFAOYSA-N 432.955 4.642 50 10 IJGE CC(C)C1CCN(C(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)CC1 742115385 AEOVPDZOOMWXOD-ZHZULCJRSA-N 435.959 4.919 50 10 IJGE CC(C)(C)c1csc(COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)n1 756332765 VDPDQVDBVVHKTR-LDADJPATSA-N 445.548 4.868 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])c2ncccc12)[C@@H]1CCCN(c2nc3ccccc3s2)C1 770136030 MUMASLNQQVPHSK-CQSZACIVSA-N 434.477 4.575 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N[C@@H]2CC23CCCCC3)c(-c2ccc(Cl)cc2)n1 770822551 BWMGRHGEIQHVML-USUABIMMSA-N 433.943 4.863 50 10 IJGE C=CCc1cc([N+](=O)[O-])ccc1OC(=O)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1 918558576 QXAFUJRJWIVNSH-OAHLLOKOSA-N 435.402 4.559 50 10 IJGE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NNC(=S)Nc1cccc(Cl)c1 1587210769 MERAPZLDKDMDAP-PKNBQFBNSA-N 429.851 4.660 50 10 IJGE CC1CCC(OC(=O)COc2cccnc2NC(=O)Nc2ccc(SC#N)cc2)CC1 1858850980 CJLJARFVUBDEAV-UHFFFAOYSA-N 440.525 4.799 50 10 IJGE CCc1cc(Br)cc2c1O[C@@]1(C=C2)CCN(C(=O)[C@H](Br)CC)C1 1859497421 GALKTKCYSUTZKY-QAPCUYQASA-N 443.179 4.562 50 10 IJGE CCCOc1ccccc1/C=C/C(=O)N1CCC(C(=O)Nc2ccc(SC#N)cc2)CC1 1860600330 DEYIZKPJVONAJO-KPKJPENVSA-N 449.576 4.939 50 10 IJGE Cc1nn(-c2cccc(Cl)c2)c2c1[C@H](c1cccc(Br)c1)C(C#N)=C(N)O2 1865684465 QMLYELQWQTYDJY-GOSISDBHSA-N 441.716 4.815 50 10 IJGE CCc1nn(Cc2ccc(F)cc2)c2c1[C@@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2 1865711192 RVOACKAJXABFOX-IBGZPJMESA-N 442.416 4.870 50 10 IJGE CCCC[C@@H](NC(=O)[C@@H](C)Cc1ccc(F)cc1)C(=O)Nc1ccc(SC#N)cc1 1866840963 RDELNJJTEOSFEP-HRAATJIYSA-N 427.545 4.891 50 10 IJGE C[C@H](c1ccc(Br)cc1F)[C@@H](CBr)NC(=O)OC(C)(C)C 1885096350 IQFLLDCMYNNODM-NOZJJQNGSA-N 425.136 4.980 50 10 IJGE CN(C[C@@H](CBr)C1CCC1)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 1890233067 DZCOWXGQYACLGZ-MOPGFXCFSA-N 425.411 4.995 50 10 IJGE FC(F)(F)c1cc2c(N(Cc3ccccc3)[C@H](CBr)C3CC3)nccn2n1 1915190883 YXWDVYNOBZGRID-MRXNPFEDSA-N 439.279 4.928 50 10 IJGE F[C@]1(CBr)CCN(Cc2cccc(Br)c2Br)C1 1917144779 GRURLPNQBFDEBY-LBPRGKRZSA-N 429.953 4.521 50 10 IJGE CN(CC(C)(C)CBr)C(=O)c1csc(Br)c1Br 1945725336 ICLYPBFIFHWXKW-UHFFFAOYSA-N 448.018 4.766 50 10 IJGE CC(C)(C)OC(=O)NC1CCC2(CC1)CC1(CCC[C@@H](CI)O1)C2 2007712558 COQIVKOOWRUNGX-CLJMJHJLSA-N 449.373 4.977 50 10 IJGE CCCn1c(CBr)nnc1-c1cccc(Br)c1Br 2031483723 HCGCGYLTLUIQGN-UHFFFAOYSA-N 437.961 4.775 50 10 IJGE FC1(F)C[C@H](CBr)N(Cc2cccc(Br)c2Br)C1 2041128345 XBLYAGOVESBHGC-SECBINFHSA-N 447.943 4.816 50 10 IJGE CC(C)(C)[C@H]1[C@H](Br)CCN1c1ncc(Br)cc1Br 2065423895 WZEOMVCWDCXMAQ-MWLCHTKSSA-N 441.005 4.995 50 10 IJGE C=CCC[C@@H](CBr)NC(=O)c1ccc(Br)cc1Br 2075330683 QVNXPMILWKIACG-JTQLQIEISA-N 439.973 4.671 50 10 IJGE Cn1cnc(Cl)c1COc1c(Br)cc(Cl)cc1CBr 2111945473 ZVCBSRIOSMQMSV-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE C[C@@H]1[C@H](C(F)(F)F)N(C[C@H](CBr)C2CCC2)CCN1C(=O)OC(C)(C)C 2115980594 SQBZNAOUQMNCCY-VHDGCEQUSA-N 443.348 4.670 50 10 IJGE O=C(N[C@@H](CCl)c1ccsc1)c1cc(Cl)ccc1I 2119039844 QNRVVWSHCQMHFU-LBPRGKRZSA-N 426.106 4.716 50 10 IJGE Cc1sc(C)c(S(=O)(=O)NCC(C)(C)CCCBr)c1Br 2143914258 OAZFCXDQKPFJLI-UHFFFAOYSA-N 447.258 4.607 50 10 IJGE CC12CC([C@H](Br)c3cc(I)cc4c3OCC4)(CCO1)C2 2164972536 FDYXPEKGBHNICE-QQFBHYJXSA-N 449.126 4.621 50 10 IJGE CN(Cc1cn(C)nc1Br)c1c(CCl)ccc(Br)c1Cl 2173264531 MHVVVIGDVSRJQD-UHFFFAOYSA-N 441.982 4.974 50 10 IJGE C[C@H](C(=O)N(C)C[C@H]1C[C@@H](Br)C1)[C@H](NC(=O)OC(C)(C)C)c1ccccc1 2196913802 HLBLTTPJGGXVQV-ONIAQPFYSA-N 439.394 4.520 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@@H](CNC(=O)OC(C)(C)C)CC1CCCCC1 2196914590 OWCWBHWREAIJEH-LXPRWKDFSA-N 445.442 4.730 50 10 IJGE Cc1cc(C(=O)Nc2ccccc2CCBr)ccc1I 2238842827 GQNJOTLVLXTUHR-UHFFFAOYSA-N 444.110 4.789 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Cl)c1cn(C)nc1Br 2277883062 JCSQUFSTUGIIJL-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)CC1CC(Br)C1 2300239200 VFJAVLUXYQCOKO-UHFFFAOYSA-N 428.539 4.550 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@@H](OC[C@H]2C[C@H]3CCC[C@H]2CC3)C1 2301132082 UXWADPLOJUNPPO-KSWRQPAISA-N 449.373 4.642 50 10 IJGE COC[C@@]1(C)C[C@]1(CBr)Cc1ccc(Cl)c(I)c1 2315552406 DQNCOYANLPQURL-KGLIPLIRSA-N 443.550 4.925 50 10 IJGE CC[C@@H](Br)[C@@H](CC)NC(=O)c1ccc(Cl)cc1I 2317771907 VYSPFMUNCSLQGD-ZYHUDNBSSA-N 444.538 4.627 50 10 IJGE COc1cc(C=NNC(=O)Nc2ccccc2C)cc([N+](=O)[O-])c1OCc1ccccc1 2323858066 AFCFYLYZPFXYOM-UHFFFAOYSA-N 434.452 4.646 50 10 IJGE COc1ccc([C@H](Br)[C@H]2COC3(C)CC2C3)cc1I 2337680680 SCOSUPAKLAPCAC-OPEKSYIUSA-N 437.115 4.551 50 10 IJGE O=C(CCNc1c2ccccc2nc2ccccc12)OCCN(CCCl)CCCl 11677807 BDLWRIAFNYVGTC-UHFFFAOYSA-N 434.367 4.513 50 10 IJGE in-man COc1ccc(/C=N/NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)cc1Br 40961271 JINRNUTXHYYBMW-WQEJZQBCSA-N 433.346 4.673 50 10 IJGE CC(C)(C)SCC(=O)N/N=C1/C(=O)N(Cc2cccc3ccccc23)c2ccccc21 59165925 XTRSCQOAHPJDHH-SLEBQGDGSA-N 431.561 4.739 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Br)c3cccc(F)c3Cl)cc2[nH]1 165448195 LTSWFEKFOFLNID-LBPRGKRZSA-N 434.490 4.896 50 10 IJGE CCCOc1c(OC)cc(/C=N\NC(=O)c2nc(-c3ccccc3)sc2C)cc1OC 169927099 WRMHONLXKZOEHV-OYKKKHCWSA-N 439.537 4.688 50 10 IJGE N#C/C(=C/Nc1ccc(Cl)cc1C(F)(F)F)C(=O)N1CCN(Cc2ccccc2)CC1 217257579 NVOAMUOLRGIAFD-VKAVYKQESA-N 448.876 4.523 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCc2ccco2)ccc1OC(=O)c1ccc(C(C)C)cc1 224936030 JXDQOAQUPPHQMI-BKUYFWCQSA-N 444.487 4.854 50 10 IJGE O=C(NC[C@H]1CC[C@@H](Br)C1)c1ccc(Br)cc1Br 227668682 YWVLFVJEOJTQBV-DTWKUNHWSA-N 439.973 4.505 50 10 IJGE C[C@]1(Cn2c(CCCl)nc3cc(Br)cnc32)CCN(Cc2ccccc2)C1 380231608 LEQIPXKZBDJPRP-NRFANRHFSA-N 447.808 4.887 50 10 IJGE O=C(NNc1ccc(F)cc1Br)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 748074967 QQQVZUBXJYFWHQ-RYUDHWBXSA-N 433.199 4.734 50 10 IJGE Cc1ccc(-n2nc(C)c(CC(=O)NNc3ccc(C(F)(F)F)cn3)c2C)cc1Cl 775252329 UXEAMZIEQXDYQV-UHFFFAOYSA-N 437.853 4.551 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc(Cl)cc(F)c2Br)c(C(F)(F)F)c1 803360102 AKZWWNPIDBNYDL-UHFFFAOYSA-N 436.590 4.889 50 10 IJGE O=C(COc1ccc(C=NNC(=O)c2ccc(Cl)cc2Cl)cc1)NC1CCCCC1 1084609255 SYZPUTXIOZPSES-UHFFFAOYSA-N 448.350 4.585 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=NNC(=O)CSCc3ccccc3C)o2)cc1 1084642600 ZTXWYYUAFAMLKW-UHFFFAOYSA-N 436.533 4.815 50 10 IJGE C=Cc1ccc(CCNC(=O)NNc2cc(C(F)(F)F)ccc2Br)cc1 1478689732 JPOSBLVEGAJFPZ-UHFFFAOYSA-N 428.252 4.980 50 10 IJGE C=C[C@@H]1OCC[C@H]1NC(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1525975372 ZQZSCDQBDXATIJ-DWTPWGMASA-N 430.335 4.768 50 10 IJGE C#CC[C@@H](CCOC)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1623648920 HAUDEWRLWRZKPF-SQWSFHKJSA-N 444.362 4.853 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccn2)c1 1865692963 GWCFVKGTDVQLEZ-QHCPKHFHSA-N 449.514 4.941 50 10 IJGE Cc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865709459 CEWVNLNRDJSZLD-GOSISDBHSA-N 442.262 4.614 50 10 IJGE C[C@@H]1[C@@H](OC2(CI)CCN(C(=O)OC(C)(C)C)CC2)CC1(C)C 1901818112 FRIGVPBAHSLATE-KGLIPLIRSA-N 437.362 4.642 50 10 IJGE Clc1nc(N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)sc1CBr 1905740111 LNGSJDLJSBEDSG-LSDHHAIUSA-N 426.811 4.650 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@H]2CC[C@@H]3CC[C@H]2C3)CC1 1947120052 HEGKHKYJVNIWRZ-JYJNAYRXSA-N 449.373 4.786 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)N(C[C@@H](CBr)C1CCC1)CCO2 1966311890 FYLWNSNQHVJIQU-QGZVFWFLSA-N 439.394 4.721 50 10 IJGE Cc1ccc(Br)c(C(=O)N(Cc2ccccc2)C(C)(C)CBr)n1 1980428615 CLGWUZNCSHIUBM-UHFFFAOYSA-N 440.179 4.968 50 10 IJGE Fc1ccc(C[C@@H](Br)c2cc(I)sn2)cc1F 2007644519 PIEDKRINZWJHQB-SSDOTTSWSA-N 430.055 4.705 50 10 IJGE Brc1cccc(CN2C[C@H](Br)[C@H](C3CC3)C2)c1Br 2031479582 YFNSZBIRKUXRCJ-AAEUAGOBSA-N 438.001 4.817 50 10 IJGE C[C@H]1CC[C@@H](CBr)N(Cc2cc(Cl)ccc2I)C1 2048064051 RUEPHGMIKGAGBT-GWCFXTLKSA-N 442.566 4.940 50 10 IJGE O=S(=O)([C@H]1CC[C@H](CBr)C1)N(Cc1ccccc1)CC1CCCCC1 2059288530 ILARRYIARXMPMH-PMACEKPBSA-N 428.436 4.962 50 10 IJGE FC(F)(F)c1c(I)c(CCl)nn1-c1cc(C2CCC2)ccn1 2078888631 DICCMBIOEQAELH-UHFFFAOYSA-N 441.622 4.897 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1C[C@H](CBr)[C@@H](C(F)(F)F)C1 2107044736 ITKVKSUHBRBQGD-ZFWWWQNUSA-N 448.304 4.973 50 10 IJGE COc1cc(CBr)ccc1S(=O)(=O)N(Cc1ccccc1)[C@@H](C)C(C)C 2123271674 TYGSWQWWHVIRKG-INIZCTEOSA-N 440.403 4.826 50 10 IJGE O=C1NCCOc2ccc([C@H](Br)c3cscc3OCc3ccccc3)cc21 2156306476 PALMGANXZGMCNC-FQEVSTJZSA-N 444.350 4.934 50 10 IJGE CN([C@H]1CC(C)(C)[C@H]1OCc1ccccc1)S(=O)(=O)c1ccc(CCCl)s1 2156442675 OAHABEBKXKFXLP-HKUYNNGSSA-N 428.019 4.534 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CCCN(C(=O)[C@H](Br)C3CCCC3)C2)C1 2167034528 XDCANFZFEXNHCN-UTKZUKDTSA-N 443.426 4.580 50 10 IJGE Cc1cc(S(=O)(=O)N(C)[C@H]2CCCCC[C@H]2Br)sc1Br 2172543413 KPQBFXAIXBBNNG-MNOVXSKESA-N 445.242 4.536 50 10 IJGE O=C(c1cccc(Br)c1Cl)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Br)C2 2190679409 QFGRPSVJZHPYPZ-RINBACNTSA-N 425.523 4.581 50 10 IJGE Fc1ccccc1[C@@H](CI)O[C@@H]1CCN(Cc2ccccc2)C1 2244772388 YZAUEYXAHVYYSZ-VQIMIIECSA-N 425.285 4.593 50 10 IJGE Cl[C@@H](c1cc(Br)co1)c1cc(I)cc2c1OCC2 2258102521 BAJDSQYXIYVAHI-GFCCVEGCSA-N 439.474 4.910 50 10 IJGE Br[C@@H]1C[C@H]2CCCC[C@@H]2N(Cc2ccc(I)cc2)C1 2264828534 ZRHJZYHRCDTVOO-FMKPAKJESA-N 434.159 4.819 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCCN1CC1(CBr)CC(F)C1 2265638167 JPLGGEVSXMLWJC-ZEVUXNIQSA-N 433.406 4.754 50 10 IJGE CC1(C)C[C@@H](Br)CN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282984636 YACJSXJXLQSKCE-MRVPVSSYSA-N 427.539 4.877 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2COc3ccccc32)cc1I 2285000178 SIQDDUQGJSRFIV-MLGOLLRUSA-N 445.094 4.912 50 10 IJGE COCc1ccc([C@H](Br)c2ccc(OC)c(I)c2)cc1 2285001831 IEISOAASHOERRO-INIZCTEOSA-N 447.110 4.931 50 10 IJGE CCC[C@H](O[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1I)c1ccccc1 2302032138 RMLCNYSQNGNADX-ULQDDVLXSA-N 445.341 4.967 50 10 IJGE Clc1ccc(CN(CCBr)C2CCC2)c(I)c1 2302326026 LZFNBHLWEBTRMG-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE Cc1cc(I)ccc1NC(=O)C(C#N)=CNc1ccccc1Cl 2325405924 TUVDSHLXILFNQS-UHFFFAOYSA-N 437.668 4.711 50 10 IJGE CC1(C)CC(CBr)(CN2CCC(C3(NC(=O)OC(C)(C)C)CC3)CC2)C1 2345008906 WDYZGKZEMFAQGI-UHFFFAOYSA-N 429.443 4.957 50 10 IJGE FC(F)(F)c1ccc(CBr)c(N2C[C@H]3C[C@H]2CN(Cc2ccccc2)C3)n1 2369841830 DNXARIMLMIAVEW-RDJZCZTQSA-N 440.307 4.706 50 10 IJGE Cc1sc(Br)cc1C(=O)N1CCC[C@H](Br)[C@H]1C(F)(F)F 2370247774 ODXXWHKXJVPORJ-WPRPVWTQSA-N 435.103 4.749 50 10 IJGE O=C(CNc1ccc(Cl)cc1Br)N/N=C/c1ccc(Cl)cc1Cl 3091188 LAZOEKSNYPLLPB-QPSGOUHRSA-N 435.536 4.972 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)ccc1OCc1ccc(C(=O)O)cc1 33301348 HSAARHKTHWEWCV-BKUYFWCQSA-N 442.471 4.827 50 10 IJGE Cc1c(C(=O)N2CCC(C)CC2)oc2c1/C(=N/NC(=O)c1cccc(Cl)c1)CCC2 40813260 RYHKJUWRZXDEQC-XIEYBQDHSA-N 427.932 4.584 50 10 IJGE COc1cc(/C=N/NC(=O)COc2cc(C)cc(C)c2)ccc1OCc1ccccc1C 40911531 WMDZOJQLWGNARC-JFLMPSFJSA-N 432.520 4.729 50 10 IJGE Cc1cccc2c(/C=N/NC(=O)C(=O)Nc3ccccc3Cl)c(-c3ccccc3)[nH]c12 58833832 UBCWXGNBLQVODR-VULFUBBASA-N 430.895 4.886 50 10 IJGE C/C(C=NNC(=O)CCCCC(=O)NN=C/C(C)=C/c1ccccc1)=C\c1ccccc1 254747129 RTQBUBOGZYYOFB-SUQWLNLISA-N 430.552 4.958 50 10 IJGE O=C1OC(=O)[C@H]2[C@H]1[C@H]1C[C@H]2[C@H]2[C@@H](c3ccc(Cl)cc3)c3sc(=S)[nH]c3S[C@H]21 256027103 TZTGJCWNBZDYHI-HBRKBTNUSA-N 435.979 4.647 50 10 IJGE O=C(CSc1nnc(SCc2ccccc2)s1)NN=C/C=C/c1ccccc1 263622278 SLEGIGLFCOOTKS-RKYOKCDMSA-N 426.592 4.738 50 10 IJGE CC[C@](C)(CCBr)NC(=O)c1scc(Br)c1Br 705403992 YJGWSZDCFYHPIR-LLVKDONJSA-N 448.018 4.957 50 10 IJGE CC[C@H](C[C@H](C)Cl)NS(=O)(=O)c1cc(Br)c(C)cc1Br 716891061 JLRAMPAOUMRKGZ-VHSXEESVSA-N 447.620 4.594 50 10 IJGE Cc1sc([C@H](Cl)c2cnn(C)c2I)c(C)c1Br 724915462 QGPHQNZHZXWAIF-SECBINFHSA-N 445.551 4.794 50 10 IJGE COc1cc(C=NNC(=O)c2cn(C)c3ccccc23)cc(OC)c1OCc1ccccc1 732765846 LQROHOUJWXBIEL-UHFFFAOYSA-N 443.503 4.538 50 10 IJGE Cc1ccccc1NNC(=O)C(=O)Nc1ccc2c(c1)CN(c1ccc(C(C)C)cc1)C2 783327680 WOVAAMJZJKUPRM-UHFFFAOYSA-N 428.536 4.720 50 10 IJGE Cc1ccccc1NC(=O)C(=O)NN=Cc1c(OCc2ccccc2)ccc2ccccc12 1083967992 UTRPCRTVXFEJJJ-UHFFFAOYSA-N 437.499 4.816 50 10 IJGE CSc1nc(O)c(C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)cc1C#N 1124716502 ONWVKSZQRVPLQQ-OAHLLOKOSA-N 433.864 4.852 50 10 IJGE C=CCCOCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1267336782 VOJLSSWASRGKCQ-CPNJWEJPSA-N 431.458 4.729 50 10 IJGE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NNC(=O)CSc1ccc(Cl)cc1 1624319576 JTEHCXHNMDLJSZ-PKNBQFBNSA-N 429.756 4.990 50 10 IJGE N#CSc1ccc(NC(=O)Oc2ccc(CNC(=O)COc3ccccc3)cc2)cc1 1858898517 CBFAULUOIILDMY-UHFFFAOYSA-N 433.489 4.566 50 10 IJGE CS(=O)(=O)Nc1ccc(/C(O)=C(\C#N)c2nc(-c3ccccc3Cl)cs2)cc1 1872746409 GUGYSUCVOVYGHU-SDXDJHTJSA-N 431.926 4.785 50 10 IJGE CCCC1(NC(=O)OC(C)(C)C)CCN(CC(C)(C)CI)CC1 1904650368 FEWKHYJPRCBOKY-UHFFFAOYSA-N 438.394 4.607 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)Cc1cn(C)nc1Br 1915296538 VIURALKHPCCYIB-INIZCTEOSA-N 429.200 4.604 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1ccc2ccccc2c1O 1916355721 XYKUKUFUTQBXGQ-GOSISDBHSA-N 428.326 4.598 50 10 IJGE C[C@@H](CCCBr)NC(=O)c1csc(Br)c1Br 1937736939 BVOZJUROHYUGDU-LURJTMIESA-N 433.991 4.567 50 10 IJGE CC(C)[C@@H](Br)CCNC(=O)c1cc(Br)c(Br)s1 1942760879 AJYLDVOLTQNKFS-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC[C@H]1CC12CCCCC2 1992224775 IWUOBMHXNARJAT-PBHICJAKSA-N 437.362 4.692 50 10 IJGE Cc1c(F)cc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)CC(C)C 2059314198 IAWOPJLDQMRZQK-UHFFFAOYSA-N 428.367 4.876 50 10 IJGE CC(C)[C@H](C)n1nc(CBr)c(I)c1C(F)(F)F 2079256805 GVVGTWPBBWJZRS-LURJTMIESA-N 425.030 4.618 50 10 IJGE CC[C@H](C)[C@H](CBr)NC(=O)c1c(Br)cccc1Br 2081241074 DMCASVTVIOAAKP-KWQFWETISA-N 441.989 4.751 50 10 IJGE CSCC[C@@H](Cl)CCNC(=O)c1cc(Br)ccc1Br 2090381683 HJMVHQNZPPNPMH-JTQLQIEISA-N 429.605 4.692 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)N(C[C@@H](CBr)c2ccccc2)C1 2106785848 COCZWBYJOVARRS-YQVWRLOYSA-N 425.411 4.742 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)c2ccccc2)C[C@@H]1CC(F)F 2177310844 AWUQVPJKENOLIA-IRXDYDNUSA-N 447.364 4.742 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CC[C@@H](OC)C2)cc1I 2257356066 RDQTWSOMVPSYSR-GLXFQSAKSA-N 425.104 4.551 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@H]2[C@@H]3CCCO[C@H]32)c1 2263514350 AIMRLQXKYUXFEA-XDQVBPFNSA-N 438.985 4.943 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ncc(Cc3ccccc3Cl)s2)ccc1O 2293038576 MOHXQNZZYOTVAO-UHFFFAOYSA-N 425.897 4.647 50 10 IJGE CC(C)N(CCCBr)Cc1ccc(Cl)cc1I 2302315054 FHXLNDKXISUWEA-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE CCOc1c(Br)cc(C=C(C#N)C(=O)Nc2ccccc2CC)cc1OC 2313681057 BZKAFOIBTVOPHC-UHFFFAOYSA-N 429.314 4.964 50 10 IJGE C[C@]1(CBr)CCCN(Cc2ccc(Cl)c(I)c2)C1 2315551192 NUBCKVZOEAUEAH-CQSZACIVSA-N 442.566 4.942 50 10 IJGE CCOC(=O)c1ccccc1NC=C(C#N)C(=O)NC(c1ccccc1)c1ccccc1 2324825539 RGQMCQSFJAZQNU-UHFFFAOYSA-N 425.488 4.588 50 10 IJGE Cl[C@H]1CCN(Cc2ccc(I)c(Br)c2)C12CCC2 2325218646 QRSYYFGKYYRHJL-ZDUSSCGKSA-N 440.550 4.790 50 10 IJGE Cc1ccc(N2C[C@H]3[C@@H](C2)OCCN3Cc2ccccc2)c(CBr)c1Cl 2335416159 WVPUHPABPRKCMO-VQTJNVASSA-N 435.793 4.633 50 10 IJGE FC1(F)C[C@]12C[C@@H]2CO[C@@H](CI)c1ccc(Br)cc1 2352459482 QRHZDLJSLKNEGN-WXHSDQCUSA-N 443.069 4.987 50 10 IJGE COc1ncc(Br)c(C)c1COc1nc(Cl)c(CBr)s1 2368221081 DCHZINVTNXSZDW-UHFFFAOYSA-N 442.560 4.745 50 10 IJGE O=C(COc1cccc(Br)c1)N/N=C/c1ccc(-c2ccccc2Cl)o1 20508340 NKZOXTSBMAVDLE-SSDVNMTOSA-N 433.689 4.892 50 10 IJGE Cc1c(C(=O)NNC(=O)c2ccc(F)cc2)oc2c1/C(=N\Nc1ccccc1)CC(C)(C)C2 101109073 BUAZMQAPRRLSAY-USHMODERSA-N 448.498 4.591 50 10 IJGE CCOc1cc(/C=N\NC(=O)Cc2ccc(N)cc2)ccc1OCc1cc(C)ccc1C 169900577 NFMNZISEYMWZCA-NTFVMDSBSA-N 431.536 4.556 50 10 IJGE CCCOc1ccccc1/C=C/C(=O)Oc1ccc(/C=C(/C#N)C(=O)OCC)cc1OC 207002731 DUMYQQCULOEPIX-ZTSFSLTASA-N 435.476 4.573 50 10 IJGE ClCc1nc2cnccc2n1-c1ccc(I)c(Br)c1 311712508 KFQQHEOPNHBDJB-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE C[C@H](Br)C[C@H]1CCCCCN1S(=O)(=O)c1cc(Br)cs1 312503984 RAOWCHVCUHCCER-CMPLNLGQSA-N 445.242 4.617 50 10 IJGE ClCc1ccc(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@@H]32)c(Br)c1 404200901 RCLJMVMDVSUQBS-LEWJYISDSA-N 435.793 4.668 50 10 IJGE Clc1cccc(N2CC[C@@]3(CN(Cc4ccccc4)CCO3)C2)c1CBr 717591588 IUPRZYFCCPRVQX-OAQYLSRUSA-N 435.793 4.716 50 10 IJGE O=C(NCC1(CBr)CCC1)c1cc(Br)sc1Br 717622528 WHDRECVTKCSWCB-UHFFFAOYSA-N 446.002 4.568 50 10 IJGE Cc1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1C(=O)N1CCCCC1 799424890 DLZMHNYWGYQPFH-UHFFFAOYSA-N 445.445 4.660 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2c(C)n(Cc3ccccc3)c3ccccc23)c1 1303281211 YQISDBHIMALIAZ-UHFFFAOYSA-N 438.556 4.611 50 10 IJGE CCN(C(=O)c1oc2c(c1C)C(=NNC(=O)Cc1ccccc1)CCC2)c1cccc(C)c1 1772749019 GJKHSJZCXGVXQS-UHFFFAOYSA-N 443.547 4.962 50 10 IJGE CCc1ccc(OCCCC(=O)NN=Cc2c[nH]c3ccccc23)c(Br)c1 1772755567 MJWGXRFLWOAXTM-UHFFFAOYSA-N 428.330 4.802 50 10 IJGE CCc1cc(Br)ccc1OCC(=O)NN=Cc1ccc(Cl)c(Cl)c1 1772755961 WBMNUFGIYFFZIT-UHFFFAOYSA-N 430.129 4.847 50 10 IJGE CCCOc1c(OC)cccc1[C@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1ccccc1 1865694207 VSSMIBVCOSMHDU-QFIPXVFZSA-N 444.535 4.509 50 10 IJGE CCCn1nc(C)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(N(CC)Cc2ccccc2)cc1 1865707026 MDHBCEPGYVEOTH-DEOSSOPVSA-N 427.552 4.846 50 10 IJGE N#C/C(=C(/O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1nc(-c2cccs2)cs1 1872750878 RXCQCCYYBYHBDN-RGEXLXHISA-N 440.506 4.566 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CN(C(=O)OC(C)(C)C)C12CCCCC2 1883178941 DWDBWAOWJCXTES-GJZGRUSLSA-N 447.414 4.844 50 10 IJGE Fc1cc(Br)c2nc(CCl)n(C3[C@H]4CN(Cc5ccccc5)C[C@H]34)c2c1 1912683856 NLSWSLIUPOZFLD-GJZGRUSLSA-N 434.740 4.980 50 10 IJGE O=C(c1ccc(I)cc1)N(Cc1ccccc1)[C@H](CCl)C1CC1 1915207816 LBIPXOWHXMAAQP-GOSISDBHSA-N 439.724 4.951 50 10 IJGE Cc1nc(N(Cc2ccccc2)[C@H](CBr)C(C)C)ncc1Br 1915328958 LRAOKPPAVWRTTE-MRXNPFEDSA-N 427.184 4.974 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCC[C@H](CBr)C1 1945188970 FVMXHQOMGQDQFE-SSDOTTSWSA-N 446.002 4.520 50 10 IJGE Cc1sc(CNCCSSCCNC(=O)OC(C)(C)C)cc1Br 1985350756 VNWFKTIJGGYYJD-UHFFFAOYSA-N 441.482 4.815 50 10 IJGE C[C@@H](NC(=O)c1cc(Br)ccc1Br)C(C)(C)CBr 2030077685 CWFFSNFOJWSKEE-MRVPVSSYSA-N 441.989 4.751 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CCC(F)(F)[C@@H](CBr)C1 2038680206 SSBGQAVTTBGQRX-AWEZNQCLSA-N 430.314 4.819 50 10 IJGE CC(F)(F)C[C@H](CBr)NC(=O)c1cc(Br)c(Cl)s1 2052454437 RYZBTYSFMANVOA-RXMQYKEDSA-N 425.520 4.703 50 10 IJGE FC(F)(F)c1ccc(I)c(I)c1CCl 2060234789 ALUCIXQRRZSWOM-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE Brc1cccc(CN2CC[C@H](Br)[C@H]3CC[C@@H]32)c1Br 2069997353 SUBTVUVWIDRIJW-MDZLAQPJSA-N 438.001 4.959 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@]1(C)CBr 2086658267 LYGXXIJSFMADQY-YGRLFVJLSA-N 442.566 4.798 50 10 IJGE CCc1nn(C[C@@H](CBr)c2ccccc2)c(CC)c1I 2150312160 REYHJMMTQAVUAB-CYBMUJFWSA-N 447.158 4.791 50 10 IJGE ClCCc1nc2ncccc2n1Cc1scc(Br)c1Br 2175977062 PZKZPSQVUNPMQT-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@@H]1C[C@H](C(C)(C)C)CN(C(=O)OC(C)(C)C)C1 2196908343 XFGRECCYHAZLPH-NCOADZHNSA-N 445.442 4.538 50 10 IJGE ClCCCOC1CCN(Cc2ccc(Br)cc2Br)CC1 2207529625 OQXYYGAMKZZTLG-UHFFFAOYSA-N 425.592 4.822 50 10 IJGE Cc1sc([C@@H](Br)c2cc(S(C)(=O)=O)cs2)cc1Br 2218971128 WXESUUFKKQOACP-NSHDSACASA-N 430.208 4.768 50 10 IJGE Brc1cc(Br)cc(C[C@@H](Br)C2CC3(COC3)C2)c1 2263507934 HACOGXPSJZHXCJ-CYBMUJFWSA-N 438.985 4.944 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@H]2C[C@]23CCOC3)c1 2263526177 QBQOCELACKYOMI-IHRRRGAJSA-N 438.985 4.944 50 10 IJGE CC1CC(CBr)(CN2C[C@H]3CCC[C@@](CNC(=O)OC(C)(C)C)(C3)C2)C1 2265307237 CVLJUEVIHZGDMS-ZZWQXLNQSA-N 429.443 4.815 50 10 IJGE O=C(N[C@H]1CCC[C@H]1CCBr)c1cc(F)c(Br)cc1Cl 2282974000 FMPIUWONJFUBCQ-SDBXPKJASA-N 427.539 4.925 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CCCCCCCBr)C2(CCOCC2)C1 2294695952 CAJUEYLAYKEJKT-SFHVURJKSA-N 447.458 4.728 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@H](Br)C(C)(C)S(C)(=O)=O 2295360210 OILVIKVFOPPBCX-LBPRGKRZSA-N 448.604 4.679 50 10 IJGE Cc1ccc(C)c(NC(=O)C(C#N)=Cc2c(Oc3ccccc3)nc3ccccn3c2=O)c1 2296720329 QYLHYJLURMCCPM-UHFFFAOYSA-N 436.471 4.649 50 10 IJGE COc1cc2nc(C(C#N)=Cc3cc4cccc(C)c4nc3Cl)nc(O)c2cc1OC 2297713418 DDHKCXAKOCWYDZ-UHFFFAOYSA-N 432.867 4.927 50 10 IJGE CC[C@H](Br)CN(CC)Cc1cc(I)ccc1Cl 2307331598 GJENAXKSWWROPN-NSHDSACASA-N 430.555 4.940 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)CCc1cccc(CC(F)(F)F)c1 2307638352 JAQNMHPSZXFYJH-HNNXBMFYSA-N 440.259 4.784 50 10 IJGE Cc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(F)c2)cc1 2314634488 ZFMOOPUZGHEWKD-VWLOTQADSA-N 426.447 4.971 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H](Br)CCC12CC2 2327398099 ZSHBJMFTEIANQZ-NSHDSACASA-N 440.550 4.837 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Br)c3ccc(F)cc3Cl)cc2[nH]1 109884540 PCTBEOVMHFKAHP-CYBMUJFWSA-N 434.490 4.896 50 10 IJGE CCn1nc(C)c(Br)c1CC(CC)(CBr)CBr 118670564 SNJSNXXUDODKTP-UHFFFAOYSA-N 431.010 4.703 50 10 IJGE C[C@H](CCCBr)NC(=O)c1cc(Br)ccc1Br 161227005 XKOMVNOVAWWTDN-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE CC[C@H](NC(=O)c1cc(Br)ccc1I)[C@H](Cl)CC 313089161 FTBGDIYTZNVNMR-PWSUYJOCSA-N 444.538 4.580 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@@H](c2c(F)cccc2Br)C1 382689015 KNYJYJFCXGJNBZ-MNOVXSKESA-N 437.147 4.934 50 10 IJGE CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H](O)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 616591402 YFXHWMFAYWHGCE-LWSSLDFYSA-N 444.644 4.896 50 10 IJGE C[C@@H]1[C@H]2CC[C@@H](C[C@@]13CC[C@@](C)(CI)O3)N2C(=O)OC(C)(C)C 686235680 GEGHBTACZRFXIW-OSARJHGOSA-N 435.346 4.537 50 10 IJGE C[C@@H](Br)[C@H]1CCN(C(=O)c2cc(Br)c(Br)s2)C1 719965893 DDAHDOVGJMOBJB-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NNc1ccc(Cl)cc1Cl 748018251 LTAUGWVGWJSINQ-UHFFFAOYSA-N 432.336 4.918 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)NCc3cc(O)nc4ccccc34)c2C)c1 754313484 BUXRHFYAIOLXKG-BKUYFWCQSA-N 436.515 4.880 50 10 IJGE CN(C(=O)c1ccc(NC(=O)NNc2ccc([N+](=O)[O-])cc2)cc1Cl)C1CCCCC1 775531403 BQFKUCOIAHWXJI-UHFFFAOYSA-N 445.907 4.802 50 10 IJGE C=CCSc1ccccc1C(=O)NNc1nnc(-c2ccccc2)n1-c1ccccc1 777126214 YDSNKNRUXOWECX-UHFFFAOYSA-N 427.533 4.969 50 10 IJGE Cc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)c2ccccc2Br)o1 915933238 OFPQEBLOSOPNFU-UHFFFAOYSA-N 449.308 4.967 50 10 IJGE CCOC(=O)c1c(-c2cccc([N+](=O)[O-])c2)csc1NC(=O)[C@@H](Br)CC 1859486377 KQGGTZARRABINQ-ZDUSSCGKSA-N 441.303 4.612 50 10 IJGE CC(C)[C@@H]1C[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)CN1Cc1ccccc1 1880755939 RJWDDVIDVRYIPQ-QRVBRYPASA-N 425.411 4.821 50 10 IJGE CCC[C@@H](CCNC(=O)OC(C)(C)C)CCC(=O)N(C)C[C@H]1C[C@@H](Br)C1 1887824410 ZGKIKPHXZLHQJE-ZACQAIPSSA-N 433.431 4.730 50 10 IJGE CC[C@@H](Br)[C@H](C)NC(=O)c1cccc(Br)c1Br 1943882781 HUUJUYFXYXPNOU-IONNQARKSA-N 427.962 4.503 50 10 IJGE C[C@H]1CCN(C(=O)c2csc(Br)c2Br)C[C@H]1Br 1945188872 DDPSJZULIAEYML-POYBYMJQSA-N 446.002 4.519 50 10 IJGE BrC[C@H]1CN(Cc2c(Br)cccc2Br)CCS1 1945332304 BDDTXCMJAUMEEM-VIFPVBQESA-N 444.030 4.524 50 10 IJGE Clc1nc(Cl)n(-c2cccc(I)c2)c1CBr 1982554116 UTQDAQRHVCOGAQ-UHFFFAOYSA-N 431.886 4.679 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC[C@@H]2C[C@@H]2C2CCC2)C1 2022600104 VWEQBDSRTYGLNK-FRQCXROJSA-N 449.373 4.644 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@H](Br)C(F)(F)F)C2(CCCCC2)C1 2044696192 JVJVZFBPWCWNTM-QWHCGFSZSA-N 429.321 4.614 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@@H]2CCC[C@@]2(CCl)C1 2103175388 IWVNXWSKGWXPBK-ISVAXAHUSA-N 427.589 4.754 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)C2CCC2)C[C@H]1CC(F)(F)F 2119514978 MXRNDGGGSFXHMR-HUUCEWRRSA-N 443.348 4.671 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC2(CCC(Cl)CC2)C1 2124673159 PEEJCIKVRWDYSA-UHFFFAOYSA-N 427.589 4.897 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@@H]1C2C[C@@H]3C1[C@@H]3C2 2134569785 JNXUHLJRJVSLGQ-DTFVPPMMSA-N 431.111 4.564 50 10 IJGE CCC(CC)(CBr)CN1C[C@H](CNC(=O)OC(C)(C)C)CC12CCOCC2 2163060046 YXCQTTYSFXHALX-KRWDZBQOSA-N 447.458 4.584 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)[C@@H](Br)C2CCCC2)c2ccccc21 2167035467 YZUDAVMROBUMOF-WMZOPIPTSA-N 437.378 4.943 50 10 IJGE CCc1nc(-c2ccc(I)cc2)nc(CC)c1CBr 2228789298 QZUQTLXJCSKJDJ-UHFFFAOYSA-N 431.115 4.768 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1scc(Br)c1Cl 2253552439 QLQYRAJKBSPNGQ-ZETCQYMHSA-N 435.634 4.801 50 10 IJGE Cc1cnc(N(C)Cc2ccccc2I)c(CBr)c1 2265546020 NLUYFTWPAGOISW-UHFFFAOYSA-N 431.115 4.526 50 10 IJGE CC12COC(CO[C@@H](CI)c3ccc(Br)cc3)(C1)C2 2266254229 MSEKLLLQUDNGGC-NFOMZHRRSA-N 437.115 4.511 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(CCCCCCCBr)C[C@@H]21 2277440982 YMLZUEUECLRIMU-HCXYKTFWSA-N 429.443 4.909 50 10 IJGE COc1ccc(NC=C(C#N)c2nc(-c3cc4cc([N+](=O)[O-])ccc4oc3=O)cs2)cc1 2296752723 SIBWJFQUTWDJKZ-UHFFFAOYSA-N 446.444 4.810 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc([N+](=O)[O-])cc2)sc2c1CC[C@H](C)C2 2296819139 ZRMGYWLPGWARAM-ZDUSSCGKSA-N 439.493 4.503 50 10 IJGE ClC[C@H](CC1CC1)NCc1ccc(I)c(Br)c1 2306222278 RXWZOOGIVCDKHB-NSHDSACASA-N 428.539 4.551 50 10 IJGE N#CC(=Cc1ccccc1)C(=O)N1CCC2(CC1)CC(=O)c1cc(Cl)cc(Cl)c1O2 2322183748 JFEANSABVOXLPD-UHFFFAOYSA-N 441.314 4.927 50 10 IJGE BrC1CCC([C@H]2CCN(C[C@H]3CC3(Br)Br)C2)CC1 2327998290 DSVRYJXTLWCHNQ-CMOBGSAGSA-N 444.049 4.768 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](CC(F)F)C1 2328522775 JRNYLDOTRIJLSY-HUUCEWRRSA-N 427.374 4.620 50 10 IJGE COc1c(C)cc(C(=O)N[C@H](CCBr)COCc2ccccc2)cc1Cl 2343417379 FPLKYZHCDOKASW-QGZVFWFLSA-N 440.765 4.757 50 10 IJGE CCc1sc(Br)cc1[C@@H](Br)[C@]12CCC[C@H]1CS(=O)(=O)C2 2357952163 PRBNJAMGZWVLMP-FZZIBODNSA-N 442.238 4.724 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Cl)c1c(F)c(F)cc(F)c1F 2364226736 PSLXQVJPLUKMEJ-SSDOTTSWSA-N 436.428 4.830 50 10 IJGE Cc1scc(C(=O)N2CC[C@H](Br)C[C@@H]2C(F)(F)F)c1Br 2369596638 QXBHMZWIXMCVJQ-IONNQARKSA-N 435.103 4.749 50 10 IJGE CC[C@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1 9874434 MCTGXALYZVQMRM-OTWHNJEPSA-N 434.536 4.736 50 10 IJGE Cc1c(C(=O)Nc2cccc3ccccc23)oc2c1/C(=N/NC(=O)c1cccnc1)CCC2 40814149 WOSIPGFZMREYFF-XHLNEMQHSA-N 438.487 4.859 50 10 IJGE Cc1ccc(OCCCC(=O)Oc2ccc(/C=C(\C#N)C(=O)NCc3ccco3)cc2)cc1 40935044 VMUNLEHQVUCSGY-LTGZKZEYSA-N 444.487 4.576 50 10 IJGE O=C1NCCc2ccc([C@H](Br)c3ccc(Br)cc3Cl)cc21 70545574 IBEZHLQHBJHFLS-HNNXBMFYSA-N 429.539 4.873 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C\Nc3ccc4oc(=O)ccc4c3)n2)cc1OC 102419536 JCWRWVWNEQOTRN-VBKFSLOCSA-N 431.473 4.910 50 10 IJGE COc1ccc(C2=CS/C(=C(/C#N)C(=O)c3cc([N+](=O)[O-])ccc3Cl)N2)cc1OC 104346011 RNTPSNYNPYRNLH-ZHZULCJRSA-N 443.868 4.518 50 10 IJGE O=C(O)CNc1ccc(Cl)cc1SSc1cc(Cl)ccc1NCC(=O)O 196115950 KMPYMZQAZQCOTP-UHFFFAOYSA-N 433.338 4.786 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C/c2ccc(OCC)c(OC)c2)cc1 207108749 HOLAPKBRACNSKU-CFRAVMCGSA-N 448.519 4.536 50 10 IJGE C[C@H](CCCBr)NC(=O)c1cc(Br)sc1Br 235419869 IXCGMDFGGFVPMS-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE CC(=NNC(=O)COc1ccc(Cl)cc1)c1cccc(NC(=O)c2ccc(C)cc2)c1 252621716 NFHCGHSMWJETBI-UHFFFAOYSA-N 435.911 4.820 50 10 IJGE COc1ccc(C(C)=NNC(=O)c2ccc(COc3cccc4cccnc34)cc2)cc1 254836883 VGDGUNWUCLWGCQ-UHFFFAOYSA-N 425.488 4.976 50 10 IJGE CC1(C)C[C@H](NC(=O)c2ccc(I)c(Cl)c2)C[C@H](Cl)C1 703341855 QDUAMDVJHJGYEA-WDEREUQCSA-N 426.125 4.861 50 10 IJGE CC[C@H](C[C@@H](C)Br)NC(=O)c1ccc(I)c(Cl)c1 716942140 XHHKFUBLMSHSKH-PSASIEDQSA-N 444.538 4.627 50 10 IJGE CO[C@H]1C[C@@H](COc2c(Br)cc(Br)cc2CBr)C1 721908362 NEUKYEFJIRPEHK-DKTWLAJQSA-N 442.973 4.910 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2cc(C)n(-c3ccc(F)cc3)c2C)cc1 725441645 JBPUETPDNZAQML-DEOSSOPVSA-N 437.515 4.596 50 10 IJGE O=C(NNC(=O)[C@H](Sc1ccc(F)c(F)c1)c1ccccc1)c1cccc2cccnc12 729972204 VVMHXBMHGGGFDC-JOCHJYFZSA-N 449.482 4.808 50 10 IJGE Cc1nc([C@@H]2CCCCN2C(=O)/C(C#N)=C/c2cc(C)n(-c3ccccc3C)c2C)no1 737613817 BAHGOAVBFRJIAD-YJADQXIJSA-N 429.524 4.755 50 10 IJGE N#Cc1ccc(NNC(=O)c2cccc3[nH]c(-c4cccs4)nc23)c(C(F)(F)F)c1 799747205 SDOGAATVNCQVEM-UHFFFAOYSA-N 427.411 4.939 50 10 IJGE CC(C)c1ccc([C@H](NC(=O)NNC(=O)COc2ccccc2F)c2cccs2)cc1 913627937 HHBPOTIOVKZPEO-QFIPXVFZSA-N 441.528 4.509 50 10 IJGE CC(=NNC(=O)c1ccc(CSc2nncn2C)cc1)[C@@H]1C[C@@H]1c1ccccc1Cl 920360759 VARZKNCIHAHWSR-RBUKOAKNSA-N 439.972 4.670 50 10 IJGE O=C(COc1ccccc1)NN=Cc1cccc(OCc2cccc(Br)c2)c1 1084271733 JSNSSTWXEWWLMO-UHFFFAOYSA-N 439.309 4.557 50 10 IJGE O=C(CSc1ccc(Cl)c(Cl)c1)NNC(=O)Nc1cccc(C(F)(F)F)c1 1088721003 RQVQRLHXALQSDR-UHFFFAOYSA-N 438.258 4.957 50 10 IJGE Cc1ccc(Cl)c(NC(=S)NNC(=O)c2ccc(Br)cc2)c1Cl 1318300234 YKPMHTONHJXKOF-UHFFFAOYSA-N 433.158 4.696 50 10 IJGE CC(=O)N1CCc2c(NC(=O)/C(C#N)=C\c3cc(C)n(-c4ccccc4F)c3C)cccc21 1537952191 BAFOWUYCDZNZTR-ZHZULCJRSA-N 442.494 4.688 50 10 IJGE C=CCOc1cn(-c2ccccc2)nc1C(=O)N1CC[C@H](O[Si](C)(C)C(C)(C)C)C1 1641426483 OJPGIUIKBNCXIR-IBGZPJMESA-N 427.621 4.673 50 10 IJGE CCOC(=O)NN=C1CCCc2oc(C(=O)Oc3ccc(Cl)cc3Cl)c(C)c21 1772751469 RRYYDBCCXQMNIH-UHFFFAOYSA-N 425.268 4.901 50 10 IJGE Cc1ccc(Cn2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2ccc(Br)cc2)cc1 1865714811 QSSLLAOTUOOVTD-HXUWFJFHSA-N 435.325 4.529 50 10 IJGE C[C@H](c1ccc(Br)cc1F)[C@H](CBr)NC(=O)OC(C)(C)C 1885096351 IQFLLDCMYNNODM-RNCFNFMXSA-N 425.136 4.980 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CNC1CC1)(C[C@H]1C[C@@H](Br)C1)C2 1887908053 MVLUGDJDSVBNHX-MVJTYMMSSA-N 427.427 4.850 50 10 IJGE Cc1nn(C)c(CN(Cc2ccccc2)[C@@H](C)CCBr)c1Br 1915114480 PFDPWFZYGZNZLM-ZDUSSCGKSA-N 429.200 4.667 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1 1915290987 KGMOUJJGXDKZNF-GOSISDBHSA-N 430.795 4.950 50 10 IJGE C[C@H]1[C@H](CBr)CCN1Cc1cc(Br)ccc1Br 2006507401 HUHGXKXWIABWAI-UWVGGRQHSA-N 425.990 4.817 50 10 IJGE CN(C(=O)c1cc(Br)c(Br)s1)C1CC(CBr)C1 2018080225 CHOOJSFOXSTPFE-UHFFFAOYSA-N 446.002 4.519 50 10 IJGE C[C@@H]1CCN(Cc2ccc(I)c(Cl)c2)C[C@@H]1Br 2026560971 OHSXJHICNRKRES-KOLCDFICSA-N 428.539 4.550 50 10 IJGE Cn1cc(Br)c(C[C@@H](CBr)c2ccccc2Br)n1 2027110930 ANBCFVYNXLSNJZ-VIFPVBQESA-N 436.973 4.666 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1C(=O)c1c(Br)cccc1Br 2033089866 YKNNHRIVHXLXDX-BDAKNGLRSA-N 439.973 4.600 50 10 IJGE FC(F)C1CC(O[C@@H](CI)c2cccc(Br)c2)C1 2035657177 VLHDPOFHLYEHPY-NHNAUAITSA-N 431.058 4.986 50 10 IJGE CCCC(CBr)(CCC)CN=[S@]1(=O)CC[C@@H](NC(=O)OC(C)(C)C)C1 2044700064 PHQGKHYXCTWQKG-BZQUYTCOSA-N 439.460 4.733 50 10 IJGE CN(C(=O)c1cc(Br)cc(Br)c1)C1(CCBr)CC1 2069688094 LFWOPYAGOFDPFK-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE CC(C)(C)OC(=O)N1CCCCN(CC2(CBr)CCCC2)CC(F)(F)C1 2108613990 OCURRMXNJMSIIJ-UHFFFAOYSA-N 439.385 4.910 50 10 IJGE Brc1ccccc1[C@@H](CI)OC[C@@H]1[C@H]2C[C@@H]3[C@H]1[C@@H]3C2 2134543354 ZOZPKGYYFDPBLG-USFXYBLGSA-N 433.127 4.844 50 10 IJGE FC1(F)CN(c2ncc(Br)c3ccsc23)CC[C@H]1CBr 2146377447 NDBSJDRSVYLZDA-QMMMGPOBSA-N 426.124 4.915 50 10 IJGE Cn1nc([C@@H](Br)c2cc3c(cc2Br)OCC3)c(Cl)c1Cl 2150719719 DUSAETPPFLYUEB-JTQLQIEISA-N 440.950 4.909 50 10 IJGE CC(C)(C)OC(=O)NCCN(C(=O)c1ccc(CBr)cc1)c1ccccc1 2163054846 ATZXHNJNPXRSAN-UHFFFAOYSA-N 433.346 4.753 50 10 IJGE O=C(c1ccc(Br)c(Cl)c1)N1CCC([C@H](F)CBr)CC1 2163247942 ZYBIEOZDZBQZKT-CYBMUJFWSA-N 427.539 4.688 50 10 IJGE O[C@@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@@H](Br)C1 2250783745 SXXVMHVIYJSVOU-QWMRMABFSA-N 434.900 4.697 50 10 IJGE CC12COC(CO[C@H](CI)c3cccc(Br)c3)(C1)C2 2266291603 WSWBVARHYDVHDI-WLYUNCDWSA-N 437.115 4.511 50 10 IJGE Cc1sc(C(=O)NCC2(CBr)CC(F)(F)C2)c(C)c1Br 2281656574 MRHRABLYUSBLCE-UHFFFAOYSA-N 431.140 4.668 50 10 IJGE COc1cc(F)c(CBr)c(N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1 2283538784 DPLDLAUBTHBVPT-MSOLQXFVSA-N 433.365 4.688 50 10 IJGE O=C(NC[C@H]1CC[C@H](CCl)CC1)c1ccc(Cl)c(I)c1 2283657530 CBJNPDOFOWSYGR-XYPYZODXSA-N 426.125 4.720 50 10 IJGE ClC[C@@H]1CC[C@H](NCc2ccc(I)c(Br)c2)C1 2306223858 KEYMPUOBCSFENO-KOLCDFICSA-N 428.539 4.551 50 10 IJGE N#CC(=Cc1ccc(OC(=O)C=Cc2ccc(Cl)cc2)cc1)C(=O)NCc1ccco1 2314754342 PXRDICOXGHKFPR-UHFFFAOYSA-N 432.863 4.775 50 10 IJGE CCc1cccc(C)c1NC(=O)C(C#N)=CNc1ccc(I)cc1C 2318462900 SDIALZODRQYHEI-UHFFFAOYSA-N 445.304 4.929 50 10 IJGE CC1(C)CC(CBr)(CN2[C@H](CNC(=O)OC(C)(C)C)C[C@@H]3CCC[C@H]32)C1 2345010522 MGDVSLBNKIRCOG-YESZJQIVSA-N 429.443 4.955 50 10 IJGE CCCCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2351888865 LNSDIWQJRGFPMM-QAPCUYQASA-N 439.385 4.908 50 10 IJGE O=C(N[C@@H]1C[C@@H]2C[C@H]1C[C@@H]2Br)c1cc(F)c(Br)cc1Cl 2359286123 JUORDSVHTGFGKE-XZCDRZHDSA-N 425.523 4.533 50 10 IJGE N#CC1=C2N=C(N)c3ccccc3N2C2=C(C(=O)C[C@H](c3ccccc3)C2)[C@H]1c1cccnc1 9590748 GLSSQZYFICLYKJ-CLOONOSVSA-N 443.510 4.540 50 10 IJGE CCOC(=O)C1=C(C)NC(SCC(=O)c2cccs2)=C(C#N)[C@H]1c1ccc(F)cc1 20609354 CWKGENYWVHLKTM-HXUWFJFHSA-N 442.537 4.762 50 10 IJGE CCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccc(C)cc1 38649304 XJBXXPJKNUARRC-XMMPIXPASA-N 426.472 4.831 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C\N2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1 216859401 AQPRBDHQDWUIRR-DAFNUICNSA-N 436.559 4.748 50 10 IJGE C[C@H](Br)[C@H](Br)[C@@H]1CC[C@H](Br)[C@@H](Br)C1 256837863 GBWKXPCFLWAUOQ-BGKGJTHRSA-N 441.827 4.860 50 10 IJGE Clc1cccc(CBr)c1N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21 404182628 KRTPCJIPJXHQGM-VQTJNVASSA-N 435.793 4.715 50 10 IJGE CC[C@H]1CN(C(=O)c2scc(Br)c2Br)C[C@@H]1Br 705442198 MUFVQPFLVHHJKJ-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE CC[C@H](C[C@@H](C)Cl)NC(=O)c1cc(I)ccc1Br 716927126 UVXABHPBJOOFKT-PSASIEDQSA-N 444.538 4.580 50 10 IJGE CCOc1ccc(/C=C(/C#N)C(=O)Nc2cnn(-c3cccc(C(F)(F)F)c3)c2)cc1 733780959 AZOSCCZOLMANDQ-YBEGLDIGSA-N 426.398 4.835 50 10 IJGE N#Cc1ccc(-c2cccc(CNC(=O)NNC(=O)Cc3cccc4ccccc34)c2)s1 740482889 HOSQUZVBOZHXBE-UHFFFAOYSA-N 440.528 4.513 50 10 IJGE CCN(c1ccccc1)c1ccc(CNC(=O)NNC(=O)c2cccc3cccnc23)cc1 745877019 FLPGGBOTIAMOAS-UHFFFAOYSA-N 439.519 4.537 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)O[C@@H]2CCc3ccc(F)cc32)c(-c2ccccc2)n1 749061918 AHXLKXBSLBOAKA-FYVGXUMQSA-N 426.451 4.741 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)nn1)[C@H](Oc1ccc(F)c(Cl)c1)c1ccccc1 755191824 SEOQXJHDMYRAAZ-QGZVFWFLSA-N 440.784 4.551 50 10 IJGE CCN1CCC(CCNC(=O)C(=O)Nc2ccc(S(F)(F)(F)(F)F)cc2)CC1 773332782 KTLMAVWGYUENEM-UHFFFAOYSA-N 429.455 4.521 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)OCc2cccc(F)c2)c(-c2ccc(Cl)cc2)n1 782090003 GPTXOSPRLZRQMR-PDGQHHTCSA-N 434.858 4.907 50 10 IJGE Cc1cc(NC(=O)C(=O)NNc2ccc(C#N)cc2C(F)(F)F)ccc1-c1ccccc1 799840315 IRZMVWWDQHIVLQ-UHFFFAOYSA-N 438.409 4.634 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2CCCc3occc3C2)c(-c2ccc(Cl)cc2)n1 809391949 CKPJBKJHGQUFLV-CPNJWEJPSA-N 445.910 4.592 50 10 IJGE CC(C)c1ccc(OCC(=O)NN=Cc2ccc(F)cc2Cl)c(Br)c1 1083976623 RMCJHXXXFGNXIZ-UHFFFAOYSA-N 427.701 4.894 50 10 IJGE C=CC[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc3ccccc23)c1C)C(=O)OCC 1632655803 DNWZYZJEGVBWKG-KZVLXBEFSA-N 441.531 4.778 50 10 IJGE Cc1ccc(CNC(=O)c2oc3c(c2C)C(=NNC(=O)c2cccc(Cl)c2)CCC3)cc1 1772746645 YVTWKRHMRZJJRC-UHFFFAOYSA-N 449.938 4.950 50 10 IJGE CCc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)Cc2ccccc2)CCC3)cc1 1772749149 QOIPJQRPRRWJCD-UHFFFAOYSA-N 429.520 4.802 50 10 IJGE O=C(CCCl)Nc1ccc(Oc2ccc(NC(=O)[C@@H]3CCCC[C@@H]3C(=O)O)cc2)cc1 1859505292 UQADGEIBVOTZBJ-UXHICEINSA-N 444.915 4.876 50 10 IJGE CCc1nn(Cc2cccc(F)c2)c2c1[C@@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 1865684938 BXBBZRUFLSPURQ-GOSISDBHSA-N 426.854 4.644 50 10 IJGE COc1ccc(OC)c([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc3ccccc23)c1 1865692109 JDFPEQLVEUMRCL-DEOSSOPVSA-N 438.487 4.569 50 10 IJGE Cc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2ccccc2[N+](=O)[O-])cc1 1865710117 OPYKNRKFDRNKGY-QFIPXVFZSA-N 449.470 4.974 50 10 IJGE BrCC1(Cc2ccc(I)c(Br)c2)CC1 1893241432 JQYYYXAPNJMJOL-UHFFFAOYSA-N 429.921 4.771 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@]23CCOC[C@@H]2C3)s1 1900919381 OYGAWJJGYZBCSL-CYUDJLOBSA-N 433.536 4.869 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)c(Cl)c1 1914640028 VUIHTPJPMFWJSW-LBPRGKRZSA-N 437.186 4.968 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)c1ccccc1S(=O)(=O)C(F)F 1915084063 SHXYCNLQEODYMD-OAHLLOKOSA-N 432.330 4.863 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1ccncc1Br 1915092321 HXPGSGYHIHDSHS-CYBMUJFWSA-N 426.152 4.660 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1F 1915097261 SJCQLEKTGCDSGL-ZDUSSCGKSA-N 427.245 4.689 50 10 IJGE CC1([C@H](Cl)c2c(Br)sc(Br)c2Cl)CS(=O)(=O)C1 1923055751 YHCZPAXZGIEOOI-ZCFIWIBFSA-N 443.009 4.641 50 10 IJGE C[C@H]1C[C@H](Br)CCN1C(=O)c1c(Br)cccc1Br 2033085494 FBIUINUJUYVCIR-DTWKUNHWSA-N 439.973 4.600 50 10 IJGE CCOC(=O)c1c(C)[nH]c(C(=O)C(C#N)=Cc2ccc(OCc3ccccn3)cc2)c1C 2042452652 VRPGOGOPAMMIBN-UHFFFAOYSA-N 429.476 4.572 50 10 IJGE O=S(=O)(NC1(CBr)CCCCCCC1)C1CC(OCc2ccccc2)C1 2105020880 JJHQIIMPBZXRBE-UHFFFAOYSA-N 444.435 4.532 50 10 IJGE CS(=O)(=O)c1sccc1[C@@H](Br)c1ccc(F)c(Br)c1F 2150556283 LZCXMZCFEFHQKK-VIFPVBQESA-N 446.132 4.677 50 10 IJGE CCCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2167031432 IOODMMREARUVKN-ZWKOTPCHSA-N 445.442 4.968 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(CBr)cc2)C2(CCCC2)C1 2179887735 UIEBJVDYDUTYGC-UHFFFAOYSA-N 437.378 4.587 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C[C@H](CBr)C(C)(C)C)C1 2185505345 ZLXNKCCOPZLIJS-CABCVRRESA-N 443.430 4.993 50 10 IJGE C[C@@H]1[C@@H](NC(=O)OC(C)(C)C)CC[C@@H](C(=O)N(C)CC2CC(Br)C2)C1(C)C 2196906456 DZNBBBUSGFIMGW-WXGPCXSOSA-N 445.442 4.584 50 10 IJGE CC[C@@H](N)Cc1cc(Cl)cc(Br)c1OC[C@H]1C[C@H](Br)C1 2196937897 MJRXZYMFDDKESM-IRUJWGPZSA-N 425.592 4.935 50 10 IJGE COc1ccc([C@@H](Br)[C@H](F)C(F)(F)F)cc1I 2248896842 VUVYCGWKNGTNMN-BDAKNGLRSA-N 426.973 4.636 50 10 IJGE C=CC[C@@]1(CBr)CCCCN1Cc1ccc(I)cc1 2272132592 PXBDJTSFFWVMGM-INIZCTEOSA-N 434.159 4.987 50 10 IJGE Cc1ccc(CBr)cc1NC(=O)c1cccc(I)c1 2278646268 MNXLUHUYOPLIDO-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE COC[C@]1([C@H](Br)c2cc(Cl)cc(Br)c2OC)CCCO1 2295360601 SBIIRXMUILLILN-KGLIPLIRSA-N 428.548 4.743 50 10 IJGE COCCNC(=O)C(C#N)=Cc1cn(Cc2ccc(Cl)c(Cl)c2)c2ccccc12 2297456323 WXLBKOPPJHRNFZ-UHFFFAOYSA-N 428.319 4.666 50 10 IJGE Cc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)cc1 2314634118 NYNHJALQGRCOSB-VWLOTQADSA-N 426.447 4.971 50 10 IJGE C[C@H]1CC[C@@H](CBr)N(Cc2cc(I)ccc2Cl)C1 2327402149 UZYTZFMTMUXWNH-GWCFXTLKSA-N 442.566 4.940 50 10 IJGE C[C@@H](Oc1ccc(F)cc1)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccc(F)cc1 38652822 YELBSFLTWXFIEP-QKFKETGDSA-N 448.425 4.556 50 10 IJGE Br[C@@H](c1csc(I)c1)c1ccc2c(c1)OCCO2 124411476 GCYHZPCLDDBDAN-CYBMUJFWSA-N 437.096 4.608 50 10 IJGE COc1c(Cl)cc(/C=N\NC(=O)CSc2nc3ccccc3s2)cc1Cl 169892978 KOOZQHWZMIHDHG-ZBKNUEDVSA-N 426.350 4.854 50 10 IJGE O=C(NC[C@H]1CC[C@@H](Br)C1)c1cc(Br)sc1Br 227675706 RBWGEZZGVODRME-NKWVEPMBSA-N 446.002 4.567 50 10 IJGE O=C(NN=C(C(=NNC(=O)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1 252601775 FCYVHTSUXHTTMQ-UHFFFAOYSA-N 446.510 4.655 50 10 IJGE CC(=NNC(=O)Cc1c(Cl)cccc1Cl)c1cccc(NC(=O)c2ccncc2)c1 252638687 YEJWSZMOASENDC-UHFFFAOYSA-N 441.318 4.724 50 10 IJGE CC[C@H](Br)[C@@H](CC)NC(=O)c1ccc(Br)cc1Br 313101126 ZEBBUBVZIBZSAJ-CMPLNLGQSA-N 441.989 4.894 50 10 IJGE CCN(C[C@](C)(CI)OC[C@@H](C)C1CCC1)C(=O)OC(C)(C)C 398383433 NYKJDKDIRUFGGH-KDOFPFPSSA-N 439.378 4.890 50 10 IJGE O=C(CBr)c1cc(OC(F)F)c(Br)cc1OC(F)(F)F 575679811 FDXVFNMUHKEWJB-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE C[C@H](Cl)c1nc2cccc(Br)c2n1C[C@H]1CN(Cc2ccccc2)CCO1 697705890 BRULOGTVAUUVOC-DOTOQJQBSA-N 448.792 5.000 50 10 IJGE COc1ccc(C=NNC(=O)c2ccccc2OCc2ccc(F)cc2)c(OC(F)F)c1 734091699 IMQNQRIAFYTJOP-UHFFFAOYSA-N 444.409 4.779 50 10 IJGE Cc1ccccc1CC(=O)NNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 755947778 PBQXWJWVSDZSMP-NRFANRHFSA-N 432.911 4.699 50 10 IJGE CC(=NNC(=O)Cc1nc(O)c2c(C)c(C)sc2n1)[C@H]1C[C@H]1c1ccccc1Cl 920365627 SUOAQANSJDPLPM-CABCVRRESA-N 428.945 4.505 50 10 IJGE CC(=NNC(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1)c1cc(O)ccc1O 1084396586 YKIANUZNKSRLHY-UHFFFAOYSA-N 445.519 4.802 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc(C)cc2)ccc1OC(=O)/C=C\c1ccccc1 1084502031 GIWROVZCMJJBIL-APJLSPFSSA-N 428.488 4.776 50 10 IJGE C#CCNC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1cc(C)n(C2CCCCC2)c1C 1125560957 WYOIWDCXJCUJBI-LTGZKZEYSA-N 428.536 4.519 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNc1cc(F)ccc1Br 1451572500 IKIXOKVLYLQQNP-UHFFFAOYSA-N 433.199 4.929 50 10 IJGE C#C[C@H](NC(=O)NNC(=O)c1ccc(COc2ccc3ccccc3c2)cc1)c1ccccc1 1636557261 NWNUHDHPPYKMTK-SANMLTNESA-N 449.510 4.737 50 10 IJGE CCOc1ccc([C@@]2(C(=O)NNc3nc4ccccc4[nH]c3=S)CC2(Cl)Cl)cc1 1646017761 RKEKFGFMBCKAGG-LJQANCHMSA-N 449.363 4.650 50 10 IJGE C=CCOc1ccc(CNC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)cc1 1681031387 GZQKZOLUVWSTSE-GOSISDBHSA-N 441.597 4.608 50 10 IJGE N#C/C(=C(/O)CCN1C(=O)c2ccccc2C1=O)c1nc(-c2ccc(F)c(F)c2)cs1 1872751833 WEJYYPBRZBAIGT-CYVLTUHYSA-N 437.427 4.567 50 10 IJGE O=C(c1ccc(Br)cn1)N(Cc1ccccc1)C1(CBr)CCC1 1915742321 VEDWOQZXNPROHH-UHFFFAOYSA-N 438.163 4.804 50 10 IJGE C[C@H]1CCC[C@](CI)(OCCOCCOCc2ccccc2)C1 1983389998 OJTGTPNGDIIKLD-HKUYNNGSSA-N 432.342 4.620 50 10 IJGE CN(Cc1cc(Cl)ccc1I)C1(CCBr)CC1 2015860362 XDDVJNQBKBGNBN-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NCc1ccc(I)c(Cl)c1 2026564141 QJHDEJOJVYQEJR-NOZJJQNGSA-N 430.555 4.844 50 10 IJGE CCN(C[C@H](Br)C(F)(F)F)[C@@H]1CCCC[C@@H]1CNC(=O)OC(C)(C)C 2044700638 RREBRLDFUGNXET-MCIONIFRSA-N 431.337 4.718 50 10 IJGE C[C@H]1C[C@@H](CBr)CCN1Cc1cc(Cl)ccc1I 2052367781 NUDAZBYNYTZRDI-QWRGUYRKSA-N 442.566 4.940 50 10 IJGE FC(F)c1c(CCl)ccc(I)c1I 2060237605 OXRXDQKSSOYELE-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE CCOc1c(Br)cc(CN[C@H]2C[C@@H](Br)C2)cc1Br 2063144197 OEDBUNFUKPMGRD-AOOOYVTPSA-N 441.989 4.626 50 10 IJGE Clc1cc(CN2CC3(CC3)C[C@H]2CBr)ccc1I 2086654242 DUORUOYIWSWIGF-NSHDSACASA-N 440.550 4.694 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](C(C)(C)C)CN(C[C@@H](Br)C(F)(F)F)C1 2108377572 SPLYYQYWCMPPSH-BFHYXJOUSA-N 445.364 4.821 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@]2(CCC[C@@H]2Br)C1 2115924465 LSKICXCDCTZACQ-GXFFZTMASA-N 427.589 4.944 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N[C@H](CCBr)C(C)(C)C)c1Br 2143914081 NFQICJNNQUGDOC-SNVBAGLBSA-N 447.258 4.605 50 10 IJGE Cc1c(Cl)cc(CN2C[C@@H](CBr)OC(C)(C)C2)cc1Br 2167396878 UBPNDNIMVGOSOF-GFCCVEGCSA-N 425.592 4.785 50 10 IJGE CCC1(CC)[C@@H](OCCOCCOCCOCc2ccccc2)C[C@H]1Br 2227781650 ZRGPUVUKJWVPLW-UXHICEINSA-N 429.395 4.595 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1C(=O)c1cc(Br)sc1Br 2251033371 JPXJMNJPVGQESU-YUMQZZPRSA-N 446.002 4.661 50 10 IJGE COc1cc(F)c(CBr)c(N2C[C@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c1 2283538785 DPLDLAUBTHBVPT-QZTJIDSGSA-N 433.365 4.688 50 10 IJGE O=C(N[C@@H](CCl)CC1CCCC1)c1ccc(Cl)c(I)c1 2283663759 ONTHGPDUPOSAKH-GFCCVEGCSA-N 426.125 4.862 50 10 IJGE CCCOc1c(Br)cc(C=C(C#N)C(=O)Nc2ccc(F)cc2)cc1OC 2293665185 FUWNYKDVHGUPRR-UHFFFAOYSA-N 433.277 4.931 50 10 IJGE C[C@H]1C[C@@H]1N(CCBr)Cc1ccc(Cl)c(I)c1 2300242107 GTRIWODMGLMVDC-ZANVPECISA-N 428.539 4.550 50 10 IJGE Cn1nc(Br)c(Br)c1[C@H](Br)c1ccc(F)cc1 2301043269 BYPPEECFLHLNOW-MRVPVSSYSA-N 426.909 4.569 50 10 IJGE Clc1ccc(I)cc1C[C@@H]1CCOCC[C@H]1Br 2307338571 SMKNBKUHSWFLLC-JOYOIKCWSA-N 429.523 4.677 50 10 IJGE C[C@H]1CN(Cc2ccc(Cl)c(I)c2)CC[C@H]1CBr 2315554088 AXEIHBZFBOURSO-JQWIXIFHSA-N 442.566 4.798 50 10 IJGE CC(C)N(C)C[C@H](Cl)CCc1ccc(I)c(Br)c1 2325223638 QDHDAHBZRPTZIY-GFCCVEGCSA-N 444.582 4.934 50 10 IJGE Cc1ccccc1COc1cccc(/C=N/NC(=O)CSc2nc3ccccc3[nH]2)c1 32520545 UFPHQCVCRTZSQU-AFUMVMLFSA-N 430.533 4.693 50 10 IJGE COc1cc(/C=C2/C(=O)N(CC(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(C)cc1 40514473 WEAYIZCVHUSPAI-WSDLNYQXSA-N 444.531 4.831 50 10 IJGE Cc1cccc(Nc2ncnc(NNC(=O)C(c3ccccc3)c3ccccc3)c2N)c1C 40755174 GOHGOJVRHVLBHX-UHFFFAOYSA-N 438.535 4.694 50 10 IJGE COc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3cccc(C)c3C)c(C)c21 40813126 CNXMPTSZRHQNDJ-VFCFBJKWSA-N 445.519 4.936 50 10 IJGE N#C/C(=C/N1CCN(c2cccc(Cl)c2)CC1)C(=O)Nc1ccccc1C(F)(F)F 217064331 GEKAAUKKVVVCJJ-PFONDFGASA-N 434.849 4.527 50 10 IJGE CC[C@@H](NC(=O)/C(C#N)=C\N1CCN(c2ccc(F)cc2)CC1)c1ccc2c(c1)CCCC2 217189780 BPGNWBAIFCEDEF-ZVUBZYFMSA-N 446.570 4.501 50 10 IJGE C[C@@H](CCCBr)NC(=O)c1ccc(Br)cc1Br 235066614 KMFXGASSIZYKHA-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE C[C@H](Br)C[C@@H](C)NC(=O)c1cc(Br)sc1Br 235400116 ZQHXDBBIEOENCO-NTSWFWBYSA-N 433.991 4.565 50 10 IJGE CC[C@@H]1CCC[C@@H](O[C@](C)(CI)CNC(=O)OC(C)(C)C)C1 299983377 WIFIBBPYTSMREM-CKEIUWERSA-N 425.351 4.690 50 10 IJGE COC(=O)[C@@H](Br)C1(Oc2cc(Cl)c(Br)cc2Cl)CCC1 380157015 UVBRBIQWHRPDKQ-LLVKDONJSA-N 446.950 4.994 50 10 IJGE CC1(C)C[C@@H](Br)CCN(c2ncc(Br)cc2Br)C1 395429312 FBXVGSWOUCGGJN-VIFPVBQESA-N 441.005 4.997 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1Br)c1scc(Br)c1Br 707811811 PQTMEJHTKNJEPA-SVRRBLITSA-N 446.002 4.709 50 10 IJGE Cc1ccc(NNC(=O)C(=O)Nc2cc(Cl)ccc2Sc2ccc(C)cc2C)nc1 783485106 MCTAURFEQCDYLQ-UHFFFAOYSA-N 440.956 4.893 50 10 IJGE C=CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](O[Si](C)(C)C(C)(C)C)C1 1149156859 UWNVMDDQIIVEQJ-ZWKOTPCHSA-N 426.674 4.859 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CBr)(O[C@H]2CCOc3ccccc32)CC1 1224325865 MCQSGVGUDVACSB-KRWDZBQOSA-N 426.351 4.691 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NNc2nc3ccccc3[nH]c2=S)c(C)n1CCC(C)C 1301148130 MHCAYSPXQDAXAK-LDADJPATSA-N 434.569 4.807 50 10 IJGE C=CC[C@H]1CCCC[C@@H]1NC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1 1470785773 DGAZPDDNPQEEKZ-CVDCTZTESA-N 443.551 4.618 50 10 IJGE C#CCO[C@H](C)C(=O)Nc1ccc(Br)cc1CO[Si](C)(C)C(C)(C)C 1523669135 RFPYSVCZBOWRRW-CQSZACIVSA-N 426.427 4.948 50 10 IJGE CC(=O)CCc1ccc(OCc2cccc(C(=O)NC[C@]3(C)C[C@@H]3Br)c2)cc1 1533793627 GVRWQHBFAJPZSR-GMAHTHKFSA-N 444.369 4.691 50 10 IJGE Cc1c(C(=O)O)oc2c1C(=NNC(=O)C(c1ccccc1)c1ccccc1)CC(C)(C)C2 1772728585 RCRSZXKOHKQICJ-UHFFFAOYSA-N 430.504 4.911 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2F)[C@@H]1c1cccc(O)c1 1865681386 LZRHXISQMXYRLQ-JOCHJYFZSA-N 438.462 4.661 50 10 IJGE Brc1ccc([C@H](CI)O[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1 1917452365 FHBJDBGZROQISR-YZAHQLQUSA-N 433.127 4.986 50 10 IJGE CC(C)N(CCBr)C(=O)c1csc(Br)c1Br 1937738908 WDXPNDWABSNBCD-UHFFFAOYSA-N 433.991 4.519 50 10 IJGE Cc1nn(-c2ccc(Br)cc2CCl)c(C)c1I 1945162850 WRPDUJUILIVRQV-UHFFFAOYSA-N 425.495 4.595 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1C(=O)c1csc(Br)c1Br 1945190073 GDIONRFBMCECBI-XPUUQOCRSA-N 446.002 4.661 50 10 IJGE CC(C)(C)OC(=O)NC1CCC2(CC1)CC1(CC[C@](C)(CI)O1)C2 2007717307 PRKMCTNSHVJTSE-UIOSHYFSSA-N 449.373 4.977 50 10 IJGE Clc1cc(C[C@]2(CBr)CCCOC2)ccc1I 2026569068 GNGPMRBCNFRFBL-ZDUSSCGKSA-N 429.523 4.679 50 10 IJGE O=C(N[C@@H]1CC[C@@H](CBr)C1)c1cccc(Br)c1Br 2031482294 QKSDVOSGBJSLOC-RKDXNWHRSA-N 439.973 4.505 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N(Cc1ccccc1)CC1CCOCC1 2034666771 UYJFZBWJHDDBCX-UHFFFAOYSA-N 425.348 4.984 50 10 IJGE O=C(CBr)c1cc(Br)c(C(F)(F)F)c(OC(F)(F)F)c1 2054798845 ZVVDZAHYSRFEAJ-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE CC(C)[C@H](Cl)c1cn(-c2ccc(I)cc2Br)nn1 2057427324 PGJAUEFWLCIWGE-LBPRGKRZSA-N 440.510 4.570 50 10 IJGE CC(C)[C@H](CBr)CN1CC[C@H](C(F)(F)F)[C@@H](CNC(=O)OC(C)(C)C)C1 2106786446 UZOSVHJWNGWUKU-ILXRZTDVSA-N 445.364 4.679 50 10 IJGE C[C@@H]1CN(C[C@@H](CBr)c2ccccc2)C[C@@H](C)C1NC(=O)OC(C)(C)C 2106789129 WLSLYOKAWVMGPU-JFIYKMOQSA-N 425.411 4.646 50 10 IJGE O=C(c1csc(Br)c1Br)N1[C@H](CCl)C[C@H]2CCC[C@H]21 2108399810 QYQGDXYXVCNLTI-KHQFGBGNSA-N 427.589 4.895 50 10 IJGE Cc1cc(CBr)cnc1N1CCN(Cc2ccccc2)C[C@H]1C(F)(F)F 2130160520 WNTKPKKTVIRWQN-KRWDZBQOSA-N 428.296 4.538 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@@H](Cl)c1nn(C)cc1Br 2138239871 FVULFQGANNIZIW-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE Cc1csc(C(=O)N2CC[C@@](CBr)(C(F)(F)F)C2)c1Br 2167676486 PJQJZXGRIBZZON-NSHDSACASA-N 435.103 4.609 50 10 IJGE CN(C(=O)c1ccc(Cl)c(I)c1)C(C)(C)CCBr 2256388908 ZLVFJBDNOVIEJS-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE O=S1(=O)CC[C@@H]([C@H](Br)c2cc3sc(Br)cc3s2)C1 2263618587 RFOPNPIWPRTROZ-KBUNVGBDSA-N 430.208 4.596 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@H](Br)c1cnn(C)c1Br 2264366168 FGMXSZYZQIAEFI-NSHDSACASA-N 428.939 4.982 50 10 IJGE COc1cc(C=C(C#N)c2ccc(C(=O)O)cc2)ccc1OCc1cccc([N+](=O)[O-])c1 2297380196 QEDGXPPUAWHJOR-UHFFFAOYSA-N 430.416 4.945 50 10 IJGE CC(C)[C@H](Br)CN(C)Cc1cc(I)ccc1Cl 2307332620 RFBYTUMLYMILBN-GFCCVEGCSA-N 430.555 4.796 50 10 IJGE CN(C)C(=O)C(C#N)=Cc1cc(Cl)c(OCc2ccccc2C#N)c(Br)c1 2313567541 LGMUFAOPUYPBER-UHFFFAOYSA-N 444.716 4.548 50 10 IJGE COc1cc(C=NNC(=O)c2ccc(C)cc2)cc([N+](=O)[O-])c1OCc1cc(C)ccc1C 2318413585 NTWFPINMGIXYON-UHFFFAOYSA-N 447.491 4.872 50 10 IJGE Cc1cccc(N2CCN(C=C(C#N)C(=O)N[C@H](C)c3ccc4c(c3)CCCC4)CC2)c1C 2318463184 YDADSGKPXAQJKV-JOCHJYFZSA-N 442.607 4.589 50 10 IJGE CC(C)COc1ccc(C=NNC(=O)c2ccc3nc(-c4ccccc4O)[nH]c3c2)cc1 2323743634 MRNNCAWOEBUWMX-UHFFFAOYSA-N 428.492 4.734 50 10 IJGE CC(F)(F)c1ccc(C(=O)N[C@H](CCBr)COCc2ccccc2)cc1 2343415209 ZEUADCKCRJRVRQ-GOSISDBHSA-N 426.301 4.899 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2cn(C)c3ccccc23)sc2c1CCCC2 14151025 CBTUKWOECCBIAY-NTCAYCPXSA-N 433.533 4.841 50 10 IJGE Cc1cccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccs2)c1C 38656533 PJJRMFZQNAKLIH-HSZRJFAPSA-N 432.501 4.568 50 10 IJGE ClC[C@H](OCc1ccccc1Br)[C@@H](I)CCl 158548917 GRUBIWQEQJOPBV-QWRGUYRKSA-N 437.930 4.616 50 10 IJGE O=C1NCCc2ccc([C@H](Cl)c3cc(Br)ccc3Br)cc21 161106067 CWTOHNSJFDUETE-HNNXBMFYSA-N 429.539 4.826 50 10 IJGE C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OC(=N)C(Cl)(Cl)Cl)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 200709248 BGINXETUARHRHG-RENAPAEUSA-N 428.740 4.558 50 10 IJGE in-vitro CCOc1ccc(C)cc1[C@@H](C)NC(=O)/C(C#N)=C\NCc1cccc(Br)c1 217187560 YBGCIOWNBRAJJF-VVZNPABPSA-N 442.357 4.531 50 10 IJGE O=C1[C@@H](Br)CCCN1c1c(Br)cc(Cl)cc1Br 304135424 CNZZMXJEQGDNTM-ZETCQYMHSA-N 446.364 4.755 50 10 IJGE ClCc1nc2ccc(Br)cc2n1C[C@@H]1CN(Cc2ccccc2)CCCO1 390647464 UOLKJJQMOZWDPF-SFHVURJKSA-N 448.792 4.829 50 10 IJGE BrCC(CBr)(C[C@@H]1CCOC1)c1ccccc1Br 400589436 PBCRYQFZLQJRRB-NSHDSACASA-N 441.001 4.903 50 10 IJGE ClCc1ccc(N2CC[C@@]3(CN(Cc4ccccc4)CCO3)C2)c(Br)c1 717596482 YAVVEOVXOKJDDB-OAQYLSRUSA-N 435.793 4.669 50 10 IJGE CC[C@H](C)N(CCCl)C(=O)c1ccc(I)c(Br)c1 721606930 XVZTWFSSPXDXDI-VIFPVBQESA-N 444.538 4.533 50 10 IJGE CCOc1ccc(C(=O)NNc2c(Cl)cc(Br)cc2Cl)cc1[N+](=O)[O-] 742005492 XHOFRSNKVADVPG-UHFFFAOYSA-N 449.088 4.820 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCCc2cc(Cl)sc2Cl)c1C 755812686 RCMYZLFLRCHKHK-UHFFFAOYSA-N 436.368 4.990 50 10 IJGE Cc1cc(C(=O)Oc2ccc([N+](=O)[O-])c3ncccc23)c2cnn(Cc3cccs3)c2n1 770136995 YNKNHBMFUQIOPU-UHFFFAOYSA-N 445.460 4.525 50 10 IJGE Cc1cccc(C(=O)NN=C2CCCc3oc(C(=O)N(C)Cc4ccccc4)c(C)c32)c1 1772745047 QLTTYXKNYKASDJ-UHFFFAOYSA-N 429.520 4.639 50 10 IJGE CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2cccc(Cl)c2)cc1 1865692938 GRXRKNYKYIMTTK-QFIPXVFZSA-N 434.927 4.900 50 10 IJGE CN(C[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)OC(C)(C)C 1880766272 GHKSRDNVBMCJQR-UONOGXRCSA-N 437.419 4.804 50 10 IJGE COc1ccc(CCC[C@H](Cl)CN2C(=O)c3ccccc3C2=O)c(Br)c1 1901210115 ZYSBMMLHVYMXOR-AWEZNQCLSA-N 436.733 4.684 50 10 IJGE Fc1cc2nc(CCl)n(-c3csnc3Br)c2cc1Br 1926861439 CYUKLAFIYZOIBF-UHFFFAOYSA-N 425.508 4.885 50 10 IJGE CCN(C[C@H](C)Br)C(=O)c1csc(Br)c1Br 1937734557 LNDOMGAOKQEHMD-LURJTMIESA-N 433.991 4.519 50 10 IJGE Clc1cc(CN[C@@H](CCBr)C2CC2)ccc1I 2026564255 REYJGYZHDXINDT-ZDUSSCGKSA-N 428.539 4.598 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NC(=O)c1cccc(Br)c1Br 2031478971 UUQPBYDPJBXGJL-BDAKNGLRSA-N 441.989 4.894 50 10 IJGE CC(C)(CBr)CCNC(=O)c1cccc(Br)c1Br 2031480164 RYMCBEJZEUZGIF-UHFFFAOYSA-N 441.989 4.753 50 10 IJGE CC(C)[C@H](Br)c1cn(-c2cc(Br)ccc2Br)nn1 2057429565 QDBSZZDSYHZUBA-LBPRGKRZSA-N 437.961 4.884 50 10 IJGE CC(C)C[C@@](C)(CNC(=O)OC(C)(C)C)NC(=O)c1ccc(CBr)cc1 2106204007 PJHQPLWJZZAOAB-FQEVSTJZSA-N 427.383 4.641 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CN(CCCCCCCCCBr)CCO1 2119486518 GERAWEAUSHAYCG-GOSISDBHSA-N 435.447 4.728 50 10 IJGE CCCOc1ccc(S(=O)(=O)N(Cc2ccccc2)C(C)C)cc1CBr 2123245519 IVXOAWSAHPAKHK-UHFFFAOYSA-N 440.403 4.970 50 10 IJGE CC(C)(C)OC(=O)NCC(F)(F)[C@@H]1CCCCN1CC1(CBr)CCCC1 2128727404 YKIKOHMTFPIBSD-HNNXBMFYSA-N 439.385 4.956 50 10 IJGE Clc1cc(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)ccc1CBr 2129050502 DILVKKWYZPUBOQ-SFTDATJTSA-N 435.793 4.715 50 10 IJGE C[C@@]1(COc2c(Br)cc(Cl)cc2CBr)CSCCO1 2136552801 GBUJOLMOZNTTSZ-CYBMUJFWSA-N 430.589 4.898 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN(C(=O)[C@@H](Br)C2CCCC2)C1 2167034568 XHVPXOOVFURZGU-KSZLIROESA-N 443.426 4.578 50 10 IJGE O=S(=O)(c1cc(Cl)c(Br)s1)N(CCCl)Cc1ccsc1 2171121262 JOYJEXDGSQWLKQ-UHFFFAOYSA-N 435.217 4.655 50 10 IJGE C[C@@]1(CCOCc2ccccc2)CCN1S(=O)(=O)c1ccc(CCl)cc1Cl 2197756370 VXGDOMKFNVMHNA-FQEVSTJZSA-N 428.381 4.839 50 10 IJGE Cc1cc(C(=O)Nc2ccc(CCBr)cc2)ccc1I 2207104404 GDFGQKHARJVVAC-UHFFFAOYSA-N 444.110 4.789 50 10 IJGE BrC[C@@H]1C[C@@H]2CCCC[C@@H]2N1C[C@H]1CC1(Br)Br 2217338227 YYDKWYSELVQDMD-USZNOCQGSA-N 430.022 4.520 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@@H](CBr)C12CCC2 2264501616 NWURLYHXNCCURL-QMMMGPOBSA-N 427.589 4.944 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2C[C@H](C)O[C@H](C)C2)cc1I 2269555933 KCQPSNMVCAVRTB-KVQFHVITSA-N 439.131 4.939 50 10 IJGE C[C@@H]1C[C@H](CBr)CN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282978368 MEXQCRBINDOQAB-RKDXNWHRSA-N 427.539 4.735 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@H](Br)CCC12CC2 2282987328 BYPFUJPKGINZTB-MRVPVSSYSA-N 425.523 4.774 50 10 IJGE N#CC(=Cc1cc(Br)ccc1OCc1ccccc1)C(=O)NCc1ccco1 2293665601 SKLUVPJASOBGRY-UHFFFAOYSA-N 437.293 4.844 50 10 IJGE Clc1ccc(C[C@@]2(CBr)CC=CCO2)cc1I 2300241480 ZYBDRTZGANGWMP-CYBMUJFWSA-N 427.507 4.597 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)NC2CC2)ccc1OCc1ccc(Br)cc1 2313676680 RJBSSBYWDFGDSW-UHFFFAOYSA-N 441.325 4.612 50 10 IJGE CCCc1ccc(OCC(=O)Oc2ccc(C=CC#N)cc2OC)c(Br)c1 2314795925 FFRCNQJDWCGFRS-UHFFFAOYSA-N 430.298 4.931 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)C=Cc3cccc(OC(C)C)c3)c(C)n2)cc1C 2321103736 UCXNEHAWGIIDJF-UHFFFAOYSA-N 443.547 4.935 50 10 IJGE Cn1nc(C(F)F)c(CBr)c1Oc1cccc(I)c1 2339764692 KNYVAVRWZTVKHC-UHFFFAOYSA-N 443.029 4.650 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Cl)[C@H]1CCCCS1(=O)=O 2365222691 GFFGZMHSINOGGS-SKDRFNHKSA-N 448.579 4.906 50 10 IJGE CC(C)C/C(=N\NC(=O)CNC(=O)C(c1ccccc1)c1ccccc1)c1ccccc1 15133318 KGWRBRXSASVLJR-RMLRFSFXSA-N 427.548 4.501 50 10 IJGE CC(C)c1ccc(O[C@@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccco2)cc1 38657559 AKJFVQDIBXHEPR-FYSMJZIKSA-N 444.487 4.994 50 10 IJGE O=C(CCCc1c(-c2ccccn2)[nH]c2ccccc12)NNC(=O)c1cccc(Cl)c1 39846654 KZQOOHNURLDFTR-UHFFFAOYSA-N 432.911 4.667 50 10 IJGE COc1cc(/C=N/NC(=O)COc2cccc(C(C)C)c2)ccc1OCc1ccccc1 40888497 OLLVURAPOQGTRI-JVWAILMASA-N 432.520 4.927 50 10 IJGE CC(=NNC(=O)/C(=C\C(C)=C\c1ccccc1)NC(=O)c1ccccc1)c1ccc(O)cc1 252622239 NRCONHIAHYHNKB-INAWZCBSSA-N 439.515 4.650 50 10 IJGE CCC(=NNC(=O)c1cc(-c2cccc(OC)c2)nc2ccccc12)c1cc(O)ccc1O 254514756 XMLXMTXACQAGSW-UHFFFAOYSA-N 441.487 4.866 50 10 IJGE O=C1Cc2cc([C@H](Br)c3ccc(Br)o3)c(Br)cc2N1 302396090 OFTQFYGZIJNKPE-ZDUSSCGKSA-N 449.924 4.784 50 10 IJGE O=C1Cc2cc([C@@H](Br)c3coc(Br)c3)c(Br)cc2N1 393532837 CWIVOSLAOOYOLG-ZDUSSCGKSA-N 449.924 4.784 50 10 IJGE O=C(NCCC1(CBr)CC1)c1scc(Br)c1Br 705425382 KMKNNHIXYSDWIK-UHFFFAOYSA-N 446.002 4.568 50 10 IJGE C[C@@]1(CBr)CCCN1C(=O)c1cc(Br)c(Br)s1 723006205 QSPXQWHXKVAEDD-NSHDSACASA-N 446.002 4.663 50 10 IJGE O=C(NCc1ccc(Sc2ccccc2)cc1)NNC(=O)c1cccc2cccnc12 746722601 KKHKWYBAFZWEHX-UHFFFAOYSA-N 428.517 4.530 50 10 IJGE CC[C@H]1CN(C[C@@H](CBr)C2CC2)[C@H](CC)CN1C(=O)OCc1ccccc1 1615577249 FOKQUWRUKPDZTP-NJYVYQBISA-N 437.422 4.919 50 10 IJGE COCCCN1C(=O)C(C#N)=C(C)/C(=C/Nc2ccc(N=Nc3ccccc3)cc2)C1=O 1772742763 LCQKJECQONDHEU-FQXNWRJASA-N 429.480 4.643 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3Cc2ccc(F)cc2)cc1 1865709276 SQRNMCRBSPWSJX-GOSISDBHSA-N 442.416 4.870 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc(Cl)c2)[C@H]1c1cccc(F)c1 1865710512 ACPIAVKXYKPZKI-HNNXBMFYSA-N 434.780 4.902 50 10 IJGE COc1cccc(-c2csc(/C(C#N)=C(\O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3)n2)c1 1872744563 YMFBBDDQSMFLBA-CYVLTUHYSA-N 438.421 4.893 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1ccc(Br)c(Cl)c1 1882086931 GFCJXEUSCWEFPC-SNVBAGLBSA-N 427.564 4.933 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)C1CCC2(CC1)CN(C(=O)OC(C)(C)C)C2 1882087535 KIBJGIWOOSXSOC-HNNXBMFYSA-N 447.414 4.702 50 10 IJGE Cc1c(Br)c(CN(Cc2ccccc2)[C@@H](CBr)C2CC2)nn1C 1915186524 MCBSWFSIKPMJPU-KRWDZBQOSA-N 441.211 4.667 50 10 IJGE O=S(=O)(c1ccc(F)cc1Br)N(Cc1ccccc1)C1(CCl)CCC1 1915767137 OABUJHMOBXCYBQ-UHFFFAOYSA-N 446.769 4.941 50 10 IJGE CC[C@@H](C)[C@H](Br)CNC(=O)c1cc(Br)c(Br)s1 1942802874 HMRCODBNKSTQPO-HTRCEHHLSA-N 448.018 4.813 50 10 IJGE C[C@H]1CCN(Cc2ccc(Br)cc2Br)[C@@H]1CBr 1943842650 HEUUQVJRRTUGCM-TVQRCGJNSA-N 425.990 4.817 50 10 IJGE Cc1nn(-c2ccc(CCl)cc2Br)c(C)c1I 1945162718 VHGCJAONNHCKAD-UHFFFAOYSA-N 425.495 4.595 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)O[C@H]1CCCC(F)(F)CC1 1995216104 BSCOYCVJOSUQRL-SWLSCSKDSA-N 447.304 4.689 50 10 IJGE CCOC(C)(C)CO[C@H](CI)c1ccccc1Br 2033158471 HBUSKEDYZDDHFS-CYBMUJFWSA-N 427.120 4.757 50 10 IJGE C[C@@H](CCl)[C@@H]1CCCCN1c1ncc(I)cc1Br 2069529836 SQAUNEBMPXSXDQ-CABZTGNLSA-N 443.554 4.683 50 10 IJGE CCCCN(CCCl)C(=O)c1ccc(Br)cc1I 2086147800 RWPNXEUADNKVAK-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@H](C)C1Br 2086659259 UXIASDDYVGAVCR-UWVGGRQHSA-N 442.566 4.796 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@@H](CNC(=O)OC(C)(C)C)Cc2ccccc21 2106787169 YEMFOHPRYFRKHW-SJLPKXTDSA-N 425.411 4.857 50 10 IJGE Clc1ccccc1C(CBr)(CBr)C[C@H]1COCCCO1 2154013024 PEEWHJFRCJFVBN-LBPRGKRZSA-N 426.576 4.563 50 10 IJGE CC(C)(C)[C@H](CBr)CN1CCC([C@@H]2CCCN(C(=O)C(F)(F)F)C2)CC1 2163065183 YDOUFENVEOSMMJ-HZPDHXFCSA-N 441.376 4.557 50 10 IJGE CC(C)(C)OC(=O)N1CCCC12CCC(NC(=O)[C@@H](Br)C1CCCC1)CC2 2167903769 VOFYNEWPGZHZQK-BATSVXPKSA-N 443.426 4.769 50 10 IJGE C[C@@H]1[C@@H](NC(=O)OC(C)(C)C)CC[C@H](C(=O)N(C)C[C@H]2C[C@H](Br)C2)C1(C)C 2196913589 DZNBBBUSGFIMGW-HHARLNAUSA-N 445.442 4.584 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)[C@H]1[C@H]2OCC[C@@H]21 2213490727 VYMFIKGUJLQYMM-YTYDCRINSA-N 428.921 4.822 50 10 IJGE BrCCCC1CN(Cc2c(Br)cccc2Br)C1 2216707193 GDUPQBRJJUOTNR-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@@H]1C[C@@H]2CCC[C@H](C1)C2(F)F 2233637899 IYORMYVGIDFYTQ-RDGPPVDQSA-N 444.360 4.887 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@H]2C[C@@H]3C[C@@H]3CO2)c1 2263514867 HPPYRCWSNICRBG-DJBIQUGXSA-N 438.985 4.943 50 10 IJGE CCCC1(O[C@@](C)(CI)c2ccccc2Br)COC1 2272852951 UYDZWPBJRWOBPO-AWEZNQCLSA-N 439.131 4.685 50 10 IJGE C[P@]1(=O)C[C@H](Br)[C@H](Cc2cc(I)ccc2Cl)C1 2307330006 IVAUZWUGPHYRHC-MIHTYCSTSA-N 447.478 4.873 50 10 IJGE CCOc1cc(C=C2C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)ccc1OCCC(C)C 2314618049 GHQXKXYEANEMOM-UHFFFAOYSA-N 448.519 4.896 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NN=Cc1ccc2c(c1)OCCO2 2321250726 FYTNTLDPGUTKLG-UHFFFAOYSA-N 442.302 4.899 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)C(C#N)=CNc1cc([N+](=O)[O-])ccc1Cl 2325072403 WLBFVWIMKPOUOV-AWEZNQCLSA-N 428.876 4.652 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(OC[C@H]2C[C@@H](C(F)(F)F)C2)C1 2327819109 KWAYCHGTYMCBRX-DVOMOZLQSA-N 430.305 4.756 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)cnc2n1[C@]12C[C@H]1CN(Cc1ccccc1)C2 2329012142 JAOOCDSFRQWAPN-AFBRZQFHSA-N 431.765 4.725 50 10 IJGE Cc1ccc(-c2csc(C(C#N)=C(O)[C@H](C)N3C(=O)c4ccccc4C3=O)n2)c(C)c1 2331309052 QQUCOSAEGFLJPN-HNNXBMFYSA-N 429.501 4.904 50 10 IJGE CC1(C)CCC(C)(C)[C@H](Br)[C@H]1Cc1ncc(I)cn1 2353064503 MNSHASMSJCWNKW-DGCLKSJQSA-N 437.163 4.850 50 10 IJGE O=[N+]([O-])c1cc(N2CC[C@@H]3CC[C@H](C2)N3Cc2ccccc2)ccc1CBr 2356883830 XFDJENUDWYEBFK-AZUAARDMSA-N 430.346 4.733 50 10 IJGE Cc1csc(C(=O)N2CC[C@@H](Br)C[C@H]2C(F)(F)F)c1Br 2361457897 GSUUIEPIFSMVHP-SFYZADRCSA-N 435.103 4.749 50 10 IJGE COc1cccc(/C=N/NC(=O)c2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2)c1O 12491749 HNGSYFKYEYERKE-JVWAILMASA-N 445.519 4.715 50 10 IJGE COc1ccc(CC(=O)Oc2ccc(/C=C(/C#N)c3ccccc3OC)cc2)cc1OC 31900811 AZTAUKVETFJSMW-ZHZULCJRSA-N 429.472 4.925 50 10 IJGE COc1cc(/C=C2/C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccc(C)cc1 38604625 TXROESRRJGCYSE-CIAFOILYSA-N 430.504 4.583 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)ccc1OC(=O)c1cccc(Cl)c1 40869936 SLHYPFLGHRFYKO-UDWIEESQSA-N 446.890 4.791 50 10 IJGE CC1=C(C#N)C(=O)N(C[C@@H]2CCCO2)C(=O)/C1=C/Nc1ccc(/N=N/c2ccccc2)cc1 101233664 AANCYKFPSMORQE-ZUCYQWQESA-N 441.491 4.786 50 10 IJGE CC(C)Oc1c(Cl)cc(/C=N\NC(=O)Cc2ccc3nc(N)sc3c2)cc1Cl 169917211 JPNFOWDSGTUHEL-AQHIEDMUSA-N 437.352 4.665 50 10 IJGE N#C/C(=C/c1ccc(OCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1)c1nc2ccccc2[nH]1 206445834 WVAIHTPYOBOAOR-LGMDPLHJSA-N 439.431 4.553 50 10 IJGE O=C(NCCCCCCI)c1ccc(Cl)c(Br)c1 236044134 RGRYMTMHUMZQFW-UHFFFAOYSA-N 444.538 4.828 50 10 IJGE C/C(C=NNC(=O)c1ccc(C(=O)NN=C/C(C)=C/c2ccccc2)o1)=C\c1ccccc1 252599397 DIJFCQHYJVBWTA-CRQCROGCSA-N 440.503 4.918 50 10 IJGE Cc1cccc(OCC(=O)NN=Cc2cc([N+](=O)[O-])ccc2N(CC(C)C)CC(C)C)c1 254442288 WZIVYMJONZZNAH-UHFFFAOYSA-N 440.544 4.551 50 10 IJGE C[C@H]1CN(S(=O)(=O)c2ccc(Cl)c(CCl)c2Cl)CCN1Cc1ccccc1 396329341 DRRHGIBCEGSWLM-AWEZNQCLSA-N 447.815 4.627 50 10 IJGE CN(C[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(CBr)cc1[N+](=O)[O-] 720017106 QFKTUSWEYNHNEF-IBGZPJMESA-N 432.362 4.838 50 10 IJGE Cc1ccc(-n2c(C)c(Br)c(C=NNC(=O)c3cccnc3)c2C)c(C)c1 1083922578 IURXSIYCNWSYND-UHFFFAOYSA-N 425.330 4.632 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2cc(C)n(-c3ccccc3F)c2C)cc1 1084036335 YKXJBCWILSWWPQ-XMMPIXPASA-N 437.515 4.596 50 10 IJGE Cc1ccc(-c2ccc(C=NNC(=O)c3ccccc3Br)o2)cc1[N+](=O)[O-] 1084092836 SLXNTXDLAYFMNK-UHFFFAOYSA-N 428.242 4.690 50 10 IJGE O=C(NN=Cc1cc(Cl)cc(Cl)c1)C(CCO)(c1ccccc1)c1ccccc1 1088669595 YUUJMKUXDYOGME-UHFFFAOYSA-N 427.331 4.812 50 10 IJGE CCCOc1ccc(/C=C/C(=O)NNC(=O)c2ccc(-c3ccc(C)cc3)nc2C)cc1 1865757500 GEKYIZJTVKWXHG-CXUHLZMHSA-N 429.520 4.629 50 10 IJGE C[C@H](NCc1c(Br)cccc1Br)c1nnc(CCl)s1 1877574680 ZNPKDGDBWAAEIM-ZETCQYMHSA-N 425.577 4.653 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCCN(C(=O)OC(C)(C)C)C1(C)C 1881088354 GGQAAGDOEQVKEX-KGLIPLIRSA-N 435.403 4.700 50 10 IJGE Brc1cnccc1C[C@H](Br)c1csnc1Br 1925225587 JDNAJZSSDVJEPP-QMMMGPOBSA-N 426.959 4.742 50 10 IJGE BrCC[C@@H]1CCCN1Cc1cccc(Br)c1Br 1943881060 NEOMIKMBZBQTAL-NSHDSACASA-N 425.990 4.961 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1Cc1cc(Br)ccc1Br 2006496681 KXOLIYHGXVLXOC-SKDRFNHKSA-N 425.990 4.959 50 10 IJGE CC[C@@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@H]1Br 2026563377 JOBNCRMMKBCHIK-GHMZBOCLSA-N 428.539 4.550 50 10 IJGE CCCN(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@H](Br)C(F)(F)F 2044704569 DQYBIEPCVASWSE-KBPBESRZSA-N 431.337 4.671 50 10 IJGE CC(C)Cc1cc(CBr)n(Cc2ccccc2I)n1 2070048749 NZYYYBQSLNNJEZ-UHFFFAOYSA-N 433.131 4.629 50 10 IJGE CCOc1cccc(-n2nc(CCl)c(I)c2C(F)(F)F)c1 2079207026 AKLAHVOZHGQEHK-UHFFFAOYSA-N 430.595 4.633 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC13CCOCC3)C[C@]2(CBr)C(F)(F)F 2083260602 PTPKIBXOKGGUNE-GOEBONIOSA-N 428.289 4.510 50 10 IJGE CCC(CC)(CBr)CN1CC[C@@H](C(F)(F)F)[C@H](NC(=O)OC(C)(C)C)C1 2106783149 XHOVOEURZPTKQU-ZIAGYGMSSA-N 445.364 4.965 50 10 IJGE C[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)N(C(=O)c2ccc(CBr)cc2)[C@@H]1C 2163056325 QEFZZDPFJOKLHQ-IIDMSEBBSA-N 439.394 4.735 50 10 IJGE ClCc1ccc(Br)c(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)n1 2177043965 JQQFTKAOBJVFSQ-SAJDGTNDSA-N 446.820 4.930 50 10 IJGE CO[C@@H]1CN(c2c(CBr)ccc(Br)c2Cl)CC(F)(F)C1 2185157504 FAZGCJCQMRKSLO-VIFPVBQESA-N 433.518 4.858 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]21 2185533278 MONSMHKFLOIMBN-ROUUACIJSA-N 447.458 4.678 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2ccc(CBr)cc2)[C@H]1C(C)(C)C 2192487586 HBYSACTZZCLXHZ-SJORKVTESA-N 439.394 4.735 50 10 IJGE C[C@@H]1CCC[C@H]([C@@H](Br)c2cc(I)cc3c2OCC3)O1 2226862864 DZVYWMTVAFEIMJ-FZQKWOKYSA-N 437.115 4.620 50 10 IJGE FC1(F)[C@@H]2CC[C@H](O[C@@H](CI)c3ccccc3Br)[C@@H]21 2230421601 RWLXKDHHXQQTCH-LPTSXCQYSA-N 443.069 4.986 50 10 IJGE CC1(C[S@](C)(=O)=NCCCCCCCBr)CN(C(=O)OC(C)(C)C)C1 2263151777 PSJNOOJIVWMNAD-VWLOTQADSA-N 439.460 4.687 50 10 IJGE COC(=O)c1cc(NC=C(C#N)c2nc(-c3ccc(C)cc3)cs2)cc(C(=O)OC)c1 2296763984 SGYHVUMAKLQVMR-UHFFFAOYSA-N 433.489 4.668 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=C(C#N)C(=O)Nc3ccc(N(C)C)cc3)o2)cc1 2297188044 YCABFBZMTXQQCA-UHFFFAOYSA-N 429.476 4.735 50 10 IJGE CC1(C)C[C@H](Cl)CN1Cc1ccc(I)c(Br)c1 2306225158 CEQCMIPMAFKKGW-JTQLQIEISA-N 428.539 4.645 50 10 IJGE C=CCOc1c(Br)cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)cc1OC 2313518503 GWTYQACDYIAQTO-UHFFFAOYSA-N 427.298 4.877 50 10 IJGE CCN(CC)C[C@@H](Br)CCc1ccc(Cl)c(I)c1 2315548880 LZAABUVLDOTJDU-LBPRGKRZSA-N 444.582 4.983 50 10 IJGE N#CC(=Cc1cccc(OC(=O)CN2C(=O)c3ccccc3C2=O)c1)c1ccc(Cl)cc1 2320511009 JKTZIKFYGGFLOO-UHFFFAOYSA-N 442.858 4.606 50 10 IJGE COc1ccc(Br)cc1C=NNC(=O)c1ccc2[nH]c3c(c2c1)C[C@H](C)CC3 2323163841 UIJAKDXNQNWBCC-CYBMUJFWSA-N 440.341 4.828 50 10 IJGE C[C@H](C(O)=C(C#N)c1nc(-c2ccc(F)cc2F)cs1)N1C(=O)c2ccccc2C1=O 2331286884 VXQSVOWKCKBUPC-LLVKDONJSA-N 437.427 4.566 50 10 IJGE Cn1cc(I)c(C[C@@H]2[C@@H](Br)C(C)(C)CCC2(C)C)n1 2341858050 YOJZEGZEQTWDQV-ZWNOBZJWSA-N 439.179 4.793 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1C[C@@H]2CCC[C@@H]2N1C[C@H](CBr)c1ccccc1 2354693521 AELCOYANOIHHPM-HAGHYFMRSA-N 437.422 4.933 50 10 IJGE CN(C[C@@H]1CCCN(Cc2ccccc2)C1)c1c(CBr)c(C(F)F)nn1C 2365275841 ZAQKJGCPPVSWAQ-INIZCTEOSA-N 441.364 4.601 50 10 IJGE CC(C)CCOc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)cc1 14021789 VYTCZAJEZWMXAP-AWEZNQCLSA-N 439.339 4.647 50 10 IJGE Cc1cccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2F)c1C 38652172 SLLKAGVGOZRVNY-RUZDIDTESA-N 444.462 4.645 50 10 IJGE CCCCOc1cccc(/C=N/NC(=O)CSc2nnc(-c3ccccc3)s2)c1 40947818 KJUBZFPSCPTBLU-HYARGMPZSA-N 426.567 4.626 50 10 IJGE CS(=O)(=O)c1cccc([C@@H](Br)c2cc(F)c(Br)cc2F)c1 70474472 SSSQLORSBDXRTJ-CQSZACIVSA-N 440.103 4.615 50 10 IJGE CCc1ccc(-c2csc(/C(C#N)=C\Nc3cc(C(=O)OC)ccc3C(=O)OC)n2)cc1 102419575 HGQVLVGOHVLVBP-AQTBWJFISA-N 447.516 4.922 50 10 IJGE O=C(c1ccc([N+](=O)[O-])o1)[C@@H](Br)[C@@H](Br)c1ccc(Cl)cc1 106866679 SCPVKHUTGFKSOJ-RYUDHWBXSA-N 437.471 4.924 50 10 IJGE CC[C@@H](CCBr)CNC(=O)c1cc(Br)ccc1Br 161229072 WPDLPZYFCYSECX-VIFPVBQESA-N 441.989 4.753 50 10 IJGE C[C@H](Br)[C@@](Br)(CBr)C(=O)Oc1ccccc1Cl 205782685 CRFLXWUXTJXTLN-CPCISQLKSA-N 449.364 4.557 50 10 IJGE CC[C@H](C)N1C(=O)C(C#N)=C(C)/C(=C/c2ccc(OCc3ccc(F)cc3)c(OC)c2)C1=O 214269913 RCJISSJMJNRJIA-IXGURIBZSA-N 448.494 4.804 50 10 IJGE CN(C(=O)/C(C#N)=C\N1CCN(C(c2ccccc2)c2ccccc2)CC1)C1CCCCC1 217188289 NBWGZAKSQGIQJN-LVWGJNHUSA-N 442.607 4.592 50 10 IJGE CCCOc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)c2ccc(O)cc2)cc1 254704172 JXIYRGWQPNOJRC-UHFFFAOYSA-N 440.503 4.798 50 10 IJGE Cc1ccc(C(=O)Oc2ccc(C=NNC(=O)COc3ccc(C(C)C)cc3)cc2)cc1 254856610 TYUFBALSVRYKDR-UHFFFAOYSA-N 430.504 4.867 50 10 IJGE BrCC(CBr)(C[C@@H]1CCOC1)c1ccc(Br)cc1 400530299 HMHNISYPCFNEEQ-NSHDSACASA-N 441.001 4.903 50 10 IJGE C[C@@H]1[C@@H](Br)CCCN1C(=O)c1scc(Br)c1Br 705425017 JGBGGUPCYIGPFV-RQJHMYQMSA-N 446.002 4.661 50 10 IJGE Cc1ccccc1NNC(=O)c1nn(-c2ccc(Br)cc2)c2c1CCCC2 739391124 HPZHPENQSVAKJJ-UHFFFAOYSA-N 425.330 4.579 50 10 IJGE O=C(C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)NNc1cccc(F)c1F 743721822 YPXKBLFQSHNPJK-IBGZPJMESA-N 429.854 4.623 50 10 IJGE Cc1ccc(C=NNC(=O)c2ccccc2OCc2ccc(F)cc2)c(-c2cnn(C)c2)c1 802703646 CDGPDPCWOICDCR-UHFFFAOYSA-N 442.494 4.878 50 10 IJGE CC(CC(C)C)=NNC(=O)CSc1nnc(CNc2ccccc2)n1-c1ccccc1 1084193988 DPYVFARSVKZYKN-UHFFFAOYSA-N 436.585 4.510 50 10 IJGE CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)cc1 1658119716 KNKZRDDPZRYMKJ-UHFFFAOYSA-N 437.883 4.588 50 10 IJGE N#CSc1ccc(NC(=O)Oc2ccc(CNC(=O)c3cccc(C#N)c3)cc2)cc1 1858913090 PSKGITOFCFDELT-UHFFFAOYSA-N 428.473 4.672 50 10 IJGE Cc1nn(Cc2cccc(F)c2)c2c1[C@@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 1865684992 CMKHTTDXXOLQTA-IBGZPJMESA-N 429.282 4.904 50 10 IJGE Cc1nn(Cc2cccc(F)c2)c2c1[C@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2 1865710683 FCDZWZZVIKIPJV-LJQANCHMSA-N 428.389 4.616 50 10 IJGE COc1c(C)cc(C)cc1-c1csc(/C(C#N)=C(\O)CN2C(=O)c3ccccc3C2=O)n1 1872754813 KEEYPQDQPIQSJX-ZZEZOPTASA-N 445.500 4.524 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CCl)[C@H]1CCCN(C(=O)OC(C)(C)C)CCC1(F)F 1893342226 NKGMJHFLZZQWEZ-KGLIPLIRSA-N 426.932 4.791 50 10 IJGE CN(C[C@](C)(CBr)C(C)(C)C)[C@@H]1CC[C@H]1NC(=O)OCc1ccccc1 1904843103 AKNXJQFIMSAVAN-OPYAIIAOSA-N 425.411 4.823 50 10 IJGE Cc1cc(C(=O)N(C)C[C@@H](Br)COCc2ccccc2)c2ccccc2n1 1916355453 UVEYXERJQUVNJC-GOSISDBHSA-N 427.342 4.596 50 10 IJGE CCCN1C[C@@H](Br)[C@H](c2c(Br)cccc2Br)C1 1950850553 LDYPZSGVGMLQPX-BXKDBHETSA-N 425.990 4.784 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CCC[C@@H]2C[C@H]21)C(=O)OC(C)(C)C 1995175607 JFQMFADOBGXJSJ-ADAWSYLGSA-N 437.362 4.642 50 10 IJGE C[C@]1(CBr)C[C@H](NC(=O)c2cc(Br)ccc2Br)C1 2059454308 GJFFBUVTHKGPOR-GMZHKTEUSA-N 439.973 4.505 50 10 IJGE BrCc1cc(C2CCC2)nn1Cc1cccc(I)c1 2070034076 KKFRBDIRKBRZJS-UHFFFAOYSA-N 431.115 4.698 50 10 IJGE Cc1cc(Cn2nc(CBr)c(Br)c2C(F)(F)F)ccc1O 2079229872 LGPDWLZEUVTAFM-UHFFFAOYSA-N 428.046 4.622 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)c2ccccc2)C(C)(C)CC1 2106781700 KIKOZVOWIAUUTG-GOSISDBHSA-N 425.411 4.887 50 10 IJGE O=C(c1cc(Cl)ccc1Br)N1CC[C@H](CBr)C(F)(F)C1 2146375066 IKPCMDAEFXUKLO-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2[C@]12C[C@H]1CN(Cc1ccccc1)C2 2184922621 NLVMHJQDERQYNJ-KKSFZXQISA-N 445.792 4.515 50 10 IJGE Fc1cccc([C@@H](CI)O[C@@H]2CCN(Cc3ccccc3)C2)c1 2244798875 CVDBIPRHEZHKJQ-RTBURBONSA-N 425.285 4.593 50 10 IJGE COc1ccc([C@@H](Br)[C@@]23CC[C@@H](C2)[C@@H](C)O3)cc1I 2269545124 MGEKIJPYWVIBRG-VNLRXTSXSA-N 437.115 4.693 50 10 IJGE CN(Cc1ccc(I)cc1)[C@H](CBr)c1ccccc1 2278835962 KJUJBOFYEADFDX-MRXNPFEDSA-N 430.127 4.859 50 10 IJGE Cl[C@@H]1CC[C@H](CNCc2ccc(I)c(Br)c2)C1 2306231967 OPGRWUSKIQCFSP-GXSJLCMTSA-N 428.539 4.551 50 10 IJGE C[C@@H]1CC[C@@H](CBr)N(Cc2ccc(Cl)c(I)c2)C1 2315554537 GHTCVEZICLSEHV-PWSUYJOCSA-N 442.566 4.940 50 10 IJGE C[C@H](c1ccncc1Br)[C@@H](Br)c1c(Br)ncn1C 2315592685 ZSCSVCGUWHCARN-GMSGAONNSA-N 437.961 4.580 50 10 IJGE COc1ccc(OC)c(NC(=O)C(C#N)=CNc2ccc(Cl)c(C(F)(F)F)c2)c1 2318462257 FHVAKSQTKDGYFG-UHFFFAOYSA-N 425.794 4.834 50 10 IJGE CC(C)[C@H](CBr)N(C)C(=O)c1cc(Br)ccc1Br 2318852874 XIBZHMDYFXOMSL-LBPRGKRZSA-N 441.989 4.703 50 10 IJGE C[C@@H](Br)CN(C(=O)c1csc(I)c1)C1CCCC1 2320003932 BYHGYDYPHMUJFV-SECBINFHSA-N 442.160 4.521 50 10 IJGE CC1(C)C[C@@H](CCl)CN1Cc1ccc(I)c(Br)c1 2325208000 FFRCRYJIXFCJDL-NSHDSACASA-N 442.566 4.893 50 10 IJGE CC(C)Oc1ccc(C(=O)NN=C2C(=O)N(Cc3ccccc3Cl)c3ccccc32)cc1 2326841490 LZKGXZDMLGLMSS-UHFFFAOYSA-N 447.922 4.808 50 10 IJGE COc1c(F)c(F)cc(C(=O)N(Cc2ccccc2)C(C)(C)CBr)c1F 2336107972 ZNWYMTUGVMPHAT-UHFFFAOYSA-N 430.264 4.928 50 10 IJGE FC(F)(F)[C@@H]1[C@H](Br)CCCN1Cc1ccc(I)cc1 2344184052 IKFJFBNSKNQVFN-NEPJUHHUSA-N 448.064 4.581 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@]1(F)CN(C[C@@](C)(CBr)C(C)(C)C)C2 2352078125 OIRAZTMCNKNQME-AABGKKOBSA-N 435.422 4.905 50 10 IJGE ClCCCOC1CCN(Cc2ccc(Cl)c(I)c2)CC1 2362367728 FUYTWNGUJBBRAN-UHFFFAOYSA-N 428.141 4.555 50 10 IJGE CCOc1ccc(/C=N/NC(=O)COc2ccc3ccccc3c2Br)cc1 3167382 JHGGCULEUKPNRP-YDZHTSKRSA-N 427.298 4.530 50 10 IJGE CCc1ccc(OCC(=O)N/N=C/c2ccc(OC)c3ccccc23)c(Br)c1 13977537 GNLFURPKDWDADJ-ZMOGYAJESA-N 441.325 4.702 50 10 IJGE CCOC(=O)/C(C#N)=C1/C(=O)N2c3c1cc(CC)cc3[C@@](C)(c1ccccc1)CC2(C)C 17095920 PVJCWBMUANSRIN-JEJBUKPGSA-N 428.532 4.924 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\Nc1cccc2c(O)cccc12 217240277 CKKWURJIWLPYTE-MSUUIHNZSA-N 429.476 4.960 50 10 IJGE Cc1cccc([C@H](Br)c2ccc3c(c2)OCCO3)c1I 236010483 GPQMAXUZCRZAQO-OAHLLOKOSA-N 445.094 4.855 50 10 IJGE O=C(NN=Cc1ccc(Sc2nc3ccc([N+](=O)[O-])cc3s2)o1)c1ccc(F)cc1 252630060 UTOXGZQWUOMUIS-UHFFFAOYSA-N 442.453 4.852 50 10 IJGE Cc1cc(C)cc(-n2c(C)cc(C=NNC(=O)COc3cccc4cccnc34)c2C)c1 254816570 IWMJFDFRVMQHEX-UHFFFAOYSA-N 426.520 4.788 50 10 IJGE aggregator O=C(N[C@@H]1c2ccccc2C[C@H]1Cl)c1cc(Br)sc1Br 379725109 KRGDFAIUKUNJMY-ZYHUDNBSSA-N 435.568 4.908 50 10 IJGE CO[C@@]1(CC(CBr)(CBr)c2cccc(Cl)c2)CCOC1 692461447 GLFJDKWMUKGUOW-OAHLLOKOSA-N 426.576 4.563 50 10 IJGE ClCc1ccc(N2CC[C@@]3(CN(Cc4ccccc4)CCO3)C2)cc1Br 717590455 DXQKASYXJLIPQW-OAQYLSRUSA-N 435.793 4.669 50 10 IJGE COc1ccc(F)c(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)c1 755603379 PXCHUJQPWWKBFM-WJDWOHSUSA-N 449.873 4.811 50 10 IJGE Cc1cc(S(=O)(=O)Nc2ccc(S(F)(F)(F)(F)F)cc2)ccc1OCC(=O)O 766569933 IBIWDQBLFAFLOQ-UHFFFAOYSA-N 447.403 4.917 50 10 IJGE Cc1cccc(NNC(=O)[C@@H](C)SCc2nc(O)c3c(C)c(C)sc3n2)c1Cl 1158108275 KWXVADSHQGTXLF-GFCCVEGCSA-N 436.990 4.741 50 10 IJGE CC(C)(C)Cc1nc(-c2cccc(C(=O)NNc3nc4ccccc4[nH]c3=S)c2)no1 1301148683 VCJQPDUHLPTUHR-UHFFFAOYSA-N 434.525 4.688 50 10 IJGE C=CCCC1(CNC(=O)NNC(=O)Nc2ccc(Br)cc2Cl)CCCC1 1470790242 GXWXGWKWISCOBV-UHFFFAOYSA-N 443.773 4.965 50 10 IJGE CC(=O)N(C)c1ccc(CNC(=O)/C(C#N)=C/c2cc(C)n(C3CCCCC3)c2C)cc1 1539472093 LFXAQBLSIDLDAB-HZHRSRAPSA-N 432.568 4.816 50 10 IJGE O=C(NNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(C(F)(F)F)cnc1O 1637502722 RAUPGOVAJWFGNE-UHFFFAOYSA-N 433.230 4.601 50 10 IJGE Cc1c(C(=O)N2CCCC[C@@H]2C)oc2c1C(=NNC(=O)c1ccccc1Cl)CCC2 1772744200 SCZAAMASHUQROM-AWEZNQCLSA-N 427.932 4.726 50 10 IJGE Cc1ccc(C(=O)NN=C2CCCc3oc(C(=O)NCc4ccccc4Cl)c(C)c32)cc1 1772744467 DUYWADHHLNUZKK-UHFFFAOYSA-N 449.938 4.950 50 10 IJGE COc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccccc2Cl)c1 1865712433 YDOYGYVPZWHOHW-MRXNPFEDSA-N 446.816 4.771 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)C1 1880762272 UNFPNLMCTYVUDK-RBSFLKMASA-N 435.403 4.606 50 10 IJGE C[C@@H](CCl)N(Cc1ccccc1)C(=O)c1cccc(F)c1I 1914225897 BQXITGGGZIYSNM-LBPRGKRZSA-N 431.676 4.700 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1snc(Cl)c1Cl 1979676540 CAVLAZIVMMBZSG-LLVKDONJSA-N 438.174 4.502 50 10 IJGE CC[C@H](Br)CN(CC)C(=O)c1scc(Br)c1Br 1999378904 ZULLGANZCJDNER-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE ClC1CCC(CNc2ncc(I)cc2Br)CC1 2015757493 UPXJWAKSCUKVEM-UHFFFAOYSA-N 429.527 4.658 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)CCc1ccc(OC(F)(F)F)cc1 2025440431 JEZXUOLZFOSKEQ-CYBMUJFWSA-N 442.231 4.578 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CCC[C@@H](Br)CC1 2033085694 FZYFRHQGXGIALA-SECBINFHSA-N 439.973 4.601 50 10 IJGE CCN(CCCCBr)C(=O)c1cc(Br)ccc1Br 2041183134 BUUWHSAMUGDUHB-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CCS[C@H](CCBr)C1 2052452686 AWHCTFQPZZXDLA-SSDOTTSWSA-N 433.618 4.507 50 10 IJGE Cc1c(F)cc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)CC1CC1 2059314528 MJOPIDIYEOPDTC-UHFFFAOYSA-N 426.351 4.630 50 10 IJGE FC(F)Oc1cc(I)cc(OC(F)(F)F)c1CBr 2060221005 JKMWBTBJBLYGET-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE Fc1nc(-n2nc(CBr)c(Cl)c2C(F)(F)F)ccc1C(F)(F)F 2078913502 DFRIHAKNXBDBRU-UHFFFAOYSA-N 426.517 4.992 50 10 IJGE COc1ccc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)[C@H](C)C(C)C 2123270856 ORLNXALLKNBUBC-MRXNPFEDSA-N 440.403 4.826 50 10 IJGE COC1(C(F)(F)F)CC(C(=O)N(Cc2ccccc2)[C@H](CBr)C2CC2)C1 2125552814 BFZDENBCTCHFBJ-UPTPFMHGSA-N 434.296 4.546 50 10 IJGE CN(c1ncc(Br)c(CCl)n1)[C@@H]1C[C@@H]2C[C@H](OCc3ccccc3)C[C@H]21 2134002234 WAOQWTYQAWOLND-YIOZNXECSA-N 436.781 4.798 50 10 IJGE Brc1cccc([C@H](CI)OC[C@@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)c1 2134537844 FKOJSISRKQDBLI-OVCQRUGDSA-N 433.127 4.844 50 10 IJGE Cc1cc(Br)c(CCl)c(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@@H]32)c1 2173452554 GEIAQGCFVVYLRB-FCHUYYIVSA-N 449.820 4.976 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@@H](CNC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2185528924 KZGVIDFMNDROTN-AQNXPRMDSA-N 439.438 4.894 50 10 IJGE Cc1cc(S(=O)(=O)N2CCCC[C@@H]2CCCBr)sc1Br 2206667424 MAYXUPSYWNMLKE-LLVKDONJSA-N 445.242 4.537 50 10 IJGE CN(Cc1cc(Cl)ccc1I)[C@H](CBr)CC1CC1 2219036539 FJSGRDJUEMXCST-ZDUSSCGKSA-N 442.566 4.940 50 10 IJGE C[C@@H](COC(F)F)O[C@@H](CI)c1ccc(Br)cc1 2253920175 SZBRHLDTLTXVPS-KWQFWETISA-N 435.046 4.570 50 10 IJGE O=C(NC[C@@H]1CCCC[C@H](Cl)C1)c1ccc(Cl)c(I)c1 2283661106 FEGLJQAYWHCRJK-PWSUYJOCSA-N 426.125 4.862 50 10 IJGE O=C(N[C@@H](CBr)c1cscn1)c1cc(Br)c(F)cc1Cl 2285837210 LVBYWVPAJSNYFS-JTQLQIEISA-N 442.535 4.564 50 10 IJGE CC(C)[C@H](CBr)N(C)Cc1ccc(Cl)c(I)c1 2302493176 SKLZXYMBXOTIFN-ZDUSSCGKSA-N 430.555 4.796 50 10 IJGE ClCCC1CC(NCc2ccc(I)c(Br)c2)C1 2306221259 FZTVBACAPLIOMH-UHFFFAOYSA-N 428.539 4.551 50 10 IJGE CC(C)c1ccc(C=NNC(=O)c2ccc(Nc3nc(O)c4ccccc4n3)cc2)cc1 2323766793 YPYDQQNXJINMRU-UHFFFAOYSA-N 425.492 4.966 50 10 IJGE N#CC(=CNCCc1ccc(Br)cc1)C(=O)Nc1ccccc1C(F)(F)F 2324305546 DYSMSCIMOFHTDX-UHFFFAOYSA-N 438.247 4.646 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@H]2CC[C@H](Cl)[C@@H]1C2 2330966547 JSEROLMUHDWJFO-JEZHCXPESA-N 427.589 4.895 50 10 IJGE COc1cc(Cl)c(CCl)c(-n2ccnc2CCCN2C(=O)c3ccccc3C2=O)c1 2365776731 QDMRASGGLOWYEQ-UHFFFAOYSA-N 444.318 4.502 50 10 IJGE O=C(CSc1nc2ccccc2n1Cc1ccc(Cl)cc1)NN=Cc1ccccc1 19833164 SHHVCJPIWKSIEM-UHFFFAOYSA-N 434.952 4.980 50 10 IJGE Cc1ccc(C)c([C@@H](C)NC(=O)/C(C#N)=C/c2cc3c(cc2Br)OCO3)c1 20356967 IZHZCYWYKVMDHM-OUAKBRRNSA-N 427.298 4.579 50 10 IJGE COc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(Cl)c2)c1 38651128 KEHSHQBQBYHOMP-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE Cc1ccc(CNC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(C)cc2)CCC3)cc1 40804439 BZTGSYZEEXLVNA-SGWCAAJKSA-N 429.520 4.605 50 10 IJGE O=C(/C=C\c1ccccc1)NNc1nc2sc3c(c2c(=O)n1C1CCCCC1)CCCC3 97372055 BKXHYPAEUDFVOX-NXVVXOECSA-N 448.592 4.999 50 10 IJGE CCCCOCCO[C@@H](CI)c1cccc(Br)c1 162121614 DPUDRLAQQFNMMM-AWEZNQCLSA-N 427.120 4.759 50 10 IJGE CCCCOCCO[C@H](CI)c1cccc(Br)c1 162121740 DPUDRLAQQFNMMM-CQSZACIVSA-N 427.120 4.759 50 10 IJGE CCOc1cc(/C=C(/C#N)c2nc3cc(C)c(C)cc3[nH]2)ccc1OCC(=O)N(CC)CC 169940338 SHNHHAXRDNUXHV-MOSHPQCFSA-N 446.551 4.890 50 10 IJGE CCOC(=O)c1cccc(-c2ccc(B3OC(C)(C)C(C)(C)O3)c(CBr)c2)c1 223828601 JRUPOUNROQEZIE-UHFFFAOYSA-N 445.162 4.724 50 10 IJGE CCCCOc1ccc(C=NNC(=O)c2ccc(OC(F)(F)C(F)F)cc2)cc1OC 254418991 FEQJZFKTIRVLRG-UHFFFAOYSA-N 442.409 4.875 50 10 IJGE CC[C@@H](Br)CCCNC(=O)c1cc(Br)ccc1Br 398533363 CLCXDHLUUAFBIY-SECBINFHSA-N 441.989 4.895 50 10 IJGE COC[C@@H](O[C@@H](CI)c1cccc(Br)c1)C(C)C 404151070 RZOQENBHICYNIC-UONOGXRCSA-N 427.120 4.613 50 10 IJGE CN(C[C@H]1CCCN(Cc2ccccc2)C1)c1nc2sccn2c1CBr 720017504 WQOYXWYCVSRREV-QGZVFWFLSA-N 433.419 4.639 50 10 IJGE CC(C)Oc1ccc(OC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cc1 735272365 ARPBVOOQGUPSCZ-HKWRFOASSA-N 426.476 4.764 50 10 IJGE CCOc1cc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc(OCC)c1OCC 799750196 YTVWYSJKZXGQBL-UHFFFAOYSA-N 437.418 4.530 50 10 IJGE CCOC(=O)c1cc(-c2ccc(C=NNC(=O)c3ccc(OCC)cc3)o2)ccc1Cl 1083892703 VDZSEOVWEMSBRR-UHFFFAOYSA-N 440.883 4.939 50 10 IJGE C=C(C)[C@@H](NC(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C)c1ccc(F)c(F)c1 1469854858 VRXZVZDIUKRHHW-JOCHJYFZSA-N 438.478 4.634 50 10 IJGE C=CC[C@H](C(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1)c1ccccc1 1558893042 VKPKAWGMDGMBLO-IBGZPJMESA-N 430.533 4.516 50 10 IJGE C=C(C)C[C@@H](CO)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1636699389 KLIQMZKXBVLIFB-LTXFRBGYSA-N 432.351 4.751 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1ccc(Br)cc1C(F)(F)F 1641877178 FWNVWKREIGWDGW-UHFFFAOYSA-N 443.248 4.831 50 10 IJGE CCOc1c(Br)cc(C=NNC(=O)COc2ccccc2C(C)C)cc1OC 1772754438 VVKDXUHFWBRWLG-UHFFFAOYSA-N 449.345 4.509 50 10 IJGE CCOc1ccc(Br)cc1C=NNC(=O)CSc1ccc(Cl)cc1 1772756290 RXDBOQASMAEQDS-UHFFFAOYSA-N 427.751 4.744 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@H]1c1cccc(O)c1 1865681228 IEEBFNLTXKRDOL-INIZCTEOSA-N 446.816 4.527 50 10 IJGE C[C@@H]([C@@H]1CCCCN1C(=O)OC(C)(C)C)[C@H](CBr)NC(=O)OC(C)(C)C 1880761086 LBXSWXKIDYTCGI-ILXRZTDVSA-N 435.403 4.700 50 10 IJGE