smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features N#CC(C(=O)COC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)=C1Nc2ccccc2N1 3279681 NIGJNDFCRNLPLP-JXMROGBWSA-N 390.355 2.993 50 40 GFGB Cc1cc2c(c(=O)n1Cc1cccnc1)[C@H](c1cccs1)C(C#N)=C(N)O2 17359849 QPTAUHWRVUFYIB-KRWDZBQOSA-N 376.441 2.880 50 40 GFGB Cc1c(C(=O)N/N=C/c2ccc(OCC(=O)NC(C)C)cc2)cccc1[N+](=O)[O-] 28215598 XILHXNLWINSEOI-SRZZPIQSSA-N 398.419 2.571 50 40 GFGB COc1cccc(/C=N/NC(=O)c2ccc(Cl)cc2)c1O[C@H](C)C(=O)O 409236839 GEQHLMPLZGIQLK-JZOCJUILSA-N 376.796 2.964 50 40 GFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2cc(Cl)cc([N+](=O)[O-])c2O)n1 8336654 PVEXQQWTIHDFMG-UBKPWBPPSA-N 395.828 2.603 50 40 GFGB C=CCOC(=O)C1=C(C)NC(SCC(N)=O)=C(C#N)[C@H]1c1ccc(C)cc1 100849743 BTFMMMYEMRSVRK-GOSISDBHSA-N 383.473 2.639 50 40 GFGB CCCNC(=O)N(NC(=O)NC1CCCCC1)c1nc(C(=O)OCC)cs1 5243465 IUAZLFWAXYXKER-UHFFFAOYSA-N 397.501 2.793 50 40 GFGB CCOc1ccc(NC(=S)NNC(=O)c2ccc3nc(N)sc3c2)cc1 6623518 GLDUGBXUAIWHDZ-UHFFFAOYSA-N 387.490 2.909 50 40 GFGB COc1ccc([C@@H](C)c2cc3c(cc2OC/C(C)=N/NC(N)=O)OCO3)cc1 5766581 JDFMUFLXSNRXNM-UMYHVIPVSA-N 385.420 2.999 50 40 GFGB O=C(CN1CCOCC1)N/N=C/c1ccc(OCc2ccc(Cl)cc2)cc1 19797789 FHYNVQNKMJNINF-LPYMAVHISA-N 387.867 2.701 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)CC(=O)NC2CCCCC2)cc1OCC 5464388 BQZOLPXWWMTGEM-PXLXIMEGSA-N 387.480 2.939 50 40 GFGB COc1ccc2[nH]c(=O)c([C@H]3C(C#N)=C(N)OC4=C3C(=O)CC(C)(C)C4)cc2c1 876545 RSABNHYLSVMTJT-SFHVURJKSA-N 391.427 2.988 50 40 GFGB O=C(NNC(=O)c1cc(C2CC2)nn1-c1ccccc1)c1ccc2c(c1)OCO2 12911080 RMUXXOWJTMDADQ-UHFFFAOYSA-N 390.399 2.553 50 40 GFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccccc1Cl 28772398 FCJACGVCPFEFLF-NSHDSACASA-N 392.242 2.808 50 40 GFGB CCOC(=O)[C@@H]1CCC/C1=N\NC(=O)CSCc1ccc([N+](=O)[O-])cc1 408719228 AFSPWWYBNHRANJ-GBUWSYLDSA-N 379.438 2.663 50 40 GFGB C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc(F)cc3F)cc2C1 7403159 YSGPDGOUOGJGEX-SECBINFHSA-N 386.445 2.774 50 40 GFGB O=C(CNC(=O)c1ccccc1Br)N/N=C/c1ccc(Cl)cc1 3149986 PMQOGLWOOWNYRI-AWQFTUOYSA-N 394.656 2.983 50 40 GFGB Cc1ccc(NC(=O)NNS(=O)(=O)c2ccc(Br)cc2)cc1 675956 NLSXTEFVNBQKPV-UHFFFAOYSA-N 384.255 2.773 50 40 GFGB aggregator CC(C)CCN1C(=O)/C(=N\NC(=O)COc2ccc(C#N)cc2)c2ccccc21 6459351 FQJKXNZCULGTJS-DAFNUICNSA-N 390.443 2.850 50 40 GFGB CSc1ncc(Cl)c(C(=O)NNC(=O)c2cc3ccccc3cc2O)n1 28287147 NCTSEMYVEPITAB-UHFFFAOYSA-N 388.836 2.786 50 40 GFGB