CCC[C@@H](CCNC(=O)OC(C)(C)C)CCC(=O)N(C)C[C@H]1C[C@H](Br)C1 1887824407 ZGKIKPHXZLHQJE-BRWVUGGUSA-N 433.431 4.730 50 10 IJGE Clc1cc(I)c([C@H](Br)[C@@H]2[C@H]3CCOC[C@H]32)s1 1900919363 MNEKBUOHAYFTHB-NAXOPYRSSA-N 433.536 4.725 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H](C)N(c2nc3ccccn3c2CBr)C1 1921468414 DTCYWSHOYFNYFY-ROUUACIJSA-N 427.390 4.576 50 10 IJGE Cc1sc([C@@H](Br)c2cn(C)nc2Br)cc1Br 1981649146 YWFJTUQBPZVQNK-VIFPVBQESA-N 428.975 4.799 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CC[C@](C)(CI)O2)[C@H]2CCCC[C@H]21 1984441678 MTIUHMJLFWCYBJ-MJSCVDMRSA-N 435.346 4.539 50 10 IJGE Brc1ccc(Br)c(CN2CCC[C@@H](Br)CC2)c1 2006508085 OKPRHZCFIJKKIK-LLVKDONJSA-N 425.990 4.961 50 10 IJGE O=S(=O)(c1ccc(CCBr)s1)N(Cc1ccccc1)C1CCCC1 2009640840 XXKIHCAMHAQSLR-UHFFFAOYSA-N 428.417 4.819 50 10 IJGE O=S(=O)(c1cc(F)c(Cl)c(CBr)c1)N(Cc1ccccc1)C1CC1 2009658719 STJPKYUDEVZICQ-UHFFFAOYSA-N 432.742 4.727 50 10 IJGE CC(C)C[C@H](CBr)NC(=O)c1cccc(Br)c1Br 2031487452 UVNXBQUXPHCEPD-SECBINFHSA-N 441.989 4.751 50 10 IJGE BrCc1c(N2CC[C@H]3CCN(Cc4ccccc4)C[C@@H]3C2)nc2sccn12 2148938547 JBCOFJOGHILEAI-QZTJIDSGSA-N 445.430 4.639 50 10 IJGE CS(=O)(=O)c1sccc1[C@@H](Br)c1cc(F)c(Br)cc1F 2150545398 MSXJTJRCZZPJCD-LLVKDONJSA-N 446.132 4.677 50 10 IJGE CCn1ncc(Br)c1[C@H](Cl)c1cc(Br)c(F)cc1OC 2150667939 IZBOYOJJFVRIPD-GFCCVEGCSA-N 426.511 4.904 50 10 IJGE CN(C(=O)c1cc(Cl)ccc1I)[C@@H]1CCCCC[C@@H]1Cl 2172546796 IXIABOXLUUPNIA-GXTWGEPZSA-N 426.125 4.957 50 10 IJGE COc1c(Cl)cc(Br)cc1[C@H](Br)[C@@]12COC[C@H]1C2(F)F 2202999820 RPAAAVVQTOAOLF-ADEWGFFLSA-N 432.486 4.829 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1Cc2ccccc2N(CCCCCI)C1 2214705329 QHVBTPPRJDDOTH-INIZCTEOSA-N 444.357 4.548 50 10 IJGE Clc1cc(CN2C[C@H](Br)CCC23CC3)ccc1I 2220275853 ZIFROCKPEDXFBF-LLVKDONJSA-N 440.550 4.837 50 10 IJGE ClCCc1nc2cc(Cl)ccc2n1C[C@H]1CC1(Br)Br 2224807546 SZDNVICGAORWRF-MRVPVSSYSA-N 426.967 4.977 50 10 IJGE FC(F)(F)c1ccc(CO[C@H](CCl)[C@H](I)CCl)cc1 2231129897 QRPHEWJYYGFUMF-GHMZBOCLSA-N 427.031 4.872 50 10 IJGE CN(C[C@@H]1C[C@H]1Br)C(=O)CCCCCCCCCNC(=O)OC(C)(C)C 2269414614 GGLMPIVHSDTTFG-DLBZAZTESA-N 433.431 4.874 50 10 IJGE C[C@@H](Br)CN(C(C)(C)C)S(=O)(=O)c1ccc(Br)cc1Cl 2288075087 QPETXHWEPPADAT-SECBINFHSA-N 447.620 4.675 50 10 IJGE Clc1ccc(CN2CC(CCCBr)C2)cc1I 2300239335 WWFWMKWCAUPOAQ-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE Clc1ccc(CN2CCCC[C@@H](Br)C2)c(I)c1 2302306525 FCSICHTYZFOBLW-LLVKDONJSA-N 428.539 4.694 50 10 IJGE C[C@H]1CO[C@](CBr)(Cc2ccc(Cl)cc2I)C1 2302315069 FLORSBXKPHIRFN-RNCFNFMXSA-N 429.523 4.677 50 10 IJGE CC(C)[C@@H](CBr)N(C)Cc1ccc(I)c(Cl)c1 2302484924 KHMGBLVVDMLTRY-CYBMUJFWSA-N 430.555 4.796 50 10 IJGE CC(C)Oc1ccc(Br)cc1C=C(C#N)C(=O)Nc1cccc([N+](=O)[O-])c1 2313676922 ZFVPUZAXUFBHNH-UHFFFAOYSA-N 430.258 4.690 50 10 IJGE C[C@H](c1ccncc1)[C@H](Br)c1c(Br)c(Br)nn1C 2316837511 IFNMLWUHUZHLKY-APPZFPTMSA-N 437.961 4.580 50 10 IJGE CC1(C)COC[C@]1(CBr)Cc1ccc(Cl)cc1I 2318528656 IAPLGZYRGKDGEB-CQSZACIVSA-N 443.550 4.925 50 10 IJGE N#CC(=Cc1cccc(OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1)c1ccccc1F 2320511489 YIHFXJMNFQAXRP-UHFFFAOYSA-N 433.351 4.925 50 10 IJGE N#CC(=CN1CCN(c2cccc(Cl)c2)CC1)C(=O)Nc1cc(Cl)ccc1Cl 2324388956 RBGVRKBOMCWJQH-UHFFFAOYSA-N 435.742 4.815 50 10 IJGE O=C(/C=C\c1ccccc1)Oc1ccc(Br)cc1/C=N\NC(=O)c1ccccc1 35385059 JESIQQYLOFLDPK-UPBBSLKTSA-N 449.304 4.832 50 10 IJGE O=C(NCC1(CCBr)CC1)c1cc(Br)ccc1Br 97907934 YLQDGHDTNYUEEF-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE Cn1c(=O)oc2cc([C@H](Cl)c3cc(Br)ccc3Br)ccc21 161096874 ZZLRHOFRWYUQLR-AWEZNQCLSA-N 431.511 4.985 50 10 IJGE CC(C)N(Cc1ccccc1)C(=O)/C(C#N)=C\Nc1ccc(I)cc1 217187073 OZQJWPSMERIKQE-LGMDPLHJSA-N 445.304 4.548 50 10 IJGE CCCO[C@@H]1[C@H](Cl)C[C@H]1Oc1cc(Br)c(OC)cc1Br 300470745 JZYBJJGWXSOCJC-LERXQTSPSA-N 428.548 4.774 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@@H](CBr)CC(F)(F)F)cc1Cl 717775444 GFIDBNHWCUIGJI-SSDOTTSWSA-N 437.481 4.857 50 10 IJGE ClCCc1nc2cccc(Br)c2n1Cc1cnc(Br)s1 718881489 GJOSCPMBDPHJIH-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE Fc1cccc([C@@H](Br)c2ccc3c(c2)COC3)c1I 721685692 WUMMKRLGGFGUMH-AWEZNQCLSA-N 433.058 4.945 50 10 IJGE COc1cccc([C@@H](NC(=O)NNC(=O)c2ccc(Cl)cc2)c2ccccc2Cl)c1 745849982 UPUQCTUEVDYHPJ-HXUWFJFHSA-N 444.318 4.736 50 10 IJGE C#C[C@@H](NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)c1ccc(Cl)cc1 794049739 DBNWIYCUWJMNOZ-QFXGEWDLSA-N 439.906 4.515 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNc2ncnc(Cl)c2C(C)C)s1 1557027749 XVOYSLZFQGJVIA-UHFFFAOYSA-N 432.402 4.549 50 10 IJGE Cc1c(C(=O)Nc2ccc(Cl)cc2)oc2c1C(=NNC(=O)c1ccc(O)cc1)CCC2 1772745437 ZMZPIADBBBWVSR-UHFFFAOYSA-N 437.883 4.670 50 10 IJGE COc1cc(C=NNC(=O)COc2ccc(C)c(C)c2)ccc1OCc1ccccc1C 1772753806 JWAZGNUIKOUKBO-UHFFFAOYSA-N 432.520 4.729 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2F)[C@@H]1c1ccc(O)cc1 1865684688 VVHNFWDNSRCHBI-JOCHJYFZSA-N 438.462 4.661 50 10 IJGE C=CCC(CBr)(CBr)Cc1nn(C)c(Cl)c1Br 1947495460 DIXMSKNJEBPRFQ-UHFFFAOYSA-N 449.412 4.731 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1C(=O)c1csc(Br)c1Br 2018118001 WCMQEPFWOCKSAM-HTRCEHHLSA-N 446.002 4.661 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Cl)cc(C(=O)NC[C@H]2C[C@H]2Br)cc1Cl 2020184020 LGLRLYYYVJOHDB-NXEZZACHSA-N 438.149 4.854 50 10 IJGE CC[C@@H](C)CCCN=c1[nH]nc(SCC(=O)C(C#N)=C2Nc3ccccc3S2)s1 2042440522 HEPOJPZNRFRSRN-CYBMUJFWSA-N 445.639 4.812 50 10 IJGE Cc1ccc(Cn2nc(CCl)c(I)c2C(F)(F)F)c(C)c1 2079212250 NJNWBMYLQAXYBR-UHFFFAOYSA-N 428.623 4.910 50 10 IJGE ClCCc1nc2c(Br)cccc2n1[C@@]12C[C@@H]1CN(Cc1ccccc1)C2 2099679097 NWLYRYGHJIWQFA-IIBYNOLFSA-N 430.777 4.811 50 10 IJGE CCC(CC)(CBr)CN1C[C@H]2[C@H]3CC[C@@H]([C@H]2C1)N(C(=O)OC(C)(C)C)C3 2106787554 ZUDZFKBLUNFTIZ-XSLAGTTESA-N 429.443 4.765 50 10 IJGE CC(C)[C@H](CBr)CN=[S@@](=O)(CCNC(=O)OC(C)(C)C)c1ccccc1 2107396601 RHABLKFOSOKYFP-AKJBCIBTSA-N 447.439 4.705 50 10 IJGE CC(C)[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@H](C)C[C@@H]1C(F)(F)F 2121769733 AFZRZXVZHBTBTN-RBSFLKMASA-N 445.364 4.916 50 10 IJGE Cc1cc(Br)c(C(=O)N2CCC(F)(CBr)CC2)cc1Cl 2157510001 MTIHXMQCPMPYOH-UHFFFAOYSA-N 427.539 4.750 50 10 IJGE CO[C@H]1CN(CC2(CBr)CCCCCC2)[C@@](C)(CNC(=O)OC(C)(C)C)C1 2163061334 GFMFJRNWCRRKAJ-YLJYHZDGSA-N 447.458 4.726 50 10 IJGE O=C(c1cc(Br)ccc1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Cl)C2 2190669254 BAIIZHUGXWZPJB-ZBPZKIAKSA-N 425.523 4.534 50 10 IJGE C[C@H](Cl)c1nc2cc(Cl)cnc2n1C[C@H]1CC1(Br)Br 2224805405 MZXRHZAWRKTRTA-NKWVEPMBSA-N 427.955 4.891 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@@H](Br)[C@@H]1CCOC1 2250737369 CDYTVLNSMDGXAJ-ANLVUFKYSA-N 434.900 4.962 50 10 IJGE COc1ccc([C@H](Br)[C@H]2C[C@@H]2C(F)(F)F)cc1I 2257353553 HUJMBIBYOABKKU-LAEOZQHASA-N 435.021 4.934 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)[C@H]1CC[C@H](C(F)(F)F)CC1 2265003603 NAMVFCJOLSLCMO-BRWVUGGUSA-N 436.312 4.794 50 10 IJGE CC(C)N(C[C@H]1CCCCN1C(=O)OC(C)(C)C)CC1(CBr)CC(F)C1 2265632871 QGYVGJOZSMSLAJ-OHTSDLOESA-N 435.422 5.000 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1cccc(Cl)c1Br 2267941909 XECFAOPXKJBYED-SECBINFHSA-N 429.605 4.739 50 10 IJGE BrC[C@@]12CC[C@@H](C1)N(Cc1cccc(Br)c1Br)C2 2314912165 ZGDJXRODRAWNME-SMDDNHRTSA-N 438.001 4.961 50 10 IJGE CC(C)[C@@H]1[C@@H](Br)CCN1Cc1ccc(Cl)cc1I 2318521905 MYDKHWYIZNTZPO-GXTWGEPZSA-N 442.566 4.938 50 10 IJGE Clc1ccc(CN2C[C@@H]3CC[C@@H](Br)[C@H]3C2)c(I)c1 2318529452 QJFAYBZCIZGCDR-TVYUQYBPSA-N 440.550 4.550 50 10 IJGE COc1ccc(-c2ccc(C(=O)NNC(=O)C=Cc3ccc(C(C)C)cc3)c(C)n2)cc1 2321075965 APSVUZMYZDSKKJ-UHFFFAOYSA-N 429.520 4.663 50 10 IJGE O=C(NN=Cc1cccc(Cl)c1Cl)c1cccn(Cc2ccccc2Cl)c1=O 2323653254 XPDXQVJWOOQWIF-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE CCOc1c(OC)cc(C=NNC(=O)Cc2cc(Cl)ccc2SCC)cc1OC 2323678050 HMZVDJMDBXREDP-UHFFFAOYSA-N 436.961 4.561 50 10 IJGE CC1(C)[C@H](CBr)CCN1Cc1cc(I)ccc1Cl 2327393258 TUDNHPYGTIOIFH-NSHDSACASA-N 442.566 4.940 50 10 IJGE COc1cc(C=C(C#N)c2nc3ccccc3[nH]2)ccc1OC(=O)c1cccc([N+](=O)[O-])c1 2331020520 SXGTVPVMOLCMAZ-UHFFFAOYSA-N 440.415 4.763 50 10 IJGE COCCOc1ccc(C=C(C#N)C(=O)Nc2ccc(C(=O)OC3CCCCC3)cc2)cc1 2331123121 GKRDHAUEYJSWFC-UHFFFAOYSA-N 448.519 4.747 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](Br)[C@H](OCc2cccc(CC(F)(F)F)c2)C1 2353123181 FKYFKNFUFINMNN-HUUCEWRRSA-N 438.284 4.691 50 10 IJGE CCOc1cccc(N2C[C@@H]3CN(Cc4ccccc4)CC[C@H]3C2)c1CBr 2367565083 IWXUEVJRWPNPPZ-PMACEKPBSA-N 429.402 4.939 50 10 IJGE FC(F)(F)c1ccc(CBr)c(N2C[C@@H]3[C@H](CCN3Cc3ccccc3)C2)n1 2369845487 UOTRNALTACWOHL-IAGOWNOFSA-N 440.307 4.706 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CN(C[C@](C)(CBr)C(C)(C)C)CCO2)C1 2380167075 DFDPTOPLZRJNEW-LEWJYISDSA-N 447.458 4.536 50 10 IJGE CCc1ccc(OCC(=O)N/N=C/c2c(OC)ccc3ccccc23)c(Br)c1 13977545 BTNVPVHKWWKUTI-ZMOGYAJESA-N 441.325 4.702 50 10 IJGE COc1ccc([C@H](C)[C@@H](Br)C(=O)N2C(=O)OC[C@@H]2c2ccccc2)c(C)c1 15777686 YPXLYMRZNMNZGG-GDIGMMSISA-N 432.314 4.591 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)Nc2c(C)cccc2C)cc(Br)c1OC(C)=O 33344059 SUYBEMJHABEBQP-PXNMLYILSA-N 443.297 4.546 50 10 IJGE CCOc1ccc(Br)cc1/C=N/NC(=O)COc1ccc2ccccc2c1 40888842 WTEFKLPRNSUAKL-YDZHTSKRSA-N 427.298 4.530 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccccc2C(C)C)ccc1OCc1ccccc1 40911084 UDPDOGZKDGKHOL-JVWAILMASA-N 432.520 4.927 50 10 IJGE O=C(N/N=C\c1cccc(Cl)c1Cl)c1cccn(Cc2ccc(Cl)cc2)c1=O 169920370 DLKDULNFIJAIIH-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE CC(C)[C@@H](CCBr)NC(=O)c1cc(Br)cc(Br)c1 231122734 BJAQTFIHTTWJNG-GFCCVEGCSA-N 441.989 4.751 50 10 IJGE COc1cc(NC(=O)CCCCBr)c(Br)cc1Br 234869835 TUDQMUYJRODTAZ-UHFFFAOYSA-N 443.961 4.724 50 10 IJGE C[C@H](Br)C[C@@H](C)NC(=O)c1ccc(Br)cc1Br 235400688 CESYWNXRLJFPML-JGVFFNPUSA-N 427.962 4.503 50 10 IJGE Cc1ccc2ccccc2c1[C@@H](Br)c1cnn(C)c1I 379220954 SUZVQIFQLYRUBS-HNNXBMFYSA-N 441.110 4.971 50 10 IJGE Cc1ccccc1[C@@H]1CN(C(=O)OCc2ccccc2)C[C@@H]1CI 382684319 GLXQMGUOMQAZFQ-PKOBYXMFSA-N 435.305 4.782 50 10 IJGE CC(C)(C)[C@H](CBr)NC(=O)c1cc(Br)sc1Br 393947825 GTEJKIPVOJNNLT-ZETCQYMHSA-N 448.018 4.813 50 10 IJGE Cc1cc([C@@H](Br)c2c(Br)cnn2C)sc1Br 693045791 BLQZIEXZTFHTRN-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE CC[C@H](C[C@@H](C)Br)NC(=O)c1cc(Br)cc(Br)c1 716939957 PTUGREDXRGOOHQ-PRHODGIISA-N 441.989 4.894 50 10 IJGE CN(Cc1ccccc1)CC1CCN(c2cc(CBr)sc2[N+](=O)[O-])CC1 717590712 ZERKLCSJVZTFFD-UHFFFAOYSA-N 438.391 4.900 50 10 IJGE O=C(NNc1cccc(F)c1F)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1 743720882 DHDAWEHLGJZNDB-NTKDMRAZSA-N 435.474 4.588 50 10 IJGE O=C(NNc1ccc(F)cc1Br)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 748074968 QQQVZUBXJYFWHQ-VXGBXAGGSA-N 433.199 4.734 50 10 IJGE Cc1ccc(F)c(NNC(=O)C(=O)Nc2ccc(-c3ccc(Cl)cc3Cl)nc2)c1 789592743 GUUQJNBZPAUXME-UHFFFAOYSA-N 433.270 4.585 50 10 IJGE CC(=C/c1cccc(C(F)(F)F)c1)/C=C(/C#N)C(=O)Nc1ccc(C(=O)N(C)C)cc1 806571392 UROAHFUVQAFCMI-BRRADNGLSA-N 427.426 4.899 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)NCc2nccc(C(F)F)n2)c(C)n1-c1cccc(Cl)c1 809291521 AUIMSDPGISHYIW-CXUHLZMHSA-N 441.869 4.699 50 10 IJGE C=CCOc1ccc(Br)cc1C=NNC(=O)c1cccc(Br)c1 1084212865 JUJAOUAXFRXVFL-UHFFFAOYSA-N 438.119 4.540 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2cn(Cc3ccc([N+](=O)[O-])cc3)c3ccccc23)cc1 1084562637 WMGVHQOGPHZLIM-UHFFFAOYSA-N 442.475 4.760 50 10 IJGE CCc1cc(Br)ccc1NNC(=O)c1cccc2nc(O)n(CC(C)(C)C)c12 1632659809 LNTBVJPCSUOWRX-UHFFFAOYSA-N 445.361 4.870 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)c1C 1648570729 ZEMXSBLGZRNYTD-DOTOQJQBSA-N 425.895 4.585 50 10 IJGE Cc1c(C(=O)Nc2ccc(F)cc2F)oc2c1C(=NNC(=O)c1ccc(F)cc1)CCC2 1772744333 CFCRDPNYQJZCOF-UHFFFAOYSA-N 441.409 4.728 50 10 IJGE COc1ccc(-c2nn(Cc3ccc(C)cc3)c3c2[C@H](c2ccco2)C(C#N)=C(N)O3)cc1 1865698159 LTOTYYVDBQVXDL-QFIPXVFZSA-N 438.487 4.727 50 10 IJGE Cc1ccc(C)c(Cn2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(Br)cc2)c1 1865714328 HJKYRAWBSPURTK-NRFANRHFSA-N 449.352 4.837 50 10 IJGE CCC[C@@H](NC(=O)CCC(=O)c1ccc(C)cc1C)C(=O)Nc1ccc(SC#N)cc1 1867091420 MWTWHLKVFDGJNV-OAQYLSRUSA-N 437.565 4.763 50 10 IJGE CC(C)N1C(=O)c2ccc(/C(O)=C(\C#N)c3nc(-c4ccc(F)cc4)cs3)cc2C1=O 1872752096 NFQSKMHNYXGIOI-ZZEZOPTASA-N 433.464 4.903 50 10 IJGE O=C(N[C@H](C[C@H]1C[C@H](Br)C1)C(=O)O)OCC1c2ccccc2-c2ccccc21 1877472986 OECLZONWYNIENY-ARGWCVDVSA-N 444.325 4.542 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C1(C)C 1882086270 AARLRZZRWDBISQ-KBXIAJHMSA-N 447.414 4.556 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1nscc1Br 1915092043 FGGSPXQITAKTRX-LLVKDONJSA-N 432.181 4.722 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1cc(F)c(F)c(O)c1F 1915329546 RIXXLSGNYPRVQA-HNNXBMFYSA-N 430.264 4.871 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@H](CCBr)C(F)(F)F)cc1Cl 1918561828 WYJNIOUWUJFSQT-SNVBAGLBSA-N 437.481 4.857 50 10 IJGE C[C@H]1C[C@@H](Br)CN(Cc2c(Br)cccc2Br)C1 1945323940 UWFCMHQKWQWSOT-VHSXEESVSA-N 425.990 4.817 50 10 IJGE CN(CC(C)(C)CBr)C(=O)c1cc(Br)sc1Br 1945727630 AOKAOUZRFJMOLS-UHFFFAOYSA-N 448.018 4.766 50 10 IJGE BrCc1ccc(OCCOCCOCc2ccccc2)c(Br)c1 1983394738 FWUNPNOPSVSGGM-UHFFFAOYSA-N 444.163 4.956 50 10 IJGE Brc1cccc(CN2C[C@@H]3C[C@H](C[C@H]3Br)C2)c1Br 2045155015 UGMKOHFVPOAYHK-SUZMYJTESA-N 438.001 4.817 50 10 IJGE C[C@]12CN(Cc3c(Br)cccc3Br)C[C@@]1(CBr)C2 2046802407 NJHQISQWCOHTQZ-KBPBESRZSA-N 438.001 4.819 50 10 IJGE Brc1cnc(N2C[C@@H](Br)CCC23CCC3)c(Br)c1 2054164841 MEKWMHJQPMCPIU-VIFPVBQESA-N 438.989 4.893 50 10 IJGE C[C@H]1OCC[C@@H]1COc1c(Br)cc(CBr)cc1Br 2057463454 GDODAWVGMLHCGE-PSASIEDQSA-N 442.973 4.910 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC2(CC[C@@H]1CCl)CC2 2097878230 XHNZMOAXEISPRP-MRVPVSSYSA-N 427.589 4.897 50 10 IJGE Clc1ccccc1C(CBr)(CBr)COC[C@H]1CCCO1 2149039685 YCYYHNZAFRZKTI-GFCCVEGCSA-N 426.576 4.563 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@]2(CCCN(C[C@@H](CBr)c3ccccc3)C2)C1 2163324571 HPBZFSRDRXZHOG-DENIHFKCSA-N 437.422 4.888 50 10 IJGE O=C(c1ccc(CBr)cc1)N1[C@H]2CCC[C@H]1CN(Cc1ccccc1)CC2 2166614522 SSGKHADPCHIRGR-VXKWHMMOSA-N 427.386 4.851 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@@](C)(CBr)C(F)(F)F)cc1Br 2167388104 OMXRYSQUUQMFAC-NSHDSACASA-N 437.481 4.857 50 10 IJGE CN(Cc1cnn(C)c1Cl)c1cc(Br)cc(F)c1CBr 2170691452 JSTYEBNNLWWIOB-UHFFFAOYSA-N 425.527 4.506 50 10 IJGE COc1cccc(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1CBr 2203190742 WCWNSUPPBZDRMU-PMACEKPBSA-N 429.402 4.939 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@@H]2CCC[C@@H](Br)[C@H]2C1 2264506383 IHGWPSMTAGMHHY-XHNCKOQMSA-N 427.589 4.800 50 10 IJGE O=C(NC[C@@]1(CBr)CC12CCC2)c1scc(Br)c1Cl 2264516280 YIEQFIQNKYRMPK-ZDUSSCGKSA-N 427.589 4.849 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@H](Br)[C@@H]2CC[C@@H]21 2285962987 KJBUCHVNRRJHQB-XICLSFFLSA-N 425.523 4.630 50 10 IJGE Clc1ccc(I)cc1COC[C@@H](CBr)C1CC1 2307221980 ZWZPYAPKHGPOEL-LLVKDONJSA-N 429.523 4.882 50 10 IJGE CCO[C@H]1[C@@H](OCc2cc(Br)cc(Br)c2)C[C@H]1Br 2315453497 NBHVLZBTPOGWEY-FRRDWIJNSA-N 442.973 4.669 50 10 IJGE CC[C@@](C)(CCBr)NC(=O)c1ccc(Cl)cc1I 2317765662 HFDOCHSXRFMGTN-ZDUSSCGKSA-N 444.538 4.628 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NN=Cc2ccc(Br)cc2F)c(C)n1 2321251724 LWXAGPMOIHNLQO-UHFFFAOYSA-N 442.288 4.731 50 10 IJGE Cc1oc(OCc2ccc(I)c(Br)c2)nc1CCl 2325384675 YOLZEZXASVMUEW-UHFFFAOYSA-N 442.478 4.668 50 10 IJGE CC(C)C[C@@H](CBr)CN(CCCNC(=O)OC(C)(C)C)CC(F)(F)F 2328528038 NLZAHNWZICOIDG-AWEZNQCLSA-N 433.353 4.823 50 10 IJGE CC(C)C[C@H](CBr)CN1CC(F)(F)[C@@](C)(CNC(=O)OC(C)(C)C)C1 2328529964 ZIKFORBNHNCZBD-PBHICJAKSA-N 427.374 4.526 50 10 IJGE Cc1ccc(-c2csc(C(C#N)=C(O)c3ccc(NS(C)(=O)=O)cc3)n2)cc1C 2331382664 TYRXGSWYYINAAI-UHFFFAOYSA-N 425.535 4.748 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@]2(CBr)CC2(F)F)[C@@H](c2ccccc2)C1 2379985472 ILNNBAJAMQEZJV-VQIMIIECSA-N 445.348 4.701 50 10 IJGE CNC(=O)/C(C#N)=C/c1ccc(-c2ccc(C34CC5CC(CC(C5)C3)C4)cc2[N+](=O)[O-])o1 58832891 RVJHGAUXLYIKHJ-GIJQJNRQSA-N 431.492 4.976 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](Oc2ccc(CBr)c(Br)c2)C1 96304776 VTXVXXBPDQQFDM-ZDUSSCGKSA-N 435.156 4.732 50 10 IJGE BrCCC[C@H]1CCCN1c1ncc(Br)cc1Br 129137882 ZUAYIGQSLGCCGW-JTQLQIEISA-N 426.978 4.751 50 10 IJGE CCOc1c(Br)cc(/C=N\NC(=O)c2ccc(C)cc2)cc1Br 169885869 XPRLOKRIEFXFRV-JMIUGGIZSA-N 440.135 4.683 50 10 IJGE CCOc1cc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4Cl)nc3c2)ccc1O 169926730 YDDCYCKCWBFHLX-DHRITJCHSA-N 434.883 4.752 50 10 IJGE CCO[C@@H]1[C@H](Cl)C[C@H]1Oc1c(I)cc(Cl)c2cccnc12 252869823 SWSYEWXVAGUEPK-MPKXVKKWSA-N 438.092 4.656 50 10 IJGE O=C(COc1ccc2ccccc2c1)NN=Cc1ccc(OC(=O)/C=C\c2ccco2)cc1 254294490 OARMTRCPUDWCOS-PQDPSWMUSA-N 440.455 4.581 50 10 IJGE C[C@@H]1C[C@H](n2c(CCCl)nc3cc(Br)cnc32)CN1Cc1ccccc1 398003326 PBBFPDMTNQJBLM-PBHICJAKSA-N 433.781 4.811 50 10 IJGE Clc1ccccc1C(CBr)(CBr)CCO[C@@H]1CCOC1 724983980 FFXOBPARRZYLQT-GFCCVEGCSA-N 426.576 4.563 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)cc1 748148862 YHSHATXAMLSWHZ-UHFFFAOYSA-N 434.439 4.533 50 10 IJGE O=C(Nc1ccc(S(F)(F)(F)(F)F)cc1)C(=O)Nc1ccc(N2CCCC2)nc1 773745767 HWDPKHNDKLXDCO-UHFFFAOYSA-N 436.406 4.916 50 10 IJGE CN(C)NC(=O)Nc1cccc(NC(=O)/C=C(\c2ccc(Cl)cc2)C(F)(F)F)c1 788253185 GNWHPCYLGNTMTH-LFIBNONCSA-N 426.826 4.523 50 10 IJGE Cc1nn(Cc2ccccc2)c(C)c1C=NNC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 1084427213 SAYSAPAGRKWFSB-INIZCTEOSA-N 445.350 4.773 50 10 IJGE O=C(NN=C1C(=O)N(C/C=C\c2ccccc2)c2ccccc21)c1cc2ccccc2cc1O 1084657479 LQQOPYNRFCPSTG-LPKULDDQSA-N 447.494 4.740 50 10 IJGE C=CCCC[C@H](C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)c1ccccc1 1463556231 NVFGBXXWSGAMLL-UZLBHIALSA-N 445.357 4.504 50 10 IJGE CC(=O)c1cccc(OCCCC(=O)NNc2ccc(Cl)cc2Br)c1 1585722713 KBDZNHMRNRFAHW-UHFFFAOYSA-N 425.710 4.607 50 10 IJGE Cc1occc1C(=O)NN=C1CCCc2oc(C(=O)Nc3cccc(Cl)c3)c(C)c21 1772749491 NXLCUJHOUWGAJX-UHFFFAOYSA-N 425.872 4.866 50 10 IJGE COc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)cc1 1865707916 JJZCDYHHTLPXCY-JOCHJYFZSA-N 438.462 4.905 50 10 IJGE COC(=O)c1c(NC(=O)CCCOc2ccc(OC)cc2)sc(/C(C)=C/C#N)c1C 1873428654 SLMQGMUSTMCXJH-SDNWHVSQSA-N 428.510 4.576 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1ccc(OC(F)(F)F)cc1 1916353786 GUHNUYCHBOKTOI-INIZCTEOSA-N 446.263 4.638 50 10 IJGE O=C(c1csc(Br)c1Br)N1CCC[C@@H](CBr)C1 1945188971 FVMXHQOMGQDQFE-ZETCQYMHSA-N 446.002 4.520 50 10 IJGE O=S(=O)(c1cc(Cl)c(F)cc1F)N(CCCBr)Cc1ccccc1 2008312166 DSMXZNXXEYZQLS-UHFFFAOYSA-N 438.721 4.594 50 10 IJGE C[C@@H]1CN(C[C@@H](CBr)c2ccccc2)C[C@@H](C)N1C(=O)OCc1ccccc1 2044701308 VDAANXGEJYEOPT-WOIUINJBSA-N 445.401 4.897 50 10 IJGE FC1(F)C[C@@H](CBr)N(Cc2cc(Br)ccc2Br)C1 2054716393 CFINGOVJDYGXEO-JTQLQIEISA-N 447.943 4.816 50 10 IJGE CC(C)[C@H](Br)c1cn(-c2ccc(Br)cc2Br)nn1 2057428408 BBWVUVPFCZQRTP-LBPRGKRZSA-N 437.961 4.884 50 10 IJGE ClCc1nc2cc(I)ccc2n1CC1CC(Br)C1 2076264435 WDPRFYLUBOWVSF-UHFFFAOYSA-N 439.522 4.553 50 10 IJGE COc1cc(F)c(F)cc1[C@@H](Br)c1cc(I)sn1 2083949386 UHWWLBYIBNVRIS-LLVKDONJSA-N 446.054 4.519 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@@H]2CCC[C@@H](Cl)[C@H]2C1 2094583822 LTPNHPKYMFNLBR-UJNFCWOMSA-N 427.589 4.753 50 10 IJGE CCC(CC)(CBr)CN1C[C@@H]2[C@@H]3CC[C@@H](CN3C(=O)OC(C)(C)C)[C@H]2C1 2106787552 ZUDZFKBLUNFTIZ-MHORFTMASA-N 429.443 4.765 50 10 IJGE COC1(C(F)(F)F)CC(C(=O)N(Cc2ccccc2)[C@@H](CBr)C(C)C)C1 2125554684 XTYAOFRFOYKOHT-PQUAAJSLSA-N 436.312 4.792 50 10 IJGE CC[C@H]1CN(C(=O)OC(C)(C)C)[C@H](CC)CN1C(=O)c1ccc(CBr)cc1 2162914262 CZBRZGZYUOSAMZ-ZWKOTPCHSA-N 439.394 4.832 50 10 IJGE COC[C@H](C)OC[C@@H](Br)CCc1ccc(Cl)c(Br)c1F 2166830962 IUKAQIQEAONOFQ-ONGXEEELSA-N 432.555 4.989 50 10 IJGE Clc1ccc(CN2CCCC[C@H]2CBr)c(I)c1 2302315010 DQFMGXXRUIUMBD-LBPRGKRZSA-N 428.539 4.694 50 10 IJGE Cl[C@H]1CC[C@@H](CNCc2ccc(I)c(Br)c2)C1 2306231968 OPGRWUSKIQCFSP-KOLCDFICSA-N 428.539 4.551 50 10 IJGE ClC[C@@H]1CCC[C@H]1NCc1ccc(I)c(Br)c1 2306232379 TZGWIFYKOJRWBF-GXFFZTMASA-N 428.539 4.551 50 10 IJGE O=S1(=O)C[C@H]2[C@@H](C1)[C@@H]2[C@@H](Cl)c1cc(Br)ccc1OCc1ccccc1 2314439269 GKAQSVDDISJPDZ-ISARSNTHSA-N 441.774 4.599 50 10 IJGE N#CC(=Cc1cccc(OC(=O)CN2C(=O)c3ccccc3C2=O)c1)c1cccc(Cl)c1 2320507162 ZZJVGZZMLXBUMM-UHFFFAOYSA-N 442.858 4.606 50 10 IJGE C=CC[C@@H](Br)[C@@H]1CCN1Cc1cc(I)ccc1Cl 2327397192 MSVWNNXDIJAGPV-OCCSQVGLSA-N 440.550 4.859 50 10 IJGE CC(C)[C@H](C(O)=C(C#N)c1nc(-c2ccccc2)cs1)N1C(=O)c2ccccc2C1=O 2331300960 FCDUNTZIKTYHAZ-HXUWFJFHSA-N 429.501 4.924 50 10 IJGE COc1ccc(C)cc1-c1csc(C(C#N)=C(O)[C@@H](C)N2C(=O)c3ccccc3C2=O)n1 2331322929 JUSMKNSNHNSDKQ-CQSZACIVSA-N 445.500 4.605 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](Br)[C@@H](OCc2cccc(CC(F)(F)F)c2)C1 2353123180 FKYFKNFUFINMNN-GJZGRUSLSA-N 438.284 4.691 50 10 IJGE CCOc1cccc(N2C[C@H]3CN(Cc4ccccc4)C[C@]3(C)C2)c1CBr 2367569955 JLCNTCJCPBYHFR-AUSIDOKSSA-N 429.402 4.939 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2ccc(Br)cc2)sc(C)c1C 14151364 PRYCDEICGPBFBN-NTEUORMPSA-N 433.327 4.850 50 10 IJGE Cc1cc(Br)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 14643302 ZMQFBTSWUXSZMZ-HNNXBMFYSA-N 447.373 4.592 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3cccc(Cl)c3)ccc2[C@H]1c1ccc([N+](=O)[O-])cc1 38654947 PRUNFELZUHCAKE-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE C=CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccs4)ccc32)c1 40529836 RSWZBFNLLGUOHU-JOCHJYFZSA-N 430.485 4.750 50 10 IJGE CC(C)Cc1ccc(-c2csc(/C(C#N)=C\Nc3ccc(S(N)(=O)=O)cc3)n2)cc1 100083904 KMYJJMRPVUCZOH-AQTBWJFISA-N 438.578 4.633 50 10 IJGE C[C@@H](Br)c1ccccc1NC(=O)c1cccc(I)c1 125521067 BCAIYLPKOHYUKO-SNVBAGLBSA-N 430.083 4.999 50 10 IJGE O=C=NC[C@H]1CCC[C@@H](CNC(=O)N2CCC(c3cc4cc(Cl)ccc4[nH]3)CC2)C1 170288666 JDNVHLFPNWZRHW-DLBZAZTESA-N 428.964 4.853 50 10 IJGE Clc1ccccc1C(CBr)(CBr)CO[C@@H]1CCCOC1 383627547 IAOQGJSNVNZBMX-GFCCVEGCSA-N 426.576 4.563 50 10 IJGE Cc1c(I)ccc(C(=O)CBr)c1SC(F)(F)F 575710199 VSKZQIPLDMYCKD-UHFFFAOYSA-N 439.034 4.789 50 10 IJGE COc1ccc(Oc2ccc(CBr)cc2C#N)cc1I 712919985 PYRYINUQQUJLNT-UHFFFAOYSA-N 444.066 4.859 50 10 IJGE Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)o1 742964851 KANJDFKZJXZFAC-HTAPYJJXSA-N 446.551 4.558 50 10 IJGE O=C(NNc1c(Cl)cccc1Cl)c1cc(I)c(F)cc1F 772475169 APLZIJQGAMBSEK-UHFFFAOYSA-N 443.018 4.633 50 10 IJGE O=C(NCc1ccc(Cl)cc1)NNC(=O)c1csc(-c2cccc3ccccc23)n1 777985078 QGZSDZIUWJKHPT-UHFFFAOYSA-N 436.924 4.761 50 10 IJGE CC(=O)N(c1ccc(F)cc1)c1nc(/C=C(\C#N)C(=O)N(C)Cc2ccccc2)cs1 787150970 WVTUESUBRIHWRZ-LDADJPATSA-N 434.496 4.532 50 10 IJGE Cc1ccc(Cn2nc(C)c(C(=O)NNc3ccc(C#N)cc3C(F)(F)F)c2Cl)cc1 799753121 OQLPQBPCJMMBRV-UHFFFAOYSA-N 447.848 4.849 50 10 IJGE COc1ccc(C=NNC(=O)CCc2c[nH]c3ccccc23)cc1CSc1ccccn1 1084605027 UYPXROILZVDGCJ-UHFFFAOYSA-N 444.560 4.947 50 10 IJGE CC(=O)c1ccc(-c2ccc(C(=O)NNC(=O)Nc3ccc(Cl)cc3Cl)o2)cc1 1138928227 IRIMHUMXGQWDHC-UHFFFAOYSA-N 432.263 4.923 50 10 IJGE C=CCC[C@H](NC(=O)NNc1ccc(F)c(C(=O)OC)c1)c1ccc(C(F)(F)F)cc1 1312343273 QQGRFNNBPSASHX-SFHVURJKSA-N 439.409 4.965 50 10 IJGE C=CCC[C@H](CO)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1449422472 IIZDBWJTUZOUEY-UWKDKTGGSA-N 432.351 4.751 50 10 IJGE Cc1ccc(NNC(=O)[C@H](C)SCc2nc(O)c3c(C)c(C)sc3n2)c(Cl)c1 1627770775 RSWZIIFSVXVIJZ-LBPRGKRZSA-N 436.990 4.741 50 10 IJGE CCCc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1cccc(O)c1)C(C#N)=C(N)O2 1865681725 UZLNHKHNHHFBRO-HXUWFJFHSA-N 438.890 4.600 50 10 IJGE ClCC[C@H](COCc1ccccc1)NCc1sccc1I 1892497632 TUDWYFOKMDOTJV-CQSZACIVSA-N 435.758 4.657 50 10 IJGE CC[C@@H]1C[C@H]1CCO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1902818119 TVGMXCVINSJREX-RKVPGOIHSA-N 437.362 4.644 50 10 IJGE COC(=O)[C@@]1(C(C)C)C[C@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 1912260392 SGCVWFPRCVYWRR-CVDCTZTESA-N 435.637 4.987 50 10 IJGE CC[C@H](CCBr)NC(=O)c1c(Br)cccc1Br 1945333266 NRTKBOGNMMNLRX-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@]2(CC[C@@](C)(CI)O2)CC12CCC2 1986113214 YSHUGQVKNUZYDU-WMZOPIPTSA-N 435.346 4.683 50 10 IJGE CSCC[C@H](Cl)CCNC(=O)c1cc(Br)sc1Br 2029925902 ZNLVGHOQBKFBOX-SSDOTTSWSA-N 435.634 4.754 50 10 IJGE O=C(Nc1ccc(Cl)cc1I)[C@H](Br)C1CCCC1 2048140433 SZMLGXDQLFKJLC-GFCCVEGCSA-N 442.522 4.837 50 10 IJGE FC(F)c1c(CBr)ccc(Br)c1I 2054780876 HQSCJWSMKIKRCT-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE O=C(CBr)c1c(C(F)F)ccc(C(F)(F)F)c1I 2060392439 OTYCVAIFPRPSLL-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE CC(C)[C@@H](Br)c1cn(-c2ccc(Br)c(Br)c2)nn1 2065990268 LYUYTHPLFMJYON-GFCCVEGCSA-N 437.961 4.884 50 10 IJGE CCOc1cc(CBr)cc(Br)c1OC[C@@H]1C[C@H]1Br 2076263758 ZJWGJPCFUAKSGV-VHSXEESVSA-N 442.973 4.905 50 10 IJGE CCCC[C@H](C)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2123201326 VGLUJPWPIIQQPU-VIFPVBQESA-N 433.231 4.605 50 10 IJGE Cc1cc2c(NCCSSCCNC(=O)OC(C)(C)C)nc(Cl)nc2s1 2125299221 QPKCZSQZHFIRRY-UHFFFAOYSA-N 435.040 4.971 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CC[C@H]2CCN(Cc3ccccc3)C[C@H]2C1 2148929715 OMUBGKGQPOLVSN-IRLDBZIGSA-N 427.386 4.566 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(CBr)cc1 2162871975 MOPXOSXLTHGLRA-BCDXTJNWSA-N 437.378 4.584 50 10 IJGE CN(C(=O)c1ccc(I)c(Cl)c1)C1(CCl)CC(C)(C)C1 2164569092 YCMFPODHZHNBLX-UHFFFAOYSA-N 426.125 4.814 50 10 IJGE Cc1c(Cl)cc(CN2CCO[C@H](CBr)C2(C)C)cc1Br 2167386503 WEIOAMVMCUZDAO-CQSZACIVSA-N 425.592 4.785 50 10 IJGE Clc1c(Br)cccc1CN1CCC(OCCCBr)CC1 2207528139 MEBOAHLHYCQBCT-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE CCC[C@@H](CCBr)CNC(=O)c1cc(C)ccc1I 2232157575 REBKDXBPPVRZAN-LBPRGKRZSA-N 438.147 4.531 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)[C@@H]2CCCS(=O)(=O)C2)c(C)c1Br 2235609007 AOOPMDRXYLWHGU-YGRLFVJLSA-N 444.616 4.933 50 10 IJGE CC(C)(C)C[C@H](Br)CNC(=O)Cc1ccc(Br)cc1Cl 2237437740 ZVMMXUFEBMSWRG-LBPRGKRZSA-N 425.592 4.961 50 10 IJGE COc1ccc([C@@H](Br)c2ccc(OC)c(I)c2)s1 2257366968 HYZWNYADRPMRKM-ZDUSSCGKSA-N 439.112 4.854 50 10 IJGE CC(C)(C)OC(=O)N1CCC([S@@](C)(=O)=NCCCCCCCBr)CC1 2263164288 GBVYYYLLBBKIDP-RUZDIDTESA-N 439.460 4.829 50 10 IJGE CC(C)(C)[C@@H]1[C@@H](Cl)CCN1C(=O)c1ccc(Cl)c(I)c1 2283670704 VINYCEBWXYBUSZ-AAEUAGOBSA-N 426.125 4.813 50 10 IJGE N#CC(=Cc1cc(Br)ccc1OCc1ccc(Cl)cc1Cl)C(N)=O 2313730520 ZROOMEFJOOHLGH-UHFFFAOYSA-N 426.097 4.727 50 10 IJGE Clc1ccc(I)c(CN2C[C@@]3(CBr)CC[C@H]2C3)c1 2314902913 FIWKZEHHPFPLPN-JSGCOSHPSA-N 440.550 4.694 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@H]2[C@H](CBr)C3)cc1I 2315553682 VUNRNOLKIMUXHB-MJVIPROJSA-N 440.550 4.692 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc3nc(Cc4ccccc4)[nH]c3c2)cc1Cl 2323721335 KIGQBUMLTYJGNR-UHFFFAOYSA-N 432.911 4.970 50 10 IJGE CO[C@H](CO[C@]1(CBr)CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1 2336212983 TZBKKXBAJXMGOF-XLIONFOSSA-N 428.367 4.555 50 10 IJGE CC1CCC([C@@H](CBr)NCc2ccc(I)cc2)CC1 2351653135 STNRPVGOHMPLPC-LDZOIKDWSA-N 436.175 4.971 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@H]2CC[C@H]1[C@@H](Br)C2 2377482699 LORNUBYPLPVOLD-TXMMPKFLSA-N 425.523 4.630 50 10 IJGE CC(C)(C)C(=O)Nc1ccc(C(=O)NN=Cc2ccccc2OC(=O)c2ccccc2)cc1 13108330 XHTWTEOUKQJDIZ-UHFFFAOYSA-N 443.503 4.654 50 10 IJGE C/C(=N\NC(=O)c1cccc(C)c1)c1ccc(/C(C)=N/NC(=O)c2cccc(C)c2)cc1 13950251 UTLCSYKGDOCUFU-MKYUKRCKSA-N 426.520 4.611 50 10 IJGE CC(C)C[C@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)c1cccs1 108883829 FCOUKVUTICHSQH-SFHVURJKSA-N 436.581 4.622 50 10 IJGE CCN(C[C@](C)(CBr)OC[C@@H]1C[C@@H]2CCCC[C@@H]2O1)C(=O)OC(C)(C)C 380803939 LCFWSTZHXZUGIB-BOSXTWCSSA-N 434.415 4.761 50 10 IJGE Nc1c(Cl)cccc1[C@@H]1CN(Cc2ccccc2)C[C@@H]1CI 394531077 XZLPRFLEYRUURX-GOEBONIOSA-N 426.729 4.573 50 10 IJGE C[C@@H]1C[C@@H](Br)CN(C(=O)c2scc(Br)c2Br)C1 705469075 VQVBLDPYASRIGB-RNFRBKRXSA-N 446.002 4.519 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=O)N[C@H](c2cccc(Cl)c2)c2ccccn2)cc1 761801436 UHSHYXHUQOCPDJ-OAQYLSRUSA-N 436.943 4.766 50 10 IJGE Cn1ncc(Br)c1/C=C(/C#N)C(=O)Nc1nc(-c2ccccc2Cl)cs1 779800000 VPCRPPWHYKLLNR-POHAHGRESA-N 448.733 4.505 50 10 IJGE COc1ccccc1C(=O)NN=Cc1ccc(OCc2ccc(Br)cc2)cc1 1084162770 ADIOZEDDDUXDEQ-UHFFFAOYSA-N 439.309 4.801 50 10 IJGE CCOc1cc(C=NNC(=O)CNc2ccccc2)ccc1OCc1ccc(Cl)cc1 1084609262 VRAMSQTZFJLBAO-UHFFFAOYSA-N 437.927 4.880 50 10 IJGE CC(C)(C)N(NC(=O)Nc1cc(F)ccc1F)C(=O)c1ccccc1Br 1088750075 OJEHKMMEJZXGCD-UHFFFAOYSA-N 426.261 4.705 50 10 IJGE O=C(CCBr)c1ccc(SC(F)(F)F)c(I)c1 1848425884 NTAGTWJBXSZHMP-UHFFFAOYSA-N 439.034 4.871 50 10 IJGE CCCc1nn(Cc2ccccc2F)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865698975 HIUFJAZLQPIKEA-QHCPKHFHSA-N 441.510 4.733 50 10 IJGE N#C/C(=C\c1ccc(F)cc1)C(=O)Nc1c(Br)cc(C#N)cc1Br 1866127456 JHKVKAZTYKISLF-LFYBBSHMSA-N 449.077 4.768 50 10 IJGE CCCC[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)C(=O)Nc1ccc(SC#N)cc1 1866939728 MEIOOYFUESTKIG-NJYVYQBISA-N 425.529 4.816 50 10 IJGE COc1ccc(Br)cc1C(=O)N(CCCBr)Cc1ccccc1 1914644291 WFHLBLNOXRUZQR-UHFFFAOYSA-N 441.163 4.885 50 10 IJGE CCn1ncc(Br)c1CN(Cc1ccccc1)[C@@H](CBr)C1CC1 1915187611 DDSCXACQJWSMDP-KRWDZBQOSA-N 441.211 4.841 50 10 IJGE O=S(=O)(c1ccccc1Br)N(Cc1ccccc1)C1(CCl)CCC1 1915760104 KUENQIVLOYOEOU-UHFFFAOYSA-N 428.779 4.802 50 10 IJGE C[C@@H](Br)[C@H]1CCN(Cc2ccc(I)c(Cl)c2)C1 2026567407 RPIIJLQGTNTHLM-KOLCDFICSA-N 428.539 4.550 50 10 IJGE CC1(C)CCN(c2ncc(Br)cc2Br)C[C@@H]1CBr 2031405432 HSSDDPWOUCGENA-VIFPVBQESA-N 441.005 4.854 50 10 IJGE CCC[C@H](CCBr)NC(=O)c1cccc(Br)c1Br 2031479901 PAMBHIKTOFBFAV-SECBINFHSA-N 441.989 4.895 50 10 IJGE O=C(N[C@@H](CCBr)C1CC1)c1cccc(Br)c1Br 2031481744 KRYMYKLDVIIDCQ-NSHDSACASA-N 439.973 4.505 50 10 IJGE CCC(CC)(CBr)CN=[S@@](C)(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 2044697367 TZOJBXPVARXHBY-BZQUYTCOSA-N 439.460 4.685 50 10 IJGE CC(C)[C@H](CBr)CN1CCCC[C@@H]1C(F)(F)CNC(=O)OC(C)(C)C 2065453372 RBCTZYXTTQPWKJ-HUUCEWRRSA-N 427.374 4.668 50 10 IJGE C[C@H](Br)[C@@H](NC(=O)c1cc(Br)c(Cl)s1)C(F)(F)F 2074719965 KDXCLAURBWOSEI-BBIVZNJYSA-N 429.483 4.608 50 10 IJGE Clc1cc(CN2C[C@@H]3CC[C@@H](Br)[C@H]3C2)ccc1I 2086662444 VFACIXPHLFXCFA-SDDRHHMPSA-N 440.550 4.550 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CN(CCCCCCCCCBr)CCO1 2106780703 AYCIJRGGWGPXON-QZTJIDSGSA-N 435.447 4.726 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2CN(CC3(CBr)CCCCCC3)C[C@@]2(C)C1 2106784209 HBMXKOHILFDLHP-PXNSSMCTSA-N 429.443 4.911 50 10 IJGE CC(C)[C@H](Br)C(=O)N1CCCC12CCC(N(C)C(=O)OC(C)(C)C)CC2 2111604062 BYMWFPAZPBAMKS-NGEICVOHSA-N 431.415 4.577 50 10 IJGE CN(C(=O)c1ccc(Br)cc1Cl)[C@H](CCBr)C(F)(F)F 2178515392 LMHOLYBNFMPRDV-SNVBAGLBSA-N 437.481 4.890 50 10 IJGE CC(C)(C)C1CC(S(=O)(=O)N(Cc2ccccc2)[C@@H](CBr)C2CC2)C1 2223711185 GBIYCVVYSOXATC-ACBHZAAOSA-N 428.436 4.817 50 10 IJGE CCCn1c(CBr)nnc1-c1ccc(Cl)c(I)c1 2256339241 QAZCUKSEUBZLIS-UHFFFAOYSA-N 440.510 4.508 50 10 IJGE N#CC(=CNc1ccc(F)c([N+](=O)[O-])c1)c1nc(-c2cc3ccccc3oc2=O)cs1 2296801637 YDRXAQWPHKNSCK-UHFFFAOYSA-N 434.408 4.940 50 10 IJGE CN(Cc1cc(I)ccc1Cl)[C@@H]1CCC[C@H]1Br 2307315185 DXUDDZVEDNOTDI-DGCLKSJQSA-N 428.539 4.692 50 10 IJGE ClC[C@@]1(Cc2ccc(I)c(Br)c2)C[C@@]12CCOC2 2325221077 KYWHIDZTMDFJSG-ZIAGYGMSSA-N 441.534 4.632 50 10 IJGE ClCCC1(NCc2cc(I)ccc2Cl)CCSCC1 2352412305 RSOSJGRMIRNSPH-UHFFFAOYSA-N 430.182 4.929 50 10 IJGE COC[C@@]1(C)C[C@@H](NC(=O)OC(C)(C)C)CN1CC1(CBr)CCCCCC1 2364207676 AOPJDAPRLIXQTJ-YLJYHZDGSA-N 447.458 4.726 50 10 IJGE O=C(N[C@H](CCl)CC1CCCC1)c1ccc(Cl)cc1I 2365598209 OYMYDQQAEKEMNH-LBPRGKRZSA-N 426.125 4.862 50 10 IJGE CCOC(=O)/C(C#N)=C1/S[C@@H](Cc2ccccc2Cl)C(=O)N1c1ccc(C)cc1 33729342 ZSSVYGAVFFLVSW-MXTRNAPSSA-N 426.925 4.638 50 10 IJGE O=[N+]([O-])c1ccc(C[C@@H](Br)c2ccccc2I)cc1 110298034 POXVPXWHDBRUHS-CYBMUJFWSA-N 432.055 4.878 50 10 IJGE O=C(N[C@@H](CBr)Cc1ccccc1)c1cc(Br)ccc1Cl 122470554 JPHXFRRQRGTRNZ-CYBMUJFWSA-N 431.555 4.839 50 10 IJGE CCCCOCCO[C@](C)(CI)c1ccccc1Br 162118845 NUPQZQSFCLCPSN-OAHLLOKOSA-N 441.147 4.933 50 10 IJGE ClCc1cccc2c(I)c(I)sc12 306947718 QQDHMMGTZXYVPG-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CC(C)CCCCCC(CBr)(CBr)[C@@H]1CCS(=O)(=O)C1 383579039 VQMUWXFOBYAGJH-CQSZACIVSA-N 432.262 4.804 50 10 IJGE CCOc1ccc(/C=C(/C#N)C(=O)N2CCC([C@@H]3C(=O)Nc4cc(Cl)ccc43)CC2)cc1 727413376 NCXOTTRJUGFDAI-ZLKNRPIFSA-N 449.938 4.620 50 10 IJGE O=C(NN=Cc1cccc(Cl)c1Cl)C(=O)Nc1ccc(Oc2ccccc2)cc1 1084532431 PAINKNMSDULYTJ-UHFFFAOYSA-N 428.275 4.875 50 10 IJGE C/C(=C/c1ccncc1)C(=O)NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1 1350047462 KWIUAIUJZKGCCQ-VLGSPTGOSA-N 435.549 4.584 50 10 IJGE Cn1cccc1[C@H]1C(C#N)=C(N)Oc2c1c(-c1ccccc1)nn2-c1ccc(Cl)cc1 1865699529 WIJYDTXVCHLXNC-HXUWFJFHSA-N 427.895 4.749 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CC[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)C1 1880761529 OCWBRWIUAWRKOW-SOUVJXGZSA-N 435.403 4.606 50 10 IJGE Cc1cc(N(C)C[C@@H](Br)COCc2ccccc2)ncc1Br 1916347180 GUZHCWJZATXTSZ-OAHLLOKOSA-N 428.168 4.569 50 10 IJGE Cc1nn(C)c([C@H](Br)c2ccc(Br)s2)c1Br 1989610875 ZEZIDXABVROURX-SECBINFHSA-N 428.975 4.799 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3C[C@H](Br)C[C@H]2C3)c1 2054715245 VVSGJURMHMHLBB-TVYUQYBPSA-N 438.001 4.959 50 10 IJGE Brc1ccc(Br)c(C[C@H]2CN(C3CC3)C[C@H]2Br)c1 2054717872 KARYEAKOYJHGRR-IINYFYTJSA-N 438.001 4.612 50 10 IJGE COc1c(F)cccc1Cn1nc(CBr)c(Br)c1C(F)(F)F 2079229084 DOONAYYWUSIIFS-UHFFFAOYSA-N 446.036 4.755 50 10 IJGE CC[C@@H]1CCOC[C@H]1O[C@@H](CI)c1ccccc1Br 2096209352 YJTHXINFOVIRLJ-BYCMXARLSA-N 439.131 4.757 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H](NC(=O)c1ccc(CBr)cc1)c1ccccc1 2179674550 OCSMAQQAYCKQHL-GOSISDBHSA-N 433.346 4.577 50 10 IJGE FC(F)(F)CC1(CBr)CCN(C[C@@]2(Br)CC2(F)F)CC1 2202508392 GNFMVRANERMXAR-JTQLQIEISA-N 429.065 4.589 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCC2(CCC2)N(CCCCCI)C1 2211185925 SYJIBBHEFKVZJL-HNNXBMFYSA-N 436.378 4.504 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OCCCCC2CC2)C1 2212363965 DLFASRLWLCOJKC-GOSISDBHSA-N 437.362 4.788 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@@H](Br)C2(CCCC2)C1 2264508906 FTAYSXMNTNMRSI-SECBINFHSA-N 427.589 4.944 50 10 IJGE Br[C@@H]1C[C@@H]2CCCC[C@@H]2N(Cc2ccc(I)cc2)C1 2264828536 ZRHJZYHRCDTVOO-LZWOXQAQSA-N 434.159 4.819 50 10 IJGE O=C(c1ccncc1C(F)(F)F)N(Cc1ccccc1)[C@@H](CBr)C1CC1 2265497273 DHCBPQHCLAEOMS-KRWDZBQOSA-N 427.264 4.916 50 10 IJGE COc1ccc(C[C@H](Br)c2ccc(OC)c(I)c2)cc1 2284998612 LWCLYVQMIAJCBQ-AWEZNQCLSA-N 447.110 4.987 50 10 IJGE COc1cc(C=CC(=O)Cl)cc(Br)c1OCc1ccc([N+](=O)[O-])cc1 2293940896 LKQHAEZHAGUTGX-UHFFFAOYSA-N 426.650 4.724 50 10 IJGE Cl[C@@H](CNCc1ccc(I)c(Br)c1)C1CCC1 2306219408 LWTSPSWISNMXBY-LBPRGKRZSA-N 428.539 4.551 50 10 IJGE CC[C@H](Cl)[C@H](CC)NCc1ccc(I)c(Br)c1 2306219592 NYJDIJRTHPPBSJ-AAEUAGOBSA-N 430.555 4.939 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)CN(C)S(=O)(=O)c1cscc1Br 2365907533 HZOPJVVXHNZMJI-GFCCVEGCSA-N 447.258 4.577 50 10 IJGE CC(C)(C)OC(=O)N[C@]1(c2ccccc2)CCN(C[C@@]2(CBr)CC2(F)F)C1 2379986519 SKWJXICNFSQGBI-RBUKOAKNSA-N 445.348 4.533 50 10 IJGE Clc1cc(Br)cc(CN(CCCBr)C2CCOCC2)c1 2381162440 GBQKYKMGMRZCSE-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE CC(C)c1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(OCc3ccccc3)cc2)cc1 14040296 VOABYNMJMMRSBA-LJQANCHMSA-N 432.520 4.618 50 10 IJGE CCc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccc(OC)c2)CCC3)cc1 40822218 VPYPPUKLUUXDBJ-SGWCAAJKSA-N 445.519 4.882 50 10 IJGE COC(=O)/C(C#N)=C/c1cccc(OC(=O)/C=C/c2ccc(OCCC(C)C)c(OC)c2)c1 40944669 BGHPJFVLRGHZNB-QGEPNLJWSA-N 449.503 4.819 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C/c2ccc(OCCC)cc2)cc1 40971019 SZSACGNWJAQWLZ-UXCYTXTISA-N 432.520 4.917 50 10 IJGE O=C(N/N=C(/CSc1nc2ccccc2s1)c1ccc([N+](=O)[O-])cc1)c1cccnc1 59460765 IQJKUKVBSKKHBI-MOHJPFBDSA-N 449.517 4.526 50 10 IJGE O=C(N/N=C\c1c(Cl)cccc1Cl)c1cccn(Cc2cccc(Cl)c2)c1=O 169920711 POILAJREYXJSDS-MYKKPKGFSA-N 434.710 4.621 50 10 IJGE BrCc1c(Oc2cccc(I)c2)nc2ccccn12 218204276 KUOXRMOUEJAJHD-UHFFFAOYSA-N 429.055 4.626 50 10 IJGE CC(C)COCCO[C@@](C)(CI)c1ccccc1Br 232692423 SVJLLEHSXRGLEJ-HNNXBMFYSA-N 441.147 4.789 50 10 IJGE CO[C@H](CO[C@H](CI)c1ccccc1Br)C(C)C 380979460 YLCZXUYJWMFHRG-ZIAGYGMSSA-N 427.120 4.613 50 10 IJGE C[C@H]1CN(c2nc3ccccn3c2CBr)[C@H](C)[C@H](C)N1Cc1ccccc1 404261082 DMOJEVTVAJCZBA-OKZBNKHCSA-N 427.390 4.717 50 10 IJGE CCn1cc([C@H](Br)c2ccc(Br)s2)nc1Br 698483392 VHAYVRKPZMKIMY-VIFPVBQESA-N 428.975 4.974 50 10 IJGE ClCc1cc(Br)c(OCC2=CSC3=NCCN23)c(Br)c1 699169428 ZTZLUFASQQSJRT-UHFFFAOYSA-N 438.572 4.589 50 10 IJGE Fc1c(Br)ccc(CNC2(CCBr)CCSCC2)c1F 719714175 IQVHVDZBYSRLHA-UHFFFAOYSA-N 429.168 4.868 50 10 IJGE CCC[C@@H](CCCl)NC(=O)c1ccc(I)c(Br)c1 721592127 DYHCEJIKRQQTOR-JTQLQIEISA-N 444.538 4.581 50 10 IJGE COc1cc(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)ccc1Cl 790145393 DKLCOWYAWVPFTJ-ATVHPVEESA-N 431.883 4.671 50 10 IJGE COc1ccc(C(=O)NN=Cc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)cc1 1084508162 LWTSFWPVMOKFBE-UHFFFAOYSA-N 430.895 4.965 50 10 IJGE CC(=O)c1cccc(OCc2cc(C(=O)N3CC[C@H](O[Si](C)(C)C(C)(C)C)C3)no2)c1 1647816468 JWRAGUZIJSKGED-IBGZPJMESA-N 444.604 4.693 50 10 IJGE CCCc1nn(CCC)c2c1[C@@H](c1ccc(OC(=O)c3ccccc3)cc1)C(C#N)=C(N)O2 1865705323 SBULDXISDBMKCH-QFIPXVFZSA-N 442.519 4.683 50 10 IJGE O=C(N[C@@H](CSCC1CC(Cl)C1)C(=O)O)OCC1c2ccccc2-c2ccccc21 1883648817 HAFCEAKOVUAVSI-XFMWISLNSA-N 445.968 4.729 50 10 IJGE C[C@@](CCl)(CBr)OCc1ccc(Cl)cc1I 1901596979 QAPOWQNAYOKJTF-NSHDSACASA-N 437.930 4.854 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]([C@@]2(C)CCC[C@@H](CI)O2)CC1 1993734191 BAOHDOCTKBLTHA-JTOWHCCKSA-N 437.362 4.833 50 10 IJGE CC[C@@H]1CN(Cc2cc(Br)ccc2Br)C[C@@H]1Br 2006497497 VFRQJBGOZORHMH-RNCFNFMXSA-N 425.990 4.817 50 10 IJGE CC1(C)[C@H](Br)CCN1Cc1ccc(I)c(Cl)c1 2026560614 LJCHLJPUOAKSDR-GFCCVEGCSA-N 428.539 4.692 50 10 IJGE COCCOC[C@H](Br)CCc1cccc(Br)c1Br 2038176288 ZULBLELEIBABCM-LLVKDONJSA-N 444.989 4.571 50 10 IJGE CC[C@H](Cl)CN(CC)C(=O)c1ccc(Br)cc1I 2086148639 DLLVQWWKHQJTGT-JTQLQIEISA-N 444.538 4.533 50 10 IJGE C[C@H](N(Cc1ccccc1)S(=O)(=O)N1CCC(CCBr)CC1)C(C)(C)C 2123371581 ZUGOTQADVNLTLQ-KRWDZBQOSA-N 445.467 4.665 50 10 IJGE CC(C)[C@@H](CBr)CN1CCC[C@@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2129043058 LKDPWCABKFYLOR-CABCVRRESA-N 429.403 4.603 50 10 IJGE Cc1nc([C@@H](Br)c2cc3c(cc2Cl)NC(=O)C3)c(Br)s1 2169496093 PNFOYSTXFVRUER-NSHDSACASA-N 436.556 4.846 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(Cc3ccc(CBr)cc3)C[C@H]21 2182844638 GUFIHUOWYUAMRY-WTGUMLROSA-N 435.406 4.659 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1ccc2c(c1)OC(F)(F)O2 2231586790 QBYFPZJBLODEHC-UHFFFAOYSA-N 426.257 4.824 50 10 IJGE Cc1c(Br)sc([C@H](Br)[C@@]23CCC[C@H]2CS(=O)(=O)C3)c1C 2234212175 CHAKOKARWRQJAP-VHRBIJSZSA-N 442.238 4.778 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)C2CCS(=O)(=O)CC2)c(C)c1Br 2235613486 YDQOPIRURYFQNI-AWEZNQCLSA-N 444.616 4.933 50 10 IJGE O=C(NC[C@@H]1CCCC[C@@H]1CCl)c1ccc(Cl)c(I)c1 2283655067 GLDAZJWKUGUOSB-NEPJUHHUSA-N 426.125 4.720 50 10 IJGE Cc1c(C=C(C#N)C(=O)Nc2nccs2)c2ccccn2c1C(=O)c1ccc(F)cc1 2297390809 QQMOAFMMFSIRAP-UHFFFAOYSA-N 430.464 4.620 50 10 IJGE C=CC[C@H](Br)[C@H]1CCN1Cc1ccc(Cl)c(I)c1 2315549154 ORTOIOCMXGTPGR-SMDDNHRTSA-N 440.550 4.859 50 10 IJGE Clc1ccc(CN2CC3(CC3)C[C@H]2CBr)cc1I 2315555343 PPXZBGCOKAFTHS-NSHDSACASA-N 440.550 4.694 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)C=Cc1cccs1 2321178288 PNTRBZHJYGPOLF-UHFFFAOYSA-N 432.332 4.900 50 10 IJGE COc1ccc(C(C)=NNC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)cc1OC 2321276006 AZTVDLAJDYNSRL-UHFFFAOYSA-N 425.435 4.506 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Br)c2)C[C@]1(C)CCl 2325214484 OSESQWUCQMPIII-HZMBPMFUSA-N 442.566 4.751 50 10 IJGE C[C@@H]1CCN(Cc2cc(I)ccc2Cl)C[C@@H]1CBr 2327398420 DIVZJEZNVMTGFX-PWSUYJOCSA-N 442.566 4.798 50 10 IJGE CC[C@H]1CN(Cc2cc(I)ccc2Cl)C[C@@H]1CBr 2327408625 CZYJTOMKTUVGFS-JQWIXIFHSA-N 442.566 4.798 50 10 IJGE N#CC(=C(O)C=Cc1ccc2c(c1)OCCO2)c1nc(-c2ccc3c(c2)OCCO3)cs1 2331330895 MHCDNBXDHHZDBE-UHFFFAOYSA-N 446.484 4.859 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@H]2CC[C@H]1[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]21 2353832321 YIYXKVWNFBMQHU-NNIGNNQHSA-N 429.443 4.621 50 10 IJGE C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 14031618 UPTFNBXZHYWZLB-UONOGXRCSA-N 447.318 4.529 50 10 IJGE C=CCOc1ccc(C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2C(C)(C)C)cc1 14661776 YNRCNXATKRWLKV-UHFFFAOYSA-N 438.568 4.686 50 10 IJGE Cc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)N(C)Cc4ccccc4)c(C)c32)c1 40811400 QLTTYXKNYKASDJ-SZXQPVLSSA-N 429.520 4.639 50 10 IJGE C=CCc1cc(/C=N\NC(=O)CC[C@H](O)c2ccccc2)cc(Br)c1OCC 58891921 OWMRSHNPBCYXQQ-ORQKMDSUSA-N 445.357 4.540 50 10 IJGE CCOC(=O)/C(C#N)=C/c1cc(Cl)c(OCCOc2ccc(C)cc2)c(OCC)c1 102444468 GTKVNJKSNGHKDZ-LDADJPATSA-N 429.900 4.975 50 10 IJGE FC(F)C(F)(F)[C@H](Br)c1cc(I)cc2c1OCC2 302558226 XNHKWCROSSGOMH-SECBINFHSA-N 438.984 4.563 50 10 IJGE CCN(CC)CCCCNC(=O)Nc1ccc(C(=O)Nc2ccc(SC#N)cc2)cc1 586616700 SHLANJWVFBVGDW-UHFFFAOYSA-N 439.585 4.756 50 10 IJGE FC(F)(F)CSCCn1c(CCl)nc2cc(I)ccc21 698973051 VIUCLXXSXSECRA-UHFFFAOYSA-N 434.652 4.675 50 10 IJGE COc1cc(F)cc(NNC(=O)C(C)(C)[C@H](O)c2ccc(OCc3ccccc3)cc2)c1 778932742 BGOURRYVTBULOA-HSZRJFAPSA-N 438.499 4.616 50 10 IJGE CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)c1 799747617 DBHWCVNLZMULDJ-UHFFFAOYSA-N 438.837 4.972 50 10 IJGE COc1cc(C(=O)NN=Cc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc(OC)c1OC 1084291326 ACGGXOXRQKRUSW-UHFFFAOYSA-N 442.556 4.777 50 10 IJGE Cc1ccc(-n2c(C)cc(C=NNC(=O)C(=O)Nc3ccc(Cl)cc3C)c2C)c(C)c1 1084485242 KAGWGMDFOZFJLN-UHFFFAOYSA-N 436.943 4.762 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N[C@@H](C)c2ccc3nc(O)oc3c2)c(C)n1-c1ccc(F)cc1 1131894301 HCZUHXKEANVCBJ-VUQQOUJSSA-N 444.466 4.864 50 10 IJGE C=CC[C@@]1(C(=O)NNc2ccc(Br)cc2C)CCCN1C(=O)OC(C)(C)C 1151480698 RSDLPCSEPLRHGA-FQEVSTJZSA-N 438.366 4.546 50 10 IJGE CC(=O)c1cc2c(cc1NC(=O)/C(C#N)=C/c1cc(C)n(-c3cccc(C)c3)c1C)OCO2 1353027624 QFZUZUDUNGEKTQ-KEBDBYFISA-N 441.487 4.880 50 10 IJGE CC(C)(C)Cn1c(O)nc2cccc(C(=O)NNc3nc4ccc(Cl)cc4s3)c21 1585731069 FUWVVOWOWQJVTI-UHFFFAOYSA-N 429.933 4.808 50 10 IJGE COc1ccc(/C(C#N)=C/c2cccc(OC(=O)c3cccc([N+](=O)[O-])c3)c2)cc1OC 1615066915 WZOCESGWGAHYDQ-YBFXNURJSA-N 430.416 4.895 50 10 IJGE CCc1nn(Cc2ccc(F)cc2)c2c1[C@@H](c1ccccc1OC(C)C)C(C#N)=C(N)O2 1865705215 OWJMKPUFZWAVOF-QFIPXVFZSA-N 432.499 4.638 50 10 IJGE CN(C[C@@H]1C[C@@H]1Br)C(=O)C(C)(C)c1ccc(NC(=O)OC(C)(C)C)cc1 1887829639 LTKYKVWZSXCGDI-BBRMVZONSA-N 425.367 4.553 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)C(=O)c1cc(F)c(Br)cc1O 1901229643 DVAAQNBMQJRMDZ-LLVKDONJSA-N 445.126 4.720 50 10 IJGE CCc1nn(C)c(CN(Cc2ccccc2)C[C@H](Br)CC)c1Br 1915129409 ZMBHZYYZWBHVPF-OAHLLOKOSA-N 443.227 4.921 50 10 IJGE Fc1cc2c(cc1Br)nc(CCCl)n2-c1csnc1Br 1926868755 VLANARFFXAJPEZ-UHFFFAOYSA-N 439.535 4.927 50 10 IJGE C[C@H]1CCN(Cc2c(Br)cccc2Br)C[C@H]1Br 1945333883 WEOZQKCKLPMBID-TVQRCGJNSA-N 425.990 4.817 50 10 IJGE CC[C@H]1CN(Cc2cc(Br)ccc2Br)C[C@H]1Br 2006497498 VFRQJBGOZORHMH-TVQRCGJNSA-N 425.990 4.817 50 10 IJGE C[C@@H]1CCN(Cc2cc(Br)ccc2Br)[C@@H]1CBr 2006503724 RIPDXVPBYZYYKJ-NOZJJQNGSA-N 425.990 4.817 50 10 IJGE C[C@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)C1CC(CBr)C1 2009708598 HZQHVJRCLCJIJM-ODIFPOPNSA-N 428.417 4.815 50 10 IJGE COc1cc([C@H](Br)[C@H]2C[C@H]2Br)c(OC)cc1Br 2020149449 CVQNDCNLQSRMTP-BLYIZYRKSA-N 428.946 4.686 50 10 IJGE CCOC(=O)[C@]1(C[C@H]2C[C@@H](Br)C2)CCCN(C(=O)OCc2ccccc2)C1 2020241582 VZXIIILGNTZBSF-UEXGIBASSA-N 438.362 4.532 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1C(=O)c1cccc(Br)c1Br 2031477192 KEWSTGSMDWROOC-RKDXNWHRSA-N 439.973 4.600 50 10 IJGE CC1(C)C[C@@H](CBr)CN(c2ncc(Br)cc2Br)C1 2052456322 LARDJSGHVZRMLE-VIFPVBQESA-N 441.005 4.854 50 10 IJGE Clc1nc(Cl)n([C@H]2CN(Cc3ccccc3)[C@@]3(CCOC3)C2)c1CBr 2055098572 SUPQQSDZDJOCAX-KDOFPFPSSA-N 445.188 4.691 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]2CCN(CC3(CBr)CCCCC3)C[C@H]2C1 2106788793 SPBRRGQCDSSCBC-MSOLQXFVSA-N 429.443 4.911 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2[C@@H]1CN(Cc2ccccc2)C[C@H]1C 2128517321 FRWWMBVEEMMWTO-CXAGYDPISA-N 433.781 4.934 50 10 IJGE Cc1cnc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)c(CBr)c1 2130158656 BWBGQKQXNLACFB-KRWDZBQOSA-N 428.296 4.538 50 10 IJGE CC1(C)CN(c2cc([N+](=O)[O-])ccc2CBr)CCCN1Cc1ccccc1 2193719756 NMNUQGGNRQWXDZ-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CCCCCCBr)CC[C@@H]1C(F)(F)F 2223283273 QYCWJXVVZVSYED-KBPBESRZSA-N 431.337 4.719 50 10 IJGE CCc1nn(C)c([C@@H](Br)c2cc(Br)c(OC)s2)c1Cl 2232174157 UPXBUZSYJLSOEC-VIFPVBQESA-N 428.577 4.953 50 10 IJGE CCC[C@](C)(CBr)NC(=O)c1ccc(Cl)c(I)c1 2256375494 ONGMYVDRKLJYRC-CYBMUJFWSA-N 444.538 4.628 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(CC2(CBr)CC(F)C2)c2ccccc21 2265632373 MORZVPJRWHKKHA-FXUPRZHBSA-N 427.358 4.976 50 10 IJGE CC(C)(C)OC(=O)NC1(C(F)(F)F)CC2(C1)C[C@@]2(CBr)C(F)(F)F 2302017053 ZPVPMOTWTJHFIV-CXQJBGSLSA-N 426.195 4.940 50 10 IJGE Cc1oc(OCc2cc(I)ccc2Br)nc1CCl 2318983526 XVZOQFSCGKZMLQ-UHFFFAOYSA-N 442.478 4.668 50 10 IJGE CN1C(=O)C(C)(C)c2cc(-c3csc(NC(=O)C(C#N)=Cc4ccccc4)n3)ccc21 2322052021 HYWUTSYPPJOLLW-UHFFFAOYSA-N 428.517 4.610 50 10 IJGE O=C(NN=Cc1cc(Cl)c(O)c(Cl)c1)c1ccc2nc(-c3ccccc3O)[nH]c2c1 2323743703 SAMIEQYJYBAEHF-UHFFFAOYSA-N 441.274 4.712 50 10 IJGE COc1ccc(C)cc1-c1csc(C(C#N)=C(O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)n1 2331323715 ZNZFUXMQWLXLDT-GOSISDBHSA-N 445.544 4.969 50 10 IJGE CC[C@@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)COc1cc(C)ccc1C(C)C 9873188 OPVLTUSEAJRSTO-MOPGFXCFSA-N 426.557 4.626 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccc(F)cc3)c(OCC)c2)C1=O 38603531 XZQAKCQJYSSUCF-FYJGNVAPSA-N 448.494 4.806 50 10 IJGE Cc1nn(Cc2ccccc2Cl)c(C)c1/C=N/NC(=O)c1cccc(Br)c1 59161018 CFUCOTDGBXOSFL-FOKLQQMPSA-N 445.748 4.728 50 10 IJGE Cc1cnc([C@@H](C)n2c(CCCl)nc3cc(I)ccc32)s1 125300106 UHIFOGYZRCKWFD-SNVBAGLBSA-N 431.730 4.796 50 10 IJGE O=S(=O)(Nc1ccc(Cl)c(Br)c1)c1ccc(CBr)cc1 126962856 ZRGQHOONWIBAAU-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE C[C@@H](NC(=O)/C(C#N)=C\NCc1ccccc1Br)C12CC3CC(CC(C3)C1)C2 217058511 VXKSNTFHYSBZDG-ZDLDVWNRSA-N 442.401 4.667 50 10 IJGE C[C@H](CBr)CCCNC(=O)c1cc(Br)ccc1Br 228277377 LAUVQKIOJPITFQ-VIFPVBQESA-N 441.989 4.753 50 10 IJGE O=C(CSc1nc2ccccc2s1)NN=C/C(Br)=C/c1ccccc1 252627293 RQYUVKSFILBYJB-NYWKFCTQSA-N 432.368 4.926 50 10 IJGE Cc1ccc(C(=O)Oc2ccc(C=NNC(=O)COc3cccc4ccccc34)cc2)cc1 254505447 DHWZINJIKQAKFR-UHFFFAOYSA-N 438.483 4.897 50 10 IJGE O=C(NN=Cc1ccc(OC(=O)c2cccc3ccccc23)cc1)c1ccccc1[N+](=O)[O-] 254520605 LPCAVEQBHPNCNE-UHFFFAOYSA-N 439.427 4.731 50 10 IJGE C[C@@H](CCl)[C@H]1CCCCN1C(=O)c1ccc(I)c(Cl)c1 696714633 POUUULKOJJGAHW-IINYFYTJSA-N 426.125 4.814 50 10 IJGE O=C(Nc1ccccc1S[C@H](Cl)C(F)(F)F)C(=O)N[C@@H]1CCCC(F)(F)C1 768757098 PQJACTULUKPCHM-OTYXRUKQSA-N 430.826 4.539 50 10 IJGE CC(=O)CCc1ccc(O[C@@H](C)C(=O)N2CCC[C@@H](O[Si](C)(C)C(C)(C)C)C2)cc1 1275314397 KRKBVWLBHPIFDW-SIKLNZKXSA-N 433.665 4.988 50 10 IJGE C#C[C@H](NC(=O)NNC(=O)c1cc(-c2ccc(C)cc2)nc2ccccc12)c1ccccc1 1478895567 FQIUQDLLEQBUQV-QHCPKHFHSA-N 434.499 4.529 50 10 IJGE C#Cc1ccc(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)cc1 1558728286 VRBNHTYSAZAFTC-RGEXLXHISA-N 425.879 4.644 50 10 IJGE C=C(C)CN(Cc1ccc(CO)o1)C(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(F)cc2)c1C 1568889349 CXKWEGYEAIEVSZ-CIAFOILYSA-N 447.510 4.830 50 10 IJGE C#CC[C@H](NC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1ccccc1 1670716246 KVDSGFDJQIEERU-QHCPKHFHSA-N 447.922 4.628 50 10 IJGE COc1cccc(O[C@H](C)C(=O)NN=Cc2ccc(OCc3ccccc3Cl)cc2)c1 1772756298 SFMZSNMXJIYCOX-QGZVFWFLSA-N 438.911 4.845 50 10 IJGE CCc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865701805 FWSUKSMEFSHHDU-LJQANCHMSA-N 426.854 4.644 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)Nc2sc3c(c2C(N)=O)CC[C@@H](C(C)(C)C)C3)cc1 1866126467 SNWLXSGPOSGQBW-RBFDBLARSA-N 437.565 4.552 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)CCN3C(=O)c4ccccc4C3=O)n2)cc1C 1872746777 XSHWLZFQCRXIQE-ZZEZOPTASA-N 445.500 4.606 50 10 IJGE COc1cc(C)c(-c2csc(/C(C#N)=C(\O)[C@@H]3CC(=O)N(C(C)(C)C)C3)n2)cc1C 1872758173 OCGOONLRYWAPPS-OVFHLDOESA-N 425.554 4.875 50 10 IJGE CC1([C@@H](CBr)NC(=O)c2cccc(Br)c2Br)CC1 2033128311 ZNFAXKPCQZQXCJ-SNVBAGLBSA-N 439.973 4.505 50 10 IJGE C[C@@]1(NC(=O)c2cccc(Br)c2Br)CCC[C@@H]1Br 2062579205 SIPOSFBIPPOYSU-GXFFZTMASA-N 439.973 4.648 50 10 IJGE C[C@@H](Br)C1CCN(Cc2ccc(I)c(Cl)c2)CC1 2086659267 VAVWYXFKWIXFDQ-SNVBAGLBSA-N 442.566 4.940 50 10 IJGE C[C@@H]1CCN(C[C@@H](CBr)c2ccccc2)[C@@H](CNC(=O)OC(C)(C)C)C1 2106783318 ZAFIGGFRNDOXRH-BHIYHBOVSA-N 425.411 4.790 50 10 IJGE COCc1cc(Br)c([C@@H](Cl)c2c(C)nn(C)c2Br)s1 2129268126 RGMXXTSDMHGYBT-JTQLQIEISA-N 428.577 4.790 50 10 IJGE CN[C@H](c1c(Br)cc(C)c(Br)c1C)[C@@H]1C[C@H]1Br 2214654171 ZGQHTYQVBPUNJZ-KKFJDGPESA-N 425.990 4.872 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Cl)cc(C(=O)N[C@H]2C[C@H](Br)C2)cc1Cl 2252749267 MTRZCSWVJYRLMO-MGCOHNPYSA-N 438.149 4.996 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CCSC[C@H]1CCBr 2253545032 IUJXNDOGBGQLMK-SSDOTTSWSA-N 433.618 4.507 50 10 IJGE CN(Cc1ccc(I)cc1)c1ccc(CBr)cc1F 2265602488 JCBCGMLCGYDXTC-UHFFFAOYSA-N 434.090 4.962 50 10 IJGE C[C@@H](Br)[C@@H](NC(=O)c1cc(Br)c(F)cc1Cl)C(F)(F)F 2285836052 WLYWSHRXRGSKTF-ALFREKQPSA-N 441.444 4.686 50 10 IJGE Cc1ccc(NC(=O)C(C#N)=Cc2cc(C)n(-c3ccc(N4CCOCC4)cc3)c2C)cc1 2294193004 DSMVQZRMAISNLD-UHFFFAOYSA-N 440.547 4.785 50 10 IJGE C[C@H](Br)CCCN(C)C(=O)c1cc(Br)sc1Br 2299590189 SMEXMJAPWVXRAC-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE N#CC(=Cc1ccc(OCc2ccccc2Cl)cc1)C(=O)NCc1ccc2c(c1)OCO2 2313681251 YARZFTUIKIXPJZ-UHFFFAOYSA-N 446.890 4.871 50 10 IJGE Clc1ccc(CN2C[C@@H]3CC[C@H](Br)[C@H]3C2)c(I)c1 2318529453 QJFAYBZCIZGCDR-XDTLVQLUSA-N 440.550 4.550 50 10 IJGE Cc1cc(F)c(Br)cc1C(=O)N[C@@H](CCCl)COCc1ccccc1 2320561127 FQMDWLJICDUFMV-HNNXBMFYSA-N 428.729 4.841 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc(-c3ccccc3OC)nc2C)cc1OCC 2321251695 FWFMGBUJPKHJSH-UHFFFAOYSA-N 433.508 4.627 50 10 IJGE N#CC(=CN1CCN(c2cccc(Cl)c2)CC1)C(=O)Nc1ccccc1C(F)(F)F 2324305338 GEKAAUKKVVVCJJ-UHFFFAOYSA-N 434.849 4.527 50 10 IJGE Cl[C@@H]1CC[C@H]2CC[C@H]1N2Cc1ccc(I)c(Br)c1 2325212541 OSVLGGOCRZHXBO-ZKYQVNSYSA-N 440.550 4.788 50 10 IJGE COCc1cc(Br)c([C@@H](Cl)c2c(Br)nc(C)n2C)s1 2337321534 LLVBPHFRORVBCS-VIFPVBQESA-N 428.577 4.790 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H](CNC(=O)OC(C)(C)C)CC23CCC3)C1 2345010901 OUYSMGXLDNXNAW-INIZCTEOSA-N 429.443 4.957 50 10 IJGE COC[C@@]1(C)C[C@H](NC(=O)OC(C)(C)C)CN1CC1(CBr)CCCCCC1 2364207673 AOPJDAPRLIXQTJ-FXAWDEMLSA-N 447.458 4.726 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1CCCl)c1ccc(Cl)cc1I 2365600240 ZTHHENDPKPBMLB-YGRLFVJLSA-N 426.125 4.862 50 10 IJGE Cc1scc(C(=O)NC[C@]2(CBr)C[C@@H]2C(F)(F)F)c1Br 2369609013 URXLQGWMEIUWQS-GZMMTYOYSA-N 435.103 4.512 50 10 IJGE N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 35484931 NESGVXVIMDVUFR-XDJHFCHBSA-N 435.443 4.993 50 10 IJGE CCOc1cccc(/C=N/NC(=O)COc2ccc(C(C)(C)c3ccccc3)cc2)c1O 59146571 LYWFEZRDNZSWQJ-WPWMEQJKSA-N 432.520 4.646 50 10 IJGE C[C@@H](SCc1ccccc1)C(=O)N/N=C1/C(=O)N(Cc2ccccc2F)c2ccccc21 59147260 QPSFJZWZCDPGLV-BXHNKXCFSA-N 447.535 4.515 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1S[C@@H](C)C(=O)N/N=C(\C)CCC 59914988 PCRXBLHZNSTHIL-FVQJWRHTSA-N 434.997 4.502 50 10 IJGE CC(C)OC(=O)c1ccsc1NC(=O)/C(C#N)=C\c1ccc(Br)s1 96438745 ROKCNLGALQSEOD-YFHOEESVSA-N 425.329 4.683 50 10 IJGE Cc1ccccc1[C@H](C(=O)NC1CCCCC1)N(Cc1ccc(F)cc1)C(=O)CCl 97914450 POYRUHCPVZTGCI-HSZRJFAPSA-N 430.951 4.892 50 10 IJGE N#C/C(=C/Nc1cccc(F)c1)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 216505483 WVGKRKQBCXMHFZ-ATJXCDBQSA-N 440.522 4.579 50 10 IJGE N#C/C(=C/NCc1ccccc1Br)C(=O)NC(c1ccccc1)c1ccccc1 216980041 RUYWOPLQWKTCBM-FXBPSFAMSA-N 446.348 4.852 50 10 IJGE C[C@@H]1CCC[C@H](O[C@@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)C1 231314402 RWFABNWIWNJRNT-RVKKMQEKSA-N 437.362 4.786 50 10 IJGE ClCc1cc2c(I)ccc(I)c2s1 307105997 JAPONLAOKGUXQE-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CC(C)(C)[C@H](Br)CNC(=O)c1cc(Br)cc(Br)c1 324397428 GQJVCWPVEZWUMZ-LLVKDONJSA-N 441.989 4.751 50 10 IJGE Cn1ncc([C@H](Br)c2ccc(Cl)c(Cl)c2)c1I 379216133 QCFDNCFBTHVJNS-SNVBAGLBSA-N 445.913 4.816 50 10 IJGE CC[C@@H]1[C@@H](CBr)CCN1Cc1cc(Cl)ccc1I 405279670 AVAGSNBKMLUTAE-QMTHXVAHSA-N 442.566 4.940 50 10 IJGE FC(F)Oc1c(C(F)(F)F)ccc(CBr)c1I 575723783 WZAHIIBJTOXEKT-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE BrCC(CBr)(c1ccccc1Br)[C@@H]1CCCO1 686741543 YBRADEJYJKQSPE-LBPRGKRZSA-N 426.974 4.656 50 10 IJGE ClCCc1nc2cccnc2n1CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 706583654 QLIKLAHSMKZURS-UHFFFAOYSA-N 446.982 4.684 50 10 IJGE CC[C@H](CCBr)CNC(=O)c1scc(Br)c1Br 707884088 CRGUXFOPOZBXKX-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE O=C(NNc1ccc(Br)c(F)c1)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 771680463 CNWWJRLZCACAED-RYUDHWBXSA-N 433.199 4.734 50 10 IJGE O=C(NNc1ncc(Cl)cc1Cl)c1cc(OCC(F)(F)F)c2ccccc2n1 775273399 VTUVFRPRLPUIIU-UHFFFAOYSA-N 431.201 4.635 50 10 IJGE O=C(COc1ccc(C=NNC(=O)c2cccc(Cl)c2)cc1)Nc1cccc(Cl)c1 1084110575 NSHBPRFOXPTZMJ-UHFFFAOYSA-N 442.302 4.775 50 10 IJGE Cc1cccc(C)c1-n1c(C)c(Br)c(C=NNC(=O)c2ccccc2O)c1C 1084119877 NHKKVRDBYIKOHF-UHFFFAOYSA-N 440.341 4.943 50 10 IJGE CCOc1ccc(C(=O)NN=Cc2ccc(OCc3ccc(F)cc3)c(OCC)c2)cc1 1084154704 BDEVRJVCAQBMRH-UHFFFAOYSA-N 436.483 4.966 50 10 IJGE C=CCc1cc(/C=C(\C#N)C(=O)N(C)C)cc(Br)c1OCc1ccccc1F 1084620325 DHNMHMBNMATISU-WOJGMQOQSA-N 443.316 4.891 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Br)cc2)c1C)C(C)(C)C 1460801690 MDOWPAVKQBEMGM-DOIQENQNSA-N 438.369 4.928 50 10 IJGE C/C(=C\C(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1)c1ccc(C(F)(F)F)cc1 1641071638 OXIMROGKJUCJIC-QJPKHSJYSA-N 442.437 4.877 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(F)c2)[C@@H]1c1cccc(Cl)c1 1865683717 NQSLSYBXNXWASM-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 1865713089 QMBKRHUYDSXPLD-HXUWFJFHSA-N 449.898 4.664 50 10 IJGE CCc1ccc(OCCCC(=O)NNC(=O)c2ccc(-c3ccc(C)c(C)c3)nc2C)cc1 1865756436 YVTZVKMCGMFWHB-UHFFFAOYSA-N 445.563 4.856 50 10 IJGE COc1cccc(-c2ccc(C(=O)NNC(=O)c3ccccc3SCC(C)C)c(C)n2)c1 1865759026 ZFGRZUNHAKCLAP-UHFFFAOYSA-N 449.576 4.889 50 10 IJGE CN(CCCCCBr)C(=O)c1c(Br)cccc1Br 2033094462 OWSKQIMTSXEVTM-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE C[C@H](CCBr)CCN=[S@@](C)(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C 2044705062 IJBGHXUOOCKYIS-XGZNKIABSA-N 441.476 4.835 50 10 IJGE Clc1cc(CN2C[C@@H](Br)C3(CCC3)C2)ccc1I 2086660442 FAXQQORUOWOCEU-CYBMUJFWSA-N 440.550 4.694 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@H]2[C@H](Cl)CCC[C@H]2C1 2094583816 LTPNHPKYMFNLBR-FXBDTBDDSA-N 427.589 4.753 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)C[C@H]1CCCCN1C(=O)OC(C)(C)C 2106786972 WRUSNVMEMAZHHS-RBUKOAKNSA-N 425.411 4.887 50 10 IJGE CCN(CC)CCCO[C@@H](CI)c1cccc(Br)c1 2119263923 MBEFVJOGKYVGGP-HNNXBMFYSA-N 440.163 4.674 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCCC2)C[C@@H]1CC(F)F 2120812664 SZPBKUNNBBEHOZ-HNNXBMFYSA-N 439.385 4.908 50 10 IJGE ClCc1nc(OCc2cc(Cl)ccc2Br)ncc1Br 2135981867 FBDWEMIPCBSZPD-UHFFFAOYSA-N 426.923 4.973 50 10 IJGE O=C(c1cccc(Br)c1Cl)N1CC[C@@H](Br)C(F)(F)CC1 2150018347 ILCTWPACJHIVBW-SNVBAGLBSA-N 431.502 4.737 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCCN1C(=O)[C@H](Br)C1CCCC1 2167031584 JCMBXNNZOHULSO-RCCFBDPRSA-N 443.426 4.721 50 10 IJGE CN(C(=O)c1cc(Cl)ccc1Br)C1(CBr)CCSCC1 2171182818 VACSXZYSZBEERP-UHFFFAOYSA-N 441.616 4.835 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@@H]1CCN2C[C@@H](CBr)c1ccccc1 2197355197 GINOMPLIYMCOBC-WOIUINJBSA-N 437.422 4.934 50 10 IJGE C[C@H]1[C@@H]([C@H](CBr)NC(=O)OC(C)(C)C)C[C@@H](C)CN1C(=O)OC(C)(C)C 2209050761 TWZCUAFNUVUMFF-QPSCCSFWSA-N 435.403 4.556 50 10 IJGE Cc1sc([C@@H](Br)c2nn(C)nc2Br)c(C)c1Br 2214373005 NLKJNJQETNZMKH-ZETCQYMHSA-N 443.990 4.503 50 10 IJGE Cc1cc(Br)c([C@@H](Br)[C@H]2COCCO2)c(C)c1Br 2220147543 IUDFZUIJBWUPLD-MFKMUULPSA-N 442.973 4.680 50 10 IJGE Fc1cc(Br)cc(F)c1CO[C@@H](CCl)[C@@H](Br)CCl 2259032470 ODBSTDOFKINZQN-KWQFWETISA-N 426.910 4.854 50 10 IJGE CC1CC(CBr)(CN2CCC[C@]2(CNC(=O)OC(C)(C)C)C(F)(F)F)C1 2265303468 CKTQKFDPXHFFKZ-IMRCBTMISA-N 443.348 4.719 50 10 IJGE O=C(N[C@]1(CCl)C[C@H]2CC[C@H]1C2)c1cc(Br)c(Br)s1 2268627720 YGMPDLDOQZSJDK-UPFKWVMWSA-N 427.589 4.801 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2OC[C@@H]3CCC[C@@H]32)cc1I 2269552877 VLTZEJVSLMFACV-LWWSYDQCSA-N 437.115 4.551 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCSC[C@@H]1CCBr 2285845268 YCRFPKBBLXBNGI-QMMMGPOBSA-N 445.579 4.584 50 10 IJGE COC[C@@]1([C@@H](Cl)c2c(F)cc(Br)c(F)c2Br)CCCO1 2288481549 XDDJHDQEKDDFMH-QWHCGFSZSA-N 434.502 4.965 50 10 IJGE CCC[C@H](CCCl)CNC(=O)Cc1cc(Br)cc(Br)c1 2295316229 WASUZZLZCDTFNP-LLVKDONJSA-N 425.592 4.916 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)COc2cccc(C(C)C)c2)c(OCC)c1 2314736116 VYNKOEDULMSURR-UHFFFAOYSA-N 437.492 4.663 50 10 IJGE Clc1ccc(CC[C@H](Br)CN2CCCC2)cc1I 2315550005 YKOIEQIHHDPECF-LBPRGKRZSA-N 442.566 4.737 50 10 IJGE ClCc1ccncc1OCc1ccc(I)c(Br)c1 2325382518 YQPCKICYFUFCES-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE CCc1nn(C[C@H](CBr)CC(C)C)c(CC)c1I 2328540912 WFWHLVAUSBXYKF-NSHDSACASA-N 427.168 4.670 50 10 IJGE O=C(NCC1(CCl)CCCCC1)c1ccc(Cl)cc1I 2365589730 YTHAKBXSEUJRNI-UHFFFAOYSA-N 426.125 4.864 50 10 IJGE C[C@H]1CN(Cc2ccccc2)CCN(c2nc(C(F)(F)F)ccc2CBr)C1 2369840059 NQKUOFVWTBADNV-HNNXBMFYSA-N 442.323 4.954 50 10 IJGE Cc1c(C(=O)N(C)Cc2ccccc2)oc2c1/C(=N/NC(=O)c1cccc(Cl)c1)CCC2 40813362 DBISGPDVTUWCHE-NHFJDJAPSA-N 449.938 4.984 50 10 IJGE N#C/C(=C/c1cn(Cc2ccccc2)nc1-c1ccccc1)C(=O)Nc1ccc2c(c1)OCO2 96438819 JTKBNXVELKPQGN-BKUYFWCQSA-N 448.482 4.873 50 10 IJGE O=C(NCC1(CCBr)CC1)c1ccc(Br)cc1Br 232456257 CECHJFDWQNZLOM-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE ClCc1c(I)cc2sccc2c1I 307302205 NAGFBJQUYQVDGQ-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CI)[C@H](c2cccc(Cl)c2F)C1 382682818 CHDACDDJQDIXPV-ZYHUDNBSSA-N 439.696 4.865 50 10 IJGE O=C(NNC(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1)c1ccc(COc2ccccc2)o1 731185079 DNUAQLQZVFIFOR-GOTSBHOMSA-N 426.472 4.577 50 10 IJGE C/C(=C\C(=O)NNC(=S)Nc1ccc(OC(C)C)cc1)c1ccccc1C(F)(F)F 743820539 MTXSAPMRKCPZQE-WYMLVPIESA-N 437.487 4.914 50 10 IJGE CN1CCC[C@@H](CNC(=O)NNc2cc(C(F)(F)F)ccc2F)[C@@H]1c1cccs1 754646334 MIUJNHMRRLYQCC-YVEFUNNKSA-N 430.471 4.615 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)O[C@H]2COc3cc(Cl)ccc32)c(-c2ccccc2)n1 774517477 GBXMVUIBRXVIFW-AAKHDSTQSA-N 444.878 4.701 50 10 IJGE CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NNc1nc2ccccc2[nH]c1=S 1301148395 PCEXKGFEGNYNSF-UHFFFAOYSA-N 429.527 4.850 50 10 IJGE C=CCc1cc(C(=O)NNc2ccc(Cl)c(Br)c2)cc(OC)c1OC 1456191889 YQBONWVHTGEHNK-UHFFFAOYSA-N 425.710 4.605 50 10 IJGE C=CCC[C@@H](NC(=O)NNc1cc(C)nc(COCC)n1)c1ccc(C(F)(F)F)cc1 1469491895 RIWRXJHALCCTDZ-QGZVFWFLSA-N 437.466 4.674 50 10 IJGE Cc1ccc(-n2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2F)cc1 1865701910 HYQFHUGLOVXIKP-INIZCTEOSA-N 432.352 4.696 50 10 IJGE Cc1cc(-c2csc(/C(C#N)=C(\O)CCN3C(=O)c4ccccc4C3=O)n2)ccc1F 1872749941 ORGCVVGUGYCBRE-JZJYNLBNSA-N 433.464 4.737 50 10 IJGE CCC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1882088524 RXMCAANCDIWADN-OAGGEKHMSA-N 449.430 4.948 50 10 IJGE COc1ccc(C(=O)N(Cc2ccccc2)[C@H](C)CBr)cc1Br 1914228840 OUPMKJUQNVCZIJ-CYBMUJFWSA-N 441.163 4.884 50 10 IJGE N#C[C@H]1CN(c2cc(Br)ccc2CBr)CCN1Cc1ccccc1 1914890561 IKMZRSCVSFJRMR-SFHVURJKSA-N 449.190 4.558 50 10 IJGE CN(Cc1ccc(Br)cc1Br)CC1(CBr)CC1 1915517526 BNRYUNPBRQYOHW-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE C[C@H]1[C@@H](CBr)CCN1C(=O)c1csc(Br)c1Br 1945189475 RBIAUFVFQHAGTK-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE Brc1cccc(C[C@H]2CCOCC[C@@H]2Br)c1Br 2001020153 AHVXOTBCMPQZEA-KOLCDFICSA-N 426.974 4.944 50 10 IJGE CCC(CC)(CBr)CN=[S@](C)(=O)C1CCN(C(=O)OC(C)(C)C)CC1 2044698377 BJTNNNLPEQUMGB-RUZDIDTESA-N 439.460 4.685 50 10 IJGE FC(F)c1ccc(CBr)c(Br)c1I 2054779456 IDWJGYNVRJYOCE-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE Cc1nc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)sc1CBr 2108213687 OHIIOHXGUBQUAV-HCXYKTFWSA-N 432.431 4.693 50 10 IJGE Cc1nc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)sc1CBr 2108213690 OHIIOHXGUBQUAV-YRXWBPOGSA-N 432.431 4.693 50 10 IJGE C[C@@](CI)(OC[C@H]1CCCOC1)c1ccccc1Br 2116006776 RUVYYJQPFWXISZ-WFASDCNBSA-N 439.131 4.543 50 10 IJGE COc1ccc([C@@H](Br)c2c(Br)cnn2C)c(Cl)c1Cl 2138620477 JDAPTPJJCVSEHK-SECBINFHSA-N 428.939 4.982 50 10 IJGE CN(c1ccc(CBr)cc1[N+](=O)[O-])[C@H]1CN(Cc2ccccc2)C(C)(C)C1 2154833918 YLTUOJWXXYPYEK-GOSISDBHSA-N 432.362 4.979 50 10 IJGE CC1(C)C[C@H](CCl)CN(C(=O)c2ccc(I)c(Cl)c2)C1 2172580136 ILULKJBHUYKYKM-SNVBAGLBSA-N 426.125 4.672 50 10 IJGE Clc1nc(Cl)n(Cc2cc(Br)cc3c2OCC3)c1CBr 2175468174 KGAIGGGXLGHGSY-UHFFFAOYSA-N 440.950 4.831 50 10 IJGE O=C(c1cc(Cl)ccc1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@H](Br)C2 2190678753 NEOMXLWGRCMKHS-OQCKYNKVSA-N 425.523 4.581 50 10 IJGE Cc1sc(Br)cc1C(=O)NC[C@@]1(CBr)C[C@@H]1C(F)(F)F 2192585898 IYZOOCJAPBEFIE-KWQFWETISA-N 435.103 4.512 50 10 IJGE CC[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](CC)CN1CCCCCI 2211186076 NMBIUTJIEXVITN-HZPDHXFCSA-N 438.394 4.702 50 10 IJGE ICCCCCN1CCC[C@H]1[C@@H]1CCN(Cc2ccccc2)C1 2211187442 UGZBBZUIFXJYKC-UXHICEINSA-N 426.386 4.578 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CCCN(CC3(CBr)CC(F)C3)C2)C1 2265631654 FXQKSODVSFHXBV-AJPWXKBRSA-N 433.406 4.613 50 10 IJGE COc1ccc([C@@H](Br)CCC2CC(OC)C2)cc1I 2269533891 JCJQGXMEIRJQOW-GDKBPFBDSA-N 439.131 4.941 50 10 IJGE CCc1cc([C@H](Br)[C@]23CCC[C@H]2CS(=O)(=O)C3)sc1Br 2282915394 AKUNIHQWQUTJJK-JKOKRWQUSA-N 442.238 4.724 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)c(I)c2)C[C@@]1(C)CBr 2315552010 YIPGVBJMQYURRQ-QMTHXVAHSA-N 442.566 4.798 50 10 IJGE CC(=O)N(C=C(C#N)C(=O)Nc1ccccc1Sc1ccccc1)c1ccc(N)cc1 2325331888 RHRBONTVNQPRTD-UHFFFAOYSA-N 428.517 4.819 50 10 IJGE CC1(C)COC[C@]1(CBr)Cc1cc(I)ccc1Cl 2327404916 XZQMKGHFSFBKRO-CQSZACIVSA-N 443.550 4.925 50 10 IJGE COC[C@]1(C)C[C@]1(CBr)Cc1cc(I)ccc1Cl 2327405721 PJXFRPCTFVMPIO-KBPBESRZSA-N 443.550 4.925 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](Br)[C@@H](OCC2CCC(C(F)(F)F)CC2)C1 2327996742 RGPBNTGRCWAXFL-HOAMVYINSA-N 430.305 4.755 50 10 IJGE CC1(C)CCC(C)(C)[C@H](Cc2ncc(I)cn2)[C@@H]1Br 2353064510 MNSHASMSJCWNKW-YPMHNXCESA-N 437.163 4.850 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)CNC(=O)c1ncc(Br)cc1Cl 2365869317 VZUBDVFVPPIPKH-GFCCVEGCSA-N 426.580 4.673 50 10 IJGE CN(CC1CC(Br)C1)[C@]1(C(=O)O)CCC(C)(C)C[C@H]1OCc1ccccc1 2374314324 QPUWQBALYRUTLC-OZODEMHJSA-N 438.406 4.711 50 10 IJGE CCCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cccs1 38656640 YMVWLUOWLMPMAN-JOCHJYFZSA-N 432.501 4.974 50 10 IJGE O=C(CSc1nc(-c2ccccc2)cs1)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 40924435 RCXYBKBMVFWZCN-AWQFTUOYSA-N 432.914 4.614 50 10 IJGE COc1cc(/C=N/NC(=O)CSc2ccc(C)cc2)ccc1OCCc1ccccc1 40961822 XPBVRXBOFIHZQA-YZSQISJMSA-N 434.561 4.868 50 10 IJGE Cc1c(/C=N\NC(=O)CC[C@H](O)c2ccccc2)c2ccccc2n1Cc1ccccc1 58888710 RJQICWFYFZZRAU-ZABXAGCJSA-N 425.532 4.962 50 10 IJGE CCCn1ncnc1CC(CBr)(CBr)c1ccc(Cl)cc1 118877003 JQPMCHOAUDGNSQ-UHFFFAOYSA-N 435.591 4.612 50 10 IJGE CCCCCCCOc1ccccc1/C=N\NC(=O)CCc1nc2ccccc2nc1O 169887208 JAAPINJLOXSWSF-ITYLOYPMSA-N 434.540 4.768 50 10 IJGE Cc1cccc(N2CCN(/C=C(/C#N)C(=O)Nc3cc(Cl)ccc3Cl)CC2)c1C 217135747 BSVKENSUJLRKMO-VKAVYKQESA-N 429.351 4.778 50 10 IJGE CC[C@](C)(CCBr)NC(=O)c1ccc(Br)cc1Br 228570281 WUWJKGXMUOTWFA-CYBMUJFWSA-N 441.989 4.895 50 10 IJGE ClCc1cnc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)c(Br)c1 705845072 KRDYCYLQTHAVJB-JKBKZWBZSA-N 446.820 4.930 50 10 IJGE Fc1cccc([C@@H](Br)c2ccc3c(c2)OCCO3)c1I 721698133 NUBQLYPKRAGBJI-AWEZNQCLSA-N 449.057 4.686 50 10 IJGE C[C@@]1(C(=O)NNc2c(Cl)cc(Cl)cc2Cl)CCCN1C(=O)c1ccccc1 734986099 LKBVQTYQTWEUFO-IBGZPJMESA-N 426.731 4.785 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)c1cn(C)c2ccccc12)c1ccc(C(F)(F)F)cc1 749769965 SWKOILCJXJMVTJ-LJQANCHMSA-N 444.457 4.849 50 10 IJGE COc1ccc(NC(=O)[C@H](NNC(=O)c2ccc(C(C)(C)C)cc2)c2ccccc2)cc1 797358627 ODEDVKMIZREDBL-HSZRJFAPSA-N 431.536 4.607 50 10 IJGE CC(C)(C)[Si](C)(C)O[C@H]1CCN(C(=O)CCSCc2nc(O)c3ccccc3n2)C1 1557689861 NYABEQUSWYYVOM-INIZCTEOSA-N 447.677 4.581 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cnc(-c3cccc(Cl)c3)s2)c1C 1650817497 FJLQWAXBZIMTJY-UHFFFAOYSA-N 436.928 4.689 50 10 IJGE COc1ccc(NNC(=O)c2cc3cccc(C(F)(F)F)c3nc2O)c(C(F)(F)F)c1 1654610673 XQMFSPRZMQQKBL-UHFFFAOYSA-N 445.319 4.744 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)Cc3ccc(NC(C)=O)cc3)n2)cc1OC 1872745184 DHTIKDWQQNZIHZ-ZZEZOPTASA-N 435.505 4.821 50 10 IJGE CC(C)[C@@H](/C(O)=C(\C#N)c1nc(-c2ccccc2)cs1)N1C(=O)c2ccccc2C1=O 1872748037 FCDUNTZIKTYHAZ-HUZQBFDWSA-N 429.501 4.924 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)c3ccc(N(C)C)c([N+](=O)[O-])c3)n2)cc1F 1872752675 NQHIJTNUFUTEKG-ZHZULCJRSA-N 440.456 4.882 50 10 IJGE COc1ccccc1-c1csc(/C(C#N)=C(\O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)n1 1872818207 RWZHJTWCPSXLRH-RGEXLXHISA-N 438.421 4.893 50 10 IJGE Cc1csc(C)c1S(=O)(=O)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915177268 SWVKXCNYXPEHAE-QGZVFWFLSA-N 428.417 4.729 50 10 IJGE Cc1c(Br)c(CN(Cc2ccccc2)[C@@H](CBr)C(C)C)nn1C 1915308760 HRZIKZBZQRFRQK-KRWDZBQOSA-N 443.227 4.913 50 10 IJGE Cc1cc(Br)c(F)c(C(=O)N(C)C[C@@H](Cl)COCc2ccccc2)c1 1916335706 UTGRBHHMCABPRT-OAHLLOKOSA-N 428.729 4.793 50 10 IJGE CCN(CCCBr)C(=O)c1csc(Br)c1Br 1937737697 LJNCLMXEWWIEJD-UHFFFAOYSA-N 433.991 4.520 50 10 IJGE C[C@@H](NC(=O)c1csc(Br)c1Br)C(C)(C)CBr 1945187549 XKWTXFASEFHBCC-ZCFIWIBFSA-N 448.018 4.813 50 10 IJGE O=C(C1CC1)[C@@H](Br)Cc1ccc(Cl)c(I)c1Cl 1945187805 FKRZJEVEGZIHTP-QMMMGPOBSA-N 447.925 4.883 50 10 IJGE Cc1csc(CBr)c1S(=O)(=O)N(Cc1ccccc1)[C@H](C)C1CC1 2009640822 XQEUGLMRNUPQFB-CQSZACIVSA-N 428.417 4.941 50 10 IJGE CC1CC(CBr)(NC(=O)c2ccc(Br)cc2Br)C1 2045117524 CLQMJDTVCKNLFX-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE FC1(F)[C@H]2CC(CBr)(Cc3ccc(I)cc3)C[C@@H]21 2045498584 LZTIFUOPAIUMHT-RYUDHWBXSA-N 427.070 4.890 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)C[C@H]1C[C@H]1C(C)(F)F 2046142676 WUXPACCCRSNOEQ-ZACQAIPSSA-N 438.378 4.529 50 10 IJGE C[C@]1(Cn2c(CCl)nc3cncc(Br)c32)CCCN1Cc1ccccc1 2095446266 SKHYYLNVJFAMGP-HXUWFJFHSA-N 433.781 4.987 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@H]1n1c(CCCl)nc2cncc(Br)c21 2095447766 MMQSNYGIMACYSD-RDTXWAMCSA-N 433.781 4.668 50 10 IJGE Cc1cc2nc(CCl)n(C[C@@H]3CN(Cc4ccccc4)CCO3)c2cc1Br 2158582866 NYVFICCHIZJOHW-KRWDZBQOSA-N 448.792 4.747 50 10 IJGE Cc1cc(C(=O)N2CC[C@](CBr)(C(F)(F)F)C2)sc1Br 2167691488 GYWCXBZWOGKFQI-LLVKDONJSA-N 435.103 4.609 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2ccc(CBr)c([N+](=O)[O-])c2)C1 2188576900 KEMYSLQNMPUKEY-IAGOWNOFSA-N 432.362 4.837 50 10 IJGE CC1(C)CN(c2ccc([N+](=O)[O-])cc2CBr)CCCN1Cc1ccccc1 2193718905 DUYGNQWTMNESFP-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE Cl[C@H]1CN(c2ncc(I)cc2Br)C2(CCCC2)C1 2224093300 GRPARFWRVKCWGR-SECBINFHSA-N 441.538 4.579 50 10 IJGE CC[C@H](Br)c1nnc(-c2c(F)cccc2I)s1 2247949469 GYVRRKYINGVESH-LURJTMIESA-N 427.080 4.795 50 10 IJGE CCc1cc([C@H](Cl)c2cnn(C)c2I)sc1Br 2248006048 YDYABBAUJVFRCH-SECBINFHSA-N 445.551 4.739 50 10 IJGE C[C@H](COC(F)F)O[C@H](CI)c1cccc(Br)c1 2253922841 HIMGEKNIHNLMJF-LDYMZIIASA-N 435.046 4.570 50 10 IJGE N#CC(=Cc1cc(Br)c(I)o1)c1nc2ccccc2[nH]1 2293465030 FAOILYXWVMKRBZ-UHFFFAOYSA-N 440.038 4.587 50 10 IJGE COc1ccccc1C=C(C#N)C(=O)N(c1ccc(C)cc1)S(=O)(=O)c1ccc(C)cc1 2314777631 NQZDTJVYNCGBAQ-UHFFFAOYSA-N 446.528 4.641 50 10 IJGE CCO[C@H]1[C@@H](Oc2cc(Cl)c(C)cc2I)C[C@H]1Br 2314953545 LQWIOVMCDQCOEB-OXHMUOHRSA-N 445.522 4.573 50 10 IJGE Clc1ccc(CN2C[C@@H](Br)CC23CCC3)cc1I 2315551100 MGUUNZRJEZYIRR-NSHDSACASA-N 440.550 4.837 50 10 IJGE COc1ccc2c(c1)c(C=NNC(=O)c1ccc(-c3ccc(Cl)cc3)nc1C)cn2C 2321213094 FPJAGZZJHXDYHZ-UHFFFAOYSA-N 432.911 4.975 50 10 IJGE Cc1cc(I)ccc1NC=C(C#N)C(=O)Nc1cccc(C)c1C 2325345563 LDEVAMBXLCCKHF-UHFFFAOYSA-N 431.277 4.675 50 10 IJGE COc1ccc(/C=N/NC(=O)c2[nH]c3ccc([N+](=O)[O-])cc3c2-c2ccccc2)cc1OC 27520401 LOQYIAFXGLQMNY-AFUMVMLFSA-N 444.447 4.524 50 10 IJGE COc1ccc(/C(C#N)=C\c2ccc(OC(=O)c3ccc([N+](=O)[O-])cc3)c(OC)c2)cc1 31902313 LEYDYJYHBWDXRM-UYRXBGFRSA-N 430.416 4.895 50 10 IJGE CCOc1cc(/C=N/NC(=O)CSc2nc3ccccc3s2)ccc1OC(C)C 32520714 SMSAETQQQYMQHU-WSDLNYQXSA-N 429.567 4.725 50 10 IJGE Cc1ccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3)c2[N+](=O)[O-])cc1Cl 40591034 FTIMYWMWFVDBFU-UHFFFAOYSA-N 433.255 4.501 50 10 IJGE Cc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3ccc(Cl)cn3)c(C)c21 40811525 YGFYMCRZJBKJLJ-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE COc1cc(Br)c([C@@H]2CCC[C@@H](CI)O2)cc1OC 382199630 FSXCUUUQBRHBPC-CABZTGNLSA-N 441.103 4.512 50 10 IJGE C[C@@H]1CC[C@@H](CBr)CN1Cc1cc(Cl)ccc1I 688745355 GYBYZONDDKJOIC-MNOVXSKESA-N 442.566 4.940 50 10 IJGE CCC[C@H](CCCl)NC(=O)c1cc(I)ccc1Br 716856646 UUWZSYGIOFOGMH-SNVBAGLBSA-N 444.538 4.581 50 10 IJGE Cc1nc2c(c(O)nn2C)c(C)c1CNC(=O)c1ccc(S(F)(F)(F)(F)F)cc1 759869774 OVQIOTSHWQBEJO-UHFFFAOYSA-N 436.406 4.878 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(CC(C)C)c1C)c1ccc(Br)cc1 1596979004 SEPGLBVBEWMAGA-PZDOZLBDSA-N 438.369 4.921 50 10 IJGE Cc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865698692 ANXXJGOZMSMYHL-JOCHJYFZSA-N 447.901 4.742 50 10 IJGE CC(C)CSc1ccc(C(=O)NNC(=O)COc2ccc(Cl)cc2Cl)cc1 1865758021 FTKXJROTDBDJHT-UHFFFAOYSA-N 427.353 4.582 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCN(Cc2ccccc2)C(C)(C)C1 1881488954 CQPNQBHHUXHHQV-MSOLQXFVSA-N 425.411 4.965 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cc(Cl)cc(Cl)c1 1914351809 BMWKUJKKOWMSID-LBPRGKRZSA-N 437.186 4.968 50 10 IJGE Cc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)CCBr)c2cccnc12 1915100375 FTGLXUDYZJPQJI-KRWDZBQOSA-N 447.398 4.908 50 10 IJGE COc1ccccc1[C@@H](CI)OCCCOCc1ccccc1 1983391630 VYXOHZWZDYYJBY-LJQANCHMSA-N 426.294 4.795 50 10 IJGE CCN(CCCCBr)C(=O)c1scc(Br)c1Br 1996959957 TVJJXSGRGAPZSA-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE CN[C@H](c1ccc(Br)c(C)c1Br)C1CC(Br)C1 2024281149 CSJYJIRSJLKOTG-RPTIHFLNSA-N 425.990 4.954 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1Br 2073313845 ZHJZPIXWAQSTTA-UFBFGSQYSA-N 439.973 4.600 50 10 IJGE CCC(CC)(CCl)NC(=O)c1ccc(Br)cc1I 2086148166 XLMDLKISJRMBSX-UHFFFAOYSA-N 444.538 4.581 50 10 IJGE COCCCCN(Cc1ccccc1)S(=O)(=O)c1cccc(CBr)c1C 2123205951 PFABKKCBFBXGPI-UHFFFAOYSA-N 440.403 4.507 50 10 IJGE CCC(CC)(CBr)CN1CCCC[C@@H]1[C@H]1CCCN(C(=O)C(F)(F)F)C1 2163062445 LITMYFPEPKKKIN-JKSUJKDBSA-N 441.376 4.843 50 10 IJGE CC(C)(C)OC(=O)N1CC([C@H]2CCCN(C[C@H](CBr)c3ccccc3)C2)C1 2163064196 TVDKFJRHADCZIV-OALUTQOASA-N 437.422 4.744 50 10 IJGE C[C@]1(CBr)CC(F)(F)CN1C(=O)c1c(Cl)cccc1Br 2169456454 PQGYXGLDZXRXEK-GFCCVEGCSA-N 431.502 4.737 50 10 IJGE O=C(c1csc(Br)c1Br)N1C[C@@]2(CCl)CCC[C@]2(F)C1 2176642006 WYSPWLGDTPJHNK-STQMWFEESA-N 445.579 4.846 50 10 IJGE C[C@H]1CCC[C@@H](N(C)S(=O)(=O)c2cc(CBr)sc2Br)C1 2179786922 HSBNXKSHAHNEJJ-VHSXEESVSA-N 445.242 4.605 50 10 IJGE CN(CC[C@@H](O)c1ccc(Br)cc1Cl)CC1CC(Br)C1 2196945374 SPADZOUKYRKVOP-MBRGGSNBSA-N 425.592 4.631 50 10 IJGE BrC[C@@H]1CC2(CCCC2)CN1C[C@@H]1CC1(Br)Br 2213087926 KKLRHUCHHBDFDF-QWRGUYRKSA-N 430.022 4.522 50 10 IJGE C[C@@H]1C[C@@]1(F)CO[C@](C)(CI)c1ccccc1Br 2219942502 LSWQOWYQPZUWKJ-LERXQTSPSA-N 427.095 4.864 50 10 IJGE CC1(C)CCN(Cc2ccccc2)CCN1c1ccc([N+](=O)[O-])cc1CBr 2239860348 NUTBGCSZXUFFJT-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE C[C@H]1CC[C@@H](COC2(CI)CCN(C(=O)OC(C)(C)C)CC2)C1 2243469184 GFEQLIXGOZDYDO-LSDHHAIUSA-N 437.362 4.644 50 10 IJGE CCCC1(O[C@H](CI)c2ccc(Br)cc2)COC1 2260091221 IYEQMLIUXFOGEU-CYBMUJFWSA-N 425.104 4.511 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCN(CCCCCCCBr)CCC1(F)F 2263164832 MFYIATAWFUZDFY-HNNXBMFYSA-N 427.374 4.956 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1cc(F)c(NC(=O)OC(C)(C)C)cc1F 2268202955 QXRXZIWFDLLOCT-UHFFFAOYSA-N 433.293 4.557 50 10 IJGE C[C@@H]1C[C@H](Br)[C@@H](C)N(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285847493 BYPLLCPXOMEVKE-MRTMQBJTSA-N 427.539 4.876 50 10 IJGE Cc1scc([C@H](Br)c2cc(S(C)(=O)=O)cs2)c1Br 2320489689 MUFLBISQFSAJQI-NSHDSACASA-N 430.208 4.768 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)NN=Cc1c(Cl)nc2scc(C)n12 2321242913 NEPQWGDFTCDOLQ-UHFFFAOYSA-N 445.882 4.770 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)[C@H]1CCCS1(=O)=O 2339654370 SDIVHOIGKRCLAP-LDYMZIIASA-N 434.552 4.516 50 10 IJGE CC1(C)CC(CBr)(CN(CC2CCC2)C2CN(C(=O)OC(C)(C)C)C2)C1 2345003788 APJAWWQVIDMQCW-UHFFFAOYSA-N 429.443 4.909 50 10 IJGE F[C@]12CCC[C@]1(CCl)CN(Cc1ccc(Cl)c(I)c1)C2 2362380989 UTGJTPYZWFGZPZ-GJZGRUSLSA-N 428.116 4.878 50 10 IJGE Cc1ccc(OCC(=O)N/N=C/c2c(C)nn(Cc3ccccc3Cl)c2C)cc1Cl 59153453 YSTYGNZNYMQYPA-OPEKNORGSA-N 445.350 4.693 50 10 IJGE Cc1ccc(C[C@H]2S/C(=C(\C#N)C(=O)N3CCC(C)CC3)N(c3ccccc3)C2=O)cc1 102438086 HTQCWUCIEFHFOG-QPQMVVSWSA-N 445.588 4.680 50 10 IJGE C[C@@]1(CI)CC[C@H](c2cc(Br)c(Br)o2)O1 307717109 JASXOPKOGXLLGE-XCBNKYQSSA-N 449.908 4.850 50 10 IJGE CC[C@H](C)N(CCCl)C(=O)c1cc(Br)ccc1I 310920153 JQFOXLKARAZVFQ-VIFPVBQESA-N 444.538 4.533 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2Cc1ccc(Cl)o1 698073180 BHQCSFUEXGWLKX-UHFFFAOYSA-N 425.028 4.814 50 10 IJGE CC(=NNC(=O)CCCSc1nc2ccccc2n1C)c1ccc(Br)cc1 1084241204 ZNIZXGDIPPQXPW-UHFFFAOYSA-N 445.386 4.749 50 10 IJGE CCc1cc(Br)ccc1NNC(=O)c1ccc(-c2ccccc2OC)nc1O 1466382752 AJBHECUFVCDOOL-UHFFFAOYSA-N 442.313 4.545 50 10 IJGE C=CC[C@@H](Cc1ccccc1)NC(=O)NNc1cccc(OC(F)F)c1Br 1564913180 HSHJJVIGTCEHKS-AWEZNQCLSA-N 440.288 4.864 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCC12CCN(C(=O)OC(C)(C)C)CC2 1882757002 ZWLVBCHVDJJWKU-GJZGRUSLSA-N 447.414 4.702 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCC[C@H](CNC(=O)OCc2ccccc2)C1 1905523646 HNVWEQNXLAVTPI-UXHICEINSA-N 425.411 4.682 50 10 IJGE O=S(=O)(c1ccc(Br)c(CCl)c1)N(Cc1ccccc1)CC1CC1 1946858677 NBKWGFDNYUYWSW-UHFFFAOYSA-N 428.779 4.789 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1ccc(OCc2ccccc2)cc1 2023034396 SHNZBVDDBAFESQ-KXBFYZLASA-N 437.321 4.845 50 10 IJGE CCC[C@@H](CBr)CN1CCC[C@@H](N(CC(F)F)C(=O)OC(C)(C)C)C1 2044699111 HYUNENMNPYNHKQ-LSDHHAIUSA-N 427.374 4.764 50 10 IJGE Brc1ccc(CN2C[C@H](Br)C3(CCC3)C2)c(Br)c1 2046461185 ABYAAAWNJPTPSO-ZDUSSCGKSA-N 438.001 4.961 50 10 IJGE Cc1cc(Br)c([C@H](Cl)[C@H]2CCCS(=O)(=O)C2)cc1Br 2089861664 UBIZKCAFKHMJTC-TVQRCGJNSA-N 430.589 4.625 50 10 IJGE Brc1cccc([C@@H](CI)OC[C@@H]2CCCCCO2)c1 2096322260 NJCJVRHJHUABTH-LSDHHAIUSA-N 439.131 4.901 50 10 IJGE C[C@@H]1CCN(C[C@H](CBr)c2ccccc2)C[C@H]1CNC(=O)OC(C)(C)C 2106781275 GMWNAHXLIDOQOZ-NZSAHSFTSA-N 425.411 4.648 50 10 IJGE CCN(C[C@H](CBr)c1ccccc1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2106784308 HTOLEKXCQBPEKQ-OALUTQOASA-N 425.411 4.887 50 10 IJGE CC(C)[C@@H](CBr)CN=[S@](=O)(CCNC(=O)OC(C)(C)C)c1ccccc1 2107396603 RHABLKFOSOKYFP-QMTYFTJSSA-N 447.439 4.705 50 10 IJGE COc1ccc(Br)c(CN[C@@H](C)CCCCCI)c1 2117883257 BDNHIAPHPGUYJV-LBPRGKRZSA-N 440.163 4.931 50 10 IJGE COc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)C2CC2)cc1CBr 2123272532 ZTPUSQAQVLWBME-OAHLLOKOSA-N 438.387 4.580 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@H](Br)c2sc(Cl)cc2Br)C1 2137234605 BUFWUUUHJZEVSL-UPZJHPNMSA-N 448.629 4.815 50 10 IJGE CCCN(C(C)(C)C)S(=O)(=O)c1ccc(CBr)cc1Br 2179858779 TVJCSIFWOWMQQZ-UHFFFAOYSA-N 427.202 4.543 50 10 IJGE Cc1sc([C@H](Br)[C@@]23CCC[C@H]2CS(=O)(=O)C3)c(C)c1Br 2201882913 QTONSBQCEUFFMI-LEWSCRJBSA-N 442.238 4.778 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@@H](Cl)c2cc(Br)ccc2Br)C1 2201887660 XMPIOPZXAUPVHH-QCZZGDTMSA-N 442.600 4.706 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCN=c1[nH]nc(C2CCCCCC2)s1 2204981436 ZLNOWQFNZHHUET-UHFFFAOYSA-N 432.681 4.716 50 10 IJGE COc1ccc([C@H](Cl)c2cnn(C)c2Br)c(Br)c1Cl 2268259460 MBJKKEHJBDNHOX-JTQLQIEISA-N 428.939 4.935 50 10 IJGE CS(=O)(=O)[C@H]1C[C@H]([C@@H](Br)c2cc(Br)c(Cl)cc2F)C1 2269773906 WBJCNZQKEMRKCX-NQYJQULFSA-N 434.552 4.501 50 10 IJGE COC[C@@H]1C[C@@H](Br)[C@@H](Cc2cc(I)ccc2Cl)C1 2327404992 AAXUFZHFKDVLRG-OPQQBVKSSA-N 443.550 4.923 50 10 IJGE Cc1cnccc1CO[C@H](CI)c1ccc(Br)cc1 2340085354 QFVQWTCKORLVJF-OAHLLOKOSA-N 432.099 4.845 50 10 IJGE CC1(C(=O)N[C@H](CCBr)COCc2ccccc2)CC2(CC(F)(F)C2)C1 2343412324 OOGRZQLCRJSKTM-MRXNPFEDSA-N 430.333 4.689 50 10 IJGE FC1(F)C[C@]12C[C@@H]2CO[C@@H](CI)c1cccc(Br)c1 2352458051 AMORPLRLLIOZDW-WXHSDQCUSA-N 443.069 4.987 50 10 IJGE N#C/C(C(=O)Nc1ccccc1)=C1\S[C@H](Cc2ccccc2)C(=O)N1c1ccc(F)cc1 1889075 WJVVHEGFWMXKEO-FNBPXTNNSA-N 443.503 4.891 50 10 IJGE Cc1cccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(Cl)c2)c1 38651188 ZRDOPGURKUXCME-DEOSSOPVSA-N 446.890 4.851 50 10 IJGE CCOc1cccc(-c2nn(-c3ccccc3)cc2/C=C(\C#N)C(=O)NCc2cccnc2)c1 39850229 FFTDYHHBVXAKSZ-HYARGMPZSA-N 449.514 4.556 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OCc1ccccc1Cl 231311472 BRBGFWPUVGRCKW-INIZCTEOSA-N 439.721 4.575 50 10 IJGE CCn1c(SCC(=O)NN=Cc2cccc(OCc3ccccc3)c2)nc2ccccc21 254577509 MHKVGSWFNDWDTH-UHFFFAOYSA-N 444.560 4.878 50 10 IJGE O=C(NC1(CCCl)CCSCC1)c1ccc(I)c(Cl)c1 719664783 HAWLBZAHUJHRQQ-UHFFFAOYSA-N 444.165 4.569 50 10 IJGE O=C(NNc1ncncc1Cl)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 782058898 PPLZNTLXZCYLSW-UHFFFAOYSA-N 442.266 4.668 50 10 IJGE Cc1c(NC(=O)NNc2c(F)cccc2Cl)nnn1Cc1ccc(C(F)(F)F)cc1 801798776 KGPULWXGDOPXKI-UHFFFAOYSA-N 442.804 4.595 50 10 IJGE C=C(Cl)CSc1nc(C)c(CC(=O)NNc2ccc(Cl)cc2[N+](=O)[O-])s1 1540988907 AHYZTKVXRBVXAR-UHFFFAOYSA-N 433.342 4.544 50 10 IJGE N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCCO2)c1nc(-c2ccc(F)cc2F)cs1 1872790201 RKGKSCCHTRUMAN-LFYBBSHMSA-N 427.388 4.832 50 10 IJGE CCC[C@@H]1C[C@H]1CO[C@](C)(CI)CN(CC)C(=O)OC(C)(C)C 1897635051 IQJQNSKHZURTIS-RVKKMQEKSA-N 439.378 4.890 50 10 IJGE CN(Cc1csc(Br)c1)C[C@H](Br)COCc1ccccc1 1904143647 IZCQGIUELFSNOG-HNNXBMFYSA-N 433.209 4.923 50 10 IJGE BrC[C@H]1CN(c2ncc(Br)cc2Br)CC12CCC2 1914506900 IKCIRXCHJDNKLT-VIFPVBQESA-N 438.989 4.608 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1cc(Br)ccc1O 1915738240 NUFRRDNFQSCJMK-UHFFFAOYSA-N 441.163 4.971 50 10 IJGE CC[C@H](Cl)c1noc(-c2ccc(Br)cc2I)n1 2026220506 FODUSMRZEWKXRW-QMMMGPOBSA-N 427.467 4.794 50 10 IJGE CC(C)[C@H](Br)CN(C)C(=O)c1cc(Br)cc(Br)c1 2048729818 GAFAUHWMCHUHSO-GFCCVEGCSA-N 441.989 4.703 50 10 IJGE C[C@H]1CCc2nn(-c3cc(Br)cc(C(F)(F)F)n3)c(CBr)c21 2080520349 SPTVCJOIIZMWDX-ZETCQYMHSA-N 439.073 4.993 50 10 IJGE CC[C@H](C)[C@@H](CI)NC(=O)c1ccc(Br)c(Cl)c1 2081235362 FEVWPKJPVXNTBR-QPUJVOFHSA-N 444.538 4.682 50 10 IJGE CCN(C(=O)OC(C)(C)C)[C@@H]1CCCN(C[C@@H](CBr)c2ccccc2)C1 2106781366 HDXZEUJZOKTFKV-RTBURBONSA-N 425.411 4.887 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@@H](Br)C2(CCCC2)C1 2117739562 CRLICVGPYYQQNH-SNVBAGLBSA-N 427.589 4.944 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@@H]1Cl)c1csc(Br)c1Br 2150344912 WIRBUVKPRLQCGR-CMPLNLGQSA-N 435.568 4.908 50 10 IJGE Cc1cc(S(=O)(=O)N(C)[C@H]2CC(C)(C)[C@H]2OCc2ccccc2)sc1CCl 2156441421 GLPQUJQGKLAPCV-LPHOPBHVSA-N 428.019 4.800 50 10 IJGE CC(C)(C)OC(=O)NCC1CCC(CNC(=O)c2ccc(CBr)cc2)CC1 2162589221 NYSQUVZYIFQSPO-UHFFFAOYSA-N 439.394 4.642 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(C[C@@H](CBr)c2ccccc2)C2(CCC2)C1 2174539780 HVOZCPOLNFCGBC-PKOBYXMFSA-N 437.422 4.934 50 10 IJGE O=C(c1cc(Br)ccc1Cl)N1CC[C@@H](C(F)(F)CBr)C1 2197765075 ZAKLFQBYPFLOGQ-MRVPVSSYSA-N 431.502 4.595 50 10 IJGE FC1(F)C[C@@]1(Br)Cn1c(CCCl)nc2ccc(Br)cc21 2202506026 OWWDKNSCHWQXIE-GFCCVEGCSA-N 428.502 4.753 50 10 IJGE O=C(Nc1ccccc1CCBr)c1ccc(F)cc1I 2239251805 SHCIUQHQPIRTRS-UHFFFAOYSA-N 448.073 4.620 50 10 IJGE CC(C)[C@](C)(CCl)NCc1ccc(I)c(Br)c1 2306221721 LFPOUINXADAOEP-ZDUSSCGKSA-N 430.555 4.797 50 10 IJGE C[C@@H]1CCN(Cc2ccc(I)c(Br)c2)[C@@H]1CCl 2306222254 ROJRWGWSFCUBMF-NOZJJQNGSA-N 428.539 4.503 50 10 IJGE C[C@@H]1C[C@@H]1N(CCCl)Cc1ccc(I)c(Br)c1 2306225110 UZRTZWYVUPEUSM-RNCFNFMXSA-N 428.539 4.503 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1Cc1cc(I)ccc1Cl 2307320782 WIMCSEBZMSAEAV-ZANVPECISA-N 428.539 4.692 50 10 IJGE BrC[C@H]1C[C@@H]2CN(Cc3ccc(Br)cc3Br)C[C@H]12 2309714661 DMDHFDYIXMUSMU-NQBHXWOUSA-N 438.001 4.674 50 10 IJGE CC(C)[C@@H]1C[C@@H](Br)CN1Cc1ccc(Cl)c(I)c1 2321369929 WMSGEMOHJRVVRG-RISCZKNCSA-N 442.566 4.938 50 10 IJGE CCCCc1nc(CC(=O)NN=Cc2ccc(OCc3ccccc3)c(OC)c2)cs1 2325902207 JCMKCXUTFOJCBM-UHFFFAOYSA-N 437.565 4.766 50 10 IJGE CCOc1ccc(-c2csc(C(C#N)=C(O)CNC(=O)c3ccccc3)n2)c(OCC)c1 2331389014 GXUBIRVTVMXELS-UHFFFAOYSA-N 449.532 4.830 50 10 IJGE CNC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccc(OCc2ccccc2)cc1 33599876 YILLWRLIWCDPIR-JWGURIENSA-N 434.499 4.771 50 