CCN(CC)Cc1ccc(C(=O)NNC(=O)c2oc(Br)cc2C)o1 48309581 PBNBHAKOKVIROD-UHFFFAOYSA-N 398.257 2.860 50 40 GFGB O=C(NNC(=O)c1ccccc1NC(=O)c1ccco1)c1ccc([N+](=O)[O-])cc1 17394546 PSSADEKLHYDXMZ-UHFFFAOYSA-N 394.343 2.515 50 40 GFGB COc1ccccc1C(=O)N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O 5918803 ARLIVRWLCANSCR-CAOOACKPSA-N 394.181 2.835 50 40 GFGB CCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2Br)cc1 59435815 JASRRAKDAXZFBS-YBFXNURJSA-N 390.237 2.937 50 40 GFGB Cc1cccc(C)c1OCC(=O)NNC(=O)CSc1nc2ccccc2o1 6602413 DDRYEBVBRLYARL-UHFFFAOYSA-N 385.445 2.763 50 40 GFGB Cc1nn(-c2ccccc2)c(C)c1/C=N/NC(=O)[C@H]1COc2ccccc2O1 6279798 DGBBSJSDWQOYAV-XLKWYTADSA-N 376.416 2.779 50 40 GFGB C/C(CC(=O)Nc1ccc(Br)cc1)=N\NC(=O)c1ccccn1 4671841 YFJUDEFJAGMJGL-RGVLZGJSSA-N 375.226 2.979 50 40 GFGB N#CCC(=O)N/N=C(\CNC(=O)c1ccccc1Br)c1ccccc1 18191624 OQQLEYBIPFFNMS-CJLVFECKSA-N 399.248 2.613 50 40 GFGB O=C(CCC1CCCCC1)NNC(=O)CCN1CCN(c2ccccc2)CC1 8777375 BKDDMLYZHKFZTE-UHFFFAOYSA-N 386.540 2.707 50 40 GFGB CCOc1ccc(CC(=O)N/N=C\c2cc([N+](=O)[O-])c(OC)cc2OC)cc1 408712080 YPIUNTJCJDWUPZ-NDENLUEZSA-N 387.392 2.704 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)NCc2ccco2)cc(Br)c1O 5069165 YTGABNOVCMNXPB-VZUCSPMQSA-N 377.194 2.980 50 40 GFGB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)NNC(=O)c1ccc(Cl)cc1 3250315 MCQICSLFYAZFOD-JTQLQIEISA-N 392.799 2.518 50 40 GFGB COc1ccc(C)cc1N(CC(=O)NN=C(C)C)S(=O)(=O)c1ccccc1 19926340 JAFBRJCNOMCZME-UHFFFAOYSA-N 389.477 2.711 50 40 GFGB Nc1nn2cccnc2c1[P+](c1ccccc1)(c1ccccc1)c1ccccc1 100679574 KOZHRZKYUJXDDA-UHFFFAOYSA-N 395.426 2.931 50 40 GFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)COc2ccccc2C)cc1 4697775 JUMZLFNGLHCNGO-XQNSMLJCSA-N 383.448 2.581 50 40 GFGB Cc1ccccc1SCC(=O)NNC(=O)c1cncn1-c1ccc(F)cc1 6509315 WIRVHVVWTJFHSS-UHFFFAOYSA-N 384.436 2.873 50 40 GFGB COc1cccc(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)c1O 3059273 GXABVORIIFNIJB-ZVBGSRNCSA-N 381.310 2.508 50 40 GFGB CC[C@H](C)NC(=S)NNC(=O)c1cc(C2CC2)nc2c1c(C1CC1)nn2C 17078980 GFKODDKRVTYXDB-JTQLQIEISA-N 386.525 2.631 50 40 GFGB O=C(Cc1ccc2c(c1)OCCO2)N/N=C\c1ccc(Cl)c([N+](=O)[O-])c1 409366557 WCQMYTGURFPUFI-GRSHGNNSSA-N 375.768 2.712 50 40 GFGB COc1ccc(Br)cc1/C=N/NC(=O)[C@@H]1COc2ccccc2O1 835619 FQUWLVOYGLDXAP-ARFNDINWSA-N 391.221 2.748 50 40 GFGB N#C/C(=C/c1ccc(-c2cccc(Cl)c2)o1)C(=O)N[C@H]1CCS(=O)(=O)C1 5944286 LMOLFTVPLBIKDT-CTXBLAANSA-N 390.848 2.810 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C\c2cc([N+](=O)[O-])c(OC)cc2OC)cc1 408817942 MLOOUXJRYMMTME-NVNXTCNLSA-N 397.387 2.844 50 40 GFGB CNC(=O)C(=O)N/N=C/c1cccc(OCc2ccc(Cl)cc2Cl)c1 408608791 IQAXEPOSHKCPAW-ZVBGSRNCSA-N 380.231 2.769 50 40 GFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)Nc2ccc3c(c2)OCCO3)cc1 100522769 ZIWCQSQNODOBRX-LPYMAVHISA-N 383.404 2.601 50 40 GFGB COc1ccc(OC(C)=O)c(/C=N/NC(=O)COc2ccc(Cl)cc2)c1 1051676 GUQUQQOGQASSDD-KEBDBYFISA-N 376.796 2.803 50 40 GFGB O=C(CSc1nc2ccccc2s1)NNC(=O)c1cccc([N+](=O)[O-])c1 3249158 WTNABORJJXYHTC-UHFFFAOYSA-N 388.430 2.758 50 40 GFGB O=C(Cc1c(F)cccc1Cl)NNC(=S)Nc1ccc([N+](=O)[O-])cc1 6402250 NEGRFJSRIMAUHR-UHFFFAOYSA-N 382.804 2.948 50 40 GFGB COc1ccc2ccccc2c1/C=N\NC(=O)[C@@H]1C(=O)NC[C@@H]1c1ccccc1 4871435 PADFYJZDWRBMDP-PAFYCRNLSA-N 387.439 2.828 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C\c2cc(OC)c(OC)c(OC)c2)cc1 408812244 OBKCUOYXRUBWAK-SXGWCWSVSA-N 382.416 2.944 50 40 GFGB Cc1ccccc1C(=O)N1CCC(C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)CC1 409006024 LEHSVOVHLMEWNA-HYARGMPZSA-N 394.431 2.906 50 40 GFGB CC(C)COC(=O)[C@@H]1/C(=N/NC(=O)CC#N)C[C@](C)(O)C[C@@H]1c1ccccc1 100249105 CIPFSKNBWXNURT-ICVCJERQSA-N 385.464 2.516 50 40 GFGB CCOc1ccc(-c2cc(C(=O)N/N=C/c3ccc(O)cc3)[nH]n2)cc1OC 9374962 CFANDJKYUCHGBN-CIAFOILYSA-N 380.404 2.954 50 40 GFGB COc1cc([C@H]2C(C#N)=C(SCC(N)=O)N=C3CCCC(O)=C32)ccc1O 100086754 FIKZSZMYIVSHIN-KRWDZBQOSA-N 385.445 2.889 50 40 GFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(Br)cc3)[C@@H]2C1 12292229 USLDAJCEQPIJJC-IAGOWNOFSA-N 394.276 2.804 50 40 GFGB COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)NNC(=O)c1ccc(Cl)cc1 3250317 MCQICSLFYAZFOD-SNVBAGLBSA-N 392.799 2.518 50 40 GFGB Cc1cc2c(c(=O)n1CCO)[C@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 4851022 RJKZNENNOAYLDL-OAHLLOKOSA-N 392.242 2.674 50 40 GFGB COc1ccc(/C=C(/C#N)C(=O)NC[C@H]2CCCO2)cc1Cn1nc(C)cc1C 17080614 MSQVQITWZBPTJJ-JZVSFUAJSA-N 394.475 2.759 50 40 GFGB I[C@H]1[C@H]2[C@@H]3[C@@H]4C[C@@H]2[C@H]2[C@H]4[C@@H](I)[C@H]3[C@@H]21 261361230 NMQHCEGZBHEZIR-YYGSXOEPSA-N 398.025 2.981 50 40 GFGB CCCCCCC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2O)s1 408730547 HVECDSKAZOEUHK-XDHOZWIPSA-N 389.481 2.845 50 40 GFGB CCOC(=O)Cn1cc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21 409177483 BFVKREQJZRBZDT-SRZZPIQSSA-N 394.387 2.877 50 40 GFGB CCCOc1ccc(/C=N/NC(=O)C(=O)N2CCCCCC2)cc1OCC 59459708 SZFHISPLGCRABG-RCCKNPSSSA-N 