10 IJGE CCCCOc1ccc(/C=C2/C(=O)N(Cc3ccc(OC)cc3)C(=O)C(C#N)=C2C)cc1 40514679 ZDCBPJQWTWBEPB-HZHRSRAPSA-N 430.504 4.667 50 10 IJGE CCCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccccc4)ccc32)c1 40529740 UNYVCIFDEPUUFR-AREMUKBSSA-N 440.499 4.842 50 10 IJGE Cc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)N(C)Cc3ccccc3)c(C)c21 40811549 VIBAMILPAWHVIO-SZXQPVLSSA-N 429.520 4.639 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)Nc2nccs2)c(Br)cc1OC(C)C 96438843 OOQIFYVRNYXIQV-QPEQYQDCSA-N 436.331 4.637 50 10 IJGE CC[C@H](CBr)COc1c(Br)cc([N+](=O)[O-])cc1Br 96869929 YVYMECJEUJCZFU-SSDOTTSWSA-N 445.933 4.920 50 10 IJGE CCCC[C@@H](CC)CC(CBr)(CBr)[C@@H]1CCS(=O)(=O)C1 118875323 VRHAHKUEDKMAGX-ZIAGYGMSSA-N 432.262 4.804 50 10 IJGE BrCC(CBr)(Cc1ccccc1)Cc1cn2ccsc2n1 149645768 ZNEWLAPNFPUEMK-UHFFFAOYSA-N 428.193 4.957 50 10 IJGE CCOc1cc(/C=N\NC(=O)Cc2ccc(Cl)cc2)cc(Br)c1OCC 169901902 FCRUAPUINDOMPJ-UUYOSTAYSA-N 439.737 4.593 50 10 IJGE COc1ccc(Cc2nc3cc(C(=O)N/N=C\c4ccc(OC(C)C)cc4)ccc3[nH]2)cc1 169925539 JIIXCMMMMOOVCU-YUMHPJSZSA-N 442.519 4.713 50 10 IJGE O=C(F)C(F)(F)O[C@@](F)(OC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F 198781785 SHJLDESSUGWECW-MRVPVSSYSA-N 448.053 4.720 50 10 IJGE CCOc1ccccc1NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc([N+](=O)[O-])c2)c1C 209432893 KVTZETCYMQTDHG-UYRXBGFRSA-N 430.464 4.947 50 10 IJGE COc1ccc(C=NNC(=O)CSc2nc3ccccc3o2)cc1OCc1ccccc1 254838273 LHKMLUGTOBURFR-UHFFFAOYSA-N 447.516 4.658 50 10 IJGE CC(=O)[C@H](Br)[C@@H](C)c1ccc(I)c(Br)c1 300892028 FZBGHOVANDXODO-UPONEAKYSA-N 445.920 4.510 50 10 IJGE ClCc1nc2ccc(Br)cc2n1CC[C@H]1CN(Cc2ccccc2)CCO1 312579390 UPHZIAXWAVIEAO-SFHVURJKSA-N 448.792 4.829 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21 404188630 CUWWHMDTTUAIOO-FGZHOGPDSA-N 437.466 4.943 50 10 IJGE O=C(CBr)c1c(OC(F)F)ccc(Br)c1OC(F)(F)F 575683851 FBBXVHFLCIQJTL-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE COc1ccc(Br)c(C=NNC(=O)[C@@H](C)Oc2cccc3ccccc23)c1 606518265 UJLBFLPAYIDDTG-CQSZACIVSA-N 427.298 4.529 50 10 IJGE CC[C@H](C[C@H](C)Cl)NC(=O)c1cc(I)ccc1Br 716927253 UVXABHPBJOOFKT-WCBMZHEXSA-N 444.538 4.580 50 10 IJGE O=C(c1scc(Br)c1Br)N1[C@H]2CC[C@H]1CC(CCl)C2 719252373 ZELNMQZMCBVYJC-IUCAKERBSA-N 427.589 4.895 50 10 IJGE CC(=C\c1ccc(Cl)cc1)/C=C(\C#N)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 753716326 YDMOKJIQYZVUGX-PQOPAYJDSA-N 432.911 4.630 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNC(=O)N[C@H]3CCCC(F)(F)C3)c3ccccc3n2)cc1 769184365 LLMZIMOEMWAWCC-KRWDZBQOSA-N 438.478 4.732 50 10 IJGE COc1cc(C=NNC(=O)c2cc3cc(Br)ccc3o2)ccc1OC(C)C 1084114690 TUEKBIHFLSKPAS-UHFFFAOYSA-N 431.286 4.755 50 10 IJGE C#C[C@H](NC(=O)NNC(=O)c1cc2c(s1)CCCCCC2)c1ccc(Cl)cc1F 1312938681 ZHOGLQQOTGZPBC-KRWDZBQOSA-N 433.936 4.518 50 10 IJGE C=CCOc1ccc(/C=C\C(=O)NNc2ccc(Br)cc2Cl)cc1OC 1569967808 SDHRJAUAXMMNSP-UITAMQMPSA-N 437.721 4.832 50 10 IJGE CCCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccccn1)C(C#N)=C(N)O2 1865700065 KHUMXEWRSFCVNX-LJQANCHMSA-N 440.334 4.804 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)c3cccc(C(F)(F)F)c3)c(C)n2)cc1 1865758628 KBWKMNHVSKOVED-UHFFFAOYSA-N 427.426 4.713 50 10 IJGE COc1ccc(OC)c(-c2csc(/C(C#N)=C(\O)Cc3ccc(NC(C)=O)cc3)n2)c1 1873920444 FTWFWHHCZHFKAK-VZCXRCSSSA-N 435.505 4.821 50 10 IJGE CC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1880767769 SBAICNRSXNAYJK-ILXRZTDVSA-N 435.403 4.558 50 10 IJGE O=S(=O)(c1ccccc1CBr)N(Cc1ccccc1)Cc1ccccc1 1880811016 WRNADPGRXOQMFF-UHFFFAOYSA-N 430.367 4.973 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CC[C@H]2[C@@H](CCN2C(=O)OC(C)(C)C)C1 1882086693 DKDNOIRHHSBGMX-QXSJWSMHSA-N 447.414 4.700 50 10 IJGE CCc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@@H](CBr)C(C)C)s1 1915291101 LPJFNAQQEUGPQG-KRWDZBQOSA-N 430.433 4.921 50 10 IJGE C[C@@H]1OCCO[C@H]1[C@H](Br)c1sc(Br)cc1Br 1922880501 DRHRSWFAVPOAPQ-WLGLDCGKSA-N 434.975 4.513 50 10 IJGE O=C(NC1CC(CCBr)C1)c1cc(Br)sc1Br 1942857551 BRMJAPJHHAHJCZ-UHFFFAOYSA-N 446.002 4.567 50 10 IJGE C[C@H]1OCC[C@@]1(CBr)Cc1c(Br)cccc1Br 1945331055 PPWCAOFRXFSCQQ-RNCFNFMXSA-N 426.974 4.944 50 10 IJGE CC[C@@H](Br)[C@H](C)NC(=O)c1c(Br)cccc1Br 1945331484 SMUHMMRUGWMVCX-JGVFFNPUSA-N 427.962 4.503 50 10 IJGE C[C@@H]1[C@H](CBr)CCN1Cc1c(Br)cccc1Br 1945333749 UQJFVAZRDIISJG-ZJUUUORDSA-N 425.990 4.817 50 10 IJGE Fc1ccc([C@H](Cl)c2cc(I)sn2)cc1Br 1983291082 PXARSNDIBVHCDJ-JTQLQIEISA-N 432.483 4.978 50 10 IJGE O=C(N[C@H]1CCC[C@H](Br)C1)c1c(Br)cccc1Br 2033089438 SWMKAIUGCXEBON-IUCAKERBSA-N 439.973 4.648 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc([S@@](C)(=O)=NC[C@H](CBr)C2CC2)cc1 2044703532 VNYSQIPHVBBCOL-HWRSSNJWSA-N 431.396 4.911 50 10 IJGE CC(C)[C@H]1[C@@H](Br)CCN1Cc1ccc(I)c(Cl)c1 2086660067 BELXRWUUXCNYJB-FZMZJTMJSA-N 442.566 4.938 50 10 IJGE Clc1cccc(CBr)c1N1CCCN(Cc2ccccc2)CCOCC1 2088627544 DTFASDXYWRHXEK-UHFFFAOYSA-N 437.809 4.964 50 10 IJGE C[C@H](Cl)c1nc2cncc(Br)c2n1Cc1cnn(Cc2ccccc2)c1 2095438758 ZYEJJBHKSQQXAL-ZDUSSCGKSA-N 430.737 4.787 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CC2(CBr)CCCCC2)C[C@@H]1C(F)(F)F 2106783004 VYUDKSFCQYTOOA-KBPBESRZSA-N 443.348 4.719 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](C(F)(F)F)CCN1C[C@@H](CBr)C1CC1 2107587288 UQDODWPJUPPSQF-ILXRZTDVSA-N 443.348 4.575 50 10 IJGE Clc1cc(CBr)ccc1N1CC[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 2129054982 QODNIQRYVZTZMY-SFTDATJTSA-N 435.793 4.715 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@H](Br)[C@@H]1CCCCS1(=O)=O 2137644668 ZIGHWSFNISNRKX-STQMWFEESA-N 430.589 4.814 50 10 IJGE COc1cc(Cl)c([C@@H](Cl)c2cc(Br)n(C)n2)cc1Br 2137648179 LIOULFCKYHKRNM-GFCCVEGCSA-N 428.939 4.935 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CC[C@H](CCl)C(F)(F)C1 2148753725 SJSOFJPVAOWSTL-MRVPVSSYSA-N 431.502 4.548 50 10 IJGE CC(C)(C)OC(=O)NCCC[C@H]1CCCCN1C(=O)c1ccc(CBr)cc1 2163058679 MOHCMCFNFWMPGF-GOSISDBHSA-N 439.394 4.881 50 10 IJGE CCc1nc(C(=O)NC[C@H](CBr)CC(C)(C)C)c(Br)s1 2169492384 PGXUOHQGEMRRPE-VIFPVBQESA-N 426.218 4.645 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@]2(CCCN2C(=O)c2ccc(CBr)cc2)C1 2182064861 NFUQXZRTXRTQMZ-OAQYLSRUSA-N 437.378 4.587 50 10 IJGE FC(F)(F)[C@]1(CCl)CCN(Cc2ccc(I)c(Cl)c2)C1 2208035124 BZGXHLZCVYWPFO-LBPRGKRZSA-N 438.058 4.938 50 10 IJGE Fc1cc2nc(CCCl)n(C[C@H]3CC3(Br)Br)c2cc1F 2233042035 VLECZOUYGZATNB-SSDOTTSWSA-N 428.502 4.602 50 10 IJGE Cc1cc(Br)c(C(=O)N2C[C@@]3(F)CCC[C@@]3(CBr)C2)s1 2237633430 LMNZLKSJLJIJJF-KGLIPLIRSA-N 425.161 4.548 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@H]2C[C@]23CCOC3)c1 2263526186 QBQOCELACKYOMI-RDBSUJKOSA-N 438.985 4.944 50 10 IJGE O=C(N1CCC[C@H](C2CCN(CCCCCCCBr)CC2)C1)C(F)(F)F 2294698790 KCHCRIRQIWQGTD-KRWDZBQOSA-N 441.376 4.845 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@@H](Br)[C@@H]1[C@H]2COC[C@H]21 2317403306 NBKGETAOAXXVAW-GJOTXNKNSA-N 442.948 4.988 50 10 IJGE CCOc1cc(C=C(C#N)c2nc3ccccc3n2CC)ccc1OCC(=O)N(CC)CC 2323840813 ZFWZYYFNOYDYGZ-UHFFFAOYSA-N 446.551 4.766 50 10 IJGE CC(C)[C@H]1C[C@@H](Br)CN1Cc1cc(I)ccc1Cl 2327398784 IRVJLRPHGPNTDT-BXUZGUMPSA-N 442.566 4.938 50 10 IJGE N#CC(=C(O)[C@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 2331281227 WJOXIXHZMPHCSZ-KRWDZBQOSA-N 446.488 4.560 50 10 IJGE Cc1sc(Br)cc1C(=O)N1CC[C@H](Br)C[C@@H]1C(F)(F)F 2361459039 QEVPMJPTPYATMC-IONNQARKSA-N 435.103 4.749 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(OC)cc4)ccc32)c1 38684838 WQKBAYBDNKWIQF-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE Cc1ccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2[N+](=O)[O-])cc1C 40590175 URELWBHDIMJLHR-UHFFFAOYSA-N 447.282 4.809 50 10 IJGE CCOC(=O)c1c(NC(=O)N/N=C/c2ccc(Cl)cc2Cl)sc2c1CCC2 40846117 CPEIRHJLXNWBNU-ZVBGSRNCSA-N 426.325 4.876 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc(N)cc2)ccc1OCc1ccc(Cl)c(Cl)c1 169900205 RHVPZXFKHBUUPC-ZRGSRPPYSA-N 444.318 4.927 50 10 IJGE N#C/C(=C\c1ccccc1)C(=O)N1CCC2(CC1)CC(=O)c1cc(Cl)cc(Cl)c1O2 170523267 JFEANSABVOXLPD-MHWRWJLKSA-N 441.314 4.927 50 10 IJGE C[C@@H](Br)CCN(C)C(=O)c1cc(Br)c(Br)s1 219988465 WXQRVYFAFKBSMB-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE BrCc1ncoc1-c1cc(I)ccc1Br 232484188 FMDBHTIMVOWAPP-UHFFFAOYSA-N 442.876 4.604 50 10 IJGE COc1cccc(C=NNC(=O)c2cc(-c3ccc(OCc4ccc(C)cc4)cc3)[nH]n2)c1 254446931 OUVKXOHGEVTBHW-UHFFFAOYSA-N 440.503 4.737 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@@H](c2ccc(F)c(Br)c2)C1 382693831 ANTMUFJZZCQKOM-VXGBXAGGSA-N 437.147 4.934 50 10 IJGE Cc1ccc([C@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CI)cc1 382710625 HAXPYIGQDNGGMF-RTBURBONSA-N 435.305 4.782 50 10 IJGE BrC[C@@H](Nc1ncc(Br)cc1Br)C1CCCC1 386221622 INCQVQNNSWCGOX-LLVKDONJSA-N 426.978 4.972 50 10 IJGE C[C@]1(Cn2c(CCl)nc3cc(Br)cnc32)CCN(Cc2ccccc2)C1 388452347 YOVUPKDJNPPHHU-FQEVSTJZSA-N 433.781 4.845 50 10 IJGE CC(C)(C)OC(=O)NCCN1CCN[C@H](c2ccccc2CO[Si](C)(C)C(C)(C)C)C1 616601073 FJBVTUUONSNRMV-NRFANRHFSA-N 449.712 4.679 50 10 IJGE CC(C)(C)S(=O)(=O)CCC[C@H](CBr)c1ccccc1Br 718763082 NYOGIVBOCTYVPO-GFCCVEGCSA-N 426.214 4.921 50 10 IJGE C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799754206 HDMXHHKZVGWPTE-AWEZNQCLSA-N 440.425 4.878 50 10 IJGE O=C(NNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(O)c(C(F)(F)F)c1 1298447519 VQYYHOMEOCTTOZ-UHFFFAOYSA-N 433.230 4.601 50 10 IJGE CC(=O)c1cccc(OCc2cc(C(=O)N3CC[C@@H](O[Si](C)(C)C(C)(C)C)C3)no2)c1 1647816472 JWRAGUZIJSKGED-LJQANCHMSA-N 444.604 4.693 50 10 IJGE C=CCCC[C@@H](NC(=O)NNC(=O)c1ccc(F)cc1Br)c1ccccc1 1684989107 OTSGKPOXWBSHAI-GOSISDBHSA-N 434.309 4.630 50 10 IJGE COCCc1nc(Nc2ccc(SC#N)cc2)cc(N2CCO[C@@H](c3ccccc3)C2)n1 1868253452 HYGXTLCRMCAXOD-OAQYLSRUSA-N 447.564 4.560 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCN(CC3(CBr)CCC3)C2)C1 1879198674 OTMDECZOXHWFDD-ROUUACIJSA-N 429.443 4.911 50 10 IJGE CCc1nn(C)c(CN(Cc2ccccc2)C[C@H](C)Br)c1Br 1914639237 RSVJUOBDAKIHPH-ZDUSSCGKSA-N 429.200 4.531 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@H]1CCCC[C@H]1C(F)(F)F 1916349721 VXADKJXIXMQIQQ-YESZJQIVSA-N 436.312 4.794 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2nc3ccccn3c2CBr)C1 1921468415 DTCYWSHOYFNYFY-ZWKOTPCHSA-N 427.390 4.576 50 10 IJGE O=C(c1cncc(C(F)(F)F)c1)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1921649232 ZOJWIWXPASXNJO-KRWDZBQOSA-N 427.264 4.916 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1Cc1c(Br)cccc1Br 1945333845 VTDPYMMOUTXBRN-ONGXEEELSA-N 425.990 4.959 50 10 IJGE Clc1cc(I)ccc1-n1cnc(Cl)c1CBr 1982517284 VHJFJXHKKVBSLT-UHFFFAOYSA-N 431.886 4.679 50 10 IJGE FC(F)CN(CCBr)Cc1cc(Br)ccc1Br 2006502835 HHBZVKOBNQWTFD-UHFFFAOYSA-N 435.932 4.674 50 10 IJGE Clc1cc(C[C@]2(CBr)CC=CCO2)ccc1I 2026562412 ASQFWGIFLQNWKW-ZDUSSCGKSA-N 427.507 4.597 50 10 IJGE CC(C)[C@H](Br)c1cn(-c2ccc(Cl)cc2I)nn1 2057429961 UVKJKKXDWZAUJI-LBPRGKRZSA-N 440.510 4.617 50 10 IJGE FC(F)(F)c1c(I)cc(I)cc1CCl 2060240196 JNBMEDZSHGBUQX-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE C[C@@]1(NC(=O)c2cc(Br)cc(Br)c2)CCC[C@H]1Br 2062572910 FIJUKDSUBRDZIV-DGCLKSJQSA-N 439.973 4.648 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CC2(CBr)CCCCC2)CC(F)(F)C1 2064309952 HNSJMUXPTDQEHV-AWEZNQCLSA-N 425.358 4.566 50 10 IJGE CN(C(=O)OC(C)(C)C)C1(C)CCN(C[C@H](CBr)c2ccccc2)CC1 2106787845 KZDITCJCEMYVSU-SFHVURJKSA-N 425.411 4.887 50 10 IJGE O=C(NC[C@H]1C[C@H](Cl)C12CCC2)c1cc(Br)c(Br)s1 2115599233 LWKJSPVXUCRVMM-XCBNKYQSSA-N 427.589 4.801 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@H]2[C@H](Br)CCC[C@H]2C1 2115923573 HUKFNEWHVZUKHS-DJLDLDEBSA-N 427.589 4.800 50 10 IJGE CCC[C@@H](Cl)CCNS(=O)(=O)c1cc(Br)c(C)cc1Br 2146561983 NRSLHSPWLIAYCV-SNVBAGLBSA-N 447.620 4.596 50 10 IJGE Fc1cnc2c(c1)nc(CCl)n2Cc1scc(Br)c1Br 2150563599 QZQMTZMHSZBUMH-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE Cc1cnc(N2C[C@@]34CCC[C@]3(CN(Cc3ccccc3)C4)C2)c(CBr)c1 2159684963 BRGGTIRMMSFSLO-GOTSBHOMSA-N 426.402 4.777 50 10 IJGE CC1(CO[C@](C)(CI)CNC(=O)OC(C)(C)C)CC2(CCC2)C1 2211602306 QQLGWVMVASQZGB-QGZVFWFLSA-N 437.362 4.692 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc2c(c1)CCN(CC1(CBr)CC(F)C1)C2 2265633565 WZBCPSNVUNLHEF-UHFFFAOYSA-N 427.358 4.905 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@@H]1C[C@H](Br)C2 2282978721 QKPUWMLXBDHCGR-AYMMMOKOSA-N 425.523 4.772 50 10 IJGE C[C@@H](Cl)C[C@@H]1CCCCN1C(=O)c1ccc(Cl)c(I)c1 2283652248 RSQFFNGVHBESQP-PWSUYJOCSA-N 426.125 4.957 50 10 IJGE CC(C)(C)c1ccc(C=NNC(=O)C(=Cc2cccs2)NC(=O)c2ccccc2)cc1 2297451133 UUJWJJHVGXGDOP-UHFFFAOYSA-N 431.561 4.967 50 10 IJGE CC(CC(=O)Nc1ccc(Cl)cc1Cl)=NNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 2297710500 MHWXZTCLMWRDAT-UHFFFAOYSA-N 443.674 4.690 50 10 IJGE Brc1ccc(CN2C[C@H]3CC[C@H](Br)[C@H]3C2)c(Br)c1 2308237521 LVAIOBHNIRAOHB-ICCXJUOJSA-N 438.001 4.817 50 10 IJGE CCCN1C[C@H](Cc2ccc(Cl)c(I)c2)[C@@H](Br)C1 2315548560 IIMLQPMNCQZRQI-RYUDHWBXSA-N 442.566 4.592 50 10 IJGE Clc1ccc(CN2CCC23CC(CBr)C3)cc1I 2315554996 LURZYYKRBQHJGX-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE CCCN(CCCBr)C(=O)c1ccc(Cl)cc1I 2317774226 HFZDNXSQOIPCGO-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE CCN(CC)C[C@@H](Cl)CCc1ccc(I)c(Br)c1 2325208218 GGDVQLJQYGPCOO-LBPRGKRZSA-N 444.582 4.936 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc(Br)cc2)sc(C)c1C 2329663780 PRYCDEICGPBFBN-UHFFFAOYSA-N 433.327 4.850 50 10 IJGE O=C(N[C@@H]1CCCC[C@@H]1CCCl)c1ccc(Cl)cc1I 2365600239 ZTHHENDPKPBMLB-QMTHXVAHSA-N 426.125 4.862 50 10 IJGE CCOc1cccc(N2C[C@H]3C[C@@H](CN(Cc4ccccc4)C3)C2)c1CBr 2367571169 WRKAHVBPNJDTQT-PMACEKPBSA-N 429.402 4.939 50 10 IJGE CC(C)c1ccc(C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2Br)cc1 10452057 DOVZTXVMJOYPNY-UHFFFAOYSA-N 447.373 4.710 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)c3ccc(Cl)cc3)cc2)cc1 12492003 YFTWEMZLIWVFAP-UHFFFAOYSA-N 449.938 4.965 50 10 IJGE C=CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccccc4)ccc32)c1 40529945 YFAWREXVIGICCA-AREMUKBSSA-N 438.483 4.618 50 10 IJGE Cc1cc(C)c2c(CC(=O)N/N=C3\CCCc4oc(C(=O)NC(C)(C)C)c(C)c43)coc2c1 40826866 QEVPBOKDFMWFCU-MTDXEUNCSA-N 449.551 4.879 50 10 IJGE O=c1c2ccccc2nc(CCl)n1-c1ccc(Br)cc1Br 49185965 DVPDAYZHPAUPRG-UHFFFAOYSA-N 428.511 4.650 50 10 IJGE O=C(c1ccc(Br)c(C(F)(F)F)c1)N1CC[C@H](CCBr)C1 125079179 DODPWFXJGQBPLD-VIFPVBQESA-N 429.074 4.715 50 10 IJGE CCCCCOc1ccc(/C=C\C(=O)Oc2cccc(/C=C(/C#N)C(=O)OC)c2)cc1OC 206679653 TZSJAYFVCLENOD-BGVZQIFQSA-N 449.503 4.963 50 10 IJGE C=CCN1C(=O)C(C#N)=C(C)/C(=C/c2cn(-c3ccccc3)nc2-c2cc(C)ccc2C)C1=O 214352041 QKVLOWVQCSTTBJ-IWIPYMOSSA-N 448.526 4.934 50 10 IJGE CC(C)(C)C[C@@H](CBr)NS(=O)(=O)c1ccc(Cl)c(Br)c1 393462081 AHCMFAMTAHSZSC-VIFPVBQESA-N 447.620 4.581 50 10 IJGE CC[C@H](O[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1I)c1ccccc1 403286805 RWYRVQQSCYKYQD-OWCLPIDISA-N 431.314 4.577 50 10 IJGE CCN(Cc1cc(Cl)ccc1I)C(C)(C)CBr 688428378 VJAHNBCCBJNHSA-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)Nc2ccc3c[nH]nc3c2)c(-c2ccc(Cl)cc2)n1 727723041 CUUHPGMKQJJURG-YVLHZVERSA-N 441.882 4.539 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)c1C 751390795 DZBLHKSZXKOPNG-MBWAJUJLSA-N 445.489 4.747 50 10 IJGE Cc1cc(Br)cc(C=NNC(=O)c2cccc3cccnc23)c1OC(F)F 777886529 NGHKHNKBLARLAW-UHFFFAOYSA-N 434.240 4.671 50 10 IJGE CC(=O)c1ccc(NC(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)cc1Cl 783559933 BDQSRVUMVXYAGN-JZVSFUAJSA-N 425.916 4.686 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2CC3(CCC3)[C@@H]2C2CC2)c(-c2ccc(Cl)cc2)n1 793428384 AXANJSAKWVZLPW-FMTUWFKASA-N 445.954 4.815 50 10 IJGE C/C(=C/C(=O)NNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1)c1cccs1 1457532715 YTDDBOOAYYOBPX-SQFISAMPSA-N 448.573 4.781 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N[C@H](C)c2ccc3nc(O)oc3c2)c(C)n1-c1ccccc1F 1534335192 YWMFPDVSENTWTE-MXDDHBLUSA-N 444.466 4.864 50 10 IJGE Cc1c(O)nc2ccccc2c1C(=O)NNC(=O)Nc1c(Cl)cc(Cl)cc1Cl 1556340179 GWACNWATIRZSMR-UHFFFAOYSA-N 439.686 4.676 50 10 IJGE CC(=O)CCc1ccc(O[C@@H](C)C(=O)NNc2c(Cl)cccc2Br)cc1 1651127053 OUXVBPBZTWYOGZ-ZDUSSCGKSA-N 439.737 4.535 50 10 IJGE CCCc1nn(Cc2ccc(F)cc2)c2c1[C@@H](c1cccc(OCC)c1)C(C#N)=C(N)O2 1865689509 AWYXDQGOCSDBLO-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)[C@H]3CC(=O)N(Cc4ccccc4)C3)n2)cc1 1872746090 RBLYQYRLBVQZEW-FGLUDEAJSA-N 431.517 4.660 50 10 IJGE ClC[C@@H]1CCC[C@H](Nc2ncc(I)cc2Br)C1 1909172232 KNBBZGZARIHSLV-SCZZXKLOSA-N 429.527 4.658 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1F 1915097260 SJCQLEKTGCDSGL-CYBMUJFWSA-N 427.245 4.689 50 10 IJGE Cc1cnc2c(S(=O)(=O)N(Cc3ccccc3)[C@@H](C)CCBr)cccc2c1 1915110539 OEJRAFWOVMNFHT-KRWDZBQOSA-N 447.398 4.908 50 10 IJGE O=C(NC1(CCCBr)CC1)c1csc(Br)c1Br 1945189032 HCLULKMVFLRUGW-UHFFFAOYSA-N 446.002 4.711 50 10 IJGE CC[C@H](Br)CN(CC)C(=O)c1csc(Br)c1Br 1999378841 YXKGQQYQEKIKKL-ZETCQYMHSA-N 448.018 4.909 50 10 IJGE C[C@](CCl)(NC(=O)c1csc(Br)c1Br)C(F)(F)F 2043177618 WGGAYUYCRUIOMH-MRVPVSSYSA-N 429.483 4.563 50 10 IJGE C[C@H](NC(=O)[C@@H](Br)C1CCCC1)c1csc(NC(=O)OC(C)(C)C)n1 2051203798 JPIWLELBWVIGFT-GWCFXTLKSA-N 432.384 4.621 50 10 IJGE CC1(C)C[C@H](O[C@H](CI)c2cccc(Br)c2)CO1 2052239725 HTRJEFGOMDLOKB-QWHCGFSZSA-N 425.104 4.509 50 10 IJGE Clc1ccc(Br)c(COC2(CI)CCOCC2)c1 2080301108 CQOGATRMRXVRHF-UHFFFAOYSA-N 445.522 4.603 50 10 IJGE CN(C[C@@H]1CCCCN1C[C@H](CBr)c1ccccc1)C(=O)OC(C)(C)C 2106785238 NWRZSTADIMWZRY-OALUTQOASA-N 425.411 4.887 50 10 IJGE CN(CC1CCN(C[C@@H](CBr)c2ccccc2)CC1)C(=O)OC(C)(C)C 2106787071 HHPPXZYYWGMYHU-LJQANCHMSA-N 425.411 4.744 50 10 IJGE CCCN(CC(C)(C)CNC(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2110717983 NAQPTIZFBHAXHH-MRXNPFEDSA-N 433.431 4.730 50 10 IJGE O=C(NC1(CCBr)CCSCC1)c1cc(Br)c(Cl)s1 2115945514 PLNLGKXSAYWMDZ-UHFFFAOYSA-N 447.645 4.945 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)[C@H]1CCN(C(=O)OC(C)(C)C)CC12CC2 2185893400 NAESYWDQNWRWPZ-MOPGFXCFSA-N 437.422 4.887 50 10 IJGE CCn1cc(Br)c([C@@H](Br)c2cc(Cl)c(F)cc2OC)n1 2207380371 YLWAKGZUPYZVMY-LBPRGKRZSA-N 426.511 4.951 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCCCC12CN(C(=O)OC(C)(C)C)C2 2209328650 UFCODQNACMGEIA-CABCVRRESA-N 447.414 4.702 50 10 IJGE Cc1c(F)ccc([C@@H](Br)c2cc(I)sn2)c1F 2216948602 ROIKBNHDWQOIFQ-SNVBAGLBSA-N 430.055 4.819 50 10 IJGE CSCC[C@@H](Br)CCNC(=O)c1sc(C)c(C)c1Br 2229321345 DBAILMZZMYXZFX-JTQLQIEISA-N 429.243 4.764 50 10 IJGE CC(C)(C)OC(=O)N1[C@H](CNC(=O)c2ccc(CBr)cc2)CCC12CCC2 2233850206 LNCQZSPRXCRGCT-KRWDZBQOSA-N 437.378 4.634 50 10 IJGE Cc1nscc1C[C@@H](Br)c1cccc(F)c1I 2246946617 PVTJXMILBJQGHH-SNVBAGLBSA-N 426.092 4.874 50 10 IJGE CC1CC(CBr)(CN2CC[C@@H](C(F)(F)F)[C@H](NC(=O)OC(C)(C)C)C2)C1 2265313830 MMGOSCNIHOMWBI-YXXKGXSTSA-N 443.348 4.575 50 10 IJGE CC1CC(CBr)(CN2C[C@@H](NC(=O)OC(C)(C)C)[C@@H](c3ccccc3)C2)C1 2280056940 MNCFSFKXDNDFDK-NXMQOFKUSA-N 437.422 4.790 50 10 IJGE Cc1ccc(OCCn2cc(C=C(C#N)C(=O)NC[C@@H]3CCCO3)c3ccccc32)cc1C 2293648531 PVIOAMSCDGCXBW-DEOSSOPVSA-N 443.547 4.539 50 10 IJGE CC(NCCSSCCNC(C)=C1C(=O)C[C@@H]2[C@H]1C2(C)C)=C1C(=O)C[C@@H]2[C@H]1C2(C)C 2297474361 SZFRXFHQDNKSIE-AHWCRGGASA-N 448.698 4.585 50 10 IJGE C[C@@H](CCBr)CCNCc1ccc(Cl)c(I)c1 2300239367 XFUPSJAOXMGFRC-JTQLQIEISA-N 430.555 4.845 50 10 IJGE Cc1ccc(C[C@@H](Br)c2c(Br)c(Br)nn2C)cc1 2316701446 NWRUQWTXQWVHML-SNVBAGLBSA-N 436.973 4.932 50 10 IJGE C[C@H]1CCCN(Cc2ccc(Cl)cc2I)[C@H]1CBr 2318529889 WFQLNXRNJQCLIR-HZMBPMFUSA-N 442.566 4.940 50 10 IJGE Cc1c(F)ccc(C(=O)N[C@@H](CCBr)COCc2ccccc2)c1Cl 2320357330 ZCTKBOXAUHKDHT-HNNXBMFYSA-N 428.729 4.888 50 10 IJGE CCCOc1ccccc1C=NNC(=O)c1ccc2nc(Cc3ccc(OC)cc3)[nH]c2c1 2323720833 KHLIHRRESFAYAD-UHFFFAOYSA-N 442.519 4.715 50 10 IJGE C[C@@H]1CC[C@@H](CCl)CN1Cc1ccc(I)c(Br)c1 2325214896 TWAYZMGLBYLLGV-PWSUYJOCSA-N 442.566 4.893 50 10 IJGE ClC[C@]1(Cc2ccc(I)c(Br)c2)C[C@]12CCOC2 2325221072 KYWHIDZTMDFJSG-KBPBESRZSA-N 441.534 4.632 50 10 IJGE CC(C)CCOc1ccccc1C(=O)NNC(=O)c1ccccc1OCc1ccccc1 14033771 NQPWLWDRVIRGEX-UHFFFAOYSA-N 432.520 4.765 50 10 IJGE Cc1c(C(=O)Nc2ccc(C(C)C)cc2)oc2c1/C(=N/NC(=O)c1cccnc1)CCC2 40814128 WBIUGHWUXSWONP-VFCFBJKWSA-N 430.508 4.829 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)Nc3ccc(C)cc3[N+](=O)[O-])o2)cc1 103485413 BMCUBQOJMICDEF-AQTBWJFISA-N 445.431 4.886 50 10 IJGE Cl[C@H](c1ccccc1)c1nc(-c2ncc(Br)cc2Br)no1 139784871 BKQIPQGZJOXYRV-LLVKDONJSA-N 429.499 4.985 50 10 IJGE CCN1C(=O)C(C#N)=C(C)/C(=C/c2cn(-c3ccccc3)nc2-c2cc(C)ccc2C)C1=O 214209015 FSFRCEPGIOWLCZ-UCQKPKSFSA-N 436.515 4.768 50 10 IJGE COC(=O)c1ccc(CN/C=C(/C#N)C(=O)Nc2ccccc2Sc2ccccc2)cc1 217244002 SUBDFLQYRAWLTR-JZJYNLBNSA-N 443.528 4.760 50 10 IJGE CCOC(=O)c1ccc(N/C=C(/C#N)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1 217249028 MWORFOLOZAPREP-QBFSEMIESA-N 437.805 4.994 50 10 IJGE O=C(N[C@H]1CCC[C@@H]1CBr)c1cc(Br)cc(Br)c1 231548420 JDDLGYWLIDIMCA-PELKAZGASA-N 439.973 4.505 50 10 IJGE O=C(NCCCCCCBr)c1cc(Br)sc1Br 232472518 LOIROWUBOPEWKL-UHFFFAOYSA-N 448.018 4.958 50 10 IJGE CCOc1ccc(-c2cc(C(=O)NN=Cc3ccc(OCc4ccccc4)cc3)[nH]n2)cc1 254308822 LIIQNPHMYQHEBJ-UHFFFAOYSA-N 440.503 4.818 50 10 IJGE CC1(C)O[C@@H]2[C@H](CO[Si](C)(C)C(C)(C)C)O[C@@H](n3ccc4c(Cl)ncnc43)[C@@H]2O1 306146918 PTFANUVYJLNMOM-LUXYFRNMSA-N 440.016 4.524 50 10 IJGE Brc1cc([C@@H]2CCC[C@@H](CI)O2)oc1Br 306180386 JLXIVQSLWAROJR-XPUUQOCRSA-N 449.908 4.850 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2ccc(O)c(Br)c2)[C@@H](CBr)C1 382703216 DJVFIPJSKKFZPK-NWDGAFQWSA-N 435.156 4.500 50 10 IJGE O=S(=O)(N[C@@H](CCBr)C1CCCCC1)c1ccc(Br)s1 725077572 POTWEHSXBADYTP-NSHDSACASA-N 445.242 4.523 50 10 IJGE Cc1ccc(-c2cc(C(=O)NNc3ccc(S(C)(=O)=O)cc3)c3ccccc3n2)c(C)c1 748147218 FBIWTGJXBREURA-UHFFFAOYSA-N 445.544 4.679 50 10 IJGE C[C@H](OC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1)c1nc2ccccc2o1 781831159 CRLTTYIGJLFDKH-WFVLPUPGSA-N 437.459 4.816 50 10 IJGE Cc1cc(Nc2ccc3c(c2)CCCC3)c(C(=O)NNc2cc(F)cc(F)c2F)c(O)n1 1164306574 PZGSDDQDPVEFLT-UHFFFAOYSA-N 442.441 4.892 50 10 IJGE COc1ccc2nc(NNC(=O)c3cc4ccc(C(F)(F)F)cc4nc3O)c(C)cc2c1 1637431991 BRESPJMUPORINR-UHFFFAOYSA-N 442.397 4.581 50 10 IJGE Cc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865684487 ZDVGDUOKOKUDTD-HXUWFJFHSA-N 440.334 4.772 50 10 IJGE CCN(CC)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3CC(C)C)cc1 1865702145 NYCGBCMVUFKHOV-QGZVFWFLSA-N 433.478 4.622 50 10 IJGE CCc1nn(Cc2ccc(C)cc2)c2c1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865705739 DNAUIEWIKGSOFB-HXUWFJFHSA-N 449.898 4.582 50 10 IJGE COc1ccc(-c2ccc(C(=O)NNC(=O)CCCc3ccc(Cl)cc3)c(C)n2)cc1 1865757357 YZKTUTISEBXHKU-UHFFFAOYSA-N 437.927 4.503 50 10 IJGE COc1cc(/C=C(\C#N)c2ccccc2[N+](=O)[O-])ccc1OC(=O)c1cccc([N+](=O)[O-])c1 1872729589 STOXSMWOHCUWAT-GZTJUZNOSA-N 445.387 4.795 50 10 IJGE Fc1cc(Br)c2nc(CCl)n(C3[C@@H]4CN(Cc5ccccc5)C[C@@H]34)c2c1 1912683857 NLSWSLIUPOZFLD-HUUCEWRRSA-N 434.740 4.980 50 10 IJGE COc1ccc(Br)c(C(=O)N(Cc2ccccc2)C[C@@H](C)Br)c1 1914609968 ISEVFHYMOWNHHP-CYBMUJFWSA-N 441.163 4.884 50 10 IJGE Brc1ccc(CN2C[C@H](Br)CC3(CC3)C2)c(Br)c1 1925992121 BPGVYXCZSJMIAJ-GFCCVEGCSA-N 438.001 4.961 50 10 IJGE CC(C)[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(CCBr)s1 2009640348 PJYXVEPENJDHMM-OAHLLOKOSA-N 430.433 4.921 50 10 IJGE O=S(=O)(c1ccc(CCBr)s1)N(Cc1ccccc1)CC1CCC1 2009640633 UJOZMLSZRKHIOZ-UHFFFAOYSA-N 428.417 4.677 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc([C@]2(C)CC[C@@](C)(CI)O2)cc1 2014211373 TYCCTQMMBYDKQH-OALUTQOASA-N 445.341 4.931 50 10 IJGE C[C@]1(CCBr)CCN1Cc1ccc(I)c(Cl)c1 2026568051 XUNSUYCYIGQCKS-ZDUSSCGKSA-N 428.539 4.694 50 10 IJGE CCC[C@](C)(CBr)NC(=O)c1cc(Br)cc(Br)c1 2029944661 KNHQSIYTRIJJJC-CYBMUJFWSA-N 441.989 4.895 50 10 IJGE CC[C@@H](C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)cc(F)c1F 2059311857 CBDVWIIWTDVPMT-CYBMUJFWSA-N 432.330 4.849 50 10 IJGE CC(C)c1cnccc1-n1nc(CCl)c(I)c1C(F)(F)F 2078889889 BZWLAGXHQRJAID-UHFFFAOYSA-N 429.611 4.753 50 10 IJGE C[C@H]1C[C@@H](n2c(CCCl)nc3cncc(Br)c32)CN1Cc1ccccc1 2095436932 LAMLRKMDQVSMAX-GOEBONIOSA-N 433.781 4.811 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2C[C@H](C)N(C)Cc1ccccc1 2128514144 XGXACBWRUAQEEY-AWEZNQCLSA-N 435.797 4.804 50 10 IJGE Cc1c(Cl)cc(C(=O)N2CCC(F)(CBr)CC2)cc1Br 2167386665 XVMRBQCYSNKUEB-UHFFFAOYSA-N 427.539 4.750 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H]1CN(Cc3ccc(CBr)cc3)C[C@H]21 2182844639 GUFIHUOWYUAMRY-ZRNYENFQSA-N 435.406 4.659 50 10 IJGE O=C(c1ccc(Br)s1)N1CCC(CBr)(CC(F)F)CC1 2188341220 HRCFGEZWQNXHHV-UHFFFAOYSA-N 431.140 4.783 50 10 IJGE CN(CC[C@@H](Br)c1ccccc1)C[C@H]1CC1(Br)Br 2218005886 KVMKHGPHKUTYSY-CHWSQXEVSA-N 440.017 4.951 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Cl)c2n1C[C@H]1CC1(Br)Br 2224802185 CMHXGKPMZNAUMQ-RNFRBKRXSA-N 427.955 4.891 50 10 IJGE Cc1ccc(I)c([C@@H](Br)c2ccc3nc(O)[nH]c3c2)c1 2240997961 WQVSGTLBNBBJJN-AWEZNQCLSA-N 443.082 4.666 50 10 IJGE CC[C@@H]1CC[C@H]([C@H](Br)c2ccc(OC)c(I)c2)O1 2257356112 RLWUWJSKOKDKEF-LERXQTSPSA-N 425.104 4.693 50 10 IJGE COCc1ncc2nc(CCl)n(CCCN(Cc3ccccc3)Cc3ccccc3)c2n1 2258635081 VAZSTLHBKWBQHT-UHFFFAOYSA-N 449.986 4.804 50 10 IJGE CN(C(=O)c1ccc(Cl)c(I)c1)C1(CCl)CCSCC1 2283658932 YOVDBWRYIJNXLM-UHFFFAOYSA-N 444.165 4.521 50 10 IJGE CCOc1cc(C=CC(=O)Oc2ccc([N+](=O)[O-])cc2)cc(Br)c1OCC 2294608565 NFPMKZLONZSRFP-UHFFFAOYSA-N 436.258 4.774 50 10 IJGE C[C@H]1C[C@@H](Br)CCN(Cc2ccc(Cl)c(I)c2)C1 2315554278 CXLJDMYORJXLFQ-JQWIXIFHSA-N 442.566 4.940 50 10 IJGE COc1c(Br)cc(C)c([C@H](N)[C@H]2C[C@@H](Br)C2)c1Br 2317411450 VGXSATWAFHCOBJ-RGNHYFCHSA-N 441.989 4.702 50 10 IJGE CCCN(C[C@H](C)Br)C(=O)c1ccc(Cl)cc1I 2317776272 UUPOURPHZMJGAQ-VIFPVBQESA-N 444.538 4.580 50 10 IJGE CC(C)c1csc(C(C#N)=C(O)[C@@H](Cc2ccccc2)N2C(=O)c3ccccc3C2=O)n1 2331329752 AVJNVSCUSGVHTI-OAQYLSRUSA-N 443.528 4.967 50 10 IJGE CC(C)C[C@@H](CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)Cc2ccccc21 2353827040 PBOBEFWWIYICJL-WMZOPIPTSA-N 425.411 5.000 50 10 IJGE COCCCOc1ccnc(CN(Cc2ccccc2)[C@H](C)CCBr)c1C 2364650191 GGBMFOLBVDSSFR-GOSISDBHSA-N 435.406 4.981 50 10 IJGE Cc1nsc(Br)c1C(=O)N(C)CC(C)(C)[C@H](Br)C(C)C 2365997117 WUHFRTSISGTYKM-LLVKDONJSA-N 426.218 4.732 50 10 IJGE CC[C@@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)c1ccc(C)c(Br)c1 10683607 SNRSZNVBEPSPRM-AUUYWEPGSA-N 447.373 4.890 50 10 IJGE CCCCCOc1ccccc1C(=O)NNC(=O)COc1ccccc1-c1ccccc1 14035746 GDJAFQWQGAQSPK-UHFFFAOYSA-N 432.520 4.763 50 10 IJGE Oc1nc2ccc([C@@H](Br)c3ccccc3I)cc2o1 40285667 RMSAOUFPWMSBHZ-CYBMUJFWSA-N 430.039 4.622 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccccc2Cl)CCC3)n1 40812765 ZGXPJKZUZKDZHQ-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE CO[C@@H]1CCC[C@H](O[C@@H](CI)c2ccc(Br)cc2)C1 162367797 RUKSDQQSYFKXDI-ILXRZTDVSA-N 439.131 4.899 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)NC(C)C)ccc1OC(=O)/C=C\c1ccc(C(C)C)cc1 206432297 GTSPNMLJSXMCGN-MDMTWPDGSA-N 432.520 4.869 50 10 IJGE COc1cc(C[C@H](Br)C(=O)C2CC2)c(Br)cc1Br 234994010 GDOQUYGHHVLVBA-NSHDSACASA-N 440.957 4.505 50 10 IJGE COc1ccc(-c2cc(C(=O)NN=C(C)c3ccc(C)o3)c3ccccc3n2)c(OC)c1 252639327 YJKHLTYOQJEWFN-UHFFFAOYSA-N 429.476 4.974 50 10 IJGE CC(C)[C@H](CBr)CNC(=O)c1cc(Br)c(Br)s1 394168669 AWEMIHLTGZYGDL-SSDOTTSWSA-N 448.018 4.670 50 10 IJGE BrCC1(CN2CCC3(CCN(Cc4ccccc4)CC3)CC2)CCOCC1 691931571 HDWDCNHQKSFQEZ-UHFFFAOYSA-N 435.450 4.556 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N[C@H](COC(=N)O)Cc2ccccc2)c(C)n1C1CCCCC1 1469026288 UKWYHRHXWLORBB-AMCKHAKVSA-N 448.567 4.754 50 10 IJGE C=CCC1(C(=O)NNC(=O)c2ccc(CSc3nc(C)cc(C)n3)cc2)CCCCC1 1540692125 XHRGVEVJDQWAAF-UHFFFAOYSA-N 438.597 4.673 50 10 IJGE COc1ccc(OC)c([C@H](O)[P+](c2ccccc2)(c2ccccc2)c2ccccc2)c1 1615948320 UDMFHBSMLAEPCM-HHHXNRCGSA-N 429.476 4.689 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2cccc(Cl)c2)[C@H]1c1ccccn1 1865700247 NTUNMIFQJJGARS-OAQYLSRUSA-N 439.906 4.865 50 10 IJGE C[C@H](C(=O)N[C@H](Cc1ccc(F)cc1)C(=O)Nc1ccc(SC#N)cc1)C1CCCC1 1867009152 FAGCROFSSFYSTP-KSFYIVLOSA-N 439.556 4.891 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)n2)cc1 1872746091 RBLYQYRLBVQZEW-HBWVRPOVSA-N 431.517 4.660 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](OCC2CCCCCCC2)[C@H](I)C1 1902602509 PJHYLGKKHZGQDJ-CVEARBPZSA-N 437.362 4.786 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1nscc1Br 1915766632 FIOQPBCUXBFNHC-UHFFFAOYSA-N 432.181 4.722 50 10 IJGE C[C@@H](Br)CN(Cc1c(Br)cccc1Br)C1CC1 1945324444 XSZJESRCDIFVBV-SECBINFHSA-N 425.990 4.959 50 10 IJGE CC[C@@H](CCBr)NC(=O)c1c(Br)cccc1Br 1945333267 NRTKBOGNMMNLRX-QMMMGPOBSA-N 427.962 4.505 50 10 IJGE CCN(C[C@](C)(CI)OC[C@H]1C[C@@H]1C(C)C)C(=O)OC(C)(C)C 1993100341 GJOZYVZXWZYBPC-RKVPGOIHSA-N 439.378 4.746 50 10 IJGE Fc1cc(F)c([C@@H](Br)c2cc(I)sn2)c(F)c1 2007644858 OESKVOFWSNAEMA-JTQLQIEISA-N 434.018 4.649 50 10 IJGE C[C@](CBr)(NC(=O)c1cc(Br)ccc1Br)C1CC1 2029958204 YPADVZULKGXRFI-CYBMUJFWSA-N 439.973 4.505 50 10 IJGE CC(C)(C)C[C@H](CBr)CNC(=O)c1csc(I)c1 2038696260 IZUODOPPXVBQSL-SECBINFHSA-N 444.176 4.530 50 10 IJGE BrC[C@H]1[C@H]2CC[C@@H](C2)N1Cc1ccc(Br)cc1Br 2058371295 YWDCFVZHITUXKP-WFBYXXMGSA-N 438.001 4.959 50 10 IJGE C[C@@]1(NC(=O)c2c(Br)cccc2Br)CCC[C@H]1Br 2062577269 CHHVBSNZKVRGBF-ZWNOBZJWSA-N 439.973 4.648 50 10 IJGE Clc1cc(CN2[C@H](CBr)[C@H]3CC[C@@H]2C3)ccc1I 2086662106 ROZBHFLWOJEIQS-MISXGVKJSA-N 440.550 4.692 50 10 IJGE CC(C)(C)OC(=O)N1CCCCN(C[C@@H](CBr)CC2CC2)CC(F)(F)C1 2112861291 LGBMATGSIYBDFX-MRXNPFEDSA-N 439.385 4.766 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C(F)(F)F)CCCN1C[C@@H](CBr)CC1CC1 2112864895 WHAYTJLPWRUSIJ-PBHICJAKSA-N 443.348 4.719 50 10 IJGE CCC(CC)(CBr)CNC(=O)c1ccc(I)c(C)c1 2142107494 QQSFEDKBYSUDHE-UHFFFAOYSA-N 438.147 4.531 50 10 IJGE CN(c1nc2sccn2c1CBr)[C@@H]1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2151242792 ZTILMNKKUMMDPD-PIIMJCKOSA-N 445.430 4.923 50 10 IJGE CC(C)(C)[C@H](CBr)CN1C[C@H](CCNC(=O)C(F)(F)F)c2ccccc21 2163065097 XJXICJOJJIQZBT-UONOGXRCSA-N 435.328 4.716 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCC(NC(=O)[C@H](Br)C3CCCC3)CC2)C1 2167033818 SZNUVIXABWKISG-BQIYRTECSA-N 443.426 4.626 50 10 IJGE CC[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1N(C)CCCCCI 2211184367 CXMBCAOMRAVNKL-HOTGVXAUSA-N 438.394 4.559 50 10 IJGE O=C(NCC[C@H]1CCC[C@@H]1Br)c1cc(Br)c(F)cc1Cl 2285846175 LAQKANCIHVSLOM-SCZZXKLOSA-N 427.539 4.925 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N(CC(C)C)C[C@@H](C)Br)c1Br 2288057113 CWWHOBKYSRMBMF-SECBINFHSA-N 447.258 4.558 50 10 IJGE CC(C)(CCCl)C(=O)Nc1ccc(I)c(Br)c1 2300170477 MVGJTULQFACBQP-UHFFFAOYSA-N 430.511 4.647 50 10 IJGE CN[C@H](c1c(C)cc(Br)c(F)c1Br)[C@H]1C[C@@H]1Br 2301487736 TZTXUORLCRDFMJ-WSFZALMZSA-N 429.953 4.703 50 10 IJGE C#CCOc1c(Br)cc(C=C(C#N)C(=O)Nc2ccc(C)cc2)cc1OCC 2313567638 JKGFMOAHEWNXKC-UHFFFAOYSA-N 439.309 4.714 50 10 IJGE CCC[C@@H](CCBr)NC(=O)c1ccc(Cl)cc1I 2317776682 YXLFFMDEUWRXIM-JTQLQIEISA-N 444.538 4.628 50 10 IJGE C[C@@H](Br)CN(C(=O)c1sccc1I)C1CCCC1 2320012404 KLCIEXXDDJMEJV-SECBINFHSA-N 442.160 4.521 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(Cc2ccc(Cl)c(I)c2)[C@H]1C 2321336560 XIGDWMOTOXKORG-NHCYSSNCSA-N 442.566 4.938 50 10 IJGE CC(C)[C@@H]1C[C@@H](Br)CN1Cc1cc(Cl)ccc1I 2321506976 FBUZEEVHNMTZHN-RISCZKNCSA-N 442.566 4.938 50 10 IJGE COc1ccc(C(=O)NN=Cc2cn(-c3ccccc3)nc2-c2ccc(OC)c(C)c2)cc1 2321721294 FEMNEEMTCCBCMR-UHFFFAOYSA-N 440.503 4.629 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)C(C#N)=CNc1cccc(Br)c1 2325309748 JMPMRUVAIRQHDR-UHFFFAOYSA-N 442.313 4.864 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]([S@](C)(=O)=NC[C@](C)(CBr)C(C)(C)C)C1 2327092537 LNGHSIQXRFOMAN-KIKZRXFUSA-N 439.460 4.541 50 10 IJGE N#CC(=Cc1ccc(Br)cc1)C(=O)NCCc1nc(-c2ccccc2)cs1 2329659778 AROPOAQJLMJKDT-UHFFFAOYSA-N 438.350 4.838 50 10 IJGE CC(C)(C)OC(=O)N(CC1CC1)C1CCN(C[C@@]2(CBr)CC2(F)F)CC1 2351889415 VLWUNVDRETVPNL-SFHVURJKSA-N 437.369 4.518 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)C1(S(C)(=O)=O)CCC1 2365194263 PKNOXKGUWCAGOY-LBPRGKRZSA-N 448.579 4.906 50 10 IJGE CN(C[C@@H]1CCN(Cc2ccccc2)C1)c1nc(C(F)(F)F)ccc1CBr 2369838563 SRZGJBGULMMRGL-INIZCTEOSA-N 442.323 4.954 50 10 IJGE O=C(c1csc(Br)c1Br)N(CCCCl)C1CCOCC1 2381030999 LQTUKGRTUNKRNA-UHFFFAOYSA-N 445.604 4.523 50 10 IJGE CC(C)C[C@H](CBr)CN1CCC([C@@H]2CCCN(C(=O)C(F)(F)F)C2)CC1 2382184982 SDOMWQFSUPQGHF-NVXWUHKLSA-N 441.376 4.557 50 10 IJGE N#CC1=C(N)Oc2ccc(/C=N/c3ccc(Br)cc3)c(O)c2[C@H]1c1ccco1 3616223 KKMOFSSDTLCZSV-VFADJPBRSA-N 436.265 4.716 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4c(C)cccc4C)ccc32)cc1 38649221 QUCJDJNGXJNAAI-VWLOTQADSA-N 440.499 4.814 50 10 IJGE CC(=NNC(=O)COc1cc(Cl)c(Cl)cc1Cl)c1ccc(-n2ccnc2)cc1 254749454 QORSTDJJAAQELQ-UHFFFAOYSA-N 437.714 4.752 50 10 IJGE COc1ccc(N=Cc2ccccc2O)cc1P(=O)(c1ccccc1)c1ccccc1 254766367 RMIAPUBWRHLUJR-UHFFFAOYSA-N 427.440 4.791 50 10 IJGE ClCc1csc2ccc(I)c(I)c12 306908255 FFJBRGFAARIPJS-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE CC(C)[C@H](CBr)CNC(=O)c1cc(Br)ccc1Br 394178860 GPOLDEGAUULZBH-SECBINFHSA-N 441.989 4.609 50 10 IJGE C[C@H]1CN(Cc2cc(Cl)ccc2I)C[C@@H](C)[C@@H]1Br 688069790 DBWNWAVUPLLCCI-MSRIBSCDSA-N 442.566 4.796 50 10 IJGE Cc1ccc(C(C)(C)CNC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cc1 728537713 HCDKWFBLOWVXKJ-JWGURIENSA-N 437.547 4.773 50 10 IJGE Cn1cc(C(=O)NNC(=O)[C@H](Sc2ccccc2F)c2ccccc2)c2ccccc21 729965991 BEYOOGOMKJWISQ-JOCHJYFZSA-N 433.508 4.612 50 10 IJGE O=C(NNc1cccc(F)c1F)c1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1 743721828 YUZCQUPQJUOCGF-UHFFFAOYSA-N 444.278 4.604 50 10 IJGE CCC(=O)c1ccc(OC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)c(F)c1 766547947 AXOXCOWOHOKZGL-UYRXBGFRSA-N 442.450 4.708 50 10 IJGE Cc1cnc(COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccc(Cl)cc2)s1 781866440 BGZMIUTVMYQQNB-CXUHLZMHSA-N 437.912 4.532 50 10 IJGE O=C(CCc1ccccc1)NN=C1C(=O)N(Cc2cccc3ccccc23)c2ccccc21 1084559365 RDHFKXRBBWRLQY-UHFFFAOYSA-N 433.511 4.840 50 10 IJGE Cc1cc(/C=C(\C#N)c2nnc(-c3cn(C)c4ccccc34)o2)c(C)n1C[C@@H]1CCCO1 1341502961 CUYIUQKCMVZABO-RQRMZWKBSA-N 427.508 4.890 50 10 IJGE Cc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCc3cnc(O)c4ccccc34)c2C)cc1 1455900895 BOOUIDVFMGSDAG-FYJGNVAPSA-N 436.515 4.880 50 10 IJGE C=CCC1(C(=O)NNC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)CCOCC1 1523702447 BTXXUGKZRSOSOQ-UHFFFAOYSA-N 444.984 4.766 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNC(=S)Nc1c(C)cccc1CC 1624482965 PSSYHPIUIDIBHZ-UHFFFAOYSA-N 437.487 4.772 50 10 IJGE Cc1nn(Cc2ccccc2F)c2c1[C@@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 1865685531 JUYXHXGPCXXYQB-IBGZPJMESA-N 429.282 4.904 50 10 IJGE CC(C)c1nc(Br)c(Br)n1C[C@@H](CBr)C1CC1 1940509663 ZJBSRSQKWGSZEX-SECBINFHSA-N 428.994 4.953 50 10 IJGE CC(C)C(CCO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1I)C(C)C 1988261962 GNACSZPBVQRQAD-HZPDHXFCSA-N 439.378 4.744 50 10 IJGE Cc1cccc(CO[C@@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)c1 2024646471 COCBXJGNKJZEJW-LJQANCHMSA-N 445.341 4.716 50 10 IJGE O=C(NC[C@@H](Br)CC(F)(F)F)c1cc(Br)c(Cl)s1 2055499469 HQNZPBYBQFQDPB-BYPYZUCNSA-N 429.483 4.610 50 10 IJGE O=C(N[C@H]1C[C@H](CCBr)C1)c1cc(Br)cc(Br)c1 2078354625 QWKLUBMEBZQHLC-ITWVYHRLSA-N 439.973 4.505 50 10 IJGE C[C@H]1[C@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1csc(Br)c1Br 2093947863 JLZVNSDZPLYMCJ-MVHNUAHISA-N 427.589 4.894 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2C[C@@H](C)N(C)Cc1ccccc1 2096786830 NRXIZSQWFWHPCL-CQSZACIVSA-N 435.797 4.804 50 10 IJGE CCC[C@H](CCBr)CNS(=O)(=O)c1c(C)sc(C)c1Br 2143911787 ANVRXBCKFUENRP-LLVKDONJSA-N 447.258 4.607 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2cc(Cl)ccc2I)C[C@@H]1CCl 2163290394 XTZFSSRYSOXXGS-ONGXEEELSA-N 438.058 4.794 50 10 IJGE CN(C(=O)c1cc(Br)ccc1Br)[C@H](CCCl)C(F)(F)F 2178516526 XFASOTKLMXDERL-SNVBAGLBSA-N 437.481 4.843 50 10 IJGE Cc1cccc(N2CCOCC23CCN(Cc2ccccc2)CC3)c1CBr 2196793891 JRQJLELANXECFY-UHFFFAOYSA-N 429.402 4.761 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Br)c1cc(Cl)n(C)n1 2277975027 OUJABFKPXPLZHI-LLVKDONJSA-N 428.939 4.982 50 10 IJGE C[C@H](NC(=O)c1cc(Br)c(F)cc1Cl)[C@H]1CCC[C@@H]1Br 2285836024 WCUDBYQXASWNNQ-XKSSXDPKSA-N 427.539 4.924 50 10 IJGE CCO[C@@]1(COc2c(Br)cc(CCl)cc2Br)CCOC1 2287072552 YTXVENBMPHJMKJ-AWEZNQCLSA-N 428.548 4.525 50 10 IJGE CNC(=O)C(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc(OCc2ccccc2)cc1 2296707920 YILLWRLIWCDPIR-UHFFFAOYSA-N 434.499 4.771 50 10 IJGE CC1(C)CN(Cc2sccc2I)C[C@H]1CCBr 2301071452 NIQRHWPSVNPHQH-SNVBAGLBSA-N 428.177 4.596 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@@H](Br)[C@@]12COC[C@@H]1C2 2313273069 YTOPVLAKXXTHJM-ZTWXUTTESA-N 446.911 4.962 50 10 IJGE O=C(NN=Cc1cc(Cl)c(O)c(Cl)c1O)c1ccc2nc(-c3ccccc3)[nH]c2c1 2323744819 HJVSBSAHKCNTTF-UHFFFAOYSA-N 441.274 4.712 50 10 IJGE N#CC(=Cc1cccc(Br)c1)C(=O)N1CCc2cc(Br)ccc21 2324521516 KUNQVIWIXDSVJJ-UHFFFAOYSA-N 432.115 4.708 50 10 IJGE CC[C@@H]1[C@@H](CBr)CCN1Cc1cc(I)ccc1Cl 2327398966 KXBOOXVGLYNKFQ-QMTHXVAHSA-N 442.566 4.940 50 10 IJGE Cc1ccccc1COc1ccccc1C=NNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C 2328833174 VXPACLFFAUYMCQ-QFIPXVFZSA-N 439.556 4.573 50 10 IJGE CCCc1sc(Br)cc1[C@H](Br)[C@H]1C[C@H](S(C)(=O)=O)C1 2338016860 GHWXPJFKTOZNCV-JRKPZEMJSA-N 430.227 4.722 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@]2(CBr)CC2(F)F)C2(CCCCC2)C1 2351884997 COGFIJNJCURWRC-YOEHRIQHSA-N 437.369 4.709 50 10 IJGE Cc1cc(Br)c(C(=O)N2CC[C@H](Br)C[C@H]2C(F)(F)F)s1 2361464840 RMXSWZUDRTYDJF-CBAPKCEASA-N 435.103 4.749 50 10 IJGE CN(Cc1ccccc1)[C@@H]1CCCCN(c2c(CBr)c(C(F)F)nn2C)C1 2365333055 YDNLQCJJXPVAPC-MRXNPFEDSA-N 441.364 4.744 50 10 IJGE COc1ccc2nc(N(/N=C/c3coc4ccccc4c3=O)C(=O)c3ccco3)sc2c1 9629628 YXJMOGICJSKLFT-WYMPLXKRSA-N 445.456 4.685 50 10 IJGE Nc1c(Cl)c(Cl)nc(C(=O)N/N=C/c2ccccc2OCc2ccccc2)c1Cl 20933401 MYDFDSBFMZTNLE-KIBLKLHPSA-N 449.725 4.967 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)c2ccccc2Br)c(OCC)c1 59464921 NCQPKQCJGHWJQF-PTNGSMBKSA-N 444.281 4.537 50 10 IJGE O=C(NCC1(CBr)CCCCC1)c1c(F)cc(Br)cc1F 131492049 WOIIIEWPNYPYGF-UHFFFAOYSA-N 425.111 4.803 50 10 IJGE CCCc1ccc(OCC(=O)NN=Cc2ccc(OC(=O)c3ccc(C)cc3)cc2)cc1 254873368 NTFFRNKGAKFIGT-UHFFFAOYSA-N 430.504 4.696 50 10 IJGE CC[C@@H](Br)[C@@H](C)NC(=O)c1cc(Br)cc(Br)c1 386848774 ZAEAOOFOCUALJI-RDDDGLTNSA-N 427.962 4.503 50 10 IJGE FC(F)c1c(Br)cc(I)cc1CBr 575685016 INFKPNLKNKGPHT-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE CCO[C@H](CO[C@H](CI)c1ccccc1Br)C1CC1 703472118 VSLHKMRHWNFGOM-HUUCEWRRSA-N 439.131 4.757 50 10 IJGE O=C(NCC1(CBr)CCC1)c1cc(Br)ccc1Br 717680898 HRAAHXIUVWPWTC-UHFFFAOYSA-N 439.973 4.507 50 10 IJGE Cc1ccncc1[C@@H](C)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 771378790 BZRFFQGDBDTXEB-MIQLPHMESA-N 444.926 4.605 50 10 IJGE CN(C)c1ccc(C(=O)NN=C2C(=O)N(Cc3cccc4ccccc34)c3ccccc32)cc1 1084115612 LSUILPOXZFVKQZ-UHFFFAOYSA-N 448.526 4.587 50 10 IJGE C=CCn1c(CCc2ccccc2)nnc1SCC(=O)NN=C(C)/C=C/c1ccccc1 1084128115 XQHSHQWNPAOVSP-NJJNJRINSA-N 445.592 4.547 50 10 IJGE CCCOc1ccc(/C=C/C(=O)NNC(=O)c2ccc(-c3ccc(CC)cc3)nc2C)cc1 1865759048 ZWBLCKILLYMZNW-LICLKQGHSA-N 443.547 4.883 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2ncccc12 1915095018 QLLFXEBJPZTBER-MRXNPFEDSA-N 433.371 4.599 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Br)cc2Br)[C@@H]1CBr 1943842648 HEUUQVJRRTUGCM-NOZJJQNGSA-N 425.990 4.817 50 10 IJGE CC1(C)OC[C@@H](Cc2c(Br)cccc2Br)[C@@H]1Br 1945330432 LEHHXRSWYOUPJC-PELKAZGASA-N 426.974 4.943 50 10 IJGE C[C@H](c1ccncc1Br)[C@H](Cl)c1cc(I)sn1 2007643149 HNLQLOQUVHBQMC-KBUNVGBDSA-N 443.535 4.989 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Br)Cc1nnc(C2CCCCCC2)s1 2025440373 IONJWSSSKAHSHV-AWEZNQCLSA-N 448.386 4.578 50 10 IJGE C[C@@H](Br)CN(C(=O)c1cccc(Br)c1Br)C1CC1 2031478208 PWKXPHXZVMUVQG-MRVPVSSYSA-N 439.973 4.600 50 10 IJGE O=C(Nc1ccc(Cl)cc1I)[C@@H](Br)C1CCCC1 2048140434 SZMLGXDQLFKJLC-LBPRGKRZSA-N 442.522 4.837 50 10 IJGE C=CCn1c(C)cc(C(=O)C(C#N)=Cc2ccc(Sc3nccn3C)c([N+](=O)[O-])c2)c1C 2053511673 CVGUAERBDAUGQQ-UHFFFAOYSA-N 447.520 4.874 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(C[C@]13CCCOC3)C[C@]2(CBr)C(F)(F)F 2083265409 XUKBARQHWQQHPY-HRCADAONSA-N 428.289 4.510 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCCCC2)C(=O)CCCCBr)C1 2106590340 GRQNKTPHRGREIL-UHFFFAOYSA-N 431.415 4.580 50 10 IJGE CC[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2CN1CC1(CBr)CCCCC1 2106789565 ZHVSBBYSKXKFAV-OKZBNKHCSA-N 429.443 4.909 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N(C)[C@@H](CBr)C(C)(C)C)c1Br 2143915381 OGLOGYNCQHAOHH-JTQLQIEISA-N 447.258 4.558 50 10 IJGE O=C(c1cc(Cl)ccc1Br)N1CC[C@H](Br)C(F)(F)CC1 2150019536 SKZFNYQKUXAREL-NSHDSACASA-N 431.502 4.737 50 10 IJGE CN([C@@H]1CC(C)(C)[C@H]1OCc1ccccc1)S(=O)(=O)c1ccc(CCCl)s1 2156442677 OAHABEBKXKFXLP-MJGOQNOKSA-N 428.019 4.534 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](CCCN2C[C@H](CBr)c2ccccc2)C1 2163062147 JYNWFMNDOZVIPK-SLFFLAALSA-N 437.422 4.887 50 10 IJGE CCCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2167033893 TZKCSFJQVSQSAY-QZTJIDSGSA-N 445.442 4.968 50 10 IJGE Cc1c(Cl)cc(C[C@]23CO[C@](CI)(C2)C3)cc1Br 2222277795 RBHQMIKGDHXYJZ-OKILXGFUSA-N 441.534 4.938 50 10 IJGE Cc1sc(C(=O)N2[C@H]3CC[C@H]2[C@H](F)[C@H](Br)C3)c(Br)c1C 2237632901 DVHHHNZRHUCPEZ-MIZYBKAJSA-N 425.161 4.606 50 10 IJGE CC[C@@H]1CN(Cc2cc(I)ccc2Cl)C[C@@H]1Br 2307328688 PXAHKUMXELBCQE-SKDRFNHKSA-N 428.539 4.550 50 10 IJGE BrC[C@@H]1[C@@H]2CC[C@@H](C2)N1Cc1ccc(Br)cc1Br 2310100065 YWDCFVZHITUXKP-LJWDBELGSA-N 438.001 4.959 50 10 IJGE CC(C)(C)OC(=O)N[C@@]1(C)CN(CC2(CBr)CCCCC2)CC1(F)F 2315165546 DYJPKXKRLOWQRZ-INIZCTEOSA-N 425.358 4.566 50 10 IJGE C[C@]1(CCBr)CCN(Cc2ccc(Cl)c(I)c2)C1 2315549548 SZGNHSBQVKXTJQ-AWEZNQCLSA-N 442.566 4.942 50 10 IJGE FC1(F)[C@@H]2CC[C@@H](O[C@@H](CI)c3ccc(Br)cc3)[C@@H]21 2333872567 WGWBXMWFQKVSDR-FVCCEPFGSA-N 443.069 4.986 50 10 IJGE O=C(CSc1nnc(CCc2ccccc2)n1-c1ccccc1)NN=C1CCCCC1 58992240 LJUZZXMGRJCJQI-UHFFFAOYSA-N 433.581 4.581 50 10 IJGE O=[N+]([O-])c1ccccc1C[C@H](Br)c1cccc(I)c1 110296482 AKEWABAADNQKCQ-ZDUSSCGKSA-N 432.055 4.878 50 10 IJGE C[C@@H](CBr)CCCNC(=O)c1cc(Br)sc1Br 228280501 IOCGPMICLYCFEH-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE CC(C)N(CCBr)C(=O)c1cc(Br)sc1Br 232635948 IUMBLQNFMUWVIF-UHFFFAOYSA-N 433.991 4.519 50 10 IJGE C[C@]12CCCC[C@H]1[C@H]2C(=O)NN=Cc1ccc(Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 254750135 MNSBUHVLKZLDLS-XJABCFGWSA-N 438.440 4.572 50 10 IJGE BrCc1cc(Br)cc(Br)c1O[C@@H]1CCCOC1 310292308 NYMIVAIBCHGVMU-SNVBAGLBSA-N 428.946 4.664 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CCC2(CCN(Cc3ccccc3)CC2)C1 380410485 DUOCYVMPMLANRO-UHFFFAOYSA-N 427.386 4.710 50 10 IJGE C[C@@H]1[C@H](CBr)CCN1Cc1cc(Cl)ccc1I 405286385 FBKAUFLQIMUXFZ-ZJUUUORDSA-N 428.539 4.550 50 10 IJGE CC(C)(C)[C@@H](CBr)NC(=O)c1scc(Br)c1Br 705426694 OFHKYGUNQUAUAZ-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE CC[C@@H](C)N(CCCl)C(=O)c1ccc(I)c(Br)c1 721606927 XVZTWFSSPXDXDI-SECBINFHSA-N 444.538 4.533 50 10 IJGE Cc1cccc(COc2ccccc2/C=C(\C#N)C(=O)N2CCN(c3ccccc3)CC2)c1 1084308575 CYHSBWKLLQFSAI-NCELDCMTSA-N 437.543 4.830 50 10 IJGE C=CCC[C@@H](CO)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1627412992 XWXFZCHYINUUSR-DDYRAIOVSA-N 432.351 4.751 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)C2(Cc3cccc(Cl)c3)CCCCC2)c1 1633773526 IVXILKNSMOFYKG-UHFFFAOYSA-N 425.985 4.832 50 10 IJGE Cc1ccnc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2Cl)CCC3)c1 1772743934 LQUUYHVZOQVQIB-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE CCCC[C@@H](NC(=O)CCCC(=O)c1cccs1)C(=O)Nc1ccc(SC#N)cc1 1866794388 TUZIFDDERPEIHT-GOSISDBHSA-N 443.594 4.988 50 10 IJGE COC(=O)c1ccc(/C=C/C(O)=C(\C#N)c2nc(-c3ccc4c(c3)OCCO4)cs2)cc1 1872751162 UOZKPJZGQCTLBG-NRXVNKIJSA-N 446.484 4.874 50 10 IJGE N[C@H](c1c(Cl)cc(Br)c(F)c1Br)[C@@H]1C[C@H]1Br 1900373193 TVLUXIIFELNDMY-SGTYWVLOSA-N 436.344 4.787 50 10 IJGE Brc1cc(Br)c([C@H](Br)[C@@H]2[C@@H]3CCOC[C@H]32)s1 1922892498 AWTSJEITKRYHBD-SXILTZBTSA-N 430.987 4.992 50 10 IJGE Brc1ccc(CN2C[C@@H]3CC[C@@H](Br)[C@H]3C2)c(Br)c1 2031402840 LVAIOBHNIRAOHB-TVYUQYBPSA-N 438.001 4.817 50 10 IJGE BrC[C@H]1CC2(CCC2)CN1c1ncc(Br)cc1Br 2034099111 WIQKMFWPLHIXLH-SNVBAGLBSA-N 438.989 4.751 50 10 IJGE CC(C)[C@H](Br)[C@@H](C)NC(=O)c1cccc(Br)c1Br 2041302462 DAUBWEUMPFSPDO-KCJUWKMLSA-N 441.989 4.749 50 10 IJGE O=C(CBr)c1ccc(OC(F)(F)F)c(Br)c1C(F)(F)F 2054797931 PEBOHFFEYSKYFN-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE C[C@@H]1CCc2nn(Cc3c(F)cccc3I)c(CBr)c21 2080648083 NNCKFHOMBDHGLA-SECBINFHSA-N 449.105 4.620 50 10 IJGE CC(C)[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1c1ccccc1 2106785806 QXXGPKAXIPKNKV-RTBURBONSA-N 425.411 4.948 50 10 IJGE C[C@H](CCBr)CCN1CCC(c2n[nH]cc2NC(=O)OC(C)(C)C)CC1 2129052656 AQRXJVNXNHEHIB-CQSZACIVSA-N 429.403 4.747 50 10 IJGE C[C@H]1C[C@@H](C)[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)c1ccc(CBr)cc1 2163055166 DTDVORDKJNXTJX-VKJFTORMSA-N 439.394 4.593 50 10 IJGE CCCC(CBr)(CCC)CN(CCO)C[C@H]1CCCN1C(=O)OC(C)(C)C 2163059351 SFOBVTRNIWVZDP-GOSISDBHSA-N 449.474 4.662 50 10 IJGE CC(C)(C)[C@@H]1C[C@H](CCl)CN(C(=O)c2sccc2I)C1 2165006874 IOEPOSPCNLXFDG-GHMZBOCLSA-N 425.763 4.716 50 10 IJGE Cn1ncc(CC(CCl)(CCl)c2ccccc2Br)c1Br 2173257584 IEBYEBIMFUNBNM-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE Cc1ccc(C(=O)N[C@H](C)CCCCCBr)cc1I 2224629108 PCRRECAVBCNXJU-GFCCVEGCSA-N 438.147 4.673 50 10 IJGE Cc1sc(C(=O)N2[C@H]3CC[C@H]2[C@H](F)[C@H](Br)C3)c(C)c1Br 2234464368 NHZQBBQMKMMKPM-MIZYBKAJSA-N 425.161 4.606 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@H]2CCC[C@@]2(CBr)C1 2264516072 WPPQWHMUUUZYMD-AMIZOPFISA-N 427.589 4.801 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CN(CCCCCCCBr)C[C@@H]1C(F)(F)F 2277448909 NJWUKGDKVQTNLB-GJZGRUSLSA-N 445.364 4.967 50 10 IJGE CCn1nc(C)c(CBr)c1N1CC[C@@H]2[C@H](CCCN2Cc2ccccc2)C1 2281295526 IWHZVNQEFLESLJ-TZIWHRDSSA-N 431.422 4.597 50 10 IJGE CC(C)(C)[C@H]1[C@H](Cl)CCN1C(=O)c1ccc(Cl)c(I)c1 2283670705 VINYCEBWXYBUSZ-DGCLKSJQSA-N 426.125 4.813 50 10 IJGE CCCOc1ccc(C=C(C#N)C(=O)Nc2sc3c(c2C(=O)OC)CC[C@H](C)C3)cc1 2314736611 QAZWLLKETFBKJL-HNNXBMFYSA-N 438.549 4.994 50 10 IJGE FC(F)C(F)(F)CO[C@@H](CI)c1ccc(Br)cc1 2315877013 CKIRYOKCNJFHFV-VIFPVBQESA-N 441.000 4.842 50 10 IJGE Clc1ccc(CN2CC[C@]23C[C@@H](CBr)C3)c(I)c1 2318538880 KHJYXXDFTFUUMC-YPFXGUDJSA-N 440.550 4.694 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc3nc(S)[nH]c3c2)cc(Cl)c1OCC(C)C 2323603605 YRJLXXWNDRUGAT-UHFFFAOYSA-N 446.960 4.702 50 10 IJGE COc1ccc(C(=O)N/N=C/c2cc(Cl)ccc2OCc2cccc(F)c2)cc1OC 10041571 IFZLBBBXBQVXSK-LGJNPRDNSA-N 442.874 4.839 50 10 IJGE CCCCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccco2)c1 38657519 OOJSKOJLQYXGIM-QHCPKHFHSA-N 430.460 4.896 50 10 IJGE Cc1c(C(=O)NC(C)(C)C)oc2c1/C(=N/NC(=O)c1ccc(Cl)cc1Cl)CCC2 40813674 RJDAMOMSXIVAOS-MFKUBSTISA-N 436.339 4.894 50 10 IJGE CCN(CC)c1ccc(-n2c(C)cc(/C=N\NC(=O)CC[C@@H](O)c3ccccc3)c2C)cc1 58890819 CFVPEPAKDXWMKK-YBNKYOMYSA-N 446.595 4.904 50 10 IJGE COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCc3csc(C(C)C)n3)c2C)cc1 208584464 JFAIDTLYBPENBJ-YBFXNURJSA-N 434.565 4.906 50 10 IJGE CCn1c(SCC(=O)NN=C(C)c2ccc3ccccc3c2)nnc1-c1ccccc1 254522230 DMPUOGFJTPKVLZ-UHFFFAOYSA-N 429.549 4.751 50 10 IJGE C[C@H](Br)C[C@@H](C)CNC(=O)c1cc(Br)c(Br)s1 397720114 JNCYKQMZADKNJF-RQJHMYQMSA-N 448.018 4.813 50 10 IJGE C[C@H](CCCCBr)NC(=O)c1cc(Br)cc(Br)c1 398554196 YOSFZUXZSSCAEV-SECBINFHSA-N 441.989 4.895 50 10 IJGE Clc1ccc(I)c(CN[C@@H](CBr)C2CCCC2)c1 405298126 LVYSOQABTCDSHB-AWEZNQCLSA-N 442.566 4.988 50 10 IJGE C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F 732491599 HAZRBABCGQXLRL-RWTORFTKSA-N 442.890 4.894 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1ccc(Oc2ccc(Cl)cc2)nc1 756226727 FPLQENSVSYQIIP-UHFFFAOYSA-N 433.855 4.542 50 10 IJGE CCn1c(NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)nc2cc(C)ccc21 775910261 GNVFBDXJBYRTDB-HMMYKYKNSA-N 449.518 4.687 50 10 IJGE N#Cc1ccc(NNC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)c(C(F)(F)F)c1 799750635 JSHIIQUXWMBHMK-CHWSQXEVSA-N 429.320 4.722 50 10 IJGE COc1cc(C=NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCc1ccccc1Cl 1083853565 XHLCCYAVFLHFBF-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE C#CCCN(CCOC)C(=O)/C(C#N)=C/c1cc(C)n(-c2cccc3ccccc23)c1C 1131407314 AUVJUVDVSLIROP-HKOYGPOVSA-N 425.532 4.653 50 10 IJGE CC(=O)N(c1cccc(Cl)c1)c1nc(CNC[C@@]2(C)C[C@H]2Br)cs1 1474640809 NTQHVQRZBTUKAF-NVXWUHKLSA-N 428.783 4.744 50 10 IJGE O=C(NNc1cc(C(F)(F)F)ccc1Br)c1cc2c(nc1O)CCCCC2 1570385978 PFJKIADDAXDLKQ-UHFFFAOYSA-N 444.251 4.594 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)[C@@H](OCC2CCCC2)c2ccccc2)c1C 1638346519 CITPWFITVKRGDH-QFIPXVFZSA-N 431.540 4.547 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNc2cc(Cl)nc3c2c(C)nn3C)cc1 1643167591 XPAPHIYRPVUPFX-UHFFFAOYSA-N 448.914 4.633 50 10 IJGE Cc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 1865701959 JJJAKBWGJXKFNB-SFHVURJKSA-N 433.245 4.984 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2)[C@H]1c1ccc([N+](=O)[O-])cc1 1865713262 VCXQHOQQMYMOGD-NRFANRHFSA-N 435.443 4.666 50 10 IJGE Cc1ccc(CC(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3Cl)nc2C)c(C)c1 1865759579 HSPUYQMCLWGQKU-UHFFFAOYSA-N 442.346 4.984 50 10 IJGE CCc1nc(-c2ccc(OC)c(OC)c2)ccc1C(=O)Oc1ccc([N+](=O)[O-])c(F)c1 1865787947 OFKODKQGDDESRI-UHFFFAOYSA-N 426.400 4.595 50 10 IJGE N#C/C(=C(/O)c1cc2ccccc2oc1=O)c1nc(-c2ccc3c(c2)OCCO3)cs1 1872750775 KWUOKPTWOYSXEA-PGMHBOJBSA-N 430.441 4.638 50 10 IJGE Cc1cc(C)c(S(=O)(=O)N(Cc2ccccc2)[C@H](CBr)C(C)C)s1 1915290639 GHRCLLZCTYEKEP-QGZVFWFLSA-N 430.433 4.975 50 10 IJGE CC[C@@H](Br)CN(CC)C(=O)c1scc(Br)c1Br 1999378903 ZULLGANZCJDNER-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE FC1(CBr)CCN(Cc2cc(Cl)ccc2I)CC1 2039787417 PREXPRIDBYMRPR-UHFFFAOYSA-N 446.529 4.644 50 10 IJGE CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1cc(CBr)n(C2CC2)c1 2059312850 QEOXXNFUGVSLMD-HNNXBMFYSA-N 425.392 4.707 50 10 IJGE CCN1CCC[C@@H]([C@@H](Br)c2ccc(OCc3ccccc3)cc2)S1(=O)=O 2089514912 NKTSMIVRXDFADE-PMACEKPBSA-N 438.387 4.516 50 10 IJGE ClCc1cc(Br)cc(Br)c1OCCS[C@@H]1CCOC1 2092688576 FJKZWYMECJTLGP-LLVKDONJSA-N 430.589 4.851 50 10 IJGE COc1ccc([C@@H](Br)c2nn(C)c(Cl)c2Cl)c(Br)c1 2094339135 MXQUSILOSWRPHI-SECBINFHSA-N 428.939 4.982 50 10 IJGE Fc1ccc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)c(CBr)c1 2130158654 BUUXFDOWKKQFMF-GOSISDBHSA-N 431.271 4.974 50 10 IJGE COc1ccc([C@@H](Br)c2cc(Br)n(C)n2)c(Cl)c1Cl 2138627852 MSKALRGCOAYPSV-SNVBAGLBSA-N 428.939 4.982 50 10 IJGE Cc1cc(Br)c(C(=O)NC[C@]2(F)C[C@@H](CBr)C2)cc1Cl 2168552689 LCCMJJLNZSJXAQ-DEZZCRIOSA-N 427.539 4.654 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 2196913158 CCAJYZDLZACCLV-KBAYOESNSA-N 439.394 4.665 50 10 IJGE COc1ncc(COc2c(Br)cc(Br)cc2CCl)s1 2231428787 XXGHHITZDRCEPL-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE Cc1ccc(I)c(C(=O)Nc2ccc(F)c(CBr)c2)c1 2240911506 FDQHGTAJSMGEPO-UHFFFAOYSA-N 448.073 4.886 50 10 IJGE C[C@H](COC(F)F)O[C@H](CI)c1ccc(Br)cc1 2253920176 SZBRHLDTLTXVPS-LDYMZIIASA-N 435.046 4.570 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@@H](CC2CC2)C2CC2)C1 2303848995 FURHZPMZBIWNQO-QFBILLFUSA-N 449.373 4.786 50 10 IJGE C[C@H]1[C@@H](CCl)CCN1Cc1ccc(I)c(Br)c1 2306224080 MPSZFYLMJILMBM-GXSJLCMTSA-N 428.539 4.503 50 10 IJGE ClC[C@H]1CCC[C@H]1NCc1ccc(I)c(Br)c1 2306232381 TZGWIFYKOJRWBF-ZWNOBZJWSA-N 428.539 4.551 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@H](Cc2ccc(F)cc2)C(=O)N1c1ccc(C(C)C)cc1 2314593357 LSAXYUNWLIDAHU-JOCHJYFZSA-N 449.551 4.678 50 10 IJGE C[C@@H]1C[C@@H](CBr)CCN1Cc1ccc(Cl)c(I)c1 2315554272 CWFVZRIUSQSDMZ-MNOVXSKESA-N 442.566 4.940 50 10 IJGE COc1ccc(CC(O)=C(C#N)c2nc(-c3ccc4c(c3)OCCO4)cs2)cc1OC 2331329818 KUDCUCOONSKGKF-UHFFFAOYSA-N 436.489 4.634 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@H]1CC12CCC(F)(F)CC2 2343414819 TYOWYFCIKUAPQX-DLBZAZTESA-N 430.333 4.689 50 10 IJGE O=C(Nc1ccccc1[N+](=O)[O-])c1cccc(S(=O)(=O)C[C@@H](Cl)c2ccccc2)c1 8453771 QMMIVTRTELTFQK-GOSISDBHSA-N 444.896 4.601 50 10 IJGE CC(C)COc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(-c3ccccc3)cc2)cc1 14038807 DMVASSKKUXFSEC-IBGZPJMESA-N 432.520 4.617 50 10 IJGE CC1CCN(C(=O)/C(C#N)=C2/S[C@H](Cc3ccc(F)cc3)C(=O)N2c2ccccc2)CC1 33931672 HZNQHBATLYLXQQ-FNBPXTNNSA-N 449.551 4.510 50 10 IJGE Cc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccccc4C)ccc32)cc1 38649183 IKMYZKNMMOKYLP-VWLOTQADSA-N 426.472 4.506 50 10 IJGE COc1ccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccs2)cc1Cl 38688433 TXDDHOXQFHEWCP-HXUWFJFHSA-N 438.892 4.847 50 10 IJGE COc1ccc([C@@H](Br)c2cccc(I)c2)cc1OC 104048979 OHUCZXLHBQYDAM-HNNXBMFYSA-N 433.083 4.793 50 10 IJGE CCCn1c(C)cc(/C=C(/C#N)C(=O)N[C@@H](C(=O)Nc2ccccc2)c2ccccc2)c1C 107646213 CTFUEZJEPXDGFG-IVNHJSRESA-N 440.547 4.918 50 10 IJGE BrC[C@@H]1CCCCCN1c1ncc(Br)cc1Br 157403589 UCYCEIYLZRHREQ-JTQLQIEISA-N 426.978 4.751 50 10 IJGE Brc1ccccc1[C@@H](CI)OC[C@H]1CCCCO1 161968303 NVTFFMVTKMWZFF-BXUZGUMPSA-N 425.104 4.511 50 10 IJGE CC[C@H](C)N(CCBr)C(=O)c1cc(Br)ccc1Br 380777415 VLJCKJAGGBSRKC-VIFPVBQESA-N 441.989 4.847 50 10 IJGE Cc1ccccc1C(C)(C)CNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 725724820 CUUFOTANVJAYPV-JWGURIENSA-N 437.547 4.773 50 10 IJGE Cc1cc(C)cc(C(=O)N(NC(=O)c2ccc([N+](=O)[O-])c3c2CC(C)(C)O3)C(C)(C)C)c1 1088690950 MNBDXNIKFBLWJS-UHFFFAOYSA-N 439.512 4.511 50 10 IJGE Cc1cc(C(=O)NNc2nc3ccccc3[nH]c2=S)ccc1NC(=O)c1cccs1 1470319511 KRWZUVJSMDYOFQ-UHFFFAOYSA-N 435.534 4.672 50 10 IJGE Cc1sc2nc(CS[C@H](C)C(=O)NNc3cccc(F)c3Cl)nc(O)c2c1C 1557604051 QNYQDULQODMDHI-SNVBAGLBSA-N 440.953 4.571 50 10 IJGE COCCCN(C[C@@H]1CCCN2CCCC[C@@H]12)C(=O)CCCC[C@H]1CCSS1 1614472312 YNUNLQRCFFUJHD-ACRUOGEOSA-N 428.708 4.830 50 10 IJGE C=CCC[C@H](CO)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1627412994 XWXFZCHYINUUSR-RPXHZFJKSA-N 432.351 4.751 50 10 IJGE Cc1occc1C(=O)NN=C1CCCc2oc(C(=O)NCc3ccccc3Cl)c(C)c21 1772748850 GRLKAOCEDHYNDR-UHFFFAOYSA-N 439.899 4.543 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)NNC(=O)CCCc1ccc(Cl)cc1 1865756902 CPRPPHBZYNGDOW-UHFFFAOYSA-N 443.881 4.773 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)c1ccc(F)c(F)c1 1865759216 OFKLLCUZXKKGPO-UHFFFAOYSA-N 436.245 4.717 50 10 IJGE COc1ccc2c(c1)c(/C=C1\Oc3c(ccc(OC(=O)C(Cl)Cl)c3C)C1=O)cn2C 1871386324 PBJQVHCBJGNUFA-LSCVHKIXSA-N 446.286 4.821 50 10 IJGE FC(F)COCOc1c(Br)cc(Br)cc1CBr 1944235551 MTYMFLHTDSKCHM-UHFFFAOYSA-N 438.888 4.725 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OCC2CC3(CCC3)C2)C1 2017328848 KVMCQYIQOVSMPG-IBGZPJMESA-N 449.373 4.788 50 10 IJGE O=C(NC1(CCBr)CCC1)c1cc(Br)ccc1Br 2029626678 WGGMPQPUJPVCPQ-UHFFFAOYSA-N 439.973 4.649 50 10 IJGE C[C@H](C[C@@H](Br)c1cc(I)cc2c1OCC2)C(F)F 2036589976 CWPYRQSEFHZLDJ-RDDDGLTNSA-N 431.058 4.953 50 10 IJGE CC(C)[C@H](Br)[C@@H](C)NC(=O)c1ccc(Br)cc1Br 2041305810 ASCMVHWEQBLZAJ-PELKAZGASA-N 441.989 4.749 50 10 IJGE FC(F)Oc1cc(OC(F)(F)F)c(I)cc1CBr 2060222323 NIQKOMDOCIYCCL-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE CC(C)(C)OC(=O)N(CC(F)F)[C@@H]1CCCN(CC2(CBr)CCCC2)C1 2106784131 GGXMYNFEAIBOPV-OAHLLOKOSA-N 439.385 4.908 50 10 IJGE O=C(NC[C@]12CCC[C@]1(CCl)C2)c1cc(Br)c(Br)s1 2142939674 IRBWKIJOYSFCFP-CHWSQXEVSA-N 427.589 4.802 50 10 IJGE CN(c1ccc([N+](=O)[O-])c(CBr)c1)[C@@H]1CN(Cc2ccccc2)C(C)(C)C1 2154826674 BLUOAJQEGOADCA-IBGZPJMESA-N 432.362 4.979 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H]3CC[C@@H](CN3Cc3ccc(CBr)cc3)[C@H]2C1 2182845570 RRZPJQGSWUSJKA-YRPNKDGESA-N 435.406 4.659 50 10 IJGE C[C@H](Br)C[C@@H]1COCCN1Cc1ccc(Cl)c(Br)c1F 2185314780 TUYVEZRMYBANTE-GXSJLCMTSA-N 429.555 4.616 50 10 IJGE CO[C@H]1CC(Oc2c(Br)cc(CCl)cc2Br)C[C@@H]1OC 2187178027 QPWGXOSFVRZWTC-STQMWFEESA-N 428.548 4.522 50 10 IJGE CN(CC1CCN(Cc2ccccc2)CC1)c1ccc(CBr)c([N+](=O)[O-])c1 2188572040 MFXBTKCOORSNMI-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE O=C(c1cccc(Br)c1Br)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Cl)C2 2190688720 YFRQTAWZOUIQAG-RINBACNTSA-N 425.523 4.534 50 10 IJGE ICCCCCN1CCC[C@@H]1[C@H]1CCN(Cc2ccccc2)C1 2211187443 UGZBBZUIFXJYKC-VQTJNVASSA-N 426.386 4.578 50 10 IJGE CC(C)(C)[C@@]1(CBr)CCN(C[C@H]2CC2(Br)Br)C1 2213091308 MMPKHOISHZNSBJ-ZYHUDNBSSA-N 432.038 4.626 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2Cc1cnc(Br)s1 2232915803 IDOHZDUHGMWLOB-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE O=C(NCCCCCI)c1cc(Br)c(F)cc1Cl 2258043022 SFHHHHCFJQCHND-UHFFFAOYSA-N 448.501 4.577 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@]23CCOC[C@@H]2C3)c1 2263509822 KVWWWOSXTRKMGS-LEWSCRJBSA-N 438.985 4.944 50 10 IJGE C=CC[C@@]1(CBr)CCCN1C(=O)c1cc(C)ccc1I 2287793992 VDMLHSNCVHFNMA-INIZCTEOSA-N 448.142 4.545 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)C=Cc2ccc(OCC)cc2)c(OC)c1 2314777593 LYPLVHWODADJOM-UHFFFAOYSA-N 448.519 4.536 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@H](C3)[C@@H]2CBr)cc1I 2315548139 DIDHXYCCMBPUHU-SUNKGSAMSA-N 440.550 4.692 50 10 IJGE BrC[C@H]1CN(Cc2sccc2I)CC12CCCC2 2316753429 YLZYOYNRUZSFPJ-NSHDSACASA-N 440.188 4.740 50 10 IJGE COc1ccc(C=C(C(=O)NNC(=O)CCCSc2ccccc2)c2ccccc2)cc1 2321116018 FYSCNTAUHWHZHK-UHFFFAOYSA-N 446.572 4.956 50 10 IJGE CC(C)Oc1cccc(C=NNC(=O)c2cc(-c3ccccc3)nc(N3CCCCC3)n2)c1 2323756765 ZUCWOUZFZJRNLZ-UHFFFAOYSA-N 443.551 4.685 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@]12CCC[C@H](CN(CC3(CBr)CC(F)C3)C1)C2 2334047308 YUFQJEBLJNUXME-MUAOVLSHSA-N 433.406 4.611 50 10 IJGE CCCc1nn(-c2ccccc2)c2c1[C@@H](c1ccc(OCC)c(OCC)c1)C(C#N)=C(N)O2 1472065 IMKOATWPJBYHRH-QHCPKHFHSA-N 444.535 4.840 50 10 IJGE COc1ccc([C@H](C(=O)NC2CCCCC2)N(Cc2cccs2)C(=O)CCl)cc1 3039740 ANWVTQVDUYAEIV-OAQYLSRUSA-N 434.989 4.514 50 10 IJGE O=C(NN=Cc1ccc(Oc2nc(Cl)ncc2F)cc1)c1cccc(Br)c1 17150161 KUSZTEOAPUVHOT-UHFFFAOYSA-N 449.667 4.588 50 10 IJGE N#CC1=C(N)Oc2nc(=S)[nH]c(O)c2[C@@H]1c1ccc(-c2cc(Cl)ccc2Cl)o1 34967380 IIZBZHOJTUANKS-ZDUSSCGKSA-N 433.276 4.630 50 10 IJGE C[C@@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cccc(F)c1 38678099 QSWLJMBRMXYZRE-QKFKETGDSA-N 448.425 4.556 50 10 IJGE O=C(NC1CCCCC1)[C@H](c1ccccc1F)N(Cc1ccc(F)cc1)C(=O)CCl 97914210 OLNKABULIXNQOT-QFIPXVFZSA-N 434.914 4.722 50 10 IJGE CC1CCC(NC(=O)[C@@H](c2ccc(F)cc2)N(Cc2ccc(F)cc2)C(=O)CCl)CC1 97914709 BMWFKAHLEADFSU-YBHUKKOHSA-N 448.941 4.968 50 10 IJGE C=CCOc1ccc(/C=C2\C(=O)N(Cc3ccc(F)cc3)C(=O)C(C#N)=C2C)cc1OCC 214411096 DTDIGSYHELUGAH-BKUYFWCQSA-N 446.478 4.582 50 10 IJGE Cc1cccc(NC(=O)/C(C#N)=C\N2CCN(C(c3ccccc3)c3ccccc3)CC2)c1 217247325 MNTYZSQQFCCAGE-DAFNUICNSA-N 436.559 4.748 50 10 IJGE Cn1ncc([C@H](Br)Cc2cccc3ccccc23)c1I 379230434 ZAUCRCBNVADJTE-OAHLLOKOSA-N 441.110 4.857 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CBr)[C@@H](c2ccc(Br)s2)C1 382732872 VKHWLBMXXXEZRE-UWVGGRQHSA-N 425.186 4.856 50 10 IJGE CC(C)[C@@](C)(CBr)NC(=O)c1cc(Br)ccc1Br 398568238 OTNYQDJKJZPLMJ-CYBMUJFWSA-N 441.989 4.751 50 10 IJGE O=C(c1ccc(Cl)c(Br)c1)N1CCC(F)(F)[C@H](CBr)C1 403966215 LRCMYDVRRFHASD-SECBINFHSA-N 431.502 4.595 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)NC1(CCBr)CCCCC1 687284052 NVZLIVXWNIXUOS-UHFFFAOYSA-N 445.242 4.585 50 10 IJGE ClCc1cc(Br)c(OCCCO[C@H]2CCOC2)c(Br)c1 699530609 MWAIHQVQHPDRIN-NSHDSACASA-N 428.548 4.525 50 10 IJGE CCC[C@H](CCBr)NC(=O)c1ccc(I)c(Cl)c1 716855901 POALPXCECUOZIU-SNVBAGLBSA-N 444.538 4.628 50 10 IJGE CCCOc1ccc(C(=O)NN=Cc2ccc(OCc3ccc(F)cc3)c(OC)c2)cc1 725385644 BXVDZQBMKDRUNJ-UHFFFAOYSA-N 436.483 4.966 50 10 IJGE Cc1ccc(F)c(NNC(=O)C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)c1 784880851 FZQSHNZNQIBTSO-GFCCVEGCSA-N 442.343 4.502 50 10 IJGE CCOc1ccc(C=NNC(=O)c2cc3cc(Br)ccc3o2)c(OCC)c1 1084177269 RUGVSGZWXABCTJ-UHFFFAOYSA-N 431.286 4.757 50 10 IJGE C=CCN(CCOC)C(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1538839939 MUTYQGIDYDFILX-AQTBWJFISA-N 432.351 4.969 50 10 IJGE CC(C)(C)OC(=O)Nc1ccccc1CCC(=O)NNc1nc2ccccc2[nH]c1=S 1629912262 QZMYIRBOSYXYPH-UHFFFAOYSA-N 439.541 4.715 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccco2)CCC3)cc1Cl 1772747926 WEEAJVBNCFVHEH-UHFFFAOYSA-N 425.872 4.866 50 10 IJGE CCOc1ccc(/C=C/C(=O)Nc2cccc(C(=O)Nc3ccc(SC#N)cc3)n2)cc1 1860567548 AFNXMUTUVCNLAB-OVCLIPMQSA-N 444.516 4.958 50 10 IJGE CCc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865688845 CJBGTOLYJVONJH-LJQANCHMSA-N 441.318 4.724 50 10 IJGE CCc1nn(-c2cccc(Cl)c2)c2c1[C@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865688874 DALWRDWBXUCDDZ-GOSISDBHSA-N 427.291 4.665 50 10 IJGE CCCc1nn(-c2ccc(C)cc2)c2c1[C@@H](c1cccc(OC)c1OCC)C(C#N)=C(N)O2 1865692209 CLGHMTGWUUPSJC-QFIPXVFZSA-N 444.535 4.759 50 10 IJGE N#C/C(=C(/O)CNC(=O)c1ccc(Cl)cc1)c1nc(-c2cccc([N+](=O)[O-])c2)cs1 1873940889 LVOPOJQKMOFLHL-VLGSPTGOSA-N 440.868 4.594 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C1CC2(CCCN(C(=O)OC(C)(C)C)C2)C1 1882690454 NAEWJTSZDAHUST-RDYUPDBUSA-N 447.414 4.702 50 10 IJGE CN(Cc1cccc(Br)c1Br)CC1(CBr)CC1 1915518224 PKBXJVZTEYPMIP-UHFFFAOYSA-N 425.990 4.819 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)C(=O)c1ccc(Cl)cc1Br 1916354987 OJXBLBMHKOFITA-OAHLLOKOSA-N 431.157 4.999 50 10 IJGE BrCC[C@H]1CCN(Cc2cccc(Br)c2Br)C1 1943881489 RKEPDCWAKRFMQC-JTQLQIEISA-N 425.990 4.819 50 10 IJGE CC[C@H](CCBr)NC(=O)c1cccc(Br)c1Br 1943887772 VEAAPFAWSIEGBF-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(OCc2ccccc2)C(=O)[C@H](Cl)c2ccccc2)C1 1982826905 PAQFRPXELSHZTK-HXUWFJFHSA-N 430.932 4.546 50 10 IJGE CCN(CCCCBr)Cc1cc(Cl)ccc1I 1996956518 FFGXDIVAAHDWCC-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE C[C@H](NC(=O)c1cscc1OCc1ccccc1)c1nnc(CBr)s1 2072477765 UGCUNZWJQXKKRL-NSHDSACASA-N 438.372 4.565 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2C[C@@H]1CCN(Cc2ccccc2)C1 2096812099 CXNQSZRVIPGKEK-MRXNPFEDSA-N 433.781 4.763 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CCN(CC3(CBr)CCCCC3)CC[C@@H]2C1 2106783672 BWUMTZQIORIWOQ-QZTJIDSGSA-N 429.443 4.911 50 10 IJGE COc1cc(Cl)c([C@@H](Cl)c2c(Br)cnn2C)cc1Br 2137638866 AXTNDUZNDJKFDR-LLVKDONJSA-N 428.939 4.935 50 10 IJGE C[C@@H]1C[C@@H](O[C@](C)(CI)c2ccccc2Br)CCO1 2140602268 MILFGSDVHVDHBZ-TYNCELHUSA-N 439.131 4.683 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2[C@@H]3CC[C@@H](CN3CC3(CBr)CCCCC3)[C@H]2C1 2163061859 IMOUUZJZAOEFKI-MANSERQUSA-N 441.454 4.909 50 10 IJGE O=S(=O)(c1cc(CBr)sc1Br)N1CCCCC12CCC2 2183179520 MZMBVLRPEHMEIR-UHFFFAOYSA-N 443.226 4.503 50 10 IJGE COc1cccc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)c1CBr 2203205162 RPDXUAQDYFSZRD-IBGZPJMESA-N 443.307 4.843 50 10 IJGE BrC[C@H]1CCC2(CCC2)CN1C[C@H]1CC1(Br)Br 2213086921 BSLDYQSBERSSQA-GHMZBOCLSA-N 430.022 4.522 50 10 IJGE CN(CCN(CCCCI)Cc1ccccc1)Cc1ccccc1 2241521986 ZPPNTBCPKOCVPI-UHFFFAOYSA-N 436.381 4.836 50 10 IJGE O=C(N[C@@H]1CCC[C@H]1CCBr)c1cc(F)c(Br)cc1Cl 2282973996 FMPIUWONJFUBCQ-ISVAXAHUSA-N 427.539 4.925 50 10 IJGE Cc1cc(N2C[C@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)cc(CBr)n1 2288446203 VHUJXXWWBWKAGI-DHIUTWEWSA-N 426.402 4.777 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Br)[C@@]12COC[C@@H]1C2(F)F 2295366302 YSYGWCSDXCFOQD-ZMLRMANQSA-N 432.486 4.829 50 10 IJGE N#CC(=Cc1ccc(Cl)cc1)C(=O)Nc1nc2c(s1)CCN(Cc1ccccc1)C2 2297399296 LTULWGORJRATME-UHFFFAOYSA-N 434.952 4.900 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)C[C@@H](Br)C1CC1 2300241210 WKVUWOLKHHYCCG-LLVKDONJSA-N 428.539 4.550 50 10 IJGE BrC[C@@H]1C[C@@H]2CC[C@H]1N2Cc1c(Br)cccc1Br 2308524106 BZZZDRLABOYARP-PKFCDNJMSA-N 438.001 4.959 50 10 IJGE Clc1ccc(I)cc1C[C@H](CBr)C1CCOCC1 2327399280 PSPIUHYRTFUUGA-GFCCVEGCSA-N 443.550 4.925 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCC[C@H](c2n[nH]cc2NC(=O)OC(C)(C)C)C1 2382173610 FQWHVPVIHOLZAR-HOTGVXAUSA-N 443.430 4.993 50 10 IJGE CCCc1cc(C(=O)OC)c(NC(=O)/C(C#N)=C\c2c[nH]nc2-c2ccc(F)cc2)s1 34983471 QJPCGOVQLPSZLF-ZROIWOOFSA-N 438.484 4.562 50 10 IJGE N#C/C(=C/c1cc(Cl)ccc1OCc1ccc(C(=O)O)cc1)C(=O)NCc1ccccc1 35147759 YRILESQJQNLDPU-MTJSOVHGSA-N 446.890 4.841 50 10 IJGE Cc1c(C(=O)Nc2ccc(Cl)cc2)oc2c1/C(=N/NC(=O)c1ccc(O)cc1)CCC2 40812092 ZMZPIADBBBWVSR-NLRVBDNBSA-N 437.883 4.670 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N[C@@H](C)c2cc3cccc(OC)c3o2)c1C 105890071 KCRGSGDSZGOKBC-FPHNSIFGSA-N 435.524 4.852 50 10 IJGE Cn1c(/C(C#N)=C/c2cn(-c3ccccc3)nc2-c2ccncc2)nnc1-c1ccccc1 108968840 NDWVFECLADKXGK-LTGZKZEYSA-N 429.487 4.794 50 10 IJGE CCOc1cc(/C=N\NC(=O)CSc2nc3ccccc3s2)cc(Cl)c1OCC 169892964 VRHVDKPCUNHPTE-JJFYIABZSA-N 449.985 4.990 50 10 IJGE COc1ccc(Cc2nc3cc(C(=O)N/N=C\c4c(F)cccc4Cl)ccc3[nH]2)cc1 169925564 MYUGNGDMYGNPIC-ZMFRSBBQSA-N 436.874 4.719 50 10 IJGE N#C/C(=C/N1CCN(Cc2ccccc2)CC1)C(=O)Nc1ccc(Oc2ccccc2)cc1 217210540 HIFBJEMQEXQZKH-LNVKXUELSA-N 438.531 4.643 50 10 IJGE CC(=NNC(=O)CSc1nc2ccccc2n1Cc1ccccc1)c1ccc(F)cc1 254518590 ZCHKPXMCOWLQGK-UHFFFAOYSA-N 432.524 4.856 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)CCN1S(=O)(=O)c1cc(CCl)c(Cl)cc1Cl 382645419 JPXQSTHCZVPRAX-CQSZACIVSA-N 447.815 4.627 50 10 IJGE FC(F)Oc1cc(Br)cc(CBr)c1I 575682689 YURWYNUEKAGGEP-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE C[C@@H](CC(C)(C)C)CC(CBr)(CBr)[C@@H]1CCS(=O)(=O)C1 709256888 FYBGABQDHBNLID-QWHCGFSZSA-N 432.262 4.660 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)N2CCc3c(Cl)cccc32)c(-c2ccccc2)n1 757202667 HLBBWWDKVWNTSW-NBVRZTHBSA-N 427.895 4.613 50 10 IJGE O=C(CC1CCCCC1)NC1CCC(C(=O)Oc2ccc([N+](=O)[O-])c3ncccc23)CC1 770128284 ZIRLHCQLDLJZIB-UHFFFAOYSA-N 439.512 4.694 50 10 IJGE COc1cc(NC(=O)/C(C#N)=C\c2cc(C)n(-c3ccc(F)cc3)c2C)ccc1NC(C)=O 916086764 AMYQLRISKYXEBC-UNOMPAQXSA-N 446.482 4.746 50 10 IJGE Cc1ccc(-n2c(C)cc(C=NNC(=O)C(=O)Nc3ccc(Cl)c(Cl)c3)c2C)cc1 1084644455 PGTHUYPTEZEYTL-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE O=C(NNC(=NC(=O)c1ccco1)SCc1ccccc1)Nc1ccc(Cl)cc1 1088741911 XEBXUSXKBNQAND-UHFFFAOYSA-N 428.901 4.689 50 10 IJGE C[C@H](NC(=S)NNC(=O)c1ccc(Br)cc1)c1ccc(Cl)cc1Cl 1325620991 BZNFWOWVMDNVEQ-VIFPVBQESA-N 447.185 4.626 50 10 IJGE C=C[C@H](CC(=O)NNc1nc2ccccc2c(=O)n1-c1ccc(C)cc1C)c1ccccc1 1565754472 DERYPJGHQFOBJE-HXUWFJFHSA-N 438.531 4.806 50 10 IJGE O=[N+]([O-])c1ccc(-n2nc(-c3ccc(OC(F)(F)F)cc3)cc2CCl)c([N+](=O)[O-])c1 1614818171 COBXVSBGTATZLQ-UHFFFAOYSA-N 442.737 4.993 50 10 IJGE O=C(NNc1cc(C(F)(F)F)ccc1F)c1cc2ccc(C(F)(F)F)cc2nc1O 1633165080 BDSYYIXAYJPXEV-UHFFFAOYSA-N 433.283 4.874 50 10 IJGE COCCOC(=O)CCc1cc2c(C)cc(=O)oc2cc1OCc1cccc(CCl)c1 1871437404 VYTUGZHYQCLSHP-UHFFFAOYSA-N 444.911 4.541 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1(C)C 1881088353 GGQAAGDOEQVKEX-KBPBESRZSA-N 435.403 4.700 50 10 IJGE CCC[C@H](CCNC(=O)OC(C)(C)C)CCC(=O)N(C)C[C@H]1C[C@@H](Br)C1 1887824409 ZGKIKPHXZLHQJE-YESZJQIVSA-N 433.431 4.730 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CCl)c1Cl)N(Cc1ccccc1)[C@H]1CCOC1 1915469687 FBMVECSXOQSEID-INIZCTEOSA-N 434.772 4.712 50 10 IJGE CCN(C[C@](C)(CI)O[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)OC(C)(C)C 1917418953 CNVKOIXZDYYZHY-ADAWSYLGSA-N 437.362 4.642 50 10 IJGE C[C@]1(CBr)CC(F)(F)CN1c1ncc(Br)cc1Br 2041121583 KQSFILYWRAUCHQ-SNVBAGLBSA-N 448.931 4.606 50 10 IJGE CC[C@@H](Cl)C(=O)N(CCCNC(=O)OC(C)(C)C)c1cccc(Br)c1 2044693309 JPHOATFRBPOHLO-OAHLLOKOSA-N 433.774 4.714 50 10 IJGE CC(C)CN(Cc1ccccc1)S(=O)(=O)c1cc(CBr)n(C2CC2)c1 2059312395 KSBFNYVFKLHAIS-UHFFFAOYSA-N 425.392 4.565 50 10 IJGE C[C@]1(NC(=O)c2cc(Br)cc(Br)c2)CCC[C@@H]1Br 2062572909 FIJUKDSUBRDZIV-AAEUAGOBSA-N 439.973 4.648 50 10 IJGE COc1cccc(-n2nc(CBr)c(Br)c2C(F)(F)F)c1C 2079241147 YXMYGJDEVJWTSB-UHFFFAOYSA-N 428.046 4.866 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1cc(Br)ccc1Cl 2081235481 GPIVCYKPMACNHC-PRHODGIISA-N 444.538 4.682 50 10 IJGE CC(C)(C)OC(=O)NCCc1ccc(NC(=O)[C@H](Br)C2CCCC2)cc1 2110715254 LQPQNZQPEBLWKN-QGZVFWFLSA-N 425.367 4.646 50 10 IJGE Brc1ccccc1[C@H](CI)OC[C@H]1[C@H]2C[C@@H]3[C@H]1[C@@H]3C2 2134543350 ZOZPKGYYFDPBLG-HMVUZJKNSA-N 433.127 4.844 50 10 IJGE CCCN(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)[C@@H](Br)C1CCCC1 2167031240 HXILNHVAKYYMSB-WMZOPIPTSA-N 445.442 4.826 50 10 IJGE CN(C(=O)c1ccc(I)c(Cl)c1)[C@H]1CCCCC[C@H]1Cl 2172547479 NZPMHTCECQXPBP-RISCZKNCSA-N 426.125 4.957 50 10 IJGE COCc1cc(Br)c([C@H](Br)C2C[C@H](OC)[C@@H](OC)C2)s1 2174889808 VMULKBAXOGEDML-RWMBFGLXSA-N 428.186 4.533 50 10 IJGE FC(F)(F)[C@@H]1C[C@]1(CCl)CNCc1ccc(I)c(Cl)c1 2208027474 AGFWIZFMHMFGTC-NEPJUHHUSA-N 438.058 4.842 50 10 IJGE CC(C)(C)[C@H]1C[C@H](S(=O)(=O)N(Cc2ccccc2)[C@H](CBr)C2CC2)C1 2223683011 GBIYCVVYSOXATC-GUDVDZBRSA-N 428.436 4.817 50 10 IJGE CC1(NC(=O)OCc2ccccc2)CCC2(CC[C@H](CI)O2)CC1 2241903825 UNMVWVPPNADQJV-IPJUCJBFSA-N 443.325 4.598 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2C(F)(F)C23CC3)cc1I 2257359084 WNWZEQKMXQMWJA-MNOVXSKESA-N 429.042 4.781 50 10 IJGE O=C(c1scc(Br)c1Cl)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Br)C2 2264500973 IASDRTJLIAUWJS-KRYIENNFSA-N 431.552 4.643 50 10 IJGE CC(C)[C@H](Cl)[C@H](C)NCc1ccc(I)c(Br)c1 2306224461 QFXXURWHGCILEL-ZANVPECISA-N 430.555 4.795 50 10 IJGE N#CC(=Cc1ccc(OC(=O)C=Cc2cccc(Cl)c2)cc1)C(=O)NCc1ccco1 2314770932 HWMZQNYRUTXTKJ-UHFFFAOYSA-N 432.863 4.775 50 10 IJGE Clc1ccc(CN2C[C@H]3CC[C@@]3(CBr)C2)c(I)c1 2318547021 YAZWSWYKGXWFTC-BXUZGUMPSA-N 440.550 4.552 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cscc1C(F)(F)F 2320356330 KUDPVBHPFGLHFI-ZDUSSCGKSA-N 436.293 4.867 50 10 IJGE N#CC(=CNCc1ccc(Br)cc1)C(=O)Nc1cc(Cl)ccc1Cl 2324392560 SXZQHAUXGSBXNU-UHFFFAOYSA-N 425.113 4.892 50 10 IJGE CCOC(=O)c1ccc(NC=C(C#N)C(=O)N[C@H](CC)c2ccc3c(c2)CCCC3)cc1 2325079274 RYXYSYOVCWKATR-XMMPIXPASA-N 431.536 4.829 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)CC[C@@H]1C(F)(F)F 2353834173 LGSVWTWSBOEHTA-LSDHHAIUSA-N 445.364 4.917 50 10 IJGE CCn1ncc(Br)c1COc1cc(F)c(CBr)c(Cl)c1 2379793231 HEGFLJBNUIUFNT-UHFFFAOYSA-N 426.511 4.932 50 10 IJGE COc1cccc(NC(=O)[C@H](NNC(=O)c2ccc(C(C)(C)C)cc2)c2ccccc2)c1 15474804 GVGFYJRTMCXNNT-HSZRJFAPSA-N 431.536 4.607 50 10 IJGE CCCCCCCOc1ccc(C(=O)NNC(=O)COc2ccc(Cl)cc2C)cc1 100153646 OODARZYEVYEISP-UHFFFAOYSA-N 432.948 4.838 50 10 IJGE COc1ccc(OC)c([C@H](Br)c2cccc(I)c2)c1 109842885 ITPVLIXDAACRRZ-OAHLLOKOSA-N 433.083 4.793 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\N(c1ccccc1)c1ccc(N)cc1 217156056 RJPQRGDXNNHINM-ZCXUNETKSA-N 426.476 4.630 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=NNC(=O)c3cc4ccccc4cc3O)o2)cc1 254905218 IUDNTPLQAKCGAB-UHFFFAOYSA-N 428.444 4.746 50 10 IJGE Cc1ccccc1-n1c(C)cc(C=NNC(=O)C(O)(c2ccccc2)c2ccccc2)c1C 263626295 GKYASORTMDPGRW-UHFFFAOYSA-N 437.543 4.789 50 10 IJGE O=C(N[C@H]1CCC[C@H](Br)C1)c1ccc(Br)cc1Br 694502455 AHBGBVXIXMSYCG-WPRPVWTQSA-N 439.973 4.648 50 10 IJGE Cc1sc([C@@H](Br)c2cn(C)c(Br)n2)cc1Br 698416518 ANZRTTVOFDGMJG-VIFPVBQESA-N 428.975 4.799 50 10 IJGE Cn1c(Cl)cnc1COc1c(Br)cc(CCl)cc1Br 700198424 NELJBOIZYHFTHQ-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)NNc1cccc(F)c1F 745804067 YROPXMFLNUTQMO-UHFFFAOYSA-N 433.462 4.703 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)Nc2cc(F)ccc2O)c(-c2ccc(Cl)cc2)n1 759700445 BCOWOXFGBOLXLV-XNTDXEJSSA-N 435.846 4.508 50 10 IJGE C[C@H](Sc1ccccc1)c1ccc(NC(=O)C(=O)NNc2cccc(F)c2F)cc1 785019827 KLQFTSJJVWBXSC-AWEZNQCLSA-N 427.476 4.900 50 10 IJGE N#Cc1ccccc1Cn1cc(C=NNC(=O)CC[C@@H](O)c2ccccc2)c2ccccc21 1083907597 VZYZSQOAZRATFV-AREMUKBSSA-N 436.515 4.525 50 10 IJGE C=CCOc1ccccc1CNC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2 1227881209 VSAVPYZSVJOBNO-SFHVURJKSA-N 441.597 4.608 50 10 IJGE COc1ccc(-c2ccc(C(=O)N/N=C\c3cccc4ccccc34)c(C)n2)cc1OC 1865760505 AUYZCQNDIYKVMR-YUMHPJSZSA-N 425.488 4.991 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)c3cc4ccccc4oc3=O)n2)cc1OC 1872745073 AWXXJPLWFHUXOT-PGMHBOJBSA-N 432.457 4.884 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CC[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C1 1882088959 VUTUVIVYJCZODR-QKPAOTATSA-N 447.414 4.558 50 10 IJGE COc1cc([C@H](Br)[C@@H]2C[C@H]2Br)c(OC)cc1Br 1910111057 CVQNDCNLQSRMTP-SLOVDRIHSA-N 428.946 4.686 50 10 IJGE Clc1ccc(I)c(CN2C[C@@H]3C[C@H](C[C@@H]3Br)C2)c1 2045149435 OLFDEUJCOABOJX-NRUUGDAUSA-N 440.550 4.550 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCCCC[C@H]1NC(=O)c1ccc(CBr)cc1 2106199029 FKEWQKSMGCTIMI-IAGOWNOFSA-N 425.367 4.537 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C(=O)CCCCBr)C2(CCCCCC2)C1 2106596179 FIBKXDWKSVNZGV-INIZCTEOSA-N 431.415 4.770 50 10 IJGE CCc1ccc(-n2cc([C@@H](Br)C(C)C)nn2)cc1I 2128674777 XRJOESHPULOFDZ-AWEZNQCLSA-N 434.119 4.526 50 10 IJGE Brc1cccc([C@H](CI)OC[C@H]2[C@H]3[C@H]4C[C@@H]2C[C@H]43)c1 2134537845 FKOJSISRKQDBLI-PRLTYNAASA-N 433.127 4.844 50 10 IJGE Cc1nc(Oc2cc(F)c(Br)cc2[N+](=O)[O-])sc1CBr 2164482942 XKVSGUOVOSZTSB-UHFFFAOYSA-N 426.061 4.949 50 10 IJGE Fc1cc(Br)cc(N2CCS[C@H](C(F)(F)F)C2)c1CBr 2170700073 XHSSFACZLKZRSV-NSHDSACASA-N 437.094 4.967 50 10 IJGE Brc1ccccc1[C@@H](CI)O[C@H]1C[C@@H](n2cccn2)C1 2183685080 KRLRHOHQAXNBBU-TYNCELHUSA-N 447.114 4.542 50 10 IJGE CP(C)(=O)CCn1c(CCCl)nc2cc(Br)c(Br)cc21 2234070790 DSXHMNCKDOVELM-UHFFFAOYSA-N 442.519 4.965 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC2(C)CCCCC2)C1 2244591419 KAURDJMTOCYXCF-GOSISDBHSA-N 437.362 4.931 50 10 IJGE Br[C@@H]1C[C@@H]2CCCC[C@@H]2N(C[C@H]2CC2(Br)Br)C1 2246599618 UNVDVMBKXZOGML-QCNOEVLYSA-N 430.022 4.520 50 10 IJGE Fc1ccc(I)c(-n2c(Cl)nc(Cl)c2CBr)c1 2250095268 HLOVLCTUBUYZLA-UHFFFAOYSA-N 449.876 4.818 50 10 IJGE CC[C@H]1[C@H](Br)CCN1C(=O)c1cc(Br)c(Br)s1 2251009893 NBAATJIFMHWIRG-SVRRBLITSA-N 446.002 4.661 50 10 IJGE COc1ccc(C=C(C#N)C(=O)N(c2cccc(C)c2C)S(=O)(=O)c2ccccc2)cc1 2314777507 IDHXSDGKEPXDIC-UHFFFAOYSA-N 446.528 4.641 50 10 IJGE COc1cc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)cc(Cl)c1OC 2323166624 JTBPTXBGZVVKCO-ZDUSSCGKSA-N 425.916 4.727 50 10 IJGE C[C@H](C(O)=C(C#N)c1nc(-c2ccccc2Cl)cs1)N1C(=O)c2ccccc2C1=O 2331265862 JIJDYTUOWCGQGP-GFCCVEGCSA-N 435.892 4.941 50 10 IJGE Cc1scc(C(=O)N2CC[C@H](Br)C[C@H]2C(F)(F)F)c1Br 2369596637 QXBHMZWIXMCVJQ-CBAPKCEASA-N 435.103 4.749 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1ccc2cc(O)ccc2c1 2369677376 LVIMWEZVJSPVDC-FQEVSTJZSA-N 428.326 4.646 50 10 IJGE C#CCOc1cc(Br)c(/C=C(\C#N)c2ccc([N+](=O)[O-])cc2)cc1OCC 2846689 KMWZSJYLLPBANZ-MHWRWJLKSA-N 427.254 4.832 50 10 IJGE CC(C)CCOc1ccc(C(=O)NNC(=O)c2ccccc2OCCc2ccccc2)cc1 10509373 FAWXJPZAFCGFQU-UHFFFAOYSA-N 446.547 4.808 50 10 IJGE O=C(NNc1ncnc(Nc2ccc(Cl)cc2)c1[N+](=O)[O-])c1cccc2ccccc12 40649078 NINLIGPMUKRNLG-UHFFFAOYSA-N 434.843 4.692 50 10 IJGE CCN(c1ncnc(NNC(=O)c2ccc(Cl)cc2)c1N)c1cccc2ccccc12 40702046 RLEVLJJMMBWXCZ-UHFFFAOYSA-N 432.915 4.780 50 10 IJGE CCCOc1ccc(/C=C/C(=O)Oc2cccc(/C=C(\C#N)C(=O)OCC)c2)cc1OC 40926764 NMJSMTKFMQGULB-JNYZPFSCSA-N 435.476 4.573 50 10 IJGE CCCOc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(I)cc1 40948910 VXPXIQCCKKYVLQ-NTCAYCPXSA-N 432.261 4.626 50 10 IJGE CCOc1ccc(-c2csc(/C(C#N)=C\c3cc(C(=O)OC)cc(C(=O)OC)c3)n2)cc1 102938874 SFAVKWWWBQLDEQ-ODLFYWEKSA-N 448.500 4.846 50 10 IJGE CN([C@@H]1CCCC[C@@H]1Cl)S(=O)(=O)c1c(Cl)cc(Br)cc1Cl 158227707 WWBVDWNYBQLRGV-JOYOIKCWSA-N 435.598 4.926 50 10 IJGE C[C@@H](Br)[C@@](Br)(CBr)C(=O)Oc1ccc(Cl)cc1 205782781 KTCDUXGRNCZTMN-HQJQHLMTSA-N 449.364 4.557 50 10 IJGE COc1cc(C=NNC(=O)c2sc3cc(Cl)ccc3c2Cl)cc(OC)c1OC 252630683 VDDQQFOFCCCMHF-UHFFFAOYSA-N 439.320 4.998 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1C1[C@H]2CN(Cc3ccccc3)C[C@H]12 398463440 SWMTVGLIFZDZEM-RCBQFDQVSA-N 431.765 4.797 50 10 IJGE FC(F)c1cc(CBr)c(Br)cc1I 575686652 QAEQCLLXRKJZML-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE CN(Cc1ccccc1)CC1CCN(c2ccc([N+](=O)[O-])c(CBr)c2)CC1 717581488 WYWGWPBQJIMZSW-UHFFFAOYSA-N 432.362 4.838 50 10 IJGE Clc1cc(N2CC[C@]3(CN(Cc4ccccc4)CCO3)C2)ccc1CBr 717591120 IGAXSZQEHJZUNV-NRFANRHFSA-N 435.793 4.716 50 10 IJGE O=C(NNc1c(Cl)cc(F)cc1Cl)c1c(F)cccc1I 768010362 BQAOVEUZLYAFHM-UHFFFAOYSA-N 443.018 4.633 50 10 IJGE CCN(CC)CC1CCN(C(=O)C(=O)Nc2ccc(S(F)(F)(F)(F)F)cc2)CC1 772943258 IRMZGGQTPOEKAM-UHFFFAOYSA-N 443.482 4.863 50 10 IJGE C=CCOc1ccc(C=NNC(=O)c2ccc(CSc3nc(C)cc(C)n3)cc2)cc1 916293800 IEAMKGSEVYXBLM-UHFFFAOYSA-N 432.549 4.714 50 10 IJGE C#C[C@H](NC(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2)c1ccc(Cl)cc1 1478897122 SRVAOYNKPZWTLU-AEFFLSMTSA-N 444.000 4.871 50 10 IJGE CC(C)C(=O)Nc1cc2ccccc2cc1C(=O)NNc1nc2ccccc2[nH]c1=S 1633439524 KWBGTPNTFPIFCW-UHFFFAOYSA-N 431.521 4.797 50 10 IJGE CCc1ccc(OCC(=O)NN=Cc2ccc(OCc3ccc(C)cc3)c(OC)c2)cc1 1772754463 ICEDOZNAYMRMFX-UHFFFAOYSA-N 432.520 4.674 50 10 IJGE Cc1ccc(S(=O)(=O)NC/C(O)=C(\C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 1872748443 XOYKFXTYGHEBQE-ZPHPHTNESA-N 445.953 4.543 50 10 IJGE C[C@H](/C(O)=C(\C#N)c1nc(-c2c[nH]c3ccccc23)cs1)N1C(=O)c2ccccc2C1=O 1872753046 FPBRFBVTFLOQAA-PWNVGIJBSA-N 440.484 4.769 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)C(=O)c1c(F)cc(Br)cc1F 1916364109 IDXPZGAVNUATHZ-CQSZACIVSA-N 432.692 4.624 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]3(CC[C@@H]21)CC[C@](C)(CI)O3 1935707896 ZDRVODWGSNOAMI-LTCOOKNTSA-N 435.346 4.539 50 10 IJGE Cl[C@@H](c1cc(I)cc2c1OCC2)[C@H]1C[C@@H](Br)C1 2020175874 QFOXKCORBJSSKS-VDDIYKPWSA-N 427.507 4.680 50 10 IJGE C[C@@H](Br)C[C@@H](C)CNC(=O)c1cccc(Br)c1Br 2031477792 NVUQHAYURJJOLA-RKDXNWHRSA-N 441.989 4.751 50 10 IJGE O=S(=O)(CCC(F)(F)CBr)N(Cc1ccccc1)CC1CCCCC1 2059390764 SKNQYDKBOLWIMB-UHFFFAOYSA-N 438.378 4.819 50 10 IJGE Cc1nccc(Cl)c1-n1nc(CCl)c(I)c1C(F)(F)F 2078881013 NRFFJWAORYQTHY-UHFFFAOYSA-N 436.002 4.591 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H](C(F)(F)F)N(C[C@H](CBr)C(C)(C)C)CC1 2106783803 CRWJKJYFUVDHNI-UONOGXRCSA-N 445.364 4.917 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CCN(CC3(CBr)CCCCCC3)C[C@@H]2C1 2106784585 JQYDQPSIEAXDCV-QZTJIDSGSA-N 429.443 4.911 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@H](NC(=O)[C@H](Br)C2CCCC2)C1 2110716185 VDDICGPZCSULMP-BHYGNILZSA-N 431.415 4.530 50 10 IJGE CCN(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)c1ccc(CBr)cc1 2162912211 SEYCDSXBOQIBNM-SFHVURJKSA-N 439.394 4.833 50 10 IJGE CCc1sc(Br)cc1[C@H](Br)[C@]12CCC[C@@H]1CS(=O)(=O)C2 2201881642 PRBNJAMGZWVLMP-IIMNLJJBSA-N 442.238 4.724 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Br)CCc1cccc(OC(F)(F)F)c1 2249827404 CWOCMZDTMDWPGJ-CYBMUJFWSA-N 442.231 4.578 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@@H]1[C@@H]2CCO[C@@H]21 2259994929 NAMSQMASLSWLRX-NCFHRBORSA-N 446.911 4.961 50 10 IJGE Cc1nsc(Cn2c(CCl)nc3cc(Br)c(Br)cc32)n1 2279957231 JYSRVLMXNIKQHL-UHFFFAOYSA-N 436.560 4.508 50 10 IJGE CCO[C@@]1(COc2c(Br)cc(Cl)cc2CBr)CCOC1 2287071057 RZFFZNWEWMURGA-AWEZNQCLSA-N 428.548 4.572 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Br)c2)CC[C@H]1Cl 2306217345 OVSFNWYKNARNDX-BXKDBHETSA-N 428.539 4.503 50 10 IJGE O=C(C=Cc1ccc(OCc2ccccc2)cc1)NNC(=O)CCCSc1ccccc1 2321109407 AFGBRKWTWFHCJI-UHFFFAOYSA-N 446.572 4.999 50 10 IJGE COc1ccc(-c2ccc(C(=O)NN=Cc3cccc(OC(C)C)c3)c(C)n2)cc1OC 2321248630 ZCXFHUQPUXPZDA-UHFFFAOYSA-N 433.508 4.625 50 10 IJGE CCCCCCCCCOc1ccc(C=NNC(=O)c2cccn(C)c2=O)cc1Cl 2323627621 AHHBGSDXLPEKCK-UHFFFAOYSA-N 431.964 4.932 50 10 IJGE CCSc1ccc(Cl)cc1CC(=O)NN=Cc1ccc(OC)c(Br)c1 2323678084 KLAIBOHQZFDZOL-UHFFFAOYSA-N 441.778 4.916 50 10 IJGE CCCN1C[C@H](Cl)[C@H](Cc2ccc(I)c(Br)c2)C1 2325210082 VDPWMCLKKZXSGU-YPMHNXCESA-N 442.566 4.545 50 10 IJGE CC[C@H]1[C@H](CBr)CCN1Cc1cc(I)ccc1Cl 2327398964 KXBOOXVGLYNKFQ-HZMBPMFUSA-N 442.566 4.940 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2C[C@H](Br)C[C@H]1C2 2327399847 WTNLYUYMSFTPMT-XHVZSJERSA-N 440.550 4.692 50 10 IJGE N#CC(=C(O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 2331281228 WJOXIXHZMPHCSZ-QGZVFWFLSA-N 446.488 4.560 50 10 IJGE Cc1nsc(Br)c1C(=O)Nc1cc(F)c(CBr)cc1F 2368911978 UJJYUHPTJKZUNA-UHFFFAOYSA-N 426.080 4.639 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)[C@@H]1C[C@@H]2CCC[C@H](C1)C2(F)F 2369430754 IGWVSHRYELABCM-RDGPPVDQSA-N 444.360 4.935 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@H](NC(=O)OC(C)(C)C)CCC12CCOCC2 2382175008 XVFLMFDWCXRXHA-QZTJIDSGSA-N 447.458 4.582 50 10 IJGE C=CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4F)ccc32)c1 38684589 QKUFVVNDRRNJFQ-DEOSSOPVSA-N 442.446 4.828 50 10 IJGE C[C@@H](Br)CCCNC(=O)c1cc(Br)c(Br)s1 227711826 TZRFHISVEWFPKJ-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE O=C(c1cc(Br)sc1Br)N1[C@H]2CC[C@H]1CC(CCl)C2 719287889 YSRUPUNVEUPQNM-IUCAKERBSA-N 427.589 4.895 50 10 IJGE CC(=O)c1cc(C(=O)NNC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)cs1 1124229524 DJBYIPDGMKKRNR-UHFFFAOYSA-N 444.965 4.971 50 10 IJGE C=CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](O[Si](C)(C)C(C)(C)C)C1 1149156858 UWNVMDDQIIVEQJ-ROUUACIJSA-N 426.674 4.859 50 10 IJGE COc1ccc(/C(C#N)=C/c2ccc(OC(=O)c3ccc([N+](=O)[O-])cc3)cc2)cc1OC 1615099333 FAFBGXAFFIRUID-CPNJWEJPSA-N 430.416 4.895 50 10 IJGE C=CC[C@H](CO)CNC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1637571005 JSMWSOFPFMWGLR-PMFHANACSA-N 432.351 4.609 50 10 IJGE Cc1cc(Nc2ccc3c(c2)CCCC3)c(C(=O)NC[C@@]2(C)C[C@@H]2Br)c(O)n1 1642130280 WEDPSADJCTUCHN-PGRDOPGGSA-N 444.373 4.621 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865683365 KBFJFWFWKSVNHY-XMMPIXPASA-N 435.531 4.872 50 10 IJGE COc1cc2nc(/C(C#N)=C/c3cccc(OCc4ccccc4)c3)nc(O)c2cc1OC 1872727533 IHSRDVCHBNRROU-YBFXNURJSA-N 439.471 4.996 50 10 IJGE Ic1cccc(CO[C@@H]2CCCC[C@H]2I)c1 1902241697 UTIOICLQYZQIRS-CHWSQXEVSA-N 442.078 4.554 50 10 IJGE CN(C[C@H](Cl)COCc1ccccc1)C(=O)c1ccc(Br)cc1Cl 1916354612 JYPNRTXAFYRAGZ-HNNXBMFYSA-N 431.157 4.999 50 10 IJGE FC(F)(F)c1cnc(N[C@H](CCCl)C(F)(F)F)c(I)c1 1918533477 QTKPKMDQZBXSKR-SSDOTTSWSA-N 432.533 4.677 50 10 IJGE ClCCc1nc2cc(Br)ccc2n1Cc1csnc1Br 1926874187 WSBIYFWCJRQRCT-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CC1(C)CN(Cc2c(Br)cccc2Br)[C@H]1CBr 1945329057 AMTUFCBPTUMFRF-LBPRGKRZSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]([C@]2(C)CCC[C@@H](CI)O2)CC1 1993734192 BAOHDOCTKBLTHA-KRXQYRFLSA-N 437.362 4.833 50 10 IJGE CC1(C)C[C@@H](Br)CCN1c1ncc(Br)cc1Br 2003744930 RJSYIPMKNYXXBC-QMMMGPOBSA-N 426.978 4.749 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1cc(Br)cc(C#N)c1 2010826783 HJCVWPHRANPPRX-UHFFFAOYSA-N 432.409 4.639 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC2CC3(CCCC3)C2)C1 2017965275 HYZLKEQTUMJLMC-LJQANCHMSA-N 449.373 4.931 50 10 IJGE CC(C)(CBr)CN(C1CC1)[C@@H](CCNC(=O)OC(C)(C)C)C(F)(F)F 2044704450 CSTJFTMDMOFYCD-ZDUSSCGKSA-N 431.337 4.718 50 10 IJGE O=C(CBr)c1c(Br)ccc(OC(F)(F)F)c1Br 2054923850 ILTCTOACOHCDAD-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE FC1(F)C(O[C@H](CI)c2cccc(Br)c2)C1(F)F 2062572649 CBLMEQVOCZLEDS-MRVPVSSYSA-N 438.984 4.595 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)C(C)(C)C)[C@H](CC(F)F)C1 2063525293 TXOJGSMPEQCZOH-ZIAGYGMSSA-N 427.374 4.620 50 10 IJGE CCOc1cc(CBr)cc(Br)c1OC[C@H]1C[C@H]1Br 2076263754 ZJWGJPCFUAKSGV-NXEZZACHSA-N 442.973 4.905 50 10 IJGE O=S(=O)(C[C@@H](Br)c1ccccc1OCc1ccccc1)N1CCCCC1 2089397413 GMTZKCIFOREUIH-LJQANCHMSA-N 438.387 4.517 50 10 IJGE CCN(CC)CCN(Cc1ccccc1)S(=O)(=O)c1cc(CCl)ccc1Cl 2152215419 SEOZRVNQCSZWBF-UHFFFAOYSA-N 429.413 4.612 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C(=O)[C@H](Br)C2CCCC2)Cc2ccccc21 2167033094 LXKWTHIITBKNDI-QZTJIDSGSA-N 437.378 4.548 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@H]1CC2(CCCC2)CCN1C(=O)OC(C)(C)C 2237000486 DFMUNNQMUSCUJB-OFLPRAFFSA-N 443.426 4.578 50 10 IJGE CC(C)(C)OC(=O)NCCCN(CC1(CBr)CC(F)C1)c1ccccc1 2265637597 CPEOLYGJSKLGEV-UHFFFAOYSA-N 429.374 4.921 50 10 IJGE BrCC1(Cc2sccc2I)CC2(CCCO2)C1 2300992710 HKOOQNQTDRJJPS-UHFFFAOYSA-N 427.145 4.620 50 10 IJGE CCOc1cc(Br)c(C=C(C#N)C(=O)Nc2ccccc2F)cc1OCC 2313630611 CQYLKNLTBBAMFY-UHFFFAOYSA-N 433.277 4.931 50 10 IJGE CCOc1cc(C=NNC(=O)COc2ccccc2OC)ccc1OCc1ccc(C)cc1 2321706308 YLQGOOHFJXBDDQ-UHFFFAOYSA-N 448.519 4.510 50 10 IJGE CCCN1C[C@@H](Cl)[C@H](Cc2ccc(I)c(Br)c2)C1 2325210080 VDPWMCLKKZXSGU-DGCLKSJQSA-N 442.566 4.545 50 10 IJGE C[C@@H]1C[C@H](Br)[C@@H](C)N(Cc2cc(I)ccc2Cl)C1 2327396710 GUHJPOVGCFQQRG-BREBYQMCSA-N 442.566 4.938 50 10 IJGE Clc1ccc(I)cc1C[C@@]1(CBr)C[C@@]12CCOC2 2327399506 SFCWJDLSLCXHNE-KGLIPLIRSA-N 441.534 4.679 50 10 IJGE CC(C)CCOc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2)cc1Br 14645610 WWUFUECHODQIOT-UHFFFAOYSA-N 439.737 4.602 50 10 IJGE COc1ccc(/C(C)=N\NC(=O)CCCOc2ccc(Cl)cc2Cl)c(OC)c1 33432443 HUCLNEAPFFABSW-QRVIBDJDSA-N 425.312 4.710 50 10 IJGE CC(C)c1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccco2)cc1 38657538 UWCZDAMETKJURE-XMMPIXPASA-N 430.460 4.606 50 10 IJGE CCN(c1cccc(C)c1)c1ncnc(NNC(=O)c2cccc3ccccc23)c1[N+](=O)[O-] 40572481 ZWFZZCIVILBSAJ-UHFFFAOYSA-N 442.479 4.761 50 10 IJGE Nc1c(NNC(=O)C(c2ccccc2)c2ccccc2)ncnc1Nc1cccc(Cl)c1 40781802 LCHURNMGSRBIKI-UHFFFAOYSA-N 444.926 4.731 50 10 IJGE COc1cc(CBr)cc(Cl)c1OCc1c(Br)c(C)nn1C 91324594 DPRKPYJTZHQREP-UHFFFAOYSA-N 438.547 4.627 50 10 IJGE C[C@@H](Br)C(C)(C)NC(=O)c1cc(Br)c(Br)s1 128784690 FQQDBPLOEOBNDB-RXMQYKEDSA-N 433.991 4.565 50 10 IJGE COc1ccc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)cc1Br 169891170 ZCGTXLHLEYFQPM-RTNLCPHNSA-N 440.341 4.828 50 10 IJGE CCCOc1ccccc1/C=C(/C#N)C(=O)Nc1sc(C(C)=O)c(C)c1C(=O)OCC 206981917 WKCQCPMSQXSGHM-ATVHPVEESA-N 440.521 4.770 50 10 IJGE CC(C)(C)[C@@H](CCBr)NS(=O)(=O)c1ccc(Cl)c(Br)c1 231189317 BSHBVHOMQQXJFM-GFCCVEGCSA-N 447.620 4.581 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)c1C 302891453 GRZJDSQZRZFGIO-BRLDDBHUSA-N 435.524 4.900 50 10 IJGE FC(F)c1cc(Br)c(CBr)c(I)c1 575687744 VUZNISUZLLMZRY-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE O=S(=O)(N[C@H](CCBr)C1CCCCC1)c1sccc1Br 725075687 AIWGDLGNUZZSDH-GFCCVEGCSA-N 445.242 4.523 50 10 IJGE Cc1ccccc1NNC(=O)Cc1ccc(NC(=O)c2ccc(Br)cc2)cc1 739390856 FHYZNVLQQFIQMP-UHFFFAOYSA-N 438.325 4.696 50 10 IJGE CN(C)c1ccc(C=NNC(=O)CSCc2ccccc2Cl)cc1Br 1084575219 KYVROAIZNAVZLF-UHFFFAOYSA-N 440.794 4.552 50 10 IJGE C#CCSCCNC(=O)/C(C#N)=C\c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1444390856 ZMHVPZBHYMSVPN-BOPFTXTBSA-N 432.376 4.791 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@H]2C)oc2c1C(=NNC(=O)c1cccs1)CCC2 1772748925 HILMBUSTZOFXBC-CQSZACIVSA-N 433.533 4.711 50 10 IJGE CCCc1nn(-c2cccc(Cl)c2)c2c1[C@@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865683724 NUOKEFUOHPBPBI-NRFANRHFSA-N 433.943 4.762 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706288 SIFAANNLMSPTDT-FQEVSTJZSA-N 449.898 4.664 50 10 IJGE CCC[C@H](NC(=O)/C=C(\CC)c1ccc(OC)cc1)C(=O)Nc1ccc(SC#N)cc1 1866688125 OTHODYGKDMIJBB-DKXPKDADSA-N 437.565 4.985 50 10 IJGE Cc1cc(Cl)c(C[C@H](Br)CN2C(=O)c3ccccc3C2=O)c(Cl)c1 1893708323 GFYSEZSEFRNCPY-NSHDSACASA-N 427.125 4.904 50 10 IJGE CCn1nc(C)c(Br)c1CN(Cc1ccccc1)C[C@H](C)Br 1914639842 VBFYSZLDMQGGDK-ZDUSSCGKSA-N 429.200 4.760 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1sncc1Br 1915290117 AFOSJUZNMZTBCW-AWEZNQCLSA-N 446.208 4.968 50 10 IJGE CC[C@@H](NC(=O)c1csc(Br)c1Br)[C@@H](C)Br 1937736918 BOCYIXMWEDQGAF-IYSWYEEDSA-N 433.991 4.565 50 10 IJGE O=C(NC1(CCBr)CCC1)c1cc(Br)c(Br)s1 1942472260 XYDIRDNBBRQPLZ-UHFFFAOYSA-N 446.002 4.711 50 10 IJGE FC(F)CN(CCBr)Cc1cccc(Br)c1Br 1943885858 SHBGETGVOYNTDZ-UHFFFAOYSA-N 435.932 4.674 50 10 IJGE C[C@@]1(CBr)CCN(Cc2c(Br)cccc2Br)C1 1945331400 SCBHOQCOSJXDNB-ZDUSSCGKSA-N 425.990 4.819 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(Cc2ccccc2)C[C@@H](CBr)CC2CC2)C1 1953971066 WHJYDRNJZUEOAT-LJQANCHMSA-N 437.422 4.919 50 10 IJGE C[C@H](Br)[C@H]1CCN(Cc2cc(Br)ccc2Br)C1 2006501893 WMFZPCHNMQSUOA-UWVGGRQHSA-N 425.990 4.817 50 10 IJGE CC[C@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1C 2025940441 WTUXHFYOAJPPHE-KRWDZBQOSA-N 430.795 4.966 50 10 IJGE C[C@H](CCBr)CCN=[S@]1(=O)CC[C@H](CNC(=O)OC(C)(C)C)C1(C)C 2044706711 WMICHSGKWQEQAS-XGZNKIABSA-N 439.460 4.589 50 10 IJGE BrC[C@H]1[C@H]2CN(Cc3cc(Br)ccc3Br)CC[C@H]21 2054718416 NDKWZRDQNVXNBM-XQQFMLRXSA-N 438.001 4.674 50 10 IJGE C[C@@H]1C[C@@H](C(F)(F)F)N(CCCCCBr)CCN1C(=O)OC(C)(C)C 2058048109 BDORDEALMATYHR-KGLIPLIRSA-N 431.337 4.814 50 10 IJGE C[C@]1(NC(=O)c2ccc(Br)cc2Br)CCC[C@H]1Br 2062573160 HBZITGVMWNJSEC-YPMHNXCESA-N 439.973 4.648 50 10 IJGE CCN(CC)C[C@@H](Br)CCc1ccc(I)c(Cl)c1 2086648479 IMLCGKNREWBMIG-LBPRGKRZSA-N 444.582 4.983 50 10 IJGE CCCN(C(=O)[C@H](Br)C(C)C)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2106775155 UZGYNORMWFFLNF-FCLJQHQZSA-N 431.415 4.575 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1cccc(Br)c1F 2117896116 XWVDUHJJRDAIJG-JTQLQIEISA-N 442.110 4.702 50 10 IJGE ClCc1c(Br)cccc1N1CC[C@H]2COC[C@@H](C1)N2Cc1ccccc1 2139652480 PHSOVOAQNBEWHM-ZWKOTPCHSA-N 435.793 4.668 50 10 IJGE O=C(NC[C@@]12CCC[C@@]1(CCl)C2)c1cc(Br)c(Br)s1 2142939677 IRBWKIJOYSFCFP-STQMWFEESA-N 427.589 4.802 50 10 IJGE CCC[C@](C)(CCl)NS(=O)(=O)c1cc(Br)c(C)cc1Br 2146580328 PMWBTWKDPNOELP-CYBMUJFWSA-N 447.620 4.596 50 10 IJGE CC1(C)CCC[C@]1(CCl)NC(=O)c1ccc(I)c(Cl)c1 2150542509 NORMBSRPHDSJMH-OAHLLOKOSA-N 426.125 4.862 50 10 IJGE Fc1cc(Br)c2nc(CCCl)n([C@]34C[C@@H]3CN(Cc3ccccc3)C4)c2c1 2155873728 QYDJKBRNYGVEKC-VFNWGFHPSA-N 448.767 4.950 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CCC[C@H]1CN(C[C@@H](CBr)c1ccccc1)C2 2163058628 MBXOZQKWQCICOG-DXIQSLLYSA-N 437.422 4.792 50 10 IJGE CC(C)(C)OC(=O)N1CCCN(CC2(CBr)CCOCC2)c2ccccc21 2163059213 RIQVOEZRFNIFOE-UHFFFAOYSA-N 439.394 4.830 50 10 IJGE Cn1nc(-n2c(CCl)nc3cc(Cl)c(Br)cc32)cc1Br 2169015297 KHIZXXCAYMASKW-UHFFFAOYSA-N 438.938 4.676 50 10 IJGE C[C@H]1CCCC[C@H]1N(C)S(=O)(=O)c1cc(CBr)sc1Br 2179790825 JHIGUEVGQIIRMF-GXSJLCMTSA-N 445.242 4.605 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@]12CCCC[C@H]1N(C(=O)OC(C)(C)C)CCC2 2196915339 XNCUVYRKTWJXTN-NOKFLLHDSA-N 443.426 4.578 50 10 IJGE C[C@@H]1C[C@@H](Br)[C@@H](C)N(c2ncc(Br)cc2Br)C1 2214807604 FDMZOJXFODIOKS-NQMVMOMDSA-N 426.978 4.605 50 10 IJGE COc1ccc([C@@H](Br)[C@@H](F)C(F)(F)F)cc1I 2248896845 VUVYCGWKNGTNMN-RKDXNWHRSA-N 426.973 4.636 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CCCCCCCBr)C[C@H]1CC(F)F 2263165410 TWJGXEUNGMYNJW-OAHLLOKOSA-N 427.374 4.908 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CC2(CBr)CC(F)C2)Cc2ccccc21 2265632025 JUFFWKSTLXSBNI-CMVHYPBASA-N 427.358 4.581 50 10 IJGE Cc1c(CBr)cccc1NC(=O)c1ccccc1I 2268265284 CWHNEUIGLSUAHB-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE C[C@@H](CBr)CC1CN(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282971332 AWDPBPCNAJUXSO-MRVPVSSYSA-N 427.539 4.735 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCc2ccccc2)ccc1OCCOc1ccc(C)cc1 2293131215 GPVLCVPQJHGXLG-UHFFFAOYSA-N 442.515 4.685 50 10 IJGE C[C@@H](CCCCCl)NCc1ccc(I)c(Br)c1 2306219937 RLKYQWKQABMRJT-JTQLQIEISA-N 430.555 4.941 50 10 IJGE CCOc1cc(C=C(C#N)C(=O)N[C@H](C)c2ccccc2)c(Br)cc1OC 2313724693 UJRDRPMHOUQAJB-CQSZACIVSA-N 429.314 4.641 50 10 IJGE CC[C@H](C)N1C(=O)C(=Cc2ccc(OCc3ccc(F)cc3)c(OC)c2)C(C)=C(C#N)C1=O 2314611130 RCJISSJMJNRJIA-INIZCTEOSA-N 448.494 4.804 50 10 IJGE CCOC(=O)C(C#N)=Cc1ccc(OC(=O)C=Cc2ccccc2Cl)c(OCC)c1 2314736151 XJYIHPVDENISFI-UHFFFAOYSA-N 425.868 4.828 50 10 IJGE CCCCOC(=O)c1ccccc1NC(=O)C(C#N)=CN1CCC(Cc2ccccc2)CC1 2318462915 SOAKDKXSIPFPLF-UHFFFAOYSA-N 445.563 4.944 50 10 IJGE O=C(Nc1ccc(CBr)c(F)c1)c1csc(I)c1 2319303042 AQWRVAWBKRKGRK-UHFFFAOYSA-N 440.075 4.639 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)C=Cc1ccc(Cl)cc1 2321059083 ABVDMGZTEAZRLM-UHFFFAOYSA-N 426.303 4.838 50 10 IJGE CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1cccc(Oc2ccccc2)c1 2328825050 LRCCZUFYIXCWAX-FQEVSTJZSA-N 443.569 4.575 50 10 IJGE Fc1c(CN(CCBr)C2CCOCC2)ccc(Cl)c1Br 2381971637 MAQRKNQBSUMBKA-UHFFFAOYSA-N 429.555 4.618 50 10 IJGE CCCCc1ccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3)c2[N+](=O)[O-])cc1 40581274 QWCNHXQXJWTZDW-UHFFFAOYSA-N 440.891 4.881 50 10 IJGE CCc1nn(C)c2c1nc(CCl)n2-c1ccc(Br)cc1Br 98040607 XNNBLGRNDSINPU-UHFFFAOYSA-N 432.547 4.585 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(=O)Nc1ccccc1C(=O)O 103485554 NDXDZAFTXXGXJF-XFXZXTDPSA-N 437.795 4.752 50 10 IJGE COc1ccc(C[C@H](Br)c2cccc(I)c2)cc1OC 110295435 IVFQDZULWFBMPA-AWEZNQCLSA-N 447.110 4.987 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccccc2Cl)cc([N+](=O)[O-])c1OCc1ccccc1 169886085 IEOUHFPGDZNRLZ-CFRMEGHHSA-N 439.855 4.600 50 10 IJGE CCOc1ccc(CCN/C=C(/C#N)C(=O)Nc2cccc(Cl)c2C)cc1OCC 217093496 LPWRZPQWJKTUGN-SDXDJHTJSA-N 427.932 4.624 50 10 IJGE CCC(=NNC(=O)[C@@]1(C)CC1(Br)Br)C12CC3CC(CC(C3)C1)C2 252627376 RSYPGRYDAVPQDX-XPSVCEGCSA-N 446.227 4.981 50 10 IJGE CC(=NNC(=O)c1ccc(Br)o1)c1ccc(NC(=O)C2CCCCC2)cc1 254821122 FCTDCZVJVAILBX-UHFFFAOYSA-N 432.318 4.715 50 10 IJGE ClCc1cc(I)c2c(I)csc2c1 307417206 JQEGAPBLHGQPSF-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE Clc1cccc(N2CC[C@@H](N3CCN(Cc4ccccc4)CC3)C2)c1CBr 312603355 FZLBHNOVGSEFPD-LJQANCHMSA-N 448.836 4.631 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Cn1c(CCCl)nc2cc(Br)cnc21 708568337 MUANAWMBGZQZLW-NVXWUHKLSA-N 447.808 4.743 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@@H](Cc2nccn2C)c2ccccc2)c(C)n1CCC(C)C 744351238 YHZVYQHTPQALRG-WWNGRIQCSA-N 443.595 4.892 50 10 IJGE CC(=NNC(=O)c1ccc(Cl)cc1)c1c(O)c2ccccc2n(-c2ccccc2)c1=O 1081815359 FCGZAGKVSKLYED-UHFFFAOYSA-N 431.879 4.504 50 10 IJGE C=C(C)[C@@H](NC(=O)NNc1ccccc1I)c1ccc(F)c(F)c1 1680284416 NLCSTAGCKQVOQR-MRXNPFEDSA-N 443.235 4.513 50 10 IJGE CCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccccc1OC)C(C#N)=C(N)O2 1865709710 FFTOEBISGAHULC-LJQANCHMSA-N 441.318 4.968 50 10 IJGE O=C(/C=C/c1cccc(OCc2ccccc2)c1)NNC(=O)CCCSc1ccccc1 1865755996 AAANMPKSTZZYIV-WUKNDPDISA-N 446.572 4.999 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@H](Cl)Cc1ccc(Br)c(Cl)c1F 1905341611 CECUZNZMRLIFQB-SNVBAGLBSA-N 431.088 4.688 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)C(=O)c1cc(Cl)ccc1Br 1916354689 KTVCVTILMDMVFZ-OAHLLOKOSA-N 431.157 4.999 50 10 IJGE COc1cc(Br)c(O)c(C=NNC(=O)c2sc3ccccc3c2Cl)c1 1933279703 KHSVYLZKFVICQV-UHFFFAOYSA-N 439.718 4.795 50 10 IJGE CN(Cc1c(Br)cccc1Br)[C@H]1CCC[C@@H]1Br 1945324158 WIEPYOBDPDZSLA-STQMWFEESA-N 425.990 4.959 50 10 IJGE CC1([C@@H](CBr)NC(=O)c2csc(Br)c2Br)CC1 1945361456 KDEIPACJGXBJRA-SSDOTTSWSA-N 446.002 4.567 50 10 IJGE O=S(=O)(c1ccc(Cl)c(CBr)c1)N(Cc1ccccc1)C1CCC1 2009622915 XBJANOWZXDHUCT-UHFFFAOYSA-N 428.779 4.978 50 10 IJGE CCCN(CCCBr)C(=O)c1c(Br)cccc1Br 2033091250 OOUCMKGRDPXYIS-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE Cc1c(Br)sc([C@H](Cl)C2(S(C)(=O)=O)CCC2)c1Br 2047873511 OQYCFBGJDFYIBE-VIFPVBQESA-N 436.618 4.829 50 10 IJGE CC(C)(C)OC(=O)NCCCN(C[C@H](CBr)CC1CC1)CC(F)(F)F 2050064062 QXYWROJVJMAWCH-AWEZNQCLSA-N 431.337 4.577 50 10 IJGE FC(F)(F)[C@@H]1C[C@@H]1[C@H](Br)c1cc(I)cc2c1OCC2 2100660416 SAIOROCHQLZHKD-GDPRMGEGSA-N 447.032 4.861 50 10 IJGE C[C@@H]1CCC[C@H](CNC(=O)OC(C)(C)C)N1C[C@H](CBr)c1ccccc1 2106782414 QGGFAAGNVPNUHS-NZSAHSFTSA-N 425.411 4.933 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@@H](Cl)C2(CCCC2)C1 2117747644 ACVVFNMGPXKIBQ-SECBINFHSA-N 427.589 4.897 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)C(C)(C)CN1C[C@H](CBr)c1ccccc1 2133658228 XADKHKYSHNCOBI-AEFFLSMTSA-N 425.411 4.885 50 10 IJGE Cc1cc(C(=O)NC[C@]2(F)CC[C@H](CBr)CC2)c(Br)s1 2178583517 YMRKSGURVLPHJH-YPFXGUDJSA-N 427.177 4.842 50 10 IJGE C[C@H]1[C@@H](Br)C[C@@H](C)CN1Cc1ccc(I)c(Cl)c1 2220345118 QPCKGZYYZODVLR-SCVCMEIPSA-N 442.566 4.938 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1C(=O)c1cc(Br)sc1Br 2251033368 JPXJMNJPVGQESU-HTQZYQBOSA-N 446.002 4.661 50 10 IJGE CC[C@@H](C[C@H](C)Br)NC(=O)c1ccc(Cl)c(I)c1 2256387865 GXIPPEDSMBVXFV-WPRPVWTQSA-N 444.538 4.627 50 10 IJGE O=C(NC1(CCBr)CCSCC1)c1scc(Br)c1Cl 2264507172 OOKPIFOSGGWANH-UHFFFAOYSA-N 447.645 4.945 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CCC([C@@H](F)CBr)CC1 2264512320 BGQPNRQWFGXXPV-VIFPVBQESA-N 433.568 4.749 50 10 IJGE N#CC(=Cc1ccc(-c2ccc(C(=O)O)cc2)o1)C(=O)Nc1cccc(Br)c1 2293571191 RGUAQQGAUIQAAD-UHFFFAOYSA-N 437.249 4.953 50 10 IJGE C[C@]1(CBr)CCN(Cc2ccc(Cl)c(I)c2)C1 2300239085 UCEVGVJFOANMHQ-CYBMUJFWSA-N 428.539 4.552 50 10 IJGE ClCC1(CNCc2ccc(I)c(Br)c2)CCC1 2306221325 GWFWMNDRDVFTFL-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE Clc1ccc(CN2CC[C@@H](Br)C23CCC3)cc1I 2315552780 ISJHFAUVGSSJPA-CYBMUJFWSA-N 440.550 4.837 50 10 IJGE C[C@@]12CN(Cc3ccc(Cl)c(I)c3)C[C@@]1(CBr)C2 2315555382 QEIKIHGXRIQDOU-KGLIPLIRSA-N 440.550 4.552 50 10 IJGE C=CC[C@@H](Br)[C@H]1CCN1Cc1ccc(Cl)cc1I 2318537957 GTOWVZCLNCFOQS-TZMCWYRMSA-N 440.550 4.859 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)C(C#N)=CNCc1ccc(Br)cc1 2325079157 SPKJIXUDWQJOKM-MRXNPFEDSA-N 442.357 4.531 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2CO[C@]3(C)C[C@H]2C3)cc1I 2337698261 SCOSUPAKLAPCAC-FKGLVLAHSA-N 437.115 4.551 50 10 IJGE Cn1cc(I)c(C[C@@]2(CBr)CCCCC23CCC3)n1 2341761017 RRQVLBIFSZXOGB-OAHLLOKOSA-N 437.163 4.693 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CC[C@@](CNC(=O)OC(C)(C)C)(C3)C2)C1 2345011045 QDIAJYBUMVTDIC-JXFKEZNVSA-N 429.443 4.815 50 10 IJGE CCCN(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2351887544 ALCALDJPGPCJQJ-YJBOKZPZSA-N 439.385 4.908 50 10 IJGE FC1(F)C[C@]1(CBr)CN1CCC2(CCN(Cc3ccccc3)CC2)CC1 2351889746 XRARESISGQIBFW-FQEVSTJZSA-N 427.377 4.785 50 10 IJGE CC(C)(C)[C@@H]1[C@H](Cl)CCN1C(=O)c1ccc(Cl)cc1I 2365591197 KNTGVBYBKDLNNJ-YPMHNXCESA-N 426.125 4.813 50 10 IJGE CC(C)[C@H](Br)C(C)(C)CN(C)S(=O)(=O)c1cc(Br)cs1 2365907333 HANAXUTYLRTLCP-LBPRGKRZSA-N 447.258 4.577 50 10 IJGE CCO[C@H](Nc1ccc(C(=O)C(Cl)Cl)cc1)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 3609621 XDTGRQWFLSGROG-SFHVURJKSA-N 445.686 4.892 50 10 IJGE COc1ccc(C=NNC(=O)Cc2csc(Nc3cccc(C(F)(F)F)c3)n2)cc1C 13108836 XFBPQDQSZISDJW-UHFFFAOYSA-N 448.470 4.915 50 10 IJGE CCCOc1ccc(Br)cc1C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 14652779 PDJHNWVLQUSDBZ-UHFFFAOYSA-N 433.346 4.610 50 10 IJGE Cc1ccc(C(=O)N/N=C/c2c(O)c(Br)cc3oc4c(c23)CCCC4)cc1 27527888 BNTAVQIBRFPOAQ-FOKLQQMPSA-N 427.298 4.852 50 10 IJGE CCOC(=O)C1=C(c2ccc(OC)cc2)OC(N)=C(C#N)[C@H]1c1ccc(Cl)cc1Cl 35576440 RSCJGKZEHYYPPN-GOSISDBHSA-N 445.302 4.784 50 10 IJGE COc1cc(/C=N\NC(=O)c2sc3cc(Cl)ccc3c2Cl)c(O)c([N+](=O)[O-])c1 38803947 YJCKHGVBOMQOFA-SCDVKCJHSA-N 440.264 4.594 50 10 IJGE O=S(=O)(NCC1(CCl)CCCC1)c1c(Cl)cc(Br)cc1Cl 160426884 ITRHNESJLRICLG-UHFFFAOYSA-N 435.598 4.833 50 10 IJGE CC[C@](C)(CCCl)NC(=O)c1cc(Br)ccc1I 228557676 AIKXNYNJGZVBLS-CYBMUJFWSA-N 444.538 4.581 50 10 IJGE CC(C)(C)S(=O)(=O)CC[C@@H](CBr)Cc1ccccc1Br 232659112 FGJOGXNVFIHVPP-GFCCVEGCSA-N 426.214 4.606 50 10 IJGE CC(=NNC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(C)cc1)c1ccccc1 252629933 UQNTZDQTCNUOOZ-UHFFFAOYSA-N 441.560 4.875 50 10 IJGE O=C(O)c1ccc(COc2ccc(C=NNC(=O)c3cccc(C(F)(F)F)c3)cc2)cc1 254287012 FMYBDHJVOAJWSA-UHFFFAOYSA-N 442.393 4.747 50 10 IJGE O=C(NN=Cc1ccccc1C(F)(F)F)c1ccccc1OCCOc1ccccc1 254612841 ZGUQGABIPSNWEI-UHFFFAOYSA-N 428.410 4.927 50 10 IJGE CCCCOc1ccc(OCC(=O)NN=Cc2ccccc2OCc2ccccc2)cc1 254877628 YEJFLVVPFVYYMK-UHFFFAOYSA-N 432.520 4.974 50 10 IJGE CCOC(=O)c1c(NC(=O)[C@@]23CC[C@@](C)([C@H]2Br)C3(C)C)sc2c1CCC2 256019338 VLYOCIDKHMPMHM-LSTHTHJFSA-N 440.403 4.942 50 10 IJGE COc1ccccc1[C@@H](Br)c1cc(I)cc2c1OCC2 380257812 PAJUGOWAKUWQRH-OAHLLOKOSA-N 445.094 4.719 50 10 IJGE O=C(N[C@H](CCl)Cc1ccccc1)c1scc(Br)c1Br 705418900 MLMVGQJYVRSJSB-JTQLQIEISA-N 437.584 4.853 50 10 IJGE CCN(C(=O)/C(C#N)=C\c1cc(C)n(C[C@@H]2CCCO2)c1C)[C@@H](C)Cc1ccc(OC)cc1 731336268 WHIJPROQWZZJSO-LSMJRZRZSA-N 449.595 4.679 50 10 IJGE O=C(NCc1ccc(Sc2ccc(F)cc2)cc1)NNC(=O)c1cccc2cccnc12 773523610 PYECDBHEUYASKC-UHFFFAOYSA-N 446.507 4.669 50 10 IJGE Cc1cccc(-n2c(C)cc(/C=C(/C#N)C(=O)n3ccc(=NCC(F)(F)F)cc3)c2C)c1 775493110 HFPKOCMFXRJONS-MOSHPQCFSA-N 438.453 4.914 50 10 IJGE CC(C)(C)OC(=O)Nc1cc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)ccc1F 799753119 OMIVCTDTPMBUHR-UHFFFAOYSA-N 438.381 4.820 50 10 IJGE C=CCCc1ccccc1NC(=O)NNC(=O)c1cc(-c2ccncc2)nc2ccccc12 800576488 MUMFLGWZIAQRRZ-UHFFFAOYSA-N 437.503 4.882 50 10 IJGE CC(=O)Oc1ccc(-n2c(C)cc(C=NNC(=O)c3ccc4ccccc4c3)c2C)cc1 1083967825 DZLBDHSWFAEMHK-UHFFFAOYSA-N 425.488 4.937 50 10 IJGE Cc1ccc(-n2nc(C)c(C=NNC(=O)COc3ccc(Cl)cc3Cl)c2C)cc1C 1084590646 WULGNBOXKJCANI-UHFFFAOYSA-N 445.350 4.942 50 10 IJGE Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)NNc1nc2ccccc2[nH]c1=S 1167430803 SCMWRRJSJQEDFT-UHFFFAOYSA-N 438.944 4.564 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNc2cc(Cl)ccc2Br)c(O)n1 1645079356 SETBIINWKIRMQX-UHFFFAOYSA-N 448.704 4.636 50 10 IJGE Cc1c(C(=O)Nc2cccc3cccnc23)oc2c1C(=NNC(=O)c1cccs1)CCC2 1772749475 NSYFXCUPVFTFAS-UHFFFAOYSA-N 444.516 4.920 50 10 IJGE CCOc1ccc2ccccc2c1C=NNC(=O)COc1ccc(Br)c(C)c1 1772753838 AXDCEWRMSVAXHH-UHFFFAOYSA-N 441.325 4.839 50 10 IJGE C[C@@H](Oc1cccnc1NC(=O)Nc1ccc(SC#N)cc1)C(=O)Nc1ccccc1 1858834395 FGBNUOSTMNIMOZ-OAHLLOKOSA-N 433.493 4.705 50 10 IJGE CCCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@H]2c1cn(C)c2ccccc12 1865699301 PYEVNHGJQSSEJE-QFIPXVFZSA-N 439.519 4.679 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1cccc(OC)c1)C(C#N)=C(N)O2 1865711796 IFQXLZBIAGMPSL-NRFANRHFSA-N 434.927 4.764 50 10 IJGE Cc1cccc(OCCCC(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3)nc2C)c1 1865755526 CMUVCBDKRBMTPC-UHFFFAOYSA-N 437.927 4.639 50 10 IJGE COc1ccc(/C=C(\C#N)C(=O)NC2CCC(c3c[nH]c4ccccc34)CC2)cc1OC 1866130374 QXYKEXLELXSPPG-CPNJWEJPSA-N 429.520 4.935 50 10 IJGE CCCC[C@@H](NC(=O)CCc1c[nH]c2ccccc12)C(=O)Nc1ccc(SC#N)cc1 1866573361 OGBMBSWQRZDYFR-JOCHJYFZSA-N 434.565 4.987 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)c1ccccc1Br 1902777359 MRUUZGKHYMKVDH-OAHLLOKOSA-N 441.163 4.549 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)S(=O)(=O)c1ccc2c(c1)CCCC2 1915109434 GNICNUYXUGRYCO-QGZVFWFLSA-N 436.415 4.930 50 10 IJGE C[C@H](CCBr)N(Cc1ccccc1)C(=O)c1ccc(Br)c(O)c1 1915131809 AKUDSHBCLGKDQG-CYBMUJFWSA-N 441.163 4.971 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1c(F)ccc([N+](=O)[O-])c1F 1915274597 SIXBNTCLFXBYFD-INIZCTEOSA-N 441.272 4.935 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@]23CC[C@@](C)(CI)O3)C1 1918347494 SZKPMRIZUITEKJ-KSZLIROESA-N 435.346 4.540 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCC2(CCC2)[C@]12CC[C@@](C)(CI)O2 1924954445 GHVJZAHGBTXEDV-FNHZYXHNSA-N 449.373 4.834 50 10 IJGE CC(C)(C)OC(=O)N1CCC(C2CCN(C[C@@H](CBr)C3CC3)CC2)CC1 1962826767 MKQNUMHZQPFLEF-LJQANCHMSA-N 429.443 4.767 50 10 IJGE CC(F)(F)C[C@@H](CCl)NC(=O)c1cc(Br)sc1Br 2050365841 AKZAKDHISMTEQW-YFKPBYRVSA-N 425.520 4.656 50 10 IJGE CCO[C@@H](C)c1nc(CN(C)C[C@H](Br)COCc2ccccc2)cs1 2050592378 ZQSSAVVRTAQGSH-RDJZCZTQSA-N 427.408 4.653 50 10 IJGE FC(F)c1cc(I)c(I)c(CCl)c1 2060237139 DVRRNKNVJDGSFE-UHFFFAOYSA-N 428.385 4.572 50 10 IJGE C[C@H]1CN(c2ncc(I)cc2Br)CC[C@@H]1CCCl 2069529890 UCIOGFOEJONQNL-UWVGGRQHSA-N 443.554 4.540 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@H](CBr)CC2CC2)C[C@H]1CC(F)(F)F 2119510938 BIXFIICJRRGCGC-HUUCEWRRSA-N 443.348 4.671 50 10 IJGE Cc1sc(C)c(S(=O)(=O)N[C@@H](CCBr)C(C)(C)C)c1Br 2143914077 NFQICJNNQUGDOC-JTQLQIEISA-N 447.258 4.605 50 10 IJGE CC(C)(C)C[C@H](CCl)CNC(=O)c1ccc(I)c(Cl)c1 2156325632 FXSOBSLZYXYNNN-SNVBAGLBSA-N 428.141 4.966 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@]12CCC[C@@H](CI)O2 2243432840 FDBKYQRENDSWII-MPGHIAIKSA-N 437.362 4.642 50 10 IJGE CC(C)(C)OC(=O)NCc1cccc2c1N(CCCCI)CCC2 2248242019 RJWFQDCQTVWDNS-UHFFFAOYSA-N 444.357 4.679 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Br)c1cnc(Cl)n1C 2264356378 LSYCXGUFJMYURS-JTQLQIEISA-N 428.939 4.982 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@@H](Br)[C@H]1[C@@H]2CCO[C@@H]21 2298020092 VYMFIKGUJLQYMM-RWXLGCHESA-N 428.921 4.822 50 10 IJGE ClC[C@@]1(Cc2ccc(I)c(Br)c2)CCCCO1 2306225467 DJVZOXUJTFIQAW-ZDUSSCGKSA-N 429.523 4.774 50 10 IJGE Cc1cccc(NC(=O)C(C#N)=Cc2c(Oc3ccccc3C)nc3ccccn3c2=O)c1 2314533209 PPKXVRKIIACTDN-UHFFFAOYSA-N 436.471 4.649 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Cl)[C@H]1COC2(CCC2)CO1 2364176997 ZYGAGDOPVOCRCH-OLZOCXBDSA-N 428.523 4.969 50 10 IJGE Cc1cc2c(c(=O)n1Cc1ccccc1)[C@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 2326297 HWQMVXZKYJQJNP-HXUWFJFHSA-N 438.314 4.730 50 10 IJGE CCCCCOc1ccc(C(=O)NNC(=O)c2ccc(NC(=O)c3ccccc3)cc2)cc1 14029515 NLJQGXATJIPHIY-UHFFFAOYSA-N 445.519 4.583 50 10 IJGE N#C/C(=C/Nc1ccc(N2CCCCC2)cc1)C(=O)N1CCC(Cc2ccccc2)CC1 216883401 QGXHKNBHIGAPBM-FLFQWRMESA-N 428.580 4.978 50 10 IJGE N#C/C(=C/NC1CCN(Cc2ccccc2)CC1)C(=O)Nc1ccc(Cl)c(Cl)c1 217006427 WEOOLWMBBBDUOS-VKAVYKQESA-N 429.351 4.594 50 10 IJGE N#C/C(=C/NCCc1cccc(Br)c1)C(=O)Nc1ccc(Cl)c(Cl)c1 217006912 RTHSVZDDDPOBOX-QBFSEMIESA-N 439.140 4.934 50 10 IJGE Cc1cc(C=NNC(=O)c2cccc([N+](=O)[O-])c2)c(C)n1-c1sc2c(c1C#N)CCCC2 254615714 KULCORVAXMQVQK-UHFFFAOYSA-N 447.520 4.578 50 10 IJGE CC1(C)CN(C(=O)c2scc(Br)c2Br)C[C@@H]1Br 705429121 WBIVNFQIGUGHHC-ZETCQYMHSA-N 446.002 4.519 50 10 IJGE O=C(N[C@H](CBr)C1CCC1)c1cc(Br)c(Br)s1 717615761 KFWUEXOOWXVLMO-MRVPVSSYSA-N 446.002 4.567 50 10 IJGE CCOc1ccc(/C=C(\C#N)C(=O)N2CCC([C@H]3C(=O)Nc4cc(Cl)ccc43)CC2)cc1 727413375 NCXOTTRJUGFDAI-PZSRYKBRSA-N 449.938 4.620 50 10 IJGE CC(C)(C)OC(=O)Nc1cc(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)ccc1F 730516042 ADWAAOOZTJDTQE-UHFFFAOYSA-N 429.492 4.545 50 10 IJGE O=C(NNC(=O)c1ccccc1O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1 779505933 KPVSDKTULMDGFO-UHFFFAOYSA-N 431.370 4.670 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccc3c(c2)nc(O)n3C2CCCC2)c(C(F)(F)F)c1 799752978 JVOMJUUYNBJGQV-UHFFFAOYSA-N 429.402 4.504 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccncc2)ccc1OCc1cccc2ccccc12 1084120676 QWICSSPAAHRZTG-UHFFFAOYSA-N 425.488 4.976 50 10 IJGE Cc1cc(C)cc(CSCC(=O)NN=Cc2ccc(N(C)C)c(Br)c2)c1 1084624758 JUKYUAUMRZNTQT-UHFFFAOYSA-N 434.403 4.515 50 10 IJGE C=C(C)c1cccc(NC(=O)NNC(=O)c2cc3c(C)nn(-c4ccccc4)c3s2)c1 1628031112 NJGXTQKQPLSCBP-UHFFFAOYSA-N 431.521 4.895 50 10 IJGE Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)NNc1nc2ccccc2[nH]c1=S 1641877543 WSQIWVJGWRHVLP-UHFFFAOYSA-N 444.442 4.767 50 10 IJGE C#C[C@H](NC(=O)NNc1cccc(OC(F)F)c1Br)c1ccc(Cl)cc1 1686918228 HRQOWMYMVLBJQF-LBPRGKRZSA-N 444.663 4.705 50 10 IJGE COc1cc(C=NNC(=O)COc2ccc(C)cc2)ccc1OCc1ccccc1Cl 1772752816 FYKBINXYVMNHDB-UHFFFAOYSA-N 438.911 4.765 50 10 IJGE O=C(CSc1nc(-c2ccc(Cl)cc2)cs1)NN=Cc1cccc([N+](=O)[O-])c1 1772754981 DSRNFGOODITYHB-UHFFFAOYSA-N 432.914 4.614 50 10 IJGE COc1ccc(-n2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2ccc(Cl)cc2)cc1 1865683772 PFDDHXDQOAFVID-INIZCTEOSA-N 446.816 4.771 50 10 IJGE COCCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(-c3ccc(N(C)C)cc3)cc2)cc1 1866214012 NRKUEYFUZTXAFA-PTGBLXJZSA-N 441.531 4.990 50 10 IJGE O=C(NN(Cc1ccccc1)Cc1ccccc1)c1cccc(I)c1 1923847041 BDDKBMMPIHAQRU-UHFFFAOYSA-N 442.300 4.638 50 10 IJGE C[C@H](Br)CN(Cc1cccc(Br)c1Br)C1CC1 1943886499 ZQSOOCKPZRHPMU-VIFPVBQESA-N 425.990 4.959 50 10 IJGE FC(F)c1c(CBr)ccc(I)c1Br 2054779547 JMZWQSCMWCLPPT-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE C[C@H](Cl)c1nc2cc(I)ccc2n1C[C@H]1C[C@@H]1Br 2076170248 HAQXLAJKUBZBSB-XKSSXDPKSA-N 439.522 4.724 50 10 IJGE Clc1cc2c(cc1[C@H](Br)c1sncc1Br)OCCO2 2088926672 AIBUTZWIDBWMHD-NSHDSACASA-N 425.529 4.815 50 10 IJGE ClCc1ccc(Br)cc1N1CC[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2129053718 NTMFDZZHTMJVOM-RTWAWAEBSA-N 435.793 4.668 50 10 IJGE O=C(N[C@H]1CCN(Cc2ccccc2)C2(CCC2)C1)c1ccc(CBr)cc1 2173443397 JMXGOFIBGIYKMR-NRFANRHFSA-N 427.386 4.899 50 10 IJGE Cc1c(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)ccnc1CBr 2205626209 QEHOYLKVTNHNSJ-AWWSKVOZSA-N 426.402 4.632 50 10 IJGE COC[C@@H]1CC[C@H]([C@H](Br)c2ccc(OC)c(I)c2)C1 2269541313 DHRKCFQFJPTZHR-ZETOZRRWSA-N 439.131 4.799 50 10 IJGE COc1ccc([C@@H](Br)c2ccccc2OC)cc1I 2269556028 KUPRLQDNJGYWIP-OAHLLOKOSA-N 433.083 4.793 50 10 IJGE C[C@@H](Br)[C@H]1CCCN(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285844687 PYPIJLNLYHVWQQ-BDAKNGLRSA-N 427.539 4.877 50 10 IJGE CC(C)[C@@]1(NC(=O)c2ccc(CBr)cc2)CCCN(C(=O)OC(C)(C)C)C1 2289940516 RIYIFMSXRWODHZ-OAQYLSRUSA-N 439.394 4.737 50 10 IJGE Clc1ccc(I)cc1CN1CC(CCCBr)C1 2307333658 GLPCMONQWCVMMJ-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE CCCCOc1ccc(C=CC(=O)Oc2ccc(C=C(C#N)C(=O)OC)cc2OC)cc1 2314734738 GRRJRDJHMBRNNS-UHFFFAOYSA-N 435.476 4.573 50 10 IJGE CC(C)[C@@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)CCCCBr)n1 2315742391 NTVKODJTOPSEIT-CQSZACIVSA-N 434.400 4.869 50 10 IJGE Clc1ccc(CN2CC[C@@H](Br)[C@H]2C2CC2)c(I)c1 2318539140 LHSMEAARDJRKHA-TZMCWYRMSA-N 440.550 4.692 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1CC(F)F 2328525232 HGQLULMRAWFRLU-GJZGRUSLSA-N 427.374 4.620 50 10 IJGE COc1ccc([C@H](Br)[C@]23C[C@H](C[C@@H](C)O2)C3)cc1I 2342811738 UOGAYOLPCKPSHU-RPVFDAQASA-N 437.115 4.693 50 10 IJGE FC(F)(F)c1ccc(CBr)c(N2C[C@H]3CCN(Cc4ccccc4)[C@H]3C2)n1 2369845489 UOTRNALTACWOHL-SJORKVTESA-N 440.307 4.706 50 10 IJGE CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccccc3F)ccc21 38650548 SIXMYFSRVKQWSN-QHCPKHFHSA-N 430.435 4.662 50 10 IJGE CC(C)c1ccc(OCC(=O)Oc2ccc(/C=C(\C#N)C(=O)NCc3ccco3)cc2)cc1 40929671 ORPIOSNMIRVPOH-KGENOOAVSA-N 444.487 4.611 50 10 IJGE COc1ccc(CN(C(=O)CCl)[C@@H](C(=O)NC2CCCCC2)c2ccccc2C)cc1 97914454 DUKRWHJLUMZXNA-XMMPIXPASA-N 442.987 4.761 50 10 IJGE O=C(c1csc(I)c1)N(CCBr)C1CCCCC1 122665953 BZCVKCKPLYRKLK-UHFFFAOYSA-N 442.160 4.523 50 10 IJGE C[C@@H]1CCC[C@H](OC2(CI)CCN(C(=O)OC(C)(C)C)CC2)C1 231314447 LSGDJJZKFHUSNX-CABCVRRESA-N 437.362 4.786 50 10 IJGE Cc1onc(-c2ccccc2)c1C(=O)NN=Cc1cccc(OC(=O)c2cccc(F)c2)c1 252599220 DGXYGTYAOUFSNV-UHFFFAOYSA-N 443.434 4.772 50 10 IJGE COc1ccc(C=NNC(=O)c2nc(-c3ccccc3)cc(-c3ccccc3)n2)c(OC)c1 254765243 XEXLYHUKXIRQBG-UHFFFAOYSA-N 438.487 4.592 50 10 IJGE CCn1c(SCC(=O)NN=C/C(Br)=C/c2ccccc2)nc2ccccc21 254833706 KTYVWTHNWAAPIG-KPDPHHEUSA-N 443.370 4.686 50 10 IJGE CC(C)(C)OC(=O)N1[C@@H](c2ccccc2)[C@H](c2ccccc2)OC(=O)[C@H]1Br 301054862 NOVNBQKUIAJJBO-BZSNNMDCSA-N 432.314 4.984 50 10 IJGE ClCc1cc2c(I)c(I)ccc2s1 307368840 OBEXSUPJTPAANK-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE C[C@@H](Br)C[C@H]1CCCCCN1S(=O)(=O)c1sccc1Br 312932752 FVYRHELYXXKIBG-GHMZBOCLSA-N 445.242 4.617 50 10 IJGE CN(Cc1cc(Cl)ccc1I)C[C@H](Br)C1CC1 690333499 RVYOBDCTOKTIJS-LBPRGKRZSA-N 428.539 4.550 50 10 IJGE Clc1cc(Br)c(OCCOC[C@@H]2CCCO2)c(CBr)c1 708055453 CYOJLCXJTLEPRR-LBPRGKRZSA-N 428.548 4.572 50 10 IJGE C[C@@H]1CCCC[C@@H]1OC1(CI)CCN(C(=O)OC(C)(C)C)CC1 725343863 BZPJXCKWMUSDIM-CABCVRRESA-N 437.362 4.786 50 10 IJGE N#C/C(=C/c1ccc(C(=O)O)cc1Cl)c1nc(O)c2cc(Br)ccc2n1 783688716 OBNDBRJLOJDCOL-WZUFQYTHSA-N 430.645 4.514 50 10 IJGE COc1ccc(/C=C(/C)C(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)cc1F 804207649 VEJFKBPTFWETJH-RAXLEYEMSA-N 446.404 4.857 50 10 IJGE O=C(NN=Cc1cccc(Br)c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 1081168717 SJHXDBSFGGSWGK-UHFFFAOYSA-N 440.272 4.604 50 10 IJGE Cc1cc(OCC(=O)NN=Cc2cccc3cccnc23)c(C(C)C)cc1Br 1084095441 IBDAFOHZLVWRMN-UHFFFAOYSA-N 440.341 4.958 50 10 IJGE Cc1ccccc1C(=O)NN=C1C(=O)N(Cc2c(Cl)cccc2Cl)c2ccccc21 1084588173 PWJNNIKUWWVKPN-UHFFFAOYSA-N 438.314 4.983 50 10 IJGE C#CCOc1ccc(C=NNC(=O)[C@H](C)c2ccc(CC(C)C)cc2)cc1Br 1084603566 LASFMARCWQNLCZ-QGZVFWFLSA-N 441.369 4.913 50 10 IJGE CC(=O)c1ccc(Br)c(NC(=O)NNc2ccc(Br)cc2C)c1 1477017618 GKSIDDCIDHLMIL-UHFFFAOYSA-N 441.123 4.871 50 10 IJGE CC(=O)c1cccc(OCc2cc(C(=O)NN(Cc3ccccc3)c3ccccc3)no2)c1 1533762419 DBXYFEKOOHZGNN-UHFFFAOYSA-N 441.487 4.808 50 10 IJGE C=CCOc1ccccc1CN(C(=O)/C(C#N)=C/c1cnn(C)c1)c1ccc(C)c(C)c1 1627425846 QQBABQWMCXTBOX-OEAKJJBVSA-N 426.520 4.742 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cc(Cl)c(Br)cc1F 1629912414 UEUYMVNNDWEJFN-UHFFFAOYSA-N 427.686 4.604 50 10 IJGE C=CCCC[C@H](NC(=O)NNC(=O)c1ccc(F)cc1Br)c1ccccc1 1684989108 OTSGKPOXWBSHAI-SFHVURJKSA-N 434.309 4.630 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@H]2C)oc2c1C(=NNC(=O)c1ccc(F)cc1)CCC2 1772745169 SDSLASTZFQCAJQ-OAHLLOKOSA-N 445.494 4.789 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc3ccccc23)[C@@H]1c1ccc(O)cc1 1865683393 CHMVSQKXQKDTQR-LJQANCHMSA-N 448.404 4.968 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(C)cc2)cc1 1865692384 LRMKUSAAIJEIPK-XMMPIXPASA-N 428.536 4.945 50 10 IJGE CCN(CC)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc(Cl)c2)cc1 1865702238 QELPXSUCHHMKOS-JOCHJYFZSA-N 433.943 4.899 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2ccc([N+](=O)[O-])c(CBr)c2)C1 1921467334 AIVAPWNLNAPCKJ-IAGOWNOFSA-N 432.362 4.837 50 10 IJGE Cc1cc([C@@H](Br)c2cc(Br)n(C)n2)sc1Br 1937821238 FGJJJMZNFWSAHA-VIFPVBQESA-N 428.975 4.799 50 10 IJGE C[C@@H]1CCN(Cc2ccc(Br)cc2Br)[C@H]1CBr 1943842649 HEUUQVJRRTUGCM-RNCFNFMXSA-N 425.990 4.817 50 10 IJGE Clc1nc(N2CCN(Cc3ccccc3)C3(CCC3)C2)sc1CBr 1949583617 JMAFDJCTBLLJIC-UHFFFAOYSA-N 426.811 4.936 50 10 IJGE CC1([C@@H](CBr)NCc2cc(Br)ccc2Br)CC1 2006499453 JSAHTMBIJJMAKH-GFCCVEGCSA-N 425.990 4.865 50 10 IJGE C[C@@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)[C@H]1C[C@H](CBr)C1 2009645158 HZQHVJRCLCJIJM-XIRDDKMYSA-N 428.417 4.815 50 10 IJGE CC(C)N(C)C[C@@H](Br)CCc1cc(Cl)ccc1I 2038159569 IFUBJCCWZPYVLC-LBPRGKRZSA-N 444.582 4.981 50 10 IJGE FC(F)Oc1c(CBr)ccc(OC(F)(F)F)c1I 2060220002 LIMOGLWFGZEFMY-UHFFFAOYSA-N 446.935 4.686 50 10 IJGE C[C@H](Br)CCc1cn(-c2ccc(Br)c(Br)c2)nn1 2068982874 YNEJWMXYKHSZHG-QMMMGPOBSA-N 437.961 4.508 50 10 IJGE Cc1ccc(F)c(Cn2nc(CCl)c(I)c2C(F)(F)F)c1 2079212337 QEMKOSNJGJKOQR-UHFFFAOYSA-N 432.586 4.741 50 10 IJGE COc1cccc(-n2nc(CBr)c(Br)c2C(F)(F)F)c1OC 2079236577 ZVQIEZBHEYOUEO-UHFFFAOYSA-N 444.045 4.566 50 10 IJGE CC(C)(C)N(CCCl)C(=O)c1ccc(Br)cc1I 2086150735 FGLPKPUEUWZERS-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE CC[C@]1([C@H](Br)c2cc(I)cc3c2OCC3)CCCO1 2090698400 YMZIRXDBQBKKNP-HUUCEWRRSA-N 437.115 4.621 50 10 IJGE FC(F)[C@@H]1CCc2c3c(cc(I)c2[C@@H](Br)C1)CCO3 2094490334 ZPBWNDLVZJOQDD-SCZZXKLOSA-N 443.069 4.880 50 10 IJGE CC(C)(C)OC(=O)N1CCC(C2CCN(C[C@@H](Br)C(F)(F)F)CC2)CC1 2106954058 FUROXTAVWKQXCD-OAHLLOKOSA-N 443.348 4.671 50 10 IJGE CCOc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)CC)cc1CBr 2123246384 LWPLKPCGARNNMM-MRXNPFEDSA-N 440.403 4.970 50 10 IJGE C[C@@H]1C[C@H](O[C@](C)(CI)c2ccccc2Br)CCO1 2140602266 MILFGSDVHVDHBZ-LALPHHSUSA-N 439.131 4.683 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@H]1CN(C(=O)[C@@H](Br)C1CCCC1)C1CC1 2167033871 POAQZVOOEJCTNH-ROUUACIJSA-N 443.426 4.721 50 10 IJGE CN(C(=O)c1c(Cl)cccc1Br)[C@@H](CCBr)C(F)(F)F 2178519744 CWJLWEUQYHNHIV-VIFPVBQESA-N 437.481 4.890 50 10 IJGE C[C@H](C(=O)N(C)CC1CC(Br)C1)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 2196906615 HLBLTTPJGGXVQV-HRSCSKTISA-N 439.394 4.520 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1c(F)ccc(Br)c1F 2210044866 UCESSVJPSBGOER-MRVPVSSYSA-N 429.099 4.558 50 10 IJGE Cc1c(Br)csc1C(=O)N[C@@H](C)CCCCCI 2219003662 SQRWQWUHUVLAFJ-VIFPVBQESA-N 444.176 4.933 50 10 IJGE CC(C)(C)OC(=O)N[C@H](C[S@@](C)(=O)=NCCCCCCBr)C(C)(C)C 2223286923 BFMRQLDRRTZGFR-SGANQWHYSA-N 441.476 4.979 50 10 IJGE CN(C(=O)Cc1ccc(Br)cc1Cl)[C@@H](CCBr)C(F)F 2237437948 BMTASJUIUJYVLP-NSHDSACASA-N 433.518 4.522 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@]12COC[C@@H]1C2 2260000336 YTOPVLAKXXTHJM-LVRCTXOYSA-N 446.911 4.962 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@H]2C[C@@]23CCOC3)c1 2263526185 QBQOCELACKYOMI-MELADBBJSA-N 438.985 4.944 50 10 IJGE CC[C@@H]1[C@@H](CBr)CCN1C(=O)c1cc(Br)c(F)cc1Cl 2285958887 RRHHDZLSIXRBMQ-AMIZOPFISA-N 427.539 4.877 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccc(Br)o2)sc2c1CCCC2 2296817767 NTDNCCASRBWDDV-UHFFFAOYSA-N 449.326 4.705 50 10 IJGE C[C@@H](Cl)[C@@H]1CCCN1Cc1ccc(I)c(Br)c1 2306218055 WHYPROUWDJEDNE-RNCFNFMXSA-N 428.539 4.645 50 10 IJGE C[C@H](Br)CCCN(C)Cc1cc(I)ccc1Cl 2307328624 PFQVONVWHVKTAY-JTQLQIEISA-N 430.555 4.940 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H]2CC[C@]2(CBr)C1 2327396086 ZLUBBQPNPHXYOF-FZMZJTMJSA-N 440.550 4.552 50 10 IJGE BrC[C@@H]1Cc2ccccc2CN1Cc1sccc1I 2338755439 PVINZRULKWFOEE-ZDUSSCGKSA-N 448.167 4.675 50 10 IJGE CC(C)C[C@H](CBr)CN1CC[C@H](C(F)(F)F)[C@H](NC(=O)OC(C)(C)C)C1 2353835442 SKDJTDCMEXWBFF-QLFBSQMISA-N 445.364 4.821 50 10 IJGE CC[C@H](C)c1ccccc1O[C@@H](C)C(=O)NNC(=O)COc1ccc([C@H](C)CC)cc1 9873887 RCXUKSVJHCWPPQ-QYZOEREBSA-N 426.557 4.707 50 10 IJGE CC/C(=N\NC(=O)COc1ccc2ccccc2c1Br)c1ccc(O)cc1 12575952 FUXYFDSGUNEEPP-PTGBLXJZSA-N 427.298 4.617 50 10 IJGE O=C(CCCc1nc2ccccc2s1)NNC(=O)C(c1ccccc1)c1ccccc1 35552049 FBVGZGLUXQUJJF-UHFFFAOYSA-N 429.545 4.599 50 10 IJGE O=C(c1ccc(I)c(Cl)c1)N(CCCl)Cc1ccccc1 232347613 VZIOEFMICVZRDT-UHFFFAOYSA-N 434.104 4.826 50 10 IJGE CC[C@@H](CCBr)CNC(=O)c1cc(Br)cc(Br)c1 233872126 KPBIWRDLCULDBJ-VIFPVBQESA-N 441.989 4.753 50 10 IJGE O=S(=O)(c1cc(CCl)c(Cl)cc1Cl)N1CCCN(Cc2ccccc2)CC1 323888598 FHKPSJOVEUWSNK-UHFFFAOYSA-N 447.815 4.629 50 10 IJGE Oc1ccc([C@H]2CN(Cc3ccccc3)C[C@@H]2CI)cc1Cl 382687060 GGLZHAWAZMUHFO-JKSUJKDBSA-N 427.713 4.696 50 10 IJGE Cc1cc(Br)c(S(=O)(=O)N(CCCl)C(C)(C)C)cc1Br 691039443 FHTXPGJIMJJWNY-UHFFFAOYSA-N 447.620 4.548 50 10 IJGE CCn1cc([C@H](Cl)c2cc(Br)c(F)cc2OC)nc1Br 698391816 NXLZULQNHATEAG-GFCCVEGCSA-N 426.511 4.904 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@@]1(C)CN(c1cc(CCl)c(Br)cn1)C2 705898761 VFHWAHWDWXNOFG-SFTDATJTSA-N 434.809 4.931 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)N(C[C@@H]2CCCO2)c2ccncc2)c(C)n1-c1ccc(F)cc1 733972696 WPHFKXNCEBALPB-IJKLPWTBSA-N 444.510 4.747 50 10 IJGE CCOc1cccc(CCNS(=O)(=O)c2cccc(S(F)(F)(F)(F)F)c2)n1 777996790 KQZYWLUZPYJOTC-UHFFFAOYSA-N 432.436 4.659 50 10 IJGE N#Cc1ccc(NNC(=O)C2(c3cc(F)cc(Br)c3)CC2)c(C(F)(F)F)c1 803361376 VFOZWHJXRSVGDW-UHFFFAOYSA-N 442.210 4.654 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NCc2ccccc2C(F)(F)F)c(-c2ccccc2)n1 914474012 HDVOEHVODFMZNN-UYRXBGFRSA-N 449.436 4.706 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)Oc2c(F)c(F)cc(F)c2F)c(-c2ccccc2)n1 916865808 HSKLKWJNXVOIOQ-ZROIWOOFSA-N 440.356 4.533 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1S[C@@H](C)C(=O)NN=C(C)CCC 1083889661 PCRXBLHZNSTHIL-HNNXBMFYSA-N 434.997 4.502 50 10 IJGE Cc1cc(C(=O)NNc2nc3ccccc3[nH]c2=S)nn1-c1cccc(C(F)(F)F)c1 1629911887 DYASHPLOVOAZBK-UHFFFAOYSA-N 444.442 4.562 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)/C=C/c1cccc(F)c1 1865759125 JRUHUFOIZJMDHU-BJMVGYQFSA-N 444.293 4.977 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)CCc2ccccc2F)cc1 1866597130 QUCQQJLBDANUEJ-QHCPKHFHSA-N 447.535 4.698 50 10 IJGE C[C@H](NC(=O)c1csc(Br)c1Br)C(C)(C)CBr 1945187548 XKWTXFASEFHBCC-LURJTMIESA-N 448.018 4.813 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)C(=O)Cc1ccc(O)c(Br)c1 1980632960 UOOMMUVSWSKTHQ-ZDUSSCGKSA-N 441.163 4.509 50 10 IJGE CC[C@H](C)[C@H](Br)CNC(=O)c1cc(Br)ccc1Br 2029977739 OSZJBYROQHTUCE-QPUJVOFHSA-N 441.989 4.751 50 10 IJGE CC(C)[C@H](CBr)CN=[S@](=O)(C(C)C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 2063273394 MHDGDVSDYCKBCW-RKPUJPDHSA-N 439.460 4.539 50 10 IJGE CC[C@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@@H]1CBr 2086660220 CEHVJVQBQXHLBL-RYUDHWBXSA-N 442.566 4.798 50 10 IJGE FC(F)(F)C[C@H](Cl)CNc1ncc(C(F)(F)F)cc1I 2175687897 CEHSHWMVPYOJTL-LURJTMIESA-N 432.533 4.677 50 10 IJGE Cc1c(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)ccnc1CBr 2205626210 QEHOYLKVTNHNSJ-NVJIOZQYSA-N 426.402 4.632 50 10 IJGE Br[C@@H]1C[C@@H](OCCOCCOCCOCc2ccccc2)C12CCCCC2 2236088533 IGWHWDYSBCDPOL-NHCUHLMSSA-N 441.406 4.739 50 10 IJGE C[C@@H]1COC[C@H]1[C@H](Br)Cc1cc(Br)cc(Br)c1 2252838382 CDFORUCKTMRVTB-BZHVJNSISA-N 426.974 4.800 50 10 IJGE CC(C)N(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)CC1(CBr)CC(F)C1 2265639092 QAWGJCOTCGTGHK-VXESANQCSA-N 435.422 4.857 50 10 IJGE COc1ccc([C@@H](Br)c2cnc(Cl)n2C)c(Br)c1Cl 2268266580 UHCTVDHTQRHDRJ-SECBINFHSA-N 428.939 4.982 50 10 IJGE COc1cc(F)c(CBr)c(N2[C@H]3CCC[C@H]2CN(Cc2ccccc2)C3)c1 2283522947 OSXZLHCFRWLWSJ-ROUUACIJSA-N 433.365 4.973 50 10 IJGE N#CC(=Cc1cn(Cc2c(F)cccc2Cl)c2ccccc12)C(=O)NC[C@H]1CCCO1 2313624429 SDEGVJNTPRAFIH-GOSISDBHSA-N 437.902 4.684 50 10 IJGE COc1ccc(C=C(C#N)C(=O)Nc2sc3c(c2C#N)CCCC3)cc1Br 2313630801 UOVWGYHUMJTREL-UHFFFAOYSA-N 442.338 4.815 50 10 IJGE C[C@H](Br)C1CCN(Cc2cc(I)ccc2Cl)CC1 2327408925 HKAUYBOZNUZZJM-JTQLQIEISA-N 442.566 4.940 50 10 IJGE CCn1nc(Br)nc1C[C@H](Br)c1cccc(Br)c1 2328475159 TVATVOXNOXLVOT-JTQLQIEISA-N 437.961 4.502 50 10 IJGE CC(C)(C)OC(=O)N[C@]12CCC[C@@]1(F)CN(C[C@](C)(CBr)C(C)(C)C)C2 2352081793 OIRAZTMCNKNQME-ZCNNSNEGSA-N 435.422 4.905 50 10 IJGE CC[C@H](Oc1ccccc1[C@@H](C)CC)C(=O)NNC(=O)COc1ccc(Cl)c(C)c1 10682221 GVUPPJVYHLZEOC-YWZLYKJASA-N 432.948 4.546 50 10 IJGE CCOc1ccccc1OCC(=O)N/N=C/c1ccc(OCc2ccc(C)cc2)c(OC)c1 40911146 XZEFMJVRKIXKEV-JVWAILMASA-N 448.519 4.510 50 10 IJGE CN(C)c1ccc(/C=C(/C#N)C(=O)OCc2csc(COc3ccc(F)cc3)n2)cc1 96943023 YAEHUXBRCKMTAG-BOPFTXTBSA-N 437.496 4.578 50 10 IJGE CCCCCCCOc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(C)c(C)c2)cc1 100272189 PGPUTWIAEWHZEU-HXUWFJFHSA-N 426.557 4.881 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Cl)c3cccc(F)c3Br)cc2[nH]1 156116349 CFTRZMSPMRZAIW-ZDUSSCGKSA-N 434.490 4.849 50 10 IJGE COC(=O)/C(C#N)=C\c1ccc(OC(=O)CCCOc2ccc(C(C)C)cc2)c(OC)c1 206992458 GBCDXGJEFPIKNO-ZHZULCJRSA-N 437.492 4.663 50 10 IJGE Cc1cc(Br)c(S(=O)(=O)N(C)CCCCCCl)cc1Br 227146445 RRTVYAYOCMTWHS-UHFFFAOYSA-N 447.620 4.550 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@H]1Br)c1cccc(Br)c1Cl 228459431 YFKIDHVUDWKJBJ-UKRRQHHQSA-N 429.539 4.893 50 10 IJGE CCOc1ccccc1-c1cc(C(=O)NN=Cc2ccccc2[N+](=O)[O-])c2ccccc2n1 252640756 YWYSBIFSAHVXJV-UHFFFAOYSA-N 440.459 4.973 50 10 IJGE CCCO[C@@H]1[C@@H](Br)C[C@H]1Oc1c(Br)cccc1Br 300475102 TWKVFHOHWXHILT-DMDPSCGWSA-N 442.973 4.921 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CCl)[C@H](c2cc(I)ccc2F)C1 394695191 SLTGYLUNGZXWMP-ZWNOBZJWSA-N 439.696 4.620 50 10 IJGE CN(CCc1ccncc1)C(=O)c1cccc(NC(=O)Nc2ccc(SC#N)cc2)c1 586716599 ABBOCHNVDTXSAQ-UHFFFAOYSA-N 431.521 4.613 50 10 IJGE C[C@H]1[C@@H](CBr)CCN1C(=O)c1scc(Br)c1Br 705426892 PFTLELSNUNDROA-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE Cc1nn(C)c(Cl)c1COc1c(F)cc(Br)cc1CBr 715817151 DPWZOUWGYITLMC-UHFFFAOYSA-N 426.511 4.757 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@@H](Cc2nccn2C)c2ccccc2)c(C)n1CC(C)C 744376269 WIGGYMOQEQVAAF-PQBKBUHISA-N 429.568 4.502 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2cc(O)nc3ccccc23)c(C)n1-c1ccc(F)cc1 748329852 LAIGGCRZCDJGRU-UNOMPAQXSA-N 440.478 4.710 50 10 IJGE O=C(NNc1nc(-c2ccc(Cl)cc2)no1)c1cnc(-c2ccc(F)c(F)c2)s1 780513224 YFHGXTKHBOLZCQ-UHFFFAOYSA-N 433.827 4.549 50 10 IJGE CC(=NNC(=O)CC1(C)OCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1)N2 1084250220 VCLUXRQGIQGXAG-CZSZKKDXSA-N 431.536 4.506 50 10 IJGE COc1cc(C=NNC(=O)COc2ccccc2C)ccc1OCc1ccccc1Cl 1772752923 ZTHIHZCJEDFTRA-UHFFFAOYSA-N 438.911 4.765 50 10 IJGE CN(C)c1ccc([C@@H](CNC(=O)/C(C#N)=C/c2ccc(Cl)cc2)N2CCCCC2)cc1 1866127836 IGWYAECQDFZNLD-MWKGPOOMSA-N 436.987 4.656 50 10 IJGE N#C[C@@H]1CN(c2ccc(CBr)cc2C(F)(F)F)CCN1Cc1ccccc1 1914893759 ZBDIXLDYWKVGBO-QGZVFWFLSA-N 438.291 4.815 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1ccc(Br)cc1O 1915079377 BEOQPMWVJAQUHV-CQSZACIVSA-N 441.163 4.971 50 10 IJGE CC[C@H](C)[C@@H](Br)CNC(=O)c1csc(Br)c1Br 1945189003 GPFLUXXPYDCBDM-XPUUQOCRSA-N 448.018 4.813 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1ccc(O)c(Br)c1 1980633964 FJTGHSSEKQNEEH-UHFFFAOYSA-N 441.163 4.971 50 10 IJGE CC(C)(C)OC(=O)NC1CCC2(CC1)CC1(CC[C@H](CI)O1)C2 1983332050 PQKOKNGKKAGLNT-CGGGCMDCSA-N 435.346 4.587 50 10 IJGE CC(C)(C)OC(=O)N1C[C@](C)([C@H]2CC[C@](C)(CI)O2)CC1(C)C 1992813773 LOOJEZCILXULAX-FSPWUOQZSA-N 437.362 4.785 50 10 IJGE O=C(NN=CC=Cc1ccccc1)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1 2042446315 WGKLJUJAFSGPNM-UHFFFAOYSA-N 439.924 4.570 50 10 IJGE ClCCc1nc2cncc(Br)c2n1C[C@H]1CCCN1Cc1ccccc1 2095447951 OQJSENGTSKITKI-MRXNPFEDSA-N 433.781 4.640 50 10 IJGE Cc1c(CCl)cc(Cl)cc1S(=O)(=O)N(C)[C@@H]1CC[C@@H]1OCc1ccccc1 2156443646 RQEIRTGGODTGPO-MOPGFXCFSA-N 428.381 4.756 50 10 IJGE CO[C@@H]1CN(CC2(CBr)CCCCCC2)[C@@](C)(CNC(=O)OC(C)(C)C)C1 2163061331 GFMFJRNWCRRKAJ-FXAWDEMLSA-N 447.458 4.726 50 10 IJGE Cc1cc(C(=O)N2C[C@@]3(CBr)CCC[C@]3(F)C2)c(Br)s1 2176637821 WZSQXIYDJSUIFY-KBPBESRZSA-N 425.161 4.548 50 10 IJGE CN(C(=O)c1cc(Cl)ccc1I)[C@@H](CCCl)C(F)(F)F 2178516399 VZERQUZGUMGEQA-JTQLQIEISA-N 440.030 4.576 50 10 IJGE C[C@@H](N(C)S(=O)(=O)c1cc(CBr)sc1Br)C1(C)CCC1 2179790658 HKQDCSKPKUNIQN-SECBINFHSA-N 445.242 4.605 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNCc1cc(Cl)ccc1OC(F)F 2181747548 PISSULNFZNJWCA-UHFFFAOYSA-N 442.981 4.937 50 10 IJGE FC(F)(F)[C@H]1C[C@]1(CCl)CNCc1cc(Cl)ccc1I 2192573356 QHTIJTLCOYZJRT-RYUDHWBXSA-N 438.058 4.842 50 10 IJGE Cc1cc([C@@H](Br)c2ccc3nc(O)[nH]c3c2)ccc1I 2207101981 IJDVDISFFSKPAL-CQSZACIVSA-N 443.082 4.666 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CCC[C@@]23CCC[C@H](CI)O3)C1 2213354085 IOGQEPVWFYEKHH-YKTARERQSA-N 449.373 4.786 50 10 IJGE C[C@@H](CCCl)N(Cc1ccccc1)S(=O)(=O)Cc1ccc(Br)cc1 2213761354 VBFMBVXAOVJPOZ-HNNXBMFYSA-N 430.795 4.799 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1cc(Br)ccc1OC 2220400223 PUKBVMBVWCVYEL-MRXNPFEDSA-N 446.794 4.666 50 10 IJGE ClCCc1nc2cccc(Cl)c2n1C[C@H]1CC1(Br)Br 2224807554 TVPFHFLETUSVQP-MRVPVSSYSA-N 426.967 4.977 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Br)c2)CC[C@@H]1Cl 2306217348 OVSFNWYKNARNDX-SKDRFNHKSA-N 428.539 4.503 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@@H]2CN(CC3(CBr)CCCCC3)C[C@@H]2C1 2333272560 UFRMZKVETFFMMD-SQNIBIBYSA-N 429.443 4.957 50 10 IJGE Cc1cc(C)cc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(F)c2)c1 38678199 KBIJARMXCDWBJD-VWLOTQADSA-N 444.462 4.645 50 10 IJGE CCOC(=O)Nc1sccc1/C=C(\C#N)S(=O)(=O)c1ccc(OC(F)(F)F)cc1 213493488 SVOMNTNYQOHZQG-NTEUORMPSA-N 446.428 4.553 50 10 IJGE CC(=O)N(/C=C(/C#N)C(=O)Nc1ccccc1Sc1ccccc1)c1ccc(N)cc1 217243270 RHRBONTVNQPRTD-VLGSPTGOSA-N 428.517 4.819 50 10 IJGE O=C(NC[C@H]1CCCC[C@H]1CCl)c1ccc(I)c(Cl)c1 232348878 PMYCYKORHVUEBR-NWDGAFQWSA-N 426.125 4.720 50 10 IJGE C[C@@H]1CCN(C(=O)c2cc(Br)sc2Br)[C@@H]1CBr 235334841 GMWDNJCIFSZZJE-HTRCEHHLSA-N 446.002 4.519 50 10 IJGE CCC(C)(C)[C@@H]1CCc2[nH]nc(C(=O)NN=Cc3c(C)nn(-c4ccccc4)c3C)c2C1 263625959 UEFRJCRGEMBCRI-GOSISDBHSA-N 432.572 4.517 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@@H](c2cccc(Br)c2F)C1 382699832 XJJCVKPFXOJCRT-PWSUYJOCSA-N 437.147 4.934 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1ccc([C@H]2CCc3ccccc3N2S(N)(=O)=O)cc1 616595706 QRUPSXWLQSXZPL-JOCHJYFZSA-N 446.689 4.948 50 10 IJGE Cc1ccccc1C(C)(C)CNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 725724811 CUUFOTANVJAYPV-CJLVFECKSA-N 437.547 4.773 50 10 IJGE CN(Cc1ccc(Cl)s1)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 914463873 HWGWUVMETCVBPS-SFQUDFHCSA-N 435.940 4.744 50 10 IJGE C=CCOc1cn(-c2ccccc2)nc1C(=O)NNc1ccccc1Oc1ccccc1 1640866445 YHPCQGVUDSDQFM-UHFFFAOYSA-N 426.476 4.986 50 10 IJGE C=CC[C@@H](Cc1ccccc1)NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 1642542234 VXDBFDWPNRMNTK-YFORGORKSA-N 435.531 4.674 50 10 IJGE N#CSc1ccc(NC(=O)c2cccc(NC(=O)CCCOc3ccccc3)n2)cc1 1860555211 CBDSRFHHGHXYFM-UHFFFAOYSA-N 432.505 4.705 50 10 IJGE CCc1nn(Cc2ccccc2F)c2c1[C@H](c1ccc(C(F)(F)F)cc1)C(C#N)=C(N)O2 1865711369 WMQIVFMQMMDQQO-LJQANCHMSA-N 442.416 4.870 50 10 IJGE N#C/C(=C\c1ccccc1)C(=O)Nc1c(Br)cc(C#N)cc1Br 1865911672 WVMQWQBTRKJCMS-AWNIVKPZSA-N 431.087 4.629 50 10 IJGE CN(C[C@@](C)(CBr)C(C)(C)C)[C@H]1CCN(C(=O)OCc2ccccc2)C1 1904845249 PRUUTOISPRHSSB-GHTZIAJQSA-N 425.411 4.777 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1cncc(Br)c1 1915126769 PBKMKMFGYNWIFV-OAHLLOKOSA-N 426.152 4.660 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCCN1C[C@@H](Br)C(F)(F)F 2044701133 GKLSUGOKISPKMK-MGPQQGTHSA-N 429.321 4.566 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3C[C@H](Br)C[C@H]3C2)c1 2065400052 RTMUOWYFXYLCLG-IWIIMEHWSA-N 438.001 4.817 50 10 IJGE C[C@H](Cl)[C@H](NC(=O)c1csc(Br)c1Br)C(F)(F)F 2074720878 PUWRTPRCGUCFPN-DZSWIPIPSA-N 429.483 4.561 50 10 IJGE BrC[C@H]1CN(Cc2ccc(I)cc2)CC12CCCC2 2118604342 RQDLHTUERBKXRO-AWEZNQCLSA-N 434.159 4.678 50 10 IJGE COc1ccc([C@@H](Cl)c2cc(I)sn2)c(OC)c1Cl 2120030674 DNQAGRJEGQOAAP-SNVBAGLBSA-N 430.094 4.747 50 10 IJGE Br[C@H]1CN(C[C@H]2CC2(Br)Br)CC12CCCCC2 2213081638 DCXPXDISSHIQFU-MNOVXSKESA-N 430.022 4.522 50 10 IJGE CC(C)CCN(CCBr)C(=O)Cc1ccc(Br)cc1Cl 2237450685 JXFCYDIWPZGHET-UHFFFAOYSA-N 425.592 4.915 50 10 IJGE C=CC[C@]1(CBr)CCCN(C[C@@H]2CC2(Br)Br)C1 2250410373 WSSUSXKYVZZMIH-NWDGAFQWSA-N 430.022 4.546 50 10 IJGE CC1CC(CBr)(CN2CC[C@H](C(F)(F)F)[C@H](NC(=O)OC(C)(C)C)C2)C1 2265313829 MMGOSCNIHOMWBI-YRTQGLMCSA-N 443.348 4.575 50 10 IJGE COc1ccc(N(C)Cc2ccccc2I)c(CBr)c1 2280269738 DZNGZCQMABHZFR-UHFFFAOYSA-N 446.126 4.831 50 10 IJGE COc1cc2ncnc(N(Cc3ccccc3)[C@H](C)CCBr)c2cc1OC 2294691242 BCRMLQDUABPKQK-OAHLLOKOSA-N 430.346 4.827 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)cc2C=C(C#N)C(=O)NCc2ccccc2)cc1 2296684281 YZUWDFNEEJPAOA-UHFFFAOYSA-N 434.499 4.771 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1C[C@@H]2CN(C(=O)OC(C)(C)C)C[C@]2(C)C1 2297085857 PMEYSZZCTATQBV-YYQBIWNASA-N 447.414 4.558 50 10 IJGE CCN(Cc1ccc(I)c(Br)c1)C(C)(C)CCl 2306219323 KVZZZGQIFRGTIH-UHFFFAOYSA-N 430.555 4.893 50 10 IJGE ClC[C@@H]1CC[C@H](NCc2ccc(I)c(Br)c2)C1 2306221604 KEYMPUOBCSFENO-KOLCDFICSA-N 428.539 4.551 50 10 IJGE CCN(CC)c1ccc(NC=C(C#N)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 2320906789 DLACYVYGJVQROM-UHFFFAOYSA-N 427.892 4.861 50 10 IJGE CCn1c(C)c(C=NNC(=O)c2cccn(Cc3ccccc3Cl)c2=O)c2ccccc21 2323653119 JFSSFFFMLHLFJP-UHFFFAOYSA-N 446.938 4.597 50 10 IJGE Cc1ccc(CCC(=O)NN=C2C(=O)N(Cc3ccccc3Cl)c3ccccc32)cc1 2326840134 WGDAAAMBTVNLEX-UHFFFAOYSA-N 431.923 4.648 50 10 IJGE Cn1cc(I)c(C[C@H]2[C@H](Br)C(C)(C)CCC2(C)C)n1 2341858047 YOJZEGZEQTWDQV-GWCFXTLKSA-N 439.179 4.793 50 10 IJGE CN(CC1(CBr)CC(C)(C)C1)[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 2345004359 JPLBVBFTPALDCZ-BBWFWOEESA-N 429.443 4.908 50 10 IJGE O=S1(=O)CC[C@H](C(CCl)(CCl)Cc2sc(Cl)cc2Br)C1 2372274064 YVNKTXHJMAWIPG-QMMMGPOBSA-N 440.639 4.605 50 10 IJGE Cc1ccn2c(C(=O)NN=Cc3cn(-c4ccccc4)nc3-c3cccs3)c(C)nc2c1 2180895 QTOQNLZQVABWHF-UHFFFAOYSA-N 440.532 4.629 50 10 IJGE C=CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccccc4)ccc32)cc1 38658284 BIHAYCFACVLINI-SANMLTNESA-N 438.483 4.618 50 10 IJGE N#C/C(=C/c1cn(Cc2c(F)cccc2Cl)c2ccccc12)C(=O)NC[C@@H]1CCCO1 59087113 SDEGVJNTPRAFIH-QMJOVRGKSA-N 437.902 4.684 50 10 IJGE BrCC1(COc2c(Br)cccc2Br)CCOCC1 96870294 VTIJFWFAYMIHFH-UHFFFAOYSA-N 442.973 4.782 50 10 IJGE BrCC[C@H]1CCCN(c2ncc(Br)cc2Br)C1 129137402 URSHGVWNAIMLHA-SECBINFHSA-N 426.978 4.608 50 10 IJGE O=C(NC[C@H]1CCC[C@H]1Br)c1cc(Br)ccc1Br 161223507 ITBFFJIRVKLPNX-LDYMZIIASA-N 439.973 4.505 50 10 IJGE CC[C@@H](CCBr)CNC(=O)c1ccc(Br)cc1Br 233872330 NCJYEYXOMXCSBD-VIFPVBQESA-N 441.989 4.753 50 10 IJGE CC(=NNC(=O)c1ccc(Br)o1)c1cccc(NC(=O)c2ccc(F)cc2)c1 252606845 GWHROODQBCZHSU-UHFFFAOYSA-N 444.260 4.588 50 10 IJGE O=S(=O)(Nc1cccc(CBr)c1)c1c(Cl)cccc1Br 312770557 CFZYEJSTVQWYKY-UHFFFAOYSA-N 439.556 4.798 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CBr)[C@@H](c2cc(Br)cs2)C1 382700731 CKEJEEJCJFVVCC-KOLCDFICSA-N 425.186 4.856 50 10 IJGE Cc1cc(Br)c([C@H](Br)c2cnn(C)c2Br)s1 393883642 XTHKFXMRZRMYJO-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE CN(C[C@@H](Br)C1CC1)C(=O)c1cc(Br)c(Br)s1 690268616 URRHAEOBODRAGW-MRVPVSSYSA-N 446.002 4.519 50 10 IJGE CN(CCCCCCCCCBr)C[C@]1(O)CCN(Cc2ccccc2)C1 711756585 MNSDASQEXYDPNA-JOCHJYFZSA-N 425.455 4.681 50 10 IJGE CN1CCC[C@@H](CNC(=O)NNc2cc(C(F)(F)F)ccc2F)[C@H]1c1cccs1 754646332 MIUJNHMRRLYQCC-SJCJKPOMSA-N 430.471 4.615 50 10 IJGE O=C(Oc1ccc([N+](=O)[O-])c2ncccc12)[C@H]1CCCN(c2nc3ccccc3s2)C1 770136027 MUMASLNQQVPHSK-AWEZNQCLSA-N 434.477 4.575 50 10 IJGE CSc1ccc([C@@H](C)NC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cc1 799066497 FHVUMZDHLCJTNX-ISPGYRLHSA-N 441.560 4.970 50 10 IJGE Cc1ccc(C=NNC(=O)c2ccccc2NC(=O)c2cccc(Br)c2)cc1 1084603557 HEDNRANZJHXDMR-UHFFFAOYSA-N 436.309 4.774 50 10 IJGE CC(C)(C)N(NC(=O)Nc1ccc(F)cc1F)C(=O)c1cc(Cl)cc(OCCF)c1 1088694334 OQJWZTQRPBNKFL-UHFFFAOYSA-N 443.853 4.944 50 10 IJGE CC(=O)c1ccc(OC(=O)/C(C#N)=C/c2cc(C)n(C[C@@H]3CCCO3)c2C)cc1Cl 1439530761 AIWOWMIVVUHXAC-CYEGBWLXSA-N 426.900 4.653 50 10 IJGE C/C(=C\C(=O)NNc1ccc([N+](=O)[O-])cc1Br)c1cccc(C(F)(F)F)c1 1634722653 LUBPHWMRXLTJHA-JXMROGBWSA-N 444.207 4.923 50 10 IJGE CCc1nn(Cc2ccc(Cl)c(Cl)c2)c2c1[C@H](c1cccc(O)c1)C(C#N)=C(N)O2 1865681529 PVWGTZAAPAFSTN-LJQANCHMSA-N 441.318 4.724 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2cccc(F)c2)cc1 1865693044 RAFZXIUOSNDUHH-QHCPKHFHSA-N 432.499 4.776 50 10 IJGE CCc1nn(-c2ccc(Cl)cc2)c2c1[C@@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865698851 DTJMOWWMNPODFU-OAQYLSRUSA-N 429.911 4.798 50 10 IJGE C[C@H]([C@@H](Br)c1c(Cl)sc(Br)c1Cl)S(C)(=O)=O 1925575454 XYQMSUGPLHULBH-NQXXGFSBSA-N 430.998 4.687 50 10 IJGE CN(CC(C)(C)CBr)C(=O)c1scc(Br)c1Br 1945721975 XQIXZPRQUGDTRG-UHFFFAOYSA-N 448.018 4.766 50 10 IJGE Cc1nn(C)c(Br)c1CN(Cc1ccccc1)[C@@H](CBr)C1CC1 1986916236 YKYPDADCECSXCT-KRWDZBQOSA-N 441.211 4.667 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC1CC2(CCCCC2)C1 1989968439 UTRBGFKZGNUMBB-KRWDZBQOSA-N 437.362 4.834 50 10 IJGE CC1(C)CN(Cc2ccc(I)c(Cl)c2)C[C@@H]1Br 2026568031 XRHYJUCHXUVOMB-LBPRGKRZSA-N 428.539 4.550 50 10 IJGE O=C(N[C@@H](CBr)CC1CC1)c1cc(Br)ccc1Br 2029978609 WIHJCRZTTZOJSH-SNVBAGLBSA-N 439.973 4.505 50 10 IJGE Brc1ccc(Br)c(CN2C[C@@H](Br)CC3(CC3)C2)c1 2054720270 WZMPGXWFBFAKEV-LBPRGKRZSA-N 438.001 4.961 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@@H]2C[C@H](Cl)CC[C@@H]21 2087665446 WBXIGAGWDQPYFX-MRTMQBJTSA-N 427.589 4.895 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@H]1CCCN(C(=O)CCCCBr)C1 2106770895 CYXPNALOOVKYSD-DLBZAZTESA-N 431.415 4.580 50 10 IJGE C[C@H](CCBr)CCN1CC[C@H](C(F)(F)F)[C@@H](CNC(=O)OC(C)(C)C)C1 2106784949 MGLONUUWGYATDE-ILXRZTDVSA-N 445.364 4.823 50 10 IJGE O=[N+]([O-])c1ccc(CBr)c(Oc2ccccc2I)c1 2120385085 RQPOERBNRFOQQO-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE CC(C)(C)OC(=O)NC[C@]12CN(CCCCCCCCCBr)C[C@@H]1CCO2 2175184362 VEVBXYLABDKOOQ-RXVVDRJESA-N 447.458 4.728 50 10 IJGE O=[N+]([O-])c1ccc(N2[C@H]3CCC[C@H]2CN(Cc2ccccc2)C3)cc1CBr 2182304998 XSXIVZSQMBDLOF-PMACEKPBSA-N 430.346 4.733 50 10 IJGE CN([C@@H]1CCCC1(C)C)S(=O)(=O)c1cc(CBr)sc1Br 2198043340 RPINHRWDMCDUHH-LLVKDONJSA-N 445.242 4.605 50 10 IJGE CC1CC(CBr)(CN2CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]2C(F)(F)F)C1 2266273873 OZSLEBLENAWSRQ-YRTQGLMCSA-N 443.348 4.718 50 10 IJGE CCCCO[C@H]1[C@@H](Oc2cccc(C)c2I)C[C@H]1Br 2277956191 PSIDCLQMELOBRW-OSAQELSMSA-N 439.131 4.700 50 10 IJGE Cn1nc(C[C@@]2(CBr)CC(F)(F)C23CCC3)c(Br)c1Cl 2280848439 IFHCCQCMGGFJTC-NSHDSACASA-N 432.534 4.969 50 10 IJGE C[C@@H]1CO[C@@](CBr)(Cc2ccc(Cl)c(I)c2)C1 2300240132 ILIUPKJSRPCFHJ-TVQRCGJNSA-N 429.523 4.677 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1OCc1ccc(F)cc1 2313676577 FKGHEOBPDLTISU-UHFFFAOYSA-N 447.422 4.867 50 10 IJGE CCc1cc(Br)cc2c1O[C@@]1(C=C2)CCN(C(=O)C(C#N)=Cc2ccccc2)C1 2318734577 LLVFKZRFMYOAKW-DEOSSOPVSA-N 449.348 4.995 50 10 IJGE COc1ccc(OC)c(C(C)=NNC(=O)c2ccc(-c3ccc(F)c(F)c3)nc2C)c1 2321260967 JUDHNVNJQRJSIT-UHFFFAOYSA-N 425.435 4.506 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@H]1CCCC[C@H]1N(C)C[C@]1(CBr)CC1(F)F 2326920467 ZZUJMAASZYKGFT-JKIFEVAISA-N 425.358 4.517 50 10 IJGE C[C@@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cccc(F)c1 38678107 QSWLJMBRMXYZRE-FATZIPQQSA-N 448.425 4.556 50 10 IJGE COc1c(C(=O)N/N=C2/C(=O)N(Cc3ccccc3)c3ccccc32)ccc2ccccc12 59152121 BDRHGPZGTCJQIM-ZZIIXHQDSA-N 435.483 4.529 50 10 IJGE CCc1cccc(C)c1NC(=O)/C(C#N)=C\Nc1ccc(I)cc1C 217219172 SDIALZODRQYHEI-VBKFSLOCSA-N 445.304 4.929 50 10 IJGE CCOc1cccc(-c2cc(C(=O)NN=C/C(Br)=C\c3ccccc3)[nH]n2)c1 254701046 PNQMXFDWCSLROR-PJFWALPYSA-N 439.313 4.627 50 10 IJGE COCCO[C@@H]1[C@H](Br)C[C@H]1Oc1cc(Cl)c(Br)cc1Cl 300481703 YONWPCOBPPNMRT-BZHVJNSISA-N 448.966 4.702 50 10 IJGE CC[C@](C)(CO[C@H](CI)c1cccc(Br)c1)OC 319034472 BVJASZNWMHDSLR-ZIAGYGMSSA-N 427.120 4.757 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccccc1[C@H]1CCc2ccccc2N1S(N)(=O)=O 616592559 CBGWUHLITLLYRT-OAQYLSRUSA-N 432.662 4.906 50 10 IJGE CN(C[C@H]1CCC[C@H]1Br)c1ncc(Br)cc1Br 689282536 UZSWPJLQFAHQTE-PSASIEDQSA-N 426.978 4.606 50 10 IJGE CC(C)(C)N(CCCl)C(=O)c1ccc(I)c(Br)c1 721510372 MTUKQEQFNKHBDI-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE Fc1cc2nc(CCl)n(Cc3sncc3Br)c2cc1Br 722791294 FOMZYYRYXOCFBC-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE CC(=O)CCc1ccc(O[C@H](C)C(=O)NNc2nc3cc(Cl)ccc3cc2C)cc1 779042814 KCKFDCRUERPEAH-MRXNPFEDSA-N 425.916 4.629 50 10 IJGE O=C(NNS(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1)c1ccc(Cl)cc1 782907032 ICRNYBLPPWSDNC-UHFFFAOYSA-N 436.811 4.621 50 10 IJGE Cc1nc2ccccn2c1C(=O)NNC(=O)N[C@@H](c1ccc(C(C)C)cc1)c1cccs1 913627853 CGGSGZKDLKIDQW-NRFANRHFSA-N 447.564 4.561 50 10 IJGE C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@@H]3[C@@H]1CCC2=NNC(=O)c1cccc([N+](=O)[O-])c1 1084617549 PEVAPRZFSJGMGN-KXEAFHOWSA-N 433.508 4.943 50 10 IJGE C#CCCCC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1Cl)CC2 1597394077 MFHORSWVKLMSQA-VLGSPTGOSA-N 443.934 4.940 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCN(C[C@H](CBr)C3CC3)C2)C1 1643212856 MIANQKOMPQWMHG-QYZOEREBSA-N 429.443 4.767 50 10 IJGE COc1cccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(C)cc2)CCC3)c1 1772744772 IIGISIWSIXOYBD-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE COc1cccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4ccccc4C)c(C)c32)c1 1772750298 ZBPCPGVJCFZRAJ-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE Cc1ccc(NC(=O)COc2cccnc2NC(=O)Nc2ccc(SC#N)cc2)cc1C 1858833817 DSALEJZIIFICHB-UHFFFAOYSA-N 447.520 4.933 50 10 IJGE N#CSc1ccc(NC(=O)c2cccc(NC(=O)COc3ccccc3Cl)n2)cc1 1860558537 LHGXIHDYQITWBD-UHFFFAOYSA-N 438.896 4.578 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@@H]1c1cccc(O)c1 1865681229 IEEBFNLTXKRDOL-MRXNPFEDSA-N 446.816 4.527 50 10 IJGE COc1ccc2ccccc2c1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccc(C)cc1 1865687815 AYDZEUALCNWONJ-VWLOTQADSA-N 436.515 4.928 50 10 IJGE CCCn1nc(-c2ccccc2)c2c1OC(N)=C(C#N)[C@@H]2c1cccc(OC)c1OCC 1865694611 ZVXUPZYFRUKHLT-FQEVSTJZSA-N 430.508 4.586 50 10 IJGE CC(C)c1nc(Nc2ccc(SC#N)cc2)cc(N2CCO[C@@H](c3ccncc3)C2)n1 1868231422 GJRUOJQTGSJREF-HXUWFJFHSA-N 432.553 4.890 50 10 IJGE C=CCOc1ccccc1OC/C(O)=C(\C#N)c1nc(-c2ccc3c(c2)OCO3)cs1 1872752418 BERVBRGKZRXLIJ-VLGSPTGOSA-N 434.473 4.975 50 10 IJGE COC(=O)c1ccc(/C=C/C(O)=C(\C#N)c2nc(-c3ccc4c(c3)OCO4)cs2)cc1 1872752845 VYYNIHWLKVRSLP-HOZXQWOCSA-N 432.457 4.831 50 10 IJGE Cc1oc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)Cc1ccccc1 1880810465 RFMSONWJZXUYFL-UHFFFAOYSA-N 434.355 4.874 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)CCC[C@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1881164027 DEGRLXIRGIMRAB-KFWWJZLASA-N 435.403 4.558 50 10 IJGE CC1(C)CN(Cc2cc(Cl)ccc2I)C[C@H]1CBr 1914502793 PHHBOXJLJRJNLW-LLVKDONJSA-N 442.566 4.798 50 10 IJGE CC1([C@H](CBr)NC(=O)c2csc(Br)c2Br)CC1 1945361465 KDEIPACJGXBJRA-ZETCQYMHSA-N 446.002 4.567 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC1)CC[C@@]21CCC[C@@H](CI)O1 1987456551 TZAZXPOUEBRHGV-KSSFIOAISA-N 435.346 4.540 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)c(F)cc1F 2008314193 UDJDSIMYQFXIPV-LLVKDONJSA-N 438.721 4.593 50 10 IJGE O=C(CCl)c1cc(I)c(C(F)(F)F)c(OC(F)(F)F)c1 2055163138 QVFJYOCFADEPEM-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE C[C@H](Cl)[C@H](NC(=O)c1cc(Br)c(Br)s1)C(F)(F)F 2074737986 NFCFSBNQZAMSRI-DZSWIPIPSA-N 429.483 4.561 50 10 IJGE Cc1ccc(C(=O)N[C@@H](C)CCCCCI)c(Br)c1 2117893070 GWTMLHAHLWFAIO-LBPRGKRZSA-N 438.147 4.871 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CCC[C@@H](CN(CC3(CBr)CCCC3)C1)C2 2135002321 VRQRDZSDBGPBPU-UTKZUKDTSA-N 429.443 4.959 50 10 IJGE O=C(NC[C@]12CCC[C@]1(CCl)C2)c1scc(Br)c1Br 2142937692 SHSSBUPYVMCQPO-CHWSQXEVSA-N 427.589 4.802 50 10 IJGE CC1(CC(CBr)(CBr)[C@H]2CCS(=O)(=O)C2)CCCCC1 2143857067 MNXVYXPFCGEQKH-ZDUSSCGKSA-N 430.246 4.558 50 10 IJGE Cn1nc([C@H](Cl)c2cc(Br)cc3c2OCC3)c(Br)c1Cl 2167048543 ROUUTICQOJTACU-SNVBAGLBSA-N 440.950 4.862 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCCCN2C(=O)[C@H](Br)C2CCCC2)CC1 2178246378 CBROHIUOWRALCY-QGZVFWFLSA-N 443.426 4.722 50 10 IJGE BrCc1ccc(CN2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)cc1 2182853730 FCXSKXLRNZSDIW-QPXUXIHVSA-N 425.414 4.924 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@H]1CCl 2208030627 TZHFOYZPOLTWCK-ZJUUUORDSA-N 438.058 4.794 50 10 IJGE COc1ccc([C@H](Cl)c2occc2Br)cc1I 2248893358 KLVYVPYXBSRNLV-NSHDSACASA-N 427.463 4.984 50 10 IJGE COc1ccc([C@H](Br)[C@@]2(C)CCCOC2)cc1I 2257365977 WXPXCAILQQVOGB-KBPBESRZSA-N 425.104 4.553 50 10 IJGE CC(C)CN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)CC1(CBr)CC(F)C1 2265640532 ZYCUJPGIJWOHMJ-GNZRSQJKSA-N 435.422 4.857 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2CCC[C@@H](OC)C2)cc1I 2269536278 YNZWCLBEBANWIB-IXPVHAAZSA-N 439.131 4.941 50 10 IJGE CO[C@H]1C[C@H]([C@@H](Cl)Cc2cc(Br)cc(Br)c2)C[C@H]1OC 2295332505 XSMUUHUUSDRZCL-FBUXBERBSA-N 426.576 4.802 50 10 IJGE COc1cc(C=C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)cc(Br)c1O 2297382220 XMFUHSPEPPFYSQ-UHFFFAOYSA-N 425.641 4.501 50 10 IJGE CC[C@@H](C[C@H](C)Br)NCc1ccc(Cl)cc1I 2302326441 PHYVGFMWJINROM-CABZTGNLSA-N 430.555 4.986 50 10 IJGE N#CCOc1c(Cl)cc(C=C(C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1Cl 2313557233 XPTAAAFQUMFMDI-UHFFFAOYSA-N 439.302 4.643 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)cc2C=C(C#N)C(=O)NCCc2ccccc2)cc1 2314487338 HUVULSDZTYYXJA-UHFFFAOYSA-N 448.526 4.814 50 10 IJGE C[C@H](CBr)CN1CC[C@H](CCNC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2315864885 WQTDTASGPSHVMA-HZSPNIEDSA-N 431.337 4.575 50 10 IJGE CCCCN(CCBr)C(=O)c1ccc(Cl)cc1I 2317768785 MZVYCOCYYFFJSM-UHFFFAOYSA-N 444.538 4.582 50 10 IJGE Cl[C@@H]1CC[C@H]2CN(Cc3ccc(I)c(Br)c3)C[C@H]12 2325225837 JMRVQLIJBAFJBH-GMXVVIOVSA-N 440.550 4.503 50 10 IJGE Cc1ccc(NC=C(C#N)C(=O)Nc2ccc(I)cc2C)cc1C 2325406299 MFDYQYTVROTBOJ-UHFFFAOYSA-N 431.277 4.675 50 10 IJGE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1ccc(-c2ccccc2Cl)o1 2328796475 ZTYPEPJCAATXAC-LIRRHRJNSA-N 433.936 4.990 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H](CN(C[C@@]2(CBr)CC2(F)F)C2CC2)C1 2351886985 HJOFCNFZMMLUOZ-KSSFIOAISA-N 437.369 4.518 50 10 IJGE C[C@H]1CCC[C@@](CCl)(NC(=O)c2ccc(Cl)cc2I)C1 2365587074 SRQPXCXPIAIGBG-ZUZCIYMTSA-N 426.125 4.862 50 10 IJGE CC(C)[C@@H](Br)C(C)(C)NS(=O)(=O)c1c(Cl)cccc1Br 2365957512 TZJDAPQBENMYND-GFCCVEGCSA-N 447.620 4.579 50 10 IJGE N#C/C(=C/c1ccc(OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1)c1ccccc1F 31901684 WZZQXOBAOQUPLG-SXGWCWSVSA-N 433.351 4.925 50 10 IJGE N#C/C(=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 33930108 IEDJXBCWXXHFFU-LCYFTJDESA-N 438.783 4.962 50 10 IJGE Cc1cccc(-c2nc(C)c(Cc3ccccc3)c(N3CCN(C(=O)[C@H](C)Cl)CC3)n2)c1 35889875 YIJMPUROGVFUAR-IBGZPJMESA-N 448.998 4.627 50 10 IJGE Cc1nn(C)c(CC(CBr)(CBr)c2ccc(F)cc2)c1Cl 118877432 UPSJSKANSNHIHS-UHFFFAOYSA-N 438.566 4.791 50 10 IJGE C[C@@](CCl)(NS(=O)(=O)c1cc(Cl)c(Br)s1)c1ccccc1 134459594 ZKTPZKCAZVFATE-ZDUSSCGKSA-N 429.188 4.597 50 10 IJGE CC(C)(C)[Si](OCc1cnc(Br)s1)(c1ccccc1)c1ccccc1 198881668 RRCZMNVZVGQTNC-UHFFFAOYSA-N 432.459 4.982 50 10 IJGE CCCOc1ccc(Br)cc1C=NNC(=O)[C@@H](C)Oc1cccc(Cl)c1 252622546 NXXMBBDGUCEPJC-CYBMUJFWSA-N 439.737 4.809 50 10 IJGE CCCCc1ccc(NC(=O)C(=O)NN=Cc2ccc(OCc3ccccc3)cc2)cc1 254765963 SMBDNXOMEBRJJJ-UHFFFAOYSA-N 429.520 4.697 50 10 IJGE CC(C)OCC(CBr)(CBr)c1ccccc1Br 310067899 CDWLYRMBFSUQJC-UHFFFAOYSA-N 428.990 4.902 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Cl)c1cnn(C)c1Br 381861796 DOSBCORYHFGSFS-JTQLQIEISA-N 428.939 4.935 50 10 IJGE Oc1ccc(Br)cc1[C@H]1CN(Cc2ccccc2)C[C@@H]1CBr 382704614 DZKMEUPRRZSXCK-YOEHRIQHSA-N 425.164 4.765 50 10 IJGE Br[C@@H](CC[C@@H]1CCCO1)c1cc(I)cc2c1OCC2 388617657 DZGBRUXYDROHIO-JSGCOSHPSA-N 437.115 4.621 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1ccccc1[C@H]1CCN(S(N)(=O)=O)c2ccccc21 616590215 XSNCVTPOJOUKGC-HXUWFJFHSA-N 446.689 4.796 50 10 IJGE COc1ccccc1Nc1nc2sc(C(=O)NNc3nc4ccccc4[nH]3)cc2s1 768504063 HEERYSARLUPYIJ-UHFFFAOYSA-N 436.522 4.743 50 10 IJGE CN(C(=O)c1cccc(C(=O)Oc2ccc([N+](=O)[O-])c3ncccc23)c1)c1ccccc1 770139587 RYNCWTLCXVMCTD-UHFFFAOYSA-N 427.416 4.639 50 10 IJGE CCC(C)(C)NC(=O)c1ccc(NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1 799388886 YECKQPULALKVKH-UHFFFAOYSA-N 433.434 4.644 50 10 IJGE Cc1cc(NNC(=O)CCc2nc(O)c3c4c(sc3n2)C[C@H](C)CC4)ccc1Cl 1154547276 UEMHPCVYUXXIHI-LLVKDONJSA-N 430.961 4.559 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccccc1)CCC2 1772744966 OZKWDWRAFWRHHB-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE CCCCc1nc(CC(=O)N/N=C/c2ccc(OCc3ccccc3)c(OC)c2)cs1 1860773889 JCMKCXUTFOJCBM-MFKUBSTISA-N 437.565 4.766 50 10 IJGE CCCCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccccc2)cc1 1865690631 XPEJIMQVDYZLBU-QHCPKHFHSA-N 428.536 4.891 50 10 IJGE CCCc1nn(C)c2c1[C@H](c1ccc(OCc3ccccc3)c(OCC)c1)C(C#N)=C(N)O2 1865692317 AWLYOQQDIAGRNQ-HSZRJFAPSA-N 444.535 4.568 50 10 IJGE COc1cccc(Br)c1C(=O)N(Cc1ccccc1)[C@H](C)CBr 1914195643 QJQBAWTZXPUQOT-CYBMUJFWSA-N 441.163 4.884 50 10 IJGE CN(Cc1ccc(I)cc1)C[C@H](Cl)COCc1ccccc1 1916371417 SFCKNWFRUNYPLX-KRWDZBQOSA-N 429.729 4.547 50 10 IJGE CC[C@H](CCBr)CNC(=O)c1csc(Br)c1Br 1945188965 FUCWDMXFMPMEDI-SSDOTTSWSA-N 448.018 4.814 50 10 IJGE C[C@@](CI)(OCCOCCOCc1ccccc1)c1ccccc1 2007814082 IYCZSDNHXGISBM-FQEVSTJZSA-N 440.321 4.587 50 10 IJGE C[C@H]1C[C@@H](CBr)CN1Cc1ccc(I)c(Cl)c1 2026565476 BNODJRLATPDSNQ-ONGXEEELSA-N 428.539 4.550 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@@H](Cl)CC2(CCC2)C1 2094999483 KRSDXGKCZZXNTK-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCCCC[C@@H]1NC(=O)c1ccc(CBr)cc1 2106199028 FKEWQKSMGCTIMI-DLBZAZTESA-N 425.367 4.537 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(CC2(CBr)CCCC2)C[C@H]1C(F)(F)F 2106784129 GGPNROBYGBDZCD-ZIAGYGMSSA-N 443.348 4.577 50 10 IJGE CCc1cc(Br)c([C@@H](Br)c2ccc(S(C)(=O)=O)cc2)s1 2145940513 BUESLHXOMYOWPY-ZDUSSCGKSA-N 438.206 4.961 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CCC[C@@H](NC(=O)c3ccc(CBr)cc3)[C@H]1CC2 2162493985 CRRMGIPCMHEPRJ-RCCFBDPRSA-N 437.378 4.632 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@]2(F)CCC[C@@]2(CCl)C1 2176640911 QETYARBTZILVIF-CHWSQXEVSA-N 445.579 4.846 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2C[C@@H]1CCCN1Cc1ccccc1 2184934997 IIVZSRFRJILCLE-KRWDZBQOSA-N 447.808 4.948 50 10 IJGE Cc1c(Cl)cc(CN2CCOC[C@H]2C[C@H](C)Br)cc1Br 2185304719 FCRYVWBLNDLEFR-GXFFZTMASA-N 425.592 4.785 50 10 IJGE COc1cc(Cl)c([C@H](Br)[C@@H]2OCCOC2(C)C)cc1Br 2202353973 SRGDNGBLVJQJFQ-STQMWFEESA-N 428.548 4.741 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2COC(C)(C)C2)cc1I 2257355151 NXNPZDQTKOTUHE-GXFFZTMASA-N 425.104 4.551 50 10 IJGE Cc1sc([C@@H](Br)c2cscc2S(C)(=O)=O)cc1Br 2260093828 BVEVZZQLPKIQMV-NSHDSACASA-N 430.208 4.768 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@@H](Br)[C@@H]1[C@@H]2CCO[C@@H]21 2298020091 VYMFIKGUJLQYMM-LSCLYLHCSA-N 428.921 4.822 50 10 IJGE CC[C@@H](C)[C@H](CCl)NCc1ccc(I)c(Br)c1 2306225903 DWXQMDFGLDFMTL-RNCFNFMXSA-N 430.555 4.797 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H]2C[C@@H](Br)C3)c(I)c1 2318514699 FJRWQGKEWXKAJX-UOJUARBOSA-N 440.550 4.835 50 10 IJGE COc1cc(Br)cc(C=NNC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)c1O 2323138666 AXKCZMQEVHTZGQ-SWOGZVPRSA-N 435.362 4.610 50 10 IJGE C[C@@H]1CCN(Cc2ccc(I)c(Br)c2)C[C@@H]1CCl 2325223361 OTQMEWKCPBMHTP-PWSUYJOCSA-N 442.566 4.751 50 10 IJGE ClCCCN(Cc1c(Br)cccc1Br)C1CCOCC1 2381163268 MYBDPPPPYMXRHV-UHFFFAOYSA-N 425.592 4.822 50 10 IJGE CCn1nc(C)c(/C=C2/CCCC3=C2OC(N)=C(C#N)[C@H]3c2c(C)nn(CC)c2C)c1C 33249024 MTEOLTPQUYIJGB-QRKROWPFSA-N 432.572 4.682 50 10 IJGE CCCCCN1C(=O)/C(=N/NC(=O)COc2ccc3ccccc3c2)c2cc(C)ccc21 33959322 FBXOJPJPISRWRF-AZPGRJICSA-N 429.520 4.584 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4Cl)ccc32)cc1 38650275 ROFJELMRTXYPRY-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE O=C(COc1ccc(C2CCCCC2)cc1)N/N=C/c1cc(Br)ccc1O 59166094 DQZXHBQLBDBEID-YDZHTSKRSA-N 431.330 4.732 50 10 IJGE CC[C@H](Br)CCNC(=O)c1cc(Br)sc1Br 233976803 IRXUNVGRNPZMGZ-LURJTMIESA-N 433.991 4.567 50 10 IJGE CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NN=Cc2cc([N+](=O)[O-])ccc2O)cc1 254351551 SSTVCJWIUYEDNR-UHFFFAOYSA-N 427.501 4.543 50 10 IJGE COc1cc(C=NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1OCc1ccccc1Cl 256017134 AYNLOQQTTASFFQ-UHFFFAOYSA-N 439.855 4.600 50 10 IJGE Br[C@@H](c1ccc2c(c1)OCCO2)c1sccc1I 310864698 RFNJZFFPUIXBFO-LBPRGKRZSA-N 437.096 4.608 50 10 IJGE O=S(=O)(NCc1cccc(OCc2ccccc2)c1)c1ccc(CBr)cc1 383649409 IUFVJLNUKLHEQF-UHFFFAOYSA-N 446.366 4.639 50 10 IJGE CC[C@H](C[C@H](C)Br)NCc1cc(Cl)ccc1I 716806065 AZOXFHIADKBXIU-JOYOIKCWSA-N 430.555 4.986 50 10 IJGE Cc1nn(-c2ccc(Cl)cc2Cl)c(C)c1CC(=O)NNc1cccc(F)c1F 743724344 HDSANODKFUANTG-UHFFFAOYSA-N 425.266 4.760 50 10 IJGE COc1ccccc1[C@@H](NC(=O)NNc1ccc(C#N)cc1C(F)(F)F)c1ccco1 799605500 DTQUQXMMJMWDPB-LJQANCHMSA-N 430.386 4.594 50 10 IJGE COCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2cccc(COc3ccccc3)c2)c1C 917865613 FMKIZEYDTRDKNU-PCLIKHOPSA-N 443.547 4.554 50 10 IJGE CCCN(CCC)c1ccc(C(=O)NN=Cc2cc(Br)ccc2OC)cc1 1084251004 HJTNQCFQIWYMQW-UHFFFAOYSA-N 432.362 4.848 50 10 IJGE O=C(CCc1ccccc1O)NN=C1C(=O)N(Cc2cccc3ccccc23)c2ccccc21 1084567075 LRJSONGZJCCZEI-UHFFFAOYSA-N 449.510 4.545 50 10 IJGE C#C[C@@H](NC(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2)c1ccc(Cl)cc1 1478897123 SRVAOYNKPZWTLU-FUHWJXTLSA-N 444.000 4.871 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2sc3cccc(F)c3c2Cl)c1C 1610925321 VRQFSWIIHPDIFN-UHFFFAOYSA-N 427.892 4.920 50 10 IJGE CN1C[C@@H](CI)[C@@H](c2cc(C(F)(F)F)ccc2Br)C1 1614693908 MMVPUZUZJIKCFL-KCJUWKMLSA-N 448.064 4.548 50 10 IJGE C=CCC[C@H](NC(=O)NNc1cc(C(=O)OC)ccc1Br)c1ccccc1 1680805002 XVJQPUZGVGMBOB-KRWDZBQOSA-N 432.318 4.569 50 10 IJGE COc1cccc(C(=O)N/N=C\c2c(C(C)C)nc3c(Cl)cc(C(F)(F)F)cn23)c1 1865762878 IHYULAIZRDZQRT-MWYAZZEHSA-N 438.837 4.902 50 10 IJGE COC(=O)c1c(NC(=O)CI)sc(C)c1-c1ccc(C)c(C)c1 1865947541 IZCDXSZYTCFDNL-UHFFFAOYSA-N 443.306 4.500 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)c3ccc(N(C)C)cc3)n2)c(OC)c1OC 1872759367 MBTXXDUNYQEJPK-JZJYNLBNSA-N 437.521 4.852 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCN(C[C@H](Br)C(F)(F)F)C2)C1 1879197712 CPXODZHUQFKXJI-ILXRZTDVSA-N 443.348 4.671 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)C(=O)c1cc(Cl)cc(Br)c1 1916354785 LSZKDSLVXZBNFU-QGZVFWFLSA-N 431.157 4.999 50 10 IJGE O=S(=O)(N[C@@H](CBr)CC1CCCCC1)c1cc(Br)cs1 1926747610 AQZIUPDEGBLBHT-GFCCVEGCSA-N 445.242 4.523 50 10 IJGE BrC[C@H]1CSCCN1Cc1c(Br)cccc1Br 1945333686 TZFGRRCNBJKKJN-VIFPVBQESA-N 444.030 4.524 50 10 IJGE O=S(=O)(C1CC(OCc2ccccc2)C1)N(Cc1ccccc1)[C@H](CCl)C1CC1 1958928515 PQHYRSWBGRYSFP-XPPIMPSXSA-N 434.001 4.584 50 10 IJGE O=S(=O)(c1occc1CBr)N(Cc1ccccc1)Cc1cccs1 2009645678 KGCZRLYEOXSDGD-UHFFFAOYSA-N 426.357 4.627 50 10 IJGE CC1(C)C[C@H](Br)CN1Cc1ccc(I)c(Cl)c1 2026568297 ZQVPHVLWZOCPTI-JTQLQIEISA-N 428.539 4.692 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc([S@@](C)(=O)=NC[C@@H](Br)C(F)(F)F)c1 2044693275 JIWZJEYDTODTCG-XELLLNAOSA-N 445.301 4.816 50 10 IJGE CC(F)(F)C[C@@H](CCl)NC(=O)c1scc(Br)c1Br 2050363985 GTSYJPBCJXAGAQ-YFKPBYRVSA-N 425.520 4.656 50 10 IJGE COc1ccc(-n2nc(CBr)c(Br)c2C(F)(F)F)c(C)c1 2079235144 OTRIRANZYWEGJO-UHFFFAOYSA-N 428.046 4.866 50 10 IJGE CCCCCC[C@@H]1C=C2[C@@]3(C)CC4=C(C(=O)OC4=O)[C@@H]([C@@H]1CCCCCC)[C@@]2(O)OC3=O 2080449539 MOBNKYGKVWHWSM-UFOJWLOOSA-N 444.568 4.751 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@H](CCl)C(F)(F)C1 2090182993 XFFCAIZTSDCKPD-ZCFIWIBFSA-N 437.531 4.609 50 10 IJGE O=C(N[C@H]1C[C@H]2CC[C@H]1[C@H](Br)C2)c1cc(Br)c(Cl)s1 2139707343 RTHYQZQPDOGATD-OORONAJNSA-N 427.589 4.846 50 10 IJGE O=C(NC[C@@]1(C2CC2)CCN(CC2(CBr)CCCCCC2)C1)C(F)(F)F 2163064592 VDPNSDJKRSWQHG-SFHVURJKSA-N 439.360 4.503 50 10 IJGE COC[C@@H](C)OC[C@@H](Br)CCc1ccc(Cl)c(Br)c1F 2166830957 IUKAQIQEAONOFQ-KOLCDFICSA-N 432.555 4.989 50 10 IJGE C[C@H](Br)C[C@H]1COCCN1Cc1ccc(Cl)c(Br)c1F 2185314786 TUYVEZRMYBANTE-ONGXEEELSA-N 429.555 4.616 50 10 IJGE COc1cc(Cl)c([C@H](Br)[C@@]23COC[C@@H]2C3(F)F)cc1Br 2202364173 GSUBOJBUGZUWIJ-SDDRHHMPSA-N 432.486 4.829 50 10 IJGE COc1ccc(Br)c(CBr)c1OCC(F)(F)C(F)(F)F 2236041421 QWSRMGGZZPBGSE-UHFFFAOYSA-N 427.989 4.929 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1Cc1c(Br)cccc1Br 2251037210 ANJPRIWNASMRRS-QWHCGFSZSA-N 425.990 4.959 50 10 IJGE FC(F)(F)Oc1ccc(OCCCCI)cc1Br 2256328069 VSIOPKXOCYTZAQ-UHFFFAOYSA-N 439.009 4.942 50 10 IJGE N#CC(=Cc1cc2ccccc2nc1N1CCCCC1)c1nn(-c2ccccc2)c(N)c1C#N 2295163781 QQFDTIFDLSCISV-UHFFFAOYSA-N 445.530 4.929 50 10 IJGE COc1cc(NC=C(C#N)c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)c(C)cc1[N+](=O)[O-] 2296073446 BBVNKDLJWZXLLX-UHFFFAOYSA-N 437.437 4.920 50 10 IJGE N#CC(=Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(=O)Nc1ccccc1[N+](=O)[O-] 2296655664 YRYOBBCFQSDLSO-UHFFFAOYSA-N 438.783 4.962 50 10 IJGE C#CCOc1cc(Br)c(C=C(C#N)c2ccc([N+](=O)[O-])cc2)cc1OCC 2297368402 KMWZSJYLLPBANZ-UHFFFAOYSA-N 427.254 4.832 50 10 IJGE CO[C@@H]1C[C@H](Br)C[C@H]1Cc1ccc(Cl)c(I)c1 2300267035 FGDRHODQSCGQMA-GIPNMCIBSA-N 429.523 4.676 50 10 IJGE C[C@@H]1C[C@@H](CCl)CN1Cc1ccc(I)c(Br)c1 2306227288 MHQAIGJWKLZEKC-KOLCDFICSA-N 428.539 4.503 50 10 IJGE CCOc1cccc(-c2nn(-c3ccccc3)cc2C=C(C#N)C(=O)N2CCCCC2)c1 2314476197 KODRSIBAFPGMSH-UHFFFAOYSA-N 426.520 4.857 50 10 IJGE CCN1C(=O)C(=Cc2ccc(OCc3ccc(Cl)cc3)c(OC)c2)C(C)=C(C#N)C1=O 2314611101 QNUKDFVPTNOIGI-UHFFFAOYSA-N 436.895 4.540 50 10 IJGE COc1ccc([C@H](C)NC(=O)C(C#N)=CN(Cc2ccccc2)c2ccccc2)cc1OC 2325045338 ADDDTXPBRXKUEU-FQEVSTJZSA-N 441.531 4.995 50 10 IJGE ClC[C@H]1CCCC[C@@H]1NCc1ccc(I)c(Br)c1 2325210661 AJHIEDFRANAHFA-RISCZKNCSA-N 442.566 4.941 50 10 IJGE CCCc1sc(Br)cc1[C@H](Br)[C@H]1CCCCS1(=O)=O 2338018409 BFOWGLMOSZJFLL-YPMHNXCESA-N 430.227 4.866 50 10 IJGE COC[C@]1(C)C[C@H](NC(=O)OC(C)(C)C)CN1CC1(CBr)CCCCCC1 2364207674 AOPJDAPRLIXQTJ-PXNSSMCTSA-N 447.458 4.726 50 10 IJGE Cc1cnc(N2C[C@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)cc1CBr 2380366174 UPWJLVUYZLZFNX-DHIUTWEWSA-N 426.402 4.777 50 10 IJGE CCOc1cc(/C=N/NC(=O)c2ccc3c(c2)CN(c2ccc(Cl)cc2)C3)ccc1O 59038504 VFBDUYNDJMGPPZ-LGJNPRDNSA-N 435.911 4.728 50 10 IJGE Cn1cc(C[C@@H](CBr)c2ccc(Br)cc2)c(Br)n1 714085327 NZDAZBOWMFLPJP-JTQLQIEISA-N 436.973 4.666 50 10 IJGE O=C(NNc1cc(C(F)(F)F)ccc1F)c1cc(O)nc2ccc(Br)cc12 754147353 KGTKMYWQHSYRSY-UHFFFAOYSA-N 444.182 4.618 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=NNC(=O)Cc3cccc(C(F)(F)F)c3)o2)cc1 1083967862 QMVQZLJWHMWNRE-UHFFFAOYSA-N 444.409 4.835 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(NS(=O)(=O)c2ccc(CBr)cc2)cc1 1237828792 GSOWXRAPFFQDOT-UHFFFAOYSA-N 441.347 4.729 50 10 IJGE C=CC[C@H]1CCCN(C(=O)CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)C1 1645066770 LVJOKIOYVKGHJK-QHCPKHFHSA-N 435.684 4.768 50 10 IJGE O=C(CCCl)Nc1ccc(Oc2ccc(NC(=O)[C@@H]3CCCC[C@H]3C(=O)O)cc2)cc1 1859505294 UQADGEIBVOTZBJ-WOJBJXKFSA-N 444.915 4.876 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2F)[C@H]1c1cccc(Cl)c1 1865683388 KQZLZYRMHJXNNV-INIZCTEOSA-N 448.807 4.961 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2cccc(Cl)c2)[C@@H]1c1ccc(O)cc1 1865684259 OTOZJSKYFPQYJD-MRXNPFEDSA-N 446.816 4.527 50 10 IJGE CCOC(=O)c1sc(NC(=O)/C(C#N)=C/c2ccc(OC)cc2)nc1-c1ccccc1 1866126279 IONTUTGXLBAVBD-GHRIWEEISA-N 433.489 4.541 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)C(=O)c1c(Cl)cccc1Br 2003557896 MGUOXOAIPHMGIO-CQSZACIVSA-N 431.157 4.999 50 10 IJGE BrCC[C@@H]1CCN(Cc2cc(Br)ccc2Br)C1 2006504056 VQFQAABRCKGVJJ-SNVBAGLBSA-N 425.990 4.819 50 10 IJGE Cc1nc(N2CCCN(Cc3ccccc3)CC(F)(F)C2)sc1CBr 2045991948 FFGFZOWOHFFNKQ-UHFFFAOYSA-N 430.362 4.694 50 10 IJGE CC1(C)OCCO[C@@H]1[C@H](Br)c1cc(Br)ccc1Br 2066691196 SYNQYXXINFVGGU-VXGBXAGGSA-N 442.973 4.842 50 10 IJGE CCN(C(=O)OC(C)(C)C)[C@H]1CCCN(C[C@@H](CBr)c2ccccc2)C1 2106781363 HDXZEUJZOKTFKV-MOPGFXCFSA-N 425.411 4.887 50 10 IJGE C[C@@H]1C[C@@H](C(F)(F)F)N(C[C@@H](CBr)C2CC2)CCN1C(=O)OC(C)(C)C 2121769791 ASSPKMRJQWOOMD-YUELXQCFSA-N 443.348 4.670 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ccccc2)CCN1c1ncc(CCl)cc1Br 2130166102 KVDUEUKMWOOKTG-MRXNPFEDSA-N 448.714 4.836 50 10 IJGE COc1ccc([C@@H](Br)c2cnn(C)c2Br)c(Cl)c1Cl 2138628346 RRGZIKHDBLAPTN-SECBINFHSA-N 428.939 4.982 50 10 IJGE CC(C)(C)[C@H]1C[C@@H](CCl)CN(C(=O)c2sccc2I)C1 2165006879 IOEPOSPCNLXFDG-QWRGUYRKSA-N 425.763 4.716 50 10 IJGE O=C(c1ccc(Cl)cc1Br)N1CC[C@H](C(F)(F)CBr)C1 2197762606 JJEYUOVIJMWFMM-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE Cc1ccc(I)c(C(=O)N(CCBr)c2ccccc2)c1 2240921089 JHJOLNLZOMYWQC-UHFFFAOYSA-N 444.110 4.641 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@@H]2CCC[C@]2(CBr)C1 2264516075 WPPQWHMUUUZYMD-SDBXPKJASA-N 427.589 4.801 50 10 IJGE CC(C)CC(CBr)(CBr)Cc1cscc1S(C)(=O)=O 2272890403 ZCCQRYOHYRFPMY-UHFFFAOYSA-N 432.243 4.516 50 10 IJGE CCOc1ccc(-c2csc(C(C#N)=Cc3cc(C(=O)OC)cc(C(=O)OC)c3)n2)cc1 2296802168 SFAVKWWWBQLDEQ-UHFFFAOYSA-N 448.500 4.846 50 10 IJGE CC[C@H](C)[C@H](Cl)CNCc1ccc(I)c(Br)c1 2306226124 YBXPXWKGFOCKPG-JOYOIKCWSA-N 430.555 4.797 50 10 IJGE CSc1ccc(Cl)cc1CC(=O)NN=Cc1ccc(OC(=O)c2ccccc2)cc1 2318418275 VOLMSKBYPQTFLA-UHFFFAOYSA-N 438.936 4.974 50 10 IJGE C[C@H]1[C@H](C)N(Cc2ccc(Cl)cc2I)CC[C@H]1Br 2321306385 YFTBTTSOKDTQCS-OUJBWJOFSA-N 442.566 4.938 50 10 IJGE COc1ccc(-c2csc(C(C#N)=C(O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)n2)cc1C 2331260098 GQVDHJLBEBYKMP-UHFFFAOYSA-N 438.421 4.893 50 10 IJGE FC(F)(CI)C(F)(F)CNCc1ccc(Cl)cc1Cl 2336528620 CRHWQGDJFMZFHF-UHFFFAOYSA-N 430.010 4.789 50 10 IJGE CC1(C)O[C@](C)([C@H]2CC[C@@](C)(Br)[C@H](Cl)C2)[C@H](O)C[C@H]1Br 30731746 OVZBIWJSECOXAT-RWBGOSSDSA-N 432.624 4.630 50 10 IJGE in-vitro CC[C@H](Br)C(=O)Nc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OC 170508085 IGQFGQYWGCJFJC-ZETCQYMHSA-N 436.089 4.547 50 10 IJGE Fc1ccc([C@H](Br)c2ccc3c(c2)COC3)c(I)c1 236222968 SBZYTXFLSLNKND-OAHLLOKOSA-N 433.058 4.945 50 10 IJGE CCO[C@@H]1[C@H](Br)C[C@H]1Oc1c(Br)cccc1Br 252840346 CSFWSAAYDONJIV-CKYFFXLPSA-N 428.946 4.531 50 10 IJGE Cc1cccc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CI)c1 382695000 XSTBSIAYTHXGFT-MOPGFXCFSA-N 435.305 4.782 50 10 IJGE O=S1(=O)CCC[C@@H]1[C@H](Br)c1scc(C(F)(F)F)c1Br 694620829 GODDBGNBVWJGGF-SVRRBLITSA-N 442.116 4.543 50 10 IJGE CCO[C@H](CO[C@H](CI)c1cccc(Br)c1)C1CC1 703468114 CALJHLMQQRILRR-HUUCEWRRSA-N 439.131 4.757 50 10 IJGE Fc1cc2c(cc1I)nc(CCl)n2Cc1ncc(Cl)s1 719413305 QQQVZYRPEKOADE-UHFFFAOYSA-N 442.084 4.677 50 10 IJGE Cc1ccc(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)c(C)n1 755638348 DLMQLIPPXHXOSG-PDGQHHTCSA-N 430.899 4.675 50 10 IJGE CCn1c(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)nc2cc(C)ccc21 775910258 GNVFBDXJBYRTDB-HKWRFOASSA-N 449.518 4.687 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)NC[C@H]2CCC(F)(F)C2)c(-c2ccc(Cl)cc2)n1 797558815 GJZBPEHQUNAGSC-HAKPAVFJSA-N 443.885 4.576 50 10 IJGE O=C(NNc1ccc(-n2ccnc2)nn1)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 806223836 MPOBVOHKFQTGKI-UHFFFAOYSA-N 440.294 4.785 50 10 IJGE Cc1cc(C(C)(C)C(=O)NNc2nc3ccccc3[nH]c2=S)ccc1Br 1167430504 GEUAGVWYODJAGT-UHFFFAOYSA-N 431.359 4.784 50 10 IJGE Cc1nc(NCC(=O)NNc2cc(F)cc(F)c2F)c2cc(-c3ccccc3)sc2n1 1557313149 KCMQVYLRFAYWHA-UHFFFAOYSA-N 443.454 4.639 50 10 IJGE COc1ccc(NNC(=O)c2ccc(-c3cccc(Cl)c3)nc2O)c(Br)c1 1558206048 DEJNLZODKXQJPE-UHFFFAOYSA-N 448.704 4.636 50 10 IJGE CC(=O)c1ccc(CCNC(=O)NNc2ccc(Br)cc2C(F)(F)F)cc1 1639121899 SUDNJZHLFGMRLA-UHFFFAOYSA-N 444.251 4.539 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)C(=NNC(=O)Cc1ccccc1)CCC2 1772749715 YEJWGHIFEBKUFE-UHFFFAOYSA-N 445.519 4.557 50 10 IJGE CCCc1nn(-c2ccccn2)c2c1[C@@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 1865686747 ZNJGBYYJKMQUHW-QGZVFWFLSA-N 426.307 4.745 50 10 IJGE CCOc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccn2)cc1 1865694237 RMYMQNKTZDYHHM-QFIPXVFZSA-N 435.487 4.551 50 10 IJGE CCN(CC)c1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccccc2Cl)cc1 1865702195 PCBDWKHHHVTRQR-QHCPKHFHSA-N 447.970 4.958 50 10 IJGE CCC[C@H](NC(=O)c1cc(C)n(-c2cccc(C)c2)n1)C(=O)Nc1ccc(SC#N)cc1 1866840525 UKOXAAKCUAKJPF-NRFANRHFSA-N 447.564 4.600 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)S(=O)(=O)c1ccccc1C(F)(F)F 1914640101 WFPUVYCBJZTYQW-ZDUSSCGKSA-N 436.293 4.680 50 10 IJGE Brc1cnc(N2CC[C@@]3(CCC[C@@H]3Br)C2)c(Br)c1 1918905531 XBCFXWDECWTILT-AAEUAGOBSA-N 438.989 4.751 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC1(C2)CC2(CC[C@@H](CI)O2)C1 2012872808 CSAWJWCWYZZIHL-KKUMJFAQSA-N 447.357 4.681 50 10 IJGE CC1(C)OC[C@H](Cc2ccc(I)c(Cl)c2)[C@@H]1Br 2026566281 IXGQWNQKICROBA-CABZTGNLSA-N 429.523 4.676 50 10 IJGE O=C(N[C@H](CCBr)C1CC1)c1ccc(Br)cc1Br 2029972444 OHXYAQYQYYZLOY-GFCCVEGCSA-N 439.973 4.505 50 10 IJGE CC1([C@H](CBr)NC(=O)c2cc(Br)ccc2Br)CC1 2033130049 MRFPPRWDVUKCSF-NSHDSACASA-N 439.973 4.505 50 10 IJGE CC1(C)C[C@@H](Br)CN1C(=O)c1ccc(Br)cc1Br 2037330005 XQSOTHCDFARHPG-SECBINFHSA-N 439.973 4.600 50 10 IJGE Cc1nc(-c2ncc(Br)cc2Br)nc(C)c1CBr 2067198352 HIRTZCAOQINYRU-UHFFFAOYSA-N 435.945 4.575 50 10 IJGE CCc1nn(C)c([C@@H](Br)c2ccc(Br)cc2)c1Br 2072302516 LHXIJWLCZBCBFU-NSHDSACASA-N 436.973 4.992 50 10 IJGE CC1(C)C[C@](C)(CBr)CN1c1ncc(Br)cc1Br 2078801648 BVHPBLKXKHPIBA-CYBMUJFWSA-N 441.005 4.997 50 10 IJGE C[C@@H]1CN(C[C@H](CBr)c2ccccc2)C[C@@H](C)N(C(=O)OC(C)(C)C)C1 2106786908 HCEVZFPOISWKEQ-LMMKCTJWSA-N 425.411 4.742 50 10 IJGE CN(C(=O)[C@@H](Br)C1CCCC1)c1ccc(CNC(=O)OC(C)(C)C)cc1 2110718873 VLWSALOIMVRNML-KRWDZBQOSA-N 425.367 4.628 50 10 IJGE C[C@@H]1[C@@H](C(F)(F)F)N(C[C@@H](CBr)C(C)(C)C)CCN1C(=O)OC(C)(C)C 2115979582 JEFWMBDJVZTZFP-MCIONIFRSA-N 445.364 4.916 50 10 IJGE CC1(C)COC[C@H](COc2c(Br)cc(Br)cc2CCl)O1 2145713656 DOMIJZXRPTUIKI-LLVKDONJSA-N 428.548 4.523 