375.469 2.727 50 40 GFGB CCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2Cl)c(OC)c1 9232167 PVLUUGQMRKBWBO-SSDVNMTOSA-N 389.839 2.514 50 40 GFGB Cn1c(SCC(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)nnc1-c1ccccc1 4311578 ZZBVANYRJHAXBQ-YBFXNURJSA-N 396.432 2.633 50 40 GFGB O=C(Cn1cnc2ccccc21)NNC(=S)Nc1ccc(F)c(Cl)c1 5268832 WDFJFXPJBLIIKM-UHFFFAOYSA-N 377.832 2.847 50 40 GFGB COc1ccc(CC(=O)NNC(=O)c2ccc(Br)s2)cc1OC 6559194 UKCDHYWZTZGHMZ-UHFFFAOYSA-N 399.266 2.532 50 40 GFGB COC(=O)c1ccc(OCC(=O)N/N=C/c2cccc(Br)c2)cc1 4903537 APLUEPJLVFBWDE-VXLYETTFSA-N 391.221 2.765 50 40 GFGB CCOc1cc([N+](=O)[O-])cc(/C=N\NC(=O)COc2cccc(C)c2C)c1O 30843169 GHTBAXFZCKMKDP-JMIUGGIZSA-N 387.392 2.845 50 40 GFGB O=C1N(CN2CCc3ccccc3C2)c2ccccc2[C@@]12OC[C@@H](CCl)O2 15218728 XEDFTGXKVQWEPB-UTKZUKDTSA-N 384.863 2.856 50 40 GFGB O=C(NN/C=C1\OC(=O)c2ccccc21)C(=O)Nc1ccc(Cl)cc1Cl 100329013 CURMSZRMSACVJN-ZSOIEALJSA-N 392.198 2.722 50 40 GFGB Cc1ccc(C)c(OCC(=O)NNC(=O)COc2ccc(Cl)cc2C)c1 6029097 HRFUYYQLHCJNHL-UHFFFAOYSA-N 376.840 2.870 50 40 GFGB COc1ccc(OCC(=O)N/N=C/c2ccccc2O)c(Br)c1 1435038 IAQXLKFGZPJBNA-GIJQJNRQSA-N 379.210 2.692 50 40 GFGB O=C(COc1ccc([N+](=O)[O-])cc1Br)N/N=C/c1ccc(O)cc1 4672077 XBDGKVXHYXYGOT-CAOOACKPSA-N 394.181 2.592 50 40 GFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1ccc2c(c1)OCO2)c1ccccc1 408980210 PVPHVDZUQCYXNH-GKXUUXLPSA-N 383.404 2.743 50 40 GFGB COc1ccc(CC(=O)N/N=C\c2ccc(OCC(=O)O)c(Cl)c2)cc1 408955559 YJLJAALJBIYUEK-JMIUGGIZSA-N 376.796 2.505 50 40 GFGB COc1cc(/C(C)=N\NC(=O)CSc2nc3ccccc3n2C)ccc1O 1293807 MMGDPFWGFVWVIB-MTJSOVHGSA-N 384.461 2.920 50 40 GFGB CCOC(=O)Cn1cc(/C=N/NC(=O)c2ccc(C#N)cc2F)c2ccccc21 977432 WGNHDBZSYQCIHE-BHGWPJFGSA-N 392.390 2.979 50 40 GFGB CCCS(=O)(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1 3316033 CHUAAEZUEMIOFC-UHFFFAOYSA-N 384.461 2.514 50 40 GFGB CCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NC(=O)NC(C)(C)C)c1C 3389778 QJPRDFRTFHYVAC-MHWRWJLKSA-N 388.468 2.589 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)cc1OC 4735383 SYEVQNYOQQVJEK-VXLYETTFSA-N 377.784 2.958 50 40 GFGB NC(=O)c1cc2ccccc2o/c1=N/NC(=O)c1cccc(Br)c1 33666713 OIKYCEQPXKZCLC-HEHNFIMWSA-N 386.205 2.540 50 40 GFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1cnnn1-c1ccccc1Cl 58015979 JUMZOAUGUOXIEH-UHFFFAOYSA-N 399.882 2.898 50 40 GFGB C[C@H](c1ccccc1)N1C[C@H](C(=O)NNC(=O)c2ccc(Cl)cc2)CC1=O 7882072 HTHOYYIZTMZUGO-CZUORRHYSA-N 385.851 2.711 50 40 GFGB COc1ccc([N+](=O)[O-])cc1NC(=O)C/C(C)=N/NC(=O)Cc1cccs1 101375558 UDUKJPVZYKLZGH-YBFXNURJSA-N 390.421 2.728 50 40 GFGB CCCn1nc(C(=O)N/N=C/c2ccc(NC(C)=O)cc2)c2ccccc2c1=O 7654690 NRGKUJGZGYSVSI-LPYMAVHISA-N 391.431 2.529 50 40 GFGB C/C(=N\NC(=O)CN(c1cccc(Cl)c1C)S(C)(=O)=O)c1ccccc1 408777579 CLXRXBBWWIMFHX-XSFVSMFZSA-N 393.896 2.955 50 40 GFGB O=C(CCc1c[nH]c2ccccc12)NNC(=O)c1cncn1-c1ccc(F)cc1 6648765 UGQBIFLRLNYHLZ-UHFFFAOYSA-N 391.406 2.887 50 40 GFGB C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(Br)cc1 5637633 JPSBGDCYMBITJE-JTQLQIEISA-N 381.201 2.817 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2ccccc2Cl)S(C)(=O)=O)c(C)c1 408780322 AYVQDYBLDKEPHH-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB N#CC1=C(S)N[C@](O)(c2ccccc2)[C@H]([n+]2ccccc2)[C@@H]1c1ccncc1 95480997 ZNEQCVUXICTZHQ-SJBKTWHCSA-O 387.488 2.807 50 40 GFGB COc1cccc(C(=O)NNC(=O)COc2ccc(C)cc2Br)c1 832000 CSOZSCGPTCHUEE-UHFFFAOYSA-N 393.237 2.606 50 40 GFGB COC(=O)C1=C2S[C@@H](C)C(=O)N2C(N)=C(C#N)[C@@H]1c1c(F)cccc1Cl 5478196 SHVSKEYZHWLYLG-WRWORJQWSA-N 393.827 2.619 50 40 GFGB Cc1ccc(S(=O)(=O)NNC(=O)CSc2nc3ccccc3s2)cc1 6030773 XJVOABNCBINZIP-UHFFFAOYSA-N 393.515 2.707 50 40 GFGB COc1cc(C)ccc1C(=O)N/N=C/c1ccc(OCC(=O)O)c(Cl)c1 59679099 QLYYIYQXTVXXMC-AWQFTUOYSA-N 376.796 2.884 50 40 GFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1 788106 FCUZLDCZSLTVBE-NPNVKNKFSA-N 386.795 2.751 50 40 GFGB C=CCc1cccc2cc(C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c(=O)oc12 705132 BXVXGZMLYZNHND-UHFFFAOYSA-N 393.355 2.505 50 40 GFGB CCOc1ccccc1-c1nc(CC(=O)NNC(=O)c2ccc(O)cc2)cs1 10280667 NKIIIVCFGJPUQU-UHFFFAOYSA-N 397.456 2.918 50 40 GFGB CCOc1ncccc1C(=O)NNC(=O)COc1ccccc1-c1ccccc1 16005889 WKQHMNSMLQAJOB-UHFFFAOYSA-N 391.427 2.987 50 40 GFGB CC(C)(C)NC(=O)CC1(C(=O)NNC(=O)Cc2ccc(Cl)cc2)CCCC1 40069597 DMWUDWVAIFHDTK-UHFFFAOYSA-N 393.915 2.895 50 40 GFGB CCOc1cc([N+](=O)[O-])cc(/C=N/NC(=O)COc2cc(C)cc(C)c2)c1O 12859436 HTHLCDGQXNMXSG-KEBDBYFISA-N 387.392 2.845 50 40 GFGB C/C(=N\NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O)c1cccs1 20209644 NEVOEYLWYDHRHZ-GZTJUZNOSA-N 385.898 2.708 50 40 GFGB O=C(N/N=C\c1cc(Br)cc([N+](=O)[O-])c1O)c1cccc(O)c1 409094963 AOWNJQRDESSFNH-APSNUPSMSA-N 380.154 2.532 50 40 GFGB CC(=O)NCC(=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 7718264 HSNHSDYBWVCEME-UHFFFAOYSA-N 391.880 2.529 50 40 GFGB Cc1cccc(/C=N\NC(=O)c2nn(-c3ccccc3C)c(=O)c(C#N)c2C)c1 