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H]1CN(CC3(CBr)CCCCC3)C[C@@H]21 2163057921 GJTQABNNKMROJI-XWSJACJDSA-N 441.454 4.909 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C(=O)[C@H](Br)C2CCCC2)C2(CCCCC2)C1 2167035001 ZMNZFBVDZKSSHH-IAGOWNOFSA-N 443.426 4.769 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@@H]1C[C@@H]2CC[C@H](C1)O2 2181362939 TXXKKHNJYLYLFN-QJZXMWHDSA-N 449.126 4.620 50 10 IJGE CC(C)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@]12CCC[C@H](CI)O2 2243432843 FDBKYQRENDSWII-VKJFTORMSA-N 437.362 4.642 50 10 IJGE ICCCCN1CCC[C@@]2(CCCN(Cc3ccccc3)C2)C1 2243591792 ZJRHLTLBVALBQB-HXUWFJFHSA-N 426.386 4.580 50 10 IJGE Cc1ccc(NC(=O)C(C#N)=Cc2c(Oc3ccccc3)nc3ccccn3c2=O)cc1C 2296719408 NHAHSXHYLXZRPC-UHFFFAOYSA-N 436.471 4.649 50 10 IJGE CC(C)(C)N(CCBr)C(=O)c1ccc(Cl)cc1I 2317769539 WAQPNLHSHSLYLI-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2CC[C@H]1[C@@H](Br)C2 2325465265 GFQWKVCAXVDOKB-HERUPUMHSA-N 438.001 4.959 50 10 IJGE Cc1cnc(N2C[C@@]34CCC[C@]3(CN(Cc3ccccc3)C4)C2)cc1CBr 2380366175 UPWJLVUYZLZFNX-GOTSBHOMSA-N 426.402 4.777 50 10 IJGE C/C(=N\NC(=O)COc1ccc([N+](=O)[O-])cc1Br)c1ccc(C(C)(C)C)cc1 20074116 JVSWMSLSIIXLLL-LPYMAVHISA-N 448.317 4.574 50 10 IJGE O=C(CNc1ccc(Cl)cc1Br)N/N=C\c1c(O)ccc2ccccc12 20074929 YTGFGGBQGRIANM-RMORIDSASA-N 432.705 4.524 50 10 IJGE Cc1cccc(C)c1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(F)cc1 38652731 JTMFKTIKTWIWRO-DEOSSOPVSA-N 444.462 4.645 50 10 IJGE O=S(=O)(c1c(Cl)cc(Br)cc1Cl)N1CCC[C@H](CCCl)C1 109647668 GEUFNULLJFCHCF-SECBINFHSA-N 435.598 4.786 50 10 IJGE CC[C@@H](CCBr)NC(=O)c1cc(Br)c(Br)s1 218369714 IWOYDYFBBZNEAX-LURJTMIESA-N 433.991 4.567 50 10 IJGE Cc1cccc([C@H]2CN(C(=O)OCc3ccccc3)C[C@H]2CI)c1 382695003 XSTBSIAYTHXGFT-RTBURBONSA-N 435.305 4.782 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@@H]1n1c(CCCl)nc2cc(Br)cnc21 389782720 JEZGEBPZHDNJEY-KDOFPFPSSA-N 433.781 4.668 50 10 IJGE C[C@H](CC(C)(C)C)CC(CBr)(CBr)[C@@H]1CCS(=O)(=O)C1 709256882 FYBGABQDHBNLID-CHWSQXEVSA-N 432.262 4.660 50 10 IJGE CCOc1ccc(/C=C(/C#N)C(=O)N2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1 726536923 IWNMZEVJNAZBCB-KYYPIKSYSA-N 446.482 4.588 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2nc3c(s2)C(=O)CCC3)c(C)n1-c1ccc(F)cc1 727713888 LSJVKCFKFZZNAF-WJDWOHSUSA-N 434.496 4.754 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)OCc2cc(Cl)ccc2OCC#N)c(C)n1CC(C)C 735338644 VIAFZGCGHZQGFB-VXLYETTFSA-N 425.916 4.967 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCCc2ccc(Cl)c(Cl)c2)c1C 736697450 XOAMXQWFYCHXSZ-UHFFFAOYSA-N 430.339 4.928 50 10 IJGE COc1ccc(CC(=O)NN=Cc2ccc(OCc3ccccc3Cl)c(OC)c2)cc1 1084163526 LYNOHCFQHHRZDX-UHFFFAOYSA-N 438.911 4.629 50 10 IJGE O=C(NN=Cc1cccc(OCc2ccccc2Cl)c1)C(=O)Nc1ccccc1Cl 1084310501 LAAZHMXORYYPQE-UHFFFAOYSA-N 442.302 4.661 50 10 IJGE C=CCCC[C@H](NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(=O)OC 1455839158 YFSLOKHHQOZZAF-SLTDHEAWSA-N 439.943 4.669 50 10 IJGE C#CC1CCN(C(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Br)cc3)c2C)CC1 1537388528 IRLIESBQRWUCCQ-XSFVSMFZSA-N 436.353 4.635 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)c1C 1650818181 WLZRASAHAWFQSR-SJLPKXTDSA-N 425.895 4.585 50 10 IJGE CCc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccc(O)cc1)CCC2 1772745035 PFRLCJDVDXNITO-UHFFFAOYSA-N 431.492 4.579 50 10 IJGE COc1cc(C=NNC(=O)CSc2nc3ccccc3s2)ccc1OCC(C)C 1772760302 AJTAPFWCIBEWGA-UHFFFAOYSA-N 429.567 4.582 50 10 IJGE CCCc1nn(Cc2ccc(C)cc2)c2c1[C@H](c1ccc(O)c(OCC)c1)C(C#N)=C(N)O2 1865681712 ULCZDVJKMSEVSE-HSZRJFAPSA-N 444.535 4.515 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccc(Cl)cc2)[C@H]1c1ccccn1 1865700095 KXXSRYBBVYNRFP-HXUWFJFHSA-N 425.879 4.806 50 10 IJGE Cc1ccc(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@@H]3c2cccc(F)c2)cc1 1865710648 DHALSUKXXVEWJZ-KRWDZBQOSA-N 428.389 4.616 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1C[C@@H]2CN(C(=O)OC(C)(C)C)C[C@]2(C)C1 1882084952 PMEYSZZCTATQBV-RTEYEHBSSA-N 447.414 4.558 50 10 IJGE CCCCOCCOCCOCCN(Cc1ccccc1)C[C@H](Br)CC 1915128167 VUOGWHMNIPTALC-OAQYLSRUSA-N 430.427 4.512 50 10 IJGE O=S(=O)(c1cc(F)ccc1Cl)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915171044 VVGCDUUBYNYPAA-KRWDZBQOSA-N 446.769 4.844 50 10 IJGE C[C@H]1CN(Cc2ccc(Br)cc2Br)CC[C@H]1Br 1943841947 FZBQDYRVNIQVOW-JOYOIKCWSA-N 425.990 4.817 50 10 IJGE ClC[C@H](Nc1ncc(I)cc1Br)c1cccs1 2015762106 HHPNPEHFOZGBLM-VIFPVBQESA-N 443.535 4.902 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)C1(CBr)CCC1 2026564772 WJARCBNTPBIYJD-UHFFFAOYSA-N 428.539 4.694 50 10 IJGE O=C(CBr)c1cc(C(F)(F)F)c(OC(F)(F)F)cc1Br 2054797380 SJVJHDDBPODNNE-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]23CCC[C@@]2(CN(C[C@H](CBr)CC2CC2)C3)C1 2112867114 UZYGOTNILHDMDF-IOMROCGXSA-N 427.427 4.521 50 10 IJGE CN(Cc1cc(Cl)ccc1I)[C@@H](CCCl)C(F)(F)F 2122000521 ILKKOXIGXOBTGC-NSHDSACASA-N 426.047 4.936 50 10 IJGE CCCN(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)CC1(CBr)CCOCC1 2163064553 UZDDPINBZYEGEA-SFHVURJKSA-N 447.458 4.680 50 10 IJGE O=C(c1ccc(Br)cc1Cl)N1CCC([C@@H](F)CBr)CC1 2163244380 HKOZJIUKBDEZAG-ZDUSSCGKSA-N 427.539 4.688 50 10 IJGE O=C(N[C@H](CBr)c1ccsc1)c1c(F)cc(Br)cc1F 2175664850 BMVNEQLTQVKDFH-LLVKDONJSA-N 425.092 4.655 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCC2(CCOCC2)N(C[C@H](CBr)C(C)(C)C)C1 2193493717 FBKMIIYSTZPDKW-IRXDYDNUSA-N 447.458 4.582 50 10 IJGE C[C@H]1[C@H](Br)C[C@@H](C)CN1c1ncc(Br)cc1Br 2214807602 FDMZOJXFODIOKS-KHQFGBGNSA-N 426.978 4.605 50 10 IJGE Fc1cc(Br)cc(F)c1CO[C@@H]1CCCC[C@@H]1I 2259042309 PKVDLXVVLCXXQD-QWHCGFSZSA-N 431.058 4.990 50 10 IJGE C[C@@H]1CC[C@H](CBr)CN1C(=O)c1cc(F)c(Br)cc1Cl 2282973916 FIRFQSMFJVFMHD-RKDXNWHRSA-N 427.539 4.877 50 10 IJGE COc1cc(F)c(CBr)c(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1 2283392011 NFJNWXPYQZCDFC-JOCHJYFZSA-N 433.365 4.832 50 10 IJGE CN(C(=O)c1ccc(Cl)c(I)c1)[C@@H]1CCCCC[C@H]1Cl 2283657066 RPSMJLBMVZELPF-TZMCWYRMSA-N 426.125 4.957 50 10 IJGE C[C@H]1OCC[C@@]1(CBr)Cc1ccc(Cl)cc1I 2302315232 HHNZHIIFJVEKOI-RNCFNFMXSA-N 429.523 4.677 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@H]2C[C@@H]3C[C@@H]3CO2)c1 2313495501 HPPYRCWSNICRBG-GIFSMMMISA-N 438.985 4.943 50 10 IJGE CCCCCN1C(=O)C(=CNc2ccccc2C(=O)c2ccccc2)C(C)=C(C#N)C1=O 2314585536 CQQGLRRXVCJLQW-UHFFFAOYSA-N 427.504 4.612 50 10 IJGE CC1(C)CN(Cc2ccc(Cl)cc2I)CC[C@H]1Br 2318526897 ONVYLEXFALNICB-CYBMUJFWSA-N 442.566 4.940 50 10 IJGE Cl[C@H]1CN(Cc2ccc(I)c(Br)c2)C[C@@H]1C1CC1 2325226223 MISWZIGDHRNAEK-YPMHNXCESA-N 440.550 4.503 50 10 IJGE FC1(F)[C@@H]2CC[C@@H](O[C@H](CI)c3ccccc3Br)[C@@H]21 2333872082 RWLXKDHHXQQTCH-OJAKKHQRSA-N 443.069 4.986 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@@](C)(CBr)C(C)(C)C)[C@H](C(F)(F)F)C1 2352076631 JABOTJPOHPBBOF-SUMWQHHRSA-N 445.364 4.917 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@](C)(CBr)C(C)(C)C)C2(CCOCC2)C1 2380203943 VRVGGLRCUFBMDL-OXJNMPFZSA-N 447.458 4.582 50 10 IJGE CC[C@@H](C)c1ccccc1O[C@H](C)C(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1 9874441 MCTGXALYZVQMRM-GUDVDZBRSA-N 434.536 4.736 50 10 IJGE N#C/C(=C/c1cccs1)C(=O)Nc1ccc(NC(=O)/C(C#N)=C\c2cccs2)cc1 27533738 SNWRPQHDXZMSGS-NFLUSIDLSA-N 430.514 4.901 50 10 IJGE CCCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccccc3)c(OC)c2)C1=O 38603688 RNDDWJCGHBTMRT-KGENOOAVSA-N 430.504 4.667 50 10 IJGE C=CCc1cccc(/C=N/NC(=O)c2ccc(NC(=O)c3ccc(Cl)cc3)cc2)c1O 97729967 AZWMHOFRBFYKOO-CVKSISIWSA-N 433.895 4.790 50 10 IJGE Cc1ccc(Cn2cccc(C(=O)N/N=C\c3c(Cl)ccc(Cl)c3Cl)c2=O)cc1 169920148 GAUUDGRJUOVGHU-GATIEOLUSA-N 448.737 4.929 50 10 IJGE Brc1cnc(N2C[C@H]3C[C@@H](Br)CC[C@H]3C2)c(Br)c1 398719434 YDKYUJKLPTWCRF-AEJSXWLSSA-N 438.989 4.606 50 10 IJGE CN(C[C@H](Br)C1CC1)C(=O)c1cc(Br)c(Br)s1 690268617 URRHAEOBODRAGW-QMMMGPOBSA-N 446.002 4.519 50 10 IJGE O=C(NC[C@H]1CC[C@@H](Br)C1)c1scc(Br)c1Br 705402009 SPMWYEGJXRNHOM-NKWVEPMBSA-N 446.002 4.567 50 10 IJGE COc1cc([C@H](C)NC(=O)NNC(=O)c2cccc3ccccc23)ccc1OC1CCCC1 743536585 IFLKYNUKLKWEHF-KRWDZBQOSA-N 447.535 4.875 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCCCCO[C@H]2CCC[C@@H](C)C2)c1C 767150166 MWVYKCWKCVBKEC-UTKZUKDTSA-N 425.577 4.754 50 10 IJGE CC(=O)c1cc(C#N)ccc1NC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(F)cc2)c1C 1543528238 VCLCLMHDSFEPBO-UDWIEESQSA-N 426.451 4.853 50 10 IJGE C=C(C)[C@@H](NC(=O)NNC(=O)c1ccc(-n2c(C)ccc2C)cc1)c1ccc(F)c(F)c1 1634436215 WOFYXWSZBOEWPL-JOCHJYFZSA-N 438.478 4.634 50 10 IJGE COc1cc(C=NNC(=O)COc2cccc(C(C)C)c2)ccc1OCc1ccccc1 1772753299 OLLVURAPOQGTRI-UHFFFAOYSA-N 432.520 4.927 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccc(OC)cc2)nn3-c2ccccn2)cc1 1865709044 MDUHYAKDVUPONL-HSZRJFAPSA-N 449.514 4.723 50 10 IJGE COc1cc(C(=O)N(Cc2ccccc2)[C@H](C)CCBr)cc(OC)c1OC 1915091586 ZDQDUKMKJBMFSH-OAHLLOKOSA-N 436.346 4.528 50 10 IJGE Cc1cc(C)c(S(=O)(=O)N(Cc2ccccc2)C2(CBr)CCC2)s1 1915774815 SXRUTKKYLZXUEB-UHFFFAOYSA-N 428.417 4.873 50 10 IJGE C[C@@H](Cl)c1cnnn1-c1cc(Br)c(Br)c(Br)c1 1946434844 OQBUOUBTECTOKY-RXMQYKEDSA-N 444.352 4.855 50 10 IJGE CO[C@@H]1C[C@@H](Br)C[C@@H]1Cc1ccc(Br)cc1Br 2007138522 WLPPINZIOQJACR-XHVZSJERSA-N 426.974 4.943 50 10 IJGE CO[C@@H]1C[C@@H]1COc1c(Br)cc(CBr)cc1Br 2014581954 HSHPSIFXDNPUJS-LDYMZIIASA-N 428.946 4.520 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@H]2CC[C@H](Cl)[C@H]1C2 2093944879 RDZFBNGIKDXERR-FKTZTGRPSA-N 427.589 4.895 50 10 IJGE CCOc1ccc(S(=O)(=O)N(Cc2ccccc2)CC2CC2)cc1CBr 2123247428 QNOMXDSMRJHRRX-UHFFFAOYSA-N 438.387 4.581 50 10 IJGE C[C@](CI)(O[C@@H]1[C@H]2C[C@@H]2[C@H]2C[C@@H]12)c1ccccc1Br 2143311173 LGJJUUYJYDHIPJ-RSUATGCGSA-N 433.127 4.770 50 10 IJGE CCCC(CBr)(CCC)CN1CCC[C@H]2CC[C@@]21CNC(=O)C(F)(F)F 2163059275 RSTGNSCYRHKLHX-MAUKXSAKSA-N 441.376 4.891 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)[C@H](Br)C2CCCC2)cc1 2167044261 WKKAYVBJIKQBRR-RDTXWAMCSA-N 439.394 4.842 50 10 IJGE Cn1ncc(CC(CBr)(CBr)c2cccc(Cl)c2)c1Cl 2168232145 SEPMQPLAVFGWFP-UHFFFAOYSA-N 440.994 4.997 50 10 IJGE CC1(C)OCCO[C@@H]1COc1c(Br)cc(Cl)cc1CBr 2186979911 WPKZVDIRDIQVHT-GFCCVEGCSA-N 428.548 4.570 50 10 IJGE CCCC[C@@H](CC)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2193562650 RKFJUEULARWWCX-SNVBAGLBSA-N 447.258 4.995 50 10 IJGE CCC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C[C@H](CBr)c1ccccc1 2231938883 CSUBDXGYCVEYCY-RBUKOAKNSA-N 425.411 4.887 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(O[C@@H]2CCCC23CCC3)C1 2250323841 XKZSFBCMWVIVCM-DNVCBOLYSA-N 449.373 4.931 50 10 IJGE Clc1ccc(C[C@H]2CCOCC[C@@H]2Br)c(I)c1 2302330023 XYFNERUYMSJCOT-SKDRFNHKSA-N 429.523 4.677 50 10 IJGE CC1=C(C#N)C(=O)N([C@@H](C)c2ccccc2)C(=O)C1=CNc1ccc(Br)cc1 2314579515 VXZNAFIPCBDSAV-HNNXBMFYSA-N 436.309 4.715 50 10 IJGE Cc1ccccc1C[C@@H](Br)c1c(Br)c(Br)nn1C 2316700503 CDHCZTGXWSHEHK-SNVBAGLBSA-N 436.973 4.932 50 10 IJGE Cl[C@H]1CCN(Cc2ccc(I)c(Br)c2)C2(CC2)C1 2325205572 YZXOLFBQUSNWKW-NSHDSACASA-N 440.550 4.790 50 10 IJGE C[C@@H]1CC[C@H](CCl)CN1Cc1ccc(I)c(Br)c1 2325214897 TWAYZMGLBYLLGV-ZYHUDNBSSA-N 442.566 4.893 50 10 IJGE Cc1ccc(Cn2c(C)cc3c(c2=O)[C@H](c2ccc(C(C)C)cc2)C(C#N)=C(N)O3)cc1 2442431 JPVSRKDQAXLBNB-XMMPIXPASA-N 425.532 4.855 50 10 IJGE O=C(NNC(=S)NC(=O)c1cc(Cl)cc(Cl)c1)c1ccc(-c2ccccc2)cc1 10505829 YWTJMXIRTYLOIS-UHFFFAOYSA-N 444.343 4.610 50 10 IJGE CC(C)(C)c1ccc(OCC(=O)N/N=C/c2c[nH]c3ccccc23)c(Br)c1 12403443 ASBRSBNKUCRSDO-WYMPLXKRSA-N 428.330 4.757 50 10 IJGE COc1ccc(C(=O)N/N=C/c2cccc(OCc3ccccc3)c2)cc1Br 12579601 DRHQJRUTITXZTO-ZVHZXABRSA-N 439.309 4.801 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccc([N+](=O)[O-])cc3)ccc2[C@H]1c1cccc(Cl)c1 38651167 LTEWQQMDYBAPTM-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)COc4ccc(F)cc4)ccc32)cc1 38676905 KTLPGBKWXAXMNV-RUZDIDTESA-N 444.462 4.591 50 10 IJGE C[C@H](Oc1ccccc1F)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cccc(F)c1 38678103 QSWLJMBRMXYZRE-PSLXWICFSA-N 448.425 4.556 50 10 IJGE N#C/C(=C\c1ccccc1OCC(=O)Nc1nccs1)c1nc(-c2ccco2)cs1 39842870 VOOPSRDBTQXYAT-XNTDXEJSSA-N 434.502 4.941 50 10 IJGE Cc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)N4CCCc5ccccc54)c(C)c32)c1 40811377 NCUHBGIWPHUMHZ-SGWCAAJKSA-N 441.531 4.960 50 10 IJGE O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)c1cc2cc(Br)ccc2o1 59680421 MDCMKHXKFPCMCH-IFRROFPPSA-N 428.069 4.972 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@@]12CCC[C@H]1OCC2 687346520 TVPXXMXOYVUYFU-FVQBIDKESA-N 449.126 4.621 50 10 IJGE CN(C(=O)c1cc(Br)ccc1Br)C(C)(C)CCBr 688397784 LBBMDQYEPSCKFB-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NNc1cc(Cl)ccc1Cl 752810068 DYXMJTYBRQYXCU-UHFFFAOYSA-N 432.336 4.918 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc(F)c(F)cc2C(=O)c2ccccc2)c(C(F)(F)F)c1 799754063 CNWAKKBGXDVVBO-UHFFFAOYSA-N 445.347 4.843 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)OCc2nc(-c3ccco3)no2)c(C)n1-c1ccc(F)cc1 897336449 FNXDBOZQRSCZAG-GZTJUZNOSA-N 432.411 4.527 50 10 IJGE CC(=NNC(=O)CSc1nc2ccc([N+](=O)[O-])cc2s1)c1ccc2ccccc2c1 1083945418 VUBMUDIHMCZJFZ-UHFFFAOYSA-N 436.518 4.990 50 10 IJGE COCCn1c(C)cc(/C=C(\C#N)c2nnc(-c3ccc(Br)cc3)o2)c1C 1322140231 KXWLUNOICYGFDS-GZTJUZNOSA-N 427.302 4.628 50 10 IJGE Cc1cc(Br)cc(C)c1OCC(=O)NN=Cc1ccc(Cl)c(Cl)c1 1772753511 JDDFUJKRKCJOBE-UHFFFAOYSA-N 430.129 4.902 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2)[C@@H]1c1ccccc1[N+](=O)[O-] 1865710432 YBJIMFCWRWVFGM-JOCHJYFZSA-N 449.470 4.725 50 10 IJGE O=C(Nc1cccc(Nc2ncnc3ccc(Br)cc23)c1)C(Cl)Cl 1865988763 XRRFLWXGXQJBCI-UHFFFAOYSA-N 426.101 4.878 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CC[C@@]12CCCN(C(=O)OC(C)(C)C)C2 1882689740 FIIMAYPOMNZIEW-BXTJHSDWSA-N 447.414 4.702 50 10 IJGE Cc1ccc(S(=O)(=O)N(Cc2ccccc2)C[C@H](C)Br)c2cccnc12 1914640017 WQEIZGFXDCXUMW-INIZCTEOSA-N 433.371 4.518 50 10 IJGE CN(Cc1c(Br)cccc1Br)[C@H]1CCC[C@H]1Br 1945324156 WIEPYOBDPDZSLA-OLZOCXBDSA-N 425.990 4.959 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1cscc1Br 2006103106 QZQCQGIHJNXGCX-SECBINFHSA-N 430.149 4.624 50 10 IJGE C[C@@]1(NC(=O)c2cc(Br)c(Br)s2)CCC[C@H]1Br 2011556960 VMVAAXMPVNLRNL-LDYMZIIASA-N 446.002 4.709 50 10 IJGE CC(C)[C@@](C)(CBr)NC(=O)c1cccc(Br)c1Br 2031476660 DRNROVDBTSVXCL-CYBMUJFWSA-N 441.989 4.751 50 10 IJGE CCCOCCCO[C@@H](CI)c1cccc(Br)c1 2031753728 BZWLIIABXCUKKP-AWEZNQCLSA-N 427.120 4.759 50 10 IJGE O=C(NC[C@H]1C[C@H](Cl)C12CCC2)c1cc(Br)sc1Br 2115598889 IOBFLUPCPMTHIG-APPZFPTMSA-N 427.589 4.801 50 10 IJGE O=C(c1cc(Cl)cc(Br)c1)N1CC[C@H](CBr)C(F)(F)C1 2146375719 QXWNKWISKXURNI-SECBINFHSA-N 431.502 4.595 50 10 IJGE CN(Cc1ccccc1)[C@]1(Cn2c(CCl)nc3cccc(Br)c32)CCOC1 2155116173 QWQNLHZGWKSLKR-NRFANRHFSA-N 448.792 4.829 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CCCN2C(=O)N1CCC(Br)CC1 2163052292 BXNKEVGUJFFAIH-UHFFFAOYSA-N 438.366 4.766 50 10 IJGE O=S(=O)(c1cc(Cl)cc(CCl)c1F)N1CCC[C@H](OCc2ccccc2)C1 2186391263 UFLBCKGWSKALAS-KRWDZBQOSA-N 432.344 4.588 50 10 IJGE O=C(c1ccc(I)c(Cl)c1)N1CCC[C@H](CCCCl)C1 2234184407 VCVRHMXFJVROHO-NSHDSACASA-N 426.125 4.816 50 10 IJGE Cc1nscc1C[C@@H](Br)c1cc(I)ccc1F 2246959902 PZETZISTJIEXAB-LLVKDONJSA-N 426.092 4.874 50 10 IJGE COC[C@]1(C)C[C@@]1(CBr)Cc1ccc(I)c(Cl)c1 2257085895 QJTQMUITIUZRFV-UONOGXRCSA-N 443.550 4.925 50 10 IJGE CC1CC(CBr)(CN(C)[C@H](CNC(=O)OC(C)(C)C)c2ccccc2)C1 2265304228 MNXRBKVLMYJZPB-NCYVPVAZSA-N 425.411 4.995 50 10 IJGE CC1CC(CBr)(CN2CCCC[C@@H]2C(F)(F)CNC(=O)OC(C)(C)C)C1 2265313082 CMCKFWZKTNNSHW-SWKXRBFHSA-N 439.385 4.812 50 10 IJGE COc1cc(F)c(CBr)c(N2CCN(Cc3ccccc3)C3(CCC3)C2)c1 2283544472 VEQZHDFUUAROHF-UHFFFAOYSA-N 433.365 4.974 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H]1CBr)c1cc(Br)c(F)cc1Cl 2285957444 HPFOJUBSVQNWCA-BDAKNGLRSA-N 427.539 4.783 50 10 IJGE CS(=O)(=O)c1cscc1C[C@H](CBr)c1cccc(Br)c1 2288494069 BGEUKUCDRVKIKK-LLVKDONJSA-N 438.206 4.635 50 10 IJGE COC[C@@]1([C@H](Br)c2cc(Cl)cc(Br)c2OC)CCCO1 2295360603 SBIIRXMUILLILN-ZIAGYGMSSA-N 428.548 4.743 50 10 IJGE CC1([C@@H](CBr)NCc2ccc(Cl)cc2I)CC1 2302335362 DFYOZCHFISSSIZ-GFCCVEGCSA-N 428.539 4.598 50 10 IJGE CN(C[C@@H](Br)CCc1ccc(Cl)c(I)c1)C1CC1 2315549075 NZARUAPSZPKMDX-NSHDSACASA-N 442.566 4.735 50 10 IJGE C[C@@](CI)(OC[C@H]1C[C@@H](F)C1)c1ccccc1Br 2327340111 FMUMOMSVGCVQMP-WDMOLILDSA-N 427.095 4.864 50 10 IJGE CC1(C)CN(Cc2cc(I)ccc2Cl)C[C@H]1CBr 2327392153 NWPPTFLCESHEDH-LLVKDONJSA-N 442.566 4.798 50 10 IJGE C[C@H]1CC[C@@H](CBr)CN1Cc1cc(I)ccc1Cl 2327402298 GQUHSIKFDYTHJW-QWRGUYRKSA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(O[C@H]2CCOc3ccc(F)cc32)C1 2364439038 VYDLKFGZDIYUOK-FXAWDEMLSA-N 444.341 4.831 50 10 IJGE CC(C)(C)[C@](C)(CBr)CN1CCN(C(=O)C(F)(F)F)C2(CCCCC2)C1 2380162971 BTFGVWOKKFVFEI-QGZVFWFLSA-N 441.376 4.843 50 10 IJGE Cc1cc([N+](=O)[O-])ccc1NC(=O)/C(C#N)=C\c1ccc(-c2ccc([N+](=O)[O-])cc2C)o1 33929992 ADBKLJBWMSFYEU-PTNGSMBKSA-N 432.392 4.926 50 10 IJGE Cc1c(C(=O)NCc2ccccc2Cl)oc2c1/C(=N/NC(=O)c1ccccc1)CCC2 40803961 WKODKIVOALPQPH-ZXVVBBHZSA-N 435.911 4.642 50 10 IJGE N#Cc1ccc(C(=O)N/N=C/c2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)cc1 59464254 FXRBMGAUBFKMHE-JFLMPSFJSA-N 425.879 4.828 50 10 IJGE O=C(N/N=C1/CC(=O)c2ccccc21)c1ccc(CSc2nc3ccccc3o2)cc1 103458463 GPDHLJYHZQAGNV-QOMWVZHYSA-N 427.485 4.841 50 10 IJGE O=C(/C=C\c1ccco1)NNC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 210189256 MTDPYKGNTULTFV-QXMHVHEDSA-N 435.530 4.656 50 10 IJGE CCO[C@H]1[C@@H](Oc2c(I)cc(Cl)c3cccnc23)C[C@H]1Cl 229349489 SWSYEWXVAGUEPK-SCDSUCTJSA-N 438.092 4.656 50 10 IJGE CCC(=NNC(=O)[C@]1(C)CC1(Br)Br)C12CC3CC(CC(C3)C1)C2 252627375 RSYPGRYDAVPQDX-JPVQUXCTSA-N 446.227 4.981 50 10 IJGE CC(=O)Nc1ccc(C(C)=NNC(=O)c2cc(-c3ccccc3O)nc3ccccc23)cc1 254815560 WUYKRZHTVWBSEJ-UHFFFAOYSA-N 438.487 4.720 50 10 IJGE O=C(COc1ccc(Cl)cc1Br)NN=Cc1ccc(Cl)cc1Cl 254845884 TVRMULZMNNDEEJ-UHFFFAOYSA-N 436.520 4.938 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NC(=O)c1ccc(I)c(Cl)c1 716942141 XHHKFUBLMSHSKH-SCZZXKLOSA-N 444.538 4.627 50 10 IJGE C=CCCc1ccccc1NC(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1 1466315526 LAUHAEOQAAOGFN-UHFFFAOYSA-N 445.519 4.616 50 10 IJGE C=C1CCC(CNC(=O)NNC(=O)c2ccc(COc3ccc(Cl)c(C)c3)cc2)CC1 1565321000 QWLUHLKSKHFUKY-UHFFFAOYSA-N 441.959 4.918 50 10 IJGE CCN1C(=O)C(=NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)c2cc(C)ccc21 1772720359 LOHBWZHRTNKSSJ-UHFFFAOYSA-N 434.499 4.711 50 10 IJGE COc1cccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4cc(C)cc(C)c4)c(C)c32)c1 1772749017 GIMHWQXSUCTYKA-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE COc1cc(CNCC(=O)Nc2ccc(SC#N)cc2)ccc1OCc1ccccc1 1860719560 CSMGCDMACHURRB-UHFFFAOYSA-N 433.533 4.576 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)c1ccc(Br)cc1 1865755002 ASRRSSSWUVWYDV-UHFFFAOYSA-N 444.716 4.548 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)c1cc(F)ccc1F 1865759159 LIOQRVAMDZENGK-UHFFFAOYSA-N 436.245 4.717 50 10 IJGE CC[C@H](NC(=O)[C@@H](c1ccc(Cl)cc1)C1CC1)C(=O)Nc1ccc(SC#N)cc1 1866999947 CPZOWEGYRHKHDV-VQTJNVASSA-N 427.957 4.940 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CN(C(=O)OC(C)(C)C)[C@H]2CCCC[C@@H]12 1882180526 OCJSJBOXUOBWQA-JJXSEGSLSA-N 447.414 4.700 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C 1890792167 SHZRTEQOQQLTKB-SOUVJXGZSA-N 435.403 4.748 50 10 IJGE FC1(F)CN(Cc2ccccc2)CCN(c2nc(Cl)c(CBr)s2)C1 1949567401 PRLZVQWIWTYWMI-UHFFFAOYSA-N 436.753 4.649 50 10 IJGE CCN(C)C[C@H](Br)CCc1cc(Cl)ccc1I 1949934641 ICHVISAMMVLIMJ-LLVKDONJSA-N 430.555 4.592 50 10 IJGE BrC[C@]1(Cc2cccc(Br)c2Br)C[C@@]12CCOC2 2039026142 WWJDGJILUFSALN-KGLIPLIRSA-N 438.985 4.946 50 10 IJGE CCCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C[C@@H](Br)C(F)(F)F 2044700373 QAXHQFDYNUHLPX-ZIAGYGMSSA-N 431.337 4.814 50 10 IJGE CCN(CC)[C@H](C)CO[C@H](CI)c1cccc(Br)c1 2119217493 HMQCRVBYPXOTPV-IUODEOHRSA-N 440.163 4.672 50 10 IJGE Cc1cc(C(=O)NCCCC(C)(C)CBr)ccc1I 2142112864 JQGXOCRDFIKEFB-UHFFFAOYSA-N 438.147 4.531 50 10 IJGE O=C(c1ccc(Cl)cc1Br)N1CCC([C@H](F)CBr)CC1 2163246437 QDMFTUNPDJCPKR-CYBMUJFWSA-N 427.539 4.688 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1ccc2c(c1)CCCN2C(=O)OC(C)(C)C 2196907275 PDLAVJXHUAFBPY-UHFFFAOYSA-N 437.378 4.620 50 10 IJGE CC(C)(C)OC(=O)NCCc1cccc(NC(=O)c2ccc(CBr)cc2)c1 2204095030 LSBFMUIRVJAMAW-UHFFFAOYSA-N 433.346 4.901 50 10 IJGE BrC[C@]12CCCC[C@H]1N(C[C@@H]1CC1(Br)Br)CCC2 2218007186 QZQUBPIDIXSMNO-YNEHKIRRSA-N 444.049 4.912 50 10 IJGE CN(c1ncc(C(F)(F)F)cc1Br)[C@@H](CCBr)C(F)F 2240947399 XFDQCKQFTAPEFB-QMMMGPOBSA-N 426.021 4.718 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)c2ccccc2N1CCCCI 2243588753 GKFOXYDESQWGDJ-CQSZACIVSA-N 430.330 4.852 50 10 IJGE C[C@H](CCCCCBr)NC(=O)c1c(F)cccc1I 2267671780 XYBDUWNITHIBLQ-SNVBAGLBSA-N 442.110 4.504 50 10 IJGE COc1cccc([C@@H](Br)c2ccc(OC)c(I)c2)c1 2269552161 LMPRSQGLJMWOMA-OAHLLOKOSA-N 433.083 4.793 50 10 IJGE O=C1Cc2cc([C@H](Br)c3cocc3Br)c(Br)cc2N1 2270464179 NKMRHTFUQYDODK-ZDUSSCGKSA-N 449.924 4.784 50 10 IJGE Cn1ncc(COc2c(Cl)cc(CBr)cc2Cl)c1Br 2278797548 UXRPLEDOIIBQDI-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE O=C(NC[C@@H]1CCC[C@H]1CBr)c1cc(F)c(Br)cc1Cl 2282969517 DCSFZMSJSHZIIH-IUCAKERBSA-N 427.539 4.783 50 10 IJGE CS(=O)(=O)c1cscc1C[C@@H](CBr)c1ccc(Br)cc1 2288495326 RTWLNTYGPZTTPR-NSHDSACASA-N 438.206 4.635 50 10 IJGE CC[C@@H](C)N(CCBr)Cc1ccc(Cl)c(I)c1 2300237542 AGUNFKWKOKZWPM-SNVBAGLBSA-N 430.555 4.940 50 10 IJGE CCOc1cccc(-c2nn(-c3ccccc3)cc2C=C(C#N)C(=O)NCc2cccnc2)c1 2314522339 FFTDYHHBVXAKSZ-UHFFFAOYSA-N 449.514 4.556 50 10 IJGE COC(=O)C(C#N)=Cc1ccc(OC(=O)CCCOc2ccc(C(C)C)cc2)c(OC)c1 2314773852 GBCDXGJEFPIKNO-UHFFFAOYSA-N 437.492 4.663 50 10 IJGE CCCOc1ccccc1C=C(C#N)C(=O)Nc1ccc(I)cc1C 2314774100 SPZRFRBHYNFEBE-UHFFFAOYSA-N 446.288 4.934 50 10 IJGE CCOc1ccc(CCNC=C(C#N)C(=O)Nc2c(CC)cccc2CC)cc1OCC 2325126731 SZTMYRGIJPAVOD-UHFFFAOYSA-N 435.568 4.787 50 10 IJGE C[C@H](NC=C(C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C12CC3CC(CC(C3)C1)C2 2325254920 DZEUOLRPNLNNKE-QRYOHXEKSA-N 428.920 4.789 50 10 IJGE COc1cc(C=C(C#N)c2nc3ccc(C)cc3[nH]2)ccc1OCC(=O)Nc1ccccc1 2331018105 TXUZCDIBLDUXDQ-UHFFFAOYSA-N 438.487 4.962 50 10 IJGE COc1ccc(C)cc1-c1csc(C(C#N)=C(O)CCc2nc3ccccc3[nH]c2=O)n1 2331324281 DSDOPLQOFYOXKU-UHFFFAOYSA-N 444.516 4.789 50 10 IJGE CC1CC(CBr)(CN2C[C@@H]3CCC[C@@](CNC(=O)OC(C)(C)C)(C3)C2)C1 2334034582 CVLJUEVIHZGDMS-VVMSIFSJSA-N 429.443 4.815 50 10 IJGE FC(F)(CI)C(F)(F)CNCc1cccc(Cl)c1Cl 2336530991 CKAKDGBFFKADAJ-UHFFFAOYSA-N 430.010 4.789 50 10 IJGE Cc1sc(Br)cc1C(=O)N1CC[C@@H](Br)C[C@@H]1C(F)(F)F 2361459040 QEVPMJPTPYATMC-VXNVDRBHSA-N 435.103 4.749 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)CCc1cc(Cl)cc(Cl)c1 2366852336 BCOBULSKXWGGKJ-YGRLFVJLSA-N 428.141 4.892 50 10 IJGE CC1(C)CC(CBr)(CN2CCOCC23CCN(Cc2ccccc2)CC3)C1 2371133540 OIEQNLKJVXXOAI-UHFFFAOYSA-N 435.450 4.555 50 10 IJGE CCc1ccc(O[C@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccs2)cc1 38656605 DKBYOKLZGYEOAF-IQMFZBJNSA-N 446.528 4.902 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@H]2C)oc2c1/C(=N/NC(=O)c1ccccc1F)CCC2 40812369 QYKIAARNTFHUIW-WVZIWNLSSA-N 445.494 4.789 50 10 IJGE Cc1ccc(-c2ccc(/C=C(/C#N)C(=O)Nc3sc4c(c3C(N)=O)CCCC4)o2)cc1 108208982 BZGNCWGNPMVZNK-VBKFSLOCSA-N 431.517 4.840 50 10 IJGE COc1ccc(Cc2nc3cc(C(=O)N/N=C\c4ccc(Cl)cc4)ccc3[nH]2)cc1OC 169925466 BUZCFDGUSABCTA-WGARJPEWSA-N 448.910 4.588 50 10 IJGE CC(=NNC(=O)c1ccc(C)c([N+](=O)[O-])c1)c1cccc(NC(=O)c2ccccc2C)c1 252631779 VMGGLEUHJROCMB-UHFFFAOYSA-N 430.464 4.618 50 10 IJGE CCOC(=O)c1c(NC(=O)NN=Cc2ccc(Cl)cc2Cl)sc(C(C)=O)c1C 256018622 VVHCSGQOHCVNIE-UHFFFAOYSA-N 442.324 4.898 50 10 IJGE CN([C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(Cl)c(CCl)c1Cl 381109947 DSGNAVWJDLOLIS-OAHLLOKOSA-N 447.815 4.627 50 10 IJGE C[C@@H](CCCBr)CNC(=O)c1cc(Br)cc(Br)c1 384400739 ULLKSCZIOFOTCG-VIFPVBQESA-N 441.989 4.753 50 10 IJGE CC1(C)[C@H](Br)CCN1Cc1cc(Cl)ccc1I 405326983 CWPTVUXEISFARE-GFCCVEGCSA-N 428.539 4.692 50 10 IJGE FC(F)c1ccc(Br)c(CBr)c1I 575685157 JMMKQPDUTQVDAO-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE Fc1ccc2nc(CCl)n(C3[C@@H]4CN(Cc5ccccc5)C[C@@H]34)c2c1Br 689722713 GSLZTNWWMPACJL-ZIAGYGMSSA-N 434.740 4.980 50 10 IJGE Cc1csc(=O)n1CCC(CBr)(CBr)C1CCCCC1 700199169 ISOWZYDATRJKHI-UHFFFAOYSA-N 425.230 4.965 50 10 IJGE COc1ccc(OC[C@H](CBr)C(C)(C)C)cc1I 712906106 SHRDAJDGSQQJSC-JTQLQIEISA-N 427.120 4.736 50 10 IJGE COc1ccc(-c2ccc(C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)c(F)c2)cc1 736693962 UHPOTHXZWDEXEU-UHFFFAOYSA-N 443.482 4.727 50 10 IJGE Cc1cccc(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)c1O 759721647 AJGMLGGBNVPVOS-ATVHPVEESA-N 431.883 4.677 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)c2ccc(C(F)(F)F)cc2)c1C 791191747 WVVNOKHADKRHBZ-RPJLVFAOSA-N 448.441 4.664 50 10 IJGE COc1cc(/C=C(\C#N)C(=O)Nc2ccccc2C)ccc1OCc1cccc(C(=O)O)c1 1083931018 SWPMJCDQUQMDOX-CIAFOILYSA-N 442.471 4.827 50 10 IJGE Cc1cccc(C)c1-n1c(C)cc(C=NNC(=O)C(=O)Nc2cccc3ccccc23)c1C 1084426443 HOWGFOBVTQLOKZ-UHFFFAOYSA-N 438.531 4.953 50 10 IJGE Cc1nn(-c2ccccc2)c(Cl)c1C=NNC(=O)CSCc1ccc(Cl)cc1 1084563843 KYFNQDUFHZQSMU-UHFFFAOYSA-N 433.364 4.871 50 10 IJGE C#C[C@H](NC(=O)NNc1c(Cl)cc(Br)cc1Cl)c1ccc(F)cc1 1252431062 CSPXVIOLQCLLFG-AWEZNQCLSA-N 431.092 4.896 50 10 IJGE O=C(NNc1cncc(Br)c1)c1csc(-c2cccc3ccccc23)n1 1337364737 FTTIBLVBSYWFCD-UHFFFAOYSA-N 425.311 4.878 50 10 IJGE C=CCC1(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(OCC)cc3)c2C)CCOCC1 1531779334 PSKTUBSRCXXSMC-OQKWZONESA-N 433.552 4.641 50 10 IJGE C#CCCCC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1Cl)CC2 1597394076 MFHORSWVKLMSQA-FBMGVBCBSA-N 443.934 4.940 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)COc1ccc(C)c(C)c1)c1ccc(C(F)(F)F)cc1 1670827372 WOYLNENPZQVWLZ-HXUWFJFHSA-N 449.473 4.739 50 10 IJGE Cc1nn(Cc2ccc(F)cc2)c2c1[C@@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 1865685369 IMDZWFGMHWUMCH-IBGZPJMESA-N 429.282 4.904 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)ccc1OC 1865760729 MBLHGFWTNIYBPY-ZMFRSBBQSA-N 425.435 4.506 50 10 IJGE N#CSc1ccc(NC(=O)[C@H](NC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)c2ccccc2)cc1 1866938411 DIWGOVQLKUPEAH-XPWALMASSA-N 445.519 4.999 50 10 IJGE CC(C)[C@@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1ccccc1Br 1915276771 UEXOZTSAPBMDFS-QGZVFWFLSA-N 430.795 4.903 50 10 IJGE CCN(C[C@](C)(CI)O[C@H]1CC[C@H]2C[C@@H]1C2)C(=O)OC(C)(C)C 1992237253 GECLQWOQRQVTTH-KRXQYRFLSA-N 437.362 4.642 50 10 IJGE CC1(C)[C@@H](Cl)C[C@H]1CNc1ncc(I)cc1Br 2015765355 NOMZLCNKCMRMQT-XVKPBYJWSA-N 429.527 4.514 50 10 IJGE C[C@@H]1CC[C@@H](Br)CN1Cc1ccc(I)c(Cl)c1 2026563697 MLDSDCHBBGGVBX-MWLCHTKSSA-N 428.539 4.692 50 10 IJGE CCC[C@](C)(CBr)NC(=O)c1ccc(I)c(Cl)c1 2029945679 QERXBOFZDVDEKK-CYBMUJFWSA-N 444.538 4.628 50 10 IJGE C[C@@H](NC(=O)c1cccc(Br)c1Br)C1(CBr)CC1 2031479184 VTUGVCVBINPCNT-MRVPVSSYSA-N 439.973 4.505 50 10 IJGE CC(C)(C)OC(=O)NCCCN(C[C@H](CBr)C(C)(C)C)CC(F)(F)F 2044704641 FEHVJBXMSLYMSB-ZDUSSCGKSA-N 433.353 4.823 50 10 IJGE Brc1cccc(CN2C[C@H](Br)C3(CCC3)C2)c1Br 2046462454 PDVGDEQXYUKKLY-LBPRGKRZSA-N 438.001 4.961 50 10 IJGE Brc1cnc(N2C[C@@H]3CCC[C@H](C2)C3Br)c(Br)c1 2048827305 REEYNTLXIXPFHP-USUYBEQLSA-N 438.989 4.606 50 10 IJGE O=C(CBr)c1c(Br)ccc(OC(F)(F)F)c1C(F)(F)F 2054797361 RUONDSBQBRZSAY-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE COC[C@H](C)CCO[C@H](CI)c1ccccc1Br 2067238220 WELKQEHMGVWYPL-BXUZGUMPSA-N 427.120 4.614 50 10 IJGE CCCC(CBr)(CCC)CN1CCCO[C@H](CNC(=O)OC(C)(C)C)C1 2106784428 INRNISJWKLCCRD-QGZVFWFLSA-N 435.447 4.584 50 10 IJGE COC[C@H](C)CCO[C@](C)(CI)c1ccccc1Br 2130878669 FEYWDMFKEBUOMO-IUODEOHRSA-N 441.147 4.789 50 10 IJGE CC1(C)CCN(C(=O)c2cc(Cl)ccc2I)C[C@@H]1CCl 2148665958 LFZCPJNBJVJBAI-JTQLQIEISA-N 426.125 4.672 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)[C@@H](Br)C2CCCC2)CC12CCC2 2176868240 JYILDGBPOCOWTF-WBVHZDCISA-N 443.426 4.626 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2ccc(CBr)c([N+](=O)[O-])c2)C1 2188576897 KEMYSLQNMPUKEY-DLBZAZTESA-N 432.362 4.837 50 10 IJGE O=C(NC[C@@]1(CBr)C[C@H]1C(F)(F)F)c1ccc(OCc2ccccc2)cc1 2192580058 LIZRPOWLFMYTIB-MJGOQNOKSA-N 442.275 4.959 50 10 IJGE Cc1cccc(C(=O)N2[C@H](CBr)CCC23CCC3)c1I 2205774294 YUOLAXQSZYMNSH-LBPRGKRZSA-N 448.142 4.522 50 10 IJGE C[C@@H](CC1CCN(CCCCCI)CC1)NC(=O)OC(C)(C)C 2211186069 NJDMUUQVELAKJK-HNNXBMFYSA-N 438.394 4.607 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CCCCCCBr)CC[C@@H]1C(F)(F)F 2223283275 QYCWJXVVZVSYED-UONOGXRCSA-N 431.337 4.719 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C)CCC[C@H]1[C@H](CBr)NC(=O)OC(C)(C)C 2241896367 GUUIGLGGKMWBBB-NJSLBKSFSA-N 435.403 4.606 50 10 IJGE COCCC1([C@@H](Br)c2ccc(OC)c(I)c2)CC1 2257352382 CUKHFSDDBOAGLA-ZDUSSCGKSA-N 425.104 4.553 50 10 IJGE O=S1(=O)CC[C@H]([C@@H](Cl)c2ccc(OCc3ccccc3)cc2Br)C1 2299501335 NIIVFQWCZAKTSR-KBXCAEBGSA-N 429.763 4.743 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)cc2I)CC[C@@H]1Br 2302315132 GAOJLZKCGDJRRA-SKDRFNHKSA-N 428.539 4.550 50 10 IJGE ClC[C@H]1CCCN(Cc2ccc(I)c(Br)c2)C1 2306216365 FJEQTSVQDSPVBW-LLVKDONJSA-N 428.539 4.505 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@@H](Cc2ccc(C)c(C)c2)C(=O)N1c1ccc(C)c(C)c1 2314592759 BDFNCEUHSILGCK-QHCPKHFHSA-N 445.588 4.649 50 10 IJGE COc1c(Br)cc(C)c([C@@H](N)C2CC(Br)C2)c1Br 2317427351 VGXSATWAFHCOBJ-TYAJBCFHSA-N 441.989 4.702 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@H](Br)[C@H]2CC3)c(I)c1 2318544783 BITYWEJIXFEVNQ-SGMGOOAPSA-N 440.550 4.835 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@]12C[C@@H](CBr)C2 2327401289 OVXZRGFMDGNOHX-YPFXGUDJSA-N 440.550 4.694 50 10 IJGE N#CC(=Cc1cccc(F)c1)C(=O)Nc1c(Br)cc(C#N)cc1Br 2329672348 ZMTKDQYACXSDKE-UHFFFAOYSA-N 449.077 4.768 50 10 IJGE CC(C)(CBr)CN1CC[C@H](CCNC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2337588284 WOUHHHWZYVYFGR-KBPBESRZSA-N 445.364 4.965 50 10 IJGE Clc1cc(Br)c(CN2CCO[C@@H]3C[C@@H](CBr)C[C@@H]32)s1 2345956437 AIUDXXPSNCVGLT-INTQDDNPSA-N 429.605 4.538 50 10 IJGE Cc1sc(C(=O)NCC(F)(F)C(F)(F)CBr)c(Br)c1C 2361674159 JBXSHOLUDYBENG-UHFFFAOYSA-N 441.082 4.523 50 10 IJGE CN(C[C@H]1CCN(Cc2ccccc2)C1)c1nc(C(F)(F)F)ccc1CBr 2369838564 SRZGJBGULMMRGL-MRXNPFEDSA-N 442.323 4.954 50 10 IJGE CC[C@@H](C)c1nc(N2CCN(C(=O)[C@@H](C)Cl)CC2)c2c3c(sc2n1)CCCCC3 35892442 CXMQCXPXPCXWFC-HUUCEWRRSA-N 435.037 4.750 50 10 IJGE COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(Cl)cc4)ccc32)cc1 38650278 VIVNJCZZMQWTGB-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE Cc1cc(C)cc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2F)c1 38652157 XGZMDTLRLIUZPI-RUZDIDTESA-N 444.462 4.645 50 10 IJGE CC1=C(C#N)C(=O)N([C@H](C)c2ccccc2)C(=O)/C1=C/Nc1ccc([N+](=O)[O-])cc1Cl 101234882 QUNNLHFPRGXGTO-CRRKTRLDSA-N 436.855 4.514 50 10 IJGE N#CC(C(=O)COC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)=C1Nc2ccccc2N1 104651550 UORRUQKHUWFKQS-ATVHPVEESA-N 445.475 4.813 50 10 IJGE COCCc1ccc([C@@H](Br)c2ccc(I)cc2)cc1 109845006 ILWOPISLHVJUOG-MRXNPFEDSA-N 431.111 4.964 50 10 IJGE CCCCOc1ccc(/C=C\C(=O)Oc2ccc(/C=C(/C#N)C(=O)OCC)cc2OC)cc1 206271389 BRECDANOPXUCHT-JPOGNWIISA-N 449.503 4.963 50 10 IJGE O=C(NC[C@@H]1CCC[C@@H]1Br)c1cc(Br)cc(Br)c1 232464124 HEUBIBGWOGJFFU-UFBFGSQYSA-N 439.973 4.505 50 10 IJGE CO[C@@H]1[C@H](Cl)C[C@H]1Oc1c(Br)cc(Br)cc1Br 252880861 ZNWVUAWDIOUXAI-FXPVBKGRSA-N 449.364 4.748 50 10 IJGE C[C@]1(CI)CC[C@](C)(c2ccc(I)cc2)O1 309350927 BSPLKVLJVCEUMH-CHWSQXEVSA-N 442.078 4.511 50 10 IJGE C[C@@H](CCCBr)CNC(=O)c1cc(Br)sc1Br 384710940 MDZCIOUDDGCIIM-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE ClCc1nc2cc(Br)cnc2n1CCCOCCOCc1ccccc1 390557842 RAHAVKLQVKDQMM-UHFFFAOYSA-N 438.753 4.556 50 10 IJGE CC(C)N(C[C@H](C)Br)C(=O)c1scc(Br)c1Br 705447004 DLNNIQDHYPXBOB-ZETCQYMHSA-N 448.018 4.907 50 10 IJGE C[C@@H](CCCCBr)NC(=O)c1scc(Br)c1Br 707838780 VUPYFMGQQZBGBI-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE Cc1ccc(-n2nc(C)c(CC(=O)NNc3nccc4sccc34)c2C)cc1Cl 734247974 BQHJEMKEBMOFHP-UHFFFAOYSA-N 425.945 4.746 50 10 IJGE CC(C)(C)CC(=O)NNC(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 757756803 YUTMPZWLRUFCEO-UHFFFAOYSA-N 427.892 4.664 50 10 IJGE Cc1cc2ccccc2nc1NNC(=O)c1cc(OCC(F)(F)F)c2ccccc2n1 777481923 YLFZTAWSEPDOJE-UHFFFAOYSA-N 426.398 4.789 50 10 IJGE CC(=O)CCc1ccc(O[C@@H](C)C(=O)NNc2nc3cc(Cl)ccc3cc2C)cc1 779042813 KCKFDCRUERPEAH-INIZCTEOSA-N 425.916 4.629 50 10 IJGE C#C[C@@H](NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1)c1ccc(Cl)cc1 794049737 DBNWIYCUWJMNOZ-HVQRGMKJSA-N 439.906 4.515 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2cc3cc(Br)ccc3o2)c(O)c1 1084239600 GEQWBYUQDKZDSH-UHFFFAOYSA-N 430.302 4.511 50 10 IJGE COc1cc2ccccc2cc1C(=O)NN=C1C(=O)N(Cc2ccccc2)c2ccccc21 1084395606 RVVWDWROQIBWLE-UHFFFAOYSA-N 435.483 4.529 50 10 IJGE Cc1ccc(COc2c(Cl)cc(/C=C(\C#N)C(=O)N(C)C)cc2Br)cc1 1084571669 MYZPTOGKJKDUOO-LZYBPNLTSA-N 433.733 4.985 50 10 IJGE C/C(=C/c1cccnc1)C(=O)NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1 1348508619 MEPMTLZKYPLWRW-SDXDJHTJSA-N 435.549 4.584 50 10 IJGE CC(=O)c1cc(C(=O)NNC(=O)c2ccc(COc3ccc(Cl)c(C)c3)cc2)cs1 1440605545 KWFBFTZTKCMSNZ-UHFFFAOYSA-N 442.924 4.566 50 10 IJGE CC(=O)c1ccc(Br)c(NC(=O)NNc2cccc(F)c2Br)c1 1674417744 DYWVJKWUUOPYBX-UHFFFAOYSA-N 445.086 4.702 50 10 IJGE O=C(Nc1ncccc1OCCCOc1ccccc1)Oc1ccc([N+](=O)[O-])cc1F 1858692252 CVOILAAYULBWHX-UHFFFAOYSA-N 427.388 4.588 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)CCCOc3c(C)cccc3C)c(C)n2)cc1 1865758741 OUVGKJLAMGECFL-UHFFFAOYSA-N 431.536 4.602 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)nc2C)ccc1O 1865762502 JUKTVVBQYKLDBY-MYKKPKGFSA-N 430.291 4.842 50 10 IJGE O=S(=O)(c1ccccc1C(F)(F)F)N(CCCBr)Cc1ccccc1 1914648065 ORWGXOJHFAXSNS-UHFFFAOYSA-N 436.293 4.681 50 10 IJGE CN(Cc1ccc(Br)cc1)C[C@H](Br)COCc1ccccc1 1916354070 HRJZBGJWEQHSPF-SFHVURJKSA-N 427.180 4.861 50 10 IJGE C[C@H](Br)C[C@@H](C)NC(=O)c1cccc(Br)c1Br 1943887235 NSVIRFYCTPNTPO-JGVFFNPUSA-N 427.962 4.503 50 10 IJGE CC(C)N1C[C@H](Br)[C@H](Cc2cc(Br)ccc2Br)C1 2054720269 WNEBCRSYEZVJIM-RISCZKNCSA-N 440.017 4.858 50 10 IJGE CC[C@@H]1[C@H](CBr)CCN1Cc1ccc(I)c(Cl)c1 2086658806 QMEAQPQJDJOYGH-SMDDNHRTSA-N 442.566 4.940 50 10 IJGE C[C@@H]1CN(Cc2ccccc2)C[C@H]1Cn1c(CCCl)nc2cncc(Br)c21 2151793942 TUUMCCUJGAMVNK-WBVHZDCISA-N 447.808 4.743 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCCN1C(=O)c1ccc(CBr)cc1 2162912257 SUKPSXQCMFBQIO-ROUUACIJSA-N 437.378 4.586 50 10 IJGE Cc1c(Cl)cc(C(=O)N2CCC[C@@](F)(CBr)C2)cc1Br 2167385114 MHDUOWZZYLWLGE-CQSZACIVSA-N 427.539 4.750 50 10 IJGE Fc1ccc(I)cc1[C@H](Br)c1ccc2c(c1)OCCO2 2169666994 CSVKTFSTSINHTJ-OAHLLOKOSA-N 449.057 4.686 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@@H]1C[C@@H](C(C)(C)C)CN(C(=O)OC(C)(C)C)C1 2196908352 XFGRECCYHAZLPH-QBPKDAKJSA-N 445.442 4.538 50 10 IJGE Fc1cc2c(cc1I)nc(CCCl)n2CC1CC(Cl)C1 2197098051 UQPVGNIRDLNEIL-UHFFFAOYSA-N 427.088 4.579 50 10 IJGE O=C(NC[C@@]12CCC[C@@H](CN1Cc1ccccc1)C2)c1ccc(CBr)cc1 2200733827 PEYIWKPPQKQTSQ-OFNKIYASSA-N 427.386 4.756 50 10 IJGE CCN(CCCCCI)C[C@H]1CCCCN1C(=O)OC(C)(C)C 2211186928 RAMOSQGGGNURQU-MRXNPFEDSA-N 438.394 4.703 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 2224711557 XNQQAOFOCRIJIH-QVDMIQRCSA-N 434.740 4.980 50 10 IJGE Fc1cc(F)c2nc(CCCl)n(C[C@H]3CC3(Br)Br)c2c1 2233040186 ODIBRTWNMNLRJZ-SSDOTTSWSA-N 428.502 4.602 50 10 IJGE COc1ccc([C@@H](Br)[C@H]2CC[C@H]3C[C@H]2CO3)cc1I 2269556045 LAECCBRCWYEDSK-JUFZMCDQSA-N 437.115 4.551 50 10 IJGE COC[C@H]1C[C@H](CNC(=O)OC(C)(C)C)N(CCCCCCCCCBr)C1 2289509263 UEPQSYZHJQZMHA-RBUKOAKNSA-N 449.474 4.974 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@@H]2C[C@@H]3CBr)cc1I 2315558408 VUNRNOLKIMUXHB-GYSYKLTISA-N 440.550 4.692 50 10 IJGE COc1ccc(-c2ccc(C(=O)NN=Cc3cccc4ccccc34)c(C)n2)cc1OC 2321248484 AUYZCQNDIYKVMR-UHFFFAOYSA-N 425.488 4.991 50 10 IJGE CC(C)[C@H]1C[C@@H](Br)CN1Cc1ccc(Cl)cc1I 2321366863 ZNFBRLWPYLYYLL-BXUZGUMPSA-N 442.566 4.938 50 10 IJGE CC(C)[C@H]1C[C@H](Br)CN1Cc1ccc(Cl)c(I)c1 2321369930 WMSGEMOHJRVVRG-SMDDNHRTSA-N 442.566 4.938 50 10 IJGE CCOC(=O)c1c(NC(=O)C(C#N)=Cc2ccccc2)sc(C(=O)OCC(C)C)c1C 2325311261 QOAGYJOGNHNXBQ-UHFFFAOYSA-N 440.521 4.592 50 10 IJGE Cc1cccc(CO[C@H](CI)c2ccc(Br)cc2)n1 2341708754 DYIHNTFKSYYLGB-OAHLLOKOSA-N 432.099 4.845 50 10 IJGE O=C(N[C@H](CCBr)COCc1ccccc1)C1CCC(C(F)(F)F)CC1 2343418656 QCHGIQPNSRVSRU-OFLPRAFFSA-N 436.312 4.842 50 10 IJGE FC1(F)C[C@]12C[C@H]2CO[C@H](CI)c1ccccc1Br 2352505658 BOWCPUHVJBNJGG-BIMULSAOSA-N 443.069 4.987 50 10 IJGE FC(F)(F)[C@H]1C[C@@H](Br)CCN1Cc1ncc(Br)cc1Cl 2361429924 QROKXFAMQNEEIW-WRWORJQWSA-N 436.497 4.788 50 10 IJGE CC1(C)CC(CCl)(CNC(=O)c2ccc(Cl)cc2I)C1 2365596344 UILKVPJQJLONKG-UHFFFAOYSA-N 426.125 4.720 50 10 IJGE CCCn1c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N[C@H](C)c2cc3ccccc3o2)c1C 24001708 BWTXOSHWYVTJEP-DJWFYOSISA-N 447.535 4.977 50 10 IJGE CCOc1ccccc1C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(OC)cc1 38650404 IGLZYDBUNJEFST-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE Cc1ccc(-c2ccc(/C=N/NC(=O)COc3cccc4ccccc34)o2)cc1C(=O)O 59104697 XDIBDXOGWCFTNV-VULFUBBASA-N 428.444 4.636 50 10 IJGE C/C(=N/NC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1ccc(-n2ccnc2)cc1 89262625 VEICPMHOEAAXRG-YKQZZPSBSA-N 432.487 4.637 50 10 IJGE CC(=C(C#N)C#N)c1ccc2cc(N(C)CCOS(=O)(=O)c3ccc(C)cc3)ccc2c1 145969441 RIFDQCDPALCGDH-UHFFFAOYSA-N 445.544 4.811 50 10 IJGE C[C@](CI)(OC[C@@H]1CCCCO1)c1ccccc1Br 161960789 SMNUBASHXIIXIA-SWLSCSKDSA-N 439.131 4.685 50 10 IJGE CCCCOc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4O)nc3c2)cc1 169926429 GWAIXGGNULAPRJ-WGOQTCKBSA-N 428.492 4.878 50 10 IJGE O=C(NC[C@@H]1CC[C@H](Br)C1)c1ccc(Br)cc1Br 227668686 YWVLFVJEOJTQBV-BDAKNGLRSA-N 439.973 4.505 50 10 IJGE BrCc1cc(Br)c(OC[C@@H]2CCCO2)c(Br)c1 232484680 XLLHMPLSQRYOIK-VIFPVBQESA-N 428.946 4.664 50 10 IJGE CN([C@@H]1CCCC[C@H]1Cl)S(=O)(=O)c1c(Cl)cc(Br)cc1Cl 252935026 WWBVDWNYBQLRGV-BXKDBHETSA-N 435.598 4.926 50 10 IJGE C[C@]1(CBr)CCN(C(=O)c2cc(Br)sc2Br)C1 381348541 HJKZMGAMURPISR-LLVKDONJSA-N 446.002 4.520 50 10 IJGE Cc1cccc(C(=O)NCC(C)(C)C[C@H](C)Br)c1I 393558996 WAIWHDTWMQKXNC-NSHDSACASA-N 438.147 4.529 50 10 IJGE COC(=O)[C@@]1(C2CC2)C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 688654897 SKCMDIFLVOEBIE-XXBNENTESA-N 433.621 4.741 50 10 IJGE C[C@@]12CN(Cc3ccccc3)C[C@@]1(C)CN(C(=O)c1ccc(CBr)cc1)C2 705910321 VABRPSVNCSREAI-GOTSBHOMSA-N 427.386 4.566 50 10 IJGE CC(C)(C)S(=O)(=O)CCOc1c(Br)cc(Cl)cc1CBr 708110524 CYOXCQUZUSZRNV-UHFFFAOYSA-N 448.604 4.590 50 10 IJGE CN(Cc1ccccc1)[C@H](Cn1c(CCl)nc2cc(Br)cnc21)C1CC1 717978859 KARFINYCZGQDPO-GOSISDBHSA-N 433.781 4.843 50 10 IJGE C#CCNC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1cc(C)n(C2CCCCC2)c1C 1125560958 WYOIWDCXJCUJBI-PGMHBOJBSA-N 428.536 4.519 50 10 IJGE CC(=O)c1cc(F)c(O)c(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccccc3C)c2C)c1 1178428624 IELWTGSHZKCZSV-KEBDBYFISA-N 431.467 4.996 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNc2ccccc2Cc2ccccc2)c(O)n1 1300356844 WYIUVGUQJXLFHN-UHFFFAOYSA-N 425.488 4.811 50 10 IJGE COc1ccccc1Nc1ccc(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)cc1 1558936468 HMRFMDABPSHILF-UHFFFAOYSA-N 440.507 4.665 50 10 IJGE Cc1sc2nc(CCC(=O)N3CC[C@@H](O[Si](C)(C)C(C)(C)C)C3)nc(O)c2c1C 1642394910 OIAPJSCNEZBCSZ-OAHLLOKOSA-N 435.666 4.569 50 10 IJGE COc1cccc(C(=O)NN=C2CCCc3oc(C(=O)Oc4ccc(C)cc4)c(C)c32)c1 1772746983 JNPXVFKRCHAFRD-UHFFFAOYSA-N 432.476 4.595 50 10 IJGE CCN(CC)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(Cl)cc2)cc1 1865702552 WSGTYGKHFRJPOS-HSZRJFAPSA-N 447.970 4.958 50 10 IJGE COc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccc(Cl)cc2)c1 1865712019 NSTBLFFRHIDZEH-MRXNPFEDSA-N 446.816 4.771 50 10 IJGE COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3-c2ccc(Cl)cc2)cc1 1865712974 NHPXWIGHIYGKNH-INIZCTEOSA-N 446.816 4.771 50 10 IJGE CCOc1cccc(C(=O)NNC(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)nc2C)c1 1865759310 TVCQOSPTZQCGGX-UHFFFAOYSA-N 444.318 4.837 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCN(Cc2ccccc2)CC1(C)C 1880767445 PLDOIBADXOSTDM-QZTJIDSGSA-N 425.411 4.823 50 10 IJGE N#C[C@@H]1CN(c2ccc(CBr)c(C(F)(F)F)c2)CCN1Cc1ccccc1 1914891519 MYPZHXBCFNLRAY-GOSISDBHSA-N 438.291 4.815 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1 1916346740 DOEZHSKLDYUHRI-BBWFWOEESA-N 436.312 4.794 50 10 IJGE C[C@H](Br)CN(Cc1c(Br)cccc1Br)C1CC1 1945324447 XSZJESRCDIFVBV-VIFPVBQESA-N 425.990 4.959 50 10 IJGE C[C@@H]1CCN(Cc2cc(Br)ccc2Br)[C@H]1CBr 2006503725 RIPDXVPBYZYYKJ-RNCFNFMXSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@@H]2CC23CCCC3)CC1 2021267634 QSSANCJTXNSTRL-HNNXBMFYSA-N 449.373 4.788 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@@H]2OCCO[C@@H]2C)cc1Br 2027178981 UNDZQPAUBORDOP-OXHMUOHRSA-N 442.973 4.760 50 10 IJGE Brc1ccc(C[C@@H]2CN(C3CC3)C[C@H]2Br)c(Br)c1 2039252814 ZJIXQQHZXDATEV-QMTHXVAHSA-N 438.001 4.612 50 10 IJGE CC(C)[C@H](Br)[C@H](C)NC(=O)c1c(Br)cccc1Br 2041305137 VXDKTOJJHCAOCM-UFBFGSQYSA-N 441.989 4.749 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc([S@](C)(=O)=NC[C@@H](CBr)C2CC2)c1 2044693320 JXCRYNNXZYSUHF-PWECECGKSA-N 431.396 4.911 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N(CCBr)CC(F)(F)F 2052449926 JAVVWQILIVHVEG-UHFFFAOYSA-N 429.483 4.563 50 10 IJGE C[C@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@@H](C)[C@@H]1Br 2086659257 UXIASDDYVGAVCR-MSRIBSCDSA-N 442.566 4.796 50 10 IJGE ClCc1cc(Br)ccc1N1CC[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 2129050227 CNXLZRPFSQRPPM-SFTDATJTSA-N 435.793 4.668 50 10 IJGE Cc1c(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)ccnc1CBr 2140705967 FBFFXBXWVLFCON-GOSISDBHSA-N 428.296 4.538 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCCCC2)c2cncnc21 2163059950 XVWLSGIIYQILNH-UHFFFAOYSA-N 439.398 4.774 50 10 IJGE C[C@@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)N1CCC[C@H](CCCl)C1 2166885550 BKCKVGMKMHKVAY-PKOBYXMFSA-N 427.035 4.897 50 10 IJGE Brc1ccc([C@@H](CI)O[C@H]2C[C@@H](n3cccn3)C2)cc1 2183684824 JCPWYXUSTDHFDR-QLFBSQMISA-N 447.114 4.542 50 10 IJGE CC(C)(C)OC(=O)NCCCc1ccccc1NC(=O)N1CCC(Br)CC1 2207179261 SZUJVISOKVUGSV-UHFFFAOYSA-N 440.382 4.535 50 10 IJGE Cc1c(C[C@@H](Br)CN2C(=O)c3ccccc3C2=O)cccc1C(F)(F)F 2211288778 OIMFLPVDWBPYCF-CYBMUJFWSA-N 426.232 4.616 50 10 IJGE CC(C)(CCl)N(Cc1ccccc1)S(=O)(=O)Cc1ccc(Br)cc1 2213760896 MVTPUXWQQATPHN-UHFFFAOYSA-N 430.795 4.799 50 10 IJGE Br[C@@H]1CN(C[C@H]2CC2(Br)Br)C2(CCCCC2)C1 2217451629 ONRQBTUEBQIWAP-MNOVXSKESA-N 430.022 4.665 50 10 IJGE Cc1cc(Br)c(C(=O)N2CC[C@@](CBr)(C(F)(F)F)C2)s1 2237630476 WBVSEEHFJAVIEJ-NSHDSACASA-N 435.103 4.609 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1C[C@H]([S@](C)(=O)=NCCCCCCCBr)C1 2263156742 YGNWPQQZAHFMNY-NWLBTCKQSA-N 439.460 4.733 50 10 IJGE CC(C)(C)C1(O[C@@H](CI)c2cccc(Br)c2)COC1 2272907053 AHYVEVOXAHRFSF-ZDUSSCGKSA-N 439.131 4.757 50 10 IJGE CCOc1cccc(NC(=O)C(C#N)=Cc2ccc(-c3ccc([N+](=O)[O-])cc3OC)o2)c1 2294193495 UNWGFIGHJFSCCV-UHFFFAOYSA-N 433.420 4.808 50 10 IJGE COc1cc(C=C(C#N)C(=O)N[C@H]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OCc1ccccc1 2294516822 IVJIXOYYIQIRPV-UTKZUKDTSA-N 449.507 4.784 50 10 IJGE COc1cc(C=C(C#N)C(=O)N[C@H]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OCc1ccccc1 2294516823 IVJIXOYYIQIRPV-UWJYYQICSA-N 449.507 4.784 50 10 IJGE CC1=C(C#N)C(=O)N(Cc2ccco2)C(=O)C1=Cc1ccc(OCc2ccc(F)cc2)cc1 2314618836 VDXFUUZSCOVZHX-UHFFFAOYSA-N 442.446 4.790 50 10 IJGE CCCCOc1ccc(C=C(C#N)C(=O)Nc2sc3c(c2C(N)=O)CC[C@H](C)C3)cc1 2314734980 LPYWLVSRMUSQDE-HNNXBMFYSA-N 437.565 4.696 50 10 IJGE Cc1cc([C@@H](Br)c2c(Br)c(Br)nn2C)ccc1F 2316724166 ITARGYSAICLZHI-SECBINFHSA-N 440.936 4.877 50 10 IJGE CN(C[C@H](Cl)CCc1ccc(I)c(Br)c1)C1CC1 2325203787 JBDGIVCZIBWWBE-LLVKDONJSA-N 442.566 4.688 50 10 IJGE Cl[C@H]1CCCC[C@H]1CNCc1ccc(I)c(Br)c1 2325211329 HQPBKAIHZRJFMW-AAEUAGOBSA-N 442.566 4.941 50 10 IJGE CC[C@H](NC=C(C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1ccc2c(c1)CCCC2 2325216875 LQQHYDBZQAUEOC-NRFANRHFSA-N 434.496 4.569 50 10 IJGE Clc1ccc(I)cc1CN1CCCC[C@@H](CBr)C1 2327399827 WOVLVGOCCYBCTE-NSHDSACASA-N 442.566 4.942 50 10 IJGE CCCc1sc(Br)cc1[C@H](Br)C1CC(S(C)(=O)=O)C1 2338025330 GHWXPJFKTOZNCV-KJHLLKJSSA-N 430.227 4.722 50 10 IJGE CS(=O)(=O)c1cccc([C@@H](Cl)c2sc(Cl)cc2I)c1 2338562944 HGIBFUQUKYUSRT-LLVKDONJSA-N 447.146 4.738 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]32)C1 2345011181 QRLCKLAMQTXHGC-IRXDYDNUSA-N 429.443 4.909 50 10 IJGE COc1c(Br)cc(C)c([C@@H](Cl)C(C)(C)S(C)(=O)=O)c1Br 2365223698 QAAGRJOLJRQJSA-GFCCVEGCSA-N 448.604 4.632 50 10 IJGE CC1(C)CCN(C(=O)c2ccc(Cl)cc2I)C[C@H]1CCl 2365597927 LSFHUNPJXIBRFM-SNVBAGLBSA-N 426.125 4.672 50 10 IJGE CC(C)[C@H](Br)C(C)(C)CN(C)Cc1nn(C)c(Cl)c1Br 2365904268 HZYBGRSIAUUSCC-LBPRGKRZSA-N 429.628 4.714 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(O[C@H]2CCCCC23CCOCC3)C1 2368353746 IASJOSFWGYADHC-LAUBAEHRSA-N 446.426 4.907 50 10 IJGE Cc1cc2c(c(=O)n1Cc1ccccc1)[C@@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 2326295 HWQMVXZKYJQJNP-FQEVSTJZSA-N 438.314 4.730 50 10 IJGE O=C(N/N=C/c1cc(Br)ccc1O)[C@@H]1CC1(c1ccccc1)c1ccccc1 3028428 UQDSXJMZNZPXMS-RASHHNMQSA-N 435.321 4.611 50 10 IJGE CCc1ccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4OC)ccc32)cc1 38676803 CAYUSLMXQZCUHT-XMMPIXPASA-N 426.472 4.695 50 10 IJGE CC(C)c1ccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2N)cc1 40706228 VAVMHJCSTCCKEC-UHFFFAOYSA-N 431.327 4.990 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccc(C)cc2C)ccc1OCc1ccc(C)cc1 40911185 CSPCOHRCNGDPMY-JFLMPSFJSA-N 432.520 4.729 50 10 IJGE CCC1CCC(=NNC(=O)CN(c2ccc(Cl)cc2)S(=O)(=O)c2ccccc2)CC1 59371756 RXHXZEGYDNKYNX-UHFFFAOYSA-N 447.988 4.608 50 10 IJGE COc1ccccc1C(=O)N/N=C/c1ccccc1OCc1ccc(Br)cc1 59417868 FJUSCCHUVGUKNA-ZVHZXABRSA-N 439.309 4.801 50 10 IJGE C[C@@]12CC[C@@H]3c4ccc(O)cc4CC[C@@H]3[C@@H]1CC/C2=N/NC(=O)c1cccc([N+](=O)[O-])c1 105436437 PEVAPRZFSJGMGN-HKNJRGNXSA-N 433.508 4.943 50 10 IJGE CCCOc1ccc(/C=N\NC(=O)Cc2cc(Cl)ccc2SCC)cc1[N+](=O)[O-] 169922398 IDCJIFGDPUFPDU-XKZIYDEJSA-N 435.933 4.842 50 10 IJGE N#C/C(=C/NCc1ccc(Br)cc1)C(=O)Nc1ccc(Cl)c(Cl)c1 217006802 SWPHWGIMYRUMSX-BENRWUELSA-N 425.113 4.892 50 10 IJGE CCn1c(SCC(=O)NN=Cc2ccc(C(F)(F)F)cc2)nnc1-c1ccc(C)cc1 254740622 DBHAGGCRYIVDHR-UHFFFAOYSA-N 447.486 4.535 50 10 IJGE CCCc1nc(-c2ncc(Br)cc2Br)ncc1CBr 305974153 ZLOVFQIPKCNMAN-UHFFFAOYSA-N 449.972 4.911 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CBr)[C@H](c2cccc(Br)c2F)C1 382699830 XJJCVKPFXOJCRT-CMPLNLGQSA-N 437.147 4.934 50 10 IJGE C[C@@H]1[C@H](CBr)CCN1C(=O)c1cc(Br)c(Br)s1 395201796 MLKKOBSIQFLDOL-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE CC(C)[C@@](C)(CBr)NC(=O)c1cc(Br)cc(Br)c1 398531240 BXFLUUVVMLCZRN-CYBMUJFWSA-N 441.989 4.751 50 10 IJGE COC[C@@H](O[C@H](CI)c1cccc(Br)c1)C(C)C 404151074 RZOQENBHICYNIC-ZIAGYGMSSA-N 427.120 4.613 50 10 IJGE Clc1cc(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@@H]32)ccc1CBr 404156396 PVNGKUCAURVNAJ-SFTDATJTSA-N 435.793 4.715 50 10 IJGE ClCc1nc2cccc(Br)c2n1C[C@@H]1CN(Cc2ccccc2)CCCO1 697736585 RYEFSEMFBCISSO-KRWDZBQOSA-N 448.792 4.829 50 10 IJGE Cc1cc(C(=O)NNC(=O)c2c(Cl)cccc2Cl)ccc1NC(=O)c1cccs1 758986733 NLDCWTZWZHVOGT-UHFFFAOYSA-N 448.331 4.690 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)Nc2cc(C)nn2-c2ccccc2C)c1C 788100594 KKVUOJFYGFPKFK-PPRFWAEMSA-N 431.540 4.661 50 10 IJGE C[C@H](Sc1ccc(Br)cc1)C(=O)NNc1nc2ccccc2[nH]c1=S 1585173502 HBJDNHXPZONMNQ-JTQLQIEISA-N 435.372 4.679 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc([N+](=O)[O-])cc2)CCC3)cc1 1772745005 OJEBBTQILKAGOG-UHFFFAOYSA-N 446.463 4.527 50 10 IJGE CCc1nn(CC(C)C)c2c1[C@H](c1ccc(OCc3ccccc3)cc1)C(C#N)=C(N)O2 1865689958 HOMDRRCFOITVSQ-HSZRJFAPSA-N 428.536 4.899 50 10 IJGE COc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3Cc2ccc(Cl)c(Cl)c2)c1 1865711919 LLGFVVJGFACLMF-HXUWFJFHSA-N 441.318 4.773 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CC[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]1C2 1882087057 HCJLIVFGFRFNAQ-JJXSEGSLSA-N 447.414 4.700 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@@H]1CN(C(=O)OC(C)(C)C)[C@H]2CCCC[C@H]12 1882180525 OCJSJBOXUOBWQA-FPCVCCKLSA-N 447.414 4.700 50 10 IJGE CC(C)(CCl)N(Cc1ccccc1)C(=O)c1cccc(I)c1 1915772216 XMQMHRKNEGQEDU-UHFFFAOYSA-N 427.713 4.951 50 10 IJGE CN(C[C@H](Br)COCc1ccccc1)C(=O)c1csc(C(F)(F)F)c1 1916375319 TWWHLZZVLOQSEW-AWEZNQCLSA-N 436.293 4.819 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CC(=O)NN(Cc2ccccc2)Cc2ccccc2)CC1 1923723257 UTLAEEZNCMUDFA-UHFFFAOYSA-N 437.584 4.757 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN1Cc1ccc(Br)cc1Br 1950534777 HJMPIHCREDEHGR-ZJUUUORDSA-N 425.990 4.817 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)Cc1cc(Br)n(C)n1 1960909898 GMJLGADNVCXUTG-MRXNPFEDSA-N 429.200 4.604 50 10 IJGE CC1(C)[C@H](Cl)CC[C@H]1Nc1ncc(I)cc1Br 2026157984 WOYFDOSYXCMOAD-NXEZZACHSA-N 429.527 4.657 50 10 IJGE CC[C@@H](C)[C@H](Br)CNC(=O)c1cccc(Br)c1Br 2031482205 PPIWXCDBGPYUPS-LDYMZIIASA-N 441.989 4.751 50 10 IJGE BrC[C@@H]1[C@H]2CCN(Cc3c(Br)cccc3Br)C[C@@H]21 2033087886 XVDPSXGEYARWJJ-MXWKQRLJSA-N 438.001 4.674 50 10 IJGE CC(C)(CCBr)CNC(=O)c1c(Br)cccc1Br 2033093641 KBHJBLXVEMDVCL-UHFFFAOYSA-N 441.989 4.753 50 10 IJGE CCCCN(C[C@H](Br)C(F)(F)F)C[C@H]1CCCN1C(=O)OC(C)(C)C 2044704195 APTLIHAHKIXKHK-KGLIPLIRSA-N 431.337 4.814 50 10 IJGE O=C(Nc1cc(I)ccc1Cl)[C@@H](Br)C1CCCC1 2048139848 OFEIOYXQYYVHQV-LBPRGKRZSA-N 442.522 4.837 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)C(C)(C)C)C[C@@H]1CC(F)F 2057192326 GCEXOOXQLVVDET-KBPBESRZSA-N 427.374 4.620 50 10 IJGE ClCCc1ccc(Nc2ncc(I)cc2Br)cc1 2069525765 LHBVPPSSNQQKKE-UHFFFAOYSA-N 437.506 4.974 50 10 IJGE CCc1nn(-c2ccc(CBr)cc2C)c(CC)c1I 2093915381 JVNAZJHIFQINMV-UHFFFAOYSA-N 433.131 4.805 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCN(C[C@@H](CBr)CC3CC3)CC2)CC1 2112868297 IMDAEFFBLUQDAC-GOSISDBHSA-N 429.443 4.911 50 10 IJGE CC[C@H](C)N(Cc1ccccc1)S(=O)(=O)c1ccc(OCCCBr)cc1 2123245474 IIYJKWHJKFVSEQ-KRWDZBQOSA-N 440.403 4.840 50 10 IJGE CS(=O)(=O)c1csc([C@H](Br)c2c(F)cc(Br)cc2F)c1 2149489233 CMQBXCXWYAYYTJ-LBPRGKRZSA-N 446.132 4.677 50 10 IJGE CCC[C@]1(NC(=O)c2ccc(CBr)cc2)CCCN(C(=O)OC(C)(C)C)C1 2162592672 WRQATIFVPBZHBY-NRFANRHFSA-N 439.394 4.881 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2CCN(C[C@@H](CBr)c3ccccc3)C[C@H]2C1 2163062282 KPULMVCZAXAOTJ-ZCNNSNEGSA-N 437.422 4.744 50 10 IJGE CC[C@H]1CCCCCN1S(=O)(=O)c1cc(CBr)sc1Br 2179792036 ZYZWDSKHOBKDRV-JTQLQIEISA-N 445.242 4.749 50 10 IJGE Brc1cnc(N2C[C@H](Br)CC23CCCC3)c(Br)c1 2224114639 ZBJNBLXRGDOPSF-SNVBAGLBSA-N 438.989 4.893 50 10 IJGE COc1ccc([C@H](Br)C23CCOC(C)(C2)C3)cc1I 2269533806 IGNCGVZASYYRML-NFOMZHRRSA-N 437.115 4.695 50 10 IJGE O=C(NC[C@H]1CCCC[C@H]1CCl)c1ccc(Cl)c(I)c1 2283655068 GLDAZJWKUGUOSB-NWDGAFQWSA-N 426.125 4.720 50 10 IJGE Cc1cc(C=C(C#N)C(=O)NCCc2c[nH]c3ccccc23)c(C)n1-c1ccccc1F 2294171891 HSKTZIBHECMAED-UHFFFAOYSA-N 426.495 4.980 50 10 IJGE CCOc1ccc(C=C(C#N)C(=O)Nc2nc(-c3cccc(OC)c3)cs2)cc1OC 2314754120 LDUOBKVECWONMT-UHFFFAOYSA-N 435.505 4.772 50 10 IJGE COC(=O)c1ccc(CNC=C(C#N)C(=O)NC2CCCCCCCCCCC2)cc1 2325489170 QNCSDBNRLFNSKS-UHFFFAOYSA-N 425.573 4.760 50 10 IJGE C[C@@H](Br)COCc1cn(-c2ccc(Cl)c(Br)c2Cl)nn1 2362101566 VURFJWOQUVRDAK-SSDOTTSWSA-N 443.954 4.637 50 10 IJGE Cc1cccc(NC(=O)/C(C#N)=C\c2c(Oc3ccccc3C)nc3ccccn3c2=O)c1 39858889 PPKXVRKIIACTDN-CYVLTUHYSA-N 436.471 4.649 50 10 IJGE COc1cc(/C=N/NC(=O)COc2cccc(C)c2C)ccc1OCc1ccccc1C 40888721 QXZRNUMQBOJAIL-JFLMPSFJSA-N 432.520 4.729 50 10 IJGE CCN1C(=O)C(C#N)=C(C)/C(=C\c2cn(-c3ccccc3)nc2-c2ccc(C)c(F)c2)C1=O 101332509 VDHVQUXDBZKJGK-CIAFOILYSA-N 440.478 4.599 50 10 IJGE N#C/C(=C/NCCc1ccc(Br)cc1)C(=O)Nc1cc(Cl)ccc1Cl 217136483 WMANNRNKBLAFKD-QBFSEMIESA-N 439.140 4.934 50 10 IJGE CC(=NNC(=O)c1ccc([C@H]2SCC(=O)N2Cc2ccccc2)cc1)c1ccc(F)cc1 254386996 YVXRLYFPGFTXEX-RUZDIDTESA-N 447.535 4.754 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCC[C@@H]1CCBr 705403101 WLQXGUPMCGSIEL-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE BrCc1cnc(-c2ccc(I)c(Br)c2)o1 721325925 CJKLGIVOCXVWPP-UHFFFAOYSA-N 442.876 4.604 50 10 IJGE N#Cc1ccc(NNC(=O)c2cc(-c3ccco3)nn2-c2ccccc2)c(C(F)(F)F)c1 799750926 HACFVXXFFZXUGS-UHFFFAOYSA-N 437.381 4.780 50 10 IJGE O=C(COc1ccc(C=NNC(=O)c2ccc(Cl)cc2)cc1)Nc1cccc(Cl)c1 1083958162 VKTKMRUONKIMNN-UHFFFAOYSA-N 442.302 4.775 50 10 IJGE COc1ccc(C(=O)NN=Cc2ccc(Sc3cccc4cccnc34)o2)cc1OC 1084495954 MLEZOWMUDJKKMX-UHFFFAOYSA-N 433.489 4.760 50 10 IJGE CC(=O)c1ccc(OCCCC(=O)NNc2ccc(Cl)c(Br)c2)cc1 1304018270 CCIZRJFPGZSACT-UHFFFAOYSA-N 425.710 4.607 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c(-c2ccccc2)n1 1341867307 DGPMMSYCYKGXCY-QFVBLGFASA-N 442.482 4.795 50 10 IJGE CC(=O)c1ccc2c(c1)CN(C(=O)/C(C#N)=C\c1cc(C)n(-c3ccccc3F)c1C)C2 1525219736 FVZVSNDBBLPPSV-UUYOSTAYSA-N 427.479 4.885 50 10 IJGE CC(=O)N1CCc2c(NC(=O)/C(C#N)=C/c3cc(C)n(-c4ccccc4F)c3C)cccc21 1537952190 BAFOWUYCDZNZTR-XSFVSMFZSA-N 442.494 4.688 50 10 IJGE COc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2ccccc2F)cc1 1865681521 POUAEBLJPJITSR-QFIPXVFZSA-N 438.462 4.905 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2ccccc2Cl)[C@@H]1c1ccccc1F 1865682897 ADVNHGATDWXHFY-OAHLLOKOSA-N 434.780 4.902 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc(Cl)c2)[C@H]1c1ccccc1F 1865683936 QRJZINIHLCVHFB-HNNXBMFYSA-N 434.780 4.902 50 10 IJGE CCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@@H](c1cccc(OC)c1)C(C#N)=C(N)O2 1865711804 IIQJDZRDDZKBME-IBGZPJMESA-N 441.318 4.968 50 10 IJGE C[C@@H](Cl)CN(Cc1ccccc1)S(=O)(=O)c1cc(Cl)c(Br)s1 1914661879 QMHKVSKPYWPURD-SNVBAGLBSA-N 443.215 4.982 50 10 IJGE CN(CCCCBr)C(=O)c1csc(Br)c1Br 1937736930 BTVVOPFEHCGLLN-UHFFFAOYSA-N 433.991 4.520 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1C[C@@]1(C)CCC[C@H](CI)O1 1979567883 RXORHTWRONTICE-IIDMSEBBSA-N 437.362 4.929 50 10 IJGE CC(C)(C)OC(=O)NC[C@@](C)(CI)OC[C@H]1C[C@@H]1c1ccccc1 2022691450 RCVXRKPLHAOUMR-GPMSIDNRSA-N 445.341 4.525 50 10 IJGE COC[C@@]1([C@H](Br)c2cc(Br)ccc2Br)CCCO1 2030231698 VRXFFDUSADJVKK-CHWSQXEVSA-N 442.973 4.843 50 10 IJGE C[C@H](CCl)C(=O)N(CCCNC(=O)OC(C)(C)C)c1cccc(Br)c1 2044692641 CDJJGJRGXNPRBH-CYBMUJFWSA-N 433.774 4.572 50 10 IJGE O=C(CBr)c1cc(C(F)(F)F)c(I)cc1C(F)F 2060394192 CAVKWMYSEXWNFB-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE COC[C@H](C)CCO[C@@H](CI)c1ccccc1Br 2067238222 WELKQEHMGVWYPL-RISCZKNCSA-N 427.120 4.614 50 10 IJGE ClCCCC1CCN(c2ncc(I)cc2Br)CC1 2069527651 CVRZZDUYWICBIU-UHFFFAOYSA-N 443.554 4.684 50 10 IJGE COc1cccc(Cn2nc(CBr)c(Br)c2C(F)(F)F)c1C 2079234100 NTYRDMYCOJOJIZ-UHFFFAOYSA-N 442.073 4.925 50 10 IJGE C[C@]1(n2c(CCCl)nc3cncc(Br)c32)CCN(Cc2ccccc2)C1 2095438535 XHDBGWJQKSZLKX-FQEVSTJZSA-N 433.781 4.596 50 10 IJGE O=C(NC[C@]1(CCl)CC12CCC2)c1csc(Br)c1Br 2097910152 JWQWURQCVPSODC-CYBMUJFWSA-N 427.589 4.802 50 10 IJGE Cc1cc(NC(=O)OC(C)(C)C)cc(NS(=O)(=O)CCC(CCl)CCl)c1 2106298589 OOYYNTPTWGDCDD-UHFFFAOYSA-N 425.378 4.568 50 10 IJGE CC(C)N(C[C@H]1CCCN(C(=O)[C@H](Br)C2CCCC2)C1)C(=O)OC(C)(C)C 2167033373 QYFPZRUSXJTZDU-FUHWJXTLSA-N 445.442 4.824 50 10 IJGE C[C@@H](CCCCCBr)NS(=O)(=O)c1c(Cl)cccc1Br 2174531261 YSAFIQPUQKRVDU-JTQLQIEISA-N 447.620 4.725 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@H](CNC(=O)[C@@H](Br)C1CCCC1)c1ccccc1 2175021214 UENZEMKJRKETQC-MSOLQXFVSA-N 439.394 4.665 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@@]12CCCC[C@@H]1N(C(=O)OC(C)(C)C)CCC2 2196908440 XNCUVYRKTWJXTN-GRXQJBFDSA-N 443.426 4.578 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)cnc2n1C[C@@]1(Br)CC1(F)F 2202501899 AWFAGTAJKBGKLC-KBUNVGBDSA-N 429.490 4.666 50 10 IJGE CN(CCCCCI)C1(CNC(=O)OC(C)(C)C)CCCCC1 2211191184 PPTIMYWZXHSAAB-UHFFFAOYSA-N 438.394 4.751 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCN(CCCCCI)C2(CCC2)C1 2211191678 RLTHFAHSUCCFGP-OAHLLOKOSA-N 436.378 4.504 50 10 IJGE O=C(NCC1(CBr)CC(F)(F)C1)c1ccc(Cl)cc1Br 2281656488 LLISWFRCMWZEOO-UHFFFAOYSA-N 431.502 4.643 50 10 IJGE O=C(NC[C@@H](CBr)C(F)(F)F)c1cc(F)c(Br)cc1Cl 2282979058 UXCLODRZRKEGMF-RXMQYKEDSA-N 441.444 4.545 50 10 IJGE COC(=O)c1ccc(C(=O)OC)c(NC=C(C#N)c2nc(-c3ccc(C)cc3C)cs2)c1 2295937329 XFEYJABSIYESPR-UHFFFAOYSA-N 447.516 4.977 50 10 IJGE COC(=O)c1sc(NC=C(C#N)c2nc(-c3cccs3)cs2)c(C(=O)OC)c1C 2296362940 DHRSLUKUDMQIRS-UHFFFAOYSA-N 445.547 4.791 50 10 IJGE C[C@H]1OCC[C@@]1(CCl)Cc1ccc(I)c(Br)c1 2306221170 FEYQRTKQIDZWHX-RNCFNFMXSA-N 429.523 4.630 50 10 IJGE C[C@@H]1CO[C@@](CCl)(Cc2ccc(I)c(Br)c2)C1 2306226162 HJYLTHHUSPWVJA-TVQRCGJNSA-N 429.523 4.630 50 10 IJGE CC1(C)OC[C@@H](Cc2cc(I)ccc2Cl)[C@H]1Br 2307330025 IZNSLEQRAUIDIC-BXKDBHETSA-N 429.523 4.676 50 10 IJGE BrC[C@@H]1[C@H]2CN(Cc3cc(Br)ccc3Br)CC[C@@H]12 2311899525 NDKWZRDQNVXNBM-AVGNSLFASA-N 438.001 4.674 50 10 IJGE C[C@@H]([C@H](Br)c1c(F)cc(Cl)c(Br)c1Cl)S(C)(=O)=O 2313742927 IGFUBBMJAOPQKU-NVNXEXLPSA-N 442.959 4.764 50 10 IJGE CC1(C)CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)C[C@@H]2CC(F)F)C1 2345005388 XXRFRHBDNMTWDE-AWEZNQCLSA-N 439.385 4.764 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@H]3CCC[C@@](NC(=O)OC(C)(C)C)(C3)C2)C1 2345010163 KKCIRIBLVVPKTE-HRAATJIYSA-N 429.443 4.957 50 10 IJGE O=C(Nc1ccccc1C(=O)N/N=C/c1ccccc1Br)c1ccc(F)cc1 3089956 XWOSMCSDMGCUBC-ZMOGYAJESA-N 440.272 4.604 50 10 IJGE COc1cc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)ccc1OCCc1ccccc1 40888751 DNGMDROSRNMBNY-OGLMXYFKSA-N 446.547 4.771 50 10 IJGE CN(Cc1cc(Br)cs1)S(=O)(=O)c1ccc(Cl)c(CCl)c1 91271669 UDKXQKHRMMLIQM-UHFFFAOYSA-N 429.188 4.724 50 10 IJGE O=C([C@H](Br)Cc1ccccc1Cl)N1CCN(C/C=C/c2ccccc2)CC1 96574457 QVXGCPCDYGKHNF-AQDCRGGLSA-N 447.804 4.504 50 10 IJGE CNC(=O)/C(C#N)=C1\S[C@@H](Cc2ccccc2Cl)C(=O)N1c1ccc(C(C)C)cc1 101240523 DSTMRUIZPMYUSH-IRJMIRDBSA-N 439.968 4.636 50 10 IJGE CCn1c2ccccc2c2cc(NC(=O)CC(C)=NNC(=O)c3cccc(C)c3O)ccc21 254306827 JPWSVQMQQRDNHC-UHFFFAOYSA-N 442.519 4.963 50 10 IJGE Cc1csc(=O)n1CCOc1c(Br)cc(CCl)cc1Br 700225009 LLAOQASGFMJSEL-UHFFFAOYSA-N 441.572 4.561 50 10 IJGE CCCCSc1ccc(C(=O)NNc2ccc(S(C)(=O)=O)cc2)cc1C(F)(F)F 760914364 CTSCQYUSIYRIQM-UHFFFAOYSA-N 446.516 4.758 50 10 IJGE CCS(=O)(=O)c1cccc(C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)c1 762463135 NPXKUFBDOCDCIT-INIZCTEOSA-N 437.892 4.952 50 10 IJGE Cn1nccc1[C@H]1CCCCN1S(=O)(=O)c1ccc(S(F)(F)(F)(F)F)cc1 798473382 HAHXLZYYWGTFNQ-OAHLLOKOSA-N 431.452 4.993 50 10 IJGE CC(=O)c1cccc(OCCCC(=O)NNc2ccc(Cl)c(Br)c2)c1 1156737209 UURDJMSDSBTTAE-UHFFFAOYSA-N 425.710 4.607 50 10 IJGE COc1ccc(/C(C#N)=C/c2ccc(OC(=O)c3cccc([N+](=O)[O-])c3)c(OC)c2)cc1 1615066011 FMMSKGACTRHLSS-XDHOZWIPSA-N 430.416 4.895 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(CCC)nn3Cc2ccccc2)c1 1865693248 IPKCYIWAYBPWGE-HSZRJFAPSA-N 428.536 4.891 50 10 IJGE Cc1ccccc1COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C(F)(F)F)nn3C)cc1 1865703189 PJADNFHEOMXUHE-SFHVURJKSA-N 440.425 4.545 50 10 IJGE CCc1ccc(-c2csc(/C(C#N)=C(\O)[C@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1 1872744285 KWSRXCYLPROIJB-MPHHAOFMSA-N 429.501 4.850 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC12CCC1(CC2)CC[C@](C)(CI)O1 1937359262 AHKOSPLNJYZOHS-WGEBEKNLSA-N 435.346 4.587 50 10 IJGE C[C@H]1C[C@@H](CBr)CN1C(=O)c1csc(Br)c1Br 1950523250 SOLMSFDQBCDCED-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE O=S(=O)(c1cc(CBr)co1)N(Cc1ccccc1)Cc1cccs1 2009647125 RJNBAMFUBNRMBR-UHFFFAOYSA-N 426.357 4.627 50 10 IJGE COC[C@]1([C@H](Br)c2cc(Br)ccc2Br)CCCO1 2030231699 VRXFFDUSADJVKK-OLZOCXBDSA-N 442.973 4.843 50 10 IJGE CC[C@H](C)[C@H](CI)NC(=O)c1cc(Cl)ccc1Br 2081235289 DJUITFXSTDDZOA-UFBFGSQYSA-N 444.538 4.682 50 10 IJGE C=CC[C@@H](CBr)CNC(=O)c1cc(Br)ccc1Br 2082056526 XFFZZOOUGFYZQZ-VIFPVBQESA-N 439.973 4.529 50 10 IJGE CCN1CCC[C@@H]([C@@H](Br)c2cccc(OCc3ccccc3)c2)S1(=O)=O 2089516899 ZSKHJEQLCAPDAB-PMACEKPBSA-N 438.387 4.516 50 10 IJGE CC1(C)[C@H]([C@@H](Br)c2cc(I)cc3c2OCC3)C1(F)F 2097390565 NCBXUFRWPRJXOV-JQWIXIFHSA-N 443.069 4.953 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@H]1[C@@H]1CCCN(C(=O)CCCCBr)C1 2106770898 CYXPNALOOVKYSD-SJORKVTESA-N 431.415 4.580 50 10 IJGE CCCC(CBr)(CCC)CN(C)CCOCCN(C)C(=O)OC(C)(C)C 2106785675 CHONHXRVVRMYLK-UHFFFAOYSA-N 437.463 4.783 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](C(C)(C)C)CN(C(=O)CCCCBr)C1 2108378283 GLWKKWQQQABUJM-JKSUJKDBSA-N 433.431 4.587 50 10 IJGE Cc1cc(C(=O)NC[C@]2(F)CC[C@@H](CBr)CC2)c(Br)s1 2178583516 YMRKSGURVLPHJH-WJONMLJTSA-N 427.177 4.842 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@H]1C[C@@H]2CC[C@H](C1)O2 2181362938 TXXKKHNJYLYLFN-IKVITTDRSA-N 449.126 4.620 50 10 IJGE Cc1c(Cl)cc(C(=O)N[C@@H]([C@H](C)Br)C(F)(F)F)cc1Br 2195309670 JMSYGUNZJSCNQA-WKEGUHRASA-N 437.481 4.855 50 10 IJGE FC(F)(F)[C@H]1C[C@@]1(CCl)CNCc1ccc(I)c(Cl)c1 2208027475 AGFWIZFMHMFGTC-NWDGAFQWSA-N 438.058 4.842 50 10 IJGE C[C@@H]1CC[C@@H](CO[C@@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)C1 2243469984 PBBHPHLAYYWSPP-IIDMSEBBSA-N 437.362 4.644 50 10 IJGE COc1cccc([C@H](Br)c2ccc(OC)c(I)c2)c1 2269552160 LMPRSQGLJMWOMA-HNNXBMFYSA-N 433.083 4.793 50 10 IJGE Cc1sc([C@H](Br)[C@]23CCC[C@H]2CS(=O)(=O)C3)c(Br)c1C 2279098728 YPNFBNACAKYXJP-BPNCWPANSA-N 442.238 4.778 50 10 IJGE O=C(N[C@H](CBr)c1cscn1)c1cc(F)c(Br)cc1Cl 2282984390 RFNLCQKUBPBINQ-SNVBAGLBSA-N 442.535 4.564 50 10 IJGE C[C@H](NC(=O)c1cc(F)c(Br)cc1Cl)[C@@H]1CCC[C@@H]1Br 2282991166 BTHUEQNIAXFSGZ-NRPADANISA-N 427.539 4.924 50 10 IJGE O=C(C=Cc1ccccc1Cl)Oc1ccc(C=NNC(=O)c2cccc([N+](=O)[O-])c2)cc1 2296699139 XIQWGPRFKUSPGM-UHFFFAOYSA-N 449.850 4.631 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)CC23CC3)cc1I 2315555016 MFQIVFCTKKQEHT-NSHDSACASA-N 440.550 4.837 50 10 IJGE CCO[C@@H]1[C@@H](Br)C[C@H]1OCc1c(Br)cccc1Br 2318173538 XZDJUDNDRXNSEM-YNEHKIRRSA-N 442.973 4.669 50 10 IJGE N#CC(=Cc1ccc(Br)cc1)C(=O)N1CCc2cc(Br)ccc21 2324499017 PODONTICSUELCU-UHFFFAOYSA-N 432.115 4.708 50 10 IJGE FC1(F)[C@@H]2CC[C@@H](O[C@H](CI)c3ccc(Br)cc3)[C@@H]21 2333872566 WGWBXMWFQKVSDR-FDYHWXHSSA-N 443.069 4.986 50 10 IJGE F[C@]12CCC[C@]1(CCl)CN(Cc1ccc(Cl)cc1I)C2 2366738058 JBBQPHNKBZWUGT-GJZGRUSLSA-N 428.116 4.878 50 10 IJGE C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)COc1ccc(-c2ccccc2)cc1 14031687 KLGWTJJMAHTMGX-LJQANCHMSA-N 440.499 4.501 50 10 IJGE C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)COc1cccc2ccccc12 14038718 VUMWMXOAEVGIHD-IBGZPJMESA-N 440.499 4.501 50 10 IJGE CCOC(=O)c1c(NC(=O)[C@H](C)Cl)c(-c2ccc(OC)cc2)cn1Cc1ccccc1 23431522 OPISVIBROHPMBL-INIZCTEOSA-N 440.927 4.955 50 10 IJGE CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccc(C)cc4)ccc32)c1 38684830 ONYFDRCCUCUKOW-DEOSSOPVSA-N 426.472 4.831 50 10 IJGE CC(C)(C)CC(C)(C)c1ccc(OCC(=O)NNC(=O)COc2ccc(Cl)cc2)cc1 40844447 GJXVCEQXLKEYAZ-UHFFFAOYSA-N 446.975 4.659 50 10 IJGE CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C/c2ccccc2Cl)c(OC)c1 40970456 RMIJEIPJLFPAQH-ZLINDNQKSA-N 438.911 4.791 50 10 IJGE C[C@@H](CCCBr)NC(=O)c1cc(Br)c(Br)s1 125998189 NRVFHBXLTSFELH-LURJTMIESA-N 433.991 4.567 50 10 IJGE Nc1nc2ccc(CC(=O)N/N=C\c3ccc(OCCCc4ccccc4)cc3)cc2s1 169917130 BYGCWZSZUVTGKZ-PKAZHMFMSA-N 444.560 4.583 50 10 IJGE Oc1ccc(Br)c([C@@H]2CN(Cc3ccccc3)C[C@@H]2CBr)c1 382681069 BATZFQIYUFOEGO-WMLDXEAASA-N 425.164 4.765 50 10 IJGE C[C@@H](CCBr)CCNC(=O)c1cc(Br)ccc1Br 397727613 CZXHLSRFJGHNJH-VIFPVBQESA-N 441.989 4.753 50 10 IJGE C[C@H]1CC[C@H](Br)CN1Cc1cc(Cl)ccc1I 405305844 QFKHXFSZJIXGPU-ONGXEEELSA-N 428.539 4.692 50 10 IJGE Cc1ccc(NC(=O)NNC(=O)NCc2c(C)cc(Br)cc2C)c(Cl)c1 743569326 SVODJXAPYICIKX-UHFFFAOYSA-N 439.741 4.564 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)cc1 763796185 YOPZCBCNDMVDDU-UHFFFAOYSA-N 443.507 4.799 50 10 IJGE C[C@H]1CCN(C(=O)C(=O)Nc2ccc(S(F)(F)(F)(F)F)cc2)C[C@H]1n1ccnc1 773405396 BCAPAELPHHFUSG-SWLSCSKDSA-N 438.422 4.589 50 10 IJGE CC(=O)CCc1ccc(OCCC(=O)N2CCC[C@H](O[Si](C)(C)C(C)(C)C)C2)cc1 1129683766 QVXVJQHXLOFDFL-QFIPXVFZSA-N 433.665 4.990 50 10 IJGE C=CCC[C@@H](NC(=O)NNC(=O)COc1cc(C)cc(C)c1)c1ccc(C(F)(F)F)cc1 1312342899 PHTZSOGHXAHNAD-HXUWFJFHSA-N 449.473 4.739 50 10 IJGE CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N1CCC[C@@H](O[Si](C)(C)C(C)(C)C)C1 1527931162 CZGVUZRKSNNCSF-IFMALSPDSA-N 428.649 4.963 50 10 IJGE CC(C)(C)OC(=O)N[C@@]12CCC[C@@]1(F)CN(Cc1ccc(CBr)cc1)C2 1893715724 FBQQERTWDHPXDD-WOJBJXKFSA-N 427.358 4.553 50 10 IJGE CCCCOCCOCCOCCN(Cc1ccccc1)[C@@H](C)CCBr 1915114003 DYAUVADHIGRNOY-FQEVSTJZSA-N 430.427 4.512 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)Cc1ccc(C(F)(F)F)cc1 1916355553 WABWMTRDLCNPLM-GOSISDBHSA-N 444.291 4.687 50 10 IJGE C[C@H]1CCN(Cc2ccc(I)c(Cl)c2)[C@@H]1CBr 2026561968 WWPKRCZCWARDEC-TVQRCGJNSA-N 428.539 4.550 50 10 IJGE Clc1cc(C[C@H]2CCOCC[C@@H]2Br)ccc1I 2026571284 YUQYUVSWUWHYIS-MNOVXSKESA-N 429.523 4.677 50 10 IJGE CCC[C@](C)(CBr)NC(=O)c1ccc(Br)cc1Br 2029945466 OZFPFYOYNNKGLM-CYBMUJFWSA-N 441.989 4.895 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1C(=O)c1cccc(Br)c1Br 2031477191 KEWSTGSMDWROOC-IUCAKERBSA-N 439.973 4.600 50 10 IJGE BrC[C@H]1CN(Cc2cccc(Br)c2Br)CC12CC2 2031479401 XEDNBKQEBSVJGE-NSHDSACASA-N 438.001 4.819 50 10 IJGE C[C@@H]1CCO[C@@H]1COc1c(Br)cc(Br)cc1CBr 2034995993 QTCVYCQOQOLTBS-PRHODGIISA-N 442.973 4.910 50 10 IJGE CCCC(CBr)(CCC)CN=[S@](C)(=O)CCN(C)C(=O)OC(C)(C)C 2044704410 CKVRHRNRNSGHFL-RUZDIDTESA-N 441.476 4.933 50 10 IJGE CCO[C@H](C)c1nc(CN(C)C[C@H](Br)COCc2ccccc2)cs1 2050592379 ZQSSAVVRTAQGSH-WBVHZDCISA-N 427.408 4.653 50 10 IJGE FC(F)(F)c1c(I)ccc(CBr)c1Br 2054871179 VHUBKTLRVNFCPB-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE CC[C@@H](C)[C@@H](CBr)NC(=O)c1cccc(Br)c1Br 2081242779 PUFUMGZYHJYYGP-LDYMZIIASA-N 441.989 4.751 50 10 IJGE C[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)CN1C[C@H](CBr)c1ccccc1 2106787117 YBLPQONEBSHBKR-AOIWGVFYSA-N 425.411 4.790 50 10 IJGE CCCC1(NC(=O)[C@@H](Br)C2CCCC2)CCN(C(=O)OC(C)(C)C)CC1 2110715010 JHKUAGROGCAZOZ-INIZCTEOSA-N 431.415 4.626 50 10 IJGE CC[C@H](CBr)CN1C[C@H](c2ccccc2)[C@H](CNC(=O)OC(C)(C)C)C1 2129068456 QVYIODQJSIMUPT-BHIYHBOVSA-N 425.411 4.648 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2CN(CC3(CBr)CCCCC3)C[C@@H]2C1 2141250582 UFRMZKVETFFMMD-OKZBNKHCSA-N 429.443 4.957 50 10 IJGE Cn1ncc(Br)c1CC(CCl)(CCl)c1cccc(Br)c1 2143633273 HHWYFJPTDXAAAO-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE Cc1sc(Br)c(C(=O)N2CC[C@@H](CBr)C(F)(F)C2)c1C 2157253710 XPOYSDYYYBZCHY-VIFPVBQESA-N 431.140 4.620 50 10 IJGE CCCC(CBr)(CCC)CN1C[C@H](OC)C[C@]1(C)CNC(=O)OC(C)(C)C 2163062723 MNJLHZZNSPFYEC-YLJYHZDGSA-N 449.474 4.972 50 10 IJGE COc1cccc(N2CC[C@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c1CBr 2203190749 WCWNSUPPBZDRMU-WOJBJXKFSA-N 429.402 4.939 50 10 IJGE CC[C@]12CO[C@]([C@H](Br)c3cc(I)cc4c3OCC4)(C1)C2 2205190328 GDBVVRLMARAQTR-OAGGEKHMSA-N 449.126 4.621 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@H](Br)c1cn(C)c(Br)n1 2264358329 AOIGFBMUQSHNIH-NSHDSACASA-N 428.939 4.982 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1CBr)c1cc(F)c(Br)cc1Cl 2282982615 LBIJNZDAOQYUEN-SDBXPKJASA-N 427.539 4.925 50 10 IJGE CN(C[C@]1(O)CCCN(CCCCCCCCCBr)C1)C(=O)OC(C)(C)C 2286319850 XJGRPCKVCQTXLU-OAQYLSRUSA-N 449.474 4.806 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Br)[C@H]1OCCOC1(C)C 2295368541 WQWIERXLGGVOSH-WCQYABFASA-N 428.548 4.741 50 10 IJGE N#CC(=Cc1ccc(OC(=O)c2ccco2)cc1)C(=O)Nc1ccccc1Br 2297331628 KYCGSAYTNZIAMV-UHFFFAOYSA-N 437.249 4.807 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@@H](Cc2ccccc2)C(=O)N1c1ccc(C(C)C)cc1 2314593038 GKFPLBFYKMGRQC-QFIPXVFZSA-N 431.561 4.538 50 10 IJGE Cc1ccc(-c2csc3nc(SCC(=O)NN=Cc4ccccc4)nc(O)c23)cc1 2320488226 JWPPJHZRGVDCDW-UHFFFAOYSA-N 434.546 4.615 50 10 IJGE CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NN=Cc1ccc(-c2ccccc2Cl)o1 2328796591 GPNFLQSBEYLYHC-SFHVURJKSA-N 433.936 4.990 50 10 IJGE FC(F)(CBr)C(F)(F)CNCc1ccc(Cl)c(Br)c1 2336540453 CBXYNBKJSMWALZ-UHFFFAOYSA-N 427.461 4.858 50 10 IJGE O=C(N[C@@H](CCl)c1cccs1)c1ccc(Cl)cc1I 2340052359 NQJDHNZTOUABGN-NSHDSACASA-N 426.106 4.716 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@H]1CCCN(C[C@@H](CBr)c2ccccc2)CC1 2340134867 LGXPALFXWCJXQH-MOPGFXCFSA-N 425.411 4.887 50 10 IJGE CC(C)c1ccc(/C=N/NC(=O)c2cccc(NC(=O)c3cccc([N+](=O)[O-])c3)c2)cc1 2752990 PBEIOGXIHBFONQ-MFKUBSTISA-N 430.464 4.734 50 10 IJGE Cc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2ccc(Cl)cc2)CCC3)nc1 40811712 SVDPEGSRTKSGMW-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE [C-]#[N+][C@H](c1cc(Br)cc(Br)c1)S(=O)(=O)c1ccc(C)cc1 138945118 ZRBDMWRXFUPOHW-HNNXBMFYSA-N 429.133 4.912 50 10 IJGE N#C/C(=C/Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NC(c1ccccc1)c1ccccc1 216974625 CCPLOVOGUKDXOX-SDXDJHTJSA-N 432.867 4.973 50 10 IJGE CCOC(=O)c1ccc(CN/C=C(/C#N)C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1 217212235 NFFVSIGJEGNZHR-UZYVYHOESA-N 441.487 4.791 50 10 IJGE CC[C@H](N/C=C(/C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1OC)c1ccc2c(c1)CCCC2 217230289 LQQHYDBZQAUEOC-SACXWWFQSA-N 434.496 4.569 50 10 IJGE Cc1cc(C)c2c(N)c(C(=O)NN=Cc3ccc(OCc4ccccc4)cc3)sc2n1 254840963 LLWKJHOPOPAVHR-UHFFFAOYSA-N 430.533 4.838 50 10 IJGE CCN(C[C@@](C)(CI)OC[C@@H](C)C1CCC1)C(=O)OC(C)(C)C 398383444 NYKJDKDIRUFGGH-RDTXWAMCSA-N 439.378 4.890 50 10 IJGE C[C@@H](CCCCBr)NC(=O)c1cc(Br)ccc1Br 398517325 KYHLOSUGCIQIGK-VIFPVBQESA-N 441.989 4.895 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)cnc2n1Cc1sncc1Br 722789661 CKXQVMNBLSHYFB-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE CCOc1ccc(/C=C(\C#N)C(=O)Nc2cnn(-c3cccc(C(F)(F)F)c3)c2)cc1 733780956 AZOSCCZOLMANDQ-MHWRWJLKSA-N 426.398 4.835 50 10 IJGE CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cc1Cl 757997098 NPNJXWJLAMEDER-UHFFFAOYSA-N 448.866 4.817 50 10 IJGE N#Cc1ccc(NNC(=O)C2CCN(c3nc4ccccc4s3)CC2)c(C(F)(F)F)c1 799747708 GXAFRNXFNSPKBT-UHFFFAOYSA-N 445.470 4.546 50 10 IJGE CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NNc1c(Cl)cccc1Br 1559008057 BGIPUGSTGISISW-QGZVFWFLSA-N 434.721 4.510 50 10 IJGE FC(F)Oc1ccccc1[C@@H]1CN(Cc2ccccc2)C[C@@H]1CI 1614623362 CVEIPZQVFJEYQT-DOTOQJQBSA-N 443.275 4.939 50 10 IJGE C=C(C)C[C@H](CO)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(Cl)c2Cl)c1C 1636699390 KLIQMZKXBVLIFB-WAFWZSCLSA-N 432.351 4.751 50 10 IJGE CCCc1nn(-c2ccccc2)c2c1[C@@H](c1ccc(OC(C)C)c(OC)c1)C(C#N)=C(N)O2 1865695754 HCRKSHDFQUNMBH-QHCPKHFHSA-N 444.535 4.839 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccccc2Cl)[C@@H]1c1ccncc1 1865700575 XTVKVUYWOULJIM-OAQYLSRUSA-N 439.906 4.865 50 10 IJGE CCn1nc(-c2ccc(OC)cc2)c2c1OC(N)=C(C#N)[C@@H]2c1ccc(C(F)(F)F)cc1 1865711023 OEBPZVOPJXYQRS-SFHVURJKSA-N 440.425 4.816 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)C(=O)N/N=C/c1c(OCc2ccccc2)ccc2ccccc12 1873794590 PYCZHTCVGGBTHO-NLTKLDOMSA-N 447.535 4.782 50 10 IJGE C[C@H](C1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](CBr)NC(=O)OC(C)(C)C 1880759865 BMKVRRULBSRLQW-UKRRQHHQSA-N 435.403 4.558 50 10 IJGE O=S(=O)(c1cccc(Cl)c1)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915167445 VYUQIKBZBDPXDH-GOSISDBHSA-N 428.779 4.704 50 10 IJGE CN(Cc1ccc(OC(F)(F)F)cc1)C[C@H](Br)COCc1ccccc1 1916369030 DVHNAPSBSXEGMG-KRWDZBQOSA-N 432.280 4.997 50 10 IJGE O=S1(=O)CCC[C@H]1[C@@H](Cl)c1c(Br)sc(Br)c1Cl 1923054859 LDPWINBIYXNAFQ-UJURSFKZSA-N 443.009 4.784 50 10 IJGE CC1(C)C[C@H](Br)CN1Cc1ccc(Br)cc1Br 1949205924 WZGJSTRQLIFHBE-NSHDSACASA-N 425.990 4.959 50 10 IJGE Cc1cc([C@H](Br)c2cc(I)sn2)cc(C)c1F 2007646441 XXTJHVQRQDHMBR-NSHDSACASA-N 426.092 4.988 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@H]2CC23CCCC3)CC1 2021267635 QSSANCJTXNSTRL-OAHLLOKOSA-N 449.373 4.788 50 10 IJGE Brc1cccc(CN2C[C@@H](Br)[C@H](C3CC3)C2)c1Br 2031479584 YFNSZBIRKUXRCJ-WCQYABFASA-N 438.001 4.817 50 10 IJGE O=C(CBr)c1cc(I)c(C(F)F)c(C(F)(F)F)c1 2060394557 MTDGLVLIAYKINB-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE Cc1c(Br)ccc([C@H](Br)C2COCCOC2)c1Br 2083316879 AJQHPMFHWFROKL-CYBMUJFWSA-N 442.973 4.619 50 10 IJGE Fc1ccc([C@@H](Br)c2ncn3ccsc23)c(I)c1 2083983202 XKOWMPTXXHIWTM-SNVBAGLBSA-N 437.075 4.624 50 10 IJGE Clc1cc(CN2CC[C@H](Br)C23CCC3)ccc1I 2086651820 KZFGWZBRLBQUTH-ZDUSSCGKSA-N 440.550 4.837 50 10 IJGE Clc1cc(CN2C[C@@H](Br)[C@@H](C3CC3)C2)ccc1I 2086651840 LBMHXFOHEUVHRL-VXGBXAGGSA-N 440.550 4.550 50 10 IJGE ClCc1nc2cncc(Br)c2n1C[C@H]1CCCN(Cc2ccccc2)C1 2095446557 XMOFXNPLNNNMTO-INIZCTEOSA-N 433.781 4.845 50 10 IJGE ClCCc1nc2cncc(Br)c2n1Cc1csc(Br)c1 2151791648 VNJYABVRRDYBRG-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H]2CC[C@H](C1)N2C[C@H](CBr)c1ccccc1 2163063020 OCYAALMBQCSBHF-FFGOWVMKSA-N 437.422 4.933 50 10 IJGE CCC(CC)N(CC)S(=O)(=O)c1ccc(CBr)c(Br)c1 2179956392 OBUUGKZHPMJFCV-UHFFFAOYSA-N 427.202 4.543 50 10 IJGE CCC[C@@H]1CN(C(=O)c2cc(Cl)ccc2I)C[C@H]1CCl 2205699840 ZYDFSJJBSIDMEW-GHMZBOCLSA-N 426.125 4.672 50 10 IJGE Fc1cc(Br)cc2c1nc(CCl)n2Cc1ncc(Br)s1 2232915025 CMDYDZWMXKZHII-UHFFFAOYSA-N 439.535 4.944 50 10 IJGE CN[C@H](Cc1cc(Br)cc(Br)c1)[C@H]1C[C@@H](Br)C1 2252836547 DCDMCNLYSAIZQB-JIMOISOXSA-N 425.990 4.516 50 10 IJGE CC(C)(C)OC(=O)NCc1c(Cl)cccc1NC(=O)N1CCC(Br)CC1 2268607771 YFMHOFOLEQUZQR-UHFFFAOYSA-N 446.773 4.756 50 10 IJGE CC(C)[C@@H]1[C@@H](Br)CCN1C(=O)c1cc(F)c(Br)cc1Cl 2282968347 VDWQDBMTMYNVIC-TVQRCGJNSA-N 427.539 4.876 50 10 IJGE Cc1cc(F)c(CBr)c(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@@H]32)c1 2283391098 ASJYBKSHWFITJE-VXKWHMMOSA-N 433.365 4.509 50 10 IJGE N#CC(=CNc1ccc(O)c(C(=O)O)c1)c1nc(-c2cccc(Br)c2)cs1 2297510357 WZPUDZNGWDNNIF-UHFFFAOYSA-N 442.294 4.953 50 10 IJGE CC[C@H]1[C@H](Br)CCN1Cc1ccc(Cl)c(I)c1 2300238557 MFQBZVNXNGOEAH-MFKMUULPSA-N 428.539 4.692 50 10 IJGE Clc1ccc(CN[C@@H](CBr)C2CCC2)c(I)c1 2302325798 KIRDSPBDBUXFBI-ZDUSSCGKSA-N 428.539 4.598 50 10 IJGE CC[C@H](C[C@H](C)Br)NC(=O)c1ccc(Cl)cc1I 2317767724 AJQMSJCMGSYUJJ-WCBMZHEXSA-N 444.538 4.627 50 10 IJGE COc1ccc(Br)cc1C=NNC(=O)Cc1cc(Cl)ccc1SC 2323683544 GJYOZOQYRGJAHQ-UHFFFAOYSA-N 427.751 4.526 50 10 IJGE C[C@]12CN(Cc3ccc(I)c(Br)c3)C[C@@]1(CCl)C2 2325226067 LRKNFBOAFQDZRR-KBPBESRZSA-N 440.550 4.505 50 10 IJGE COc1nc(OCc2cc(Br)cc(Br)c2)c(CCl)s1 2337069811 UYLSJLVKSAFSEJ-UHFFFAOYSA-N 427.545 4.995 50 10 IJGE CS(=O)(=O)c1csc([C@H](Cl)c2ccc(Cl)cc2I)c1 2340066301 ZAOUFLCVDZONED-GFCCVEGCSA-N 447.146 4.738 50 10 IJGE CCCN(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@@]1(CBr)CC1(F)F 2351892361 ODQGRJZWKPKWSW-YJBOKZPZSA-N 439.385 4.766 50 10 IJGE CC(C)(C)[C@@H]1[C@@H](Cl)CCN1C(=O)c1ccc(Cl)cc1I 2365591194 KNTGVBYBKDLNNJ-AAEUAGOBSA-N 426.125 4.813 50 10 IJGE CCCCCCOc1ccc(C(=O)NNC(=S)NC(=O)c2ccc(C(C)C)cc2)cc1 10453293 ODFNSORZXTWBBE-UHFFFAOYSA-N 441.597 4.718 50 10 IJGE O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)c1ccc(NC(=O)C2CCCCC2)cc1 12487491 IIESCKJUFIAVDD-WYMPLXKRSA-N 434.323 4.982 50 10 IJGE O=C(/C=C/c1ccc(Cl)cc1)NNC(=O)CCCOc1ccc(Cl)cc1Cl 14833649 AKTYXPGILWSZAZ-BJMVGYQFSA-N 427.715 4.667 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)Cc3ccc(Cl)cc3)ccc2[C@@H]1c1ccc(F)cc1 38653223 SDHRAUNMSGUQSJ-QHCPKHFHSA-N 434.854 4.845 50 10 IJGE CCN(c1ncnc(NNC(=O)c2ccccc2F)c1[N+](=O)[O-])c1cccc2ccccc12 40589272 DUXXRZNNJPCWOZ-UHFFFAOYSA-N 446.442 4.592 50 10 IJGE CCCOc1ccccc1/C=N/NC(=O)c1cc(-c2ccccc2)nc(N2CCCCC2)n1 169927496 CFWJLYQGROKDNW-ZXVVBBHZSA-N 443.551 4.687 50 10 IJGE FC(F)(F)COCCOc1c(Br)cc(CCl)cc1Br 236117304 RIPATIZHBNMKBP-UHFFFAOYSA-N 426.454 4.908 50 10 IJGE CCC(=NNC(=O)Cc1ccc(Br)cc1)c1ccc(Br)s1 252604678 GCTPWWVIHPDBPA-UHFFFAOYSA-N 430.165 4.746 50 10 IJGE CCc1ccc(OCC(=O)NN=Cc2cn(-c3ccccc3)nc2-c2cccc(C)c2)cc1 254501892 XZWPFFIYUADYTN-UHFFFAOYSA-N 438.531 4.939 50 10 IJGE O=C(NN=Cc1cc(Cl)ccc1OCc1ccc(F)cc1Cl)c1cc(O)ccc1O 254697564 YGKWQPYXCKFFPN-UHFFFAOYSA-N 449.265 4.887 50 10 IJGE C[C@@H]1CCC[C@H](O[C@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)C1 299981950 RWFABNWIWNJRNT-VKJFTORMSA-N 437.362 4.786 50 10 IJGE C[C@H]1CN(Cc2ccccc2)CCN1S(=O)(=O)c1cc(Cl)cc(CCl)c1Cl 382647768 PHRFPOUSKQAIEA-AWEZNQCLSA-N 447.815 4.627 50 10 IJGE CC(C)(C)[C@@H](CBr)NCc1cc(Cl)ccc1I 405292024 ICEBSSGUWVOXHY-GFCCVEGCSA-N 430.555 4.844 50 10 IJGE CC(C)(C)N(CCBr)C(=O)c1cc(Br)sc1Br 691099282 SMEOIKYWPGXYOH-UHFFFAOYSA-N 448.018 4.909 50 10 IJGE C[C@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1ncc(CCl)cc1Br)C2 705899501 ZKZGEYUEBORDDW-NHCUHLMSSA-N 434.809 4.931 50 10 IJGE CCc1cccc(C)c1NC(=S)NNC(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 741298720 GTDRERLFZUKJTC-HZPDHXFCSA-N 437.487 4.577 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)cc1 768982923 NLGVREZNVDNJJT-QGZVFWFLSA-N 425.426 4.761 50 10 IJGE O=C(NNc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 775785867 RNQDWFBDLQRJOO-UHFFFAOYSA-N 443.822 4.788 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 1087457737 UNBOXUFZONZSJQ-VXGBXAGGSA-N 433.308 4.879 50 10 IJGE Cc1cc(NNC(=O)c2cc3ccc(C(F)(F)F)cc3nc2O)ccc1Br 1295321715 KCCGVGKGNRBSAQ-UHFFFAOYSA-N 440.219 4.787 50 10 IJGE C#C[C@@H](NC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(Cl)cc1)c1ccccc1 1557178498 OTWPEIUVZRUTGP-HVQRGMKJSA-N 439.906 4.515 50 10 IJGE Cc1cc(CNC(=O)/C(C#N)=C\c2cc(C)n(-c3cccc4ccccc34)c2C)cc(O)n1 1630338958 AUAAZASGMOZJGN-UCQKPKSFSA-N 436.515 4.880 50 10 IJGE Cc1ccc(CNC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(Cl)cc2)CCC3)cc1 1772743791 KYEUNUKGHMXMGA-UHFFFAOYSA-N 449.938 4.950 50 10 IJGE Cc1nn(Cc2ccccc2F)c2c1[C@@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 1865686721 ZSLWWQXKIQRRSK-IBGZPJMESA-N 429.282 4.904 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3-c2ccc(C)cc2)cc1OCC 1865688912 DZECTMCREPULOQ-HSZRJFAPSA-N 444.535 4.759 50 10 IJGE C[C@@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1c(Cl)cccc1Br 1914351878 XYAUXCGBYUXFDT-LBPRGKRZSA-N 437.186 4.921 50 10 IJGE C[C@H](CCCl)N(Cc1ccccc1)C(=O)c1cccc(I)c1 1915084183 XUTRJBCUIFVGEO-CQSZACIVSA-N 427.713 4.951 50 10 IJGE Cc1c(Br)c(CN(Cc2ccccc2)C2(CBr)CCC2)nn1C 1915752041 ZRSCXPVUIURCDZ-UHFFFAOYSA-N 441.211 4.811 50 10 IJGE CCn1cc([C@@H](Br)Cc2ccncc2Br)nc1Br 1924070610 MCJOJSWQLHEOIT-VIFPVBQESA-N 437.961 4.502 50 10 IJGE C[C@]1([C@@H](Br)c2cc(Br)c(Br)s2)COCCO1 1992637610 CKXIMGUCUDONQA-WCBMZHEXSA-N 434.975 4.515 50 10 IJGE C[C@H](CCBr)CCN=[S@@](C)(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C 2044705061 IJBGHXUOOCKYIS-XESHVACXSA-N 441.476 4.835 50 10 IJGE CN1C(=C(C#N)C(=O)COC(=O)C2(c3ccc(Cl)cc3)CCC2)Sc2ccccc21 2053621346 CPTDDZVVIFTLMQ-UHFFFAOYSA-N 438.936 4.851 50 10 IJGE F[C@H]([C@@H](Br)c1cc(I)cc2c1OCC2)C(F)(F)F 2059187375 OBEVXKBWTYXBFM-WCBMZHEXSA-N 438.984 4.563 50 10 IJGE CC(C)[S@@](=O)(=NCC[C@H](C)CCBr)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2063273348 LQRNAKIHKSQKEX-TWKFVSLJSA-N 439.460 4.683 50 10 IJGE Fc1ccc(F)c(-n2nc(CCl)c(I)c2C(F)(F)F)c1F 2079210626 WIDMDSOXDZTWML-UHFFFAOYSA-N 440.512 4.652 50 10 IJGE BrC[C@H]1CCC2(CCC2)CN1Cc1ccc(I)cc1 2095703016 GCPRREDRRSTDSV-OAHLLOKOSA-N 434.159 4.821 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CC2(CBr)CCCC2)CC[C@H]1C(F)(F)F 2106780836 BWIZRSGYUJFTJO-KGLIPLIRSA-N 443.348 4.719 50 10 IJGE CC(C)[C@@H](CBr)CN=[S@@](=O)(CCNC(=O)OC(C)(C)C)c1ccccc1 2107396604 RHABLKFOSOKYFP-YHAMSUFESA-N 447.439 4.705 50 10 IJGE Cc1cc(C(=O)N[C@@H](C)CCCCCI)ccc1Br 2117892112 CCDXFORLSJWFLN-LBPRGKRZSA-N 438.147 4.871 50 10 IJGE O=[N+]([O-])c1ccc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1CBr 2163336608 YOTVIXHWXDVCNO-NRFANRHFSA-N 430.346 4.592 50 10 IJGE Cc1c(Cl)cc(C(=O)NC[C@H](CBr)C(F)(F)F)cc1Br 2167387669 JOKJNLOWTRNXSA-QMMMGPOBSA-N 437.481 4.714 50 10 IJGE CN(C1CCCCCC1)S(=O)(=O)c1cc(CBr)sc1Br 2179787301 MYRFQUBRSLMZMN-UHFFFAOYSA-N 445.242 4.749 50 10 IJGE BrC1CCC2(CC1)CCN(C[C@@H]1CC1(Br)Br)C2 2213089140 VHNSBSNIOPUADR-UNXYVOJBSA-N 430.022 4.522 50 10 IJGE CCC(CC)[C@@H](Br)CNC(=O)c1ccc(C)c(I)c1 2224618500 KVPJXUSARLARRZ-ZDUSSCGKSA-N 438.147 4.529 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)c(Br)cc2n1Cc1csnn1 2234060719 YAXGXGPESWZNQS-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE O=[N+]([O-])c1ccc(N2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)c(CBr)c1 2234719398 NMTQNQXPUMHYAU-BGYRXZFFSA-N 430.346 4.733 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2COC(C)(C)C2)cc1I 2257355150 NXNPZDQTKOTUHE-GWCFXTLKSA-N 425.104 4.551 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)c1cc(F)c(NC(=O)OC(C)(C)C)cc1F 2268202954 QXRXZIWFDLLOCT-PHIMTYICSA-N 433.293 4.557 50 10 IJGE O=C(NC[C@@H](Br)CC(F)(F)F)c1cc(Br)c(F)cc1Cl 2285958919 SAVFRPIHHHFNPY-YFKPBYRVSA-N 441.444 4.687 50 10 IJGE C[C@@H](Br)C[C@H]1CCCCN1Cc1sccc1I 2301076972 RPCVRBNMWAIZIG-GHMZBOCLSA-N 428.177 4.881 50 10 IJGE COc1cc(C=NNC(=O)c2c(C)ccc3ccccc23)cc(Br)c1OC 2323675400 JYUNDHAMAVGOAQ-UHFFFAOYSA-N 427.298 4.692 50 10 IJGE CC(C)c1ccc(NC(=O)C(C#N)=CNc2ccc(I)cc2)cc1 2324241383 QYMKLAGIARVPPU-UHFFFAOYSA-N 431.277 4.873 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@H]([S@@](C)(=O)=NC[C@](C)(CBr)C(C)(C)C)C1 2327092538 LNGHSIQXRFOMAN-RQQMDJRQSA-N 439.460 4.541 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H](Br)C2(CCC2)C1 2327402564 XSKFXEMMEJKEBL-ZDUSSCGKSA-N 440.550 4.694 50 10 IJGE F[C@]1(CBr)CCCN(Cc2cc(I)ccc2Cl)C1 2327404819 LLCPLMJPPAXGHB-ZDUSSCGKSA-N 446.529 4.644 50 10 IJGE CCCOc1ccc(C=C(C#N)c2nc(O)c3cc(OC)c(OC)cc3n2)cc1OCC 2331039526 LXCVASSSMWUGAE-UHFFFAOYSA-N 435.480 4.604 50 10 IJGE COc1c(C)cc(Cl)cc1-c1csc(C(C#N)=C(O)[C@H]2CC(=O)N(C(C)C)C2)n1 2331391750 AAIYLZYIGHADKL-ZDUSSCGKSA-N 431.945 4.830 50 10 IJGE CC1(C)COC[C@@H]1CO[C@H](CI)c1ccccc1Br 2339010111 IXCJLQNWQNTTLB-BXUZGUMPSA-N 439.131 4.614 50 10 IJGE Cc1cc(S(=O)(=O)N(C[C@H](C)Br)C2CCCC2)sc1Br 2368873137 KQBQVZLHUVJDOP-JTQLQIEISA-N 445.242 4.536 50 10 IJGE CCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(C)cc2)c1 38649261 VWOBTEHTEYFIOX-DEOSSOPVSA-N 426.472 4.831 50 10 IJGE Cc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4ccc(Cl)cn4)c(C)c32)cc1 40804683 RANMQEXORDQTGP-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE CCOc1ccc(/C=N\NC(=O)Cc2cc(Cl)ccc2SC)cc1Br 169922771 AGOGXMURYRBJMQ-NHDPSOOVSA-N 441.778 4.916 50 10 IJGE CCOc1c(Cl)cc(/C=N\NC(=O)c2nc(-c3ccccc3)sc2C)cc1OC 169927275 DIFNCQZBLWCSNP-FMCGGJTJSA-N 429.929 4.943 50 10 IJGE O=C(NCCCCCBr)c1cc(Br)cc(Br)c1 232475411 CDMSFUJJYIFMMM-UHFFFAOYSA-N 427.962 4.507 50 10 IJGE Cc1ccc(-n2c(SCC(=O)NN=Cc3ccccc3C)nnc2-c2ccccc2)cc1 263628797 FQJYIRMWXNOFOU-UHFFFAOYSA-N 441.560 4.794 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2cc(Br)ccc2O)[C@@H](CBr)C1 382691385 ABKDIRUOSKOTAS-GWCFXTLKSA-N 435.156 4.500 50 10 IJGE BrCc1c(N2CCC3(CCN(Cc4ccccc4)CC3)C2)nc2sccn12 383374540 KHVXPPPSSZZYHC-UHFFFAOYSA-N 445.430 4.783 50 10 IJGE O=C(CBr)c1cc(OC(F)F)cc(OC(F)(F)F)c1Br 575684553 HBFXXYZJVNIZGM-UHFFFAOYSA-N 427.945 4.527 50 10 IJGE CC(C)N(C[C@H](C)Br)C(=O)c1ccc(Br)cc1Br 691345751 XBCYMABSHBDZPJ-VIFPVBQESA-N 441.989 4.846 50 10 IJGE CC(C)N(C[C@H](C)Cl)C(=O)c1ccc(I)c(Br)c1 721625553 YZCNEBWUDWMOLD-VIFPVBQESA-N 444.538 4.532 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)c1cc(-c2ccco2)n(-c2cccc(Cl)c2)n1 727759893 GSFIUNUWQAORPG-UHFFFAOYSA-N 432.789 4.960 50 10 IJGE O=C(NNc1c(Cl)cc(F)cc1Cl)c1cc(O)nc2ccc(Br)cc12 768006852 DHYLWJDQMVUTJC-UHFFFAOYSA-N 445.075 4.906 50 10 IJGE CCN(CC)c1ccc(C=NNC(=O)c2ccc(NC(=O)c3cccc(C)c3)cc2)cc1 1084128835 WCDDZBWKFVHZBJ-UHFFFAOYSA-N 428.536 4.857 50 10 IJGE CCOc1ccc2ccccc2c1C=NNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 1084245689 LGUCJYDYJGAAOM-UHFFFAOYSA-N 449.510 4.857 50 10 IJGE Cc1cccc(C(=O)Nc2ccc(C(=O)NN=Cc3cccc(Br)c3)cc2)c1 1084591822 QBJLZXXUNJKOQO-UHFFFAOYSA-N 436.309 4.774 50 10 IJGE CC(C)(C)c1ccc(C=NNC(=O)C(=O)Nc2ccc(OCc3ccccc3)cc2)cc1 1084638495 JPEAIAWHROUDSI-UHFFFAOYSA-N 429.520 4.652 50 10 IJGE O=C(NNC(=O)[C@@H](Oc1ccc(F)c(Cl)c1)c1ccccc1)c1ccccc1Cl 1321617379 CILDSHHJAHBPEH-IBGZPJMESA-N 433.266 4.714 50 10 IJGE CC(=O)c1ccc(OC(=O)/C(C#N)=C\c2cc(C)n(C[C@H]3CCCO3)c2C)cc1Cl 1439530765 AIWOWMIVVUHXAC-JZVSFUAJSA-N 426.900 4.653 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNC(=O)Nc1ccc(C)cc1Cl 1467434273 LHVPNIPVLLFOKK-UHFFFAOYSA-N 427.810 4.699 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2cccc(Oc3ccc(Cl)cn3)c2)c1C 1610903677 VCXHHYJYTOVPJI-UHFFFAOYSA-N 446.898 4.753 50 10 IJGE CN(C)c1ccc(/C(O)=C(\C#N)c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)cc1[N+](=O)[O-] 1872747239 UENVUVONUTXAEP-CYVLTUHYSA-N 437.437 4.642 50 10 IJGE Brc1cccc([C@H](CI)O[C@H]2COC3(CCC3)C2)c1 1889722797 QATHZMCDRNBSSU-KGLIPLIRSA-N 437.115 4.653 50 10 IJGE C[C@H](CCCBr)NC(=O)c1cccc(Br)c1Br 1943885947 HSFFKXANNZOEFL-MRVPVSSYSA-N 427.962 4.505 50 10 IJGE C[C@H](CCCCCI)NC(=O)c1ccc(Br)s1 2006106124 YYIORVNWSNCORC-SECBINFHSA-N 430.149 4.624 50 10 IJGE Clc1cc(CN[C@@H](CBr)CC2CC2)ccc1I 2026565190 ZLEHSRGZKJLUJC-LLVKDONJSA-N 428.539 4.598 50 10 IJGE O=C(c1c(Br)cccc1Br)N1CCC[C@H](Br)CC1 2033085695 FZYFRHQGXGIALA-VIFPVBQESA-N 439.973 4.601 50 10 IJGE CC(C)C[C@@H](Br)CNC(=O)c1c(Br)cccc1Br 2033094569 PULDWYMQVINDSF-SECBINFHSA-N 441.989 4.751 50 10 IJGE N#CC(=Cc1ccccc1)C(=O)N=C1N=CC(=NNc2cccc(C(F)(F)F)c2)S1 2040465487 QGWOUCXNHWZOSJ-UHFFFAOYSA-N 427.411 4.738 50 10 IJGE Brc1cc2c(cc1[C@H](Br)C1(Br)CCC1)OCCO2 2049229028 KKWVCUHNJVHUTK-LBPRGKRZSA-N 440.957 4.974 50 10 IJGE FC1(F)C(O[C@@H](CI)c2cccc(Br)c2)C1(F)F 2062572650 CBLMEQVOCZLEDS-QMMMGPOBSA-N 438.984 4.595 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc(CCNC(=O)[C@H](Br)C2CCCC2)c1 2110714451 DAWVEMDEJFWRAU-QGZVFWFLSA-N 425.367 4.646 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1CC[C@H]2CN(Cc3ccccc3)C[C@H]2C1 2112432250 WILGEOBMXGCNPG-HOTGVXAUSA-N 436.375 4.510 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2[C@H]1CN(Cc2ccccc2)C[C@@H]1C 2128517323 FRWWMBVEEMMWTO-GUYCJALGSA-N 433.781 4.934 50 10 IJGE CC1(C)CCC[C@@]1(CCl)NC(=O)c1ccc(I)c(Cl)c1 2150542507 NORMBSRPHDSJMH-HNNXBMFYSA-N 426.125 4.862 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(CBr)cc2)[C@@H](C(C)(C)C)C1 2163051174 QQHJPRRBPNRECJ-QGZVFWFLSA-N 439.394 4.689 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C(=O)[C@H](Br)C2CCCC2)C2(CCCCC2)C1 2167031533 ISAZWNDGSWLFGD-QGZVFWFLSA-N 443.426 4.722 50 10 IJGE CC(C)N(C[C@@H]1CCCN(C(=O)[C@@H](Br)C2CCCC2)C1)C(=O)OC(C)(C)C 2167033371 QYFPZRUSXJTZDU-AEFFLSMTSA-N 445.442 4.824 50 10 IJGE F[C@]12CCC[C@@]1(CCl)CN(Cc1ccc(I)c(Cl)c1)C2 2208029213 JNRMQNWHSFOWQA-CABCVRRESA-N 428.116 4.878 50 10 IJGE CN(CCCCCI)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 2214708451 KJFUUTDKGSWATD-QGZVFWFLSA-N 446.373 4.790 50 10 IJGE COc1ncc(Cl)cc1C(=O)N(Cc1ccccc1)[C@H](CBr)C(C)C 2217962131 XRVQQHPCQQUNKI-QGZVFWFLSA-N 425.754 4.806 50 10 IJGE COC1CC(CO[C@@](C)(CI)c2ccccc2Br)C1 2230120301 UHOXTQKETWMMDK-QOZQQMKHSA-N 439.131 4.541 50 10 IJGE Cc1ccc(I)c(C(=O)N[C@@H](CCBr)C(C)(C)C)c1 2232157896 TWDUPOVINSUDDA-ZDUSSCGKSA-N 438.147 4.529 50 10 IJGE Cc1c(Br)sc(C[C@H](CBr)NC(=O)OC(C)(C)C)c1C 2241392355 MCVXPUULXAMVOJ-SNVBAGLBSA-N 427.202 4.958 50 10 IJGE CC[C@@]1([C@@H](Br)c2ccc(OC)c(I)c2)CCCO1 2257353225 CEZRFJVGXFBAFZ-KBPBESRZSA-N 425.104 4.695 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2OC[C@H]3CCC[C@@H]32)cc1I 2269552869 VLTZEJVSLMFACV-FDRIWYBQSA-N 437.115 4.551 50 10 IJGE C=CC[C@]1(CBr)CCN(C(=O)c2scc(Br)c2Cl)C1 2272179416 NHGIMUPXAFXANN-CYBMUJFWSA-N 427.589 4.967 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@@H]2C[C@@H]3CC[C@H]2C3)CC1 2298751511 MQBZJHLDDCTMJW-PMPSAXMXSA-N 449.373 4.644 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](OC[C@H]2C[C@H]3CCC[C@H]2CC3)C1 2301132085 UXWADPLOJUNPPO-ZOFXXKQRSA-N 449.373 4.642 50 10 IJGE CC[C@H](Cl)CCCNCc1ccc(I)c(Br)c1 2306219145 IYLHEESSFKUCKR-NSHDSACASA-N 430.555 4.941 50 10 IJGE C[C@@H]1CCN(Cc2ccc(I)c(Br)c2)C[C@H]1Cl 2306231477 JYRCJKVSHHZTQV-BXKDBHETSA-N 428.539 4.503 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)cc1[N+](=O)[O-] 2323168635 OXIZKCAUUKREEH-HNNXBMFYSA-N 434.496 4.754 50 10 IJGE CC1(C)[C@@H](Cl)CC[C@@H]1NCc1ccc(I)c(Br)c1 2325213937 WOLPVBTWWZRPCL-STQMWFEESA-N 442.566 4.939 50 10 IJGE Cl[C@H]1CN(Cc2ccc(I)c(Br)c2)CC12CCC2 2325220956 KMWXBYRZHYDVQY-ZDUSSCGKSA-N 440.550 4.647 50 10 IJGE Cl[C@@H]1CN(Cc2ccc(I)c(Br)c2)C[C@H]1C1CC1 2325226222 MISWZIGDHRNAEK-WCQYABFASA-N 440.550 4.503 50 10 IJGE Cc1cc(-c2csc(C(C#N)=C(O)CCc3nc4ccccc4[nH]c3=O)n2)ccc1F 2331322582 OUNBFKHVNWWGIT-UHFFFAOYSA-N 432.480 4.920 50 10 IJGE CCCC(CCC)=NNC(=O)CN(c1ccc(C)c(C)c1)S(=O)(=O)c1ccccc1 5307913 XVELPKOLMWFFDZ-UHFFFAOYSA-N 429.586 4.571 50 10 IJGE CC(C)c1cc(Br)ccc1OCC(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 9231630 WPKNKSKYAYPAPC-UHFFFAOYSA-N 447.373 4.710 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)cc2/C=C(/C#N)C(=O)NCCc2ccccc2)cc1 33658218 HUVULSDZTYYXJA-NKFKGCMQSA-N 448.526 4.814 50 10 IJGE CCCCOc1ccc(/C=N/NC(=O)CSc2nnc(-c3ccccc3)s2)cc1 40947718 YWNKWKGSAHOQLM-HYARGMPZSA-N 426.567 4.626 50 10 IJGE C#CCOc1c(Br)cc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)cc1OCC 59335610 JKGFMOAHEWNXKC-BOPFTXTBSA-N 439.309 4.714 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1SCC(=O)N/N=C(\C)CCCC 59915321 VKFURNPDHWYGIU-HZHRSRAPSA-N 434.997 4.504 50 10 IJGE CCCCCCCOc1ccc(C(=O)NNC(=O)COc2ccc(C(C)C)cc2)cc1 100153558 GJMUNURGXDSOQQ-UHFFFAOYSA-N 426.557 4.999 50 10 IJGE N#C/C(=C/Nc1ccccc1F)c1nc(-c2cc3cc([N+](=O)[O-])ccc3oc2=O)cs1 100480628 YCCAOTSYHXGAIZ-RAXLEYEMSA-N 434.408 4.940 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(C(F)(F)F)ccc2Br)CC[C@H]1Br 167754448 MNMZEMUHLNUMDD-LDYMZIIASA-N 429.074 4.713 50 10 IJGE CCCCCCCOc1ccccc1/C=N/NC(=O)c1cc(-c2ccccc2)nc(O)n1 169923272 GGKRALZDAOPFTI-NLRVBDNBSA-N 432.524 4.962 50 10 IJGE CC[C@@H](NC(=O)/C(C#N)=C\N[C@@H](C)c1ccc(OC)c(OC)c1)c1ccc2c(c1)CCCC2 217189416 CCDOGXUQFZICQM-VZBHIUKOSA-N 447.579 4.908 50 10 IJGE C=CCc1ccccc1OCC(=O)NN=Cc1ccc(OC(=O)/C=C\c2ccccc2)cc1 254346923 FPPODVZTOHXBJW-SYUSKUMASA-N 440.499 4.563 50 10 IJGE CC[C@H](Br)[C@@H](CC)NC(=O)c1cc(Br)sc1Br 313125240 VKWBVNKSVXRVMA-JGVFFNPUSA-N 448.018 4.955 50 10 IJGE CC1(C)[C@@H](Br)CCN1C(=O)c1cc(Br)c(Br)s1 383922939 AIIIGHHRIRGSQY-QMMMGPOBSA-N 446.002 4.661 50 10 IJGE O=C(NNC(=O)[C@@H](Sc1ccccc1F)c1ccccc1)c1cccc2cccnc12 729970831 BZJZRHVXOHKHOD-QFIPXVFZSA-N 431.492 4.669 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N2[C@H]3CC[C@H]2CC(O)C3)c(C)n1-c1cccc2ccccc12 736187467 URQYXYJFHGZJAW-OVXJJRPCSA-N 425.532 4.669 50 10 IJGE Cc1ccccc1CC(=O)NNC(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 763633489 IIVRYORGKGHUCS-CQSZACIVSA-N 442.972 4.714 50 10 IJGE Cc1ccc(-n2c(C)cc(C=NNC(=O)CSCc3ccc([N+](=O)[O-])cc3)c2C)cc1 1083927762 RIHAANCWCLDJDZ-UHFFFAOYSA-N 436.537 4.694 50 10 IJGE COc1ccc(CCC(=O)NN=Cc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c(O)c1 1083982724 QCSMWOQJQFNSIT-UHFFFAOYSA-N 426.557 4.784 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N[C@H](C)c2ccc3nc(O)oc3c2)c(C)n1-c1ccccc1F 1534335197 YWMFPDVSENTWTE-SKCQWOFPSA-N 444.466 4.864 50 10 IJGE CCCc1nn(-c2ccc(C)cc2)c2c1[C@H](c1ccc(OCC)c(OC)c1)C(C#N)=C(N)O2 1865695214 MXTNPKUHZOXOQE-HSZRJFAPSA-N 444.535 4.759 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C[C@@H]1CN(C(=O)OC(C)(C)C)C(C)(C)C1 1881244838 WYJXHRWVZKTXLM-KBPBESRZSA-N 435.403 4.700 50 10 IJGE CCN(C[C@@](C)(CI)OCC(C)(C)C(F)F)C(=O)OC(C)(C)C 1900148952 SJWGWHCWASOACY-MRXNPFEDSA-N 449.320 4.745 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)C(=O)c1ccc(Br)cc1O 1914229245 QYITXTPCSOLSKF-GFCCVEGCSA-N 427.136 4.581 50 10 IJGE Brc1cc(Br)c([C@H](Br)[C@@H]2[C@H]3CCOC[C@H]32)s1 1922892497 AWTSJEITKRYHBD-NAXOPYRSSA-N 430.987 4.992 50 10 IJGE Cc1c(Br)sc([C@@H](Cl)C2CCS(=O)(=O)CC2)c1Br 1922912520 OCPICXWZZFPXHK-VIFPVBQESA-N 436.618 4.686 50 10 IJGE O=C(N[C@H](CCBr)C1CC1)c1cc(Br)sc1Br 1942802336 ADTAKVWMEJEHGV-MRVPVSSYSA-N 446.002 4.567 50 10 IJGE CC(C)(C)OC(=O)N(CC(F)F)[C@H]1CCCN(C[C@@H](CBr)C2CCC2)C1 1966430713 PHXYRYRIJCZVOE-CVEARBPZSA-N 439.385 4.764 50 10 IJGE CC(C)(C)OC(=O)NCCSSCCNc1ccc(C#N)c(Br)c1 2010826828 HWBOPLOXINSOTO-UHFFFAOYSA-N 432.409 4.639 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CCC[C@@H]1CCBr 2031487147 QZOHMMZCGNLMBO-SECBINFHSA-N 439.973 4.601 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CC[C@@H](Br)C(F)(F)CC1 2038684268 OZZKXYDDYCQNDC-MRXNPFEDSA-N 430.314 4.962 50 10 IJGE CC(N)=C(C#N)C(=O)CSc1nnc(Cc2cccc3ccccc23)n1C1CCCCC1 2040425903 HEXVXOWHAONXPO-UHFFFAOYSA-N 445.592 4.945 50 10 IJGE COc1ccc(Oc2cncc(F)c2CBr)cc1I 2087677074 FKGXMSVZVZOCRH-UHFFFAOYSA-N 438.034 4.521 50 10 IJGE O=C(N[C@@H](CCl)c1ccsc1)c1ccc(I)c(Cl)c1 2119041010 XFMGZEHIPKOEJN-LBPRGKRZSA-N 426.106 4.716 50 10 IJGE Clc1cc2c(cc1[C@@H](Cl)c1cc(I)sn1)OCCO2 2120032210 MOVKQONVKXGCND-GFCCVEGCSA-N 428.078 4.501 50 10 IJGE CCc1sc(Br)cc1[C@@H](Br)c1ccc(S(C)(=O)=O)cc1 2146828963 UKIUZLGOQSEZEH-AWEZNQCLSA-N 438.206 4.961 50 10 IJGE CN(CCc1ccc(NC(=O)[C@H](Br)C2CCCC2)cc1)C(=O)OC(C)(C)C 2167032540 NATGTAVMIUJBFN-GOSISDBHSA-N 439.394 4.988 50 10 IJGE Fc1cc(Br)cc2c1nc(CCCl)n2C[C@H]1CCN1Cc1ccccc1 2224707522 FBRHSVWCNIPQCA-MRXNPFEDSA-N 436.756 4.994 50 10 IJGE CCOCc1cc(Br)c([C@H](Br)[C@H]2OCCOC2(C)C)s1 2233019572 PGDYGBOHWJYZBA-WCQYABFASA-N 428.186 4.677 50 10 IJGE COc1ccc([C@H](Br)C[C@@H]2OCC[C@H]2C)cc1I 2257368796 JQFGWWIVUJZPRR-UDZFHETQSA-N 425.104 4.551 50 10 IJGE Cc1cc(Br)sc1[C@@H](Br)c1cscc1S(C)(=O)=O 2260093498 YFNFSFDIKHYCFK-JTQLQIEISA-N 430.208 4.768 50 10 IJGE CC(C)N(C[C@H]1CCCN(CC2(CBr)CC(F)C2)C1)C(=O)OC(C)(C)C 2265632180 LFNUIEVLSKLQAZ-VXESANQCSA-N 435.422 4.857 50 10 IJGE COc1ccc([C@@H](Br)C23CCC(CC2)OC3)cc1I 2269547075 CDOUWNBYGDQPHH-XGTXGMFGSA-N 437.115 4.695 50 10 IJGE Cc1sc([C@H](Br)[C@]23CCC[C@@H]2CS(=O)(=O)C3)c(Br)c1C 2279098731 YPNFBNACAKYXJP-SWHYSGLUSA-N 442.238 4.778 50 10 IJGE C[C@H]1[C@H](Br)C[C@@H](C)CN1C(=O)c1cc(F)c(Br)cc1Cl 2282971416 CEUYPDHOEQJFRS-KHQFGBGNSA-N 427.539 4.876 50 10 IJGE CCOC(=O)C(C#N)=C1S[C@@H](Cc2cccc(Cl)c2)C(=O)N1c1ccc(C)cc1 2293039085 BBXIIOBUOSUWJV-IBGZPJMESA-N 426.925 4.638 50 10 IJGE Clc1ccc(CN2CCC[C@@H]2CCBr)c(I)c1 2302325255 FMYALZVAZOWSEC-GFCCVEGCSA-N 428.539 4.694 50 10 IJGE ClC[C@H]1CCCCN1Cc1ccc(I)c(Br)c1 2306229930 YZKPENLRCLQKNQ-LLVKDONJSA-N 428.539 4.647 50 10 IJGE COc1ccc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)C[C@@H](C)CC4)cc1Br 2318415972 ZCGTXLHLEYFQPM-ZDUSSCGKSA-N 440.341 4.828 50 10 IJGE CCN(CC)c1ccc(NC=C(C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c(C)c1 2320906826 SXSKSWRXJKJPDP-UHFFFAOYSA-N 427.892 4.861 50 10 IJGE CC1(C)C[C@H](CBr)CN1Cc1cc(I)ccc1Cl 2327405645 DQBBSNZRMAHCKA-SNVBAGLBSA-N 442.566 4.940 50 10 IJGE Cn1nc(C(F)(F)F)c(CBr)c1N(Cc1ccccc1)[C@@H]1COC(C)(C)C1 2365280874 BBJKMHUWSPFARE-AWEZNQCLSA-N 446.311 4.908 50 10 IJGE CCOc1cccc(N2CCN(Cc3ccccc3)CC(F)(F)C2)c1CBr 2367574492 VTBNJCVVAMBUQS-UHFFFAOYSA-N 439.344 4.938 50 10 IJGE C[C@H]1CN(c2nccc(N(C)C)c2CBr)[C@H](C)[C@@H](C)N1Cc1ccccc1 2377484545 IOAFYGIGQPXDKF-RCCFBDPRSA-N 431.422 4.530 50 10 IJGE CCOc1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C(=O)OC)c3)c2C)cc1 2306801 NVUQOEWPWIUOPS-KGENOOAVSA-N 443.503 4.825 50 10 IJGE CCOc1cc([C@H]2CC(=O)N3CN(c4ccc(C)c(C)c4)CSC3=C2C#N)ccc1O 6089720 XYQUFKWVWKDXQL-LJQANCHMSA-N 435.549 4.627 50 10 IJGE O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)NNC(=O)CC12CC3CC(CC(C3)C1)C2 14335788 HKTWRYHNTQRMSH-UHFFFAOYSA-N 441.959 4.682 50 10 IJGE CCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\NC(c1ccccc1)c1ccccc1 217154546 XTAOMNAMKDHIBF-UZYVYHOESA-N 425.488 4.588 50 10 IJGE CC[C@H](Oc1ccccc1[C@@H](C)CC)C(=O)NNC(=O)[C@H](C)Oc1ccc(C)c(C)c1 251374790 RRKFUUNEEZNTSM-BPXKWBHBSA-N 426.557 4.589 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)C1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12 383294326 XBXXSJHBQHUUDL-HVLUCRTBSA-N 445.138 4.954 50 10 IJGE C[C@H](NC(=O)c1ccc(Br)cc1Br)C1(CBr)CC1 696075334 CSRMSKJAFOPYJA-QMMMGPOBSA-N 439.973 4.505 50 10 IJGE CC(C)[C@@H]1CN(c2nc3sccn3c2CBr)CCN1Cc1ccccc1 704739082 NCSJMTZSAUZKCT-SFHVURJKSA-N 433.419 4.638 50 10 IJGE C[C@@H](Oc1ccc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cn1)c1ccccc1 799750510 CYLUMEMAVFLSHA-CQSZACIVSA-N 426.398 4.869 50 10 IJGE CCOc1cc(/C=C(/C#N)C(=O)NC2CC2)ccc1OCc1ccc(Br)cc1 1084046434 RJBSSBYWDFGDSW-BOPFTXTBSA-N 441.325 4.612 50 10 IJGE O=C(NN=C1C(=O)N(Cc2ccccc2Cl)c2ccccc21)c1nc2ccccc2s1 1084057785 WCFJFANXTDEJSA-UHFFFAOYSA-N 446.919 4.631 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2cc(C)n(-c3cccc(F)c3)c2C)cc1 1084584556 CQJRNGOBYMLQRL-DEOSSOPVSA-N 437.515 4.596 50 10 IJGE C#CCN(C(=O)[C@H](Br)C(C)(C)C)[C@@H]1CCOc2ccc(Br)cc21 1617600640 MTHSSTVXQKJLCK-ZBFHGGJFSA-N 443.179 4.544 50 10 IJGE C[C@H](c1cc(Br)ccc1F)[C@H](CBr)NC(=O)OC(C)(C)C 1885098289 XMVBMBNWKYPSIK-RNCFNFMXSA-N 425.136 4.980 50 10 IJGE C[C@H](CCl)N(Cc1ccccc1)C(=O)c1cccc(F)c1I 1914225896 BQXITGGGZIYSNM-GFCCVEGCSA-N 431.676 4.700 50 10 IJGE O=C(C1CC1)[C@H](Br)Cc1ccc(Cl)c(I)c1Cl 1945187804 FKRZJEVEGZIHTP-MRVPVSSYSA-N 447.925 4.883 50 10 IJGE Brc1ccc(Br)c(CN2CCC[C@H](Br)CC2)c1 2006508086 OKPRHZCFIJKKIK-NSHDSACASA-N 425.990 4.961 50 10 IJGE Cc1cc(Br)c([C@@H](Br)c2ccsc2S(C)(=O)=O)s1 2033135022 JBBFXJQANSCTRP-VIFPVBQESA-N 430.208 4.768 50 10 IJGE BrC[C@@H]1C[C@H]2CC[C@H]1N2Cc1cccc(Br)c1Br 2039487721 JNSYZZFYZKXGAO-DMDPSCGWSA-N 438.001 4.959 50 10 IJGE C[C@@H]1CN(Cc2cc(Cl)ccc2I)CC[C@@H]1CBr 2046687346 RKIFUCSUDQEKLB-GHMZBOCLSA-N 442.566 4.798 50 10 IJGE CCC[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]1C(F)(F)F 2052479126 MWBKKEBTPIRXSC-BFHYXJOUSA-N 431.337 4.670 50 10 IJGE Cn1ncc(C[C@H](CBr)c2ccc(Br)cc2)c1Br 2053032341 YNGQXRGRIMAJEU-SNVBAGLBSA-N 436.973 4.666 50 10 IJGE CCCC(CBr)(CCC)CN(C)[C@]1(CNC(=O)OC(C)(C)C)CCOC1 2106784420 IMWYTLNGMUFXAK-FQEVSTJZSA-N 435.447 4.584 50 10 IJGE C[C@H]1[C@H](Br)C[C@H]2CC[C@H]1N2C(=O)c1cc(Br)c(Cl)s1 2115941800 DQGZTGUNNWKZFH-OKJYPTKPSA-N 427.589 4.941 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCC[C@@H](NC(=O)c2ccc(CBr)cc2)C1 2162592880 YPBIXVRGYWDDSG-CRAIPNDOSA-N 439.394 4.785 50 10 IJGE CO[C@@]1(CBr)CCCN(Cc2cc(Cl)c(C)c(Br)c2)C1 2167385960 RHHGYKGHYDOVII-OAHLLOKOSA-N 425.592 4.787 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)C[C@@H]1CC1(Br)Br 2208937836 ZVFKUUWRYANRID-AAEUAGOBSA-N 440.017 4.778 50 10 IJGE Cc1cc(Br)c([C@@H](Br)[C@@H]2CCCS2(=O)=O)c(C)c1Cl 2224302916 QCSMZVPAIGUARN-JQWIXIFHSA-N 430.589 4.733 50 10 IJGE CC1CC(CBr)(CN2CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]2C(F)(F)F)C1 2265307683 JHXYSBWUZZVTIN-YXXKGXSTSA-N 443.348 4.670 50 10 IJGE Cc1c(CBr)cccc1NC(=O)c1cccc(I)c1 2268261503 JICMVQAQIZVVTA-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE Cc1cc(Br)c([C@@H](Cl)[C@H]2C[C@H](S(C)(=O)=O)C2)cc1Br 2269883282 IUDQTVPFJZJSHF-RVBZMBCESA-N 430.589 4.623 50 10 IJGE COc1cc(NCCSSCCNC(=O)OC(C)(C)C)c(Cl)cc1[N+](=O)[O-] 2279139030 HHHVGXMCAKLYFU-UHFFFAOYSA-N 437.971 4.575 50 10 IJGE CC(C)(C)[C@@H]1[C@H](Cl)CCN1C(=O)c1ccc(Cl)c(I)c1 2283670707 VINYCEBWXYBUSZ-YPMHNXCESA-N 426.125 4.813 50 10 IJGE Cc1sc(Br)cc1S(=O)(=O)N(CCBr)CCC(C)(C)C 2289889471 HNDUYQZFCXWDTH-UHFFFAOYSA-N 447.258 4.641 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCc2ccco2)ccc1OCCOc1ccc(C)cc1C 2293294608 KXSCVLLUHWOPLC-UHFFFAOYSA-N 446.503 4.586 50 10 IJGE COc1c(Br)cc(Cl)c(C)c1[C@@H](Cl)c1nn(C)nc1Br 2295282836 GNGLQQBANPURGV-SECBINFHSA-N 443.954 4.639 50 10 IJGE CC1=C(C#N)C(=O)N([C@@H](C)c2ccccc2)C(=O)C1=CNc1cccc(C(F)(F)F)c1 2314585760 RSJZYMHXPQKARE-HNNXBMFYSA-N 425.410 4.971 50 10 IJGE Clc1ccc(C[C@H](CBr)C2CCOCC2)cc1I 2315550810 IRPOUITWNBRBTN-GFCCVEGCSA-N 443.550 4.925 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cc(F)c(Cl)cc1F 2320361761 UIECDTKHVNUWFI-ZDUSSCGKSA-N 432.692 4.718 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)cc(Cl)c1OC 2323150929 YYOYYISCOPMRMJ-UHFFFAOYSA-N 425.916 4.871 50 10 IJGE CC(C)[C@H]1[C@H](Br)CCN1Cc1cc(I)ccc1Cl 2327407708 UQUIJPZTDUZAHE-OCCSQVGLSA-N 442.566 4.938 50 10 IJGE N#CC(=C(O)CN1C(=O)c2ccccc2C1=O)c1nc(-c2ccc3c(c2)CCCC3)cs1 2331240120 SYHQNIGHUJBTTF-UHFFFAOYSA-N 441.512 4.778 50 10 IJGE COc1ccc(C)cc1-c1csc(C(C#N)=C(O)[C@H](C)N2C(=O)c3ccccc3C2=O)n1 2331322928 JUSMKNSNHNSDKQ-AWEZNQCLSA-N 445.500 4.605 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)C(=O)[C@]12CO[C@](C(F)(F)F)(C1)C2 2338484309 VXMBFGNJMHJCCD-KBAYOESNSA-N 434.296 4.546 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)C[C@H]3C2)C1 2345010874 OQZCMEBPRXWNLY-ULQDDVLXSA-N 429.443 4.813 50 10 IJGE CCCCC(=O)Nc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2[C@@H](C)CC)cc1 9873971 NWCMILZYRUSGCF-ZWKOTPCHSA-N 439.556 4.557 50 10 IJGE Cc1ccccc1C(=O)NNC(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1 12491976 XGYZRZSAWCMTGK-UHFFFAOYSA-N 429.520 4.620 50 10 IJGE C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1 14665994 NYJWMWLPUVBAKJ-QZTJIDSGSA-N 434.536 4.520 50 10 IJGE CCOc1ccc(Br)cc1/C=C(/C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1C 34861266 NCOQKOJXSIQXCF-ZROIWOOFSA-N 430.258 4.610 50 10 IJGE Cc1cccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2cccc(Cl)c2)c1 38651187 ZRDOPGURKUXCME-XMMPIXPASA-N 446.890 4.851 50 10 IJGE Cc1cccc(C)c1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cccs1 38656396 UCUQVIDFZZNRDH-JOCHJYFZSA-N 432.501 4.568 50 10 IJGE CCCCCCOc1ccc(/C=N/NC(=O)COc2ccccc2Br)cc1 40912118 ITNDPIBLQQFVNG-HZHRSRAPSA-N 433.346 4.937 50 10 IJGE ClCc1ccn(-c2c(Br)cc(Br)cc2Br)n1 91301051 DIQHANFZSAPVKG-UHFFFAOYSA-N 429.337 4.899 50 10 IJGE COc1ccc(CCNC(=O)/C(C#N)=C\Nc2ccc(Nc3ccccc3)cc2)cc1OC 216783444 XFZMWKKXTMIUFF-ZZEZOPTASA-N 442.519 4.626 50 10 IJGE Cc1cccc(N2CCN(/C=C(/C#N)C(=O)Nc3cccc(Cl)c3Cl)CC2)c1C 217129143 ZIZNSKBFEBCVEE-VKAVYKQESA-N 429.351 4.778 50 10 IJGE O=C(NC[C@@H]1CC[C@@H](Br)C1)c1cc(Br)cc(Br)c1 227678394 KCXUKOODNNSTRL-PSASIEDQSA-N 439.973 4.505 50 10 IJGE CC(C)c1ccc(OCC(=O)NN=Cc2ccc(OC(=O)c3ccccc3F)cc2)cc1 254303305 TUAZXIYTYUPYCA-UHFFFAOYSA-N 434.467 4.697 50 10 IJGE FC(F)Oc1cc(Br)cc(I)c1CBr 575682437 QKMAZVXFCATJDW-UHFFFAOYSA-N 441.835 4.550 50 10 IJGE C[C@H]1[C@H](CBr)CCN1C(=O)c1scc(Br)c1Br 705426888 PFTLELSNUNDROA-BQBZGAKWSA-N 446.002 4.519 50 10 IJGE CCc1cccc(C)c1NC(=S)NNC(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 741298724 GTDRERLFZUKJTC-JKSUJKDBSA-N 437.487 4.577 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCCCCO[C@H]2CCC[C@H](C)C2)c1C 767150167 MWVYKCWKCVBKEC-UWJYYQICSA-N 425.577 4.754 50 10 IJGE COc1ccc(Oc2ccc(Cl)cc2NC(=O)C(=O)NNc2ccccc2C)cc1 783331119 GWFNNQQJAWMFRG-UHFFFAOYSA-N 425.872 4.531 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNc2cc(Cl)nc3ncccc23)cc1 1303439397 DFSPYKZASZRVIR-UHFFFAOYSA-N 431.883 4.986 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Cl)CCc1ccc(Br)cc1Cl 1905341913 FRUKGOBHTSLCOP-ZDUSSCGKSA-N 427.125 4.939 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1Cc1csnc1Br 1926872351 LDPQHRPRGQSFLC-LURJTMIESA-N 436.560 4.761 50 10 IJGE CC1(C)CC[C@]2(CC[C@@H](CI)O2)[C@@H](CNC(=O)OC(C)(C)C)C1 1927121582 JTHSQUZVHBNOLG-QWQRMKEZSA-N 437.362 4.690 50 10 IJGE CCCc1ccc([C@H](Br)c2cnn(C)c2I)s1 1940257458 AEHOHLHFQTWAIK-LLVKDONJSA-N 425.133 4.523 50 10 IJGE CCc1cc(Br)c([C@H](Cl)c2cnn(C)c2I)s1 1942097437 IABUHSIYTJDMTD-SECBINFHSA-N 445.551 4.739 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1C1CCN(C[C@H](CBr)C2CCC2)CC1 1966156377 KPHLIDURVNWASY-RBUKOAKNSA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CC[C@@H](CI)O2)C12CCCC2 1994328391 TWSJNLIARTVSJR-KSSFIOAISA-N 435.346 4.683 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@H](CI)O2)C[C@H]1C1CCC1 2018371873 PGNLCWWHODEIAI-JTDSTZFVSA-N 449.373 4.929 50 10 IJGE Cc1cc(Br)c(NC(=O)[C@H]2C[C@@H](Br)C2)c(Br)c1 2020158557 BWEVMXRZXRAOFK-OCAPTIKFSA-N 425.946 4.632 50 10 IJGE CCCC(CBr)(CCC)CN=[S@@]1(=O)CC[C@@H](NC(=O)OC(C)(C)C)C1 2044700067 PHQGKHYXCTWQKG-SGANQWHYSA-N 439.460 4.733 50 10 IJGE O=C(CBr)c1cc(C(F)(F)F)cc(Br)c1OC(F)(F)F 2054797584 ARQRCELYMVJMPC-UHFFFAOYSA-N 429.936 4.944 50 10 IJGE COc1cc2c(cc1OC)[C@@H](c1cccc(F)c1)N(C(=O)C(C#N)=Cc1ccccc1)CC2 2077614707 GJCHHFIJSFBNPA-AREMUKBSSA-N 442.490 4.924 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1ccc(Cl)cc1Br 2081235058 ATRXWCZYADUYRH-PELKAZGASA-N 444.538 4.682 50 10 IJGE CCCC(CBr)(CCC)CN1CCO[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C1 2106780816 BVFKWVHHZWBYMY-DLBZAZTESA-N 435.447 4.582 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2C1[C@H]2CN(Cc3ccccc3)C[C@H]12 2128511374 ITMJGBQFVGOLJN-GJZGRUSLSA-N 431.765 4.544 50 10 IJGE O=C(c1cccc(OCc2ccccc2)c1)N1C[C@@H](C(F)(F)F)[C@@H](CBr)C1 2163357767 FEOWUSJHNKFFLQ-FUHWJXTLSA-N 442.275 4.911 50 10 IJGE CN(C(=O)c1cc(Cl)cc(Br)c1)[C@H](CCBr)C(F)(F)F 2178516344 VKNOTSQWRXCAGC-SNVBAGLBSA-N 437.481 4.890 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(Cc3ccc(CBr)cc3)C[C@@H]21 2182844637 GUFIHUOWYUAMRY-WCIQWLHISA-N 435.406 4.659 50 10 IJGE FCC12CC(COc3c(Br)cc(Br)cc3CCl)(CO1)C2 2202753119 AQPBEMWJKWXHJT-UHFFFAOYSA-N 428.523 4.848 50 10 IJGE COc1ccc([C@H](Br)[C@@H](F)C(F)(F)F)cc1I 2248896843 VUVYCGWKNGTNMN-DTWKUNHWSA-N 426.973 4.636 50 10 IJGE CC1(C)[C@H]2CC[C@@H](C2)[C@]1(CI)O[C@@H]1CCN(Cc2ccccc2)C1 2250379986 DZWXRQWHWBSEQY-HUUJSLGLSA-N 439.381 4.907 50 10 IJGE COc1ccc([C@@H](Cl)c2cn(C)c(Br)n2)c(Br)c1Cl 2268263466 HZZJPTIMZSBORM-SNVBAGLBSA-N 428.939 4.935 50 10 IJGE CCn1nc(C)c(CBr)c1N1CCC[C@@]2(CCN(Cc3ccccc3)C2)C1 2281295167 CPOSPMGBEVBHAS-QFIPXVFZSA-N 431.422 4.599 50 10 IJGE CO[C@@H]1CC([C@@H](Cl)Cc2cc(Br)cc(Br)c2)C[C@H]1OC 2295332510 XSMUUHUUSDRZCL-RRFJBIMHSA-N 426.576 4.802 50 10 IJGE C[C@H](CBr)[C@@H]1CCCCN1Cc1sccc1I 2301076166 IQPFYEVLNXZXNZ-PWSUYJOCSA-N 428.177 4.738 50 10 IJGE CC1(C)COC[C@@]1(CBr)Cc1cc(Cl)ccc1I 2314641291 FRMJWWYSIUIXFL-AWEZNQCLSA-N 443.550 4.925 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)CCCOc2ccc(C)cc2C)cc1 2314785823 QOBZTQWOLWYODZ-UHFFFAOYSA-N 434.536 4.891 50 10 IJGE BrC[C@@]12CC[C@@H](C1)N(Cc1c(Br)cccc1Br)C2 2314907486 KBHFRNKUYIJGBU-IINYFYTJSA-N 438.001 4.961 50 10 IJGE C[C@H]([C@@H](Cl)c1c(Cl)cc(Br)c(F)c1Br)S(C)(=O)=O 2315454146 UICPXRPRMPXYPY-ALFREKQPSA-N 442.959 4.717 50 10 IJGE C[C@H](CBr)CN1CC[C@H](CCNC(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2315864889 WQTDTASGPSHVMA-RDBSUJKOSA-N 431.337 4.575 50 10 IJGE CCN(CC)Cc1ccc(C=NNC(=O)c2ccc(-c3ccc(F)cc3F)nc2C)cc1 2321244565 ZMAPYSAMLZBZND-UHFFFAOYSA-N 436.506 4.941 50 10 IJGE C[C@@]1(CCl)C=CCCN1Cc1ccc(I)c(Br)c1 2325207685 QTPBOYQUWBQYOA-AWEZNQCLSA-N 440.550 4.813 50 10 IJGE CC1CC(CCl)(CNCc2ccc(I)c(Br)c2)C1 2325232597 CWWRYVHMXUBZLX-UHFFFAOYSA-N 442.566 4.798 50 10 IJGE CCCc1sc(Br)cc1[C@H](Br)[C@@H]1CCCCS1(=O)=O 2338018400 BFOWGLMOSZJFLL-AAEUAGOBSA-N 430.227 4.866 50 10 IJGE BrC[C@H]1C[C@@H]2C[C@H](C1)CN(Cc1ccc(I)cc1)C2 2343242240 LKWNPQHELIYHDL-QDMKHBRRSA-N 434.159 4.534 50 10 IJGE CC1(C)C[C@H](Cl)C[C@@H](NC(=O)c2ccc(Cl)cc2I)C1 2365587813 BNVIHRNMAREKCZ-GHMZBOCLSA-N 426.125 4.861 50 10 IJGE COc1cc(/C=N\NC(=O)c2cccnc2)ccc1OCc1ccc(Cl)cc1Cl 33341407 GYVHAZWEUOGDOM-GATIEOLUSA-N 430.291 4.740 50 10 IJGE CCOc1ccc(/C=C2/C(=O)N(Cc3ccccc3Cl)C(=O)C(C#N)=C2C)cc1OC 38608753 VGLWANXRMXWXRS-WOJGMQOQSA-N 436.895 4.540 50 10 IJGE CCc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccccc2F)cc1 38652233 JAXSRTSXHOVSKF-RUZDIDTESA-N 444.462 4.591 50 10 IJGE Nc1c(NNC(=O)c2ccc(Cl)cc2)ncnc1NC(c1ccccc1)c1ccccc1 40783659 DWHYNUQAHJGPHH-UHFFFAOYSA-N 444.926 4.671 50 10 IJGE C[C@@H](Br)C(C)(C)NC(=O)c1cc(Br)ccc1Br 161245388 NDHOSDXFDLAAIF-SSDOTTSWSA-N 427.962 4.503 50 10 IJGE CC(C)(C)Oc1ccc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4O)nc3c2)cc1 169926509 QYFNJMUDACMPMX-CVKSISIWSA-N 428.492 4.877 50 10 IJGE CCOc1cc(/C=N\NC(=O)Nc2ccc(Cl)cc2)cc(Br)c1OC 169943175 OEBXSLBESJKKGR-JMIUGGIZSA-N 426.698 4.665 50 10 IJGE CC(C)(C)OC(=O)N1CCN(/C=C(/C#N)C(=O)NC2CCCCCCCCCCC2)CC1 217260222 PCJZIUSSBZSPLY-MRCUWXFGSA-N 446.636 4.736 50 10 IJGE COc1ccc(-c2cc(C(=O)NN=C/C=C\c3ccco3)c3ccccc3n2)c(OC)c1 252593989 BOARPFLFGYMSOK-NADFZCFGSA-N 427.460 4.941 50 10 IJGE CC(C)(CBr)CCNC(=O)c1cc(Br)sc1Br 395164778 KPASFBGASDTUPD-UHFFFAOYSA-N 448.018 4.814 50 10 IJGE COCc1nc(-c2cc(Br)ccc2I)oc1CCl 401124952 LOUCPNHJJSTSEZ-UHFFFAOYSA-N 442.478 4.594 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2nc3c(s2)C(=O)CCC3)c(C)n1-c1ccccc1F 727713480 CVTCNZKUKLGQEK-WJDWOHSUSA-N 434.496 4.754 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N(C)[C@H](c2ccccc2)C(F)(F)F)c1C 728499465 UOIWQIAXRAZKHC-CARVDOJZSA-N 433.474 4.981 50 10 IJGE Cc1nc([C@H]2CCCCN2C(=O)/C(C#N)=C\c2cc(C)n(-c3ccccc3C)c2C)no1 737613813 BAHGOAVBFRJIAD-LJJBLSSYSA-N 429.524 4.755 50 10 IJGE COc1ccccc1[C@@H](NC(=O)NNC(=O)c1ccc(Cl)cc1)c1ccccc1Cl 745842823 ODXKYMPDEHMSGI-FQEVSTJZSA-N 444.318 4.736 50 10 IJGE Cc1c(NNC(=O)c2cc(-c3ccc(F)cc3)nc3onc(C4CC4)c23)cccc1[N+](=O)[O-] 748673679 MXTOZRCTGRLBFR-UHFFFAOYSA-N 447.426 4.880 50 10 IJGE O=C(NN=Cc1ccc(OCc2ccc(F)cc2)cc1)c1cccc(Br)c1 1084332924 NMIGSSMSZNASST-UHFFFAOYSA-N 427.273 4.931 50 10 IJGE O=C(CSc1ccc(C=NNC(=O)c2cc3ccccc3cc2O)o1)Nc1ccccc1 1084563909 WHBZHJGQRSMCBY-UHFFFAOYSA-N 445.500 4.633 50 10 IJGE Cc1cc(C=NNC(=O)CC[C@H](O)c2ccccc2)c(C)n1-c1ccc(F)c(Cl)c1 1084637573 GNOSQIRMUGGAPY-QFIPXVFZSA-N 427.907 4.851 50 10 IJGE CN1C[C@H](CI)[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 1614615026 LJSXDRZKHBVHIS-CABZTGNLSA-N 437.165 4.804 50 10 IJGE Cc1ccc([C@H]2CN(Cc3ccccc3)C[C@H]2CI)cc1[N+](=O)[O-] 1614691906 JRMKCIQWMPTELL-QZTJIDSGSA-N 436.293 4.554 50 10 IJGE CC(=O)c1ccc(OS(=O)(=O)c2ccc(CCCCl)cc2)c(Br)c1 1655900820 IHLZDQPORVHIOP-UHFFFAOYSA-N 431.735 4.591 50 10 IJGE CCOc1ccccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1cccs1)CCC2 1772750190 ZDQOBEIJWIAHHW-UHFFFAOYSA-N 437.521 4.771 50 10 IJGE CCc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 1865699869 FESKVRBAKOLSED-OAQYLSRUSA-N 447.901 4.986 50 10 IJGE COc1ccc(C)cc1-c1csc(/C(C#N)=C(\O)[C@H](C)N2C(=O)c3ccccc3C2=O)n1 1873920761 JUSMKNSNHNSDKQ-DLFJBECYSA-N 445.500 4.605 50 10 IJGE CC(C)N(C[C@H]1CCCN1C(=O)OC(C)(C)C)CC(C)(C)CI 1904653487 MJDFQKOKMNBOEK-OAHLLOKOSA-N 438.394 4.558 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCC(CNC(=O)OCc2ccccc2)CC1 1905524383 LPXJVUOLMWEIPC-FQEVSTJZSA-N 425.411 4.682 50 10 IJGE CC1CC(CBr)(NC(=O)c2cc(Br)sc2Br)C1 1999811476 BFDQITMIXQCXHR-UHFFFAOYSA-N 446.002 4.567 50 10 IJGE CCC[C@H](Br)CCNC(=O)c1cc(Cl)ccc1I 2029922237 KLKNDHPKVKPJOA-VIFPVBQESA-N 444.538 4.628 50 10 IJGE COc1ccc(C2=CSC(=C(C#N)c3nnc4n3-c3ccccc3SC4)N2C)cc1 2040470104 DUMNPOCCCQEIBZ-UHFFFAOYSA-N 431.546 4.751 50 10 IJGE CC(C)(C)OC(=O)NCCCN(C[C@@H](CBr)CC1CC1)CC(F)(F)F 2050064063 QXYWROJVJMAWCH-CQSZACIVSA-N 431.337 4.577 50 10 IJGE CC1(C)C(Cl)C(C)(C)C1Nc1ncc(I)cc1Br 2069537892 QNCTXRFBHNVZNV-UHFFFAOYSA-N 443.554 4.903 50 10 IJGE C[C@@]1(CCBr)CCN1C(=O)c1cc(Br)ccc1Br 2084700959 SYWKYUAOBWLSHS-CYBMUJFWSA-N 439.973 4.601 50 10 IJGE C[C@@H]1CC[C@@H](CBr)CN1Cc1ccc(I)c(Cl)c1 2086662699 WTROMBPZCPPNDX-PWSUYJOCSA-N 442.566 4.940 50 10 IJGE O=S1(=O)CCCC[C@H]1[C@H](Br)c1cc(Br)c(Cl)cc1F 2097835180 QNFJLAFNPLOEGB-NWDGAFQWSA-N 434.552 4.645 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]23CCC[C@@]2(CN(Cc2ccc(CBr)cc2)C3)C1 2182844670 HAVVBIWXECMLGF-FGZHOGPDSA-N 435.406 4.805 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC2(CCOCC2)N(C[C@H](CBr)C(C)(C)C)C1 2193493715 FBKMIIYSTZPDKW-DLBZAZTESA-N 447.458 4.582 50 10 IJGE O=S(=O)(Nc1ccc(Cl)cc1CBr)C1CC(OCc2ccccc2)C1 2223198782 NPONDZQAMZUBTE-UHFFFAOYSA-N 444.778 4.724 50 10 IJGE BrCC1(OCCOCCOCCOCc2ccccc2)CCCCCC1 2227781527 YFIOGHJFVUXPMM-UHFFFAOYSA-N 429.395 4.741 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(CCC[C@H](CI)O2)C[C@H]2CCCC[C@@H]21 2246608479 ZNWJAJNWMMAMIA-JEWRLFTDSA-N 449.373 4.929 50 10 IJGE COc1ccc([C@H](Br)c2sccc2F)cc1I 2248884591 HADAGJBNYRJKIN-NSHDSACASA-N 427.076 4.985 50 10 IJGE O=C(c1scc(Br)c1Cl)N(CCBr)CC(F)(F)F 2253544892 LHAVSWJRMYNVNL-UHFFFAOYSA-N 429.483 4.563 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1C(=O)c1c(Br)cccc1Br 2260390373 YQKFLDSKPYIPAM-LDYMZIIASA-N 439.973 4.600 50 10 IJGE O=C(c1cccc(Cl)c1Br)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Br)C2 2283142358 JDDXYLMQHYZERX-XSIYEUOJSA-N 425.523 4.581 50 10 IJGE COc1ccc([C@@H](Br)c2ccc3c(c2)COC3)cc1I 2285017496 ZTFLTZBQHHLPMX-INIZCTEOSA-N 445.094 4.814 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Br)[C@@]12COC[C@H]1C2(F)F 2295366299 YSYGWCSDXCFOQD-ADEWGFFLSA-N 432.486 4.829 50 10 IJGE CC1(C)CC[C@H](CBr)N(Cc2sccc2I)C1 2301074884 WXBSRNTXOUWIEG-SNVBAGLBSA-N 428.177 4.738 50 10 IJGE CN(Cc1ccc(Cl)cc1I)CC(C)(C)CBr 2302318511 ULKKIAPCLVTDBX-UHFFFAOYSA-N 430.555 4.798 50 10 IJGE CC(C)[C@@H]1C[C@H](Br)CN1Cc1ccc(Cl)c(I)c1 2321369928 WMSGEMOHJRVVRG-FZMZJTMJSA-N 442.566 4.938 50 10 IJGE CCCCCCCCCOc1ccc(C=NNC(=O)c2cccn(C)c2=O)c(Cl)c1 2323627778 VSTYEJRDMVFWPJ-UHFFFAOYSA-N 431.964 4.932 50 10 IJGE COc1cc(F)c(F)cc1[C@@H](Cl)c1c(Br)c(Br)nn1C 2364235494 PIAMGCVUEMDKJC-SNVBAGLBSA-N 430.474 4.560 50 10 IJGE CN(CC1CC(Br)C1)[C@@]1(C(=O)O)CCC(C)(C)C[C@@H]1OCc1ccccc1 2374314326 QPUWQBALYRUTLC-VLMZZQAOSA-N 438.406 4.711 50 10 IJGE Cc1cc2c(c(=O)n1Cc1ccccc1)[C@@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 2352801 JNPDJAGJDBKBIV-LJQANCHMSA-N 438.314 4.730 50 10 IJGE CCn1c2ccccc2c2cc(NC(=O)c3oc4c(c3C)/C(=N/NC(N)=O)CCC4)ccc21 40824318 HKGIAGCTMKNJER-MTDXEUNCSA-N 443.507 4.677 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccccc2C(C)C)ccc1OCCc1ccccc1 40911699 GVEJRSIQFRHFIU-MTDXEUNCSA-N 446.547 4.969 50 10 IJGE Cc1nn(Cc2ccccc2)c(C)c1/C=N/NC(=O)CSCc1ccccc1Cl 59159909 BNZBAGIUNNIESX-WYMPLXKRSA-N 426.973 4.585 50 10 IJGE CC1(C)C[C@H](NC(=O)NC[C@@]2(c3ccc(F)cc3F)CC2(C)C)C[C@](C)(CN=C=O)C1 170290745 NHKOTQILITZNSV-YRUKQIKQSA-N 433.543 4.853 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)/C(C#N)=C\NCc1ccc(Br)cc1 217187574 SPKJIXUDWQJOKM-VVZNPABPSA-N 442.357 4.531 50 10 IJGE BrCc1cc(Br)c(O[C@H]2CCCOC2)c(Br)c1 232484884 SYUAYOSXMULKOR-VIFPVBQESA-N 428.946 4.664 50 10 IJGE O=C(/C=C/c1ccco1)Oc1ccc(C=NNC(=O)c2ccc(Cl)cc2Cl)cc1 254557802 BUZYGKRFQQLLGP-QVWIXQKQSA-N 429.259 4.969 50 10 IJGE COC(=O)c1c(NC(=O)NN=Cc2c(Cl)cccc2Cl)sc2c1CCCC2 256017392 LAHMHODPQKZUEZ-UHFFFAOYSA-N 426.325 4.876 50 10 IJGE C[C@H](CCCBr)NC(=O)c1scc(Br)c1Br 705510819 KYHAUHBHLCLVNF-ZCFIWIBFSA-N 433.991 4.567 50 10 IJGE CCOC(=O)c1c(I)c(CBr)cc2ccsc12 725283873 ZCQKIHSRXPLBQW-UHFFFAOYSA-N 425.085 4.578 50 10 IJGE CC[C@H](C)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N1CC=C(C#N)CC1 760002895 DTJWGMQSINONJA-AVRWGWEMSA-N 443.547 4.622 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)O[C@@H]2COc3cc(Cl)ccc32)c(-c2ccccc2)n1 774517501 GBXMVUIBRXVIFW-JRVGGCGHSA-N 444.878 4.701 50 10 IJGE Cc1cc(C)c(C(CSc2nc3ccccc3[nH]2)=NNC(=O)c2cccnc2)cc1C 1084193999 ICJTWPOFMIAPDR-UHFFFAOYSA-N 429.549 4.810 50 10 IJGE C=CCN(Cc1cc(Br)ccc1F)S(=O)(=O)c1ccc(CCl)cc1 1474918736 MIOCVISEZPDJSB-UHFFFAOYSA-N 432.742 4.704 50 10 IJGE O=C(CCBr)c1cc(I)ccc1SC(F)(F)F 1848425929 UTDXTLKDWADNBD-UHFFFAOYSA-N 439.034 4.871 50 10 IJGE Cc1cc(=O)c(C(=O)Nc2ccc(SC#N)cc2)nn1-c1ccc(Cl)c(Cl)c1 1859616812 HXGIZQDRMLPAQV-UHFFFAOYSA-N 431.304 4.673 50 10 IJGE CCCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1ccncc1)C(C#N)=C(N)O2 1865700270 OMDPWXOVITVYRX-GOSISDBHSA-N 426.307 4.745 50 10 IJGE CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)C[C@@]1(CBr)CC1(F)F 1893489598 RTUFALCVTHGRNT-IBGZPJMESA-N 447.364 4.824 50 10 IJGE O=C(NC1(C(F)(F)F)CCC(Cl)CC1)c1sccc1I 1924743769 FKPAMLPTSXVKCY-UHFFFAOYSA-N 437.652 4.565 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@]23CC[C@@H](CI)O3)C1 1939507020 RURZTYCNAZCZCT-QGTPRVQTSA-N 435.346 4.540 50 10 IJGE CC(C)[C@@H](CBr)N(Cc1ccccc1)Cc1cnn(C)c1Br 1961869090 QHTVZDRMLQBIPC-MRXNPFEDSA-N 429.200 4.604 50 10 IJGE CC[C@H](Br)c1cn(Cc2ccc(Br)cc2Br)nn1 2031403157 OFLMRGDLKCOJEN-JTQLQIEISA-N 437.961 4.697 50 10 IJGE Brc1cccc(Br)c1CN1C[C@H]2[C@@H](Br)CC[C@H]2C1 2033086017 HQIVPTFJPBEFGY-RBZYPMLTSA-N 438.001 4.817 50 10 IJGE C[C@H](CCBr)CCN1CC[C@H](C(F)(F)F)[C@H](NC(=O)OC(C)(C)C)C1 2044695750 GNTDZIBCFACSTL-HZSPNIEDSA-N 431.337 4.575 50 10 IJGE CCCn1cc(S(=O)(=O)N(Cc2ccccc2)C2CCC2)cc1CBr 2059312875 QLBIDGLKTBJMKX-UHFFFAOYSA-N 425.392 4.536 50 10 IJGE BrC[C@H]1CCN(Cc2ccc(Br)cc2Br)C12CC2 2070107133 SIYSMDXCEURIIO-LLVKDONJSA-N 438.001 4.961 50 10 IJGE CC[C@@H](C)[C@H](CBr)NC(=O)c1c(Br)cccc1Br 2081241073 DMCASVTVIOAAKP-KCJUWKMLSA-N 441.989 4.751 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CCCCN(C[C@@H](CBr)c2ccccc2)C1 2106786256 TUWJMCDYRWHBFK-PKOBYXMFSA-N 425.411 4.792 50 10 IJGE COc1ccc([C@H](Br)c2cnn(C)c2Br)c(Cl)c1Cl 2138628347 RRGZIKHDBLAPTN-VIFPVBQESA-N 428.939 4.982 50 10 IJGE O=S(=O)(Cc1cccc(Br)c1)N(Cc1ccccc1)C1(CCl)CCC1 2218986791 AXPQUWFTXCTICJ-UHFFFAOYSA-N 442.806 4.943 50 10 IJGE COc1ccc([C@@H](Br)c2cscc2F)cc1I 2248895577 QDNCFRNXOWPMDL-GFCCVEGCSA-N 427.076 4.985 50 10 IJGE COc1cc(OC)c([C@H](Cl)c2cc(I)sn2)cc1Cl 2264476966 UPKUVZVYHWLQEK-LBPRGKRZSA-N 430.094 4.747 50 10 IJGE O=C(NC[C@H]1CCC[C@H](Br)C1)c1cc(F)c(Br)cc1Cl 2282970431 OLMPSJANCIRCIZ-IUCAKERBSA-N 427.539 4.925 50 10 IJGE Cc1cc(F)c(CBr)c(N2CCCN(Cc3ccccc3)CCOCC2)c1 2283527643 FTDAZEXXDRKGHN-UHFFFAOYSA-N 435.381 4.758 50 10 IJGE CN(C(=O)c1ccc(Cl)c(I)c1)[C@@H]1CCCCC[C@@H]1Cl 2283657063 RPSMJLBMVZELPF-GXTWGEPZSA-N 426.125 4.957 50 10 IJGE C[C@H]1C[C@H]1N(CCCl)Cc1ccc(I)c(Br)c1 2306225111 UZRTZWYVUPEUSM-TVQRCGJNSA-N 428.539 4.503 50 10 IJGE CC[C@H](C)[C@@H](Cl)CNCc1ccc(I)c(Br)c1 2306226122 YBXPXWKGFOCKPG-CABZTGNLSA-N 430.555 4.797 50 10 IJGE CCOc1cccc(NC(=O)C(C#N)=Cc2cc(Br)c(N3CCCC3)o2)c1 2313565128 UIWVZNULFBFRAT-UHFFFAOYSA-N 430.302 4.587 50 10 IJGE Cc1nc(Br)c(C[C@@H](Br)c2ccccc2Br)n1C 2315671414 DVLXNGSMHUUQFI-LLVKDONJSA-N 436.973 4.932 50 10 IJGE CC[C@H]1CN(Cc2ccc(I)c(Br)c2)C[C@H]1CCl 2325234051 UANAXHJMJKSJIA-NWDGAFQWSA-N 442.566 4.751 50 10 IJGE O=C(c1cc(Br)sc1Br)N1[C@H]2CCC[C@H]2C[C@@H]1CCl 2329613519 ZMAOCJZCAUCFQH-XKSSXDPKSA-N 427.589 4.895 50 10 IJGE COc1cc(C=C(C#N)c2ccccc2[N+](=O)[O-])ccc1OCC(=O)Nc1ccc(C)cc1 2331066015 HLIKXFOZVSDTII-UHFFFAOYSA-N 443.459 4.994 50 10 IJGE COc1ccc(CCN(C)CCCCCI)c(Br)c1 2339257743 MOBYZUBYJUVNQD-UHFFFAOYSA-N 440.163 4.537 50 10 IJGE CC[C@@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)c1ccc(OCC(C)C)cc1 10683834 WFJDQBXDYQGDAO-XMSQKQJNSA-N 426.557 4.854 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2ccc(OCc3ccc(C)cc3)cc2)cc1 58893702 RIOLBBZLEDMEDM-JQXKRNIHSA-N 446.547 4.937 50 10 IJGE C[C@@H](NC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)c1ccc(C(C)(C)C)cc1 71997211 YGAFMQKQOWQLFZ-QGZVFWFLSA-N 435.524 4.861 50 10 IJGE N#C/C(=C/NCc1ccc(Br)cc1)C(=O)Nc1ccc(Cl)cc1Cl 217178283 AMFVSDDEZOLBLR-BENRWUELSA-N 425.113 4.892 50 10 IJGE CSc1cccc(N/C=C(/C#N)C(=O)Nc2ccc(I)cc2C)c1 217253951 ZSUHCEWHBNQJEU-QBFSEMIESA-N 449.317 4.780 50 10 IJGE CCC(CC)(CBr)NC(=O)c1cc(Cl)ccc1I 232851485 OVQOLJBMMULXNU-UHFFFAOYSA-N 444.538 4.628 50 10 IJGE CC[C@@H](C)N(CCBr)C(=O)c1ccc(Br)cc1Br 310717328 WWWVSJWSTDGODW-SECBINFHSA-N 441.989 4.847 50 10 IJGE C[C@@H](CCCCBr)NC(=O)c1ccc(I)c(Cl)c1 398531399 RELLIXSHOGXEOJ-VIFPVBQESA-N 444.538 4.628 50 10 IJGE C[C@H](Br)[C@H]1CCN(Cc2cc(Cl)ccc2I)C1 719749183 UZFHSLYGYKKARK-UWVGGRQHSA-N 428.539 4.550 50 10 IJGE CC[C@@H](C)NC(=O)[C@H](c1cccs1)N(C(=O)CCl)c1cccc(C(F)(F)F)c1 725238038 OZMIMVRGCJDLJJ-PXAZEXFGSA-N 432.895 4.995 50 10 IJGE CCCOc1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CI)cc1 725401825 WGJJLMMERJTPAA-DOTOQJQBSA-N 445.341 4.861 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)c(C)n1CC(C)C 741605404 KFFHGBLKBSSPFS-BTZSEUGTSA-N 438.641 4.929 50 10 IJGE CC(C)(C#N)c1ccccc1COC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 767975312 BTQLGXVNIKLOAT-PXLXIMEGSA-N 449.514 4.915 50 10 IJGE COC(=O)c1cccc(-n2c(C)cc(C=NNC(=O)c3cccc(C(F)(F)F)c3)c2C)c1 1084012834 JZQFPXFBOXUPLB-UHFFFAOYSA-N 443.425 4.663 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc(OC)cc2)c1C)c1ccc(F)cc1 1129717069 PGOZRNHSSJHAAZ-IJKLPWTBSA-N 427.479 4.640 50 10 IJGE C=C(CNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1ccccc1 1251695024 UGSUBPBCSXDOLJ-UHFFFAOYSA-N 435.911 4.576 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2cccnc2O)c(C)n1-c1cc(Cl)ccc1Cl 1287497343 UTYZSVXOCKXGRZ-MFOYZWKCSA-N 441.318 4.725 50 10 IJGE C/C(=C\C1CCC(C)CC1)C(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1 1354024236 YQRUNKIKIVFCTA-CAPFRKAQSA-N 436.552 4.564 50 10 IJGE C#CCN(CC1CC1)C(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(Br)cc2)c1C 1435585499 VQKVYKPVALJHGW-DEDYPNTBSA-N 436.353 4.635 50 10 IJGE C/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1 1521231154 WDIMGDMSUBUGDX-PEZBUJJGSA-N 438.886 4.923 50 10 IJGE CCCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(C)cc2)cc1OC 1865697187 OWLUSHXKUNNQDY-XMMPIXPASA-N 444.535 4.895 50 10 IJGE COc1ccc(-c2nn(Cc3ccc(F)cc3)c3c2[C@H](c2ccco2)C(C#N)=C(N)O3)cc1 1865698300 PQMIOPDYCFXRCA-NRFANRHFSA-N 442.450 4.557 50 10 IJGE Cc1ccc(OCC(=O)NNC(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)nc2C)cc1 1865759410 YVFONWZWIDCCQN-UHFFFAOYSA-N 444.318 4.512 50 10 IJGE Cc1ccccc1-c1nc(Nc2ccc(SC#N)cc2)cc(N2CCC[C@H](CO)C2)n1 1868301785 YAHTXRBUCFSSRT-SFHVURJKSA-N 431.565 4.978 50 10 IJGE CCCc1nc(Nc2ccc(SC#N)cc2)cc(N2CCO[C@H](c3cccnc3)C2)n1 1868389196 RMWDYPUHXUYWHJ-FQEVSTJZSA-N 432.553 4.719 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)N(C)C[C@H]2C[C@@H](Br)C2)cc1 1887828882 BTAABNPUOJPLIH-CPUCHLNUSA-N 425.367 4.518 50 10 IJGE CCCN(CC(C)(C)CI)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1904652121 XCEDLQMKRRRZSE-HNNXBMFYSA-N 438.394 4.559 50 10 IJGE Cc1sc(CBr)cc1S(=O)(=O)N(Cc1ccccc1)[C@@H](C)C1CC1 2009640030 LAPYUOZNAZYINW-ZDUSSCGKSA-N 428.417 4.941 50 10 IJGE CC(C)(C)[C@@H](Br)CNC(=O)c1c(Br)cccc1Br 2033088010 YQODNLUXRGWRSM-JTQLQIEISA-N 441.989 4.751 50 10 IJGE COCCOc1ccc([C@@H](Br)C2(Br)CC2)cc1Br 2049222600 FDXJNIIPRSIASQ-GFCCVEGCSA-N 442.973 4.838 50 10 IJGE BrC[C@H]1CC2(CC2)CN1Cc1cc(Br)ccc1Br 2054717960 LFXRQJUIWJERTC-GFCCVEGCSA-N 438.001 4.961 50 10 IJGE O=C(CCl)c1ccc(C(F)(F)F)c(OC(F)(F)F)c1I 2055150675 OGPTZBNBBBEOJB-UHFFFAOYSA-N 432.485 4.630 50 10 IJGE CCn1cc(Br)c(CC(CBr)(CBr)C2CCC2)n1 2060836015 LHLAACMZPVABLM-UHFFFAOYSA-N 443.021 4.784 50 10 IJGE COC[C@@H](C)CCO[C@@H](CI)c1ccc(Br)cc1 2067236906 CLEZVPUHIJYECS-FZMZJTMJSA-N 427.120 4.614 50 10 IJGE Clc1cc2c(cc1[C@H](Cl)c1cc(I)sn1)OCCO2 2120032311 MOVKQONVKXGCND-LBPRGKRZSA-N 428.078 4.501 50 10 IJGE CCc1nn(Cc2ccc(CBr)cc2)c(CC)c1I 2126469524 AIWRURSVEAMCLU-UHFFFAOYSA-N 433.131 4.556 50 10 IJGE Cc1c(Br)ccc([C@@H](Cl)[C@@H]2CCCCS2(=O)=O)c1Br 2138862151 FUQJKFGIPSJPBD-WCQYABFASA-N 430.589 4.767 50 10 IJGE BrCc1c(N2CCC[C@H]2[C@@H]2CCN(Cc3ccccc3)C2)nc2sccn12 2145252381 DYTLJTRPUMJFAF-MSOLQXFVSA-N 445.430 4.782 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@H]2NC(=O)N1CCC(Br)CC1 2162494212 GIKRLCKVLWMJNT-QGZVFWFLSA-N 438.366 4.590 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@@]2(F)CCC[C@@]2(CCl)C1 2176634432 CMQUZBPWVDEINZ-OLZOCXBDSA-N 445.579 4.846 50 10 IJGE C[C@@H]1[C@@H](NC(=O)OC(C)(C)C)CC[C@H](C(=O)N(C)CC2CC(Br)C2)C1(C)C 2196906454 DZNBBBUSGFIMGW-LKRQVQDUSA-N 445.442 4.584 50 10 IJGE C[C@@H](CCCl)N(Cc1ccccc1)S(=O)(=O)Cc1cccc(Br)c1 2213760353 DYCXRJJWBZXYTD-HNNXBMFYSA-N 430.795 4.799 50 10 IJGE Br[C@@H]1CCC2(CCN(C[C@@H]3CC3(Br)Br)CC2)C1 2250562861 MFYUNMRXWMDYHR-WDEREUQCSA-N 430.022 4.522 50 10 IJGE Fc1cccc(I)c1[C@H](Br)c1ncn2ccsc12 2255963352 IXQWDJWANXDLII-JTQLQIEISA-N 437.075 4.624 50 10 IJGE C[C@@H]1[C@@H](Cl)CCCN1Cc1ccc(I)c(Br)c1 2306220398 XBBSVNJGFVLTRG-SKDRFNHKSA-N 428.539 4.645 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)[C@H]3CC[C@@H]32)c(I)c1 2318524249 LYJLRIZEFTZIQM-DYEKYZERSA-N 440.550 4.692 50 10 IJGE Cc1nc(-c2ccc(F)cc2)ccc1C(=O)NNC(=O)C=Cc1ccc(Cl)cc1Cl 2321157752 YATCWOXWHMIAHA-UHFFFAOYSA-N 444.293 4.977 50 10 IJGE CCOc1ccc(C)cc1[C@@H](C)NC(=O)C(C#N)=CNc1cccc(Br)c1 2325074097 ABEXBBVZCJVPPE-OAHLLOKOSA-N 428.330 4.853 50 10 IJGE N#CC(=C(O)CNC(=O)c1ccccc1)c1nc(-c2cccc(Br)c2)cs1 2331279125 MDSAPPBIRIBHML-UHFFFAOYSA-N 440.322 4.795 50 10 IJGE Cc1cc(Br)c(C(=O)N2CCC[C@H](Br)[C@H]2C(F)(F)F)s1 2370262504 WOFXBGKCYMFIKD-XVKPBYJWSA-N 435.103 4.749 50 10 IJGE O=C(COc1ccccc1)N/N=C/c1cccc(OCc2cccc(Br)c2)c1 20523450 JSNSSTWXEWWLMO-ZVHZXABRSA-N 439.309 4.557 50 10 IJGE O=C(CSc1nc2ccccc2[nH]1)N/N=C/c1cccc(OCc2ccccc2F)c1 32520541 ASIANXAKOQRKAK-DHRITJCHSA-N 434.496 4.523 50 10 IJGE C[C@@H]1CCc2sc(C(=O)NNC(=O)c3ccc(SCc4cccnc4)cc3)cc2C1 106307900 ASWLSEVJSOYDTG-OAHLLOKOSA-N 437.590 4.635 50 10 IJGE CCOc1cccc(-c2nn(-c3ccccc3)cc2/C=C(/C#N)C(=O)NCc2cccnc2)c1 210033923 FFTDYHHBVXAKSZ-HMAPJEAMSA-N 449.514 4.556 50 10 IJGE N#C/C(=C/Nc1ccc(S(=O)(=O)O)cc1)C(=O)NC1CCCCCCCCCCC1 217259469 BGLWIZRTNOCPJH-ZCXUNETKSA-N 433.574 4.542 50 10 IJGE CCOc1ccc(-c2cc(C(=O)NN=Cc3cccc(COc4ccccc4)c3)[nH]n2)cc1 254398255 MMXHLQAIPHJVBN-UHFFFAOYSA-N 440.503 4.818 50 10 IJGE CCC(CC)CO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 300755490 UGEXOIJYTXLVDG-QGZVFWFLSA-N 425.351 4.644 50 10 IJGE CO[C@H](CO[C@@H](CI)c1ccc(Br)cc1)C(C)C 311065265 KYGBQYIMHJPQCY-UONOGXRCSA-N 427.120 4.613 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CI)[C@@H](c2ccc(Cl)cc2F)C1 382682287 CKLMSHNOHAGMEP-MFKMUULPSA-N 439.696 4.865 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1C(=O)c1cc(Br)sc1Br 705491822 TXBDHPQIMDVUAA-BQBZGAKWSA-N 446.002 4.661 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2ccc(C(C)(C)C(F)(F)F)cc2)c1C 765845080 REVUCAJNYVJHQV-UHFFFAOYSA-N 429.446 4.752 50 10 IJGE O=S(=O)(Nc1cccc(N2CCOCC2)c1)c1cccc(S(F)(F)(F)(F)F)c1 777611908 BAPIGBVHYCLAIH-UHFFFAOYSA-N 444.447 4.981 50 10 IJGE O=C(NNc1ccc(F)c(F)c1F)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1 810382473 FIHYEGRKMCGASC-UHFFFAOYSA-N 435.789 4.631 50 10 IJGE O=C(CCC(=O)Nc1ccccc1Br)NN=Cc1ccc(Cl)c(Cl)c1 1084364582 DYYCJQABTYEXDS-UHFFFAOYSA-N 443.128 4.625 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)NCc2cc3ccccc3nc2O)c(C)n1-c1ccccc1F 1135099624 KNRFZWJSJMFGLO-MOSHPQCFSA-N 440.478 4.710 50 10 IJGE CC(=O)c1cc2c(cc1NC(=O)/C(C#N)=C\c1cc(C)n(-c3ccccc3F)c1C)OCO2 1522485207 QVYJPAOOLHSSRD-NVMNQCDNSA-N 445.450 4.710 50 10 IJGE CC(C)[C@H]1N(C(=O)OC(C)(C)C)CC12CCN(C[C@H](CBr)C1CC1)CC2 1620662415 CZYYAPRTVHMBBW-ZWKOTPCHSA-N 429.443 4.765 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccccc2Cl)CCC3)n1 1772744639 ZGXPJKZUZKDZHQ-UHFFFAOYSA-N 436.899 4.668 50 10 IJGE COc1ccc(-c2ccc(C(=O)N/N=C\c3c(F)cccc3Cl)c(C)n2)cc1OC 1865760984 ZXFIFLCKNHZFPD-ROTLSHHCSA-N 427.863 4.631 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@H](C)N(C(=O)OCc2ccccc2)[C@H](C)C1 1905533908 ZHOGIWKHWDFXBC-WSTZPKSXSA-N 425.411 4.775 50 10 IJGE Cn1ncc(Br)c1C[C@H](CBr)c1ccccc1Br 2027121770 HWJSHRFGMAOIBA-SECBINFHSA-N 436.973 4.666 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1C[C@H](C(F)(F)F)CCN1CCCCCBr 2045430858 HGRMIZKOMFYFRF-ZIAGYGMSSA-N 431.337 4.719 50 10 IJGE COC[C@@H](C)CCO[C@H](CI)c1ccccc1Br 2067238223 WELKQEHMGVWYPL-SMDDNHRTSA-N 427.120 4.614 50 10 IJGE CN(Cc1ccc(CNC(=O)[C@@H](Br)C2CCCC2)cc1)C(=O)OC(C)(C)C 2167032980 OWOAXIOGILPAQI-SFHVURJKSA-N 439.394 4.623 50 10 IJGE CN(CCCCCI)[C@H]1CCCC[C@H]1N(C)C(=O)OC(C)(C)C 2211186345 OYXPVZMTCQIPET-JKSUJKDBSA-N 438.394 4.702 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1C(=O)c1scc(Br)c1Br 2251004841 SNWIMIXQLXDEOA-XPUUQOCRSA-N 446.002 4.661 50 10 IJGE C[C@@H](Br)CN(CC(C)(C)C)C(=O)c1csc(I)c1 2259755564 SZKBBDYUKNHTHB-SECBINFHSA-N 444.176 4.624 50 10 IJGE O=C(NC[C@H](CBr)C1CCC1)c1cc(F)c(Br)cc1Cl 2282982786 HLGWKMYTNDSKMV-VIFPVBQESA-N 427.539 4.783 50 10 IJGE O=C(N[C@@H]1CC[C@H]2C[C@]21CBr)c1cc(F)c(Br)cc1Cl 2282990569 SYXAJEBDIATXIG-DSBAHLMNSA-N 425.523 4.535 50 10 IJGE CCCCCOc1ccc(C=C(C#N)C(=O)Nc2ccccc2C(=O)OCC)cc1OC 2296819098 UGXCNGXNEBVGES-UHFFFAOYSA-N 436.508 4.987 50 10 IJGE O=C(C=Cc1ccc(Cl)cc1Cl)NNC(=O)C(c1ccccc1)c1ccccc1 2296909429 TVSQWGMIUISAHV-UHFFFAOYSA-N 425.315 4.986 50 10 IJGE C[C@]1(CBr)CCN(Cc2cc(I)ccc2Cl)C1 2307328631 PICZYCGKXUHLJQ-CYBMUJFWSA-N 428.539 4.552 50 10 IJGE CCCO[C@@H]1[C@@H](Cl)C[C@H]1Oc1cc(Br)cc(I)c1 2316756544 FYLPXYGNKMRONM-YNEHKIRRSA-N 445.522 4.607 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2Cl)ccc1C(=O)NNC(=O)C=Cc1ccccc1 2321143214 DYLNGGRARXKIOS-UHFFFAOYSA-N 426.303 4.838 50 10 IJGE CCCOc1ccc(C=NNC(=O)c2ccc(-c3ccc(OC)cc3)nc2C)cc1OC 2321218476 YKVFYVCWFLDGNY-UHFFFAOYSA-N 433.508 4.627 50 10 IJGE Cl[C@@H]1CC[C@H]2CN(Cc3ccc(I)c(Br)c3)C[C@@H]12 2325225836 JMRVQLIJBAFJBH-DMDPSCGWSA-N 440.550 4.503 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2C[C@H]1CC[C@H]2Br 2327391838 MNFLSZNMRGAXRB-OASPWFOLSA-N 440.550 4.692 50 10 IJGE C[C@@H]1[C@@H](Br)CCN(C(=O)c2cc(F)c(Br)cc2Cl)[C@@H]1C 2370651739 WPBAWYKMCQBBNY-XKSSXDPKSA-N 427.539 4.876 50 10 IJGE Br[C@@H]1c2ccccc2CCC[C@H]1Cc1ncc(I)cn1 2381287581 LDQGYDJOQZEXAL-LRDDRELGSA-N 443.126 4.712 50 10 IJGE COc1ccc(C(=O)Nc2cccc(/C=C(/C#N)C(=O)NCc3ccc(Cl)cc3)c2)cc1 33499108 CGNDPMGGOQULBT-MOSHPQCFSA-N 445.906 4.824 50 10 IJGE O=C(COc1ccccc1)N/N=C/c1cc(Br)ccc1OCc1ccccc1 40912310 IVHSSCQBUSITQY-ZVHZXABRSA-N 439.309 4.557 50 10 IJGE CC(C)Cc1ccc([C@H](C)C(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)cc1 66199276 LLTGOVZLJRSFSW-GJZGRUSLSA-N 437.367 4.910 50 10 IJGE O=C(NN=Cc1cccs1)c1csc(-n2nc(C(F)(F)F)cc2-c2ccccc2)n1 252620373 MCVMKJWDMQUGGK-UHFFFAOYSA-N 447.467 4.840 50 10 IJGE Cc1ccc(OCC(=O)NN=Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)c([N+](=O)[O-])c1 254508681 UTRFQOVHEJZLQR-UHFFFAOYSA-N 447.369 4.711 50 10 IJGE CCOc1ccc(C(=O)Oc2ccc(C=NNC(=O)c3ccc(C)cc3)cc2OCC)cc1 254633799 QMAJWQXHWQHEDJ-UHFFFAOYSA-N 446.503 4.776 50 10 IJGE O=C(NN=Cc1ccccc1OP(=O)(c1ccccc1)c1ccccc1)c1ccccc1 254745809 PXFAAAHXRDHBHF-UHFFFAOYSA-N 440.439 4.758 50 10 IJGE CCN(C(=O)/C(C#N)=C/c1cc(C)n(C[C@@H]2CCCO2)c1C)[C@@H](C)Cc1ccc(OC)cc1 303382100 WHIJPROQWZZJSO-CTAXJASRSA-N 449.595 4.679 50 10 IJGE CC(CBr)(CBr)NC(=O)c1ccccc1OCc1ccccc1 381898563 GPDDVQDTJFBMIU-UHFFFAOYSA-N 441.163 4.544 50 10 IJGE O=S(=O)(NCCCN(Cc1ccccc1)Cc1ccccc1)c1ccc(CCl)cc1 390538880 QBQKAVKIFDDNJK-UHFFFAOYSA-N 443.012 4.796 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1N1CC[C@H]2CC[C@@H](C1)N2Cc1ccccc1 404517591 UCNOASVICBNKKR-CVEARBPZSA-N 436.375 4.795 50 10 IJGE C[C@H]1C[C@H](CBr)CN(Cc2cc(Cl)ccc2I)C1 405311076 TWZOESHBFIOMKV-WDEREUQCSA-N 442.566 4.798 50 10 IJGE ClCCc1nc2c(Br)cccc2n1Cc1ncc(Br)s1 714925328 FXAFJWZIWCCTIZ-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE CC[C@H](C[C@H](C)Br)NC(=O)c1cc(Br)cc(Br)c1 716939958 PTUGREDXRGOOHQ-QPUJVOFHSA-N 441.989 4.894 50 10 IJGE CC[C@@H](C)Sc1ccc(NC(=O)C(=O)NNc2cccc(F)c2F)c(C(F)(F)F)c1 785019391 DAJGNOMBLOTMTM-SNVBAGLBSA-N 447.429 4.956 50 10 IJGE Cc1ccoc1CN(C)C(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 817026480 FHRQFLXRDMSXJK-LDADJPATSA-N 433.899 4.584 50 10 IJGE CC(=O)c1cc(C(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)ccc1OC(C)C 1135538050 BRPREROPVJOOAO-UHFFFAOYSA-N 440.496 4.619 50 10 IJGE C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NNc1c(Cl)cc(F)cc1Cl 1137988724 ZJBOQUWICDERAU-GFCCVEGCSA-N 426.703 4.612 50 10 IJGE C/C(=C/C1CCC(C)CC1)C(=O)NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1 1182533818 DLDSEHOGICRDQN-VLGSPTGOSA-N 427.570 4.703 50 10 IJGE C#C[C@@H](NC(=O)NNC(=O)c1ccc(OCCCCCC)cc1)c1ccc(Cl)cc1F 1252479728 RYPTURJMFNJDAN-OAQYLSRUSA-N 445.922 4.757 50 10 IJGE CC(=O)C(C)(C)CCC(=O)NNC(=O)c1cc(-c2ccccc2Cl)nc2ccccc12 1457462807 HNUQGBOIDPIDEC-UHFFFAOYSA-N 437.927 4.712 50 10 IJGE Cc1ncc([P+](c2ccccc2)(c2ccccc2)c2ccccc2)c2c1OC(C)(C)OC2 1615716763 FGDZWJCOINHJAC-UHFFFAOYSA-N 440.503 4.655 50 10 IJGE CCCc1nn(C)c2c1[C@@H](c1ccc(OCc3ccccc3)c(OCC)c1)C(C#N)=C(N)O2 1865692319 AWLYOQQDIAGRNQ-QHCPKHFHSA-N 444.535 4.568 50 10 IJGE COCCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(OCc3ccccc3)cc2)cc1 1866214186 WHFIDXMGTLHKHF-OQKWZONESA-N 428.488 4.836 50 10 IJGE CCc1nc(Nc2ccc(SC#N)cc2)cc(N2CCN(C)[C@@H](c3ccc(F)cc3)C2)n1 1868277886 LOSVHNWASOSQFB-OAQYLSRUSA-N 448.571 4.988 50 10 IJGE ClCC[C@H]1CCC[C@@H]1Nc1ncc(I)cc1Br 2015765377 FPIUAWWSAZWPMX-KCJUWKMLSA-N 429.527 4.658 50 10 IJGE Cn1ncc([C@H](Br)c2ccc(CC3CC3)s2)c1I 2027410320 ILZUVXPDJAWXTN-LBPRGKRZSA-N 437.144 4.523 50 10 IJGE C[C@@]12CN(Cc3cc(Br)ccc3Br)C[C@@]1(CBr)C2 2054721105 BRDGWOJDGKKNIJ-KGLIPLIRSA-N 438.001 4.819 50 10 IJGE O=C(CBr)c1cc(Br)c(OC(F)(F)F)cc1Br 2054923250 BQGDJVFIUPCOEL-UHFFFAOYSA-N 440.835 4.688 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCC2(CC1)C[C@@H]2CCl 2092486375 BDHYYIXMHFALII-MRVPVSSYSA-N 427.589 4.754 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCCC[C@@H]2NC(=O)CCCCBr)CC1 2106204166 RUWXBXVAFRIITK-INIZCTEOSA-N 431.415 4.628 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CN(CC3(CBr)CCCCC3)C(C)(C)[C@H]2C1 2106788561 QORJNTCSGYLHNS-IRXDYDNUSA-N 429.443 4.909 50 10 IJGE C[C@H]1C[C@@H](C)N(C[C@H](CBr)c2ccccc2)CCN1C(=O)OC(C)(C)C 2108184599 DUVXXECVPAMGHM-AOIWGVFYSA-N 425.411 4.885 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@H]([S@@](C)(=O)=NCc2ccc(CBr)cc2)C1 2126472895 ZQAKZXBGIXQXJK-MRDQGFSESA-N 445.423 4.579 50 10 IJGE COc1cc(Cl)c([C@@H](Cl)c2cn(C)c(Br)n2)cc1Br 2137639634 ICEWHAOVDLSFDE-LLVKDONJSA-N 428.939 4.935 50 10 IJGE CC(C)(C)OC(=O)NCCc1ccc(NC(=O)c2ccc(CBr)cc2)cc1 2162591329 JVHYHENTGLTSBA-UHFFFAOYSA-N 433.346 4.901 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@](CNC(=O)[C@@H](Br)C2CCCC2)(C(C)(C)C)C1 2167031941 KOMVEXWQEHYNBT-HRAATJIYSA-N 445.442 4.730 50 10 IJGE O=C1NCCc2ccc([C@@H](Br)c3cc(Br)c(Cl)s3)cc21 2172569537 OCIBGZAYJJDOCL-GFCCVEGCSA-N 435.568 4.934 50 10 IJGE CN(C(=O)c1cc(Br)cc(Br)c1)[C@@H](CCCl)C(F)(F)F 2178516451 WLDKTXVIAIIGLC-JTQLQIEISA-N 437.481 4.843 50 10 IJGE C[C@H](Br)CCCc1cn(-c2cc(Cl)c(Br)cc2F)nn1 2189279203 NSDYEODQMBMCAT-QMMMGPOBSA-N 425.527 4.928 50 10 IJGE Cc1ccc(C(=O)Nc2cccc(CBr)c2)cc1I 2224618064 DEOQQAPLZPTQME-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE C[C@](CI)(O[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1F 2250385208 PNDLOEOIRGLOPF-FXAWDEMLSA-N 439.312 4.767 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CBr)(OC[C@@H]2CC(F)(F)C23CCC3)C1 2266115902 WOZKIRJBUGFLMY-YOEHRIQHSA-N 438.353 4.993 50 10 IJGE CCn1nc(C)c(CBr)c1N1CCC2(CCN(Cc3ccccc3)CC2)C1 2281296817 ZTRZJLHINPJQSQ-UHFFFAOYSA-N 431.422 4.599 50 10 IJGE Br[C@@H]1CN(Cc2sccc2I)C2(CCCC2)C1 2301070705 FQDCDTZFPDWMSI-JTQLQIEISA-N 426.161 4.635 50 10 IJGE Br[C@@H]1CCC[C@@H]2CN(Cc3sccc3I)CC[C@@H]21 2316763598 CSOKFMKIAXIJGB-GRYCIOLGSA-N 440.188 4.738 50 10 IJGE C[C@@H]1C[C@H](CBr)CCN1Cc1ccc(Cl)cc1I 2318540089 OUGUADSHNLIUTQ-GHMZBOCLSA-N 442.566 4.940 50 10 IJGE C[C@@H]1CCc2[nH]c3ccc(C(=O)NN=Cc4cc(Cl)c(O)c(Cl)c4O)cc3c2C1 2323168505 CMQYGSXFDYTBLE-SNVBAGLBSA-N 432.307 4.775 50 10 IJGE CCc1cccc(CC)c1NC(=O)C(C#N)=CNCCc1cccc(Br)c1 2325129540 BBKPMVRCDRTUJH-UHFFFAOYSA-N 426.358 4.752 50 10 IJGE ClC[C@H]1CC[C@H](NCc2ccc(I)c(Br)c2)CC1 2325204106 LFRHHOMFXMGLEF-UMSPYCQHSA-N 442.566 4.941 50 10 IJGE Cl[C@@H]1C[C@H]2C[C@H]1C[C@@H]2NCc1ccc(I)c(Br)c1 2325227132 XGUNBOJZCMPMPQ-SVBLFDIKSA-N 440.550 4.549 50 10 IJGE ClCc1ccc(OCc2ccc(I)c(Br)c2)nc1 2325380768 GRMMEEGOGVNKTM-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@@]2(CBr)CC[C@H]1C2 2361610786 BIPBYPAHBXNRLB-RTHLEPHNSA-N 425.523 4.631 50 10 IJGE COc1cc(CBr)cc(N(C)[C@@H]2C[C@@H]3C[C@H](OCc4ccccc4)C[C@@H]32)n1 2364761519 IGTIUADAMJVDFB-LWYYNNOASA-N 431.374 4.805 50 10 IJGE O=C(NC[C@@H]1CCC[C@H]1Br)c1cc(C(F)(F)F)ccc1Br 124440728 GWKWHZDWAWHFIP-GZMMTYOYSA-N 429.074 4.761 50 10 IJGE CC1(C)O[C@@H]2[C@H](O1)[C@H](n1ccc3c(Cl)ncnc31)O[C@@H]2CO[Si](C)(C)C(C)(C)C 198128660 PTFANUVYJLNMOM-LDDOYCOJSA-N 440.016 4.524 50 10 IJGE in-vitro C[C@@H](Br)C[C@H]1CCCCN1C(=O)c1csc(I)c1 310731191 MYFOCKBPRUVFLY-MWLCHTKSSA-N 442.160 4.521 50 10 IJGE CN(CCn1c(CCl)nc2cc(I)ccc21)Cc1ccccc1 386799014 BIJCKKDWKDEYLH-UHFFFAOYSA-N 439.728 4.512 50 10 IJGE N#C[C@H](Br)c1cc(OCc2ccccc2)ccc1I 390771960 LUHCWHSSEGYHQD-AWEZNQCLSA-N 428.067 4.830 50 10 IJGE FC(F)(F)c1c(I)cc(Br)cc1CBr 575691779 OPCBWIVJKMTBLC-UHFFFAOYSA-N 443.826 4.967 50 10 IJGE Clc1ccccc1C(CBr)(CBr)CCN1CCSCC1 706370491 FWFNGJGHAHBAFS-UHFFFAOYSA-N 441.660 4.807 50 10 IJGE CC(C)(C)c1cnc(COC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)s1 790887374 BUANYTJNJARPBV-LDADJPATSA-N 445.548 4.868 50 10 IJGE CCC(C)(C)C(=O)COC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1 811029886 DZFVGTVKVXNDLI-SFQUDFHCSA-N 438.915 4.573 50 10 IJGE Cc1ccc(CNC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)c(C)c1 914482425 CWLGYZGKVSKSQD-BKUYFWCQSA-N 443.938 4.957 50 10 IJGE CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NN=Cc3ccc([N+](=O)[O-])cc3)cc2)cc1 1084478596 SRVKFLMHLRMRCA-UHFFFAOYSA-N 444.491 4.909 50 10 IJGE C#C[C@H](NC(=O)NNC(=O)c1ccc(OCCCCCC)cc1)c1ccc(Cl)cc1F 1252479727 RYPTURJMFNJDAN-NRFANRHFSA-N 445.922 4.757 50 10 IJGE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NNc1nc(-c2ccccn2)nc(C)c1C 1306591712 YTCIQLDIXSMSCR-SEYXRHQNSA-N 443.429 4.601 50 10 IJGE C=C(CBr)CN(CC(=O)Nc1ccccc1F)Cc1ccc(Cl)cc1 1459740338 HACCEDQNXFEXSZ-UHFFFAOYSA-N 425.729 4.871 50 10 IJGE C=CC[C@H](C(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1 1623476687 GNVATAHFICSZKJ-QHCPKHFHSA-N 436.515 4.660 50 10 IJGE C[C@H](/C(O)=C(\C#N)c1nc(-c2ccc(F)c(F)c2)cs1)N1C(=O)c2ccccc2C1=O 1872751800 UGEPUPRHUCIFKP-QNPMFDGYSA-N 437.427 4.566 50 10 IJGE C[C@@H]([C@@H](CBr)NC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1880760294 FPNHVPCILULRSL-QLFBSQMISA-N 435.403 4.558 50 10 IJGE C[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)[C@H]1CCCCN1C(=O)OC(C)(C)C 1880761089 LBXSWXKIDYTCGI-RBSFLKMASA-N 435.403 4.700 50 10 IJGE CC(C)(C)OC(=O)NC[C@H](c1ccccc1)[C@H](CBr)NC(=O)OC(C)(C)C 1883674848 IJMBJRKFNPVOHZ-CVEARBPZSA-N 443.382 4.583 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1c(F)cc(Br)cc1F 1885097413 QNAOHOSOXHAILL-VIFPVBQESA-N 429.099 4.558 50 10 IJGE C[C@@H]1[C@@H](CBr)CCN1Cc1cccc(Br)c1Br 1943880165 AZPGTAPQPPANDR-NXEZZACHSA-N 425.990 4.817 50 10 IJGE CCN(CC)C[C@H](Br)Cc1c(Br)cccc1Br 1949915330 HIDLEXLOYFWATL-SNVBAGLBSA-N 428.006 4.859 50 10 IJGE CC[C@H]1CN(C(=O)OCc2ccccc2)[C@H](CC)CN1CC(C)(C)CBr 1977884925 NQMVWTLJMOHTBU-RBUKOAKNSA-N 425.411 4.919 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1sccc1Br 2006105761 WTWVVNQJGXOVHU-VIFPVBQESA-N 430.149 4.624 50 10 IJGE Cc1ccc(-n2c(Cl)nc(Cl)c2CBr)cc1I 2006648499 UOILSUJALXRLFI-UHFFFAOYSA-N 445.913 4.987 50 10 IJGE C[C@@H](Br)[C@H]1CCCN1Cc1c(Br)cccc1Br 2018117032 JXWPCVHTGKYFDE-NOZJJQNGSA-N 425.990 4.959 50 10 IJGE Cc1c(Br)sc([C@@H](Br)C2COCCOC2)c1Br 2024260858 WBHSLBNNFSOONR-VIFPVBQESA-N 449.002 4.681 50 10 IJGE CC[C@H](NC(=O)c1cccc(Br)c1Br)[C@H](Br)CC 2031476278 AFIAKTKKXSYYGA-KOLCDFICSA-N 441.989 4.894 50 10 IJGE CCC[C@H](CBr)CN=[S@](C)(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C 2044706538 VCXXDWVGGNPTLD-KDCSIKNMSA-N 441.476 4.835 50 10 IJGE C[C@]12CN(Cc3cccc(Br)c3Br)C[C@@]1(CBr)C2 2046798886 QYSDSXVKGWBYQH-KBPBESRZSA-N 438.001 4.819 50 10 IJGE CN(CC1CC(Br)C1)C(=O)c1cc(Cl)cc(NC(=O)OC(C)(C)C)c1 2076219856 FUGYVSZFVIPQPB-UHFFFAOYSA-N 431.758 4.933 50 10 IJGE COc1cc(C)ccc1-n1nc(CCl)c(I)c1C(F)(F)F 2079214002 UIOFGVCZKRPKCO-UHFFFAOYSA-N 430.595 4.552 50 10 IJGE CC[C@@H](C)[C@H](CI)NC(=O)c1cc(Cl)ccc1Br 2081235286 DJUITFXSTDDZOA-PELKAZGASA-N 444.538 4.682 50 10 IJGE CCc1nn(-c2cccc(F)c2CBr)c(CC)c1I 2093914629 DNZNFTNQXKBYIH-UHFFFAOYSA-N 437.094 4.636 50 10 IJGE CS(=O)(=O)C1([C@@H](Br)c2cc(Br)c(Cl)cc2F)CCC1 2110377176 BXQIMZRGKRYLFA-NSHDSACASA-N 434.552 4.645 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2Cc1nccn1Cc1ccccc1 2128512443 WVYIYZVWHCKLGX-UHFFFAOYSA-N 430.737 4.534 50 10 IJGE O=[N+]([O-])c1cc(Oc2ccccc2I)ccc1CBr 2132052356 GZPHZILEGFUQGA-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE C[C@@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)N1CCC[C@@H](CCCl)C1 2166885547 BKCKVGMKMHKVAY-HKUYNNGSSA-N 427.035 4.897 50 10 IJGE Cc1sc(Br)c(C(=O)N2CC[C@@H](C(F)(F)CBr)C2)c1C 2197752568 IOOIPOXFFSOLHD-SECBINFHSA-N 431.140 4.620 50 10 IJGE CN[C@H](c1cc(Br)c(Br)cc1F)C1CC(Br)C1 2213492613 QSDACTGOASFQRX-FOEZSWGGSA-N 429.953 4.785 50 10 IJGE CC(C)(C)OC(=O)N(CC(F)F)[C@@H]1CCCN(CCCCCCBr)C1 2223294296 YGQMYWNMEZQUFY-OAHLLOKOSA-N 427.374 4.908 50 10 IJGE Cc1cc(Br)c([C@@H](Br)[C@H]2CCCS2(=O)=O)c(C)c1Cl 2224302917 QCSMZVPAIGUARN-PWSUYJOCSA-N 430.589 4.733 50 10 IJGE Cc1ccc([C@H](CBr)OCCOCCOCCOCc2ccccc2)cc1 2236087966 AXKBOMJZKNTCSQ-QFIPXVFZSA-N 437.374 4.698 50 10 IJGE COCCCCCO[C@H](CI)c1ccc(Br)cc1 2258912225 ZRSSEWVEKOGMNQ-CQSZACIVSA-N 427.120 4.759 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@H]2C[C@H](Br)C[C@H]1C2 2285849454 ZAAWTQVMBMMXKY-XHNCKOQMSA-N 425.523 4.630 50 10 IJGE C[C@H]1CO[C@](CCl)(Cc2ccc(I)c(Br)c2)C1 2306226160 HJYLTHHUSPWVJA-RNCFNFMXSA-N 429.523 4.630 50 10 IJGE C=CCOc1c(Br)cc(C=C(C#N)C(=O)NCc2ccccc2)cc1OCC 2313518732 QCYSOZFHEOBRFY-UHFFFAOYSA-N 441.325 4.636 50 10 IJGE CCCCOc1ccc(C=C2C(=O)N(CCc3ccc(OC)cc3)C(=O)C(C#N)=C2C)cc1 2314620855 VXZGUQSNIGSVIH-UHFFFAOYSA-N 444.531 4.709 50 10 IJGE CCOc1ccc(CCNC=C(C#N)C(=O)Nc2ccccc2C(F)(F)F)cc1OCC 2324305252 OONGXAAKBBMUKZ-UHFFFAOYSA-N 447.457 4.681 50 10 IJGE ClC[C@]12C[C@H]1CC[C@H]2NCc1ccc(I)c(Br)c1 2325206804 KVRNKEGNJZKJAN-LERXQTSPSA-N 440.550 4.551 50 10 IJGE CC(C)(C)OC(=O)NCCCCCC(=O)NN=Cc1cccc(OCc2ccccc2)c1 2328799978 NRACCJJXRIAMIU-UHFFFAOYSA-N 439.556 4.801 50 10 IJGE CN(C(=O)OC(C)(C)C)[C@H]1CN(C[C@H](CBr)c2ccccc2)CC1(C)C 2336372497 CWWJFALXCCSONN-ROUUACIJSA-N 425.411 4.742 50 10 IJGE COc1ccc(/C=N/NC(=O)CCc2c[nH]c3ccccc23)cc1CSc1ccccn1 20258664 UYPXROILZVDGCJ-RWPZCVJISA-N 444.560 4.947 50 10 IJGE CCOc1cc(/C=C(\C#N)C(=O)Nc2ccccc2F)cc(Br)c1OCC 32751994 JIIZDBIIRHJOGT-NTEUORMPSA-N 433.277 4.931 50 10 IJGE C=CCn1c(CCc2ccccc2)nnc1SCC(=O)N/N=C(C)/C=C/c1ccccc1 58991450 XQHSHQWNPAOVSP-PEJWVSIRSA-N 445.592 4.547 50 10 IJGE COc1c(Br)cc(Br)cc1/C=N\NC(=O)c1ccccc1Cl 169885996 MIEHIZSMHPNLFD-UWVJOHFNSA-N 446.526 4.638 50 10 IJGE COc1cc(/C=N\NC(=O)c2ccc(N)cc2)ccc1OCc1ccc(Cl)cc1Cl 169900180 IRWBSIKCQJKARN-ZRGSRPPYSA-N 444.318 4.927 50 10 IJGE CCCOc1ccc(/C=N\NC(=O)c2cccn(Cc3ccc(C(C)(C)C)cc3)c2=O)cc1 169921146 BLVOGVSEXVZBGL-VEILYXNESA-N 445.563 4.747 50 10 IJGE N#Cc1cc(C(Br)Br)cnc1Sc1ccc([N+](=O)[O-])cc1 207294800 SYDVRSVEEDJBEK-UHFFFAOYSA-N 429.093 4.801 50 10 IJGE BrCc1c(Oc2ccc(I)cc2)nc2sccn12 218201107 QMROABJSBGCDPD-UHFFFAOYSA-N 435.084 4.688 50 10 IJGE CCCO[C@@H]1[C@H](Br)C[C@H]1Oc1c(Br)cccc1Br 300475103 TWKVFHOHWXHILT-NQBHXWOUSA-N 442.973 4.921 50 10 IJGE ClCc1cc(I)cc2scc(I)c12 306902155 PPPFUDPPJNPXAA-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE C[C@@H]1[C@H](Br)CCCN1C(=O)c1cc(Br)cc(Br)c1 384230787 GGEGAYJCWAYGQL-PRHODGIISA-N 439.973 4.600 50 10 IJGE CC(C)(CBr)CCNC(=O)c1cc(Br)cc(Br)c1 385810349 QCQXEJGBUKGYKV-UHFFFAOYSA-N 441.989 4.753 50 10 IJGE C[C@H](Br)C[C@H](C)CNC(=O)c1scc(Br)c1Br 705442268 NNDMZUUTLIBDNU-BQBZGAKWSA-N 448.018 4.813 50 10 IJGE N#Cc1ccc(NNC(=O)c2cnn(-c3ccc(C(F)(F)F)cc3)c2)c(C(F)(F)F)c1 803360101 AJGJOFYSYOTQMQ-UHFFFAOYSA-N 439.319 4.538 50 10 IJGE CCC[C@H](C)c1ccc(OCC(=O)NN=Cc2cc(Br)ccc2OC)cc1 1083958278 ORSCHMGSQRPVKW-HNNXBMFYSA-N 433.346 4.890 50 10 IJGE N#CC1=C(N)Nc2c(N=Nc3ccc(Cl)cc3)c(N)nn2[C@H]1c1ccc(Cl)cc1 1088724928 KWBXMULDAIDAEH-INIZCTEOSA-N 425.283 4.896 50 10 IJGE C#CCSCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C(F)(F)F)c2)c1C 1293737348 JHBCMEGFSNWABM-LDADJPATSA-N 431.483 4.503 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNC(=O)c1cccc(Br)c1 1361082045 SIAQXACQPVVQEK-NTMALXAHSA-N 428.113 4.620 50 10 IJGE C/C(=C\c1ccccc1Cl)C(=O)NNC(=O)c1ccc(Br)cc1Cl 1520969908 OFMZUGCUQSIUPK-CSKARUKUSA-N 428.113 4.620 50 10 IJGE C=C(C)CN1CCC(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 1585279477 PGSFHZXFPPKOEX-KGENOOAVSA-N 436.987 4.811 50 10 IJGE COc1ccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4ccc(C)cc4C)c(C)c32)cc1 1772745699 IJDGHIPJRTYVRL-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)NNC(=O)c1ccc(Cl)c(Cl)c1 1865759866 WJRQYXFDXQCJDW-UHFFFAOYSA-N 436.245 4.717 50 10 IJGE CCOC(=O)CN(C(=O)/C(C#N)=C/c1cccc(Br)c1)c1ccc(Cl)cc1 1866366948 YNWOUFXAJNXIKK-XNTDXEJSSA-N 447.716 4.606 50 10 IJGE CC[C@H](NC(=O)[C@@H](c1ccc(OC)cc1)C(C)C)C(=O)Nc1ccc(SC#N)cc1 1866980733 RFAYLYKQRSGWGG-LEWJYISDSA-N 425.554 4.541 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)n2)cc1F 1872752400 ALWOFHIXLYFEPY-JXAWBTAJSA-N 442.384 4.724 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)Cc1c(F)cc(Br)cc1F 1885097412 QNAOHOSOXHAILL-SECBINFHSA-N 429.099 4.558 50 10 IJGE COc1cc(C(=O)N(Cc2ccccc2)[C@H](CBr)C(C)C)ccc1[N+](=O)[O-] 1915271824 HRSXFQPRKISVAR-GOSISDBHSA-N 435.318 4.665 50 10 IJGE CC1(C)OC[C@@H](Cc2ccc(Br)cc2Br)[C@H]1Br 1943859983 UEQSWCRKXCPWAY-BXKDBHETSA-N 426.974 4.943 50 10 IJGE CC[C@@H](C)[C@H](Br)CNC(=O)c1csc(Br)c1Br 1945189000 GPFLUXXPYDCBDM-HTRCEHHLSA-N 448.018 4.813 50 10 IJGE O=S(=O)(c1ccc(CCl)cc1Br)N(Cc1ccccc1)C1CCC1 1946851640 OTUUDSFXJRLXOE-UHFFFAOYSA-N 428.779 4.931 50 10 IJGE CC[C@@H](Br)CN(CC)C(=O)c1csc(Br)c1Br 1999378840 YXKGQQYQEKIKKL-SSDOTTSWSA-N 448.018 4.909 50 10 IJGE Cl[C@H]1CCCC[C@H]1CNc1ncc(I)cc1Br 2015756617 INIFFQQLKQNPJB-KWQFWETISA-N 429.527 4.658 50 10 IJGE CC(C)(C)OC(=O)NC[C@](C)(CI)OC[C@H]1C[C@H]1c1ccccc1 2022691449 RCVXRKPLHAOUMR-GJYPPUQNSA-N 445.341 4.525 50 10 IJGE C[C@]12CN(Cc3cc(Cl)ccc3I)C[C@]1(CBr)C2 2046801303 GPOQZZYHUMDTJE-UONOGXRCSA-N 440.550 4.552 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3C[C@H]2CC[C@@H]3Br)c1 2054714848 SUVKNTSLHIZOOY-QKCSRTOESA-N 438.001 4.959 50 10 IJGE O=S(=O)(C1CCC(CBr)CC1)N(Cc1ccccc1)CC1CCCC1 2059289545 RRRNRQGFEZINSD-UHFFFAOYSA-N 428.436 4.962 50 10 IJGE C[C@@H]1CN(c2ncc(I)cc2Br)CC[C@@H]1CCCl 2069529892 UCIOGFOEJONQNL-ZJUUUORDSA-N 443.554 4.540 50 10 IJGE FC(F)(F)c1c(I)c(CCl)nn1-c1cncc(C2CC2)c1 2078880607 DIKJNKUXNJMHRB-UHFFFAOYSA-N 427.595 4.507 50 10 IJGE Cc1cccc([C@H](Br)c2ncn3ccsc23)c1I 2083981640 CNXYADDZBRJZQO-JTQLQIEISA-N 433.112 4.793 50 10 IJGE C[C@@H](c1cnn(Cc2ccccc2)c1)n1c(CCl)nc2cc(Br)cnc21 2090023023 DATNQWLOEJCGBI-ZDUSSCGKSA-N 430.737 4.787 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2C[C@@H]1CCN1Cc1ccccc1 2137598878 QWJWKZXAMYCAIB-HNNXBMFYSA-N 434.765 4.821 50 10 IJGE Cc1cc(Br)c(C(=O)NC[C@]2(F)C[C@H](CBr)C2)cc1Cl 2168559227 LCCMJJLNZSJXAQ-KMHCFJFGSA-N 427.539 4.654 50 10 IJGE CN(C(=O)c1cccc(Br)c1Cl)C1(CBr)CCSCC1 2171181391 DUMRRPNKAZHUTG-UHFFFAOYSA-N 441.616 4.835 50 10 IJGE Clc1cc(Br)cc(CN2CCC(OCCCBr)CC2)c1 2207528772 OKVIVVSDEHIJDU-UHFFFAOYSA-N 425.592 4.869 50 10 IJGE Cc1sc(C(=O)NCCCCCCI)c(C)c1Br 2218964010 DPZKZPIADBCSTJ-UHFFFAOYSA-N 444.176 4.853 50 10 IJGE C[C@H](CBr)CC1CN(Cc2cc(Cl)ccc2I)C1 2222844149 SUMJFSVRBKBYGA-JTQLQIEISA-N 442.566 4.798 50 10 IJGE FC1(F)[C@@H]2[C@@H](O[C@H](CI)c3cccc(Br)c3)CC[C@H]21 2230328893 SYDVBOGKIHDCOG-XQHKEYJVSA-N 443.069 4.986 50 10 IJGE COC(=O)[C@@]1(CCl)C[C@@H](O[Si](C)(C)C(C)(C)C)CN1C(=O)OCc1ccccc1 2230922120 SZNXTPCJMSKXCC-UTKZUKDTSA-N 442.028 4.570 50 10 IJGE COc1ccc(Br)c2c1nc(CCl)n2-c1cnn(Cc2ccccc2)c1 2270559715 JUPVLEGTXRQNCC-UHFFFAOYSA-N 431.721 4.780 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1Cc1cc(I)ccc1Cl 2307328507 NZCVMOWLFWNZIE-KOLCDFICSA-N 428.539 4.692 50 10 IJGE CC(C)c1ccc(OCC(=O)Oc2ccc(C=C(C#N)C(=O)NCc3ccco3)cc2)cc1 2314755039 ORPIOSNMIRVPOH-UHFFFAOYSA-N 444.487 4.611 50 10 IJGE CCOc1cc(C=NNC(=O)c2ccc3nc(S)[nH]c3c2)ccc1OCc1ccccc1 2323603084 MWKGRXNCILRDNZ-UHFFFAOYSA-N 446.532 4.593 50 10 IJGE CCOC(=O)c1ccccc1NC=C(C#N)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 2325382784 WRRFBFQJLLQCBQ-UHFFFAOYSA-N 437.805 4.994 50 10 IJGE COc1c(Br)cc(C)c([C@H](Cl)[C@]2(C)COCCO2)c1Br 2365232759 RALKKOWLZWSVSN-KBPBESRZSA-N 428.548 4.614 50 10 IJGE CCN(CC)CCN(Cc1ccccc1)c1c(CBr)c(C(F)(F)F)nn1C 2365278745 VHTRUTGHMLJAQY-UHFFFAOYSA-N 447.343 4.682 50 10 IJGE N#CC1=C2SCN(c3ccccc3F)CN2C(=O)C[C@H]1c1ccc(Br)cc1 9693400 VRXPBUYBCBRRCE-HNNXBMFYSA-N 444.329 4.808 50 10 IJGE O=C(/C=C/c1ccco1)NNC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 15792520 MTDPYKGNTULTFV-VAWYXSNFSA-N 435.530 4.656 50 10 IJGE CCOc1cc(/C=C2/C(=O)N(C(C)C)C(=O)C(C#N)=C2C)ccc1OCc1ccccc1 38604555 GAXUACDHPHLEPJ-FYJGNVAPSA-N 430.504 4.665 50 10 IJGE N#CC1=C(N)Oc2cc(OC(=O)c3ccccc3Cl)ccc2[C@H]1c1ccc([N+](=O)[O-])cc1 38654390 PKVMYJKCCNHSKF-OAQYLSRUSA-N 447.834 4.686 50 10 IJGE CCc1ccc(O[C@@H](C)C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccs2)cc1 38656609 DKBYOKLZGYEOAF-WNSKOXEYSA-N 446.528 4.902 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Br)c3ccc(F)cc3Cl)cc2[nH]1 109884538 PCTBEOVMHFKAHP-ZDUSSCGKSA-N 434.490 4.896 50 10 IJGE CCOc1c(Cl)cc(/C=C\C(=O)NNC(=O)c2cc(Cl)ccc2Cl)cc1OC 209811100 VJRHWNCWZUQEKQ-DAXSKMNVSA-N 443.714 4.529 50 10 IJGE CO[C@H](C)CC(CBr)(CBr)c1ccccc1Br 228630604 SCGXRYSVTBMCQY-SNVBAGLBSA-N 428.990 4.902 50 10 IJGE O=C(NN=C/C=C\c1ccccc1[N+](=O)[O-])c1cc(-c2ccc3c4c(cccc24)CC3)n[nH]1 254293514 WIKZTVAFWGRJKR-RWAHFTBLSA-N 437.459 4.666 50 10 IJGE O=C(/C=C\c1ccco1)Oc1ccc(C=NNC(=O)c2ccc(Cl)cc2Cl)cc1 254557801 BUZYGKRFQQLLGP-HRNMCVMOSA-N 429.259 4.969 50 10 IJGE Oc1ccc(Cl)cc1[C@@H]1CN(Cc2ccccc2)C[C@@H]1CI 382700398 NXPKONZKPJYNDU-WMLDXEAASA-N 427.713 4.696 50 10 IJGE Cc1cc(Br)c(C(=O)N[C@H](CI)C(C)C)cc1Cl 385099914 MHEDOZGEENXZFQ-GFCCVEGCSA-N 444.538 4.600 50 10 IJGE Clc1cc(Br)c(OCCOC2CCOCC2)c(CBr)c1 708072692 IIAHBYBDPLZKGS-UHFFFAOYSA-N 428.548 4.572 50 10 IJGE CC[C@H](C[C@@H](C)Br)NC(=O)c1ccc(Br)cc1Br 716939260 ODHAULQIRACONX-PSASIEDQSA-N 441.989 4.894 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2ccc3c(ccn3Cc3ccccc3)c2)c1C 762871490 QWBWKYQDICYJCE-UHFFFAOYSA-N 448.530 4.915 50 10 IJGE C#CCN(Cc1ccc(F)cc1)C(=O)/C(C#N)=C/c1cc(C)n(-c2ccccc2F)c1C 1264870997 AMHVGTDKUNPCPF-PXLXIMEGSA-N 429.470 4.941 50 10 IJGE CC(C)(C)OC(=O)N[C@H](C(=O)NNc1nc2ccccc2[nH]c1=S)C1CCCCCC1 1470321672 WUBAVLLRBOEPCT-KRWDZBQOSA-N 445.589 4.599 50 10 IJGE CC(=O)c1ccc(-c2ccc(C(=O)NNC(=S)Nc3ccc(OC(C)C)cc3)o2)cc1 1594254437 FKCFHKUTBOGJCP-UHFFFAOYSA-N 437.521 4.568 50 10 IJGE CCCCCCOc1ccc([C@H]2CN(C(C)=O)C[C@H]2CI)cc1 1614613633 ANFSMNPFVMKKKV-IEBWSBKVSA-N 429.342 4.643 50 10 IJGE CCc1nn(-c2ccc(Cl)cc2)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865698850 DTJMOWWMNPODFU-NRFANRHFSA-N 429.911 4.798 50 10 IJGE CCOc1ccc(/C(C)=N\NC(=O)c2ccc(-c3ccc(OC)c(OC)c3)nc2C)cc1 1865763282 DJHXDTMJCLRKFL-YUMHPJSZSA-N 433.508 4.627 50 10 IJGE O=C(NCC1CC2(CC[C@H]2Cl)C1)c1cc(Br)sc1Br 1882896414 CKKCUUJSBNEVOF-ZNZYBQRESA-N 427.589 4.801 50 10 IJGE Cc1cc(Br)sc1[C@@H](Br)c1c(Br)ncn1C 1900422283 OITIOIIETPLTIH-ZETCQYMHSA-N 428.975 4.799 50 10 IJGE C[C@@H](CBr)N(Cc1ccccc1)C(=O)Cc1ccccc1Br 1914226765 GKTXUVWMQPAMNM-AWEZNQCLSA-N 425.164 4.804 50 10 IJGE C[C@@H]1C[C@H](Br)CN(C(=O)c2csc(Br)c2Br)C1 1945186979 PAQXOWJQYRCRBC-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE CC[C@H](C)N(CCBr)C(=O)c1c(Br)cccc1Br 2033095792 VHTAEUXJDTWMEA-VIFPVBQESA-N 441.989 4.847 50 10 IJGE O=C(c1cscc1OCc1ccccc1)N1CC[C@@H](CBr)C(F)(F)C1 2038683870 KPGXGDZZNVJXIK-AWEZNQCLSA-N 430.314 4.819 50 10 IJGE CCCN1C[C@@H](Br)[C@H](Cc2cc(Cl)ccc2I)C1 2039250370 JJIHQCPDDIBULH-DGCLKSJQSA-N 442.566 4.592 50 10 IJGE CCC(CC)(CBr)CN=[S@](C)(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2044697369 TZOJBXPVARXHBY-ODCWNRFASA-N 439.460 4.685 50 10 IJGE CCC[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]1C(F)(F)F 2052479129 MWBKKEBTPIRXSC-MJBXVCDLSA-N 431.337 4.670 50 10 IJGE COc1ccc(OCc2ccc(CBr)cc2)cc1I 2126472170 RMZJHGQGGCYISV-UHFFFAOYSA-N 433.083 4.774 50 10 IJGE FC(F)(F)[C@H]1CN(Cc2ccccc2)CCN1c1cc(CCl)c(Br)cn1 2130166012 JTWJHNOQYCLZFR-MRXNPFEDSA-N 448.714 4.836 50 10 IJGE C[C@H]1CCCN(CC2(CBr)CCOCC2)[C@H]1CCCNC(=O)OC(C)(C)C 2163063289 PJXLQMYMLRGGGS-ROUUACIJSA-N 447.458 4.584 50 10 IJGE Cc1nn(C)c(Br)c1[C@@H](Cl)c1c(F)cc(F)c(Br)c1F 2236108223 JASARNZRSRNVBW-SNVBAGLBSA-N 432.465 4.999 50 10 IJGE COc1ccc([C@H](Br)C[C@@H]2CCO[C@@H]2C)cc1I 2257357001 MLLNLTDNCOVDGB-JFGNBEQYSA-N 425.104 4.551 50 10 IJGE CC[C@H]1[C@H](Br)CCN1C(=O)c1cccc(Br)c1Br 2260389001 SIYFPLLNCWZJTK-KOLCDFICSA-N 439.973 4.600 50 10 IJGE CC1CC(CBr)(CN(C[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)C1 2265311593 INBXDLPKJFPIBP-BQIYRTECSA-N 429.443 4.909 50 10 IJGE C[C@@H]1CC[C@](CBr)(NC(=O)c2cc(Br)c(F)cc2Cl)C1 2285962927 JNRMBRPVYHXRBG-CLAHSXSESA-N 427.539 4.925 50 10 IJGE C[C@H]1CN(CC2(CBr)CC(C)(C)C2)C[C@H](C)N1C(=O)OCc1ccccc1 2304520497 JUSZVEDIJGAHAI-ROUUACIJSA-N 437.422 4.919 50 10 IJGE Cc1sc(C(=O)N2CC[C@@H](Br)C[C@@H]2C(F)(F)F)cc1Br 2361463693 BPTBVQGNXPOPIA-GMSGAONNSA-N 435.103 4.749 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Cl)[C@@H]1COC2(CCC2)CO1 2364176999 ZYGAGDOPVOCRCH-STQMWFEESA-N 428.523 4.969 50 10 IJGE CC[C@H](Oc1ccccc1[C@@H](C)CC)C(=O)NNC(=O)[C@@H](C)Oc1ccc(C)c(C)c1 10153688 RRKFUUNEEZNTSM-NBCNXNJRSA-N 426.557 4.589 50 10 IJGE C=CCN1C(=O)/C(=N/NC(=O)c2cc(-c3ccccc3)nc3ccccc23)c2ccccc21 15778067 USCKPRKOQKFRNJ-XLVZBRSZSA-N 432.483 4.569 50 10 IJGE Cc1ccc(-c2nnc(SCC(=O)N/N=C\c3cccs3)n2-c2ccccc2)cc1 19800144 YCYBRBCOUDBWOB-UCQKPKSFSA-N 433.562 4.547 50 10 IJGE CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccc(Br)cc1)[C@H](Br)C2=O 35548702 ZUHKNCNLMMRTQD-JLZZUVOBSA-N 429.152 4.547 50 10 IJGE Cc1cccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)Cc2ccccc2)CCC3)c1C 40815667 GNZOINRVLVFVLG-SGWCAAJKSA-N 429.520 4.856 50 10 IJGE O=C(CC[C@H](O)c1ccccc1)N/N=C\c1cn(Cc2ccc(F)cc2)c2ccccc12 58888505 AUJNVJCPJQGHAR-WWUVGGQHSA-N 429.495 4.793 50 10 IJGE CCOC(=O)c1ccc(N/C=C(/C#N)c2nc(-c3ccc(OC(C)=O)cc3)cs2)cc1 102934340 ZIFLJYGKNKBMCB-AQTBWJFISA-N 433.489 4.889 50 10 IJGE O=C(NC1(CBr)CCCC1)c1cc(C(F)(F)F)ccc1Br 122580243 PJSDWIBXKYCREI-UHFFFAOYSA-N 429.074 4.905 50 10 IJGE COc1ccc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)cc1Br 169891171 ZCGTXLHLEYFQPM-IFUVNARDSA-N 440.341 4.828 50 10 IJGE O=C(NCCCCCCI)c1ccc(Br)c(Cl)c1 236035596 DFCVPVUOYOXFOZ-UHFFFAOYSA-N 444.538 4.828 50 10 IJGE CC[C@@H](C)C(C)=NNC(=O)c1cccc(S(=O)(=O)Nc2cc(Cl)ccc2Cl)c1 254407493 DUXBPCCFFRCYKO-GFCCVEGCSA-N 442.368 4.946 50 10 IJGE C[C@@H]1CC(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)C[C@H](C)C1 739653740 DMBPIKDKWOKRRL-OUZANRTLSA-N 435.959 4.965 50 10 IJGE COc1cc(C)c(C(=O)NNc2ccc(Br)cc2C(F)(F)F)cc1OC 755356949 IMPJWXQFUZLINS-UHFFFAOYSA-N 433.224 4.550 50 10 IJGE Cc1cc(C(=O)NNC(=O)c2ccc3ccccc3c2)ccc1NC(=O)c1cccs1 758507091 PJQWIKRHXHYZLU-UHFFFAOYSA-N 429.501 4.537 50 10 IJGE C#CC[C@@]1(C(=O)NNc2ccc(Cl)c(C(F)(F)F)c2)CCCN1C(=O)OC(C)(C)C 1165454186 OILUBYOGPOBXNF-IBGZPJMESA-N 445.869 4.595 50 10 IJGE O=C(CSc1nc2ccccc2[nH]1)NN=Cc1ccccc1OCc1ccccc1F 1772760340 DPGUPXLTUSTCGJ-UHFFFAOYSA-N 434.496 4.523 50 10 IJGE CCCc1nn(Cc2ccccc2Cl)c2c1[C@@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865710046 NEVOCJTVCOSZGC-FQEVSTJZSA-N 449.898 4.664 50 10 IJGE C[C@@H]1CN(C(=O)OC(C)(C)C)[C@H](C)C[C@@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1880767118 NBBLDLXAZCITHG-KBXIAJHMSA-N 435.403 4.556 50 10 IJGE C[C@@H]1C[C@@H]1CCCO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 1896108525 DVXRJLHQRJZUOL-VKJFTORMSA-N 437.362 4.644 50 10 IJGE CO[C@@H]1C[C@]2([C@H](Br)c3sc(Cl)cc3I)C[C@@H]12 1900924527 MSVJMGTXPBZUKF-FPSZXWGJSA-N 433.536 4.867 50 10 IJGE CO[C@@H]1C[C@H]1COc1c(Br)cc(Br)cc1CBr 1908943551 LNZGJOWARFCBFW-GZMMTYOYSA-N 428.946 4.520 50 10 IJGE Cc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)CBr)c2cccnc12 1914341224 IMXSZRDELBFZIL-MRXNPFEDSA-N 433.371 4.518 50 10 IJGE CN(C(=O)c1cc(Br)sc1Br)C1(CBr)CCC1 1914991598 NZIMDRBBZVQEBF-UHFFFAOYSA-N 446.002 4.663 50 10 IJGE O=C(c1ncsc1Br)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915265113 OBPHXPWUPSIPGS-CYBMUJFWSA-N 444.192 4.722 50 10 IJGE CCCC(CBr)(CBr)Cc1c(C)nn(C)c1Br 2013222174 KONVCTVRTARVGN-UHFFFAOYSA-N 431.010 4.610 50 10 IJGE CC(C)C[C@H](CCl)CNc1ncc(I)cc1Br 2015762152 HTHKQXCRKKXUJQ-SECBINFHSA-N 431.543 4.762 50 10 IJGE Brc1ccc(Br)c(CN2C[C@H]3[C@H](Br)CC[C@H]3C2)c1 2054715845 ZMRNBMFDAFSOSV-MRCXROJRSA-N 438.001 4.817 50 10 IJGE CC[C@H](C)[C@H](CBr)NC(=O)c1cc(Br)ccc1Br 2081239494 SUFHBTFZCIJLGP-UFBFGSQYSA-N 441.989 4.751 50 10 IJGE Clc1ccc(CBr)c(N2CCCN(Cc3ccccc3)CCOCC2)c1 2088628026 JYOQIQAAJSLBMT-UHFFFAOYSA-N 437.809 4.964 50 10 IJGE O=S1(=O)CCC[C@@H]([C@H](Br)c2cc(C3CC3)c(Br)s2)C1 2094669682 STHYTFJVENCBDG-SKDRFNHKSA-N 428.211 4.649 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H]1Cn1c(CCl)nc2cncc(Br)c21 2095438906 BRUVVZIVWNFKPC-GOEBONIOSA-N 433.781 4.701 50 10 IJGE C[C@@H]1CN(C[C@H](CBr)c2ccccc2)C[C@@]1(C)CNC(=O)OC(C)(C)C 2106784575 JPPQCVCXPXQQND-PLMTUMEDSA-N 425.411 4.648 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2CN(CC3(CBr)CCCCCC3)C[C@@H]2C1 2112471606 HBVJXUVXVNFIEP-QZTJIDSGSA-N 429.443 4.911 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CC[C@H]1CN(CC1(CBr)CCCCCC1)C2 2136690954 FTHDTAXNCUEGDP-LAUBAEHRSA-N 429.443 4.959 50 10 IJGE Cc1cc(Br)c(CCl)c(N2CC[C@H]3OCCN(Cc4ccccc4)[C@H]3C2)c1 2185517134 XAWKNRZAJBSMEB-FCHUYYIVSA-N 449.820 4.976 50 10 IJGE C[C@@H]1[C@H](NC(=O)OC(C)(C)C)CC[C@@H](C(=O)N(C)C[C@H]2C[C@H](Br)C2)C1(C)C 2196913593 DZNBBBUSGFIMGW-OVYGPGRDSA-N 445.442 4.584 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CN(CCCCI)c2ccccc21 2248241988 QYLPDAGKALQPGN-HNNXBMFYSA-N 444.357 4.720 50 10 IJGE COc1cc(Cl)c(Cl)cc1[C@@H](Cl)c1cnn(C)c1I 2264365020 PIPMRXSTDYJVBI-LLVKDONJSA-N 431.488 4.668 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCN(CC3(CBr)CC(F)C3)CC2)CC1 2265637761 FIFLNYQWCQSZAL-UHFFFAOYSA-N 433.406 4.613 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@@H](CBr)C12CC2 2285836020 WCQLZKWYQXBDPT-QMMMGPOBSA-N 425.523 4.631 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CCCC[C@H](CBr)C1 2285960874 VZQUIKPWFIYMBH-SECBINFHSA-N 427.539 4.879 50 10 IJGE N#CC(=Cc1ccc(-c2cc(Cl)ccc2Cl)o1)C(=O)NNC(=O)c1ccccc1 2296655617 LKLXEDOPWFKDHN-UHFFFAOYSA-N 426.259 4.622 50 10 IJGE N#CC(=Cc1cccc(NC(=O)c2ccccc2Cl)c1)C(=O)NCCc1ccccc1 2297381897 QDRCCHBMMLQUME-UHFFFAOYSA-N 429.907 4.858 50 10 IJGE BrC[C@H]1Cc2ccccc2CN1Cc1sccc1I 2338755438 PVINZRULKWFOEE-CYBMUJFWSA-N 448.167 4.675 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CCN(C[C@@]3(CBr)CC3(F)F)CC2)CC1 2351887167 KOGACDDXFZPDDX-SFHVURJKSA-N 437.369 4.520 50 10 IJGE CN(C[C@@H]1CN(C[C@H](CBr)c2ccccc2)CC12CC2)C(=O)OC(C)(C)C 2366104158 MJSRUHJTVLYVRO-RBUKOAKNSA-N 437.422 4.744 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@@]3(CN(Cc4ccccc4)CCO3)C2)C1 2371133116 LDGKOSVIQNVQRY-HSZRJFAPSA-N 435.450 4.555 50 10 IJGE CC(C)c1ccc(C(=O)NC(=S)NNC(=O)c2sc3ccccc3c2Cl)cc1 10453045 QOYDJIVARSIRGQ-UHFFFAOYSA-N 431.970 4.627 50 10 IJGE CCC(C)(C)c1ccc(OCC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1 14784150 ADIMCVPXYPIUOP-GOSISDBHSA-N 434.536 4.521 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)N/N=C\c2ccccc2OCc2cccc(C)c2)cc1 58895481 XHQKQEHYJPQRSE-UEYTXEIUSA-N 446.547 4.937 50 10 IJGE COC(=O)c1ccc(C(=O)OC)c(N/C=C(/C#N)c2nc(-c3ccc(C)cc3)cs2)c1 102417673 WVADTOIOIWAMJD-ATVHPVEESA-N 433.489 4.668 50 10 IJGE CC(C)COc1cccc(/C=N\NC(=O)c2ccc3[nH]c(Cc4ccccc4)nc3c2)c1 169925810 BETBGFNZSXXWAH-YUMHPJSZSA-N 426.520 4.952 50 10 IJGE CCC(CC)(CCl)NC(=O)c1cc(Br)ccc1I 232860560 ATBGVMBZVXAHKH-UHFFFAOYSA-N 444.538 4.581 50 10 IJGE CCOc1ccc(C(=O)c2ccccc2C(=O)NNc2cc(C)ccc2F)cc1OCC 760147250 HVOSZCKGZQZROM-UHFFFAOYSA-N 436.483 4.919 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccccc2NC(=O)c2ccsc2)c(C(F)(F)F)c1 799750227 AIEVQFYKRNOGOC-UHFFFAOYSA-N 430.411 4.648 50 10 IJGE O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)NN=Cc1c(Cl)cccc1Cl 1084623894 RNQKDSYNCJEDMX-UHFFFAOYSA-N 441.321 4.754 50 10 IJGE C=C[C@](C)(CCOC)C(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 1587236021 JULDGZRXPQZHPA-JOCHJYFZSA-N 432.973 4.622 50 10 IJGE CCCOc1ccc(C=NNC(=O)COc2ccc(Br)cc2C(C)C)cc1 1772755317 AOYLRXGBFQCRRZ-UHFFFAOYSA-N 433.346 4.890 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2-c2cccc(Cl)c2)[C@@H]1c1ccccc1F 1865683937 QRJZINIHLCVHFB-OAHLLOKOSA-N 434.780 4.902 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1cccc(Cl)c1 1865691473 SRHLRVCGPKMBJS-QFIPXVFZSA-N 432.911 4.676 50 10 IJGE CCCc1nn(Cc2ccc(C)cc2)c2c1[C@@H](c1ccc(OCC)cc1)C(C#N)=C(N)O2 1865693672 LQLYZDLPDZHXIF-QHCPKHFHSA-N 428.536 4.809 50 10 IJGE CC(C)(C)OC(=O)NCC1CC2(C1)CC([C@@H](CBr)NC(=O)OC(C)(C)C)C2 1882088276 PUXAQAPQHXETGN-NHMCCKQCSA-N 447.414 4.606 50 10 IJGE FC[C@@H](Br)CCc1ccc(I)c(Br)c1 1893242101 VDVFCYSPNZMNJL-QMMMGPOBSA-N 435.900 4.719 50 10 IJGE CC[C@@H](Cl)CN(Cc1ccccc1)C(=O)c1cc(I)ccc1O 1915104458 ARYNRPCECOTCEE-CQSZACIVSA-N 443.712 4.657 50 10 IJGE C[C@H]1CO[C@](CBr)(Cc2cccc(Br)c2Br)C1 1943885432 FRIXRYSLOCFPBL-RNCFNFMXSA-N 426.974 4.944 50 10 IJGE C[C@H]1C[C@H](CBr)CN1C(=O)c1scc(Br)c1Br 1950513267 QUCNSSFWMUSNDW-NKWVEPMBSA-N 446.002 4.519 50 10 IJGE Cc1ccccc1[C@H](CI)OCCOCCOCc1ccccc1 2007814076 IWIUZGKIHGTKCQ-FQEVSTJZSA-N 440.321 4.721 50 10 IJGE C[C@@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)[C@@H](CBr)C1CC1 2009644930 GTCKKELGBRFEFH-KSSFIOAISA-N 428.417 4.815 50 10 IJGE C[C@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)[C@H]1C[C@H](CBr)C1 2009645157 HZQHVJRCLCJIJM-DJIMGWMZSA-N 428.417 4.815 50 10 IJGE Cc1ccc(COC2(CI)CCN(C(=O)OC(C)(C)C)CC2)cc1 2024642449 QQBJYAIGFANIIX-UHFFFAOYSA-N 445.341 4.716 50 10 IJGE CCCN(C[C@H](Br)C(F)(F)F)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2044704570 DQYBIEPCVASWSE-KGLIPLIRSA-N 431.337 4.671 50 10 IJGE O=C(CBr)c1cc(C(F)(F)F)cc(I)c1C(F)F 2060393712 NGXBFUYZQKAQTF-UHFFFAOYSA-N 442.947 4.825 50 10 IJGE C[C@@]1(NC(=O)c2ccc(Br)cc2Br)CCC[C@@H]1Br 2062573159 HBZITGVMWNJSEC-WCQYABFASA-N 439.973 4.648 50 10 IJGE BrC[C@]12CC[C@@H]1CN(Cc1cccc(Br)c1Br)C2 2078133630 OATOBIHOMWFZID-RISCZKNCSA-N 438.001 4.819 50 10 IJGE C[C@@H]1CN(C[C@H](CBr)c2ccccc2)C[C@]1(C)CNC(=O)OC(C)(C)C 2106784574 JPPQCVCXPXQQND-MMOPVJDHSA-N 425.411 4.648 50 10 IJGE CC(C)[C@H](CBr)CN1CCOc2ccc(CNC(=O)OC(C)(C)C)cc21 2106785970 RORQCSAGHZISHQ-MRXNPFEDSA-N 427.383 4.577 50 10 IJGE CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(CC3(CBr)CCC3)C2)CC1 2106788261 OCTUZMCPGLCNIS-SFHVURJKSA-N 429.443 4.911 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CCC(F)(F)[C@H](CBr)C1 2115941696 CRSXABOYXURCMX-ZCFIWIBFSA-N 437.531 4.656 50 10 IJGE COc1ccc(S(=O)(=O)N(Cc2ccccc2)C2CCCC2)cc1CBr 2123272364 ZDJZUEQCMMWMDR-UHFFFAOYSA-N 438.387 4.724 50 10 IJGE ClCc1c(Br)cccc1N1CC[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2129055729 RWNCQYUZVUTZRN-RTWAWAEBSA-N 435.793 4.668 50 10 IJGE O=C(NC[C@@]12CCC[C@]1(CCl)C2)c1csc(Br)c1Br 2142942534 DTQGSNLVTZRKEL-OLZOCXBDSA-N 427.589 4.802 50 10 IJGE O=C(NC[C@@]12CCC[C@]1(CBr)C2)c1cc(Br)c(Cl)s1 2142949501 KHRLEAMAKLPWJM-OLZOCXBDSA-N 427.589 4.849 50 10 IJGE BrCc1c(N2CCC[C@@]3(CCN(Cc4ccccc4)C3)C2)nc2sccn12 