409067159 JPGBJWFDRACLQL-CFRMEGHHSA-N 385.427 2.793 50 40 GFGB COc1ccccc1OCC(=O)NNC(=O)Cc1ccc(Cl)c(Cl)c1 2617639 YQZASRFTRAFUMP-UHFFFAOYSA-N 383.231 2.771 50 40 GFGB COc1ccccc1[PH](CO)(c1ccccc1OC)c1ccccc1OC 104144529 KMHDYWQZPOUPCT-UHFFFAOYSA-N 384.412 2.688 50 40 GFGB C#CCOc1ccc([C@@H]2C(C#N)=C(N)N(C)C3=C2C(=O)CCC3)cc1OCC 409139561 OEOUTCARSXARGR-HXUWFJFHSA-N 377.444 2.827 50 40 GFGB COc1ccc(NC(=O)C(=O)N/N=C/c2ccccc2C(F)(F)F)cc1OC 59459556 IGWHNBSFVKMDLA-LSHDLFTRSA-N 395.337 2.811 50 40 GFGB CC1(C)CC(=O)C2=C(C1)N(N1CCOCC1)C(N)=C(C#N)[C@H]2c1ccsc1 691045 AWFXDGIGUVISGL-QGZVFWFLSA-N 384.505 2.732 50 40 GFGB COc1cccc(/C=N/NC(=O)CSCC(=O)Nc2ccccc2)c1OC 3039859 CZRXDYXCQKTISJ-RGVLZGJSSA-N 387.461 2.526 50 40 GFGB CCCCn1nc(C(=O)NNC(=O)c2ccc(CC)cc2)c2ccccc2c1=O 13148953 WJXWDZPRGONWHC-UHFFFAOYSA-N 392.459 2.834 50 40 GFGB COc1cccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)c1OC 409168404 MEHGTOLGRKAFPL-FZJZADEZSA-N 395.459 2.824 50 40 GFGB COc1ccc(N(CC(=O)N/N=C(\C)C(C)(C)C)S(C)(=O)=O)cc1Cl 408768076 BQZFWCSUAHTDPT-WOJGMQOQSA-N 389.905 2.653 50 40 GFGB Cc1cccc(N(CC(=O)N/N=C/c2ccc(Cl)cc2)S(C)(=O)=O)c1C 408906962 FGZSLHAPMUSYFF-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)c2ccccc2F)c(Br)c1 5927166 CAGVIIYPZLDNGE-UHFFFAOYSA-N 381.201 2.737 50 40 GFGB O=C(Cc1nnc(NC(=O)Nc2ccccc2)s1)N/N=C/c1ccccc1 753984 CFFGCYBQGDFVTF-XDHOZWIPSA-N 380.433 2.875 50 40 GFGB COC(=O)CSC1=C(C#N)[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)OC)C(O)=N1 2300867 YFSHYHLNKSDTRS-UONOGXRCSA-N 394.836 2.824 50 40 GFGB Cc1ccc(SCC(=O)NNC(=O)c2cncn2-c2ccc(F)cc2)cc1 12581475 YVSNFFQNKZSNMO-UHFFFAOYSA-N 384.436 2.873 50 40 GFGB CC(C)OCCCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 4703046 ULEDJGJLTNWCAI-BUVRLJJBSA-N 397.475 2.647 50 40 GFGB Cc1ccccc1C(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2)s1 17146878 BNHXOPJABYTJSY-UDWIEESQSA-N 379.445 2.792 50 40 GFGB CCOc1ccccc1NC(=O)C(=O)N/N=C/c1cc(Cl)c(O)c(OC)c1 409266478 ZEGAQGRINCKXQL-KEBDBYFISA-N 391.811 2.542 50 40 GFGB C[C@@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc(OCC(N)=O)cc1 28214154 DIEUVNSUCFTTAE-FZTAQKCPSA-N 391.880 2.835 50 40 GFGB CCOc1cc([N+](=O)[O-])cc(/C=N\NC(=O)COc2ccc(C)cc2C)c1O 30843550 IWJHRUBTYWJRAI-JMIUGGIZSA-N 387.392 2.845 50 40 GFGB C/C(CC(=O)NCc1ccco1)=N\NC(=O)c1ccc([N+](=O)[O-])cc1Cl 100510210 FQIPNGKYDOTFBQ-VXLYETTFSA-N 378.772 2.653 50 40 GFGB O=C(C[C@H]1CCS(=O)(=O)C1)N/N=C1/C[C@@H](c2ccccc2)Oc2ccccc21 38323571 YYIFVMHODGLJNA-MJHAXRAASA-N 398.484 2.856 50 40 GFGB N#CCOc1ccc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1 4209496 LMEUZTUZRLDMCL-KOEQRZSOSA-N 385.423 2.975 50 40 GFGB COc1cccc(C(=O)N/N=C\c2cc(Cl)c(OCC(N)=O)c(Cl)c2)c1 409261510 DKKZJYZOOHIJGB-WNFQYIGGSA-N 396.230 2.630 50 40 GFGB C[C@H](Oc1ccc(/C=N\NC(=O)COc2ccccc2Cl)cc1)C(=O)O 33935555 OXCDATFCOXSYJC-XGTDKWECSA-N 376.796 2.721 50 40 GFGB O=C(CN1CCOCC1)N/N=C/c1ccccc1OCc1ccccc1Cl 19799595 RGTDFIGGYMBLGY-LPYMAVHISA-N 387.867 2.701 50 40 GFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1cc2c(cc1Cl)OCO2 2756598 CWZZTTFQLZCZAD-CNHKJKLMSA-N 377.740 2.506 50 40 GFGB COc1ccc2ccccc2c1/C=N\NC(=O)[C@@H]1C(=O)NC[C@H]1c1ccccc1 13534959 PADFYJZDWRBMDP-RSURDBENSA-N 387.439 2.828 50 40 GFGB O=C(CSc1cccc2cccnc12)NNC(=O)c1ccc2c(c1)OCCO2 6559875 OWMAAOLODISGEK-UHFFFAOYSA-N 395.440 2.559 50 40 GFGB CCOc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4cccnc4)c32)ccc1O 8569239 PSEMKGPRYYTIAY-MRXNPFEDSA-N 375.388 2.794 50 40 GFGB CCC(=O)Nc1ccc(N2C(=O)CS/C2=N\NC(=O)c2ccc(O)cc2)cc1 35313298 BRHNITLYHBWNQX-QOCHGBHMSA-N 398.444 2.522 50 40 GFGB Cc1cccc(NC(=O)C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1Cl 5796375 HVMNFMAESHLLAF-UHFFFAOYSA-N 389.883 2.951 50 40 GFGB Cc1noc(C)c1CSc1ccccc1C(=O)NNC(=O)[C@@H]1CCCO1 32261111 ZFNNBPSFIHNZHE-HNNXBMFYSA-N 375.450 2.524 50 40 GFGB Cc1c([C@@H]2C(C#N)=C(N)N(c3ccccc3C#N)C3=C2C(=O)CCC3)cnn1C 696077 ZCFLXRQEYCOUSV-FQEVSTJZSA-N 384.443 2.905 50 40 GFGB CCOC(=O)Nc1ccc(C(=O)NNC(=O)COc2c(C)cccc2C)cc1 8245918 ACDFSDMVIDNZTE-UHFFFAOYSA-N 385.420 2.712 50 40 GFGB Cc1ccc(C(=O)NNC(=O)[C@H](C)Nc2nc3ccccc3s2)cc1[N+](=O)[O-] 8984360 GFHZRZODFFFDCV-NSHDSACASA-N 399.432 2.775 50 40 GFGB Cc1cc(C(=O)NNC(=O)CC2(C(=O)O)CCCC2)c(C)n1-c1ccccc1 9378950 XHGOBZYTVQQEFZ-UHFFFAOYSA-N 383.448 2.890 50 40 GFGB COc1cc(/C=N\NC(=O)COc2cccc3cccnc23)cc2c1OCO2 409024077 UHEUYDPQLBQCMU-YVNNLAQVSA-N 379.372 2.501 50 40 GFGB COc1cc([N+](=O)[O-])cc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)c1O 38430965 GKTLKFVXVIKYAJ-UDWIEESQSA-N 384.392 2.673 50 40 GFGB O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccccc1)NN=C1CCCC1 16479549 HOLALQMEZWAUFF-UHFFFAOYSA-N 385.489 2.924 50 40 GFGB Cn1c(SCC(=O)N/N=C/c2cccc([N+](=O)[O-])c2)nnc1-c1ccccc1 1085710 NDLXQSWUICMSSI-YBFXNURJSA-N 396.432 2.633 50 40 GFGB O=C(CCCC[C@@H]1CCSS1)N[C@H]1CCN(c2nccn3cnnc23)C1 575414458 HVMKVJIXAFUTKU-UONOGXRCSA-N 392.554 2.533 50 40 