2163315281 YSWLPCHLJQGJOE-NRFANRHFSA-N 445.430 4.783 50 10 IJGE CC1(C)C[C@@H](CCl)CN(C(=O)c2cc(Cl)ccc2I)C1 2172585005 IFYKPKUUDHAVOT-JTQLQIEISA-N 426.125 4.672 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@]2(F)CCC[C@@]2(CCl)C1 2176634431 CMQUZBPWVDEINZ-CHWSQXEVSA-N 445.579 4.846 50 10 IJGE COc1cc(F)c(Br)cc1[C@H](Cl)c1c(C)nn(C)c1Br 2185751824 SDTXSTUYUNGEFS-LBPRGKRZSA-N 426.511 4.729 50 10 IJGE CC(C)(C)OC(=O)NCCCc1ccc(NC(=O)N2CCC(Br)CC2)cc1 2203187697 IUPLIKGKLCAVAE-UHFFFAOYSA-N 440.382 4.535 50 10 IJGE C[C@H](CBr)N(Cc1ccccc1)C[C@H]1CC1(Br)Br 2208937837 ZVFKUUWRYANRID-DGCLKSJQSA-N 440.017 4.778 50 10 IJGE Cn1nc([C@H](Br)c2ccc3c(c2Br)CCO3)c(Cl)c1Cl 2238063300 OAIOFSCGEUMXEE-SNVBAGLBSA-N 440.950 4.909 50 10 IJGE CC1(C)CCN(Cc2ccccc2)CCN1c1ccc(CBr)cc1[N+](=O)[O-] 2239858720 NOTLIIATXYIAEO-UHFFFAOYSA-N 432.362 4.981 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1Cc1cc(Cl)ccc1I 2251035269 FLKYKMQSHTUVPJ-AAEUAGOBSA-N 428.539 4.692 50 10 IJGE O=C(c1scc(Br)c1Cl)N1C[C@H](Br)C2(CCCC2)C1 2264508907 FTAYSXMNTNMRSI-VIFPVBQESA-N 427.589 4.944 50 10 IJGE CN(Cc1ccc(I)cc1)Cc1ccc(CBr)cc1 2265527287 HCWZORDDXIPTAN-UHFFFAOYSA-N 430.127 4.818 50 10 IJGE COc1cc(F)c(CBr)c(N2CC[C@H]3CC[C@@H](C2)N3Cc2ccccc2)c1 2283531751 XOTHMBITKFRHFW-MSOLQXFVSA-N 433.365 4.973 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1[C@H]2CC[C@H]1[C@H](CBr)C2 2285847172 XHTZBSHMCJZART-UPFKWVMWSA-N 425.523 4.630 50 10 IJGE COc1ccc(NC=C(C#N)c2nc(-c3cc4ccccc4oc3=O)cs2)c(OC)c1 2296752730 UYENAKBGTBCXSP-UHFFFAOYSA-N 431.473 4.910 50 10 IJGE CC1(C)[C@@H](Br)CCN1Cc1ccc(Cl)c(I)c1 2300238332 JSHZHQSEYOSPGF-LBPRGKRZSA-N 428.539 4.692 50 10 IJGE Clc1ccc(I)cc1CN1CCC[C@@H](CBr)C1 2307325400 YUSTZMDBQJAOQL-JTQLQIEISA-N 428.539 4.552 50 10 IJGE COc1ccc(C=C(C#N)C(=O)N(c2cc(C)ccc2C)S(=O)(=O)c2ccccc2)cc1 2314777653 ORGOLFFESMPJAC-UHFFFAOYSA-N 446.528 4.641 50 10 IJGE FC(F)(CI)C(F)(F)CNCc1cc(Cl)sc1Cl 2314937622 GDDHJOTWUURGTE-UHFFFAOYSA-N 436.039 4.850 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](OCC2CCC(C(F)(F)F)CC2)[C@H](Br)C1 2327996744 RGPBNTGRCWAXFL-PQAZSJQKSA-N 430.305 4.755 50 10 IJGE CC(C)[C@H](Br)C(C)(C)CNC(=O)c1ncc(Br)cc1Cl 2365869318 VZUBDVFVPPIPKH-LBPRGKRZSA-N 426.580 4.673 50 10 IJGE CC1(C)CC(CBr)(CN2C[C@]34CCC[C@]3(C2)CN(C(=O)OC(C)(C)C)C4)C1 2371150505 XTDVWFHOEDIFJB-VXKWHMMOSA-N 441.454 4.911 50 10 IJGE CCCCCOc1ccccc1C(=O)NNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 14035785 DVLQOEXPEKFJMZ-CQSZACIVSA-N 439.339 4.791 50 10 IJGE Cc1cccc(COc2ccc(/C=N/NC(=O)CSc3nc4ccccc4[nH]3)cc2)c1 32520605 CIOPTZFHHOFWEQ-AFUMVMLFSA-N 430.533 4.693 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(/C=C(\C#N)c3nc(O)c4cc(OC)ccc4n3)o2)cc1 34988527 XQJLOQBNMXSYKZ-SFQUDFHCSA-N 441.443 4.845 50 10 IJGE COc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccc(Cl)cc3)ccc21 38649939 IBILHXJDVNLKNF-JOCHJYFZSA-N 432.863 4.786 50 10 IJGE COc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccccc2Cl)c1 38650964 WJNLKCIRWRAYNL-QFIPXVFZSA-N 432.863 4.786 50 10 IJGE Cc1ccccc1OCC(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccccc1Cl 38650992 XZYMACAQFUROGI-DEOSSOPVSA-N 446.890 4.851 50 10 IJGE COc1cc(/C=N/NC(=O)COc2ccccc2C)ccc1OCc1ccccc1Cl 40846852 ZTHIHZCJEDFTRA-VULFUBBASA-N 438.911 4.765 50 10 IJGE COc1cc2c(cc1NC(=O)CC(C)=NNC(=O)c1ccccc1F)oc1ccccc12 254382423 BHEBUKUYILBMPG-UHFFFAOYSA-N 433.439 4.868 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](O[C@@H]2C[C@H]3CC[C@@]2(C)C3(C)C)C1 303741838 PZNCMNCMCWAADV-ZEKKIGMLSA-N 449.373 4.641 50 10 IJGE ClCc1cc(I)c2scc(I)c2c1 307038639 GIJOACSXRDJVBQ-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE Cc1cccc([C@@H]2CN(C(=O)OCc3ccccc3)C[C@@H]2CI)c1 382695001 XSTBSIAYTHXGFT-OALUTQOASA-N 435.305 4.782 50 10 IJGE ClCc1c(Br)cccc1N1CC[C@@H](N2CCN(Cc3ccccc3)CC2)C1 394694502 DDVHCGRECAQYKD-LJQANCHMSA-N 448.836 4.584 50 10 IJGE FC(F)c1cc(CBr)c(I)cc1Br 575683327 AGVGYGJCYBSADG-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE O=S1(=O)CCC(CC(CBr)(CBr)C2CCCCC2)CC1 692900687 IXJNXJDPVHBSLY-UHFFFAOYSA-N 430.246 4.558 50 10 IJGE CC(C)[C@@H]1CN(c2ccc(CBr)cc2[N+](=O)[O-])CCN1Cc1ccccc1 704736083 DOQFQXWBBVCQOZ-NRFANRHFSA-N 432.362 4.837 50 10 IJGE CC[C@@H](C[C@@H](C)Br)NC(=O)c1cc(Br)sc1Br 716854917 KSRUUOYQWVVOLG-RQJHMYQMSA-N 448.018 4.955 50 10 IJGE O=C(NN=Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)c1cnn(-c2ccccc2)c1 733078099 GVMKWBAFFZLUOD-UHFFFAOYSA-N 441.438 4.779 50 10 IJGE Cc1ccc(-n2ncc(C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)c2C(C)C)cc1 736694454 ZZXPBWRRWXPJBN-UHFFFAOYSA-N 441.539 4.530 50 10 IJGE CC(C)Sc1ccc([C@H](C)NC(=O)NNC(=O)c2ccc(Br)cc2)cc1 1251636869 USAXYHATXFCDOD-ZDUSSCGKSA-N 436.375 4.655 50 10 IJGE C=CC[C@H]1CCCC[C@H]1NC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1 1470785774 DGAZPDDNPQEEKZ-WMZHIEFXSA-N 443.551 4.618 50 10 IJGE C=CCCc1ccccc1NC(=O)NNC(=O)c1ccc(OCCC(C)C)c(OC)c1 1676885033 OBNJPVYXNIFYEN-UHFFFAOYSA-N 425.529 4.705 50 10 IJGE CCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1cc(C)ccc1O)C(C#N)=C(N)O2 1865687035 HWNITEXSOPTEOK-LJQANCHMSA-N 441.318 4.974 50 10 IJGE CCc1nn(CC)c2c1[C@@H](c1ccc(OCc3ccc(Cl)cc3)cc1)C(C#N)=C(N)O2 1865694904 FGPADZHQYOYNBL-NRFANRHFSA-N 434.927 4.916 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@@H](C)N(c2nc3sccn3c2CBr)C1 1921469089 IMXHDKFEXVDEMO-JKSUJKDBSA-N 433.419 4.638 50 10 IJGE CC(C)(C)OC(=O)Nc1c(Br)cc(Br)cc1[C@@H](O)CCl 1951632703 SGMZPCKSAPZOHN-JTQLQIEISA-N 429.536 4.831 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC2CC3(CCC3)C2)CC1 1985550517 YBNJCYVCQVCYHE-UHFFFAOYSA-N 435.346 4.540 50 10 IJGE O=C(N[C@H]1[C@H]2C[C@H]1N(CC1(CBr)CCCCCC1)C2)OCc1ccccc1 1999504123 OYPITYUTVCBPAT-ZCNNSNEGSA-N 435.406 4.721 50 10 IJGE BrC[C@@]1(Cc2c(Br)cccc2Br)C[C@@]12CCOC2 2039021407 AIEZIEDMEPGNRM-ZIAGYGMSSA-N 438.985 4.946 50 10 IJGE CCC(CC)n1nc(CBr)c(I)c1C(F)(F)F 2079258182 VUPDGLYMTORQHC-UHFFFAOYSA-N 425.030 4.763 50 10 IJGE COCCN(CCCCCCCCCBr)C1CN(C(=O)OC(C)(C)C)C1 2106784083 FTLRKKDINQDNTJ-UHFFFAOYSA-N 435.447 4.680 50 10 IJGE CCCN(CC1CCN(C(=O)OC(C)(C)C)CC1)CC1(CBr)CCOCC1 2163059811 WTPRNUPORQHPEW-UHFFFAOYSA-N 447.458 4.537 50 10 IJGE CC(C)(C)OC(=O)NCCC1(O)CCN(CCCCCCCCCBr)CC1 2163064320 UDNPXHRCKXBQQK-UHFFFAOYSA-N 449.474 4.854 50 10 IJGE CCCN(C[C@H]1CCCCN1C(=O)OC(C)(C)C)CC1(CBr)CCOCC1 2163064552 UZDDPINBZYEGEA-GOSISDBHSA-N 447.458 4.680 50 10 IJGE Fc1ccc(N2CCOCC23CCN(Cc2ccccc2)CC3)c(CBr)c1 2163147842 QIQCTRDVWJSBLS-UHFFFAOYSA-N 433.365 4.592 50 10 IJGE CC(C)(C)OC(=O)N1Cc2ccc(CNC(=O)[C@H](Br)C3CCCC3)cc2C1 2167040436 RKQOUNFRAKUTNJ-GOSISDBHSA-N 437.378 4.507 50 10 IJGE COC[C@@]1([C@@H](Br)c2cc(Br)c(OC)cc2Cl)CCCO1 2202367855 YYVCXYMDEHNYJK-UONOGXRCSA-N 428.548 4.743 50 10 IJGE ICCCCCN1CC[C@H]2[C@H](CCCN2Cc2ccccc2)C1 2211184363 CWXIYDCRBCBHLT-UXHICEINSA-N 426.386 4.578 50 10 IJGE Br[C@@H]1CCC[C@H]2CN(Cc3ccc(I)cc3)CC[C@@H]12 2225475350 UMUUTYXWLIRBDT-NUEKZKHPSA-N 434.159 4.677 50 10 IJGE CC(C)(C)OC(=O)NCc1ccc2c(c1)N(CCCCCCBr)CCO2 2231086227 ARYPBCOAORISTQ-UHFFFAOYSA-N 427.383 4.865 50 10 IJGE CNc1cc(NCCSSCCNC(=O)OC(C)(C)C)c(Cl)cc1[N+](=O)[O-] 2234226891 INOCFFIMKWMREM-UHFFFAOYSA-N 436.987 4.608 50 10 IJGE CC[C@H]1[C@H](Br)CCN1C(=O)c1cc(Br)cc(Br)c1 2260379069 KVQBKLVHPJOXIY-NEPJUHHUSA-N 439.973 4.600 50 10 IJGE O=C1COc2ccc([C@@H](Br)c3scc(Br)c3Cl)cc2N1 2279284603 YQMUWCFMHDBTEH-LLVKDONJSA-N 437.540 4.979 50 10 IJGE C[C@H](NC(=O)c1cc(F)c(Br)cc1Cl)[C@H]1CCC[C@@H]1Br 2282991169 BTHUEQNIAXFSGZ-XKSSXDPKSA-N 427.539 4.924 50 10 IJGE C[C@@]1(CNC(=O)c2cc(F)c(Br)cc2Cl)CCC[C@@H]1Br 2286879675 JEOLXTSIXURXGN-JSGCOSHPSA-N 427.539 4.925 50 10 IJGE Clc1ccc(CN2CC[C@@H](CCBr)C2)c(I)c1 2302315977 PZWDKGRIJWFXFL-SNVBAGLBSA-N 428.539 4.552 50 10 IJGE CC[C@H]1CN(Cc2ccc(Cl)cc2I)C[C@@H]1Br 2302327125 WINVVLQEIVGGIC-CABZTGNLSA-N 428.539 4.550 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=C(C#N)C(=O)Nc3cccc([N+](=O)[O-])c3)o2)cc1 2313738478 FDCRBJVDRIBIMF-UHFFFAOYSA-N 431.404 4.577 50 10 IJGE Clc1ccc(CN2C[C@@H]3CC(Br)C[C@H]3C2)cc1I 2315546830 MIVSYEIDNCKZQH-QWRGUYRKSA-N 440.550 4.550 50 10 IJGE Clc1ccc(CN2CC[C@@H](Br)C23CCC3)c(I)c1 2318530557 BQZARBZNTQEMRY-CYBMUJFWSA-N 440.550 4.837 50 10 IJGE NC(=O)NN=Cc1cn(-c2ccccc2)nc1-c1ccc(OCc2ccc(Cl)cc2)cc1 2321690867 FIHTVHDDSFDWHD-UHFFFAOYSA-N 445.910 4.774 50 10 IJGE Clc1ccc(I)cc1CN1C[C@@H]2CC[C@@]2(CBr)C1 2327396088 ZLUBBQPNPHXYOF-SMDDNHRTSA-N 440.550 4.552 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@H]2CC(Cl)C[C@@H](C2)C1 2338798035 GGNGDJTWSUDKFL-HTQZYQBOSA-N 427.589 4.753 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]1C(F)(F)F 2353827463 ZFSSLSKUUYEUHC-RRFJBIMHSA-N 445.364 4.916 50 10 IJGE CC(C)[C@@H](C)[C@@H](C)N(C)S(=O)(=O)c1cc(CBr)sc1Br 2365436392 JZSKAWOUVQFOGO-NXEZZACHSA-N 447.258 4.707 50 10 IJGE CCc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(OC)c4)ccc32)cc1 38676820 PSGCFBJQMYWDLF-DEOSSOPVSA-N 426.472 4.695 50 10 IJGE Cc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)N(C)Cc4ccccc4)c(C)c32)cc1 40804756 KECCTHXRVMGOSU-SZXQPVLSSA-N 429.520 4.639 50 10 IJGE Cc1csc([C@H](C)n2c(CCl)nc3cc(I)c(F)cc32)n1 97409374 XHUZDGNSIAWJBR-QMMMGPOBSA-N 435.693 4.893 50 10 IJGE C=CCc1cccc(/C=N/NC(=O)c2ccc(NC(=O)c3cccc(Cl)c3)cc2)c1O 97729830 HOYTXAISUPFGQP-CVKSISIWSA-N 433.895 4.790 50 10 IJGE CCc1nn(CC)c(CC(CC)(CBr)CBr)c1Br 118670547 CZFCYWGKSARBLO-UHFFFAOYSA-N 445.037 4.957 50 10 IJGE C/C(C=NNC(=O)CSc1nnc(SCc2ccccc2)s1)=C/c1ccco1 254353390 XYMITIKKJQDUCP-NYWKFCTQSA-N 430.580 4.721 50 10 IJGE O=C(NN=Cc1cccn1-c1cccc(C(F)(F)F)c1)c1cc2cc([N+](=O)[O-])ccc2o1 254513286 KJVINLXXZTUBJI-UHFFFAOYSA-N 442.353 4.914 50 10 IJGE CC(C[C@@H]1C(C#N)=C(N(C)C)N(c2ccc([N+](=O)[O-])cc2)c2c1n(C)c1ccccc21)=NO 254825294 WANQCCZFLAKNDW-LJQANCHMSA-N 444.495 4.859 50 10 IJGE C[C@@H](Cl)C[C@H]1CCCCN1C(=O)c1ccc(I)c(Cl)c1 380181183 AFHRDGXYSCRRNC-ZYHUDNBSSA-N 426.125 4.957 50 10 IJGE CCN(C[C@@](C)(CI)O[C@H](C)C1CCC1)C(=O)OC(C)(C)C 719774201 FLFADVPGZPNYSR-CXAGYDPISA-N 425.351 4.642 50 10 IJGE CC(C)Oc1ccc(OC(=O)/C(C#N)=C/c2cn(CCC#N)nc2-c2ccccc2)cc1 735272366 ARPBVOOQGUPSCZ-HMMYKYKNSA-N 426.476 4.764 50 10 IJGE O=C(Nc1ccc2c(c1)CCCO2)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F 784163490 VQUBWQGAYYRZSL-SFHVURJKSA-N 444.862 4.808 50 10 IJGE COc1ccc(CSCC(=O)NN=C(C)c2ccc(NC(=O)c3ccccc3)cc2)cc1 1084215303 GGTAPRWOTULXLA-UHFFFAOYSA-N 447.560 4.721 50 10 IJGE N#Cc1ccc(NNC(=O)c2ccc(-c3cccc(Cl)c3)nc2O)c(C(F)(F)F)c1 1467403869 RVHGOPXVFDQSIJ-UHFFFAOYSA-N 432.789 4.755 50 10 IJGE Cc1cc(C)cc(NC(=O)c2oc3c(c2C)C(=NNC(=O)c2ccc(O)cc2)CCC3)c1 1772745223 UHQNPPRTPMHMLT-UHFFFAOYSA-N 431.492 4.633 50 10 IJGE COc1ccc(-c2nn(C)c3c2[C@H](c2ccc(Cl)cc2Cl)C(C#N)=C(N)O3)cc1 1865685487 JKVWBPLLHITPCE-QGZVFWFLSA-N 427.291 4.621 50 10 IJGE Cc1nn(Cc2c(F)cccc2Cl)c2c1[C@@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865688824 BZLNUEIJGDGVSZ-IBGZPJMESA-N 445.281 4.610 50 10 IJGE CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(-c2ccccc2)nn3-c2ccccn2)cc1 1865692470 BOEGNIVRWURSIA-HSZRJFAPSA-N 449.514 4.941 50 10 IJGE Cc1ccc(-c2ccc(C(=O)NNC(=O)c3cccc(Br)c3)c(C)n2)cc1C 1865756238 NGPLYRPSZLXSMR-UHFFFAOYSA-N 438.325 4.511 50 10 IJGE CCN(C[C@](C)(CBr)O[C@H]1COC2(CCCCC2)C1)C(=O)OC(C)(C)C 1879029292 KAPMDGJAKNWSSH-APWZRJJASA-N 434.415 4.905 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CCC(C)(C)N(C[C@H](CBr)c2ccccc2)C1 1879062630 RSKYACLAEBTSGH-ZWKOTPCHSA-N 425.411 4.933 50 10 IJGE CC1(C)C[C@H](C[C@@H](CBr)NC(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)C1 1880753836 JLIFOVVLKKBSJU-KBPBESRZSA-N 435.403 4.700 50 10 IJGE Brc1ccc(I)cc1SC[C@H]1C[C@@H]1Br 1887827953 NKNNJJRXDPQJNP-MUWHJKNJSA-N 447.961 4.929 50 10 IJGE O=C(c1cc(O)cc(Br)c1)N(CCCBr)Cc1ccccc1 1914604794 ZEBWMZVEUUMSHL-UHFFFAOYSA-N 427.136 4.582 50 10 IJGE C[C@H]1[C@@H](CBr)CCN1Cc1cc(Br)ccc1Br 2006507402 HUHGXKXWIABWAI-VHSXEESVSA-N 425.990 4.817 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1F 2008321654 KSKLDYRUFLXQHF-ZDUSSCGKSA-N 434.758 4.844 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1C(=O)c1cc(Br)sc1Br 2018118368 ADOIUOIDROCOHE-XPUUQOCRSA-N 446.002 4.661 50 10 IJGE CN[C@@H](c1cc(Br)c(C)cc1Br)[C@H]1C[C@H](Br)C1 2020167577 SEZKDDQZNHUKCM-JRKPZEMJSA-N 425.990 4.954 50 10 IJGE Brc1ccc(CN2C[C@@H]3C[C@H](C[C@H]3Br)C2)c(Br)c1 2045152914 CGZAUWKTVXKSEC-SUZMYJTESA-N 438.001 4.817 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CN(C[C@@H](Br)C(F)(F)F)c2ccccc21 2106781405 HKMHPGYPCAOCNZ-SWLSCSKDSA-N 437.300 4.831 50 10 IJGE CC(C)(C)OC(=O)NCCC[C@@H]1CCCCN1C(=O)[C@@H](Br)C1CCCC1 2110716719 AFFNDMVYBWBNIM-IRXDYDNUSA-N 431.415 4.626 50 10 IJGE ClCCc1nc2cncc(Br)c2n1CC1CCN(Cc2ccccc2)CC1 2151781094 XVGIPMQAJAEUCI-UHFFFAOYSA-N 447.808 4.887 50 10 IJGE CCCC(CBr)(CCC)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1CCOC 2163059795 WMHJTIGHXMPIFY-GOSISDBHSA-N 449.474 4.926 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(CCCCCCCCCBr)[C@]2(CCOC2)C1 2163065081 XHFKGESHXVHHSC-GHTZIAJQSA-N 447.458 4.870 50 10 IJGE CC(C)(C)[C@@H](CBr)CN1C[C@H](CCNC(=O)C(F)(F)F)c2ccccc21 2163065095 XJXICJOJJIQZBT-KBPBESRZSA-N 435.328 4.716 50 10 IJGE CC(C)(C)OC(=O)N1CCC2(CC[C@H](NC(=O)[C@H](Br)C3CCCC3)C2)CC1 2167035007 ZNOBDLQDKFTLNV-DLBZAZTESA-N 443.426 4.626 50 10 IJGE CCC[C@H](CC)N(C)S(=O)(=O)c1ccc(CBr)c(Br)c1 2193556800 AQURXNHVSVFQRC-LBPRGKRZSA-N 427.202 4.543 50 10 IJGE COc1ccc(CBr)c(Oc2cccc(C)c2I)n1 2277898895 ZJLKRNQKTPPDLJ-UHFFFAOYSA-N 434.071 4.690 50 10 IJGE CCn1nc(C)c(CBr)c1N(C)C1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 2281303819 OASQNPMVTCYEJT-YOFSQIOKSA-N 431.422 4.738 50 10 IJGE Br[C@@H]1CCC2(CCC2)N(Cc2sccc2I)C1 2301069309 VKQGCVGOMKVXFV-SNVBAGLBSA-N 426.161 4.635 50 10 IJGE Clc1ccc(I)cc1CN1CC[C@@H](CCBr)C1 2307332327 NGBCYBAKXRJNGX-SNVBAGLBSA-N 428.539 4.552 50 10 IJGE C[C@@H]1CN(Cc2ccc(Cl)cc2I)CC[C@@H]1CBr 2318556790 DTBJFJGMSLVYCP-GHMZBOCLSA-N 442.566 4.798 50 10 IJGE CC[C@@H]1CN(Cc2cc(I)ccc2Cl)C[C@@H]1CBr 2327408626 CZYJTOMKTUVGFS-PWSUYJOCSA-N 442.566 4.798 50 10 IJGE CN(Cc1ccc(Cl)c(I)c1)[C@H](CCCl)C(F)(F)F 2337231060 ZLNANIQFDIRTFC-LLVKDONJSA-N 426.047 4.936 50 10 IJGE C=CC[C@H](Br)[C@@H]1CCN1C(=O)c1cc(F)c(Br)cc1Cl 2360963491 JIKLQQGEVNVTLE-ZANVPECISA-N 425.523 4.796 50 10 IJGE Cc1cc(Br)c(S(=O)(=O)N(C)CCC[C@H](C)Cl)cc1Br 2361186357 ONDREWRTCCVMHJ-JTQLQIEISA-N 447.620 4.548 50 10 IJGE Cc1ccc(NCC(=O)N/N=C/c2ccc(OC(=O)c3cccc4ccccc34)cc2)cc1 2903269 OERFCAIFRZCIPV-STBIYBPSSA-N 437.499 4.930 50 10 IJGE CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(NC(=O)c3cccc(C)c3)cc2)cc1 12577311 WCDDZBWKFVHZBJ-OVVQPSECSA-N 428.536 4.857 50 10 IJGE COc1ccc(C)cc1N1C(=O)CS[C@@H]1c1ccc(NC(=O)C(C)(C)CCl)cc1 35910162 SPPQYWCHOVTROZ-HXUWFJFHSA-N 432.973 4.986 50 10 IJGE CCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(OC)cc2)c1 38650380 BMHXLCUNZOONLP-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE COc1cc(/C=C\C#N)ccc1OC(=O)/C=C/c1cc(Br)c(OC)c(OC)c1 41017015 PUWSLFXCJWYHIT-XEQCUQEESA-N 444.281 4.630 50 10 IJGE COc1ccc(C(=O)N/N=C/c2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)cc1 59464236 LWTSFWPVMOKFBE-CVKSISIWSA-N 430.895 4.965 50 10 IJGE CCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C\c2ccc(OCCC)cc2)c(OC)c1 98027938 FANSOMOVIIKYIZ-UUGKNAQTSA-N 448.519 4.536 50 10 IJGE CCc1ccccc1N/C=C(/C#N)C(=O)Nc1ccc(I)cc1C 217254167 JCGQTZODKLTNMS-QINSGFPZSA-N 431.277 4.620 50 10 IJGE C[Si](C)(C)O[C@H]1CO[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C 231127427 KEOUSSOURMHEKN-VVLHAWIVSA-N 438.862 4.855 50 10 IJGE CC[C@@H](C[C@@H](C)Cl)NC(=O)c1cc(Br)ccc1I 716924905 LRXBJTDFUKLOBX-SCZZXKLOSA-N 444.538 4.580 50 10 IJGE CN(C[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1CBr 720016912 NKOQOBUEGSOLMH-SFHVURJKSA-N 432.362 4.838 50 10 IJGE CC(=O)N(C)c1ccccc1NC(=O)/C(C#N)=C\c1cc(C)n(-c2ccccc2C)c1C 735640371 XHAGZUHXBIDHGS-JCMHNJIXSA-N 426.520 4.931 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)n2ccc(=NCC(F)(F)F)cc2)c1C 775493097 GSHMXYTWMQYMSJ-MOSHPQCFSA-N 438.453 4.914 50 10 IJGE C/C(=C/c1ccccc1Cl)C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1 1349416080 AMOAIYVXGSNOAL-PEZBUJJGSA-N 438.886 4.923 50 10 IJGE C=CCCC[C@H](C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1)c1ccccc1 1463556222 NVFGBXXWSGAMLL-JXFKEZNVSA-N 445.357 4.504 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNC(=S)Nc2cccc(C)c2C)cc1 1540367444 QRENGTWYFQMZFM-UHFFFAOYSA-N 432.549 4.881 50 10 IJGE C=CC[C@H](Cc1ccccc1)NC(=O)NNc1cccc(OC(F)F)c1Br 1564913181 HSHJJVIGTCEHKS-CQSZACIVSA-N 440.288 4.864 50 10 IJGE C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNc1ccc(Br)cc1F 1631043550 CDGKYXUENPEBEM-UHFFFAOYSA-N 433.199 4.929 50 10 IJGE Cc1ccc(C(=O)NNC(=O)c2oc3c(c2C)C(=NNc2ccccc2)CC(C)(C)C3)cc1 1772729470 PNQOPNZXMMHOIK-UHFFFAOYSA-N 444.535 4.760 50 10 IJGE CCc1nn(-c2ccc(OC)cc2)c2c1[C@@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 1865685773 MWEISGCSQAQPEG-GOSISDBHSA-N 441.318 4.968 50 10 IJGE COc1cc(/C(O)=C(\C#N)c2nc(-c3ccc(F)cc3)cs2)c([N+](=O)[O-])cc1OC 1872753254 OCVXOGDSNRWBMR-RGEXLXHISA-N 427.413 4.824 50 10 IJGE COc1ccc(C)cc1-c1csc(/C(C#N)=C(\O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)n1 1873920810 KOGFNLLIWKOXDW-MNDPQUGUSA-N 438.421 4.893 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC[C@H](C(F)(F)CCl)C1 1892708424 WHRDFDGHEMNUNU-LURJTMIESA-N 437.531 4.609 50 10 IJGE CCN(C[C@](C)(CI)OCC(C)(C)C(F)F)C(=O)OC(C)(C)C 1900148951 SJWGWHCWASOACY-INIZCTEOSA-N 449.320 4.745 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)C(=O)c1cc(Br)ccc1O 1914606981 FIRYCDHHGXYOFR-LBPRGKRZSA-N 427.136 4.581 50 10 IJGE CC(C)[C@@H](Br)CCNC(=O)c1cc(Br)sc1Br 1942762282 PNEWDNTZFWWILZ-QMMMGPOBSA-N 448.018 4.813 50 10 IJGE C[C@]1(CCl)CN(c2c(Br)cc(Br)cc2Br)C1=O 1946549963 OJTWQHFIFWMJAI-NSHDSACASA-N 446.364 4.566 50 10 IJGE Brc1ccc(C[C@H]2CCOCC[C@H]2Br)c(Br)c1 2001023413 PEKVTYVOYRGQGN-ZYHUDNBSSA-N 426.974 4.944 50 10 IJGE CN(C[C@@H](Br)COCc1ccccc1)C(=O)c1ccsc1C(F)(F)F 2039889132 VCBQJQKRXCVURM-CYBMUJFWSA-N 436.293 4.819 50 10 IJGE Brc1cc2c(cc1[C@@H](Br)C1(Br)CCC1)OCCO2 2049229027 KKWVCUHNJVHUTK-GFCCVEGCSA-N 440.957 4.974 50 10 IJGE O=S(=O)(c1cc(CBr)co1)N(Cc1ccccc1)CC1CCCCC1 2059292400 WNGDNPPWRVQXHX-UHFFFAOYSA-N 426.376 4.946 50 10 IJGE Cl[C@@H]1CCC2(CCC2)N(c2ncc(I)cc2Br)C1 2069528988 OIGYDWGSYURSJL-SECBINFHSA-N 441.538 4.579 50 10 IJGE C[C@@H]1C[C@H](O[C@H](CI)c2ccc(Br)cc2)CCO1 2084724853 KKDBWCBDVCGCMY-LERXQTSPSA-N 425.104 4.509 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@H](CBr)C(C)(C)C)CC[C@@H]1C(F)(F)F 2106781643 JVENBZGPLGFLAL-MELADBBJSA-N 445.364 4.821 50 10 IJGE CC(C)(C)OC(=O)N1CC(N(CC2CCCCC2)C[C@@H](CBr)C2CC2)C1 2106786420 UWBOTPRHKIHLMU-GOSISDBHSA-N 429.443 4.909 50 10 IJGE C[C@@H]1[C@@H](C(F)(F)F)N(C[C@@H](CBr)CC2CC2)CCN1C(=O)OC(C)(C)C 2115980978 XEFDSVPBSPCODD-YUELXQCFSA-N 443.348 4.670 50 10 IJGE CCN(CC)CCCO[C@@H](CI)c1ccc(Br)cc1 2119265515 YLZQDGNDYIRKPD-HNNXBMFYSA-N 440.163 4.674 50 10 IJGE CC(C)(C)OC(=O)NCc1ccccc1CNC(=O)c1ccc(CBr)cc1 2162494939 OTQPASHMTPBFDD-UHFFFAOYSA-N 433.346 4.536 50 10 IJGE CO[C@@]1(CN(C)c2c(CBr)ccc(Br)c2Cl)CCSC1 2186290326 BNMMARHQIPXTPI-CQSZACIVSA-N 443.632 4.956 50 10 IJGE Cc1cc(Br)sc1[C@H](Br)c1cscc1S(C)(=O)=O 2260093499 YFNFSFDIKHYCFK-SNVBAGLBSA-N 430.208 4.768 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@H]2CC[C@@H](Br)[C@H]1C2 2264506559 JSXVTJCSKWCFMF-NQMVMOMDSA-N 427.589 4.942 50 10 IJGE Clc1ccc(CN2CCC[C@H](CBr)C2)cc1I 2300238489 LQQBVYVHIFCMAS-LLVKDONJSA-N 428.539 4.552 50 10 IJGE CCCCCN1C(=O)C(=Cc2ccc(-c3ccc(C(=O)OCC)cc3)o2)C(C)=C(C#N)C1=O 2314611273 RYFGIQWFIOGYCZ-UHFFFAOYSA-N 446.503 4.906 50 10 IJGE CCOc1ccc(C=NNC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc1OCC 2323607382 HVTJATHJRQPYBG-UHFFFAOYSA-N 426.542 4.625 50 10 IJGE C[C@@H]1CCCN(Cc2ccc(I)c(Br)c2)[C@@H]1CCl 2325207936 SQKGOAGKKIYWKD-QMTHXVAHSA-N 442.566 4.893 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Cl)c1c(Br)ncn1C 2337273316 TVNMPPGXNCIWLA-SECBINFHSA-N 428.939 4.935 50 10 IJGE CCN(C[C@]1(CBr)CC1(F)F)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2351889062 NYTYIYIMSGIGOF-JCHQDKQGSA-N 437.369 4.659 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1[C@H]2CC[C@H](C2)[C@H]1CBr 2359285778 NZXGBMHDVCAZIF-BFHDXFOESA-N 425.523 4.630 50 10 IJGE CN(CC1CCN(Cc2ccccc2)CC1)c1c(CBr)c(C(F)F)nn1C 2365331533 HYQIDIJVKAROIM-UHFFFAOYSA-N 441.364 4.601 50 10 IJGE CCOc1ccc(/C=C2\CN(C)CC3=C2OC(N)=C(C#N)[C@@H]3c2ccc(OCC)cc2)cc1 19898851 IMALPVYECIGASW-SUUHDTSPSA-N 443.547 4.575 50 10 IJGE Cc1ccc(NC(=O)CO/C(=C(/C#N)c2nnc3n2CCCCC3)c2ccccc2)cc1C 33627563 QXLNHKFFJYUALR-LVWGJNHUSA-N 441.535 4.669 50 10 IJGE O=C(NNc1ncnc(Nc2cccc3ccccc23)c1[N+](=O)[O-])c1ccccc1Cl 40627201 MXONIRWJXVVRDG-UHFFFAOYSA-N 434.843 4.692 50 10 IJGE O=C(CSc1nc(-c2ccccc2)cs1)N/N=C/c1cccc(Br)c1 40924264 XHXFEFBKYIUNHS-KEBDBYFISA-N 432.368 4.815 50 10 IJGE CCOc1ccc2ccccc2c1/C=N\NC(=O)c1cccn(Cc2cccc(C)c2)c1=O 169918112 CHJQIRZWPANBOT-QRQIAZFYSA-N 439.515 4.521 50 10 IJGE C[C@H]1CCN(C(=O)c2cc(Br)c(Br)s2)C[C@@H]1Br 230293421 DZNPMIPHIMYLQB-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE CCC[C@@H](C)CO[C@]1(CI)CCCN(C(=O)OC(C)(C)C)C1 233267439 QWSASFXCRXBKPI-PBHICJAKSA-N 425.351 4.644 50 10 IJGE COc1cc2c(cc1NC(=O)CC(C)=NNC(=O)c1cccc(C)c1O)oc1ccccc12 254392167 QZEQADWXIKAGKH-UHFFFAOYSA-N 445.475 4.743 50 10 IJGE CCC(C)(C)[C@H]1CCc2[nH]nc(C(=O)NN=Cc3c(C)nn(-c4ccccc4)c3C)c2C1 263625960 UEFRJCRGEMBCRI-SFHVURJKSA-N 432.572 4.517 50 10 IJGE ClCc1cc(I)cc2cc(I)sc12 307524916 GPNOWBKLVSKAQA-UHFFFAOYSA-N 434.467 4.849 50 10 IJGE COC(=O)[C@H](Br)C1(Oc2c(C)cc(Br)cc2Cl)CCC1 312910014 ZTFJBGCVVSVBDY-LBPRGKRZSA-N 426.532 4.649 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1C[C@H]2C[C@H](Cl)CC[C@H]2C1 398668292 GWHNQCVGIYFIOW-DJLDLDEBSA-N 427.589 4.753 50 10 IJGE O=[N+]([O-])c1sc(CBr)cc1Oc1ccccc1I 404267845 IQRPDQGMQHUJKB-UHFFFAOYSA-N 440.056 4.948 50 10 IJGE C[C@@H]1CCCN(Cc2cc(Cl)ccc2I)[C@H]1CBr 688704353 GKEISVMXPDRPHG-YGRLFVJLSA-N 442.566 4.940 50 10 IJGE O=S(=O)(N[C@H](CCBr)C1CCCCC1)c1cc(Br)cs1 725085227 JDZGRJRPVVOIQP-GFCCVEGCSA-N 445.242 4.523 50 10 IJGE COc1ccc(-c2cc(N)c(C(=O)NN=C(C[C@H]3CCOC3)c3ccccc3)s2)cc1 753923971 PCRQWUCUBIHLCF-MRXNPFEDSA-N 435.549 4.567 50 10 IJGE C#Cc1cccc(NC(=S)NNC(=O)c2csc(-c3cccc4ccccc34)n2)c1 777977833 PLBWIYKZXPVGHM-UHFFFAOYSA-N 428.542 4.576 50 10 IJGE Cc1nc(-c2ccc(NC(=O)/C(C#N)=C/c3cn(CCC#N)nc3-c3ccccc3)cc2)co1 918013501 IEGUEUUDUFCYOD-KGENOOAVSA-N 448.486 4.973 50 10 IJGE CCOc1ccc([C@@H](O)CCC(=O)NN=Cc2ccc(-c3cccc(C(C)=O)c3)o2)cc1 1084358261 BTOPIPAYZRQWRR-QHCPKHFHSA-N 434.492 4.512 50 10 IJGE CC(C)Oc1cc(Br)ccc1C(=O)NNc1nc2ccccc2[nH]c1=S 1629908154 VWDNOWDWWHKMAL-UHFFFAOYSA-N 433.331 4.599 50 10 IJGE Cc1ccn2cc(C(=O)NNC(=O)c3ccc(-c4ccc5ccccc5c4)s3)nc2c1 1860391438 HAKZNEHBTCTSKF-UHFFFAOYSA-N 426.501 4.599 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2cccc(F)c2)[C@@H]1c1cccc(O)c1 1865681370 LMVMSDSRNJBFQT-JOCHJYFZSA-N 438.462 4.661 50 10 IJGE CCc1nn(-c2ccc(Cl)c(Cl)c2)c2c1[C@H](c1cccc(O)c1)C(C#N)=C(N)O2 1865681442 NKUMKDGIGDCMDI-GOSISDBHSA-N 427.291 4.665 50 10 IJGE CCCc1nn(Cc2ccc(F)cc2)c2c1[C@@H](c1ccc(OCC)cc1)C(C#N)=C(N)O2 1865694433 UYGYRLMPYZYJMZ-QFIPXVFZSA-N 432.499 4.640 50 10 IJGE Cc1nc(-c2ccc(Cl)cc2)ccc1C(=O)NNC(=O)CCn1ccc2ccccc21 1865755512 BVQPORBXXMVKBT-UHFFFAOYSA-N 432.911 4.516 50 10 IJGE N#CSc1ccc(Nc2cc(N3CCC[C@H](CO)C3)nc(Cc3ccccc3)n2)cc1 1868206999 BVSVMKACPNCGCA-IBGZPJMESA-N 431.565 4.593 50 10 IJGE CC[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1[C@H](CBr)NC(=O)OC(C)(C)C 1880757030 WEQGIGPVAGMLJH-KFWWJZLASA-N 435.403 4.558 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CCl)Cc1c(Br)cccc1Br 1882069048 DKRSXSLFVUEXLB-SECBINFHSA-N 427.564 4.886 50 10 IJGE Cc1nc(Br)c([C@H](Br)c2ccc(Br)s2)n1C 1900420673 FNEUZGWRLFOTLR-MRVPVSSYSA-N 428.975 4.799 50 10 IJGE BrC[C@@H]1CSCCN1Cc1cccc(Br)c1Br 1943880599 HQHAKDJCVTXGLI-SNVBAGLBSA-N 444.030 4.524 50 10 IJGE BrC[C@H]1CCCCN1Cc1cccc(Br)c1Br 1943883356 ZYTFGAMVQAGIMC-LLVKDONJSA-N 425.990 4.961 50 10 IJGE CC1(C)CN(C(=O)c2cc(Br)c(Br)s2)[C@@H]1CBr 1944083959 DNELKMUMPHAWCE-MRVPVSSYSA-N 446.002 4.519 50 10 IJGE O=C(N[C@H](CBr)CC1CC1)c1cc(Br)ccc1Br 2029978608 WIHJCRZTTZOJSH-JTQLQIEISA-N 439.973 4.505 50 10 IJGE Cc1ccc(C2=CSC(=C(C#N)C(=O)CN3CCC(Cc4ccccc4)CC3)N2)cc1 2040464418 MSZDTEQYVGOGCK-UHFFFAOYSA-N 429.589 4.889 50 10 IJGE CN(C(=O)c1csc(I)c1)[C@H]1CCCCC[C@H]1Br 2052427309 BUAYTIOINKPLKX-MNOVXSKESA-N 442.160 4.521 50 10 IJGE BrC[C@@H]1C[C@@H]2CN(Cc3c(Br)cccc3Br)C[C@H]21 2053980536 HKCQCAJBTUVTJR-AXFHLTTASA-N 438.001 4.674 50 10 IJGE Cc1csc(C(=O)N(C)C2(CBr)CCSCC2)c1Br 2114720927 MIYDGTGYFNEBAK-UHFFFAOYSA-N 427.227 4.552 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2-c1cnn(Cc2ccccc2)c1 2128514309 ZFRIRVWLCUQNOI-UHFFFAOYSA-N 430.737 4.518 50 10 IJGE COc1ccc([C@@H](Br)Cc2ccccc2I)cc1OC 2143868526 PFKHAANVZUGTNP-ZDUSSCGKSA-N 447.110 4.987 50 10 IJGE COc1cc(F)c([C@@H](Br)c2nn(C)c(Cl)c2Br)c(F)c1 2167047331 IKJOKKJBFFZEPP-SECBINFHSA-N 430.474 4.607 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2N1C(=O)OC(C)(C)C 2196913242 CNCQUVONXAFDIT-ZBRFXRBCSA-N 443.426 4.577 50 10 IJGE C[C@@H](Br)CN(Cc1ccccc1)C[C@@H]1CC1(Br)Br 2208937066 KDNDXGRVDONJFT-YPMHNXCESA-N 440.017 4.778 50 10 IJGE Cn1cc(-n2c(CCl)nc3cc(Cl)c(Br)cc32)c(Br)n1 2238992999 ZPIPHZGFASXMOU-UHFFFAOYSA-N 438.938 4.676 50 10 IJGE C[C@@H]1CC[C@@H](CBr)N(C(=O)c2cc(F)c(Br)cc2Cl)C1 2282987911 KQVZLCZGCGKEHN-BDAKNGLRSA-N 427.539 4.877 50 10 IJGE O=C(N[C@@H](CCBr)C(F)(F)F)c1cc(F)c(Br)cc1Cl 2282990291 PWCDBLQKTKFJJY-VIFPVBQESA-N 441.444 4.687 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1C[C@H](Br)CC12CCC2 2285847049 WCEMVYDSAJJUKL-MRVPVSSYSA-N 425.523 4.774 50 10 IJGE CCOC(=O)C(C#N)=Cc1cc(Cl)c(OCCOc2ccc(C)c(C)c2)c(OC)c1 2293110787 VTKQNRMHSVGKMH-UHFFFAOYSA-N 429.900 4.893 50 10 IJGE CCOc1cccc(NC(=O)C(C#N)=Cc2ccc(OCc3ccc(C(=O)O)cc3)cc2)c1 2294193428 OPNKDCNNRMUUSA-UHFFFAOYSA-N 442.471 4.908 50 10 IJGE CCCNC(=O)c1cc2ccc(OC(=O)C(C#N)=Cc3ccc(C(C)C)cc3)cc2oc1=O 2314751104 PWONUUMLMJCPSA-UHFFFAOYSA-N 444.487 4.569 50 10 IJGE Clc1ccc(CN2C[C@H]3CC[C@H]2C[C@@H]3Br)c(I)c1 2318546850 WLDFOHDQCMNIQK-ICCXJUOJSA-N 440.550 4.692 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1C(F)(F)F 2328527842 MLRAEQSTVMHVHY-KBPBESRZSA-N 431.337 4.527 50 10 IJGE CC(C)(C)OC(=O)NCCCCCC(=O)NN=Cc1ccc(OCc2ccccc2)cc1 2328835249 TVZRCXPKZBXZGM-UHFFFAOYSA-N 439.556 4.801 50 10 IJGE O=C(NCC[C@H]1CCCC[C@@H]1Cl)c1ccc(Cl)cc1I 2365592375 PLPQHYLMEUHHPP-MFKMUULPSA-N 426.125 4.862 50 10 IJGE Cc1c(C(=O)Nc2nc3ccccc3s2)oc2c1/C(=N/NC(=O)c1ccco1)CCC2 40814453 DUCFIYKSSQJTQC-AFUMVMLFSA-N 434.477 4.513 50 10 IJGE N#C/C(=C\c1cc(Br)ccc1OCc1ccccc1)C(=O)NC1CCCC1 59281845 RLIRMEHVJGAMDC-LDADJPATSA-N 425.326 4.994 50 10 IJGE CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)N/N=C/c1cccc(Oc2ccccc2)c1 96557029 LHTDVZYQGDZNQS-SIAYLZOOSA-N 429.520 4.774 50 10 IJGE CCCN(CCBr)C(=O)c1cc(Br)c(Br)s1 123191850 JCJFKXMABSNNQB-UHFFFAOYSA-N 433.991 4.520 50 10 IJGE O=c1[nH]c2cc(Br)c([C@H](Cl)c3c(F)cccc3Br)cc2[nH]1 161208932 ZVSUZHRGWAOIFK-ZDUSSCGKSA-N 434.490 4.849 50 10 IJGE O=[N+]([O-])c1ccc(Oc2ccccc2I)c(CBr)c1 218229619 YKKMQUTUPACRBP-UHFFFAOYSA-N 434.027 4.887 50 10 IJGE CC(C)(C)C[C@H](Br)CNS(=O)(=O)c1ccc(Cl)c(Br)c1 226267143 QWMPOLDTTVKWKD-VIFPVBQESA-N 447.620 4.581 50 10 IJGE Cc1c(C=NNC(=O)CNc2ccccc2)c2ccccn2c1C(=O)c1ccc(Cl)cc1 254843694 JSKCPMQETRCVHW-UHFFFAOYSA-N 444.922 4.694 50 10 IJGE aggregator C[C@@H]1[C@H](Cl)C[C@H]2CC[C@H]1N2C(=O)c1cc(Br)sc1Br 686186470 QXTWWMNNCNRVLN-KHUVANEUSA-N 427.589 4.894 50 10 IJGE CC[C@H](Br)CCCNC(=O)c1scc(Br)c1Br 705441571 IXGZIPJEDMHXOO-ZETCQYMHSA-N 448.018 4.957 50 10 IJGE CN(C(=O)c1cc(Br)sc1Br)[C@H]1CCC[C@H]1Br 709101710 GDOIVCXYYAHHMH-SFYZADRCSA-N 446.002 4.661 50 10 IJGE Cc1ccc(F)c(NNC(=O)c2c(C)nn(Cc3cccc(Br)c3)c2C)c1 760140939 FAJQOSYITRJYKD-UHFFFAOYSA-N 431.309 4.515 50 10 IJGE C#CCCCC(=O)NNC(=O)/C(=C\c1cccc(OCc2ccccc2)c1)c1cccs1 1635718582 MLZQAFPGFNWWHT-NKFKGCMQSA-N 444.556 4.819 50 10 IJGE COc1cc(C=NNC(=O)COc2ccccc2C(C)C)ccc1OCc1ccccc1 1772754761 UDPDOGZKDGKHOL-UHFFFAOYSA-N 432.520 4.927 50 10 IJGE CCc1ccc(-c2ccc(C(=O)NNC(=O)[C@@H](C)Oc3ccc(C(C)C)cc3)c(C)n2)cc1 1865758486 CLTKQNLLDNHPIO-LJQANCHMSA-N 445.563 4.971 50 10 IJGE CCCC(CBr)(CCC)CS(=O)(=O)c1cncc(Br)c1 1921668145 QXAYEKWCRFCMGC-UHFFFAOYSA-N 427.202 4.599 50 10 IJGE CCC[C@@H](Br)CCNC(=O)c1cc(Br)c(Br)s1 1942748942 TUNVFNMOJHQXRQ-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE BrCC[C@@H]1CCN(Cc2c(Br)cccc2Br)C1 1945332448 CJLWWGJZBRUGSH-SNVBAGLBSA-N 425.990 4.819 50 10 IJGE Cc1c(Br)sc([C@H](Br)[C@H]2[C@H]3COC[C@H]32)c1Br 1982233720 YSULNWHTEVGMOS-JVZYCSMKSA-N 430.987 4.910 50 10 IJGE Cn1cc(Br)c(COc2c(Cl)cc(Cl)cc2CBr)n1 2087326055 YMMQFFURUCHYDA-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE CCCN1CC[C@H]([C@@H](Br)c2cccc(OCc3ccccc3)c2)S1(=O)=O 2089515989 UQPDUIQEPZUBQY-UXHICEINSA-N 438.387 4.516 50 10 IJGE CN(C(=O)c1c(Br)cccc1Br)C1(CCl)CCSCC1 2171183686 LYICNTIPXCSKFJ-UHFFFAOYSA-N 441.616 4.788 50 10 IJGE CCCC[C@H](CC)N(C)S(=O)(=O)c1cc(CBr)oc1Br 2193563397 UQDDCPCHQRJNHF-JTQLQIEISA-N 431.190 4.526 50 10 IJGE CCCC[C@@H](CC)N(C)S(=O)(=O)c1cc(CBr)oc1Br 2193563398 UQDDCPCHQRJNHF-SNVBAGLBSA-N 431.190 4.526 50 10 IJGE Cc1c(NC(=O)OC(C)(C)C)ccc(C(=O)N(C)C[C@H]2C[C@@H](Br)C2)c1C 2268159237 GCMJTEXEWLUFCW-GASCZTMLSA-N 425.367 4.896 50 10 IJGE COc1ccc([C@H](Br)[C@H]2Cc3ccccc3O2)cc1I 2284998055 JPHWEYLIAXQRRT-CVEARBPZSA-N 445.094 4.740 50 10 IJGE C[C@H]([C@H](Br)c1c(F)cc(Cl)c(Br)c1Cl)S(C)(=O)=O 2313742934 IGFUBBMJAOPQKU-VHWMUFPASA-N 442.959 4.764 50 10 IJGE Cc1ccc(C[C@H](Br)c2c(Br)c(Br)nn2C)cc1 2316701445 NWRUQWTXQWVHML-JTQLQIEISA-N 436.973 4.932 50 10 IJGE O=C(c1cc(F)c(Br)cc1O)N(Cc1ccccc1)[C@H](CCl)C1CC1 2317272162 SQXHWDUXYKXORX-QGZVFWFLSA-N 426.713 4.954 50 10 IJGE O=C(NN=Cc1ccc(OCc2ccccc2)c(Cl)c1)c1ccc2nc(S)[nH]c2c1 2323603488 KPGZOYZFKIZGIH-UHFFFAOYSA-N 436.924 4.848 50 10 IJGE Clc1ccc(I)cc1COc1cccnc1CBr 2327238810 XTTXAQBOGFOIHD-UHFFFAOYSA-N 438.490 4.814 50 10 IJGE CC(C)C[C@H](CBr)CN1C[C@H](CNC(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1 2353830106 JQWDGJWTPGHUBP-QLFBSQMISA-N 445.364 4.679 50 10 IJGE CN(C(=O)c1ccc(Cl)cc1I)[C@@H](CCCl)C(F)(F)F 2365589905 ALASPDZRVPITSI-JTQLQIEISA-N 440.030 4.576 50 10 IJGE O=C(c1ccc(Cl)cc1I)N1CCCC[C@@H]1CCCCl 2365592824 QCPDNGKNJFCOEE-GFCCVEGCSA-N 426.125 4.958 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc(NS(=O)(=O)CCCCCl)cc1C(F)(F)F 2366954017 GGYJEKUFRNTKKH-UHFFFAOYSA-N 430.876 4.813 50 10 IJGE CC(C)=NNC(=O)c1ccccc1NC(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 33809482 CVFPSUWOURSZEL-UHFFFAOYSA-N 440.843 4.886 50 10 IJGE Cc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3cccc([N+](=O)[O-])c3)c(C)c21 40811537 VMCBAABTZIGXEH-LGUFXXKBSA-N 446.463 4.527 50 10 IJGE O=C(N/N=C/c1ccccc1F)c1ccccc1OCc1ccc(Br)cc1 96095893 CFUQMYOEGJODFH-ZMOGYAJESA-N 427.273 4.931 50 10 IJGE COc1cc(/C=C(/C#N)C(=O)NCc2ccco2)ccc1OCCOc1c(C)cccc1C 96515426 YQGYGNFAYOKJSO-STZFKDTASA-N 446.503 4.586 50 10 IJGE N#C/C(C(=O)Cn1cnc2sc(-c3ccccc3)cc2c1=O)=C1\Nc2ccccc2S1 103908379 MUFDSZIUHAGZLC-JWGURIENSA-N 442.525 4.647 50 10 IJGE COc1ccc([C@@H](Br)c2csc(I)c2)c(OC)c1 124412586 CWPDCDZVKNWAMJ-ZDUSSCGKSA-N 439.112 4.854 50 10 IJGE C[C@@H](Br)[C@](Br)(CBr)C(=O)Oc1ccccc1Cl 205782739 CRFLXWUXTJXTLN-RDDDGLTNSA-N 449.364 4.557 50 10 IJGE N#C/C(=C/N1CCN(Cc2ccccc2)CC1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 217249598 VQUSWMVOKOTMDB-ICFOKQHNSA-N 448.876 4.523 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](c2cccc(Cl)c2F)[C@@H](CI)C1 382682812 CHDACDDJQDIXPV-JQWIXIFHSA-N 439.696 4.865 50 10 IJGE CC[C@H]1CN(C(=O)c2cc(Br)c(Br)s2)C[C@@H]1Br 399999732 MHANCYXZBKSAKX-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE C[C@@H](Br)[C@@H]1CCCCN1c1ncc(Br)cc1Br 688877415 ZSPGQSJICNSECX-KCJUWKMLSA-N 426.978 4.749 50 10 IJGE C[C@H](CC(CBr)(CBr)C1CCCCCC1)CS(C)(=O)=O 706456866 YGDXTYMKBRCWKQ-CYBMUJFWSA-N 432.262 4.804 50 10 IJGE Fc1cccc([C@@H](Br)c2ccc3c(c2)CCO3)c1I 721683160 FURLOPNJTQATMT-AWEZNQCLSA-N 433.058 4.850 50 10 IJGE Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)CC/C=C\c3ccccc3)cc12 737468890 YXEXLRRYSZPHFF-WQLSENKSSA-N 430.533 4.650 50 10 IJGE O=C(NNc1c(Cl)cccc1Cl)C(=O)Nc1nc2c3c(ccc2s1)CCCC3 773699201 OPKIQEPPINOHBA-UHFFFAOYSA-N 435.336 4.564 50 10 IJGE Cc1ccc(C(=O)CC(C)(C)CC(=O)NNc2nc(-c3cccnc3)nc(C)c2C)cc1 781935808 WFYMPTKFQUVLAE-UHFFFAOYSA-N 431.540 4.596 50 10 IJGE O=C(CN(Cc1ccccc1)Cc1ccccc1)NN=Cc1cccc(Br)c1 1083986794 KAQJPVZCBICWON-UHFFFAOYSA-N 436.353 4.602 50 10 IJGE CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)C[C@@H](CBr)C1CC1 1460053126 RMJSRDCHSBRDEX-LJQANCHMSA-N 425.411 4.825 50 10 IJGE CCc1nn(Cc2ccc(Cl)cc2)c2c1[C@H](c1cc(Cl)ccc1O)C(C#N)=C(N)O2 1865689801 WWLJHKPJBAFGNU-LJQANCHMSA-N 441.318 4.724 50 10 IJGE COc1ccc(OC)c(-c2csc(/C(C#N)=C/c3cc(OC)c(OC)c(OC)c3)n2)c1 1872791835 VAVUPVQSQPGPSI-OVCLIPMQSA-N 438.505 4.917 50 10 IJGE CC[C@@H]1C[C@@H]1CCOC1(CI)CCN(C(=O)OC(C)(C)C)CC1 1902773300 HMSPAGAFQULRMM-CABCVRRESA-N 437.362 4.644 50 10 IJGE CC[C@@H](Br)CN(Cc1ccccc1)C(=O)c1c(F)ccc([N+](=O)[O-])c1F 1915097175 RGJVMSAXAXGNPQ-CYBMUJFWSA-N 427.245 4.689 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)c1csnc1Br 1925212188 SEXXURPYGKHKFM-AWEZNQCLSA-N 446.208 4.968 50 10 IJGE O=C(c1csnc1Br)N(Cc1ccccc1)C1(CBr)CCC1 1925217342 SVFWESVOJBEQQS-UHFFFAOYSA-N 444.192 4.866 50 10 IJGE CC[C@@H](Br)C(=O)Nc1ccc(Cl)c(I)c1Cl 1937733458 IBHSAJDEBMOMPM-RXMQYKEDSA-N 436.902 4.710 50 10 IJGE O=C(N[C@H]1CCC[C@@H]1CBr)c1csc(Br)c1Br 1945189136 JVGNCHJBFAVNFX-SVRRBLITSA-N 446.002 4.567 50 10 IJGE CC1(C)OCCO[C@@H]1[C@H](Br)c1sc(Br)cc1Br 2013734245 NGVZPHXZLKYIMJ-PSASIEDQSA-N 449.002 4.903 50 10 IJGE BrC[C@@H]1CN(Cc2c(Br)cccc2Br)CC12CC2 2033086417 LUZCHSZNQZDECI-SNVBAGLBSA-N 438.001 4.819 50 10 IJGE CC(=O)OC1=C(C=O)CCc2c1c(C)nn2-c1cc(C(F)(F)F)cc(C(F)(F)F)c1 2080383899 BGNRBNMWAYLKCZ-UHFFFAOYSA-N 432.320 4.638 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1C[C@@H]2CCC[C@H](C1)C2Br 2115942828 PHOZJXXPRYFUFM-OQJHAAMPSA-N 427.589 4.800 50 10 IJGE CN(C(=O)c1cc(Br)sc1Br)[C@H](CCCl)C(F)(F)F 2121994183 FIADFRKHEJYRRJ-ZCFIWIBFSA-N 443.510 4.905 50 10 IJGE O=S1(=O)C[C@@H]2CCC[C@@]2([C@@H](Cl)c2cc(Br)sc2Br)C1 2137227281 LSWFRBGWIZVEQK-VIRWGQHYSA-N 448.629 4.768 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Br)c2n1CCc1nccn1Cc1ccccc1 2151788580 JEPHQHSAXXQEJO-CQSZACIVSA-N 444.764 4.981 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@]1(C)CCN(Cc2ccccc2)C1 2153105849 IEGRWTINGDTYHH-OAQYLSRUSA-N 447.808 4.905 50 10 IJGE Clc1ccc(CN2CCC(COCCBr)CC2)cc1Br 2167398198 KVUKVQQLWWNMPC-UHFFFAOYSA-N 425.592 4.726 50 10 IJGE O=C(c1c(Cl)cccc1Br)N1CCC(F)(F)[C@@H](CBr)C1 2169465758 UISSWLKCGPRQHM-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE Cc1c(Cl)cc(CN2CCOC[C@@](C)(CBr)C2)cc1Br 2199837759 IZBNCQKZKDIPJO-HNNXBMFYSA-N 425.592 4.644 50 10 IJGE Fc1cc(Br)c(Br)cc1[C@H](Br)[C@@H]1[C@H]2CCO[C@H]21 2213490728 VYMFIKGUJLQYMM-ZZKGKEEZSA-N 428.921 4.822 50 10 IJGE CC(C)CN(C[C@@H](C)Br)c1ncc(Br)cc1Br 2250501552 UJQWNSHEJWPBFT-SECBINFHSA-N 428.994 4.852 50 10 IJGE Cc1nc(N(C)Cc2ccc(I)cc2)sc1CBr 2254410668 LGZLYJYKCVSSSO-UHFFFAOYSA-N 437.144 4.587 50 10 IJGE CC1CC(CBr)(CN2C[C@H]3CCC[C@@](N(C)C(=O)OC(C)(C)C)(C3)C2)C1 2265310985 AKPVIZPQZGLWKB-HPAHXVRCSA-N 429.443 4.909 50 10 IJGE Fc1cccc(I)c1[C@@H](Br)c1ccc2c(c1)COC2 2267740808 WVOUZTBDOIJSNC-HNNXBMFYSA-N 433.058 4.945 50 10 IJGE CN(C(=O)c1ccc(Cl)c(I)c1)[C@@H](CCCl)C(F)(F)F 2283661127 FMWYVAWNMPADKV-JTQLQIEISA-N 440.030 4.576 50 10 IJGE CC1(C)CN(C(=O)c2cc(Br)c(F)cc2Cl)C[C@@H]1CBr 2285845752 FLMAMIRKZRWVPS-QMMMGPOBSA-N 427.539 4.735 50 10 IJGE ClC[C@@H]1CCCCN1Cc1ccc(I)c(Br)c1 2306218319 YZKPENLRCLQKNQ-NSHDSACASA-N 428.539 4.647 50 10 IJGE CC1CC(CCl)(NCc2ccc(I)c(Br)c2)C1 2306223114 ARKGTWZSAHQDSC-UHFFFAOYSA-N 428.539 4.551 50 10 IJGE CC(=CC(=O)C(F)(F)C(F)(F)C(F)(F)F)NNC(=O)c1ccc(-c2ccccc2)cc1 2313523411 RVGIOAPVAWJGLS-UHFFFAOYSA-N 448.338 4.894 50 10 IJGE COc1cc(C=C(C#N)S(=O)(=O)c2ccccc2)cc(OC)c1OCc1ccccc1 2331029811 CPXOVNFYMNRJRK-UHFFFAOYSA-N 435.501 4.621 50 10 IJGE CCOc1cccc(N2CC[C@H]3CN(Cc4ccccc4)C[C@@H]3C2)c1CBr 2367555678 OKMQNBODBVOHEF-VQTJNVASSA-N 429.402 4.939 50 10 IJGE CC(C)CO[C@@H]1[C@H](Cl)C[C@H]1OCc1cc(I)ccc1Cl 2380343034 OWBMMHKZDWFKQE-RBSFLKMASA-N 429.125 4.882 50 10 IJGE Cc1ccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4cccc([N+](=O)[O-])c4)c(C)c32)cc1 40804719 CTFPAJWUTMGERI-LGUFXXKBSA-N 446.463 4.527 50 10 IJGE CCCCCCOc1ccc(/C=N/NC(=O)COc2ccc(Br)cc2)cc1 40912070 JPVZQQUVOGVARI-HZHRSRAPSA-N 433.346 4.937 50 10 IJGE CCOC(=O)/C(C#N)=C/c1cccc(OC(=O)COc2ccc(-c3ccccc3)cc2)c1 40934374 PZSJNIYJHKXJLM-PXLXIMEGSA-N 427.456 4.808 50 10 IJGE Cc1c(I)cccc1NC(=O)c1ccc(CBr)cc1 311674903 BIOJAEDPGKVVFF-UHFFFAOYSA-N 430.083 4.747 50 10 IJGE O=S(=O)(Nc1cccc(CCCBr)c1)c1cc(Br)cs1 312676581 OIISLUUFFHIMRT-UHFFFAOYSA-N 439.194 4.639 50 10 IJGE ClCc1nc2cc(Br)cnc2n1C[C@@H]1CCCCN1Cc1ccccc1 379577966 BGFRIOJRHMVKAE-KRWDZBQOSA-N 433.781 4.987 50 10 IJGE C[C@H]1CN(c2nc3ccccn3c2CBr)[C@H](C)[C@@H](C)N1Cc1ccccc1 404261085 DMOJEVTVAJCZBA-RCCFBDPRSA-N 427.390 4.717 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1cccc([C@H]2CCN(S(N)(=O)=O)c3ccccc32)c1 616674277 BMJGQAYHQCMVJU-LJQANCHMSA-N 432.662 4.754 50 10 IJGE CC[C@H](Br)CCNc1ncc(C(F)(F)F)cc1I 686108345 DYMPWNBPPJLEAX-QMMMGPOBSA-N 437.041 4.681 50 10 IJGE Cc1cc(Br)c([C@@H](Br)c2cn(C)c(Br)n2)s1 698419763 QPYLXBVRPIIUFQ-QMMMGPOBSA-N 428.975 4.799 50 10 IJGE Cc1cccc(C(=O)N(CCBr)c2ccccc2)c1I 714527112 VIEFTILTXKIXDE-UHFFFAOYSA-N 444.110 4.641 50 10 IJGE O=C(NNC(=O)c1ccccc1OCc1ccc(F)cc1)N[C@@H](c1ccccc1)C1CCC1 729614799 OWCWODGVIYHDHQ-DEOSSOPVSA-N 447.510 4.890 50 10 IJGE N#Cc1ccc(NNC(=O)NCc2ccc(Oc3cccc(F)c3)nc2)c(C(F)(F)F)c1 799563700 LBDIWBMFYMVXLQ-UHFFFAOYSA-N 445.376 4.730 50 10 IJGE CCOC1=N/C(=C(\C#N)N=Nc2ccc(OC)cc2)NC(=N)[C@H]1N=Nc1ccc(OC)cc1 1084251882 OZMQFSNQCOMIOT-KCKXCHHKSA-N 446.471 4.648 50 10 IJGE CC1(C)Cc2cc(NC(=O)NN=Cc3ccc(OC(F)(F)C(F)F)cc3)ccc2O1 1088648081 AJURVPICDJQMBS-UHFFFAOYSA-N 425.382 4.792 50 10 IJGE CC(=O)N1CCc2c(NC(=O)/C(C#N)=C/c3cc(C)n(-c4cccc(C)c4)c3C)cccc21 1459312551 KXOXZHJGFUYYTR-PXLXIMEGSA-N 438.531 4.857 50 10 IJGE CC(C)(C)N(/N=C/c1ccc(S(C)(=O)=O)cc1)C(=O)c1cc(Cl)cc(Cl)c1 1615947169 YYYJPFAXSNXLAH-WSDLNYQXSA-N 427.353 4.672 50 10 IJGE C#CCN(C(=O)/C(C#N)=C\c1cc(C)n([C@H](C)COC)c1C)[C@H]1CCCc2ccccc21 1617567224 UWWLKOKVOJYIBW-HVLQXJGNSA-N 429.564 4.759 50 10 IJGE CC(=O)c1cc(F)c(O)c(NC(=O)/C(C#N)=C/c2cc(C)n(-c3cccc(C)c3)c2C)c1 1645065084 UXUGATABFCZRKR-KEBDBYFISA-N 431.467 4.996 50 10 IJGE CCCCCCOc1ccc(C=NNC(=O)[C@H](C)Oc2cccc(OC)c2)cc1OC 1772756069 KOYDDUGFTSLIRJ-SFHVURJKSA-N 428.529 4.581 50 10 IJGE O=C(Cc1cccc(Br)c1)N(CCCBr)Cc1ccccc1 1914627486 GHBWDWLZNMPAFB-UHFFFAOYSA-N 425.164 4.805 50 10 IJGE CN(CC1CC(Br)C1)c1cc(Br)ccc1CBr 2020226895 PGQSDRJMIYQWIM-UHFFFAOYSA-N 425.990 4.954 50 10 IJGE CCN(CCCCBr)C(=O)c1cccc(Br)c1Br 2041182086 JMWXEHLIZMOIEW-UHFFFAOYSA-N 441.989 4.849 50 10 IJGE O=C(c1ccc(Cl)c(Br)c1)N1CC[C@H](CBr)C(F)(F)C1 2146375608 PKNNYTZPNMBHTN-SECBINFHSA-N 431.502 4.595 50 10 IJGE O=C1COc2ccc([C@@H](Cl)c3csc(Br)c3Br)cc2N1 2150342727 YUHOLMXGXVCNKB-GFCCVEGCSA-N 437.540 4.932 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1CN(CC1CC1)C(=O)[C@H](Br)C1CCCC1 2167033139 PTXCIZUDSOUKRF-QZTJIDSGSA-N 443.426 4.578 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C1CC([C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1 2241364339 HJQHTFNQOUHWOX-PRLABOORSA-N 447.414 4.558 50 10 IJGE C[C@](CI)(O[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1F 2250387489 PNDLOEOIRGLOPF-FXAWDEMLSA-N 439.312 4.767 50 10 IJGE CC[C@@H]1[C@H](Br)CCN1C(=O)c1cccc(Br)c1Br 2260389007 SIYFPLLNCWZJTK-MWLCHTKSSA-N 439.973 4.600 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C[C@H](C)O[C@H](C)C2)cc1I 2269555934 KCQPSNMVCAVRTB-MAWWSGROSA-N 439.131 4.939 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@]1(C)CBr 2282977515 CVGZIXGHFZLYDW-XLKFXECMSA-N 427.539 4.735 50 10 IJGE C[C@@H](c1ccncc1Br)[C@@H](Br)c1cscc1S(C)(=O)=O 2288510667 GKMFSGULFDVOLT-ISVAXAHUSA-N 439.194 4.549 50 10 IJGE CCCCCOc1ccc(C=C(C#N)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)cc1 2296729525 VSELQXVPIJYBCL-UHFFFAOYSA-N 444.535 4.599 50 10 IJGE Cc1ccc(C)c(OCCn2cc(C=C(C#N)C(=O)NC[C@H]3CCCO3)c3ccccc32)c1 2297456346 KIWJGDMDRPTPRV-HSZRJFAPSA-N 443.547 4.539 50 10 IJGE Clc1ccc(CN(CCBr)CC2CC2)c(I)c1 2302325031 CRJLIORDRVCJDV-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE Cc1ccc(-n2nc(C)c(I)c2C)c(CBr)c1Cl 2313997007 IJPMJMSHDDITKJ-UHFFFAOYSA-N 439.522 4.950 50 10 IJGE COc1cccc2c1O[C@H](C)C(C=C(C#N)S(=O)(=O)c1ccc(Br)cc1)=C2 2314450749 PUESKNXKXCVKTA-CYBMUJFWSA-N 446.322 4.503 50 10 IJGE CN(Cc1c(Br)cccc1Br)C(=O)CCCCBr 2318183984 FNSXZWHDIJMSGE-UHFFFAOYSA-N 441.989 4.735 50 10 IJGE N#CC(=CNCCc1cccc(Br)c1)C(=O)Nc1ccc(Cl)c(Cl)c1 2324269553 RTHSVZDDDPOBOX-UHFFFAOYSA-N 439.140 4.934 50 10 IJGE Cl[C@H]1CCC[C@@H]1CCNCc1ccc(I)c(Br)c1 2325217192 BMCDYVQJUUNUON-YPMHNXCESA-N 442.566 4.941 50 10 IJGE COc1cc2nc(C(C#N)=Cc3ccccc3OCc3ccccc3)nc(O)c2cc1OC 2331039392 BEJBQLCIAIWFPM-UHFFFAOYSA-N 439.471 4.996 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@H]2C[C@]1(CBr)C2 2361923113 MTPKFBXKHFMLFS-XZWHAEGMSA-N 425.523 4.631 50 10 IJGE COc1cc(Cl)c(CBr)c(N2C[C@@](C)(F)[C@](C)(Br)C2)c1 2365816757 SDUOLLNLNJQELG-ZIAGYGMSSA-N 429.555 4.945 50 10 IJGE C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)c1ccc(Cl)cc1Cl 14038568 OZABQVIZKGUGGT-AWEZNQCLSA-N 429.303 4.889 50 10 IJGE O=C(CSc1nc(=O)c2c(-c3ccccc3)csc2[nH]1)N/N=C/C=C/c1ccccc1 19646097 MWLOUOHQZDTZSI-RHESKXDESA-N 446.557 4.559 50 10 IJGE CC(=O)c1ccc(NC(=O)COc2ccc(/C=C(/C#N)c3nc4ccccc4[nH]3)cc2)cc1 33549023 KJUHJXHAJHXOOR-ZHZULCJRSA-N 436.471 4.847 50 10 IJGE N#C/C(=C/c1ccc(-c2cccc(C(=O)O)c2)o1)c1nnc(NC(=O)c2ccccc2)s1 33563240 HZCXMRWVJWKOPL-ATVHPVEESA-N 442.456 4.813 50 10 IJGE CCCOc1ccc(/C=C2/C(=O)N(Cc3ccc(C)cc3)C(=O)C(C#N)=C2C)cc1OCC 38608442 CCDPENMHHOJJGO-HYARGMPZSA-N 444.531 4.975 50 10 IJGE CC(C)Cc1ccc([C@H](C)C(=O)NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1 66199274 LLTGOVZLJRSFSW-LSDHHAIUSA-N 437.367 4.910 50 10 IJGE C[C@H](Cl)c1cn(-c2c(Br)cc(Br)cc2Br)nn1 163600882 UJYPNKVZIMDJQH-YFKPBYRVSA-N 444.352 4.855 50 10 IJGE CCOc1cc(/C=N\NC(=O)Cc2cc(Cl)ccc2SCC)cc(Cl)c1O 169922419 HVFPVFMVNNIAMQ-JJFYIABZSA-N 427.353 4.903 50 10 IJGE CCCCOC(=O)c1ccccc1N/C=C(/C#N)C(=O)Nc1ccc(OC)c(Cl)c1 217138380 NVFVXVPXEDZZLJ-PFONDFGASA-N 427.888 4.764 50 10 IJGE CO[C@@H]1CCC[C@H](O[C@H](CI)c2cccc(Br)c2)C1 253117143 GJJVZRINFUIIAB-QLFBSQMISA-N 439.131 4.899 50 10 IJGE CC(C)(C)C[C@H](CBr)NS(=O)(=O)c1c(Cl)cccc1Br 393493655 OJYKKTRNBIFQFW-SECBINFHSA-N 447.620 4.581 50 10 IJGE COc1ccc(Br)cc1[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1CBr 394786975 PGARRXNQJLZMDY-SMDDNHRTSA-N 449.183 4.803 50 10 IJGE CC[C@H](NC(=O)c1cc(Br)cc(Br)c1)[C@H](C)Br 395378101 RPQWUGKCGRNPQM-CPCISQLKSA-N 427.962 4.503 50 10 IJGE C/C(NCCSSCCN/C(C)=C1/C(=O)C[C@@H]2[C@@H]1C2(C)C)=C1/C(=O)C[C@H]2[C@H]1C2(C)C 503976548 SZFRXFHQDNKSIE-QCNLNZPESA-N 448.698 4.585 50 10 IJGE CN(CCCCCBr)C(=O)c1scc(Br)c1Br 705398663 GWFBLVYHLHIJIY-UHFFFAOYSA-N 448.018 4.910 50 10 IJGE CCN(C(=O)c1ccc(I)c(Br)c1)C(C)(C)CCl 721512177 VYOZAHMWVMYJRP-UHFFFAOYSA-N 444.538 4.533 50 10 IJGE Cc1ccc(Cn2cc(C=NNC(=O)CC[C@@H](O)c3ccccc3)c3ccccc32)cc1 725401426 LEQVSTIIVZYWLR-AREMUKBSSA-N 425.532 4.962 50 10 IJGE Cc1ccc(Cn2cc(C=NNC(=O)CC[C@H](O)c3ccccc3)c3ccccc32)cc1 725401427 LEQVSTIIVZYWLR-SANMLTNESA-N 425.532 4.962 50 10 IJGE C[C@]1(C(=O)NNc2c(Cl)cc(Cl)cc2Cl)CCCN1C(=O)c1ccccc1 734986102 LKBVQTYQTWEUFO-LJQANCHMSA-N 426.731 4.785 50 10 IJGE CN1CCC[C@H](CNC(=O)NNc2nc(Cl)c(Cl)cc2Cl)[C@H]1c1cccs1 745850332 WUUGDDPHKPSJNB-YGRLFVJLSA-N 448.807 4.813 50 10 IJGE O=C(CCOc1ccccc1)NNC(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F 755614317 MDCXIEUDBZTCDD-INIZCTEOSA-N 447.866 4.528 50 10 IJGE CSc1cc(C)ccc1CNC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccccc1 756995970 DSGUFKHPRDOCJR-KGENOOAVSA-N 441.560 4.717 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)Oc1ccc([N+](=O)[O-])c3ncccc13)O[C@H](C)C2 770137152 UFLRLNZUNPJZCH-RPVQJOFSSA-N 434.448 4.574 50 10 IJGE O=C(Cc1cccc2ccccc12)NN=C1C(=O)N(C/C=C/c2ccccc2)c2ccccc21 1084493713 BLATVEQBPIWGLY-IZQOPFDRSA-N 445.522 4.963 50 10 IJGE CCOc1ccc([C@H](O)CCC(=O)NN=Cc2ccc(OCc3ccccc3)cc2)cc1 1084588169 PABYZRPXJGATLQ-RUZDIDTESA-N 432.520 4.628 50 10 IJGE CC(=O)c1ccc(Nc2ccccc2C(=O)NNc2nc3ccccc3[nH]c2=S)cc1 1629911763 AEYXZSKNCKTDPC-UHFFFAOYSA-N 429.505 4.995 50 10 IJGE Cc1c(C(=O)N(C)c2ccccc2)oc2c1C(=NNC(=O)c1ccc(Cl)cc1)CCC2 1772744144 UWNTWIDNURYSEP-UHFFFAOYSA-N 435.911 4.988 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(F)cc2)[C@H]1c1ccc(Cl)cc1 1865684358 XKKDBDXAZQLPML-INIZCTEOSA-N 448.807 4.961 50 10 IJGE CCN(CC)c1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2Cl)cc1 1865702042 LGVWFHOMCVRASX-JOCHJYFZSA-N 433.943 4.899 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@]2(CCC[C@@H]2Cl)C1 1918932510 ARJKBHRECRYAIF-TVQRCGJNSA-N 427.589 4.897 50 10 IJGE Cc1nn(-c2ccc(Cl)cc2CBr)c(C)c1I 1945161412 CHBOOIFZEPPPGD-UHFFFAOYSA-N 425.495 4.642 50 10 IJGE CC[C@@H](Br)CN(C)C(=O)c1scc(Br)c1Br 1977857332 WJSFGGHCUCCUTL-ZCFIWIBFSA-N 433.991 4.519 50 10 IJGE C[C@@H]1C[C@@H]1N(CCBr)C(=O)c1cc(Br)sc1Br 2002025000 ZAPVKRUVXBQKKZ-SVRRBLITSA-N 446.002 4.519 50 10 IJGE CCC[C@](C)(CCl)NC(=O)c1cc(Br)ccc1I 2029946133 SKFQUKFCBPFYBH-CYBMUJFWSA-N 444.538 4.581 50 10 IJGE O=S(=O)(C[C@H](Br)c1cscc1OCc1ccccc1)N1CCCCC1 2038675778 AXZCYFLVZXAKNO-KRWDZBQOSA-N 444.416 4.579 50 10 IJGE BrC[C@@H]1C[C@@H]2CN(Cc3ccc(Br)cc3Br)C[C@@H]21 2053979282 DMDHFDYIXMUSMU-DMDPSCGWSA-N 438.001 4.674 50 10 IJGE CCc1ccc(O)c(-n2nc(CBr)c(Br)c2C(F)(F)F)c1 2079239981 PKCHYYFRTRKEON-UHFFFAOYSA-N 428.046 4.817 50 10 IJGE C[C@@H]1C[C@@H](CBr)CN(Cc2ccc(I)c(Cl)c2)C1 2086652363 OSXXZCIWCSOWFR-PWSUYJOCSA-N 442.566 4.798 50 10 IJGE CC[C@@H]1CCOC[C@@H]1O[C@H](CI)c1ccccc1Br 2096209353 YJTHXINFOVIRLJ-DFBGVHRSSA-N 439.131 4.757 50 10 IJGE CC(C)(C)OC(=O)NC[C@H]1CCCC2(CCC2)[C@H]1NC(=O)CCCCBr 2106299203 VXCZMVXIQCKMGX-WBVHZDCISA-N 431.415 4.532 50 10 IJGE Cn1nc(COc2c(Cl)cc(Cl)cc2CBr)cc1Br 2111922586 KGBNGLVCKOCFGZ-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE O=C(NC[C@H]1C[C@H](Cl)C12CCC2)c1scc(Br)c1Br 2115601364 GICVNAWBCNZDFV-APPZFPTMSA-N 427.589 4.801 50 10 IJGE CCc1ccc(-n2cc([C@H](Br)C(C)C)nn2)cc1I 2128674780 XRJOESHPULOFDZ-CQSZACIVSA-N 434.119 4.526 50 10 IJGE CC[C@H]1CCN(C(=O)c2ccc(CBr)cc2)[C@H](CNC(=O)OC(C)(C)C)C1 2162912402 VFNZBGCFAIYJQU-YJBOKZPZSA-N 439.394 4.737 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2Cc1nccn1Cc1ccccc1 2184934802 HEMPCILRAXZNLT-UHFFFAOYSA-N 444.764 4.577 50 10 IJGE CC1(C)OCCO[C@@H]1COc1c(Br)cc(Br)cc1CCl 2186966335 AHMJVMSEXGIWTJ-GFCCVEGCSA-N 428.548 4.523 50 10 IJGE O=C(c1ccc(Cl)c(Br)c1)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](Br)C2 2190678178 KHKOEFZGAYHZRM-JAAHAHCPSA-N 425.523 4.581 50 10 IJGE CCc1cc(Br)c([C@H](Br)[C@]23CCC[C@@H]2CS(=O)(=O)C3)s1 2201878824 MOIRTONFJHDVJC-IIMNLJJBSA-N 442.238 4.724 50 10 IJGE C[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)N(CCCCCI)[C@@H]1C 2211188873 GYEYMQOFFXKQEW-OAGGEKHMSA-N 438.394 4.605 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)cc1I 2269554889 UQOGYWBLLHJWQD-TZDNBKRZSA-N 439.131 4.795 50 10 IJGE CN(Cc1cccc(I)c1)C[C@H](CBr)c1ccccc1 2280346742 HJIVJOUEIAWGAI-INIZCTEOSA-N 444.154 4.902 50 10 IJGE C[C@@H]1CC[C@H](CBr)CN1C(=O)c1cc(Br)c(F)cc1Cl 2285844639 PJVPIRAODZHHAI-RKDXNWHRSA-N 427.539 4.877 50 10 IJGE CCCCOc1ccc(C=C(C#N)C(=O)Oc2cccc(C=C(C#N)C(=O)OCC)c2)cc1 2293198442 QEMGNNAHVDNOKI-UHFFFAOYSA-N 444.487 4.848 50 10 IJGE CC[C@H](C[C@@H](C)Br)NCc1ccc(Cl)c(I)c1 2300241431 ZAYUDQAIRQGXLY-MWLCHTKSSA-N 430.555 4.986 50 10 IJGE C[C@H](Br)CCCN(C)Cc1ccc(Cl)cc1I 2302307958 VHCRZYUEHXWXAL-JTQLQIEISA-N 430.555 4.940 50 10 IJGE CCN(CCCCBr)Cc1cc(I)ccc1Cl 2307332397 OEBYVBZTONHHGS-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE C[C@H]1C[C@@H](Br)CCN(Cc2ccc(Cl)cc2I)C1 2318513936 YDEUGYXMEXLAAD-JQWIXIFHSA-N 442.566 4.940 50 10 IJGE C#CCOc1c(Br)cc(/C=C(\C#N)c2cccc([N+](=O)[O-])c2)cc1OCC 2866083 WXWAALOATCLYHK-CXUHLZMHSA-N 427.254 4.832 50 10 IJGE O=C(CCCCCCl)N1CCN(CCOC(c2ccccc2)c2ccccc2)CC1 22353148 OCHNZEQIQUMCAG-UHFFFAOYSA-N 429.004 4.736 50 10 IJGE COc1cc(-c2ccc(NC(=O)[C@H](C)Cl)c(OC)c2)ccc1NC(=O)[C@H](C)Cl 101260726 YIZIHDGOENRNMZ-RYUDHWBXSA-N 425.312 4.502 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CCCC[C@@H]1CBr 122800536 SMWLMWHBSUJFOS-SSDOTTSWSA-N 446.002 4.663 50 10 IJGE C[C@H]1CCC[C@H](C)N1/C=C(/C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 216498779 IPDGRCWTWVYUKB-RYBNMZHFSA-N 442.607 4.591 50 10 IJGE CC[C@H](Br)[C@H](CC)NC(=O)c1ccc(Br)cc1Br 313101128 ZEBBUBVZIBZSAJ-JQWIXIFHSA-N 441.989 4.894 50 10 IJGE ClCCc1nc2cc(Br)ccc2n1Cc1ccn(Cc2ccccc2)n1 389673336 RGABQBOXSHMJDE-UHFFFAOYSA-N 429.749 4.873 50 10 IJGE CN(C)c1nc(CC(CBr)(CBr)C2CCCCC2)ns1 699215607 PYYDHAWNFKPRFF-UHFFFAOYSA-N 425.234 4.503 50 10 IJGE O=C(NNC(=S)Nc1cccc(Br)c1)[C@H]1C[C@H]1c1ccc2ccccc2c1 731232092 FPPBPAZUJFTOKP-OALUTQOASA-N 440.366 4.724 50 10 IJGE O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 741285287 YXMARVWHBPOSFY-NEPJUHHUSA-N 449.307 4.759 50 10 IJGE Cc1cnc(COC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccc(Cl)cc2)s1 781866444 BGZMIUTVMYQQNB-SXGWCWSVSA-N 437.912 4.532 50 10 IJGE CC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(C[C@H]3CCCO3)c2C)cc1Cl 783559930 BDQSRVUMVXYAGN-ACEGTKJHSA-N 425.916 4.686 50 10 IJGE C/C(=C\C(=O)NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1ccc([N+](=O)[O-])cc1 804207444 QPLBWEXTPPFVCQ-ACCUITESSA-N 443.385 4.617 50 10 IJGE O=C(NN=Cc1cccs1)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 1083866617 IJUWXYUHIBRLGE-UHFFFAOYSA-N 428.311 4.527 50 10 IJGE C=CCOc1c(Br)cc(C=NNC(=O)c2cc3ccccc3o2)cc1OC 1084188986 HCQGXQWMVXZWCP-UHFFFAOYSA-N 429.270 4.533 50 10 IJGE CC(=O)c1ccc(CCNC(=O)/C(C#N)=C\c2cc(C)n(-c3ccccc3C)c2C)cc1 1137784127 XAXOCEAIQKEJSV-XYGWBWBKSA-N 425.532 4.871 50 10 IJGE Cc1ccc(Cn2nc(C)c(C(=O)NNc3nc4ccccc4[nH]c3=S)c2Cl)cc1 1585174128 WXMBOWWWMXNLDY-UHFFFAOYSA-N 438.944 4.564 50 10 IJGE CCCc1nn(Cc2cccc(Cl)c2)c2c1[C@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 1865684500 ZKJJMXORFIPZPV-JOCHJYFZSA-N 447.970 4.821 50 10 IJGE CCCOc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(CC)nn3Cc2ccc(F)cc2)c1 1865694050 ORDBJBNDXMKVQU-JOCHJYFZSA-N 432.499 4.640 50 10 IJGE CCCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(CC)nn2Cc1ccc(C)cc1 1865702869 HFJRPQQVPORGNV-QHCPKHFHSA-N 428.536 4.809 50 10 IJGE O=C(NN(Cc1ccccc1)Cc1ccccc1)c1cc(Cl)ncc1Br 1923937525 IZEKMUJEZXFYKF-UHFFFAOYSA-N 430.733 4.845 50 10 IJGE CN(N[C@H]1[C@@H](CNC(=O)OC(C)(C)C)CCCC12CCC2)C(=O)OCc1ccccc1 1924832729 SRFXOQHXWYPTPP-UXHICEINSA-N 431.577 4.623 50 10 IJGE CC1(C)CN(Cc2cccc(Br)c2Br)[C@@H]1CBr 1944095719 MLJYTRRONQKGQL-LLVKDONJSA-N 425.990 4.817 50 10 IJGE C[C@@]1(CBr)CCN(C(=O)c2csc(Br)c2Br)C1 1945186124 BSMSMWARUWOBSO-NSHDSACASA-N 446.002 4.520 50 10 IJGE Fc1ccc(C[C@H](Br)c2cc(I)sn2)cc1F 2007644520 PIEDKRINZWJHQB-ZETCQYMHSA-N 430.055 4.705 50 10 IJGE BrC[C@@]12CC[C@@H](CN1Cc1cccc(Br)c1Br)C2 2031487175 RGODBPLFKAOSLJ-YGRLFVJLSA-N 438.001 4.961 50 10 IJGE C[C@H](CCBr)CCN1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]1C(F)(F)F 2052477555 GTKBSBWDVQJPJV-MGPQQGTHSA-N 431.337 4.670 50 10 IJGE CC(C)[C@@H](Br)c1cn(-c2ccc(Br)cc2Br)nn1 2057428407 BBWVUVPFCZQRTP-GFCCVEGCSA-N 437.961 4.884 50 10 IJGE Cc1cccc(Cn2nc(CBr)c(Br)c2C(F)(F)F)c1O 2079232852 GYNAXMCRCGMWEX-UHFFFAOYSA-N 428.046 4.622 50 10 IJGE Clc1cc(CN2CCC23CC(CBr)C3)ccc1I 2086652974 UHXKEJGOJLMOBA-UHFFFAOYSA-N 440.550 4.694 50 10 IJGE C[C@H]1CN(C[C@H](Br)C(F)(F)F)c2ccccc2CN1C(=O)OC(C)(C)C 2106783751 CJTXTEIOSQWQDK-WFASDCNBSA-N 437.300 4.958 50 10 IJGE CC1(C)C[C@H](NC(=O)OC(C)(C)C)CN(C[C@@H](CBr)c2ccccc2)C1 2106787358 IKVJCLLUXOXBEO-MSOLQXFVSA-N 425.411 4.790 50 10 IJGE Cc1nc(Br)c(Br)n1CC1(c2nc(CCl)cs2)CC1 2110002653 YSYJFGFXMMEGEB-UHFFFAOYSA-N 425.577 4.644 50 10 IJGE Fc1ccc(I)cc1[C@@H](Br)c1ccc2c(c1)COC2 2113357854 KKIIGUGWRSJJLB-HNNXBMFYSA-N 433.058 4.945 50 10 IJGE Cc1nc([C@H](Br)c2cc3c(cc2Cl)NC(=O)C3)c(Br)s1 2169496092 PNFOYSTXFVRUER-LLVKDONJSA-N 436.556 4.846 50 10 IJGE BrCc1ccc(CN2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)cc1 2182853729 FCXSKXLRNZSDIW-LWSSLDFYSA-N 425.414 4.924 50 10 IJGE O=C(c1cccc(Br)c1Cl)N1CC[C@H](C(F)(F)CBr)C1 2197764644 VIXYCAQWPIMCBC-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE ICCCCCN1CCC2(CC1)CCN(Cc1ccccc1)C2 2211187899 WPEQXRGCVRVQSW-UHFFFAOYSA-N 426.386 4.580 50 10 IJGE CC(C)(C)OC(=O)Nc1c[nH]nc1[C@H]1CCCN(CCCCCCBr)C1 2231088630 PPJWUCFWGHSUMT-HNNXBMFYSA-N 429.403 4.891 50 10 IJGE CN(C[C@H]1CCC[C@H]1Br)C(=O)c1cc(F)c(Br)cc1Cl 2282979345 YZCVZWAFGBXACJ-PSASIEDQSA-N 427.539 4.877 50 10 IJGE Cc1cc(N2C[C@@]34CCC[C@]3(CN(Cc3ccccc3)C4)C2)cc(CBr)n1 2288446206 VHUJXXWWBWKAGI-GOTSBHOMSA-N 426.402 4.777 50 10 IJGE C=CCNC(=O)C(C#N)=C1S[C@H](Cc2ccc(CC)cc2)C(=O)N1c1ccc(C)c(C)c1 2314593590 PRMIMAHERHXKGI-HSZRJFAPSA-N 445.588 4.594 50 10 IJGE Clc1ccc(CN2CC[C@H](Br)[C@@H]3CC[C@@H]32)cc1I 2315548187 DQCYPLZRFLHJCS-MJVIPROJSA-N 440.550 4.692 50 10 IJGE CCOC(=O)c1ccc(CNC=C(C#N)C(=O)N[C@H](CC)c2ccc3c(c2)CCCC3)cc1 2318466973 BFJXXEBYJRUMKG-RUZDIDTESA-N 445.563 4.507 50 10 IJGE CCCCOc1cccc(C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccco2)c1 38657517 OOJSKOJLQYXGIM-HSZRJFAPSA-N 430.460 4.896 50 10 IJGE Cc1ccccc1NC(=O)/C(C#N)=C\c1c(Oc2ccccc2C)nc2ccccn2c1=O 39858883 QBGKMSHXSIECMD-CYVLTUHYSA-N 436.471 4.649 50 10 IJGE CCCCCCCC(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1Br 100170074 FTFVHLFMCPMICZ-UHFFFAOYSA-N 427.383 4.633 50 10 IJGE CC[C@@H](NC(=O)/C(C#N)=C\N1CCN(c2ccccc2F)CC1)c1ccc2c(c1)CCCC2 217192690 COMZEHRVBMDZEH-PFSTYLAZSA-N 446.570 4.501 50 10 IJGE C[C@H]1CC[C@@H](Br)CN1C(=O)c1cc(Br)sc1Br 399489598 SPPCRFYVZLEPNV-NKWVEPMBSA-N 446.002 4.661 50 10 IJGE CC(C)(C)[Si](C)(C)OCc1ccccc1[C@@H]1Cc2ccccc2N(S(N)(=O)=O)C1 616593051 NPQCNVKHSWXSDB-LJQANCHMSA-N 432.662 4.558 50 10 IJGE CC(C)(C)[Si](C)(C)OCCN1c2ccccc2NC[C@H]1S(=O)(=O)c1ccccc1 616684794 OLGPPSINSNAAPX-OAQYLSRUSA-N 432.662 4.740 50 10 IJGE CC(C)(C)N(CCBr)C(=O)c1ccc(I)c(Cl)c1 690978712 ATXPWYMHDYNYAQ-UHFFFAOYSA-N 444.538 4.580 50 10 IJGE C[C@@H]1CCCC[C@H]1OC1(CI)CCN(C(=O)OC(C)(C)C)CC1 725343865 BZPJXCKWMUSDIM-HUUCEWRRSA-N 437.362 4.786 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)CCc2cccc(OC3CCCC3)c2)c1C 736694136 YTGSOXDWVGWWGG-UHFFFAOYSA-N 431.540 4.553 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)c1C 743462561 JSOCEPZATHFBBS-MSOLQXFVSA-N 428.323 4.709 50 10 IJGE Cc1csc(-c2ccc(NC(=O)NNC(=O)c3cc(-c4ccc(C)c(C)c4)[nH]n3)cc2)n1 756300316 SDROXJKEUWDXEH-UHFFFAOYSA-N 446.536 4.592 50 10 IJGE Cc1cccc([C@H](NC(=O)NNc2ccc(C#N)cc2C(F)(F)F)c2ccccn2)c1 799613964 SVWKYPKQHOOYJG-FQEVSTJZSA-N 425.414 4.696 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)[C@H](C)Oc2ccc(-c3ccccc3)cc2)c1C 806888239 KXHOPOPYJJKOMW-IBGZPJMESA-N 439.519 4.733 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)OCc2nc(-c3ccco3)no2)c(C)n1-c1ccc(F)cc1 897336448 FNXDBOZQRSCZAG-BOPFTXTBSA-N 432.411 4.527 50 10 IJGE C=CCn1c(CNc2ccc(Cl)cc2)nnc1S[C@H](C)C(=O)NN=C(C)CCC 1083889662 PCRXBLHZNSTHIL-OAHLLOKOSA-N 434.997 4.502 50 10 IJGE CCC[C@@H](NC(=O)C[C@H](C)c1cccc(OC)c1)C(=O)Nc1ccc(SC#N)cc1 1867113355 NRPRKBDOUZXVJC-HRAATJIYSA-N 425.554 4.686 50 10 IJGE Cc1nc(Nc2ccc(SC#N)cc2)cc(N2CC[C@H](c3ccc4c(c3)OCO4)C2)n1 1868479797 BGYWGDMPTQWFNS-KRWDZBQOSA-N 431.521 4.824 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C/c3ccc(O)c([N+](=O)[O-])c3)n2)c(OC)c1OC 1872794912 DCIOYHGDXDVVPG-MDWZMJQESA-N 439.449 4.514 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CN(C(=O)OC(C)(C)C)C2(CCCC2)C1 1882088797 UNMYYNUNGLUOSE-HUUCEWRRSA-N 447.414 4.844 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C2CC2)C1 1883307644 YDUHXRZKZYAXIO-XHSDSOJGSA-N 447.414 4.700 50 10 IJGE Cc1cc(S(=O)(=O)Nc2ccc(F)c(CBr)c2)sc1Br 1924908090 UPPXEWQMZDDAGF-UHFFFAOYSA-N 443.157 4.654 50 10 IJGE CN(Cc1cccc(Br)c1Br)CC1CC(Br)C1 1943881395 QFMBITWRIOBVTL-UHFFFAOYSA-N 425.990 4.817 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1CN(C[C@@H](CBr)C2CCC2)CC[C@@H]1C(F)(F)F 1966375847 YVOBXVUMXPSYFC-QLFBSQMISA-N 443.348 4.575 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CC[C@]23CCC[C@@H](CI)O3)C1 1986986358 QRUAJJYWYACJHK-JCGIZDLHSA-N 435.346 4.540 50 10 IJGE FC(F)[C@@H]1C[C@H]1[C@@H](Br)c1cc(I)cc2c1OCC2 2041791467 ALTJHQICKBYXRA-FXPVBKGRSA-N 429.042 4.563 50 10 IJGE CC(C)N(C[C@H](Br)C(F)(F)F)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 2044699483 LTEWFXDPNKSUIN-KBPBESRZSA-N 431.337 4.670 50 10 IJGE C[C@H](Br)[C@H]1CCCN1C(=O)c1cccc(Br)c1Br 2073314583 HNEVIFWOSMKFFX-GZMMTYOYSA-N 439.973 4.600 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@H]2CC[C@H](Br)[C@H]1C2 2115946585 ZWWURSYFBDMXMT-KHQFGBGNSA-N 427.589 4.942 50 10 IJGE ClCc1c(Br)cccc1N1CC[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 2129055719 RWNCQYUZVUTZRN-NHCUHLMSSA-N 435.793 4.668 50 10 IJGE O=S(=O)(c1cc(CCl)cc(F)c1F)N(CCC(F)(F)F)Cc1ccccc1 2152211453 MUBFKLCXTVTVML-UHFFFAOYSA-N 427.822 4.847 50 10 IJGE FC(F)(F)[C@H]1COCCN1c1c(CBr)ccc(Br)c1Cl 2154373592 NZMWEXMDGJMJNB-SECBINFHSA-N 437.481 4.765 50 10 IJGE Cn1ncc(CC(CCl)(CCl)c2cccc(Br)c2)c1Br 2173258713 WSJNDXQHYSCNKP-UHFFFAOYSA-N 440.994 4.903 50 10 IJGE O=C(NC[C@H]1CN(CC2(CBr)CCCCCC2)CC12CCC2)C(F)(F)F 2174052865 DHEUMOOLUMYRRP-HNNXBMFYSA-N 439.360 4.503 50 10 IJGE CC(C)(C)[C@H]1[C@@H](Cl)CCN1C(=O)c1cc(Cl)ccc1I 2185112377 AZRUBZUHTQBBIE-WCQYABFASA-N 426.125 4.813 50 10 IJGE CCC[C@H]1CN(C(=O)c2cc(Cl)ccc2I)C[C@H]1CCl 2205699843 ZYDFSJJBSIDMEW-WDEREUQCSA-N 426.125 4.672 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CCCCCI)Cc2ccccc21 2214695943 JGBOSUYIETUIOR-KRWDZBQOSA-N 444.357 4.673 50 10 IJGE CCOCc1cc(Br)c([C@@H](Cl)c2cc(Br)n(C)n2)s1 2224783597 UCVSYXOQYFOBGK-NSHDSACASA-N 428.577 4.871 50 10 IJGE CCC[C@H](CBr)CN1CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]1C(F)(F)F 2254964925 RNBGRPSWKPEBFA-HZSPNIEDSA-N 431.337 4.718 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN(CC2(CBr)CC(F)C2)C1 2265638371 LXIOIPKYZBOOPH-NZEHOUKNSA-N 433.406 4.611 50 10 IJGE CC1CC(CBr)(N(C)C(=O)c2cc(Br)c(F)cc2Cl)C1 2285846073 JOYIVQYLPDTZOJ-UHFFFAOYSA-N 427.539 4.877 50 10 IJGE N#CC(=CNc1ccccc1C(N)=O)c1nc(-c2cccc(Br)c2)cs1 2295934389 OYCKGRFBZRDORA-UHFFFAOYSA-N 425.311 4.648 50 10 IJGE C[C@H]1C[C@@H](Br)CCN1Cc1ccc(Cl)c(I)c1 2300241386 YKPOEIGGHVDZJG-ONGXEEELSA-N 428.539 4.692 50 10 IJGE Clc1ccc(CN2C3CCC2(CBr)CC3)cc1I 2315553358 RGENVKUKRUTKQC-UHFFFAOYSA-N 440.550 4.837 50 10 IJGE CCOC(=O)c1ccc(NC(=O)C(C#N)=CN[C@H](CC)c2ccc3c(c2)CCCC3)cc1 2324332056 DWJJBKDMLVVCAW-XMMPIXPASA-N 431.536 4.829 50 10 IJGE CSc1cccc(NC=C(C#N)C(=O)Nc2ccc(I)cc2C)c1 2325406380 ZSUHCEWHBNQJEU-UHFFFAOYSA-N 449.317 4.780 50 10 IJGE COc1cc(CBr)cc(N(C)[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)n1 2364759134 CDVRTIVLQMHEHG-ACDBMABISA-N 430.390 4.617 50 10 IJGE CCCOc1ccc(/C=C\C(=O)Oc2ccc(/C=C(\C#N)C(=O)OCC)cc2OCC)cc1 33378280 CVUPJRIXYJAIRS-POVPUTRVSA-N 449.503 4.963 50 10 IJGE CCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C\c2ccc(C(C)C)cc2)c(OC)c1 34715386 YNEJDKDGXGDGPF-ILXONMBNSA-N 432.520 4.871 50 10 IJGE Cc1ccccc1C(=O)N/N=C1\CCCc2oc(C(=O)N3CCCc4ccccc43)c(C)c21 40811526 HJFJEQQNQFBBHA-SGWCAAJKSA-N 441.531 4.960 50 10 IJGE Cc1occc1C(=O)N/N=C1\CCCc2oc(C(=O)Nc3cccc4cccnc34)c(C)c21 40823605 XLILQQBYIGYTIJ-MTDXEUNCSA-N 442.475 4.760 50 10 IJGE CCCCCCCC(=O)N/N=C/c1ccc(OCc2ccc(C(=O)O)cc2)c(OC)c1 103724506 RRIAUEYXXQEGAC-PCLIKHOPSA-N 426.513 4.783 50 10 IJGE CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2ccccc2OC)sc2c1CC[C@H](CC)C2 209406376 VGABVXACWBFVRZ-SUCHYCSPSA-N 438.549 4.994 50 10 IJGE COc1cc(Br)cc(C=NNC(=O)c2cc3c(ccc4ccccc43)o2)c1O 252623641 OVXHJLJGXQSFQW-UHFFFAOYSA-N 439.265 4.827 50 10 IJGE CC(C)(C)C(=O)[C@@H](Br)Cc1cc(Cl)ccc1I 689761716 MGOKGRZOMKDQEK-JTQLQIEISA-N 429.523 4.866 50 10 IJGE C[C@@H]1CCCN(c2ncc(Br)cc2Br)[C@@H]1CCBr 700290408 DMRWQVLRZLZBCP-BXKDBHETSA-N 441.005 4.997 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC[C@@H](CCBr)C1 705520022 ZNWFVYRWETZYNF-SSDOTTSWSA-N 446.002 4.520 50 10 IJGE CN1CCC[C@H](CNC(=O)NNc2cc(C(F)(F)F)ccc2F)[C@H]1c1cccs1 754646331 MIUJNHMRRLYQCC-PXAZEXFGSA-N 430.471 4.615 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1ccc(N2CCCCCCC2)c(F)c1 757997491 ZHJUWJOEFYIKLR-UHFFFAOYSA-N 435.503 4.611 50 10 IJGE Cc1nc(NCC(=O)NNc2cccc(F)c2F)c2cc(-c3ccccc3)sc2n1 771024378 HQDFNPAJRZUOLI-UHFFFAOYSA-N 425.464 4.500 50 10 IJGE CCCc1ccc(-c2ccc(NC(=O)C(=O)NNc3cccc(C(F)(F)F)n3)cc2)cc1 784951851 AHWCFCHMACLURE-UHFFFAOYSA-N 442.441 4.802 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)C(F)(F)c2cccc(Cl)c2Cl)c1C 1472512302 MNARBXYGMSFVJP-UHFFFAOYSA-N 438.265 4.697 50 10 IJGE Cc1nn(-c2ccccc2Cl)c2c1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706142 OUHOGPFCYZGVAX-GOSISDBHSA-N 442.262 4.614 50 10 IJGE CCCc1nn(Cc2ccc(Cl)cc2)c2c1[C@@H](c1ccc(OC)cc1)C(C#N)=C(N)O2 1865714980 SDPQNWHUIFDUBW-NRFANRHFSA-N 434.927 4.764 50 10 IJGE CCCOc1ccc(-c2csc(/C(C#N)=C(\O)COCCOC)n2)cc1OCCC 1872818383 ZNCYHWMSSZHFGM-ZPHPHTNESA-N 432.542 4.843 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)C[C@@]1(C)CCCCN1C(=O)OC(C)(C)C 1890137060 YPTRTPCCFTYWJA-IFXJQAMLSA-N 435.403 4.844 50 10 IJGE C[C@@H](Oc1cccc(Cl)c1)C(=O)N(C)C[C@@H](Br)COCc1ccccc1 1916346361 BVGSCWVOUYIGPL-NVXWUHKLSA-N 440.765 4.546 50 10 IJGE Cc1ccc(Br)c(CN(C)C[C@@H](Br)COCc2ccccc2)n1 1980429324 GYLGUDAQDKFEEQ-MRXNPFEDSA-N 442.195 4.565 50 10 IJGE C[C@H](Br)[C@H]1CCCN1Cc1cccc(Br)c1Br 2018118174 YGUPTMGOIDUOBR-JOYOIKCWSA-N 425.990 4.959 50 10 IJGE CCC[C@H](Cl)CCNC(=O)c1ccc(I)c(Br)c1 2029917113 OJPUQCLEPMDZJW-JTQLQIEISA-N 444.538 4.581 50 10 IJGE CCCN(C(=O)[C@H](Br)C1CCCC1)C1CCN(C(=O)OC(C)(C)C)CC1 2110716591 ZDYSVJPVJAHQOU-QGZVFWFLSA-N 431.415 4.578 50 10 IJGE F[C@@]12CCC[C@@]1(CBr)CN(Cc1ncc(Br)cc1Cl)C2 2183581817 QAPHTMKURLSGRF-ZIAGYGMSSA-N 426.555 4.587 50 10 IJGE CC(C)[C@H](CBr)CN1C[C@H](CNC(=O)OC(C)(C)C)[C@@H](c2ccccc2)C1 2185528925 KZGVIDFMNDROTN-HSALFYBXSA-N 439.438 4.894 50 10 IJGE COc1cccc(N2C[C@]3(C)CN(Cc4ccccc4)C[C@]3(C)C2)c1CBr 2203190648 SAZJKHWFFMSSCM-ZRZAMGCNSA-N 429.402 4.939 50 10 IJGE Clc1cc(CN2CC(CCCBr)C2)ccc1I 2216687351 DLDKESILWDQFQJ-UHFFFAOYSA-N 428.539 4.552 50 10 IJGE CN[C@@H](c1c(F)cc(Br)c(F)c1Br)C1CC(Br)C1 2260005163 FFOIOKDRMJSDEG-REFSAOSRSA-N 447.943 4.924 50 10 IJGE O=C(N[C@H]1CCC[C@@H]1CCBr)c1cc(Br)c(F)cc1Cl 2285959753 VGSQABGLTVHBFQ-OQPBUACISA-N 427.539 4.925 50 10 IJGE COc1ccc(C=CC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2ccc(F)cc2)cc1 2314634184 XQKQWRWDERWRKR-VWLOTQADSA-N 442.446 4.671 50 10 IJGE Clc1ccc(CN2C[C@H]3[C@H](Br)CC[C@H]3C2)cc1I 2315553879 YHFUGLYPNLPBCG-QJPTWQEYSA-N 440.550 4.550 50 10 IJGE O=C(N[C@H](CCl)C1CCCCC1)c1ccc(Cl)cc1I 2365585398 AAWOTLPOXGUGJO-CQSZACIVSA-N 426.125 4.862 50 10 IJGE CC(C)(C)C[C@@H](CCl)CNC(=O)c1ccc(Cl)cc1I 2365599575 WKKMGRBXPXPMAL-JTQLQIEISA-N 428.141 4.966 50 10 IJGE O=C(CSc1nc2ccccc2s1)N/N=C/c1cccn1-c1ccc(Cl)cc1 1413812 WDVCHGFVEWKHMR-WSDLNYQXSA-N 426.954 4.983 50 10 IJGE CC(C)(C)c1ccc(/C=N/NC(=O)/C(=C/c2cccs2)NC(=O)c2ccccc2)cc1 3166621 UUJWJJHVGXGDOP-NMVQVFOTSA-N 431.561 4.967 50 10 IJGE COc1ccc(Br)cc1/C=N/NC(=O)[C@H](C)Nc1cccc2ccccc12 27528117 NXAFNJGCIYRCOX-WQEJZQBCSA-N 426.314 4.562 50 10 IJGE CCOc1ccc(/C=N\NC(=O)c2ccc3nc(SC(C)C)[nH]c3c2)cc1OCC 169917840 HVTJATHJRQPYBG-QRVIBDJDSA-N 426.542 4.625 50 10 IJGE CC(C)COCCO[C@@H](CI)c1ccc(Br)cc1 232675335 AFLSMTSBPABGNB-AWEZNQCLSA-N 427.120 4.614 50 10 IJGE O=C(NCCCCCCI)c1ccc(Br)cc1Cl 236036094 MYOMJZPMDYQDNM-UHFFFAOYSA-N 444.538 4.828 50 10 IJGE O=C(NCCC1(CBr)CC1)c1cc(Br)c(Br)s1 395827164 AJLVPEZOGZFGNJ-UHFFFAOYSA-N 446.002 4.568 50 10 IJGE CC[C@H](Cl)c1noc(-c2ccc(I)c(Br)c2)n1 721576222 DEEYYNXYVNZXAH-QMMMGPOBSA-N 427.467 4.794 50 10 IJGE CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 763794987 IXJUYNBVGOVZIU-UHFFFAOYSA-N 447.988 4.538 50 10 IJGE O=C(NNC(=O)c1ccc(Br)cc1)Nc1ccccc1SCC(F)(F)F 1116582037 ACVVSBGVAQSHIH-UHFFFAOYSA-N 448.264 4.570 50 10 IJGE C#CC[C@@H](CCOC)NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc3ccccc23)c1C 1438147442 LSDHNWHBCJDONM-PSJJOBAMSA-N 425.532 4.699 50 10 IJGE C#CCCCC(=O)NNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1)C[C@H](C)C2 1597394172 QHZSTOIQJYRAOF-UQNFDQQLSA-N 437.543 4.922 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cc3oc(O)nc3cc2F)c(C)n1-c1ccc(F)cc1 1645189339 DBHADYONWOLTGJ-NVNXTCNLSA-N 434.402 4.765 50 10 IJGE O=C(NNc1nc2ccccc2[nH]c1=S)c1cc(-c2ccccc2C(F)(F)F)on1 1646017778 RVSJCEIBHGGYAO-UHFFFAOYSA-N 431.399 4.723 50 10 IJGE Cc1nn(Cc2c(F)cccc2Cl)c2c1[C@H](c1cn(C)c3ccccc13)C(C#N)=C(N)O2 1865698693 ANXXJGOZMSMYHL-QFIPXVFZSA-N 447.901 4.742 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2-c2ccccc2Cl)[C@H]1c1ccncc1 1865700422 SPPOEQPIUOKZGI-FQEVSTJZSA-N 425.879 4.806 50 10 IJGE C[C@H]1CN(Cc2ccccc2)C[C@H](C)N(c2ccc([N+](=O)[O-])c(CBr)c2)C1 1921467335 AIVAPWNLNAPCKJ-IRXDYDNUSA-N 432.362 4.837 50 10 IJGE O=C(N[C@H]1CC[C@H](CBr)C1)c1cc(Br)cc(Br)c1 2029536102 PFHSBETYXBWJTK-UFBFGSQYSA-N 439.973 4.505 50 10 IJGE CCn1c(Cc2ccccc2)nnc1SCC(=O)C(C#N)=C1Nc2ccccc2S1 2042438778 AIBNMYJFDYMSFK-UHFFFAOYSA-N 433.562 4.503 50 10 IJGE CCCN1C[C@@H](Br)[C@H](Cc2cc(Br)ccc2Br)C1 2054715934 AKKHQXUCHCTBTK-BXUZGUMPSA-N 440.017 4.859 50 10 IJGE ClC[C@@H](Nc1ncc(I)cc1Br)c1ccccc1 2069530140 VSHFBRKRXSFSBI-GFCCVEGCSA-N 437.506 4.841 50 10 IJGE C=CCC[C@@H](CBr)NC(=O)c1c(Br)cccc1Br 2075336567 WLWDNCDDSJFTMP-VIFPVBQESA-N 439.973 4.671 50 10 IJGE CC(C)(C)OC(=O)NCC1(CNC(=O)[C@H](Br)C2CCCC2)CCCCC1 2110715585 OLIUNEXGUXHLIL-MRXNPFEDSA-N 431.415 4.532 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CCC(F)(F)[C@H](CCl)C1 2148750626 MLPUELHYGNONNK-MRVPVSSYSA-N 431.502 4.548 50 10 IJGE CC1(C)C[C@H](CNC(=O)c2ccc(CBr)cc2)CN(C(=O)OC(C)(C)C)C1 2172558117 VJZQYFUMYNHAED-MRXNPFEDSA-N 439.394 4.595 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@H](C(=O)O)N(CCCCCCCCCBr)C1 2188789621 YBMCFNJALMOGBS-DLBZAZTESA-N 449.430 4.554 50 10 IJGE C[C@@H](Cl)c1nc2cncc(Br)c2n1C[C@]1(Br)CC1(F)F 2202505262 LVXJIJTZFHOURB-KSBSHMNSSA-N 429.490 4.666 50 10 IJGE C[C@H](Br)C[C@@H]1CCCCCN1C[C@H]1CC1(Br)Br 2213095568 PHEWJIFAOJFHRH-TUAOUCFPSA-N 432.038 4.911 50 10 IJGE Cc1cc(Br)c([C@H](Br)C2(C)CS(=O)(=O)C2)c(C)c1Cl 2224309261 ATPPPLCOVRCBAZ-LBPRGKRZSA-N 430.589 4.590 50 10 IJGE COc1ccc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)c(CBr)c1 2235953746 FRMBGUQBNGTSSF-IBGZPJMESA-N 443.307 4.843 50 10 IJGE Cc1cc(Br)c([C@@H](Br)c2cscc2S(C)(=O)=O)s1 2260093613 ZMBHDIHKZRULGJ-JTQLQIEISA-N 430.208 4.768 50 10 IJGE CCc1cc([C@H](Br)[C@]23CCC[C@@H]2CS(=O)(=O)C3)sc1Br 2282915395 AKUNIHQWQUTJJK-OSMZGAPFSA-N 442.238 4.724 50 10 IJGE COc1c(C(=O)N[C@H](CCBr)COCc2ccccc2)csc1Cl 2303539211 NALABKZQWYBQNK-CYBMUJFWSA-N 432.767 4.510 50 10 IJGE C[C@@H]1OCC[C@]1(CCl)Cc1ccc(I)c(Br)c1 2306221171 FEYQRTKQIDZWHX-TVQRCGJNSA-N 429.523 4.630 50 10 IJGE CN(Cc1cc(I)ccc1Cl)C(C)(C)CCBr 2307327327 ZYRUCORHOFDSFP-UHFFFAOYSA-N 430.555 4.940 50 10 IJGE COC(=O)C(C#N)=Cc1ccc(OC(=O)c2sc3ccccc3c2Cl)c(OC)c1 2314792500 IOVMNAKNQZZMNS-UHFFFAOYSA-N 427.865 4.862 50 10 IJGE Brc1cnc(N2C[C@H]3CC(Br)C[C@@H](C3)C2)c(Br)c1 2316862300 CICLEFPVNNGFDY-RKDXNWHRSA-N 438.989 4.606 50 10 IJGE COc1ccc2c(c1)c(C=NNC(=O)c1ccc(-c3ccc(F)c(F)c3)nc1C)cn2C 2321218357 KGVXLQDTZBKMNX-UHFFFAOYSA-N 434.446 4.599 50 10 IJGE CC(C)(C)OC(=O)Nc1cccc2c1CN(C[C@@]1(CBr)CC1(F)F)CC2 2351889358 UKKWJOHNLPEWNB-SFHVURJKSA-N 431.321 4.812 50 10 IJGE O=C(CSc1nc2ccccc2n1Cc1ccccc1Cl)N/N=C\c1ccccc1 33393122 AUSMFFIEDLWMJF-QFEZKATASA-N 434.952 4.980 50 10 IJGE C[C@@H](Oc1ccc(F)cc1)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(F)cc1 38652835 YELBSFLTWXFIEP-FATZIPQQSA-N 448.425 4.556 50 10 IJGE CCOc1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCc1ccc(C)cc1 169879641 QZKURIKJWWRHOQ-MFKUBSTISA-N 433.464 4.645 50 10 IJGE CCOc1cc(/C=N\NC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)cc(Cl)c1OC 169890118 YYOYYISCOPMRMJ-MXAYSNPKSA-N 425.916 4.871 50 10 IJGE COc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(F)cc2)cc1 205645249 XQKQWRWDERWRKR-PEIBFACBSA-N 442.446 4.671 50 10 IJGE CC(=O)c1cccc(N2Cc3ccccc3C2=NC(=O)/C(C#N)=C/c2ccc3c(c2)OCO3)c1 254440589 BNBOOSJKKXCBFD-CBMOFQPBSA-N 449.466 4.518 50 10 IJGE C[C@H](Br)C[C@@H]1CCCCCN1S(=O)(=O)c1ccc(Br)s1 312913616 AVXNUSNYZOZZGB-QWRGUYRKSA-N 445.242 4.617 50 10 IJGE CC[C@H](Cl)[C@H](CC)NC(=O)c1cc(Br)ccc1I 313089154 FTBGDIYTZNVNMR-JQWIXIFHSA-N 444.538 4.580 50 10 IJGE COc1ccc([C@H](Br)c2cccc(F)c2I)s1 721671413 FWMJQLNDCVTOQU-LLVKDONJSA-N 427.076 4.985 50 10 IJGE O=C(NNc1ccccc1OC(F)(F)F)C1CCN(c2nc3ccccc3s2)CC1 779209868 SYBGYXRLDQTBJF-UHFFFAOYSA-N 436.459 4.555 50 10 IJGE N#Cc1ccc(NNC(=O)Nc2nc(-c3cccc(Cl)c3)ns2)c(C(F)(F)F)c1 799411398 MTMCUWFXUHDEGZ-UHFFFAOYSA-N 438.822 4.898 50 10 IJGE Cc1sc2nc(CS[C@H](C)C(=O)NNc3ccc(C(C)C)cc3)nc(O)c2c1C 1449547623 YJSTWOPMAUWDQM-CQSZACIVSA-N 430.599 4.902 50 10 IJGE C=CCOc1cn(-c2ccccc2)nc1C(=O)NNc1cc(Cl)ccc1Br 1455594643 WPXXYWHCHTVHSK-UHFFFAOYSA-N 447.720 4.610 50 10 IJGE Cc1nn(-c2ccc(Br)cc2)c2c1[C@H](c1cccc(Cl)c1)C(C#N)=C(N)O2 1865683142 GTSKWHLUBDEMCO-GOSISDBHSA-N 441.716 4.815 50 10 IJGE COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C)nn2-c1ccc(Cl)c(Cl)c1 1865709795 GYFNDIZCOFJVGQ-LJQANCHMSA-N 427.291 4.714 50 10 IJGE O=C(N/N=C/c1c(C(=O)O)[nH]c2ccc(Cl)cc12)c1ccc2[nH]c3c(c2c1)CCCC3 1873498297 AXWDTJDKFVWRNL-OPEKNORGSA-N 434.883 4.644 50 10 IJGE C[C@H](Br)CN(Cc1ccccc1)C(=O)Cc1ccccc1Br 1914639156 RKZCBWYCMNPIAN-AWEZNQCLSA-N 425.164 4.804 50 10 IJGE O=C(c1cc(F)cc([N+](=O)[O-])c1F)N(Cc1ccccc1)C1(CBr)CCC1 1915749852 PUDYUMJIENCUDG-UHFFFAOYSA-N 439.256 4.833 50 10 IJGE C[C@@H](c1ccncc1Br)[C@H](Br)c1cn(C)c(Br)n1 1924055075 DSDXCXNEZPSJKT-CPCISQLKSA-N 437.961 4.580 50 10 IJGE Brc1cc([C@H](Br)[C@@H]2[C@H]3CCOC[C@@H]32)sc1Br 1937556818 AKHMXLFZNNIWPR-DERVNVNRSA-N 430.987 4.992 50 10 IJGE C[C@@H]1CN(Cc2c(Br)cccc2Br)C[C@H]1CBr 1945321883 JFELGMGYBNZCBT-NXEZZACHSA-N 425.990 4.674 50 10 IJGE CC[C@@H](C)[C@@H](Br)CNC(=O)c1cc(Br)ccc1Br 2029977737 OSZJBYROQHTUCE-PELKAZGASA-N 441.989 4.751 50 10 IJGE O=C(NC1CC(CCBr)C1)c1cc(Br)cc(Br)c1 2030033535 QWKLUBMEBZQHLC-UHFFFAOYSA-N 439.973 4.505 50 10 IJGE CC(C)[C@@H](CBr)CN1CCC[C@@H](N(CC(F)F)C(=O)OC(C)(C)C)C1 2044698302 AUPHPBKNTNBKBF-LSDHHAIUSA-N 427.374 4.620 50 10 IJGE ClC[C@H](Nc1ncc(I)cc1Br)c1ccccc1 2069530141 VSHFBRKRXSFSBI-LBPRGKRZSA-N 437.506 4.841 50 10 IJGE C[C@H](CCn1c(CCCl)nc2cncc(Br)c21)N(C)Cc1ccccc1 2095448611 XGGMAUYQPKWKMZ-OAHLLOKOSA-N 435.797 4.886 50 10 IJGE CC[C@@]1(CNC(=O)[C@@H](Br)C2CCCC2)CCCCN1C(=O)OC(C)(C)C 2110723803 OWLDNGHYFKWHAS-JXFKEZNVSA-N 431.415 4.626 50 10 IJGE C[C@@H](CCCCCI)NC(=O)c1c(F)cccc1Br 2117894088 JVEOISYKTDQCLA-JTQLQIEISA-N 442.110 4.702 50 10 IJGE CC(C)(C)OC(=O)N1CCN(C[C@H](CBr)C(C)(C)C)C[C@H]1CC(F)(F)F 2119512312 FQUFTGVCMNRECR-UONOGXRCSA-N 445.364 4.917 50 10 IJGE Cc1cc(N2C[C@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)ncc1CBr 2153341611 RYGWAILGKBVLQV-DHIUTWEWSA-N 426.402 4.777 50 10 IJGE O=C(c1c(Cl)cccc1Br)N1CC[C@@H](Br)C(F)(F)CC1 2169452141 HMHSIOIUSAFWNB-SNVBAGLBSA-N 431.502 4.737 50 10 IJGE FC(F)(CBr)[C@@H]1CCN(c2ncc(Br)c3ccsc23)C1 2197760709 DDPOOZXUGXMCGN-MRVPVSSYSA-N 426.124 4.915 50 10 IJGE O=S(=O)(c1ccc(F)c(Br)c1)N(Cc1ccccc1)C1(CCl)CCC1 2224003845 KRTVXPUPNKPPCS-UHFFFAOYSA-N 446.769 4.941 50 10 IJGE C[C@@H](COC(F)F)O[C@H](CI)c1ccccc1Br 2253912355 AMDMUCJMAWFAHM-GZMMTYOYSA-N 435.046 4.570 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@H](Br)[C@@H]1[C@@H]2CCO[C@H]21 2259994930 NAMSQMASLSWLRX-PKKPQWAOSA-N 446.911 4.961 50 10 IJGE Cc1cc(Br)c([C@H](Br)[C@@H]2CCCCS2(=O)=O)c(C)c1F 2279145132 VDNJECLKUPSOQJ-WCQYABFASA-N 428.161 4.608 50 10 IJGE C[C@H](CCl)[C@H]1CCCCN1C(=O)c1ccc(Cl)c(I)c1 2283670664 UWRXSJFJURNKRY-QMTHXVAHSA-N 426.125 4.814 50 10 IJGE COc1ccc([C@@H](Br)c2ccc3c(c2)CCO3)cc1I 2284996701 BXBYIYGXKUOHSS-INIZCTEOSA-N 445.094 4.719 50 10 IJGE CN[C@@H](c1c(F)cc(Br)c(F)c1Br)[C@@H]1C[C@@H]1Br 2298669987 LFVFLXPKQJPXLK-QWMRMABFSA-N 433.916 4.534 50 10 IJGE CC[C@@H](CBr)CN1CC[C@H](C(F)(F)F)C[C@@H]1CNC(=O)OC(C)(C)C 2308951053 YWDFPNGKVOXCFA-MELADBBJSA-N 431.337 4.575 50 10 IJGE CCOc1ccc(C=C(C#N)C(=O)Nc2nc(-c3ccccc3OC)cs2)cc1OC 2314777833 XCLPMHGFIGSROD-UHFFFAOYSA-N 435.505 4.772 50 10 IJGE CCSc1ccc(Cl)cc1CC(=O)NN=Cc1ccc(O)c(Br)c1 2323679940 PJZUHIBEKVRVQV-UHFFFAOYSA-N 427.751 4.613 50 10 IJGE F[C@]1(CNCc2ccc(I)c(Br)c2)C[C@@H](CCl)C1 2325203315 CUWJFVQFRQSJCR-MJHDQNEOSA-N 446.529 4.500 50 10 IJGE Clc1ccc(I)cc1CN1C[C@H]2C[C@@H](Br)C[C@H]1C2 2327399846 WTNLYUYMSFTPMT-UFGOTCBOSA-N 440.550 4.692 50 10 IJGE CCOc1ccc(CCNC(=O)C(C#N)=Cc2cccc(Br)c2)cc1OCC 2329691603 WIXPWGIVGZJMAV-UHFFFAOYSA-N 443.341 4.512 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1CN(CC1CC1)C[C@@]1(CBr)CC1(F)F 2351888909 LTFHGVBNERIYBK-QAPCUYQASA-N 437.369 4.518 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@H]2CC[C@H]1[C@H](Br)C2 2377475361 UXTWBSUYJJMSEZ-NYNLCMDTSA-N 425.523 4.630 50 10 IJGE Cn1c(SCC(=O)N/N=C\c2c(Cl)ccc(Cl)c2Cl)nc2ccccc21 169876496 MDFITPKIHKHCRW-WNFQYIGGSA-N 427.744 4.776 50 10 IJGE COc1cc(/C=N/NC(=O)c2ccc3[nH]c(-c4ccccc4)nc3c2)ccc1OC(C)C 169926869 NCMWFGYFSBOACF-CVKSISIWSA-N 428.492 4.790 50 10 IJGE CC[C@@H](Br)C(=O)Nc1nc2scc(-c3cc(Cl)ccc3Cl)n2n1 170503019 GOSADNQZPJOLEV-SECBINFHSA-N 434.146 4.877 50 10 IJGE CC[C@](C)(CO[C@H](CI)c1ccc(Br)cc1)OC 319151510 ZIKIKCPECWBZJM-ZIAGYGMSSA-N 427.120 4.757 50 10 IJGE CC(C)N(C[C@@H](C)Br)C(=O)c1ccc(Br)cc1Br 691345750 XBCYMABSHBDZPJ-SECBINFHSA-N 441.989 4.846 50 10 IJGE CCC[C@H](Br)CNC(=O)c1scc(Br)c1Br 705509746 FYNZARFFYPWPPY-LURJTMIESA-N 433.991 4.567 50 10 IJGE Cc1ccccc1NNC(=O)c1sc(-c2ccccc2)cc1OCC(=O)N1CCCCC1 739387793 MMBHFTXFCLLPFM-UHFFFAOYSA-N 449.576 4.872 50 10 IJGE Cc1ccccc1C(=O)NNC(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 757755964 MQXALVKZJBHAQK-UHFFFAOYSA-N 447.882 4.850 50 10 IJGE O=C(NCc1ccnc(OC(F)F)c1)C(=O)Nc1cccc(S(F)(F)(F)(F)F)c1 793102070 UUOBJYQHWUFDSI-UHFFFAOYSA-N 447.332 4.595 50 10 IJGE N#CCCn1cc(/C=C(\C#N)C(=O)NCC2(c3ccccc3)CCC2)c(-c2ccccc2)n1 914467365 DESQHPZWCNTJFZ-OQKWZONESA-N 435.531 4.609 50 10 IJGE O=C(CCCSc1nc2ccc([N+](=O)[O-])cc2s1)NN=Cc1c[nH]c2ccccc12 1084263428 ZLWXJCLOZHDERO-UHFFFAOYSA-N 439.522 4.708 50 10 IJGE COc1ccc(/C(C#N)=C/c2ccc(OC(=O)COc3ccccc3OC)cc2)cc1OC 1615099368 OJTNOTACRNGDOR-XSFVSMFZSA-N 445.471 4.761 50 10 IJGE C#CCCCC(=O)NNC(=O)Nc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1C 1669453490 QDTTWPPRONYPSR-UHFFFAOYSA-N 435.503 4.688 50 10 IJGE C=CCOc1cccc(NC(=O)NNc2c(Br)cccc2Br)c1 1673782126 DWQHVIHYWWPMDM-UHFFFAOYSA-N 441.123 4.925 50 10 IJGE CCc1nn(CC)c2c1[C@@H](c1ccc(OCc3ccc(C)cc3)c(OC)c1)C(C#N)=C(N)O2 1865694847 CYDJHZIBSBSBEY-QHCPKHFHSA-N 444.535 4.580 50 10 IJGE Cc1ccc(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2ccc(F)cc2F)cc1 1865701643 AGNSILZGVAUBTC-QGZVFWFLSA-N 446.379 4.755 50 10 IJGE COc1ccc(-c2nn(-c3cccc(Cl)c3)c3c2[C@H](c2ccc[nH]2)C(C#N)=C(N)O3)cc1 1865710482 ZACTZZSPKHNJQK-FQEVSTJZSA-N 443.894 4.748 50 10 IJGE CC[C@]1(C)[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C 1887218562 YRADNODIOLYJEW-IQUTYRLHSA-N 435.403 4.700 50 10 IJGE Cn1nc(C(=O)N(Cc2ccccc2)C2(CBr)CCC2)c(Cl)c1Cl 1915759667 GHHHYAUSNYLSCL-UHFFFAOYSA-N 431.161 4.687 50 10 IJGE O=C(c1cc(Br)sc1Br)N1CC[C@]2(CCC[C@@H]2Cl)C1 1918905945 ASXYVEGIXSLQAR-TVQRCGJNSA-N 427.589 4.897 50 10 IJGE C[C@H](Br)C[C@H](C)NC(=O)c1csc(Br)c1Br 1937737548 KLUPNKZWGGXMPP-WDSKDSINSA-N 433.991 4.565 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CC12CCC1(CC2)CC[C@@](C)(CI)O1 1996430089 GSEVDOPMWRJWMK-MVFQDEJUSA-N 449.373 4.834 50 10 IJGE C[C@]1(NC(=O)c2cc(Br)c(Br)s2)CCC[C@@H]1Br 2011556959 VMVAAXMPVNLRNL-KWQFWETISA-N 446.002 4.709 50 10 IJGE ClC[C@@H]1CCC[C@@H](Nc2ncc(I)cc2Br)C1 2015756764 KNBBZGZARIHSLV-PSASIEDQSA-N 429.527 4.658 50 10 IJGE ClC[C@H](CNc1ncc(I)cc1Br)C1CCC1 2015764466 BBLPSOBOOZLZPG-SECBINFHSA-N 429.527 4.516 50 10 IJGE CC(C)(C)OC(=O)N1CCN(CC2(CBr)CCCC2)C[C@@H]1CC(F)F 2057191967 BFNKKNXLQWSIQH-AWEZNQCLSA-N 425.358 4.518 50 10 IJGE Cc1cc(C)c(O)c(-n2nc(CCl)c(I)c2C(F)(F)F)c1 2079210035 GUVSNWPGSLUBKD-UHFFFAOYSA-N 430.595 4.557 50 10 IJGE C[C@@H]1[C@@H](C(F)(F)F)N(C[C@H](CBr)CC2CC2)CCN1C(=O)OC(C)(C)C 2115980976 XEFDSVPBSPCODD-SNPRPXQTSA-N 443.348 4.670 50 10 IJGE Clc1cccc(N2CC[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1CBr 2129053544 NNDWVVPQESMCDL-RTWAWAEBSA-N 435.793 4.715 50 10 IJGE Br[C@H](c1cc(I)cc2c1OCC2)[C@@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]32 2134557599 JNXUHLJRJVSLGQ-UWTUMZHZSA-N 431.111 4.564 50 10 IJGE CC(C)(C)OC(=O)N1C[C@]2(C)CN(C[C@H](CBr)c3ccccc3)C[C@]2(C)C1 2163060062 ZBAYZFROZZFFBT-YUXAGFNASA-N 437.422 4.744 50 10 IJGE Clc1ccc(Br)c(CN2CCC(COCCBr)CC2)c1 2167392866 QOTKCKSMQPOHTK-UHFFFAOYSA-N 425.592 4.726 50 10 IJGE CN(C(=O)c1cc(Cl)ccc1Br)[C@H](CCBr)C(F)(F)F 2178515256 KHMNTOZLTUIPBF-SNVBAGLBSA-N 437.481 4.890 50 10 IJGE Cc1nn(C)c(Br)c1[C@@H](Cl)c1c(Br)cc(F)c(F)c1F 2185753315 HMAAUNKEVFNVPK-SECBINFHSA-N 432.465 4.999 50 10 IJGE CN(CC1CC(Br)C1)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 2196906300 CCAJYZDLZACCLV-VMWRSERWSA-N 439.394 4.665 50 10 IJGE C[C@](CI)(O[C@H]1[C@H]2[C@H]3[C@H]2C[C@@H]2[C@@H]1[C@@H]32)c1ccccc1Br 2208404058 BWOBTWGJKJTBCG-YISWAJAUSA-N 445.138 4.626 50 10 IJGE O=C(c1csc(Br)c1Br)N1CC(CCCBr)C1 2216697569 WJSQCYHLEXAXHV-UHFFFAOYSA-N 446.002 4.520 50 10 IJGE Fc1cc(Br)c(F)c(Br)c1[C@@H](Br)[C@H]1CCOC1 2250737370 CDYTVLNSMDGXAJ-CDUCUWFYSA-N 434.900 4.962 50 10 IJGE CC(C)[C@H](Cl)C(=O)N1CCC(c2nc(N(C)C)ncc2-c2cccc(Cl)c2)CC1 2296578166 MHFSJJBNRWEEOO-IBGZPJMESA-N 435.399 4.832 50 10 IJGE C[C@@H](NC=C(C#N)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C12CC3CC(CC(C3)C1)C2 2318462012 BJWQFQZBVZEQRZ-ZHHULCEESA-N 428.920 4.789 50 10 IJGE N#CC(=CNc1ccc(S(=O)(=O)O)cc1)C(=O)NC1CCCCCCCCCCC1 2325471450 BGLWIZRTNOCPJH-UHFFFAOYSA-N 433.574 4.542 50 10 IJGE COc1ccccc1-c1csc(C(C#N)=C(O)c2ccc3c(c2)C(=O)N(C(C)C)C3=O)n1 2331281804 SXWQQKGTPZAANU-UHFFFAOYSA-N 445.500 4.773 50 10 IJGE COc1cc(OC)c(-c2csc(C(C#N)=C(O)[C@H]3CC(=O)N(C(C)C)C3)n2)cc1Cl 2331378735 WEVQLPGTYREAFY-LBPRGKRZSA-N 447.944 4.530 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2OC[C@@H]3CCC[C@@H]32)cc1I 2334464167 VLTZEJVSLMFACV-UOVKNHIHSA-N 437.115 4.551 50 10 IJGE O=C(N[C@@H]1C[C@@H]2C[C@H]1C[C@H]2Br)c1cc(F)c(Br)cc1Cl 2359286121 JUORDSVHTGFGKE-KNWYZZDGSA-N 425.523 4.533 50 10 IJGE COC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc(COc2ccccc2Cl)c(C)cc1C 1010410 XGPQJBBOGZNMPW-QFIPXVFZSA-N 438.911 4.791 50 10 IJGE CCOC(=O)[C@@]1(C)c2[nH]c3ccccc3c2[C@H](c2ccc(Cl)cc2)CN1C(=O)CCl 11767124 GMTABGKMARAVLC-GAJHUEQPSA-N 445.346 4.813 50 10 IJGE CC(C)(C)c1ccc(C(=O)NNC(=O)COc2ccc(C3SCCCS3)cc2)cc1 17518453 PRJBIWBZUIXNGC-UHFFFAOYSA-N 444.622 4.693 50 10 IJGE COc1cccc(OCC(=O)Oc2ccc(/C=C(/C#N)c3ccc(OC)c(OC)c3)cc2)c1 31901048 XKDAZEKYTSLAJB-MOSHPQCFSA-N 445.471 4.761 50 10 IJGE COc1ccc(-c2nn(-c3ccccc3)cc2/C=C(\C#N)C(=O)NCCc2ccccc2)cc1 33658217 HUVULSDZTYYXJA-PTGBLXJZSA-N 448.526 4.814 50 10 IJGE Cc1cc([C@@H](Br)c2cccc(S(C)(=O)=O)c2)c(C)cc1Br 70472129 UEFGZQVFRRFAHP-INIZCTEOSA-N 432.177 4.954 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1Br)c1ccc(Br)c(C(F)(F)F)c1 123004043 LTZCKBYRXMMYFO-NEPJUHHUSA-N 429.074 4.904 50 10 IJGE O=C(N[C@H]1CCC[C@@H]1CBr)c1cc(Br)c(Br)s1 231556844 BYOAUSRPWDLGPC-SVRRBLITSA-N 446.002 4.567 50 10 IJGE Cc1ccc2c(c1)c1c3n2CCN(CC(=O)NN=Cc2ccc(C(C)C)cc2)[C@H]3CCC1 254403192 IPXMQNGZHBPDEF-VWLOTQADSA-N 428.580 4.916 50 10 IJGE CCOC(=O)c1ccc(-c2ccc(C=NNC(=O)CNc3cccc4ccccc34)o2)cc1 254405024 WLHANTTURXUCPZ-UHFFFAOYSA-N 441.487 4.839 50 10 IJGE CCCCCN1C(=O)C(=NNC(=O)c2ccc(-n3c(C)ccc3C)cc2)c2ccccc21 254622479 MBMUERGUSUVYKU-UHFFFAOYSA-N 428.536 4.765 50 10 IJGE Cl[C@@H](c1ccc(Br)o1)c1cc(I)cc2c1OCC2 385375069 PRVKVYDJHORMJD-GFCCVEGCSA-N 439.474 4.910 50 10 IJGE CN(C[C@H]1CCC[C@@H]1Br)c1ncc(Br)cc1Br 689282538 UZSWPJLQFAHQTE-SCZZXKLOSA-N 426.978 4.606 50 10 IJGE COc1ccccc1OCC(=O)NN=Cc1cc(C)n(-c2ccc(Cl)cc2Cl)c1C 725438572 XQRDUPMKXBAIQH-UHFFFAOYSA-N 446.334 4.939 50 10 IJGE CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NNc1ccc(F)cc1Br)O[C@@H](C)C2 748073891 GMRBOOOVRWUSSY-PJODQICGSA-N 449.320 4.557 50 10 IJGE O=C(NCc1ccn(C2CCCC2)n1)C(=O)Nc1ccc(S(F)(F)(F)(F)F)cc1 773417478 KXEDLTXUZJPFJW-UHFFFAOYSA-N 438.422 4.911 50 10 IJGE N#Cc1cccc(NNC(=O)C(=O)Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)c1 773689329 YFVOTXKABOXCRQ-UHFFFAOYSA-N 425.275 4.614 50 10 IJGE O=C(NNc1cc(F)ccc1Br)c1cc2cccc(C(F)(F)F)c2nc1O 1626625687 LUYMXHSLXMTCLW-UHFFFAOYSA-N 444.182 4.618 50 10 IJGE CC(=O)c1cccc(CNC(=O)NNc2c(Cl)cc(Br)cc2Cl)c1 1636606498 GPVQTVGMXMTHEW-UHFFFAOYSA-N 431.117 4.785 50 10 IJGE Cc1ccc2c(c1)C(=NNC(=O)[C@@H](C)Oc1ccc(Cl)cc1C)C(=O)N2CCC(C)C 1772720259 HAEWBBSGLMVXCT-QGZVFWFLSA-N 441.959 4.637 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2cccc(F)c2)[C@@H]1c1ccccc1O 1865708016 LUCJJDYBJNWKDL-JOCHJYFZSA-N 438.462 4.661 50 10 IJGE Cc1ccc(OCCCC(=O)NNC(=O)c2ccc(-c3ccc(C)c(C)c3)nc2C)cc1 1865756365 UQXPJBCUDHFOKJ-UHFFFAOYSA-N 431.536 4.602 50 10 IJGE CC(C)[C@@H]1[C@@H]([C@H](CBr)NC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C 1881095383 SYUGTMSYAMLDOU-QLFBSQMISA-N 435.403 4.556 50 10 IJGE O=C(c1cc(F)c(F)c(O)c1F)N(Cc1ccccc1)[C@@H](CBr)C1CC1 1915315323 VSTNYZYTBWCUIS-HNNXBMFYSA-N 428.248 4.625 50 10 IJGE ClCC[C@@H]1CCC[C@H]1Nc1ncc(I)cc1Br 2015765376 FPIUAWWSAZWPMX-GZMMTYOYSA-N 429.527 4.658 50 10 IJGE Clc1cc(CN2CCC[C@@H]2CCBr)ccc1I 2026559466 AOFRSJIQQAOGAR-LLVKDONJSA-N 428.539 4.694 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1Cc1ccc(I)c(Cl)c1 2026563696 MLDSDCHBBGGVBX-KOLCDFICSA-N 428.539 4.692 50 10 IJGE CC[C@H](C)[C@@H](CBr)NCc1ccc(I)c(Cl)c1 2026564143 QJHDEJOJVYQEJR-TVQRCGJNSA-N 430.555 4.844 50 10 IJGE CC(C)Cc1ccc([C@H](Br)c2cnn(C)c2I)s1 2027127343 FGUPOORXLBXMMX-GFCCVEGCSA-N 439.160 4.769 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCCN1C[C@@H](Br)C(F)(F)F 2044701126 GKLSUGOKISPKMK-BFHYXJOUSA-N 429.321 4.566 50 10 IJGE Oc1nc2cc([C@@H](Br)C3CC(Br)C3)c(Br)cc2[nH]1 2076167964 SWRYNLQBSYOWIN-HPPGLBNUSA-N 438.945 4.641 50 10 IJGE O=C(c1scc(Br)c1Br)N1C[C@H]2CCC[C@@]2(CCl)C1 2103173917 XRJXQZHXOMBVJT-AMIZOPFISA-N 427.589 4.754 50 10 IJGE Cc1cc(NS(=O)(=O)CCC(CCl)CCl)ccc1NC(=O)OC(C)(C)C 2106296193 PJUODXOOFOSIKT-UHFFFAOYSA-N 425.378 4.568 50 10 IJGE Cc1cc(Cl)c(Br)cc1[C@@H](Br)[C@@H]1CCCS(=O)(=O)C1 2137655361 LTMSBUORCPEWDW-RNCFNFMXSA-N 430.589 4.672 50 10 IJGE C[C@@]1(CBr)CC(F)(F)CN1C(=O)c1cccc(Br)c1Cl 2159049751 QENUQCXTWQWAEZ-LBPRGKRZSA-N 431.502 4.737 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CC[C@H](C(F)(F)CCl)C1 2197756248 LJICULZYRBEPMJ-QMMMGPOBSA-N 431.502 4.548 50 10 IJGE O=C(N1CCC[C@@H]([C@@H]2CCCCN2CCCCCCBr)C1)C(F)(F)F 2231102138 CDTOELTWNVDYEG-CVEARBPZSA-N 427.349 4.597 50 10 IJGE N[C@H](c1c(F)cc(Br)c(F)c1Br)[C@H]1C[C@H](Br)C1 2250815588 DLTFQLCQBXFKMG-ANYMCVJYSA-N 433.916 4.663 50 10 IJGE COc1ccc([C@H](Br)[C@@H]2C[C@]23CC3(F)F)cc1I 2257367864 DFHWYBKWTMUSII-UWJYBYFXSA-N 429.042 4.781 50 10 IJGE C[C@@H]1CC[C@@](CBr)(NC(=O)c2cc(F)c(Br)cc2Cl)C1 2282974135 FOEBIPUDKHBXNS-XLKFXECMSA-N 427.539 4.925 50 10 IJGE C[C@@H](c1ccncc1Br)[C@H](Br)c1cscc1S(C)(=O)=O 2288510669 GKMFSGULFDVOLT-SDBXPKJASA-N 439.194 4.549 50 10 IJGE C[C@@]1(CBr)CCN(Cc2ccc(Cl)c(I)c2)C1 2300239086 UCEVGVJFOANMHQ-ZDUSSCGKSA-N 428.539 4.552 50 10 IJGE C[C@@H]1CCN(Cc2ccc(I)c(Br)c2)C[C@@H]1Cl 2306231480 JYRCJKVSHHZTQV-SKDRFNHKSA-N 428.539 4.503 50 10 IJGE C[C@@H]1C[C@H](Br)CCN1Cc1cc(I)ccc1Cl 2307328227 KJJKDGITJJKUTF-MWLCHTKSSA-N 428.539 4.692 50 10 IJGE CCO[C@@H]1[C@@H](Br)C[C@H]1OCc1cc(Br)cc(Br)c1 2315453500 NBHVLZBTPOGWEY-YNEHKIRRSA-N 442.973 4.669 50 10 IJGE C[C@@H]1CCC[C@@H](C)N1C=C(C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 2324605997 IPDGRCWTWVYUKB-DHIUTWEWSA-N 442.607 4.591 50 10 IJGE CN(Cc1ccc(I)c(Br)c1)C[C@H]1CCC[C@H]1Cl 2325224885 ZZVJLDWIBPLNAM-DGCLKSJQSA-N 442.566 4.893 50 10 IJGE COc1c(C)cc(C)cc1-c1csc(C(C#N)=C(O)[C@@H]2CC(=O)N(C(C)(C)C)C2)n1 2331373196 KZTCFHQMCFGPLN-OAHLLOKOSA-N 425.554 4.875 50 10 IJGE CC(C)C[C@H](CBr)CN1CCN(C(=O)OC(C)(C)C)CC[C@H]1C(F)(F)F 2353834167 LGSVWTWSBOEHTA-CABCVRRESA-N 445.364 4.917 50 10 IJGE CC(C)C[C@H](CBr)CN1CCc2sc(CNC(=O)OC(C)(C)C)nc2C1 2353834873 PLCXNLYOSXGEKC-CQSZACIVSA-N 446.455 4.583 50 10 IJGE Cc1cc(Br)c(F)c(Br)c1[C@H](Cl)[C@H]1CCCCS1(=O)=O 2365222688 GFFGZMHSINOGGS-BXKDBHETSA-N 448.579 4.906 50 10 IJGE O=C(COc1cc(Cl)ccc1Cl)N/N=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1 855710 LXWMRUJHIDJCRS-LSHDLFTRSA-N 434.235 4.691 50 10 IJGE Cc1cccc(C)c1NC(=O)COC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(F)cc2)c1C 11458964 DREXBGXYGZZLFO-FYJGNVAPSA-N 445.494 4.939 50 10 IJGE N#C/C(=C/c1ccc(-c2cccc(C(=O)O)c2)o1)C(=O)Nc1cccc(Br)c1 35074058 ZMCKRMWNHDPLSY-GDNBJRDFSA-N 437.249 4.953 50 10 IJGE CCCN1C(=O)/C(=N/NC(=O)CCCOc2ccc(Cl)cc2Cl)c2cc(C)ccc21 38180212 TYEFERLNDIXSDL-YYADALCUSA-N 448.350 4.738 50 10 IJGE O=C(N/N=C1\C(=O)N(C/C=C/c2ccccc2)c2ccccc21)c1cc2ccccc2cc1O 59148629 LQQOPYNRFCPSTG-LJMGGYGLSA-N 447.494 4.740 50 10 IJGE CCc1ccc2c(c1)/C(=N/NC(=O)COc1ccc(C(C)(C)CC(C)(C)C)cc1)C(=O)N2 59382393 BHEHUXRVEXQWCF-UHFFFAOYSA-N 435.568 4.814 50 10 IJGE O=C(N[C@H]1CCCC[C@@H]1Br)c1cc(Br)ccc1Br 161220682 JMJYKIKQLNEJAF-RYUDHWBXSA-N 439.973 4.648 50 10 IJGE Cc1ccc(/C=C\C(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@H]3c2cccc(F)c2)cc1 205652448 ZFMOOPUZGHEWKD-VDUBTBKOSA-N 426.447 4.971 50 10 IJGE CCCCc1ccc(OCC(=O)NN=Cc2ccc(OC(=O)c3ccccc3)cc2)cc1 254878727 BJRMQJAFCOLDRY-UHFFFAOYSA-N 430.504 4.778 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CBr)(OC(C(F)(F)F)C(F)(F)F)C1 301945355 BAZBSMRHUQJAOY-GFCCVEGCSA-N 444.210 4.661 50 10 IJGE O=C(NC[C@@H]1CN(Cc2ccccc2)CC12CCC2)c1ccc(CBr)cc1 693681736 RUGACIUMFPCPII-OAQYLSRUSA-N 427.386 4.614 50 10 IJGE Cc1cncc(/C=C/C(=O)NS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)c1 783460513 CVYPRWLWVFLXFZ-FARCUNLSSA-N 428.404 4.566 50 10 IJGE Cc1cc(Cl)ccc1NC(=O)C(=O)NN=Cc1cc(C)n(-c2cccc(Cl)c2)c1C 1084016782 HMZZVUOCVNRVER-UHFFFAOYSA-N 443.334 4.798 50 10 IJGE C/C(=C/c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(Br)cc1Cl 1360072278 XZGGAEJXARYFKV-NTMALXAHSA-N 428.113 4.620 50 10 IJGE CC(=O)c1cc(NC(=O)NNc2cccc(OC(F)F)c2Br)ccc1C 1625925735 FBMHJSGXLNELJZ-UHFFFAOYSA-N 428.233 4.710 50 10 IJGE C=CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2-c1ccccc1 1865691649 XJCVYMSKRSEUGD-SFHVURJKSA-N 438.409 4.674 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2Cl)[C@@H]1c1cccs1 1865698424 SZJKLOANGCJVAA-AWEZNQCLSA-N 436.846 4.883 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccccc2)[C@@H]1c1c[nH]c2ccccc12 1865700085 KTGNRJPFMWBOSW-SFHVURJKSA-N 435.409 4.650 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C(N)O2 1865706327 TXEGVYOZYXAWOU-QFIPXVFZSA-N 437.459 4.714 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@@H]1c1ccc(F)cc1 1865707583 ABXXFGHIDMGAPL-MRXNPFEDSA-N 448.807 4.961 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CCC(C)(C)N(C[C@H](CBr)c2ccccc2)C1 1879062629 RSKYACLAEBTSGH-ROUUACIJSA-N 425.411 4.933 50 10 IJGE C[C@@H](C1CCC(NC(=O)OC(C)(C)C)CC1)[C@@H](CBr)NC(=O)OC(C)(C)C 1882086963 GLUDYOZOFOXJDC-SLTXQBBLSA-N 449.430 4.994 50 10 IJGE C[C@H](c1ccc(F)c(Br)c1)[C@@H](CBr)NC(=O)OC(C)(C)C 1885093145 KWYIBMHSWPUJPS-NOZJJQNGSA-N 425.136 4.980 50 10 IJGE O=S(=O)(c1ccc(N(CCCBr)Cc2ccccc2)cc1)C(F)(F)F 1914652906 KUDCIKBMJGDYTA-UHFFFAOYSA-N 436.293 4.772 50 10 IJGE C[C@H]1CC[C@H](Br)CN1Cc1cccc(Br)c1Br 1943884220 PBJBCEDPBMNCOB-ONGXEEELSA-N 425.990 4.959 50 10 IJGE C[C@@H]1[C@H](CBr)CCN1C(=O)c1csc(Br)c1Br 1945189477 RBIAUFVFQHAGTK-RQJHMYQMSA-N 446.002 4.519 50 10 IJGE COc1cc([C@H]2C(C#N)=C(N)Oc3cc4c(cc32)[C@H](C)CC(C)(C)N4C)cc(OC)c1OC 2087934215 ZAHNTKBQPBRGBI-QKFKETGDSA-N 449.551 4.653 50 10 IJGE CC(C)(C)OC(=O)N1CCOC2(CCC3(CC2)C[C@@]3(CBr)C(F)(F)F)C1 2138799800 JFPXOQVDTLKNSL-JCYILVPMSA-N 442.316 4.900 50 10 IJGE O=C(NC[C@@]1(C2CC2)CCN(CCCCCCCCCBr)C1)C(F)(F)F 2163064061 SKBYOPGUYPPEKJ-SFHVURJKSA-N 441.376 4.893 50 10 IJGE C[C@@H]1CN(C(=O)c2ccc(I)c(Cl)c2)CC[C@@H]1CCCl 2172476004 RDEMDQAKIRNLKM-MNOVXSKESA-N 426.125 4.672 50 10 IJGE CC(C)(C)OC(=O)NC[C@@]12CC[C@@H](CN(C[C@@H](CBr)c3ccccc3)C1)C2 2176937300 NRHMDSCYMOWOQA-JUXOCIIHSA-N 437.422 4.792 50 10 IJGE COc1ccc(N2C[C@]3(C)CN(Cc4ccccc4)C[C@@]3(C)C2)c(CBr)c1 2235961550 ZCQXCTTWCGSIJL-GOTSBHOMSA-N 429.402 4.939 50 10 IJGE C[C@H](Br)CN(c1ncc(Br)cc1Br)C1CCC1 2250508774 DJDKHSKEJWSCAH-QMMMGPOBSA-N 426.978 4.749 50 10 IJGE Cc1nc(N(C)Cc2cccc(I)c2)sc1CBr 2254353733 SZQHVNZPSHCGJE-UHFFFAOYSA-N 437.144 4.587 50 10 IJGE O=C(c1scc(Br)c1Cl)N1CC[C@H](CBr)C(F)(F)C1 2264506735 LEDHGBJIWJSBEQ-ZCFIWIBFSA-N 437.531 4.656 50 10 IJGE Clc1ccc(CN2CC[C@@H](CCBr)C2)cc1I 2300242977 PUACTRMEZIQLDX-SNVBAGLBSA-N 428.539 4.552 50 10 IJGE C[C@]1(CCl)CCN(Cc2ccc(I)c(Br)c2)C1 2306220506 YGVDVNCIMIBDGH-CYBMUJFWSA-N 428.539 4.505 50 10 IJGE Clc1ccc(CN2[C@H]3CC[C@H]2[C@@H](CBr)C3)cc1I 2315553683 VUNRNOLKIMUXHB-SUNKGSAMSA-N 440.550 4.692 50 10 IJGE O=C(NN=Cc1ccc(Cl)cc1Cl)c1cccn(Cc2ccccc2Cl)c1=O 2318417660 BEFRYVXPDVMXSG-UHFFFAOYSA-N 434.710 4.621 50 10 IJGE C[C@@H](NC(=O)C(C#N)=CNCc1ccccc1Br)C12CC3CC(CC(C3)C1)C2 2318469574 VXKSNTFHYSBZDG-LRYXAPPNSA-N 442.401 4.667 50 10 IJGE ClCc1ccc(OCc2cc(I)ccc2Br)nc1 2318983667 ZFKRNXUAOHFMJG-UHFFFAOYSA-N 438.490 4.767 50 10 IJGE Cc1nc(-c2ccc(Cl)c(Cl)c2)ccc1C(=O)NNC(=O)C=Cc1ccccc1 2321176162 JRVYWYBXJIQBFU-UHFFFAOYSA-N 426.303 4.838 50 10 IJGE COc1ccc(Br)cc1C=NNC(=O)c1ccc2nc(SC(C)C)[nH]c2c1 2323606920 OQJCQLCJJNYPKY-UHFFFAOYSA-N 447.358 4.598 50 10 IJGE CCC[C@@H](CBr)CN1C[C@@H](NC(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 2331632880 JHXQNCDZAXHVAK-YTQUADARSA-N 425.411 4.790 50 10 IJGE CC(F)(F)c1ccc(C(=O)N[C@@H](CCBr)COCc2ccccc2)cc1 2343417731 ZEUADCKCRJRVRQ-SFHVURJKSA-N 426.301 4.899 50 10 IJGE O=C(COc1ccc(Br)cc1Cl)N/N=C/c1ccc(Cl)cc1Cl 13977875 UWAPXQBIOPHTAQ-IFRROFPPSA-N 436.520 4.938 50 10 IJGE COc1ccc(CC(=O)Oc2ccc(/C=C(/C#N)c3ccccc3OC)cc2OC)cc1 31901954 AELHSJBEKJIAKD-ZHZULCJRSA-N 429.472 4.925 50 10 IJGE Cc1c(C(=O)N(C)C)sc(NC(=O)/C(C#N)=C\c2cn(C(C)C)c3ccccc23)c1C#N 96438823 UTZAZUSAXLUEDB-YBEGLDIGSA-N 445.548 4.711 50 10 IJGE CC(=O)N(c1ccccc1)c1nc(/C=C(/C#N)c2nnc(-c3ccccc3)n2C)cs1 109087741 ZHDCZTJBTYGURA-AQTBWJFISA-N 426.505 4.687 50 10 IJGE CC(C)(C)OCCO[C@@H](CI)c1ccccc1Br 162578341 PMXGOGRQMCBTCQ-ZDUSSCGKSA-N 427.120 4.757 50 10 IJGE COc1ccc(CC(=O)NN=C(C)c2cccc(NC(=O)c3cccc(Cl)c3)c2)cc1 252628676 SVKUEWBWRKDLPQ-UHFFFAOYSA-N 435.911 4.684 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)ccc2n1C[C@H]1CN(Cc2ccccc2)CCO1 312356611 AJZDCFLWYAIMQX-CRAIPNDOSA-N 448.792 5.000 50 10 IJGE O=C(NC[C@@H](Br)C1CCC1)c1cc(Br)cc(Br)c1 315860784 OUOGXMCRMYMUES-GFCCVEGCSA-N 439.973 4.505 50 10 IJGE C[C@H]1[C@H](CBr)CCN1Cc1cc(Cl)ccc1I 405286374 FBKAUFLQIMUXFZ-UWVGGRQHSA-N 428.539 4.550 50 10 IJGE C[C@H](Br)C[C@@H](C)Nc1ncc(C(F)(F)F)cc1I 686108132 ASMQZUUOHRZFOD-NKWVEPMBSA-N 437.041 4.679 50 10 IJGE C[C@@H]1CCCN(c2ncc(Br)cc2Br)[C@@H]1CBr 688692182 GRNFRGCEBPAZGE-LDYMZIIASA-N 426.978 4.606 50 10 IJGE COc1ccc(OCC2(CBr)CCCC2)cc1I 712904966 MBKNOHPVMDZFBK-UHFFFAOYSA-N 425.104 4.634 50 10 IJGE Cn1cc(CC(CBr)(CBr)C2CCCC2)c(Br)n1 714081183 AAXMYUWQBGAGCR-UHFFFAOYSA-N 443.021 4.692 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)OCc2cccc(Br)c2)c(C)n1C[C@@H]1CCCO1 786381756 UPAHBBGERSTFET-MRCZTLKWSA-N 443.341 4.697 50 10 IJGE O=C(NNc1cccc(F)c1F)N[C@H](Cc1ccccn1)c1ccc(Br)cc1 788870276 NAOUKTZHNCSHJH-GOSISDBHSA-N 447.283 4.732 50 10 IJGE Cc1c(C(=O)N2CCCCC2)oc2c1C(=NNC(=O)c1ccc(Cl)cc1Cl)CCC2 1772747615 JZPNKKDFOQHVQA-UHFFFAOYSA-N 448.350 4.991 50 10 IJGE CC[C@H](NC(=O)Cc1nc(-c2ccccc2C)oc1C)C(=O)Nc1ccc(SC#N)cc1 1866647333 ZILRZKKAKACRCO-FQEVSTJZSA-N 448.548 4.608 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)C(=O)C12CC(C1)[C@H](C(F)(F)F)O2 1878394603 CFGZFDNHIVGGOK-BNQMIIOLSA-N 434.296 4.545 50 10 IJGE C[C@H]1CCN(Cc2cc(Br)ccc2Br)[C@H]1CBr 2006503727 RIPDXVPBYZYYKJ-ZANVPECISA-N 425.990 4.817 50 10 IJGE C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CN(CCCCCCCCCBr)CCO1 2106780704 AYCIJRGGWGPXON-ROUUACIJSA-N 435.447 4.726 50 10 IJGE CC[C@@]1(NC(=O)OC(C)(C)C)CCCN(C[C@@H](CBr)c2ccccc2)C1 2106788322 ORQSSHOTKRWOOJ-WIYYLYMNSA-N 425.411 4.934 50 10 IJGE O=C(NC1(CCl)CC2(CCC2)C1)c1csc(Br)c1Br 2107264475 XWTKNGBYUQAKLZ-UHFFFAOYSA-N 427.589 4.945 50 10 IJGE C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1N(C)C[C@@H](CBr)c1ccccc1 2107354786 BALSSNLDPIQULW-QRQLOZEOSA-N 425.411 4.742 50 10 IJGE CN(C(=O)c1cc(Br)c(Br)s1)C1(CCl)CCSCC1 2114718260 CPDJUCPXZQQHST-UHFFFAOYSA-N 447.645 4.850 50 10 IJGE Fc1ccccc1C(CBr)(CBr)CCS[C@@H]1CCOC1 2149122840 KZKWURDIZBJNIB-GFCCVEGCSA-N 426.189 4.766 50 10 IJGE Cn1nc(-n2c(CCl)nc3cc(Br)c(Cl)cc32)cc1Br 2159875524 VCGJHGLAMNOLDB-UHFFFAOYSA-N 438.938 4.676 50 10 IJGE Cc1nc(C2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)nc(O)c1CCCBr 2187360632 QNTRBGBSQIAJJR-YQQQUEKLSA-N 430.390 4.729 50 10 IJGE CCn1cc(Br)c([C@H](Br)c2cc(Cl)c(F)cc2OC)n1 2207380370 YLWAKGZUPYZVMY-GFCCVEGCSA-N 426.511 4.951 50 10 IJGE Cc1ccc(C(=O)Nc2cccc(CCBr)c2)cc1I 2232831272 RAVGAEZQJJRNRU-UHFFFAOYSA-N 444.110 4.789 50 10 IJGE CS(=O)(=O)C1CC([C@@H](Br)c2cc3sc(Br)cc3s2)C1 2278020270 IYFLPERGBBOVCS-LBVLNNNDSA-N 444.235 4.985 50 10 IJGE CC[C@H](Cl)[C@@H]1CCCCN1C(=O)c1ccc(Cl)c(I)c1 2283654853 FNGQYKCGRPRRAR-FZMZJTMJSA-N 426.125 4.957 50 10 IJGE CC(C=NNC(=O)CSc1nnc(-c2ccccc2)n1C)=Cc1ccc(C(C)C)cc1 2295968103 PYWLXCFKMPMBFS-UHFFFAOYSA-N 433.581 4.903 50 10 IJGE COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(OC(=O)C=Cc3ccc(C)cc3)ccc21 2314634289 XKTDVQKFUKOBGM-SANMLTNESA-N 438.483 4.841 50 10 IJGE COc1c(Br)cc(Br)cc1C=NNC(=O)Nc1ccccc1C 2323852730 XPAKRGZGEZQVBA-UHFFFAOYSA-N 441.123 4.684 50 10 IJGE C[C@]1(CBr)CCCN(Cc2cc(I)ccc2Cl)C1 2327403004 KXENQCLBVBFATN-CQSZACIVSA-N 442.566 4.942 50 10 IJGE Clc1ccc(I)cc1CN1CCC[C@H](CCBr)C1 2327409411 OCXABZRAJVQWCS-LLVKDONJSA-N 442.566 4.942 50 10 IJGE COc1cc(C(O)=C(C#N)c2nc(-c3ccc(F)cc3)cs2)c([N+](=O)[O-])cc1OC 2331344454 OCVXOGDSNRWBMR-UHFFFAOYSA-N 427.413 4.824 50 10 IJGE CN(Cc1c(Br)c(Br)nn1C)c1cccc(Cl)c1CCl 2364334325 VLOXUOKDICRHLV-UHFFFAOYSA-N 441.982 4.974 50 10 IJGE CCOC(=O)/C(C#N)=C\c1ccc(OC(=O)c2cccc(Br)c2)c(OCC)c1 957992 SFBABVBOIISFGV-YBEGLDIGSA-N 444.281 4.537 50 10 IJGE O=C(Nc1nnc(CCBr)s1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 36238453 PAFNPHLLUKGEPO-UHFFFAOYSA-N 448.186 4.765 50 10 IJGE CCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(OCc3ccccc3F)c(OCC)c2)C1=O 38603550 KQMUDGQVOYRQRW-DEDYPNTBSA-N 448.494 4.806 50 10 IJGE CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(OC(=O)c3ccccc3OC)ccc21 38650435 OLKREXAVEPDKBT-XMMPIXPASA-N 442.471 4.531 50 10 IJGE O=C(c1ccc(Br)c(C(F)(F)F)c1)N1CCC[C@@H](CBr)C1 124688208 HCKDWOKBIPFYPG-VIFPVBQESA-N 429.074 4.715 50 10 IJGE C[C@H]1CCC[C@@H](C)N1/C=C(/C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 216498731 IPDGRCWTWVYUKB-NVMHZUBXSA-N 442.607 4.591 50 10 IJGE FC(F)c1ccc(I)c(CBr)c1Br 575687606 UQXMOORTJBCZAN-UHFFFAOYSA-N 425.836 4.886 50 10 IJGE O=C(c1scc(Br)c1Br)N1CCC[C@H]1CCBr 705403106 WLQXGUPMCGSIEL-ZETCQYMHSA-N 446.002 4.663 50 10 IJGE COCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c1C 739595176 GDYSYRCGHOFSFS-LPYMAVHISA-N 444.560 4.575 50 10 IJGE Cc1ccnc(C2CCN(C(=O)/C(C#N)=C\c3cc(C)n(-c4ccccc4F)c3C)CC2)n1 754539600 PVVTXHNVHHZNDE-JCMHNJIXSA-N 443.526 4.645 50 10 IJGE Cc1onc(-c2ccc(Cl)c(Cl)c2)c1C(=O)NNC(=O)c1cccc2cccnc12 797846568 GQDCJJPELWOPFK-UHFFFAOYSA-N 441.274 4.580 50 10 IJGE C=CCC[C@@H](C(=O)NNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1)c1ccccc1 1182112220 VMQBDXISCXMRSW-HXUWFJFHSA-N 444.560 4.906 50 10 IJGE C=CC[C@@]1(C(=O)NNc2cc(C(F)(F)F)ccc2F)CCCN1C(=O)OC(C)(C)C 1556051341 MJLHQGVPMZVRJH-IBGZPJMESA-N 431.430 4.633 50 10 IJGE Cc1ccc(C(=O)NNc2nc3ccccc3[nH]c2=S)cc1NC(=O)c1ccccc1 1641877409 PKQZMPFJWFTUEQ-UHFFFAOYSA-N 429.505 4.610 50 10 IJGE COc1ccc(C(=O)NN=C2CCCc3oc(C(=O)Nc4ccccc4C)c(C)c32)cc1 1772745470 BCLQGASJXHYQSS-UHFFFAOYSA-N 431.492 4.628 50 10 IJGE CCc1nn(-c2cccc3ccccc23)c2c1[C@@H](c1cccc(OC)c1O)C(C#N)=C(N)O2 1865684043 LPDXZXRQYDYEHO-QFIPXVFZSA-N 438.487 4.520 50 10 IJGE N#CSc1ccc(NC(=O)[C@@H](NC(=O)c2snc3ccccc23)c2ccccc2)cc1 1867269368 YDMSWYFASUEVFL-FQEVSTJZSA-N 444.541 4.979 50 10 IJGE CCc1cc(Br)c(C[C@@H](CBr)NC(=O)OC(C)(C)C)s1 1882086099 YXLCNZUKXGXMLS-VIFPVBQESA-N 427.202 4.904 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)Cc1cc(Cl)ccc1Br 1882086207 ZQSSZTFZEAGLQF-NSHDSACASA-N 427.564 4.933 50 10 IJGE O=C1c2ccccc2C(=O)N1C[C@@H](Cl)CCc1cc(Br)ccc1Cl 1905407545 YZYYGUJHMLGZLJ-ZDUSSCGKSA-N 427.125 4.939 50 10 IJGE N#C[C@@H]1CN(c2cc(Br)ccc2CBr)CCN1Cc1ccccc1 1914890558 IKMZRSCVSFJRMR-GOSISDBHSA-N 449.190 4.558 50 10 IJGE CC(C)[C@H](CCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(Br)s1 1915264027 URPQWEMDDJJUON-AWEZNQCLSA-N 436.824 4.965 50 10 IJGE CC(C)(CBr)N(Cc1ccccc1)C(=O)c1cc(O)cc(Br)c1 1915773603 IFVAYWDHJYTCTP-UHFFFAOYSA-N 441.163 4.971 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1CC[C@]2(CCC[C@@H]2Cl)C1 1918907784 HNZHUDAXOAPHIM-GXFFZTMASA-N 427.589 4.897 50 10 IJGE C[C@@H](Cl)c1cn(-c2cc(Br)c(Br)c(Br)c2)nn1 1946435646 YWKQPTVDNYQGTN-RXMQYKEDSA-N 444.352 4.855 50 10 IJGE C[C@]1(CCl)CN(c2cc(Br)c(Br)c(Br)c2)C1=O 1946527084 BOQGLNMZHRDVDR-NSHDSACASA-N 446.364 4.566 50 10 IJGE BrCc1cc(Br)c(OCc2nncs2)c(Br)c1 2013620180 QWHHBSYXWQUJSO-UHFFFAOYSA-N 442.958 4.537 50 10 IJGE Cc1sc(Br)cc1C(=O)N[C@H](C)CCCCCI 2054162963 VOEDITXIOIEJOJ-SECBINFHSA-N 444.176 4.933 50 10 IJGE Brc1ccc(CN2C[C@H]3C[C@H](Br)C[C@H]3C2)c(Br)c1 2065402372 JUPFYHCLZBLYTB-PJXYFTJBSA-N 438.001 4.817 50 10 IJGE Cc1nc2c(cc1Br)nc(CCCl)n2[C@H]1CCN(Cc2ccccc2)C1 2096785649 ZBYZKWIPLIYGOW-INIZCTEOSA-N 433.781 4.731 50 10 IJGE Br[C@H](Cc1ccc2c(c1)CCO2)c1ccc(I)cc1 2112339202 QRNNXDJLOZUKFU-OAHLLOKOSA-N 429.095 4.905 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2[C@H]1[C@@H]2CN(Cc3ccccc3)C[C@@H]21 2128511376 ITMJGBQFVGOLJN-QWHZDKJVSA-N 431.765 4.544 50 10 IJGE Fc1cccc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)c1CBr 2130158598 BGJNJPYGVXPWCW-GOSISDBHSA-N 431.271 4.974 50 10 IJGE O=C(c1cc(Br)c(Br)s1)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](Cl)C2 2134124763 NSXXKTSYBRKJCV-RXHUMLQZSA-N 431.552 4.596 50 10 IJGE CN(Cc1ccccc1)[C@H]1CCN(S(=O)(=O)c2cc(Cl)cc(CCl)c2Cl)C1 2152158039 GTEQMMBLXNZCIW-KRWDZBQOSA-N 447.815 4.627 50 10 IJGE C[C@@H](Br)C[C@H]1CCCCCN1Cc1nn(C)c(Cl)c1Br 2152984851 IDHKJAFVJYDHJN-GHMZBOCLSA-N 427.612 4.754 50 10 IJGE C[C@H](C(=O)N(C)CC1CC(Br)C1)[C@H](NC(=O)OC(C)(C)C)c1ccccc1 2196906616 HLBLTTPJGGXVQV-OBHHBEAMSA-N 439.394 4.520 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(CCCCCCBr)CC[C@H]1C(F)(F)F 2223283274 QYCWJXVVZVSYED-KGLIPLIRSA-N 431.337 4.719 50 10 IJGE CCCC(CBr)(CCC)CN1CCN(CCCNC(=O)OC(C)(C)C)CC1 2234447163 IVHXDGAPSSKEAY-UHFFFAOYSA-N 448.490 4.500 50 10 IJGE C[C@H](c1cccs1)N(Cc1ccccc1)S(=O)(=O)CC1(CBr)CC1 2251569665 DXGQJTZFTMUYDS-OAHLLOKOSA-N 428.417 4.816 50 10 IJGE Cn1nc(CN2CCC(CCCCBr)CC2)c(Br)c1Cl 2283215570 YSOMXGXWJKBNFR-UHFFFAOYSA-N 427.612 4.613 50 10 IJGE CCOC(=O)C(C#N)=C1SC=C(c2ccccc2)C(C#N)=C(N)N1c1ccc(C)cc1 2297506206 BWTAZUUSWGIWGQ-UHFFFAOYSA-N 428.517 4.581 50 10 IJGE CCCN(CCCBr)Cc1ccc(Cl)c(I)c1 2300240971 SNUHJPHKZKNDDR-UHFFFAOYSA-N 430.555 4.942 50 10 IJGE CN[C@@H](c1c(C)cc(Br)c(F)c1Br)[C@@H]1C[C@H]1Br 2301487734 TZTXUORLCRDFMJ-NQYJQULFSA-N 429.953 4.703 50 10 IJGE CC1(CCl)CC(NCc2ccc(I)c(Br)c2)C1 2306217883 UTDFGHVEIOZIBK-UHFFFAOYSA-N 428.539 4.551 50 10 IJGE Clc1ccc(I)cc1CN[C@@H](CBr)C1CCCC1 2327397753 UXVSPUJENYZHLG-AWEZNQCLSA-N 442.566 4.988 50 10 IJGE N#CC(=C(O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1nc(-c2ccccc2)cs1 2331304841 JTANQTSNPCELNR-UHFFFAOYSA-N 434.477 4.505 50 10 IJGE CC(C)N(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C[C@@]1(CBr)CC1(F)F 2351887532 AIAMEXUODOVFAZ-QAPCUYQASA-N 439.385 4.907 50 10 IJGE FC(F)(F)c1cccc(CO[C@H](CCl)[C@@H](I)CCl)c1 2353210949 OLTPSQLTNRCYJW-WDEREUQCSA-N 427.031 4.872 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CN(C[C@@]2(CBr)CC2(F)F)c2ccccc21 2379986457 RMEVYPDIFDNBIC-LIRRHRJNSA-N 445.348 4.925 50 10 IJGE Cc1ccc(/C=N/NC(=O)c2cc(OCC(F)(F)F)ccc2OCC(F)(F)F)cc1 13142643 MMFWIHFLMLZMAQ-JQAMDZJQSA-N 434.336 4.641 50 10 IJGE Cc1ccc(OCC(=O)Oc2ccc3c(c2)OC(N)=C(C#N)[C@@H]3c2ccc(Cl)cc2)cc1 38651309 QBQSNFBOEPTTAQ-XMMPIXPASA-N 446.890 4.851 50 10 IJGE C[C@@H](Oc1ccc(F)cc1)C(=O)Oc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cccc(F)c1 38678125 VMTRYLSBLADRHY-FATZIPQQSA-N 448.425 4.556 50 10 IJGE Cc1ccc(Cl)cc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccncc1)CCC2 40813976 NBMMKTBIHNUMBU-WPWMEQJKSA-N 436.899 4.668 50 10 IJGE C[Si](C)(C)O[C@@H]1OC[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C 195803717 KEOUSSOURMHEKN-TWMKSMIVSA-N 438.862 4.855 50 10 IJGE CCc1ccc([C@@H](Br)c2cc(I)cc3c2OCC3)o1 381822185 OANDVOBWKFCWDF-AWEZNQCLSA-N 433.083 4.866 50 10 IJGE CC(C)(C)OC(=O)N1C[C@@H](CI)[C@H](c2ccc(CCl)cc2)C1 382696246 BBLABJHBLXIWAV-CABCVRRESA-N 435.733 4.811 50 10 IJGE Cc1cc(S(=O)(=O)N2CCCC[C@H]2C[C@H](C)Br)sc1Br 383529304 ALMMOQVHDSYTKG-QWRGUYRKSA-N 445.242 4.536 50 10 IJGE COC(C)(C)CO[C@](C)(CI)c1ccccc1Br 386305016 IHNYMAWXWVYLOK-CQSZACIVSA-N 427.120 4.541 50 10 IJGE C[C@H](Br)CN(C(=O)c1cc(Br)c(Br)s1)C1CC1 691354567 AZTRKTZMCFFXDR-LURJTMIESA-N 446.002 4.661 50 10 IJGE BrCc1cc(Br)c(OCCOC2CC2)c(Br)c1 711719558 OGQPSDVOSDJXLL-UHFFFAOYSA-N 428.946 4.664 50 10 IJGE Cc1ccc(NNC(=O)C(=O)Nc2cc(Cl)ccc2Oc2ccc(Cl)cc2)nc1 783488921 UJSIUTBHCXDENJ-UHFFFAOYSA-N 431.279 4.571 50 10 IJGE C#C[C@H](NC(=O)/C(C#N)=C\c1cc(C)n(-c2cccc(Cl)c2Cl)c1C)[C@H]1CCCO1 1459223765 JFDCTZXBHAXILF-BMJXIYGQSA-N 442.346 4.605 50 10 IJGE C#CC[C@H](NC(=O)NNc1cc(C(F)(F)F)ccc1Br)c1ccccc1 1469448792 WDSNXLKVPURFGL-HNNXBMFYSA-N 426.236 4.859 50 10 IJGE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NNC(=O)Cc1nc(-c2ccccc2)cs1 1608521060 YLVRCMLUCAZDFI-RAXLEYEMSA-N 446.359 4.910 50 10 IJGE C=C(C)[C@@H](CC(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12)OCC 1625006978 YLBRCGVKMJWGFY-JOCHJYFZSA-N 437.927 4.688 50 10 IJGE CCOc1cc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc3ccccc23)ccc1O 1865681430 NDYBGFKLGWMPOV-DEOSSOPVSA-N 438.487 4.656 50 10 IJGE N#CC1=C(N)Oc2c(c(-c3ccccc3)nn2Cc2ccc(F)cc2)[C@@H]1c1ccccc1O 1865708406 WERPYNKQPFZUBT-JOCHJYFZSA-N 438.462 4.661 50 10 IJGE O=S(=O)(c1ccccc1N(CCCBr)Cc1ccccc1)C(F)(F)F 1914652226 BMSKTEZRXHJKAP-UHFFFAOYSA-N 436.293 4.772 50 10 IJGE C[C@@H](CCCl)N(Cc1ccccc1)S(=O)(=O)c1ccc(Br)cc1F 1915069743 NWXMNXDUZVAYLZ-ZDUSSCGKSA-N 434.758 4.797 50 10 IJGE O=S(=O)(c1cccc2cnccc12)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915172484 NLHFKQQHRBWCBA-HXUWFJFHSA-N 445.382 4.599 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@]2(CCCC[C@@]23CC[C@](C)(CI)O3)C1 1950282313 ZOIIRDQSXDTGBV-GUDVDZBRSA-N 449.373 4.931 50 10 IJGE Cc1ccc(Br)c(C(=O)N(Cc2ccccc2)[C@@H](C)CBr)n1 1961081927 FMPILIIEZNJACI-ZDUSSCGKSA-N 426.152 4.578 50 10 IJGE CC(C)(C)OC(=O)N1C[C@](C)([C@@H]2CCC[C@@H](CI)O2)CC1(C)C 1992813518 JVYVRSCWHQEKFG-SUNYJGFJSA-N 437.362 4.785 50 10 IJGE CCOc1c(Br)cc(Br)cc1C[C@@H](CBr)OC 2008748317 JDTAVHFUDHDYKV-JTQLQIEISA-N 430.962 4.563 50 10 IJGE O=C(N[C@@H](CCBr)C1CC1)c1cc(Br)ccc1Br 2029973820 TWFOPBVEYWVKIN-LBPRGKRZSA-N 439.973 4.505 50 10 IJGE CC(C)(C)N(Cc1ccccc1)S(=O)(=O)c1ccc(F)c(CBr)c1F 2059312930 RBUXVTGOMWUABE-UHFFFAOYSA-N 432.330 4.849 50 10 IJGE BrCc1cc(Br)c(OC[C@]23C[C@H](CO2)C3)c(Br)c1 2073833506 SEVQKSLVYUIQTN-SWZMTVOYSA-N 440.957 4.664 50 10 IJGE Cc1ccc(F)cc1Cn1nc(CCl)c(I)c1C(F)(F)F 2079211893 DMDRREBHVMYJFL-UHFFFAOYSA-N 432.586 4.741 50 10 IJGE Clc1cc(CN2C[C@H]3CC[C@@]2(CBr)C3)ccc1I 2086663015 YZAMRAXCNRNHNX-FZMZJTMJSA-N 440.550 4.694 50 10 IJGE C[C@@H]1CN(C[C@H](Br)C(F)(F)F)c2ccccc2CN1C(=O)OC(C)(C)C 2106783748 CJTXTEIOSQWQDK-DOMZBBRYSA-N 437.300 4.958 50 10 IJGE Cc1cc(Br)c([C@H](Cl)C2(S(C)(=O)=O)CCC2)cc1Br 2110396277 DTLYJWUKVJUXKJ-LBPRGKRZSA-N 430.589 4.767 50 10 IJGE COc1ccc(Br)cc1[C@H](Cl)c1nn(C)c(Cl)c1Br 2110720029 AIEFIRRTMXYTEY-JTQLQIEISA-N 428.939 4.935 50 10 IJGE Cc1cccc(C(=O)N[C@@H](C)CCCCCBr)c1I 2117894985 OMYVXVOLVUFNRT-LBPRGKRZSA-N 438.147 4.673 50 10 IJGE CC(C)(C)OC(=O)NC[C@@H]1CN(C[C@@H](CBr)c2ccccc2)C(C)(C)C1 2132466689 HGZHMSOODNQJJC-SJLPKXTDSA-N 425.411 4.790 50 10 IJGE Br[C@@H](c1cc(I)cc2c1OCC2)[C@H]1C2C[C@@H]3C1[C@@H]3C2 2134569786 JNXUHLJRJVSLGQ-GDDBJHNDSA-N 431.111 4.564 50 10 IJGE COc1cc(Cl)c([C@H](Cl)c2c(Br)cnn2C)cc1Br 2137638867 AXTNDUZNDJKFDR-NSHDSACASA-N 428.939 4.935 50 10 IJGE ClCCc1nc2cnccc2n1Cc1scc(Br)c1Br 2150581485 GJZKCLMIATUBGU-UHFFFAOYSA-N 435.572 4.847 50 10 IJGE C[C@@H](Br)C[C@H]1COCCN1Cc1ccc(Cl)c(Br)c1F 2185314782 TUYVEZRMYBANTE-KOLCDFICSA-N 429.555 4.616 50 10 IJGE O=C(NC[C@]1(CBr)C[C@H]1C(F)(F)F)c1ccccc1OCc1ccccc1 2192585219 ZJBONZFOVPSMRZ-IEBWSBKVSA-N 442.275 4.959 50 10 IJGE Fc1cc(Br)c2nc(CCl)n(C[C@@]3(Br)CC3(F)F)c2c1 2202505843 OCWJHHVAALPTAT-NSHDSACASA-N 432.465 4.849 50 10 IJGE CC(C)(C)OC(=O)N1CC2(CCCC[C@]23CCC[C@H](CI)O3)C1 2211826888 YFEPRTXENRVHPL-KDOFPFPSSA-N 435.346 4.540 50 10 IJGE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)[C@@H]2[C@H](CBr)NC(=O)OC(C)(C)C 2241742117 VSTCTWNVWWBEOZ-CQJMVSDSSA-N 447.414 4.604 50 10 IJGE CC[C@@H]1[C@@H](Br)CCN1C(=O)c1cc(Br)sc1Br 2251033369 JPXJMNJPVGQESU-JGVFFNPUSA-N 446.002 4.661 50 10 IJGE O=C(NCCCCCCBr)c1ccc(Cl)c(I)c1 2256393740 XKHDLLXZPIIIDU-UHFFFAOYSA-N 444.538 4.630 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@@H](Br)C12CCC2 2282986599 SKBOZFMMLGJJNH-GFCCVEGCSA-N 425.523 4.774 50 10 IJGE CN[C@@H](c1c(Br)cc(C)c(Br)c1C)[C@@H]1C[C@H]1Br 2298079267 ZGQHTYQVBPUNJZ-JRKPZEMJSA-N 425.990 4.872 50 10 IJGE Clc1ccc(CN2CCC[C@H](Br)CC2)cc1I 2300238021 FYDURRXCRJUUOT-NSHDSACASA-N 428.539 4.694 50 10 IJGE CCCCOc1ccc(C=C2C(=O)N(Cc3ccco3)C(=O)C(C#N)=C2C)cc1OCC 2314618038 GEBDLGTWQBGASS-UHFFFAOYSA-N 434.492 4.650 50 10 IJGE CC(C)N(C[C@H]1CCCN1C(=O)OC(C)(C)C)C[C@]1(CBr)CC1(F)F 2326915119 OHOSGQNKJDIBFH-RHSMWYFYSA-N 425.358 4.517 50 10 IJGE C[C@H]1C[C@@H](Br)CCN(Cc2cc(I)ccc2Cl)C1 2327387874 CHTGAUXOAJKMFJ-JQWIXIFHSA-N 442.566 4.940 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C[C@]2(CBr)CC2(F)F)C2(CCCCC2)C1 2351884995 COGFIJNJCURWRC-RHSMWYFYSA-N 437.369 4.709 50 10 IJGE COc1ccc([C@@H](C(=O)NC2CCCC2)N(CCC2=CCCCC2)C(=O)CCl)cc1 4672984 HXBYNHOJECDEES-QHCPKHFHSA-N 432.992 4.753 50 10 IJGE COc1cc(CCl)cc(Br)c1OCc1c(Br)c(C)nn1C 91324721 ISIAGCUJLQLUCL-UHFFFAOYSA-N 438.547 4.580 50 10 IJGE COc1cccc(CN(C(=O)CCl)[C@H](C(=O)NC2CCCCC2)c2ccc(C)cc2)c1 97914439 HQTMDGLBQSTSAK-DEOSSOPVSA-N 442.987 4.761 50 10 IJGE Cc1ccc(C23C[C@H]4C[C@@H](CC(NC(=O)N/N=C/c5ccccc5[N+](=O)[O-])(C4)C2)C3)cc1 100489913 LXEOBDLYKJAOCI-XCADOBRSSA-N 432.524 4.827 50 10 IJGE CCOc1c(Br)cc(/C=N\NC(=O)Nc2cccc(Cl)c2)cc1OC 169943177 OVHFFNSGXZIAAX-JMIUGGIZSA-N 426.698 4.665 50 10 IJGE CCCCN1C(=O)/C(=C/Nc2cc(Cl)ccc2Cl)C(=O)N(CCCCl)C1=O 214396494 MMWZKSNQBSTLTG-QBFSEMIESA-N 432.735 4.509 50 10 IJGE CC1CCC(CCl)(NC(=O)c2cc(Cl)ccc2I)CC1 232829352 JXRHSYWUZMVNNS-UHFFFAOYSA-N 426.125 4.862 50 10 IJGE Cc1cccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)c2cccc([N+](=O)[O-])c2)c1 254704503 AXYFRUIWNTZSKA-UHFFFAOYSA-N 425.448 4.520 50 10 IJGE C[C@@H](Br)C[C@@H]1CCCCCN1S(=O)(=O)c1sccc1Br 312932753 FVYRHELYXXKIBG-MNOVXSKESA-N 445.242 4.617 50 10 IJGE CN(C[C@@H](Br)C1CC1)C(=O)c1scc(Br)c1Br 690327477 LJGNUHKFHYKSJR-SSDOTTSWSA-N 446.002 4.519 50 10 IJGE COc1ccc(Nc2ccccc2C(=O)NNc2nc(-c3ccccn3)nc(C)c2C)cc1 734256036 FQCJYGBKPADKGS-UHFFFAOYSA-N 440.507 4.665 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2cc(Cl)ccc2OC2CCCC2)c1C 749538333 NQPGNIKNKRLZJV-UHFFFAOYSA-N 437.931 4.887 50 10 IJGE O=C(NNC(=O)c1cccc2cccnc12)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 755360405 QJCBBEISHFWMCS-UHFFFAOYSA-N 442.319 4.739 50 10 IJGE Cc1cc(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)ccc1NC(=O)c1cccs1 758075542 IZFUIHJRNJZDMD-UHFFFAOYSA-N 435.549 4.681 50 10 IJGE Cc1cc(C=NNC(=O)C(=O)Nc2cccc3ccccc23)c(C)n1-c1ccc(Cl)cc1 1084125193 GVFDXIQNAZDZGF-UHFFFAOYSA-N 444.922 4.990 50 10 IJGE CCc1nn(-c2ccc(Br)cc2)c2c1[C@H](c1ccccc1F)C(C#N)=C(N)O2 1865684108 TVWQYVJUZLNUHC-GOSISDBHSA-N 439.288 4.554 50 10 IJGE CCO[C@@H](C)C(CBr)(CBr)c1cccc(Br)c1 1941151412 WJSHASMQRCRTAN-JTQLQIEISA-N 428.990 4.902 50 10 IJGE C[C@@]1(CBr)CCCN1Cc1cc(Br)ccc1Br 2006502339 ZUYVNVVFIUFHRE-ZDUSSCGKSA-N 425.990 4.961 50 10 IJGE CC(C)N(CCOCCBr)C(=O)c1cscc1OCc1ccccc1 2038687861 GMWBKKWBSPUZOT-UHFFFAOYSA-N 426.376 4.589 50 10 IJGE Fc1cc2nc(CCl)n([C@@]34C[C@@H]3CN(Cc3ccccc3)C4)c2cc1Br 2099678577 JQDNOAUTVVMUGW-JLTOFOAXSA-N 434.740 4.908 50 10 IJGE Cc1c(Br)cnc2c1nc(CCl)n2C[C@H]1CCCN1Cc1ccccc1 2128499590 YURVQBWVAXZSHD-MRXNPFEDSA-N 433.781 4.906 50 10 IJGE COCc1cc(Br)c([C@H](Cl)c2c(Br)nn(C)c2C)s1 2131596947 JERFBCRDBPEJAH-SNVBAGLBSA-N 428.577 4.790 50 10 IJGE O=C1NCCc2ccc([C@H](Cl)c3csc(Br)c3Br)cc21 2150341824 LIMGFKKRVLRRQW-LBPRGKRZSA-N 435.568 4.887 50 10 IJGE CCN(CC)S(=O)(=O)C[C@H](Br)c1cc(Cl)c(C)c(Br)c1 2167378210 VARCYCSYMKTEDE-LBPRGKRZSA-N 447.620 4.519 50 10 IJGE CN(Cc1ccccc1)[C@H]1CCCCN(c2ccc(CBr)cc2[N+](=O)[O-])C1 2169164946 HDOFTXAZGPPWIK-IBGZPJMESA-N 432.362 4.981 50 10 IJGE ClCCCOC1CCN(Cc2c(Br)cccc2Br)CC1 2207533896 ZXEZZJFKZBCGQP-UHFFFAOYSA-N 425.592 4.822 50 10 IJGE CN[C@H](Cc1cc(Br)cc(Br)c1)C1CC(Br)C1 2252836550 DCDMCNLYSAIZQB-UTVJUBTNSA-N 425.990 4.516 50 10 IJGE Brc1cc(Br)cc(C[C@H](Br)[C@@H]2CCCOC2)c1 2252836777 GUDHOBWPYWAJSX-MFKMUULPSA-N 426.974 4.944 50 10 IJGE O=S1(=O)CC[C@@H]([C@@H](Cl)c2ccc(OCc3ccccc3)cc2Br)C1 2299501338 NIIVFQWCZAKTSR-RDTXWAMCSA-N 429.763 4.743 50 10 IJGE CCO[C@@H]1[C@@H](Br)C[C@@H]1Oc1cc(Cl)c(C)cc1I 2314953543 LQWIOVMCDQCOEB-AQUOVQTQSA-N 445.522 4.573 50 10 IJGE O=C(N[C@@H](CCBr)COCc1ccccc1)c1cc(F)c(F)cc1Cl 2320359215 ZGZHPKUFKFMVAW-ZDUSSCGKSA-N 432.692 4.718 50 10 IJGE CCCOc1c(OC)cc(C=NNC(=O)c2ccc3[nH]c4c(c3c2)C[C@H](C)CC4)cc1OC 2323163310 IQQCVCKKYCQHMW-MRXNPFEDSA-N 449.551 4.863 50 10 IJGE C[C@@H](NC(=O)C(C#N)=CNc1ccc(Cl)c([N+](=O)[O-])c1)C12CC3CC(CC(C3)C1)C2 2324900485 YZPZRCQQAHTFCI-ZHHULCEESA-N 428.920 4.789 50 10 IJGE Clc1cc(Br)c(CN2C[C@H]3OCCC[C@@]3(CBr)C2)s1 2345960211 USKRLWDGOMNSMC-DGCLKSJQSA-N 429.605 4.540 50 10 IJGE CC(C)(C)OC(=O)N1CCCC[C@@H]1CN(C[C@]1(CBr)CC1(F)F)C1CC1 2351887623 BBRKVRRRRXPJSM-CRAIPNDOSA-N 437.369 4.661 50 10 IJGE ClCCCN(Cc1cc(I)ccc1Cl)C1CCOCC1 2381150550 DEGBCFWQZMCMDM-UHFFFAOYSA-N 428.141 4.555 50 10 IJGE O=C(N/N=C/c1ccc(Br)cc1)c1cccc(NC(=O)c2ccc(F)cc2)c1 27520064 OCIJNRTWCOJDNP-ZMOGYAJESA-N 440.272 4.604 50 10 IJGE Cc1cccn2c(=O)c(/C=C(/C#N)c3nc4ccccc4[nH]3)c(Oc3ccc(F)cc3)nc12 33584002 MZBLAEDIIKYKAO-SSZFMOIBSA-N 437.434 4.875 50 10 IJGE CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4ccccc4)ccc32)cc1OC 38659427 SOUQDRUVRZTDML-DEOSSOPVSA-N 442.471 4.531 50 10 IJGE C/C(=N\NC(=O)c1ccc(OCc2ccc(Br)cc2)cc1)c1ccccc1O 59384092 KYDMLRUQIJPNJN-BUVRLJJBSA-N 439.309 4.888 50 10 IJGE COc1cc(/C=N/NC(=O)Cc2ccc(F)cc2)ccc1OCc1ccccc1Cl 59447305 PLHSWSHDTIOGAK-VULFUBBASA-N 426.875 4.760 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)/C(C#N)=C\Nc1ccc(Cl)c([N+](=O)[O-])c1 217183999 LEMHRMGQYRLQDS-UZFBZYOGSA-N 428.876 4.652 50 10 IJGE C[C@H](Br)CCN(C)C(=O)c1cc(Br)c(Br)s1 219988532 WXQRVYFAFKBSMB-LURJTMIESA-N 433.991 4.519 50 10 IJGE Oc1cc(Cl)ccc1[C@H]1CN(Cc2ccccc2)C[C@@H]1CI 382677833 ZYZQZCJQPCHLQR-YOEHRIQHSA-N 427.713 4.696 50 10 IJGE C[C@@H]1CC[C@@H](CBr)CN1c1ncc(Br)cc1Br 688663828 IIZNUDUMGKPSLK-BDAKNGLRSA-N 426.978 4.606 50 10 IJGE O=C(N[C@@H]1CCC[C@H](Br)C1)c1ccc(Br)cc1Br 694502453 AHBGBVXIXMSYCG-WCBMZHEXSA-N 439.973 4.648 50 10 IJGE O=C(c1ccc(CBr)cc1)N1CC[C@H]2[C@@H](CCCN2Cc2ccccc2)C1 714994282 IUIMBSXRFBHHQZ-VXKWHMMOSA-N 427.386 4.708 50 10 IJGE Cc1cccc(-n2c(C)cc(C(=O)NNc3nc(-c4cccnc4)nc(C)c3C)c2C)c1 736694853 HQFYBMSVYPRZFC-UHFFFAOYSA-N 426.524 4.628 50 10 IJGE Cc1ccccc1-c1nc(C)c(C(=O)NNc2nc(-c3cccnc3)nc(C)c2C)s1 776152398 DTKNKJNZAJFNLK-UHFFFAOYSA-N 430.537 4.653 50 10 IJGE C=CCc1cccc(C=NNC(=O)c2ccc(NC(=O)c3cccc(Cl)c3)cc2)c1O 1082753761 HOYTXAISUPFGQP-UHFFFAOYSA-N 433.895 4.790 50 10 IJGE Cc1cc(/C=C(/C#N)C(=O)Nc2cccc3nc(O)[nH]c23)c(C)n1-c1cccc(Cl)c1 1298765656 WJDFKBLPVZXQDG-YBEGLDIGSA-N 431.883 4.875 50 10 IJGE Cc1ccc(C)c(Cn2nc(C(F)(F)F)c3c2OC(N)=C(C#N)[C@H]3c2cccs2)c1 1865698018 IEYMWCIAVRGLBG-INIZCTEOSA-N 430.455 4.847 50 10 IJGE Cc1nc(-c2ccc(F)c(F)c2)ccc1C(=O)NNC(=O)CCCSc1ccccc1 1865756897 CFVRVIMUAMTKRS-UHFFFAOYSA-N 441.503 4.669 50 10 IJGE CCCC[C@@H](NC(=O)C[C@@H]1CC(=O)c2ccccc21)C(=O)Nc1ccc(SC#N)cc1 1867243859 VNPBHMIDBMAGAN-HRAATJIYSA-N 435.549 4.634 50 10 IJGE C[C@H]1[C@H](C)[C@H]([C@@H](CBr)NC(=O)OC(C)(C)C)CCN1C(=O)OC(C)(C)C 1892778169 WTQUVVRYYPFNGN-BYNSBNAKSA-N 435.403 4.556 50 10 IJGE CC1(C)CN(C(=O)c2csc(Br)c2Br)C[C@@H]1Br 1945188909 DTBDNYHWDDVTMV-ZETCQYMHSA-N 446.002 4.519 50 10 IJGE CC1(C)C[C@H](Br)CN1Cc1c(Br)cccc1Br 1949218323 IJHJEWKJLYDAFW-VIFPVBQESA-N 425.990 4.959 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@]2(CC[C@]23CC[C@](C)(CI)O3)C1 1986985112 KTCGHSXRWHZOSI-FGTMMUONSA-N 435.346 4.540 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@](CI)(OC[C@@H]2C[C@H]3CC[C@H]2C3)C1 1997929609 MGJUTUZILHAWSG-IUVQAAGXSA-N 449.373 4.644 50 10 IJGE Fc1cc(F)c([C@@H](Br)c2cc(I)sn2)cc1F 2007644641 MRCBRRDWNBNBOG-SNVBAGLBSA-N 434.018 4.649 50 10 IJGE C[C@@H]1C[C@H](CBr)CN1Cc1ccc(I)c(Cl)c1 2026565475 BNODJRLATPDSNQ-MWLCHTKSSA-N 428.539 4.550 50 10 IJGE CCN(CCCCCl)C(=O)c1cc(I)ccc1Br 2041180453 GEPOWRJGQIWDNI-UHFFFAOYSA-N 444.538 4.535 50 10 IJGE Clc1ccc(I)c(CN2C[C@H]3CC[C@]3(CBr)C2)c1 2078145548 FFFBFEMNMWCIDR-RISCZKNCSA-N 440.550 4.552 50 10 IJGE CN(Cc1ccc(I)c(Cl)c1)C[C@H]1CCC[C@@H]1Br 2086653425 XYHYYJITNYKGFR-NEPJUHHUSA-N 442.566 4.940 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1 2106784112 GDNQZRZEIAZLPC-RTBURBONSA-N 425.411 4.887 50 10 IJGE O=C(c1cc(Cl)ccc1Br)N1CC[C@@H](CBr)C(F)(F)C1 2146375067 IKPCMDAEFXUKLO-QMMMGPOBSA-N 431.502 4.595 50 10 IJGE C[C@H]1CN(C(=O)OC(C)(C)C)c2ccccc2N1CC1(CBr)CCOCC1 2163059505 UGRSBAPMMFDBFA-INIZCTEOSA-N 439.394 4.828 50 10 IJGE O=C(c1cc(Br)sc1Br)N1C[C@@]2(F)CCC[C@@]2(CCl)C1 2176640088 LBEZDBUJBGJLNW-OLZOCXBDSA-N 445.579 4.846 50 10 IJGE C[C@H](Cl)c1nc2cncnc2n1CC1(N(Cc2ccccc2)Cc2ccccc2)COC1 2219824079 KBASRWIPNHEXMQ-IBGZPJMESA-N 447.970 4.598 50 10 IJGE Cc1sc(C(=O)NCC2(F)CCC(CBr)CC2)cc1Br 2234475060 MQMBVFOLERDCNL-UHFFFAOYSA-N 427.177 4.842 50 10 IJGE Cc1nscc1C[C@H](Br)c1cccc(F)c1I 2246946616 PVTJXMILBJQGHH-JTQLQIEISA-N 426.092 4.874 50 10 IJGE COc1ccc([C@H](Br)C2(OC)CC(C)C2)cc1I 2257355753 PZWFNPWFAQRQRW-IMXVTNBVSA-N 425.104 4.551 50 10 IJGE C[C@@H](Br)CN(CC(C)(C)C)C(=O)c1sccc1I 2259778932 OJBSQABRYNORSP-SECBINFHSA-N 444.176 4.624 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Cl)c1cn(C)nc1Br 2277883061 JCSQUFSTUGIIJL-JTQLQIEISA-N 428.939 4.935 50 10 IJGE O=C(c1cc(Br)c(F)cc1Cl)N1CC[C@H](CBr)C12CC2 2285836019 WCQLZKWYQXBDPT-MRVPVSSYSA-N 425.523 4.631 50 10 IJGE CC1CC(CBr)(CNC(=O)c2cc(Br)c(F)cc2Cl)C1 2285962818 IIGOSYZSMLWCFN-UHFFFAOYSA-N 427.539 4.783 50 10 IJGE C[C@H]1CCN(Cc2ccc(Cl)cc2I)[C@H]1CBr 2302314876 BWSPETBNJMONGD-ZANVPECISA-N 428.539 4.550 50 10 IJGE CCCCNC(=O)C(C#N)=Cc1ccc(OC(=O)CCCOc2ccc(Cl)cc2)cc1 2314785577 BCXYCKRGZGZNNV-UHFFFAOYSA-N 440.927 4.928 50 10 IJGE Clc1ccc(CN2C[C@H]3C[C@@H](Br)C[C@H]2C3)c(I)c1 2318529341 OUWFEPFXLPYSPQ-UFGOTCBOSA-N 440.550 4.692 50 10 IJGE ClC[C@H]1CCC[C@H]1CNCc1ccc(I)c(Br)c1 2325211807 LWDDGTDZDGXXTE-NEPJUHHUSA-N 442.566 4.798 50 10 IJGE N#CC(=Cc1ccc(OC(=O)c2ccccc2)cc1)c1cc2c(cc1[N+](=O)[O-])OCCO2 2331051227 KNVWUEVVQBYHQY-UHFFFAOYSA-N 428.400 4.649 50 10 IJGE COc1ccccc1-c1csc(C(C#N)=C(O)[C@H]2CC(=O)N(Cc3ccccc3)C2)n1 2331281974 OBEFMMCBGRRWSA-KRWDZBQOSA-N 431.517 4.660 50 10 IJGE COc1ccc(COc2ccc(/C=N/NC(=O)CNc3cccc4ccccc34)o2)cc1 20248800 DBAKCAUTCWGHOC-JFLMPSFJSA-N 429.476 4.583 50 10 IJGE CN(C)c1ccc(N2C(=O)CS[C@@H]2c2ccc(NC(=O)C(C)(C)CCl)cc2)cc1 35928424 ILIHQWOEWAHIPS-HXUWFJFHSA-N 431.989 4.735 50 10 IJGE C=CCOc1cccc([C@H]2C(C#N)=C(N)Oc3cc(OC(=O)c4cccc(C)c4)ccc32)c1 40529775 SMBLEJKHRXGRHB-RUZDIDTESA-N 438.483 4.997 50 10 IJGE Cc1c(C(=O)N2c3ccccc3C[C@@H]2C)oc2c1/C(=N/NC(=O)c1ccccc1)CCC2 40804074 SISXCHIPNOWZOK-DFIGIENVSA-N 427.504 4.650 50 10 IJGE COc1ccc(NC(=O)c2oc3c(c2C)/C(=N/NC(=O)c2cccc(C)c2)CCC3)cc1 40811393 TVOWHEUXCVYFQL-NHFJDJAPSA-N 431.492 4.628 50 10 IJGE CCOc1ccc(/C=C(/C#N)C(=O)Nc2nc(-c3cccc(OC)c3)cs2)cc1OC 206698873 LDUOBKVECWONMT-YVLHZVERSA-N 435.505 4.772 50 10 IJGE CCCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)/C=C\c2ccc(OCC)c(OC)c2)cc1 207108667 HOLAPKBRACNSKU-JPOGNWIISA-N 448.519 4.536 50 10 IJGE COc1ccc([C@@H](Br)c2sccc2I)c(F)c1 383340019 XIHYQCSMINJFRL-LLVKDONJSA-N 427.076 4.985 50 10 IJGE C[C@@H]1CC[C@H](Br)CN1C(=O)c1cc(Br)sc1Br 399489606 SPPCRFYVZLEPNV-RQJHMYQMSA-N 446.002 4.661 50 10 IJGE Brc1ccccc1[C@H](CI)OCCOC1CCC1 400736532 CWCZLSQLBYODEP-AWEZNQCLSA-N 425.104 4.511 50 10 IJGE CC(C)(C)[Si](C)(C)OCCc1cccc([C@@H]2Cc3ccccc3N(S(N)(=O)=O)C2)c1 616591565 AUABWFUSXZLDNU-OAQYLSRUSA-N 446.689 4.601 50 10 IJGE O=C(NC1(CCBr)CCSCC1)c1cccc(Br)c1Cl 719666308 RGAAONDVYJASGM-UHFFFAOYSA-N 441.616 4.883 50 10 IJGE CCOc1ccc(/C=C(\C#N)C(=O)N2CCC([C@@H]3C(=O)Nc4cc(Cl)ccc43)CC2)cc1 727413373 NCXOTTRJUGFDAI-HKRNCWMRSA-N 449.938 4.620 50 10 IJGE COc1ccc(-c2cc(C(=O)NNc3cccc(F)c3F)c3ccccc3n2)cc1OC 743725642 KMNLVKLNOJGHPO-UHFFFAOYSA-N 435.430 4.954 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2ccccc2COCc2ccccc2)c1C 1160812535 HHNQQIIYRHQCNK-UHFFFAOYSA-N 439.519 4.629 50 10 IJGE CC[C@@H](NC(=O)[C@H](Cc1ccccn1)c1ccccc1)C(=O)Nc1ccc(SC#N)cc1 1866697764 VYNLMZODTGSWIN-DHIUTWEWSA-N 444.560 4.515 50 10 IJGE COc1ccc(-c2csc(/C(C#N)=C(\O)[C@H](C)N3C(=O)c4ccccc4C3=O)n2)cc1C 1872744722 FUJSQJAIUGODSE-DLFJBECYSA-N 445.500 4.605 50 10 IJGE Cn1nc(C(=O)N(Cc2ccccc2)[C@@H](CBr)C2CC2)c(Cl)c1Cl 1915264054 QAKBPDRSAOHXOQ-ZDUSSCGKSA-N 431.161 4.543 50 10 IJGE C[C@H](Cl)CN(Cc1ccccc1)C(=O)c1cc(I)ccc1F 1961212448 CIYIAICGOOLZNT-LBPRGKRZSA-N 431.676 4.700 50 10 IJGE CC1(C)C[C@H](CBr)CN1c1ncc(Br)cc1Br 2012360841 BXKUOIZFUAXJCR-MRVPVSSYSA-N 426.978 4.606 50 10 IJGE C[C@](CI)(OCP(C)(C)=O)c1ccccc1Br 2025379944 LKULBXCHBRDBHW-GFCCVEGCSA-N 431.048 4.696 50 10 IJGE CC(C)[C@H](Br)CCNC(=O)c1cc(Br)ccc1Br 2029915902 CQVRNDOXXKSCSY-LLVKDONJSA-N 441.989 4.751 50 10 IJGE CCN(C[C@H](Br)C(F)(F)F)[C@@H]1CCCC[C@H]1CNC(=O)OC(C)(C)C 2044700639 RREBRLDFUGNXET-MJBXVCDLSA-N 431.337 4.718 50 10 IJGE CC(C)Cc1cc(CBr)n(Cc2cccc(I)c2)n1 2070049331 XQELQCPZDONUFG-UHFFFAOYSA-N 433.131 4.629 50 10 IJGE CN(C[C@@H](CBr)c1ccccc1)[C@H](CNC(=O)OC(C)(C)C)C(F)(F)F 2106783742 CJSGYLXJABUTCP-HUUCEWRRSA-N 439.316 4.553 50 10 IJGE C[C@H](c1cc(Br)cs1)N(C)c1ncc(Br)c(CCl)n1 2130032842 RLQNLBOOJDQAMY-SSDOTTSWSA-N 425.577 4.999 50 10 IJGE Brc1ccccc1[C@@H](CI)OC[C@H]1[C@H]2C[C@@H]3[C@H]1[C@@H]3C2 2134543353 ZOZPKGYYFDPBLG-QLRGAXTRSA-N 433.127 4.844 50 10 IJGE COc1cc2c(cc1Br)nc(CCl)n2-c1cnn(Cc2ccccc2)c1 2137608809 USRKIODWSIGUOW-UHFFFAOYSA-N 431.721 4.780 50 10 IJGE Cn1nc(CC2(CBr)CC3(CC(F)(F)C3)C2)c(Br)c1Cl 2158842295 WGNFZZSOQNKZEL-UHFFFAOYSA-N 432.534 4.969 50 10 IJGE ClCc1nc2cc(Br)cnc2n1C[C@]12CC[C@@H]1CN(Cc1ccccc1)C2 2201230066 MALWEPHMZGJDNM-IIBYNOLFSA-N 445.792 4.845 50 10 IJGE Cc1cc(Cl)cc(C(=O)N(C)C[C@H]2C[C@H]2Br)c1NC(=O)OC(C)(C)C 2223980522 DJNZTLUDLLMTAW-BXUZGUMPSA-N 431.758 4.851 50 10 IJGE Cc1cc(C(=O)N(C[C@H](C)Br)C(C)(C)C)ccc1I 2272450897 HYPCKUYRVRXOLF-NSHDSACASA-N 438.147 4.624 50 10 IJGE CC(C)COc1c(Cl)cc(C=NNC(=O)c2ccc3nc(S)[nH]c3c2)cc1Cl 2323603525 PCCPHOROXHQTQW-UHFFFAOYSA-N 437.352 4.957 50 10 IJGE COc1ccc(Cl)c(CC(=O)NN=Cc2ccc(OCc3ccccc3)c(OC)c2)c1 2323675736 LNDVVDKHXMQPNN-UHFFFAOYSA-N 438.911 4.629 50 10 IJGE CC1(C)CC(CBr)(CN2[C@H]3CC[C@@H]2C[C@@H](CNC(=O)OC(C)(C)C)C3)C1 2345003833 BJMRJZKLENBPCC-OSYLJGHBSA-N 429.443 4.955 50 10 IJGE COc1ccc(Br)cc1/C=C(/C#N)C(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] 33930141 IWNLWDNLQOKILT-WDZFZDKYSA-N 436.649 4.565 50 10 IJGE C[C@@H](Br)c1ccccc1NS(=O)(=O)c1sccc1Br 136605007 VXOSWNHFKWINLO-MRVPVSSYSA-N 425.167 4.767 50 10 IJGE O=C(c1cc(C(F)(F)F)ccc1Br)N1CCCC[C@@H]1CBr 159883879 RVPPHGSDCQJZHT-SNVBAGLBSA-N 429.074 4.858 50 10 IJGE O=C=NC[C@@H]1CCC[C@@H](CNC(=O)N2CCC(c3cc4cc(Cl)ccc4[nH]3)CC2)C1 170288664 JDNVHLFPNWZRHW-IAGOWNOFSA-N 428.964 4.853 50 10 IJGE COc1ccc(-c2n[nH]c(C(=O)NN=C/C(Br)=C/c3ccccc3)c2C)cc1 254740402 TYAOVDKJGZQKHD-SWQCHLMMSA-N 439.313 4.545 50 10 IJGE Cc1ccc(-n2c(SCC(=O)NN=Cc3cccc(C)c3)nnc2-c2ccccc2)cc1 254848242 GNFZTVSHEINSPB-UHFFFAOYSA-N 441.560 4.794 50 10 IJGE CO[C@@H](CO[C@H](CI)c1ccc(Br)cc1)C(C)C 311065263 KYGBQYIMHJPQCY-KGLIPLIRSA-N 427.120 4.613 50 10 IJGE Cc1sc(Br)cc1[C@H](Br)c1cnn(C)c1Br 379198677 GYFYJSMGHZXPRM-VIFPVBQESA-N 428.975 4.799 50 10 IJGE O=C(CBr)c1ccc(Cl)c(C(F)(F)F)c1I 396152287 RONFCWYEHPLTGH-UHFFFAOYSA-N 427.385 4.541 50 10 IJGE C[C@H](CO[C@@]1(CI)CCCN(C(=O)OC(C)(C)C)C1)C1CCC1 398340420 CYBJLGOSXPASNF-RDTXWAMCSA-N 437.362 4.644 50 10 IJGE CC1(CBr)CCN(Cc2cc(Cl)ccc2I)CC1 405282911 CRPDVXGSZLMENJ-UHFFFAOYSA-N 442.566 4.942 50 10 IJGE C[C@H]1CCCN(Cc2cc(Cl)ccc2I)[C@@H]1CBr 688704351 GKEISVMXPDRPHG-IINYFYTJSA-N 442.566 4.940 50 10 IJGE CN(C)c1cc(C(=O)NN=Cc2c(Cl)cccc2OCc2ccccc2Cl)ccn1 731560860 FTNUUZANMQGXDO-UHFFFAOYSA-N 443.334 4.797 50 10 IJGE CN(C)c1cc(C(=O)NNc2c(Cl)cc(Br)cc2Cl)cc(Cl)n1 742005993 CLTHPTIRLAEEOU-UHFFFAOYSA-N 438.540 4.627 50 10 IJGE CS(=O)(=O)c1ccc(NNC(=O)/C(=C/c2ccc(Cl)cc2)c2ccc(F)cc2)cc1 748156818 NNAYLSUDEKLOFD-KGENOOAVSA-N 444.915 4.567 50 10 IJGE Cc1csc(Sc2ccc(NC(=O)NNC(=O)c3cccc4cccnc34)cc2)n1 756172449 AVGYODTVOSWRNV-UHFFFAOYSA-N 435.534 4.617 50 10 IJGE Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)n2ccc(=NCC(F)(F)F)cc2)c1C 775493092 GSHMXYTWMQYMSJ-DEDYPNTBSA-N 438.453 4.914 50 10 IJGE N#CCCn1cc(/C=C(/C#N)C(=O)N2CC3(CCC3)[C@H]2C2CC2)c(-c2ccc(Cl)cc2)n1 793428391 AXANJSAKWVZLPW-FYVGXUMQSA-N 445.954 4.815 50 10 IJGE C=CCCC[C@H](NC(=O)NNc1cc(C(=O)OC)ccc1Br)c1ccccc1 1479191179 TUFINGXLYAHAQT-SFHVURJKSA-N 446.345 4.959 50 10 IJGE C=CC[C@@H]1CCCC[C@H]1NC(=O)NNC(=O)Nc1ccc(Br)cc1Cl 1682683255 KOOXSOXCDGOBHT-BXUZGUMPSA-N 429.746 4.573 50 10 IJGE COc1ccc(C)cc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1cccc(C)c1)CCC2 1772745121 SMEVIKFCDYIWBO-UHFFFAOYSA-N 445.519 4.936 50 10 IJGE Cc1ccc(O)c([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(Cl)c(Cl)c2)c1 1865684973 BQMPKQLVFMLXHA-IBGZPJMESA-N 427.291 4.720 50 10 IJGE CCCc1nn(C)c2c1[C@@H](c1ccccc1OCc1ccccc1Cl)C(C#N)=C(N)O2 1865702454 ASSXEWXDSHGSHJ-NRFANRHFSA-N 434.927 4.823 50 10 IJGE CC(C)(C)OC(=O)N[C@@H](CBr)[C@H]1CCN(Cc2ccccc2)CC1(C)C 1880767444 PLDOIBADXOSTDM-MSOLQXFVSA-N 425.411 4.823 50 10 IJGE CC(C)C1CC(O[C@]2(CI)CCCN(C(=O)OC(C)(C)C)C2)C1 1987764470 UKNLZVXOJJFBHI-JMLCCBQJSA-N 437.362 4.642 50 10 IJGE C[C@H]1C[C@@H](CBr)CN1Cc1cc(Br)ccc1Br 2006503206 LKAAKSLPPMKNEB-UWVGGRQHSA-N 425.990 4.817 50 10 IJGE Cc1cc(Br)c(NC(=O)C2CC(Br)C2)c(Br)c1 2020151322 BWEVMXRZXRAOFK-UHFFFAOYSA-N 425.946 4.632 50 10 IJGE C[C@@H]1OCC[C@]1(CBr)Cc1ccc(I)c(Cl)c1 2026569924 ODKKYBPNSDMUSJ-TVQRCGJNSA-N 429.523 4.677 50 10 IJGE COC[C@@]1([C@@H](Br)c2cc(Br)ccc2Br)CCCO1 2030231700 VRXFFDUSADJVKK-QWHCGFSZSA-N 442.973 4.843 50 10 IJGE C[C@H](NC(=O)c1c(Br)cccc1Br)C1(CBr)CC1 2033089632 VQDWCXSYLTVOFI-QMMMGPOBSA-N 439.973 4.505 50 10 IJGE BrC[C@@H]1CCC2(CC2)CN1c1ncc(Br)cc1Br 2036626556 UGAYINIFSPGFFJ-JTQLQIEISA-N 438.989 4.751 50 10 IJGE FC1(F)C(O[C@H](CI)c2ccc(Br)cc2)C1(F)F 2062573929 NLSIRKULBXQTEH-MRVPVSSYSA-N 438.984 4.595 50 10 IJGE CC1(C)[C@H](CBr)CCN1Cc1ccc(I)c(Cl)c1 2086661959 QMKSDLHVJVUVKJ-NSHDSACASA-N 442.566 4.940 50 10 IJGE Cc1ccc(N2CCC[C@]3(CN(Cc4ccccc4)CCO3)C2)c(CBr)c1 2151740553 SKFBUJPDZSMLRU-QHCPKHFHSA-N 429.402 4.761 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CN(C[C@H](CBr)c2ccccc2)CC2(CCC2)C1 2163061720 HSXNGTTVVQKQBQ-RBUKOAKNSA-N 437.422 4.934 50 10 IJGE Cn1nc([C@@H](Cl)c2cc3c(cc2Br)OCC3)c(Br)c1Cl 2167042874 QUEDPKMGLBTYNX-NSHDSACASA-N 440.950 4.862 50 10 IJGE Cc1c(Cl)cc(C(=O)N2CCS[C@H](CCBr)C2)cc1Br 2167383619 KUXZCBUHKZKTNM-LLVKDONJSA-N 441.616 4.754 50 10 IJGE CN[C@@H](c1cc(Br)c(Br)cc1F)[C@H]1C[C@H](Br)C1 2213490344 QSDACTGOASFQRX-NQYJQULFSA-N 429.953 4.785 50 10 IJGE CCCN(C[C@H](C)Br)C(=O)c1cc(Cl)ccc1I 2259758929 ZGBKOTCLLLIKPN-VIFPVBQESA-N 444.538 4.580 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@H](Cl)c1cc(Br)n(C)n1 2277988793 CIBXBCBMIDGECQ-NSHDSACASA-N 428.939 4.935 50 10 IJGE C[C@@H]1CN(C(=O)c2cc(F)c(Br)cc2Cl)C[C@@H](C)C1Br 2282978531 OGSBDOITQWXBCR-HTQZYQBOSA-N 427.539 4.733 50 10 IJGE N#CC(=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)NCCc1c[nH]c2ccccc12 2294172009 SOAPORDUNHVOGC-UHFFFAOYSA-N 426.432 4.602 50 10 IJGE CC[C@@H](C)[C@@H](Cl)CNCc1ccc(I)c(Br)c1 2306226128 YBXPXWKGFOCKPG-SKDRFNHKSA-N 430.555 4.797 50 10 IJGE CC1(C)C[C@@H](Br)CN(Cc2ccc(Cl)c(I)c2)C1 2315554577 GRCZSHYWGQWDLE-LLVKDONJSA-N 442.566 4.940 50 10 IJGE CCOc1ccc([C@H](Br)c2cc(I)sn2)c(F)c1 2319130000 SQVIZJTWTNMMRQ-LBPRGKRZSA-N 442.091 4.770 50 10 IJGE Clc1ccc(I)cc1CC[C@@H](Br)CN1CCCC1 2327407740 VBIZMVMCYNCVEY-GFCCVEGCSA-N 442.566 4.737 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]1C(F)(F)F 2353829354 ZFSSLSKUUYEUHC-KKUMJFAQSA-N 445.364 4.916 50 10 IJGE C[C@H]1CN(c2c(CBr)c(C(F)F)nn2C)[C@H](C)[C@@H](C)N1Cc1ccccc1 2365337342 KCWWXWALZFGBKM-RRFJBIMHSA-N 441.364 4.740 50 10 IJGE COCCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)CC1(CBr)CC(C)(C)C1 2371132308 ZGZIPJSQQZVUHG-KRWDZBQOSA-N 447.458 4.536 50 10 IJGE O=C(Cc1csc(-c2ccsc2)n1)NNC(=O)c1cc2c(s1)CCCCCC2 12698593 PSEZJJNGODGNKM-UHFFFAOYSA-N 431.608 4.596 50 10 IJGE CCCOc1ccccc1/C=N/NC(=O)COc1ccc2ccccc2c1Br 20595707 BRCSDOMGRLXVSI-ZVHZXABRSA-N 441.325 4.920 50 10 IJGE C=CCOc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(OC(=O)Cc4ccccc4)ccc32)c1 40529949 YFAWREXVIGICCA-SANMLTNESA-N 438.483 4.618 50 10 IJGE Cc1c(C(=O)Nc2ccc(C(C)C)cc2)oc2c1/C(=N/NC(=O)c1ccccn1)CCC2 40814279 ZILRKOBPCYDUME-TURZUDJPSA-N 430.508 4.829 50 10 IJGE CC1=C(C#N)C(=O)N(CCc2ccccc2)C(=O)/C1=C/Nc1ccc(Cl)c(Cl)c1 101234727 YCFPIJLXSAGYKI-QGOAFFKASA-N 426.303 4.741 50 10 IJGE O=C(N[C@@H]1c2ccccc2C[C@H]1Cl)c1cc(Br)ccc1Br 161208224 OECALZHSZRPIBV-HUUCEWRRSA-N 429.539 4.846 50 10 IJGE COc1ccccc1/C=C(/C#N)C(=O)N(c1cc(C)ccc1C)S(=O)(=O)c1ccccc1 207133348 XSMDZWZAURJLLZ-PGMHBOJBSA-N 446.528 4.641 50 10 IJGE COc1ccc(CCNC(=O)/C(C#N)=C\Nc2ccc(Oc3ccccc3)cc2)cc1OC 216776392 HXYNTMUGXZTBEO-ZZEZOPTASA-N 443.503 4.674 50 10 IJGE C[C@H](NC(=O)/C(C#N)=C\N1CCN(c2cccc(Cl)c2)CC1)c1ccc2c(c1)CCCC2 217203672 SGGHRRGAKKWKQJ-FGLBZAAHSA-N 448.998 4.626 50 10 IJGE O=C(OCc1ccccc1)N1C[C@H](c2cccc(F)c2)[C@@H](CI)C1 382737610 XXSPAZHQRBHNGR-FUHWJXTLSA-N 439.268 4.613 50 10 IJGE C[C@H]1[C@@H](CBr)CCN1Cc1cc(Cl)ccc1I 405286382 FBKAUFLQIMUXFZ-VHSXEESVSA-N 428.539 4.550 50 10 IJGE O=C1NCCc2ccc([C@@H](Cl)c3scc(Br)c3Br)cc21 705447375 HZMISGVSPKYEAY-GFCCVEGCSA-N 435.568 4.887 50 10 IJGE Cn1ccnc1C[C@@H](NC(=O)NNc1c(Cl)cc(Cl)cc1Cl)c1ccccc1 745912656 RUVSENAVHRBQPQ-MRXNPFEDSA-N 438.746 4.990 50 10 IJGE O=C(NN=Cc1cc(Br)c(N2CCCC2)o1)c1ccc(Cl)c(Cl)c1 1084157524 JUJVYFMMIBUDAL-UHFFFAOYSA-N 431.117 4.713 50 10 IJGE Cc1ccc(NC(=O)NN=C2c3ccccc3C[C@@H]2NC(=O)c2cccc(Cl)c2)cc1 1088700337 GPPBZHZJXXFSGA-NRFANRHFSA-N 432.911 4.529 50 10 IJGE C=CCC[C@H](C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)c1ccccc1 1124216515 UMSFEEAWDOHWLO-QFIPXVFZSA-N 432.495 4.916 50 10 IJGE COc1ccccc1-c1ccc(C(=O)NNc2ccc(Br)cc2Cl)c(O)n1 1625574525 IKHGUKSOHXUZRI-UHFFFAOYSA-N 448.704 4.636 50 10 IJGE CCCOc1ccc(C=NNC(=O)CSc2nc(-c3ccccc3)cs2)cc1OC 1772755081 LFKNBJDDLBSYKN-UHFFFAOYSA-N 441.578 4.850 50 10 IJGE CCCOc1c(OC)cccc1[C@H]1C(C#N)=C(N)Oc2c1c(C)nn2Cc1ccc(C)cc1 1865694494 YOPFSPFFJIGCKK-QHCPKHFHSA-N 444.535 4.564 50 10 IJGE Cc1ccc(C)c(Cn2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@@H]3c2ccncc2)c1 1865700219 NGTAARNGXRSGBJ-QHCPKHFHSA-N 433.515 4.828 50 10 IJGE Cc1ccc(-n2nc(-c3ccccc3)c3c2OC(N)=C(C#N)[C@H]3c2ccc([N+](=O)[O-])cc2)cc1 1865713372 XMDGDMLBALFFBY-JOCHJYFZSA-N 449.470 4.974 50 10 IJGE C[C@H](Cl)CN(Cc1ccccc1)C(=O)c1cccc(F)c1I 1914615122 YYLDZFHKEHXJFD-LBPRGKRZSA-N 431.676 4.700 50 10 IJGE CN(C[C@@H](Cl)COCc1ccccc1)C(=O)c1ccc(Br)c(Cl)c1 1916355065 PJUUHCPXPSFIQW-OAHLLOKOSA-N 431.157 4.999 50 10 IJGE Brc1ccc(CN2C[C@@H]3CC(Br)C[C@H]3C2)c(Br)c1 2065396866 JUPFYHCLZBLYTB-QWRGUYRKSA-N 438.001 4.817 50 10 IJGE FC(F)(F)c1cc(Br)nc(-n2nc3c(c2CBr)[C@H]2C[C@@H]2C3)c1 2080648135 OERORICAVKLHCA-SVRRBLITSA-N 437.057 4.603 50 10 IJGE C[C@H]1CCc2c1c(CBr)nn2Cc1c(F)cccc1I 2080702481 DYORJPZKQHVRDW-VIFPVBQESA-N 449.105 4.620 50 10 IJGE C[C@@H]1CN(Cc2ccc(I)c(Cl)c2)C[C@@H](C)C1Br 2086659258 UXIASDDYVGAVCR-NXEZZACHSA-N 442.566 4.796 50 10 IJGE Cn1nc(COc2c(Br)cccc2CCl)c(Br)c1Cl 2096689337 XVGAHCUSYJCZFP-UHFFFAOYSA-N 428.939 4.916 50 10 IJGE O=C(c1scc(Br)c1Br)N1CC2(CC[C@H]1CCl)CC2 2097886577 BPDCEOXXAQVSPY-QMMMGPOBSA-N 427.589 4.897 50 10 IJGE C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CCN1C[C@H](CBr)c1ccccc1 2106786337 UNTDSOZSVCMNQV-AOIWGVFYSA-N 425.411 4.790 50 10 IJGE O=C(c1cc(Br)c(Cl)s1)N1CC[C@@]2(CCC[C@H]2Br)C1 2115924472 LSKICXCDCTZACQ-MFKMUULPSA-N 427.589 4.944 50 10 IJGE CC[C@@]1(C)CCCN(S(=O)(=O)c2cc(CBr)sc2Br)C1 2179788331 AZVFDFXBQQFXAP-ZDUSSCGKSA-N 445.242 4.606 50 10 IJGE O=S(=O)(Cc1ccccc1Br)N(Cc1ccccc1)[C@@H](CCl)C1CC1 2218983600 MTKMHQKKXRXAIB-IBGZPJMESA-N 442.806 4.799 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1Cc1cccc(Br)c1Br 2251035886 AILKASXZBYKHFN-JQWIXIFHSA-N 425.990 4.959 50 10 IJGE CC[C@H]1[C@@H](Br)CCN1C(=O)c1c(Br)cccc1Br 2260390372 YQKFLDSKPYIPAM-KWQFWETISA-N 439.973 4.600 50 10 IJGE C[C@H]1[C@@H](Br)C[C@@H](C)CN1C(=O)c1cc(Br)c(F)cc1Cl 2285847495 BYPLLCPXOMEVKE-WEDXCCLWSA-N 427.539 4.876 50 10 IJGE C=CC[C@@]1(CBr)CCCN1Cc1sccc1I 2301075503 ASIIZCYQXLNXKB-ZDUSSCGKSA-N 426.161 4.658 50 10 IJGE Clc1ccc(CN2CC[C@H](CCBr)C2)c(I)c1 2302315976 PZWDKGRIJWFXFL-JTQLQIEISA-N 428.539 4.552 50 10 IJGE CC(C)CN(CCBr)Cc1ccc(Cl)cc1I 2302325354 GTHMCFPIHVIETH-UHFFFAOYSA-N 430.555 4.798 50 10 IJGE C[C@H]1CCN(Cc2ccc(I)c(Br)c2)[C@@H]1CCl 2306222256 ROJRWGWSFCUBMF-TVQRCGJNSA-N 428.539 4.503 50 10 IJGE C=CC[C@H](Br)[C@H]1CCN1Cc1cc(Cl)ccc1I 2314264718 CJPLICBTMJPERN-GXTWGEPZSA-N 440.550 4.859 50 10 IJGE O=C(c1cc(F)c(Br)cc1O)N(Cc1ccccc1)[C@@H](CCl)C1CC1 2317272159 SQXHWDUXYKXORX-KRWDZBQOSA-N 426.713 4.954 50 10 IJGE Cn1cc(I)c(C[C@@H]2C[C@@H](C(C)(C)C)CC[C@@H]2Br)n1 2341856364 JUHBKNYQFMLHHD-SRVKXCTJSA-N 439.179 4.793 50 10 IJGE CC1(C)CC(CBr)(CN2CCC[C@@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]32)C1 2345011182 QRLCKLAMQTXHGC-SJORKVTESA-N 429.443 4.909 50 10 IJGE CC(C)(C)OC(=O)NC[C@]1(C)CN(C[C@H](CBr)c2ccccc2)CC1(F)F 2379683779 UBOLCKVPHBFFLE-QFBILLFUSA-N 447.364 4.647 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CN(C[C@@]2(CBr)CC2(F)F)c2ccccc21 2379986456 RMEVYPDIFDNBIC-KUHUBIRLSA-N 445.348 4.925 50 10 IJGE CC(=O)N(/N=C/c1coc2ccccc2c1=O)c1nc2ccc(Br)cc2s1 9148706 PAZHFYGZILRXIM-ZVBGSRNCSA-N 442.294 4.552 50 10 IJGE C/C(N)=C(/C#N)C(=O)CSc1nnc(Cc2cccc3ccccc23)n1C1CCCCC1 9373596 HEXVXOWHAONXPO-OQKWZONESA-N 445.592 4.945 50 10 IJGE CC(C)CCOc1ccccc1C(=O)NNC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 14033698 CYHUZYZICFUVFV-AWEZNQCLSA-N 439.339 4.647 50 10 IJGE N#C/C(=C/c1ccc(OC(=O)c2ccco2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 33930114 PHRKMBWJAXOFGC-UVTDQMKNSA-N 437.795 4.606 50 10 IJGE Cc1ccc(Nc2ncnc(NNC(=O)C(c3ccccc3)c3ccccc3)c2N)cc1C 40702958 QUYGIDUKJCXUGM-UHFFFAOYSA-N 438.535 4.694 50 10 IJGE O=c1[nH]c2cc(Br)c([C@@H](Cl)Cc3cccc(Br)c3)cc2[nH]1 109883792 PXTYNWRMABQIHF-LBPRGKRZSA-N 430.527 4.904 50 10 IJGE O=S(=O)(c1c(Cl)cc(Br)cc1Cl)N1[C@H]2CC[C@H]1CC(Cl)C2 111391018 NTWLKPQRWUHXJG-UWVGGRQHSA-N 433.582 4.679 50 10 IJGE CC(C)(CCBr)NC(=O)c1cc(Br)ccc1Br 161244323 WLEUIEPAYVCTEK-UHFFFAOYSA-N 427.962 4.505 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](CBr)[C@H](c2cc(F)ccc2Br)C1 382686478 FOELUJGETCSYIP-GXFFZTMASA-N 437.147 4.934 50 10 IJGE CCN(C(=O)c1cc(Br)cc(Br)c1)C(C)(C)CBr 688360004 GPMVTBVIYGYJRU-UHFFFAOYSA-N 441.989 4.847 50 10 IJGE C[C@H](CBr)CCCNC(=O)c1scc(Br)c1Br 705402111 TUNDATGYRSOMGG-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE CN(Cc1ccccc1)[C@@H](Cn1c(CCl)nc2cc(Br)cnc21)C1CC1 717978866 KARFINYCZGQDPO-SFHVURJKSA-N 433.781 4.843 50 10 IJGE O=C(NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)[C@H]1C[C@H]1c1cccc2ccccc12 734259817 CIBRPJHNJCKVJG-ROUUACIJSA-N 449.436 4.957 50 10 IJGE Cc1cc(-c2cc(C(=O)NNc3cccc(F)c3F)c3cnn(C(C)C)c3n2)c(C)o1 748796961 RMLAUJCREJTHMP-UHFFFAOYSA-N 425.439 4.924 50 10 IJGE Cc1cccc(NC(=O)NN=C2c3ccccc3C[C@@H]2NC(=O)c2cccc(Cl)c2)c1 1088691993 PFPOAWMPPGDEHO-NRFANRHFSA-N 432.911 4.529 50 10 IJGE C=CCN1CCC(NC(=O)/C(C#N)=C\c2cc(C)n(-c3cccc4ccccc34)c2C)CC1 1136669995 XEEQHUAVXUVIJO-MOHJPFBDSA-N 438.575 4.921 50 10 IJGE COc1ccc2c(c1)c(/C=N\NC(=O)c1ccc(-c3ccc(Cl)cc3)nc1C)cn2C 1865761955 FPJAGZZJHXDYHZ-ZMFRSBBQSA-N 432.911 4.975 50 10 IJGE O=C(c1ccncc1Br)N(Cc1ccccc1)[C@H](CBr)C1CC1 1915314553 SIKPMRLWZWWAJI-QGZVFWFLSA-N 438.163 4.660 50 10 IJGE CC(C)(C)OC(=O)NCC[C@@H]1CCC[C@@]2(CC[C@](C)(CI)O2)C1 1939622035 XZAGPEWGANENJW-BMGDILEWSA-N 437.362 4.834 50 10 IJGE O=C(N[C@H]1CCCC[C@H]1Br)c1csc(Br)c1Br 1945183301 BSRJBCQWHREPKW-SFYZADRCSA-N 446.002 4.709 50 10 IJGE C[C@H]1C[C@H](Br)CCN1Cc1c(Br)cccc1Br 1945328306 ATZSMXUSFBYLIA-VHSXEESVSA-N 425.990 4.959 50 10 IJGE Cc1sc(Br)cc1[C@@H](Br)c1cn(C)nc1Br 1981647888 FRGJANNSFJSPMU-SECBINFHSA-N 428.975 4.799 50 10 IJGE Brc1cc([C@H](Br)Cc2ccncc2Br)ns1 1983295122 NWFZBSDDRIZYAI-SSDOTTSWSA-N 426.959 4.742 50 10 IJGE Cl[C@@H]1CCCCC[C@H]1Nc1ncc(I)cc1Br 2015757138 PCSAHTVZDXFZLU-GHMZBOCLSA-N 429.527 4.801 50 10 IJGE CC(C)(C)N(CCCCl)c1ncc(I)cc1Br 2015762830 PVJZEEOFKXGKEW-UHFFFAOYSA-N 431.543 4.683 50 10 IJGE C[C@@H](NC(=O)c1c(Br)cccc1Br)C(C)(C)CBr 2033092058 YPSQBPMPIOAMMV-MRVPVSSYSA-N 441.989 4.751 50 10 IJGE O=S(=O)(c1cc(CBr)n(C2CC2)c1)N(Cc1ccccc1)CC1CCC1 2123271876 USBMDVZLWZHPJK-UHFFFAOYSA-N 437.403 4.709 50 10 IJGE CS(=O)(=O)c1sccc1[C@H](Br)c1cc(F)c(Br)cc1F 2150545399 MSXJTJRCZZPJCD-NSHDSACASA-N 446.132 4.677 50 10 IJGE CN(C(=O)c1ccc(CBr)cc1)[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 2162872174 KZGNTMYEVKRDGU-PIIMJCKOSA-N 437.378 4.584 50 10 IJGE Cc1sc(Br)cc1[C@H](Br)c1ccc2c(c1)CCS2(=O)=O 2170066472 HPLKYWPONNFWSR-CQSZACIVSA-N 436.190 4.633 50 10 IJGE CN(CCC1CCCC1)S(=O)(=O)c1cc(CBr)sc1Br 2182388913 MGXHAEZIEMHQOM-UHFFFAOYSA-N 445.242 4.606 50 10 IJGE CO[C@H]1C[C@@H](Oc2c(Br)cc(Cl)cc2CBr)C[C@H]1OC 2187174755 YPUQKYLHRYLREB-LMKPVCQUSA-N 428.548 4.569 50 10 IJGE COc1cc(F)c(F)cc1[C@@H](Br)c1nn(C)c(Cl)c1Br 2204485884 DZJXPZQMMZEZTF-SECBINFHSA-N 430.474 4.607 50 10 IJGE CC(C)(C)OC(=O)Nc1ccc2c(c1)CCN(CCCCI)C2 2243585445 BMEJTDQIJUKRNT-UHFFFAOYSA-N 430.330 4.607 50 10 IJGE FC(F)(F)[C@H](Br)COc1cc(I)ccc1Cl 2244975298 ALPXWYLSFQSZNP-MRVPVSSYSA-N 429.401 4.649 50 10 IJGE CC(C)(C)OC(=O)N1[C@H]2CSC[C@H]1CC1(C2)C[C@@]1(CBr)C(F)(F)F 2249373698 BBLPYIAVTSVCTC-HFAKWTLXSA-N 430.330 4.835 50 10 IJGE CC1CC(CBr)(CN2CCC[C@@]2(CNC(=O)OC(C)(C)C)C(F)(F)F)C1 2265303469 CKTQKFDPXHFFKZ-QWFMPGPPSA-N 443.348 4.719 50 10 IJGE CC1CC(CBr)(CN2CCC[C@@H]([C@H]3CCCN3C(=O)OC(C)(C)C)C2)C1 2265311452 HDJXCFPXWXSSRG-BKVYSMKUSA-N 429.443 4.909 50 10 IJGE CCOc1cc(Br)c(C=C(C#N)C(=O)Nc2ccc(OC)cc2)cc1OCC 2313681185 RKGXIZIJFMSZJO-UHFFFAOYSA-N 445.313 4.801 50 10 IJGE FC1(F)CC[C@H]1CO[C@@H](CI)c1cccc(Br)c1 2313727041 RXHFZTARXVOXJU-JQWIXIFHSA-N 431.058 4.987 50 10 IJGE CCCCOc1ccc(C=C2C(=O)N(CCc3ccccc3)C(=O)C(C#N)=C2C)cc1OC 2314616970 ODORMOWMDGLRTB-UHFFFAOYSA-N 444.531 4.709 50 10 IJGE Clc1ccc(CN2C[C@H]3CC[C@@]3(CBr)C2)cc1I 2315548815 LGJZMEXVDVGNOJ-BXUZGUMPSA-N 440.550 4.552 50 10 IJGE CCC(CC)(CBr)NC(=O)c1ccc(Cl)cc1I 2317766478 MDHLIRJYUSBCOZ-UHFFFAOYSA-N 444.538 4.628 50 10 IJGE N#CC(=Cc1ccc(Cl)cc1)C(=O)NC[C@@H](c1c(F)cccc1Cl)N1CCCC1 2329647006 HUVUWLXFZUHWKD-FQEVSTJZSA-N 432.326 4.993 50 10 IJGE CC(C)N(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C[C@@]1(CBr)CC1(F)F 2351886836 FGBGYQJSTZBWNR-QAPCUYQASA-N 439.385 4.764 50 10 IJGE CCOc1cccc(-c2nn(-c3ccccc3)cc2/C=C(\C#N)C(=O)NC2CCCC2)c1 39850221 DOXAGLZUGWSAMD-HMMYKYKNSA-N 426.520 4.904 50 10 IJGE O=C(CCCc1c(-c2ccc3ccccc3n2)[nH]c2ccccc12)NNC(=O)c1ccncc1 39867153 FPGSNZVANJJIGL-UHFFFAOYSA-N 449.514 4.562 50 10 IJGE Cc1cccc(Nc2ncnc(NNC(=O)c3ccc(Cl)cc3Cl)c2[N+](=O)[O-])c1C 40620674 LERZJMFDQZRCEM-UHFFFAOYSA-N 447.282 4.809 50 10 IJGE Cc1nc2ccccc2n1CC(=O)N/N=C/c1ccc(OCc2ccccc2Cl)cc1 59181269 FILOXPXTQQJENO-VULFUBBASA-N 432.911 4.727 50 10 IJGE O=C(N/N=C/c1ccccc1F)c1cc(Br)ccc1OCc1ccccc1 96095872 NLYZKGUSJSTWGH-ZMOGYAJESA-N 427.273 4.931 50 10 IJGE ClC[C@H](I)[C@@H](CCl)OCc1ccccc1Br 158549051 GRUBIWQEQJOPBV-WDEREUQCSA-N 437.930 4.616 50 10 IJGE COC(=O)c1c(NC(=O)/C(C#N)=C/c2ccc(N3CCCCC3)o2)sc2c1CCCC2 205774274 LKLXPCSOAJCMQK-FYWRMAATSA-N 439.537 4.542 50 10 IJGE O=C(NN=Cc1c[nH]c2ccccc12)c1cc(-c2ccc(OCCc3ccccc3)cc2)[nH]n1 254523057 QJUMTOQAFLTRIO-UHFFFAOYSA-N 449.514 4.943 50 10 IJGE O=C(CCn1cnc(-c2ccccc2)c1-c1ccccc1)NN=Cc1cccc([N+](=O)[O-])c1 254568020 YXPUBOLDJSCQEL-UHFFFAOYSA-N 439.475 4.666 50 10 IJGE Cc1nnc(CSc2ccc(C(=O)NN=Cc3ccccc3C(F)(F)F)cc2)s1 254699732 WPHJNEXINKBIOY-UHFFFAOYSA-N 436.484 4.922 50 10 IJGE COc1ccc2ccccc2c1-c1cc(C(=O)NN=Cc2c(O)ccc3ccccc23)[nH]n1 254827135 YDQIOYQPOFWBDV-UHFFFAOYSA-N 436.471 4.861 50 10 IJGE C[C@H](CCCCBr)NC(=O)c1cc(Br)ccc1Br 398517322 KYHLOSUGCIQIGK-SECBINFHSA-N 441.989 4.895 50 10 IJGE FC(F)Oc1ccc(I)c(CBr)c1C(F)(F)F 575723824 YRMZUTKOXXGTGA-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE CSc1ccc(F)cc1CNC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccccc1 744682645 BMCLOMOTTBLQBD-PDGQHHTCSA-N 445.523 4.548 50 10 IJGE CCOc1ccc(OCC(=O)NN=Cc2ccc(OCc3ccc(C)cc3)c(OC)c2)cc1 1772754849 YNCZUJJDWZJAEY-UHFFFAOYSA-N 448.519 4.510 50 10 IJGE CCCc1nn(-c2ccc(Cl)cc2)c2c1[C@@H](c1ccccc1[N+](=O)[O-])C(C#N)=C(N)O2 1865710174 QCBKXHHWIHEODX-IBGZPJMESA-N 435.871 4.605 50 10 IJGE COc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1OCc1cccc(Cl)c1 1873498544 UIVPHGRPQRGESV-ZMOGYAJESA-N 439.855 4.600 50 10 IJGE O=C(NCC1CC2(CC[C@@H]2Cl)C1)c1cc(Br)c(Br)s1 1882897360 NGLMOFUUPHELDS-JRIBOLAGSA-N 427.589 4.801 50 10 IJGE CC[C@H](Br)CN(Cc1ccccc1)c1ccccc1S(=O)(=O)C(F)F 1915084060 SHXYCNLQEODYMD-HNNXBMFYSA-N 432.330 4.863 50 10 IJGE CN(Cc1cccc(Br)c1Br)C1(CCBr)CC1 2015868057 PXJFTQLVGULKST-UHFFFAOYSA-N 425.990 4.961 50 10 IJGE O=C(c1cccc(Br)c1Br)N(CCBr)C1CCC1 2031487622 WULAEBBVPAAYQS-UHFFFAOYSA-N 439.973 4.601 50 10 IJGE C[C@H]1C[C@H](Br)[C@H](C)CN1Cc1cc(Cl)ccc1I 2032205029 VZCRQCQLVGHMSV-NRUUGDAUSA-N 442.566 4.938 50 10 IJGE CC[C@@H](CCCCl)NC(=O)c1cc(I)ccc1Br 2036511010 QEERCASNKZMXRP-JTQLQIEISA-N 444.538 4.581 50 10 IJGE CC(N)=C(C#N)c1csc(NC(=O)c2cc(-c3ccccc3)nc3c2cnn3C(C)C)n1 2040490714 RECSZLBHXZLMJQ-UHFFFAOYSA-N 443.536 4.601 50 10 IJGE CC(C)(C)OC(=O)NCCCN(C[C@@H](CBr)C(C)(C)C)CC(F)(F)F 2044704640 FEHVJBXMSLYMSB-CYBMUJFWSA-N 433.353 4.823 50 10 IJGE FC(F)(F)c1c(I)cc(CCl)cc1I 2060240157 JAUOEGMLSYMBJB-UHFFFAOYSA-N 446.375 4.653 50 10 IJGE ClC[C@@H]1CCCC[C@H]1CNc1ncc(I)cc1Br 2069526178 RMWGSFZLHKQHSI-UWVGGRQHSA-N 443.554 4.906 50 10 IJGE CSCC[C@H](Br)CCNC(=O)c1ccc(Cl)cc1Br 2090386856 DPTUNKRIWMPAIA-SECBINFHSA-N 429.605 4.739 50 10 IJGE C[C@@H]1CCO[C@@H]1CO[C@@](C)(CI)c1ccccc1Br 2096130625 XNTKDBYOWHIQCB-DFBGVHRSSA-N 439.131 4.541 50 10 IJGE CN(C[C@H](CBr)c1ccccc1)[C@@H](CNC(=O)OC(C)(C)C)C(F)(F)F 2106783741 CJSGYLXJABUTCP-GJZGRUSLSA-N 439.316 4.553 50 10 IJGE CCCN(C[C@@H](CBr)c1ccccc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2106788989 VIGYTBNNHSMCOS-MOPGFXCFSA-N 425.411 4.887 50 10 IJGE O=C(NC[C@@H]1C[C@H](Cl)C12CCC2)c1cc(Br)sc1Br 2115598890 IOBFLUPCPMTHIG-CBAPKCEASA-N 427.589 4.801 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)[C@@]12CCCC[C@H]1N(C(=O)OC(C)(C)C)CCC2 2196908438 XNCUVYRKTWJXTN-BZLDKRAPSA-N 443.426 4.578 50 10 IJGE Clc1c(Br)cccc1CC12COC(CI)(C1)C2 2216253381 RFQPJQDSBPBHAL-UHFFFAOYSA-N 427.507 4.629 50 10 IJGE O=C(Nc1ccccc1CCBr)c1csc(I)c1 2222938477 SRNICAHQMBPFPG-UHFFFAOYSA-N 436.112 4.542 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)C(=O)c1ccc2c(c1)OC(F)(F)O2 2231587278 VMGBQAWLDNJAFE-ZDUSSCGKSA-N 426.257 4.824 50 10 IJGE Cc1ccc(I)c(C(=O)N(CCCBr)C(C)(C)C)c1 2232166783 NNDDDCKASHCBCB-UHFFFAOYSA-N 438.147 4.625 50 10 IJGE ClCc1nc2cc(Br)c(Br)cc2n1CCc1nccs1 2234067125 NPFNIFOYWBNBFJ-UHFFFAOYSA-N 435.572 4.999 50 10 IJGE FCC(F)(F)OC1CN(c2c(CBr)ccc(Br)c2Cl)C1 2237638993 PBXUDTKTCHKHEY-UHFFFAOYSA-N 437.481 4.765 50 10 IJGE CC[C@H]1[C@H](Br)CCN1C(=O)c1csc(Br)c1Br 2251003579 PSLRLSGXKIZOCA-SFYZADRCSA-N 446.002 4.661 50 10 IJGE COc1ccc([C@H](Br)[C@H]2COC(C)(C)C2)cc1I 2257355152 NXNPZDQTKOTUHE-MFKMUULPSA-N 425.104 4.551 50 10 IJGE CCC1(COc2c(Br)cc(Br)cc2CBr)COC1 2259007685 FZIKBHCCORTGHM-UHFFFAOYSA-N 442.973 4.912 50 10 IJGE CCCN(C[C@H](C)Br)C(=O)c1cc(Br)ccc1Br 2259760366 DIZHLMAAXJDQST-VIFPVBQESA-N 441.989 4.847 50 10 IJGE CC(C)(C)OC(=O)N1CC[C@@H]2CCCN(C[C@@H](CBr)c3ccccc3)[C@@H]2C1 2290276770 UMZVTPBGBULGMD-XUVXKRRUSA-N 437.422 4.887 50 10 IJGE CC(C)[C@@H](CBr)N(C)C(=O)c1cc(Br)sc1Br 2302533036 KUXWJUISNQTJOX-MRVPVSSYSA-N 448.018 4.765 50 10 IJGE C[C@H]1[C@@H](C(F)(F)F)N(CC[C@@H](C)CCBr)CCN1C(=O)OC(C)(C)C 2309539797 GTKBSBWDVQJPJV-IHRRRGAJSA-N 431.337 4.670 50 10 IJGE Cc1c(Br)ccc([C@@H](Br)[C@H]2OCCO[C@H]2C)c1Br 2311919393 KNOQFPRKQAASQE-CKLFPEKLSA-N 442.973 4.760 50 10 IJGE Clc1ccc(CC[C@H](Br)CN2CCCC2)c(I)c1 2318536703 BGHRGKDZVAPUDV-LBPRGKRZSA-N 442.566 4.737 50 10 IJGE CCOc1ccc(C)cc1[C@H](C)NC(=O)C(C#N)=CNCc1cccc(Br)c1 2325079182 YBGCIOWNBRAJJF-INIZCTEOSA-N 442.357 4.531 50 10 IJGE N#CC(=Cc1cccc(Br)c1)C(=O)Nc1cccc(-c2cccc(C(=O)O)c2)n1 2329699598 GJCQDKAKFLRNKW-UHFFFAOYSA-N 448.276 4.755 50 10 IJGE COc1ccc([C@@H](Br)[C@@H]2COC3(C)CC2C3)cc1I 2337680682 SCOSUPAKLAPCAC-YCKOLBRVSA-N 437.115 4.551 50 10 IJGE CN1C(=O)/C(=N/NC(=O)c2cc(-c3ccc(Cl)cc3)nc3ccccc23)c2ccccc21 3345350 ZUYNLPTULJKVQC-WEMUOSSPSA-N 440.890 4.666 50 10 IJGE CC[C@@H](C)c1ccccc1OCC(=O)NNC(=O)c1cccc(OCCc2ccccc2)c1 10330839 BLVYYBBWQQQHTK-HXUWFJFHSA-N 446.547 4.662 50 10 IJGE Cc1c(C(=O)Nc2ccc(F)cc2F)oc2c1/C(=N/NC(=O)c1ccc(F)cc1)CCC2 40811968 CFCRDPNYQJZCOF-MTDXEUNCSA-N 441.409 4.728 50 10 IJGE COc1cccc(C(=O)N/N=C2\CCCc3oc(C(=O)Nc4cc(C)ccc4C)c(C)c32)c1 40822251 FKTUGEPNRZHENW-VFCFBJKWSA-N 445.519 4.936 50 10 IJGE Clc1nc(Cl)nc(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)n1 105406451 HYRDNDDUINJESQ-UHFFFAOYSA-N 425.259 4.988 50 10 IJGE O=C(NC[C@H]1CCCC[C@H]1CBr)c1c(F)cc(Br)cc1F 126943040 MTHVXDFHNKGBIH-VHSXEESVSA-N 425.111 4.658 50 10 IJGE Cc1ccc(OCC(=O)NN=Cc2c(OC(=O)c3ccccc3)ccc3ccccc23)cc1 254385720 NZUDMRWZIHFBNG-UHFFFAOYSA-N 438.483 4.897 50 10 IJGE O=C(CNc1cccc2ccccc12)NN=Cc1ccc(OC(=O)/C=C\c2ccco2)cc1 254766647 NCONQZSJSJJAMU-KSKQSDHASA-N 439.471 4.614 50 10 IJGE C[C@H]1[C@@H](Br)CCCN1C(=O)c1cc(Br)cc(Br)c1 384230791 GGEGAYJCWAYGQL-UFBFGSQYSA-N 439.973 4.600 50 10 IJGE CC[C@@H](NC(=O)c1scc(Br)c1Br)[C@H](C)Br 705423747 FQBUJUVMNBVAJE-CAHLUQPWSA-N 433.991 4.565 50 10 IJGE CC(C)[C@@H](NC(=O)NNC(=O)c1cccc2cccnc12)c1ccc(C(F)(F)F)cc1 747950315 QUTDZBGSEOITSJ-GOSISDBHSA-N 430.430 4.595 50 10 IJGE CC(C)(C)n1nc(-c2ccccc2)cc1NC(=O)C(=O)NNc1cc(Cl)ccc1Cl 783366724 FCYYKBCFVFLYKX-UHFFFAOYSA-N 446.338 4.694 50 10 IJGE Cc1ccc(NC(=O)C(=O)NNc2cccc(F)c2F)cc1OCc1cccc(Cl)c1 785016568 DBQIYSGGSYAWEB-UHFFFAOYSA-N 445.853 4.587 50 10 IJGE COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)Nc2cc(C)nn2-c2ccccc2C)c1C 788100596 KKVUOJFYGFPKFK-UUMRFZBWSA-N 431.540 4.661 50 10 IJGE Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)NNc1ccc(C#N)cc1C(F)(F)F 799748523 RDGIVIBGOIFQAX-UHFFFAOYSA-N 433.821 4.541 50 10 IJGE Cc1nc(-c2cccnc2)nc(NNC(=O)c2c(F)ccc(SCC3CC3)c2F)c1C 1182768184 DZVXINABHGAJFI-UHFFFAOYSA-N 441.507 4.693 50 10 IJGE C=C(CBr)CN(CCOc1cccc(Br)c1)C[C@H]1CCCS1 1193963276 LTFZXLNBPUZMBJ-QGZVFWFLSA-N 449.252 4.977 50 10 IJGE CC(=O)c1cccc(OCc2cc(C(=O)NN=C(c3ccccc3)c3ccccc3)no2)c1 1352783873 CPWJUCNDPYJRLE-UHFFFAOYSA-N 439.471 4.639 50 10 IJGE Cc1sc2nc(CS[C@H](C)C(=O)NNc3cc(Cl)ccc3F)nc(O)c2c1C 1649099368 MDAOVSGTWDLYMN-SNVBAGLBSA-N 440.953 4.571 50 10 IJGE C#Cc1ccc(NC(=O)NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)c(Cl)c1 1675169333 LKCYPOJBNLOFJC-UHFFFAOYSA-N 431.805 4.946 50 10 IJGE Cc1c(Cl)cccc1NC(=O)c1oc2c(c1C)C(=NNC(=O)c1ccco1)CCC2 1772748032 XORYUVHPKIIEIX-UHFFFAOYSA-N 425.872 4.866 50 10 IJGE N#CC1=C(N)Oc2c(c(C(F)(F)F)nn2Cc2ccc(Cl)cc2)[C@H]1c1ccc(F)cc1 1865707582 ABXXFGHIDMGAPL-INIZCTEOSA-N 448.807 4.961 50 10 IJGE N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCc2cc(Br)ccc21 1866367953 PODONTICSUELCU-NTEUORMPSA-N 432.115 4.708 50 10 IJGE COC(=O)c1ccc(/C=C(\C#N)c2nc(-c3ccc(OC)c(OC)c3OC)cs2)cc1 1872795270 WOKIQDIHFFIDEU-LFIBNONCSA-N 436.489 4.687 50 10 IJGE CCOc1ccc(CCC(=O)Nc2sc(/C(C)=C/C#N)c(C)c2C(=O)OC)cc1OC 1873427982 GQHBLOWUWVAYHC-SDNWHVSQSA-N 442.537 4.749 50 10 IJGE C[C@H](C[C@@H]1CCCN1C(=O)OC(C)(C)C)[C@@H](CBr)NC(=O)OC(C)(C)C 1880762729 YFBXGXYOJVXWDT-QLFBSQMISA-N 435.403 4.700 50 10 IJGE CN(Cc1cccc(NC(=O)OC(C)(C)C)c1)CC(C)(C)CI 1904649770 XRLXHIZJSHIOLB-UHFFFAOYSA-N 432.346 4.927 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@H](OC[C@@H]2C[C@H]2C2CCCCC2)C1 1910840706 LRSYEJWNDGURFI-LUKYLMHMSA-N 449.373 4.642 50 10 IJGE CC(C)[C@H](CBr)N(Cc1ccccc1)S(=O)(=O)c1cc(F)ccc1F 1915294967 FGFPBOLKGYEJBR-KRWDZBQOSA-N 432.330 4.575 50 10 IJGE CCN(C[C@@](C)(CI)O[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)OC(C)(C)C 1917431935 CNVKOIXZDYYZHY-ATNYBXOESA-N 437.362 4.642 50 10 IJGE C[C@H]1C[C@H](Br)CN(Cc2ccc(Br)cc2Br)C1 1943860180 VRTNKJHDAPZPIC-CABZTGNLSA-N 425.990 4.817 50 10 IJGE CC[C@@H](CCBr)CNC(=O)c1csc(Br)c1Br 1945188966 FUCWDMXFMPMEDI-ZETCQYMHSA-N 448.018 4.814 50 10 IJGE CC(C)(C)OC(=O)N[C@H]1CC[C@H]([C@]2(C)CCC[C@H](CI)O2)CC1 1993734187 BAOHDOCTKBLTHA-ADAWSYLGSA-N 437.362 4.833 50 10 IJGE C[C@H]1C[C@@H]1N(CCBr)C(=O)c1cc(Br)sc1Br 2002025001 ZAPVKRUVXBQKKZ-XPUUQOCRSA-N 446.002 4.519 50 10 IJGE O=C(Nc1c(Br)cc(Cl)cc1Br)[C@H]1C[C@H](Br)C1 2020166894 KNLOUMSYZSGMHB-IZLXSQMJSA-N 446.364 4.977 50 10 IJGE CN(C[C@H]1C[C@@H](Br)C1)c1ccc(Br)cc1CBr 2020225160 OIVILPYWWAYHNT-WVSHTKLVSA-N 425.990 4.954 50 10 IJGE COc1ccc(C)cc1-n1nc(CBr)c(Br)c1C(F)(F)F 2079240075 QVVLIMKHNXLQFY-UHFFFAOYSA-N 428.046 4.866 50 10 IJGE CC[C@@H](C)[C@@H](CI)NC(=O)c1cc(Cl)ccc1Br 2081235287 DJUITFXSTDDZOA-PRHODGIISA-N 444.538 4.682 50 10 IJGE C[C@@H]1[C@H](C(F)(F)F)N(C[C@@H](CBr)C2CCC2)CCN1C(=O)OC(C)(C)C 2115980592 SQBZNAOUQMNCCY-BPLDGKMQSA-N 443.348 4.670 50 10 IJGE CC(C)(CBr)CN1C[C@H](CNC(=O)OC(C)(C)C)[C@@H](c2ccccc2)C1 2129068443 QSPIRYBIWUHCCK-ZWKOTPCHSA-N 425.411 4.648 50 10 IJGE O=C(NC[C@@]12CC[C@@H]1CCCN2Cc1ccccc1)c1ccc(CBr)cc1 2145607684 OTGPCWGUGUSALT-GMAHTHKFSA-N 427.386 4.756 50 10 IJGE C[C@H](Cl)c1nc2cc(Br)cnc2n1CCc1cnn(Cc2ccccc2)c1 2146275917 ACFKITGKNNRZAO-AWEZNQCLSA-N 444.764 4.981 50 10 IJGE C[C@H]1CCCC[C@]1(CNC(=O)OC(C)(C)C)NC(=O)c1ccc(CBr)cc1 2162496118 XPSYWZFWGKUDRN-YCRPNKLZSA-N 439.394 4.785 50 10 IJGE Cc1ccc(-c2nnc(CBr)n2C(C)(C)C)cc1I 2224620055 HVGSIOUVBASXML-UHFFFAOYSA-N 434.119 4.508 50 10 IJGE CCOCc1cc(Br)c([C@H](Cl)c2nn(C)cc2Br)s1 2224774478 PPSWUKPPLQUASR-SNVBAGLBSA-N 428.577 4.871 50 10 IJGE Clc1cccc(CBr)c1OCCOCCOCCOCc1ccccc1 2227770429 FVPOXUPMQPWZGI-UHFFFAOYSA-N 443.765 4.864 50 10 IJGE CC(C)N(C[C@@H](C)Br)C(=O)c1ccc(Cl)c(I)c1 2256381983 IJIKVLPNRXJNJW-SECBINFHSA-N 444.538 4.579 50 10 IJGE COc1ccc([C@@H](Br)[C@@]23C[C@@H](CO2)C3(C)C)cc1I 2273463126 RCIQHGULUXMZDW-PSOPSSQASA-N 437.115 4.551 50 10 IJGE C[C@H]1CC[C@@H](CBr)N(C(=O)c2cc(Br)c(F)cc2Cl)C1 2285960290 UJMDLTRKCBQDQY-IUCAKERBSA-N 427.539 4.877 50 10 IJGE COc1c(Br)cc(Cl)cc1[C@@H](Br)[C@@H]1OCCOC1(C)C 2295368542 WQWIERXLGGVOSH-YPMHNXCESA-N 428.548 4.741 50 10 IJGE CCO[C@@H]1[C@H](Br)C[C@H]1Oc1cc(Br)cc(Br)c1 2301115261 OJKRTZOZDJPANW-IJLUTSLNSA-N 428.946 4.531 50 10 IJGE C[P@]1(=O)C[C@@H](Br)[C@@H](Cc2ccc(Cl)cc2I)C1 2302317565 ITUPSIVKAOXVAK-VKHBWIJISA-N 447.478 4.873 50 10 IJGE ClC[C@H]1CCC[C@@H]1CNCc1ccc(I)c(Br)c1 2325211810 LWDDGTDZDGXXTE-VXGBXAGGSA-N 442.566 4.798 50 10 IJGE C[C@@H]1CN(Cc2cc(I)ccc2Cl)CC[C@H]1CBr 2327402341 WBTNIRUTAPOIAH-MNOVXSKESA-N 442.566 4.798 50 10 IJGE CS(=O)(=O)c1cccc([C@H](Cl)c2sc(Cl)cc2I)c1 2338562945 HGIBFUQUKYUSRT-NSHDSACASA-N 447.146 4.738 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CN(C[C@]2(CBr)CC2(F)F)C2CC2)CC1 2351887860 RJJLWFAYDGAKIG-GOSISDBHSA-N 437.369 4.518 50 10 IJGE Fc1c(Br)cc(Cl)c([C@H](Cl)[C@@H]2CO[C@H]3COC[C@H]23)c1Br 2362230956 CGCKSJGRCGDCIN-WUGHWKQCSA-N 448.941 4.945 50 10 IJGE CC[C@@H](Oc1ccccc1[C@H](C)CC)C(=O)NNC(=O)COc1ccc(C(C)C)cc1 10682459 OYAXSZSZAUYTMM-XMSQKQJNSA-N 426.557 4.707 50 10 IJGE N#C/C(=C\c1ccc(OCc2ccc(F)cc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1O 12556036 JKSFCHKLLAOHDC-GZTJUZNOSA-N 433.395 4.564 50 10 IJGE O=C(CCCc1nc2ccccc2s1)NNC(=O)COc1ccccc1-c1ccccc1 17202030 BXBFZQGMQZTSLK-UHFFFAOYSA-N 445.544 4.512 50 10 IJGE CCCNC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccc(-c3ccccc3)cc1)CCC2 40822653 AIIHWVGGLFEPBF-SGWCAAJKSA-N 429.520 4.865 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H](I)[C@@H](O[C@@H]2C[C@H]3CC[C@@]2(C)C3(C)C)C1 303741836 PZNCMNCMCWAADV-QHGRHRLRSA-N 449.373 4.641 50 10 IJGE C[C@](CI)(OCCOCC1CC1)c1ccccc1Br 400748305 GNLHHKBVZCZHMC-OAHLLOKOSA-N 439.131 4.543 50 10 IJGE CCN(C[C@](C)(CI)O[C@H]1CC[C@H](C)C1)C(=O)OC(C)(C)C 721536061 NPTTWALUUPWSIT-ZQIUZPCESA-N 425.351 4.642 50 10 IJGE Cc1cc(/C=C(\C#N)C(=O)N2[C@H]3CC[C@H]2CC(O)C3)c(C)n1-c1cccc(C(F)(F)F)c1 736187010 OMZZOGOXQHKKPL-QIMVITRWSA-N 443.469 4.534 50 10 IJGE COc1ccc(C[C@@H](NC(=O)NNc2cccc(F)c2F)c2ccccc2)cc1OC 745800720 MWWPZLQTDWWULZ-LJQANCHMSA-N 427.451 4.592 50 10 IJGE CC(C)(C)OC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2ccccc2Br)cc1 764885437 KBPRWZLDKAHADP-FOWTUZBSSA-N 427.298 4.950 50 10 IJGE Cc1ccc(-n2c(C)c(Br)c(C=NNC(=O)c3ccccc3O)c2C)c(C)c1 1084475733 BVTBVWILFYYEPO-UHFFFAOYSA-N 440.341 4.943 50 10 IJGE Cc1c(C(=O)Nc2ccccc2Cl)oc2c1C(=NNC(=O)Cc1ccccc1)CCC2 1772747992 HKMTVOKBOAHYEI-UHFFFAOYSA-N 435.911 4.893 50 10 IJGE N#C/C(=C\c1cccc(F)c1)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 1866366380 CMVKPQHFEIVAJP-HKOYGPOVSA-N 425.507 4.666 50 10 IJGE CCC[C@@H](NC(=O)[C@@H](c1ccc(OC)cc1)C(C)C)C(=O)Nc1ccc(SC#N)cc1 1866981850 YZKHKPSNNKPEGN-FGZHOGPDSA-N 439.581 4.932 50 10 IJGE CSCC[C@@H](NC(=O)c1sc(C)nc1C(C)C)C(=O)Nc1ccc(SC#N)cc1 1867156026 BEQJXSMKDGZGKB-MRXNPFEDSA-N 448.639 4.638 50 10 IJGE CC(C)(C)OC(=O)N[C@H](CBr)[C@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C(C)(C)C 1882801451 WGQDYHJAJJVWCG-RBSFLKMASA-N 449.430 4.946 50 10 IJGE CN(C[C@H]1C[C@H](Br)C1)C(=O)CCC1(NC(=O)OC(C)(C)C)CCCCC1 1887829263 HRRWEGMQXZAFIT-WKILWMFISA-N 431.415 4.626 50 10 IJGE CN(CC(C)(C)CI)C1(CNC(=O)OC(C)(C)C)CCCCC1 1904653846 QJJQMVXLCBJMJF-UHFFFAOYSA-N 438.394 4.607 50 10 IJGE C[C@@H](CCBr)N(Cc1ccccc1)S(=O)(=O)c1cccc2cnccc12 1915095135 SDARCXYDDOVCKA-INIZCTEOSA-N 433.371 4.599 50 10 IJGE CC1(C)CN(C(=O)c2cc(Br)c(Br)s2)[C@H]1CBr 1944083960 DNELKMUMPHAWCE-QMMMGPOBSA-N 446.002 4.519 50 10 IJGE CC[C@H](CCCBr)NC(=O)c1cc(Br)c(Br)s1 1948445269 OMTPHUUNVLKCPI-SSDOTTSWSA-N 448.018 4.957 50 10 IJGE CN(Cc1cc(Cl)ccc1I)C[C@H]1C[C@H](Br)C1 2020201616 NFUGLHXUGDQHRS-HOMQSWHASA-N 428.539 4.550 50 10 IJGE O=Cc1cc(Br)c(OC[C@H]2C[C@@H](Br)C2)c(Br)c1 2020214116 QHNZMWCLORIAPF-DTORHVGOSA-N 426.930 4.576 50 10 IJGE C[C@]1(CCBr)CCN1Cc1cc(Cl)ccc1I 2025218687 LXCHDGJIHRPXPL-ZDUSSCGKSA-N 428.539 4.694 50 10 IJGE C[C@H]1C[C@H]1N(CCBr)Cc1ccc(I)c(Cl)c1 2026563361 JISYQLMFZPPKNE-TVQRCGJNSA-N 428.539 4.550 50 10 IJGE Brc1cccc(C[C@H]2CN(C3CC3)C[C@@H]2Br)c1Br 2039252293 WKPJZLFORHUVLW-GWCFXTLKSA-N 438.001 4.612 50 10 IJGE CCOC(C)(C)CO[C@@](C)(CI)c1ccccc1Br 2094181177 JNTOXSNYPNPUJU-HNNXBMFYSA-N 441.147 4.931 50 10 IJGE O=C(NC[C@]1(CCl)CC12CCC2)c1scc(Br)c1Br 2097910371 VZUFWIPLCPXORU-CYBMUJFWSA-N 427.589 4.802 50 10 IJGE CCC[C@H](CCBr)CNC(=O)c1ccc(I)c(C)c1 2142108090 UXPHQEJZPVZUHK-GFCCVEGCSA-N 438.147 4.531 50 10 IJGE O=C(NC[C@]12CCC[C@@]1(CCl)C2)c1scc(Br)c1Br 2142937694 SHSSBUPYVMCQPO-QWHCGFSZSA-N 427.589 4.802 50 10 IJGE Cn1nc([C@H](Br)c2cc(Br)cc3c2OCC3)c(Cl)c1Cl 2150718617 PHJFVRSBHOELFP-SECBINFHSA-N 440.950 4.909 50 10 IJGE CC(C)CN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@H](Br)C1CCCC1 2167030587 CTECFFVGNHWKQK-QZTJIDSGSA-N 445.442 4.824 50 10 IJGE COCCN(C)C[C@H](Br)CCc1cc(Cl)c(C)c(Br)c1 2167384900 RGDLYRRKMPIVOD-CYBMUJFWSA-N 427.608 4.685 50 10 IJGE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H]1CN(Cc3ccc(CBr)cc3)C[C@@H]21 2182844636 GUFIHUOWYUAMRY-FYQPLNBISA-N 435.406 4.659 50 10 IJGE ClCc1nc2cnccc2n1-c1ccc(Br)cc1I 2231445550 GRVSVSNPBZNTED-UHFFFAOYSA-N 448.489 4.526 50 10 IJGE O=C(N[C@H](CBr)C1CCCC1)c1cc(F)c(Br)cc1Cl 2282973110 YLINLVQQWKWFAX-CYBMUJFWSA-N 427.539 4.925 50 10 IJGE CCOc1cc(C=C(C#N)c2nc3ccccc3[nH]2)cc(Br)c1OC(C)=O 2297577998 SSLOKLOQUXPWDP-UHFFFAOYSA-N 426.270 4.714 50 10 IJGE COCCOC(=O)C(C#N)=Cc1cc(Br)c(Sc2ccc(Cl)cc2)o1 2297620299 ZWNQMOFILOZNAE-UHFFFAOYSA-N 442.718 4.943 50 10 IJGE C[C@H](Br)[C@@H]1CCCN1Cc1ccc(Cl)c(I)c1 2300238730 OJYYZBVFAARIMT-ZANVPECISA-N 428.539 4.692 50 10 IJGE Cn1cc(I)c(C[C@H]2CCCCCCC[C@@H]2Br)n1 2319223061 JGKIONGHLUQFTK-NEPJUHHUSA-N 425.152 4.691 50 10 IJGE CC(C)(C)OC(=O)NCC[C@H]1CCN(C[C@H]2C[C@H](Br)C2)[C@H](C(F)(F)F)C1 2337681803 BGHUALQPXGHHBK-AJNGGQMLSA-N 443.348 4.718 50 10 IJGE CC1(C)COC[C@H]1CO[C@H](CI)c1cccc(Br)c1 2339010722 NBGQSHKRMZNXSD-GXTWGEPZSA-N 439.131 4.614 50 10 IJGE Cc1scc(C(=O)NC[C@@]2(CBr)C[C@@H]2C(F)(F)F)c1Br 2369609015 URXLQGWMEIUWQS-KWQFWETISA-N 435.103 4.512 50 10 IJGE COc1ccc(/C=C(/C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1OCc1ccccc1 33344051 NADHNTWBKFDHFX-WQRHYEAKSA-N 447.422 4.867 50 10 IJGE C[C@](CBr)(NS(=O)(=O)c1cc(Cl)sc1Cl)c1ccccc1 134455488 FCLNWWJRQRMXCD-CYBMUJFWSA-N 429.188 4.644 50 10 IJGE Cc1ccccc1C(CBr)(CBr)Cc1cn2ccsc2n1 149647070 XZBJYKGSVPYBCO-UHFFFAOYSA-N 428.193 4.975 50 10 IJGE CSCCCCn1c(CCCl)nc2cc(I)c(F)cc21 229325499 SPUIVTFQQKOPAM-UHFFFAOYSA-N 426.726 4.705 50 10 IJGE CC(CC(=O)NC12CC3CC(CC(C3)C1)C2)=NNC(=O)c1ccc(-c2ccccc2)cc1 252462996 YBSKYOYGNJADAL-UHFFFAOYSA-N 429.564 4.934 50 10 IJGE CCN(C[C@@](C)(CBr)OC(C(F)(F)F)C(F)(F)F)C(=O)OC(C)(C)C 305755275 FIPSFEZRTPEKDX-GFCCVEGCSA-N 446.226 4.907 50 10 IJGE CC[C@H](Cl)[C@@H](CC)NC(=O)c1cc(I)ccc1Br 313087026 CFOIEXDZUFMYCF-NWDGAFQWSA-N 444.538 4.580 50 10 IJGE CC(C)(C)[C@H](Br)CNC(=O)c1cc(Br)sc1Br 324648334 ZRGJZDIVZKYDRJ-SSDOTTSWSA-N 448.018 4.813 50 10 IJGE ClCc1cc(Br)ccc1N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21 404217738 ZZKJOLZJFHESES-LEWJYISDSA-N 435.793 4.668 50 10 IJGE FC(F)Oc1cc(CBr)c(C(F)(F)F)cc1I 575722805 GORZYWHIDAKSKB-UHFFFAOYSA-N 430.936 4.806 50 10 IJGE COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)c1C 726766099 LFZADOHQPNNBQO-XYHOIZSOSA-N 444.539 4.521 50 10 IJGE Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)NNC(=O)c1cccc2cccnc12 736656982 NGADHPTYUMTYBM-FQEVSTJZSA-N 430.533 4.533 50 10 IJGE Cc1c(NC(=O)/C(C#N)=C\c2cn(CCC#N)nc2-c2ccccc2)cnn1-c1ccccc1 772728091 GTLNQTNORBBCBP-QNGOZBTKSA-N 447.502 4.504 50 10 IJGE N#Cc1ccc(NNC(=O)c2cccc(NC(=O)C3CCCCC3)c2)c(C(F)(F)F)c1 799750237 AOCVEXUNFLSNOI-UHFFFAOYSA-N 430.430 4.853 50 10 IJGE CC(C)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCN(C[C@@H](CBr)C1CC1)CC2 1620662412 CZYYAPRTVHMBBW-MSOLQXFVSA-N 429.443 4.765 50 10 IJGE C=CC[C@H](NC(=O)NNc1cc(C(F)(F)F)ccc1Br)c1ccncc1 1669192532 RSOWIDFMTNUUPH-AWEZNQCLSA-N 429.240 4.806 50 10 IJGE CCOC(=O)c1c(NC(=O)NN=Cc2c(Cl)cccc2Cl)sc2c1CCC2 1772752961 BGIWDRCVQQAIQB-UHFFFAOYSA-N 426.325 4.876 50 10 IJGE COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(C(F)(F)F)nn2-c1ccc(Cl)cc1 1865709885 JIXCKLNIVPKEIY-MRXNPFEDSA-N 446.816 4.771 50 10 IJGE Cc1c(Br)c(CN(Cc2ccccc2)[C@H](CBr)C(C)C)nn1C 1915308764 HRZIKZBZQRFRQK-QGZVFWFLSA-N 443.227 4.913 50 10 IJGE BrCC[C@@H](NCc1c(Br)cccc1Br)C1CC1 1945321878 JDXNEFCJGHHUET-CYBMUJFWSA-N 425.990 4.865 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(O[C@@H]2CC[C@@H]3CC[C@H]2C3)CC1 1947120051 HEGKHKYJVNIWRZ-HRCADAONSA-N 449.373 4.786 50 10 IJGE COc1cc(C(=O)N(Cc2ccccc2)[C@@H](C)CBr)ccc1Br 1989502587 RWWYXVXUKORORW-ZDUSSCGKSA-N 441.163 4.884 50 10 IJGE C[C@H](NC(=O)c1cc(Br)ccc1Br)C(C)(C)CBr 2030077688 CWFFSNFOJWSKEE-QMMMGPOBSA-N 441.989 4.751 50 10 IJGE O=C(c1cccc(Br)c1Br)N1CCCC[C@H]1CBr 2031486374 MPLBKXJZUDITSO-VIFPVBQESA-N 439.973 4.601 50 10 IJGE CC[C@H](C[C@H](C)Cl)NC(=O)c1ccc(Br)cc1I 2086153558 LWMOJSVLACSKGQ-WCBMZHEXSA-N 444.538 4.580 50 10 IJGE Cc1cccc(C(=O)N[C@H](C)CCCCCI)c1Br 2117894912 NVTDNWZKYUETDG-GFCCVEGCSA-N 438.147 4.871 50 10 IJGE Cc1c(Br)cnc2c1nc(CCCl)n2C[C@@H](C)N(C)Cc1ccccc1 2128514145 XGXACBWRUAQEEY-CQSZACIVSA-N 435.797 4.804 50 10 IJGE CN(CC1CC(Br)C1)C(=O)[C@@]12CCCC[C@H]1N(C(=O)OC(C)(C)C)CCC2 2196915341 XNCUVYRKTWJXTN-YPHMPPRQSA-N 443.426 4.578 50 10 IJGE CN(C(=O)c1ccc(Cl)c(I)c1)[C@H]1CCCCC[C@@H]1Cl 2283657064 RPSMJLBMVZELPF-JSGCOSHPSA-N 426.125 4.957 50 10 IJGE COC(=O)C(C#N)=Cc1ccc(OC)c(CSc2nc(C(F)(F)F)cc(C)c2C#N)c1 2295635809 NGJHUWNHEGQZMC-UHFFFAOYSA-N 447.438 4.661 50 10 IJGE CC(C)(C)OC(=O)N1CCC(CI)(OC[C@@H]2C[C@@H]3CC[C@H]2C3)CC1 2298753041 MQBZJHLDDCTMJW-PMPSAXMXSA-N 449.373 4.644 50 10 IJGE BrC[C@H]1[C@@H]2CC[C@@H](C2)N1Cc1cc(Br)ccc1Br 2310105571 OHLOEUCHIOUNIH-LQJRIPTKSA-N 438.001 4.959 50 10 IJGE Cn1cnc(Br)c1[C@H](Br)c1cc(F)c(Br)cc1F 2315598587 CMSAGPXRJZYKJI-SECBINFHSA-N 444.899 4.708 50 10 IJGE C[C@@H](c1ccccn1)[C@@H](Br)c1c(Br)c(Br)nn1C 2316718524 USXNRZFXXBFURM-IONNQARKSA-N 437.961 4.580 50 10 IJGE COc1ccc(CC(=O)Oc2cccc(C=C(C#N)c3ccccc3OC)c2)cc1OC 2318356279 KYPJEQBEBSUPAF-UHFFFAOYSA-N 429.472 4.925 50 10 IJGE COc1cc(C=NNC(=O)Cc2ccc(Cl)cc2)cc(Br)c1OC(C)C 2318415950 YKQXFRJFRGOLGF-UHFFFAOYSA-N 439.737 4.591 50 10 IJGE CC(C)Oc1c(Cl)cc(C=NNC(=O)c2cc(-c3ccccc3)nc(O)n2)cc1Cl 2323693781 VXLGFNVEJDKJGL-UHFFFAOYSA-N 445.306 4.707 50 10 IJGE CCc1cccc(CC)c1NC(=O)C(C#N)=CNc1ccc(I)cc1 2325129283 HWPLCGGACBPCCW-UHFFFAOYSA-N 445.304 4.874 50 10 IJGE Cl[C@@H]1CC[C@@H]2CN(Cc3ccc(I)c(Br)c3)C[C@H]21 2325225838 JMRVQLIJBAFJBH-NQBHXWOUSA-N 440.550 4.503 50 10 IJGE CN(Cc1cc(I)ccc1Cl)[C@H](CCCl)C(F)(F)F 2352414365 SRQCYKYOCAAJPH-LLVKDONJSA-N 426.047 4.936 50 10 IJGE O=C(N[C@H]1C[C@@H]2C[C@H]1C[C@H]2Br)c1cc(Br)c(F)cc1Cl 2359509199 RNXRPZWAXXDHIE-FWAJVQJESA-N 425.523 4.533 50 10 IJGE COc1ccccc1NC(=O)c1oc2c(c1C)/C(=N/NC(=O)c1ccccc1C)CCC2 40811533 RXSPZIMYCOTQJS-ZXVVBBHZSA-N 431.492 4.628 50 10 IJGE O=[N+]([O-])c1cc(Br)c(OCC2(CBr)CC2)c(Br)c1 96870987 QHYYKLKUAWQUBM-UHFFFAOYSA-N 443.917 4.674 50 10 IJGE C=CCNC(=O)/C(C#N)=C1\S[C@H](Cc2ccc(F)cc2)C(=O)N1c1ccc(C(C)C)cc1 101241545 LSAXYUNWLIDAHU-CKVBZJJFSA-N 449.551 4.678 50 10 IJGE CC(C)(C)OC(=O)N1CCC[C@@](CI)(OCC2CCCCC2)C1 231315622 KWCJJEKWKKFOND-SFHVURJKSA-N 437.362 4.788 50 10 IJGE COc1cc(OC)c(C=NNC(=O)c2ccc(Cl)cc2Cl)cc1Br 252460490 FUYMCNVPRPHFJR-UHFFFAOYSA-N 432.101 4.537 50 10 IJGE COCc1nc(-c2cc(I)ccc2Br)oc1CCl 401254347 FSYZKYBYRMNTCG-UHFFFAOYSA-N 442.478 4.594 50 10 IJGE Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@@H]1C[C@H]1c1cccc2ccccc12 730768280 BONFQGCIHCVTTE-LEWJYISDSA-N 427.529 4.836 50 10 IJGE C[C@@H]1CCN(C(=O)C(=O)Nc2ccc(S(F)(F)(F)(F)F)cc2)C[C@H]1n1ccnc1 773405391 BCAPAELPHHFUSG-IUODEOHRSA-N 438.422 4.589 50 10 IJGE Cc1nc(-c2ccccn2)nc(NNC(=O)c2cc(OCc3ccccc3)cs2)c1C 1160812973 QZIAMLAFYSSEOW-UHFFFAOYSA-N 431.521 4.553 50 10 IJGE C#CC[C@@H](CCOC)NC(=O)/C(C#N)=C/c1cc(C)n(-c2cc(Cl)ccc2Cl)c1C 1623648922 HAUDEWRLWRZKPF-YWFITGJYSA-N 444.362 4.853 50 10 IJGE CCCNC(=O)c1oc2c(c1C)C(=NNC(=O)C(c1ccccc1)c1ccccc1)CCC2 1772747361 AZMIPYGNCIFWBM-UHFFFAOYSA-N 443.547 4.717 50 10 IJGE Cc1nn(Cc2ccc(F)cc2)c2c1[C@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 1865685371 IMDZWFGMHWUMCH-LJQANCHMSA-N 429.282 4.904 50 10 IJGE CN(C(=O)OC(C)(C)C)C1CCC([C@H](CBr)NC(=O)OC(C)(C)C)CC1 1880762077 SFMFSMXMWDLPAK-NRXISQOPSA-N 435.403 4.700 50 10 IJGE CO[C@H]1C[C@H]1COc1c(Br)cc(CBr)cc1Br 2014581953 HSHPSIFXDNPUJS-KWQFWETISA-N 428.946 4.520 50 10 IJGE C[C@H]1[C@H](Br)CCCN1C(=O)c1cccc(Br)c1Br 2031480519 WKFSONRPLBIPCR-WCBMZHEXSA-N 439.973 4.600 50 10 IJGE Cn1nc(COc2ccc(Cl)cc2CBr)c(Br)c1Cl 2096688394 KVIIJABPBZPBOT-UHFFFAOYSA-N 428.939 4.963 50 10 IJGE Cc1nc2c(cc1Br)nc(CCl)n2C[C@H]1CCCN1Cc1ccccc1 2096812058 MCVOTISWWDORHC-MRXNPFEDSA-N 433.781 4.906 50 10 IJGE Cc1ccc(Br)c(C(=O)N[C@H](C)CCCCCI)c1 2117895046 OTSCVECUVSLRAC-GFCCVEGCSA-N 438.147 4.871 50 10 IJGE C[C@@H](NC(=O)OC(C)(C)C)c1csc(NC(=O)c2ccc(CBr)cc2)n1 2138367109 XRIBBGUBMGBTNR-LLVKDONJSA-N 440.363 4.876 50 10 IJGE O=S(=O)(c1cc(CCl)ccc1Cl)N(Cc1ccccc1)CC1CCOCC1 2152167991 IFNSNTZCKPUIHW-UHFFFAOYSA-N 428.381 4.696 50 10 IJGE CC[C@@H]1CCCCN(S(=O)(=O)c2cc(CBr)sc2Br)C1 2179787781 UEHDGYAHWXWYOB-SNVBAGLBSA-N 445.242 4.606 50 10 IJGE FC(F)(F)[C@@H]1CN(Cc2ccccc2)CCN1C[C@@H](CBr)c1ccccc1 2186713863 ZTKJZKVCJARYFS-UXHICEINSA-N 441.335 4.914 50 10 IJGE C[C@@H]1[C@H](NC(=O)OC(C)(C)C)CC[C@H](C(=O)N(C)C[C@H]2C[C@@H](Br)C2)C1(C)C 2196913591 DZNBBBUSGFIMGW-NQNKBUKLSA-N 445.442 4.584 50 10 IJGE C[C@@H](Cl)c1nc2cc(Br)c(Br)cc2n1Cc1cnsn1 2234067808 NQNGLPCSVVWXQU-ZCFIWIBFSA-N 436.560 4.761 50 10 IJGE CC1CC(CBr)(CN2C[C@]34CCC[C@@]3(C2)CN(C(=O)OC(C)(C)C)C4)C1 2265307629 IOWITXGPBGZGBW-LYEIGVQKSA-N 427.427 4.521 50 10 IJGE Cc1cccc(O[C@@H]2C[C@@H](Br)[C@H]2OCC(C)C)c1I 2277946476 CGCURKNDODTQLK-UXIGCNINSA-N 439.131 4.555 50 10 IJGE O=C(c1cc(F)c(Br)cc1Cl)N1C[C@H](Br)CC2(CC2)C1 2282978355 MCXHYYQTJVDUJF-MRVPVSSYSA-N 425.523 4.631 50 10 IJGE COc1cc(C=C(C#N)C(=O)NCc2ccccc2)ccc1OC(=O)C=Cc1ccccc1 2314737037 IITXKELITKHLJZ-UHFFFAOYSA-N 438.483 4.537 50 10 IJGE COc1cc(C=C(C#N)c2ccccc2OC)ccc1OC(=O)c1cccc(NC(C)=O)c1 2320506841 SQBNKDSNGVRQSZ-UHFFFAOYSA-N 442.471 4.946 50 10 IJGE CC(C)C[C@@H](CBr)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1CC(F)F 2328525234 HGQLULMRAWFRLU-LSDHHAIUSA-N 427.374 4.620 50 10 IJGE CN(CC[C@H](Br)c1cccs1)C(=O)Cc1cnn(Cc2ccccc2)c1 2340653044 MXFKAHUMEARGBG-SFHVURJKSA-N 432.387 4.520 50 10 IJGE