GFGB O=C(Cc1ccccc1)NNC(=O)c1ccc(NC(=O)Cc2ccccc2)cc1 3162789 GHOCMRSSWYRSAA-UHFFFAOYSA-N 387.439 2.872 50 40 GFGB O=C(COc1ccc(Br)cc1)NNC(=S)NCc1ccccc1 4976596 NESZIZBKCSBDLP-UHFFFAOYSA-N 394.294 2.523 50 40 GFGB COc1ccc(CC(=O)N/N=C(\C)CC(=O)Nc2ccc(N(C)C)cc2)cc1 100523022 QZEWUDIJSVGEHI-HZHRSRAPSA-N 382.464 2.825 50 40 GFGB COc1cc([C@@H]2ON=C(C(=O)N/N=C/c3ccc(F)cc3)[C@@H]2C)cc2c1OCO2 15085849 NOLSIEJLPQXROM-YITRBVBMSA-N 399.378 2.777 50 40 GFGB NC(=O)COc1ccc(/C=N/NC(=O)CCSc2ccc(Cl)cc2)cc1 28214873 XFKARKFATIMQDT-SRZZPIQSSA-N 391.880 2.837 50 40 GFGB O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2C(=O)O)o1)c1cccnc1 409040367 YLZURKJAONBSTM-KEBDBYFISA-N 380.316 2.712 50 40 GFGB Cc1ccc(NCC(=O)NNC(=O)CCc2ncc(-c3ccccc3)o2)cc1 40034380 AIKPDPIESGSGIX-UHFFFAOYSA-N 378.432 2.842 50 40 GFGB C=CC(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1 1135459431 NIIURVXVOMDJHQ-LLVKDONJSA-N 399.472 2.778 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1C 3451235 DAUWEYNQIDUSPW-UHFFFAOYSA-N 377.784 2.705 50 40 GFGB C/C(=N\NC(=O)CN(c1ccccc1Cl)S(C)(=O)=O)c1ccc(F)cc1 58925059 LSTBFWLYBYKYTD-UDWIEESQSA-N 397.859 2.786 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(Cl)cc(Cl)c1 59101661 DUMOFKSCOVUPRX-QGMBQPNBSA-N 381.175 2.990 50 40 GFGB Cc1ccc(/C=N\NC(=O)c2nn(-c3ccc(F)cc3)c(=O)c(C#N)c2C)cc1 409071736 PGMIZOUWHONSFR-MSXFZWOLSA-N 389.390 2.624 50 40 GFGB C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2cccc(C)c2[nH]c1=O 4131438 AMOMAENWNVYZHX-QGZVFWFLSA-N 377.400 2.647 50 40 GFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2cccc(Cl)c2Cl)C1)c1ccccc1 7928409 RNNZTPJZQYGQGH-GFCCVEGCSA-N 392.242 2.808 50 40 GFGB CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc([N+](=O)[O-])cc3)[C@@H]2C1 4123648 JLDZPQMAJAQKFG-MOPGFXCFSA-N 388.431 2.730 50 40 GFGB C#CCOc1ccc(Br)cc1/C=C(\C#N)C(=O)NC[C@@H]1CCCO1 408817070 KOSYQFUXSBZKNA-IDJPSDCMSA-N 389.249 2.663 50 40 GFGB O=C(/C=C/c1cccs1)NNC(=O)CCC(=O)Nc1ccccc1Cl 6592188 QHYXMDNMNIITAL-BQYQJAHWSA-N 377.853 2.981 50 40 GFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1ccc(OC(C)=O)cc1)c1ccccc1 408999253 QJEFZWFWTOZLTL-KWJZBXMYSA-N 397.431 2.940 50 40 GFGB O=C(c1ccc(F)cc1)[C@H](CCCl)OC(=O)[C@H]1[C@H]2C(=O)O[C@H]3C[C@H]1C[C@@H]32 408673066 WHFGZZJBKWIVEV-PVSUWSIZSA-N 380.799 2.747 50 40 GFGB C[C@H](Oc1ccccc1Cl)C(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1 32795739 NQBUZZUVBHONCY-NEPJUHHUSA-N 380.803 2.861 50 40 GFGB COc1ccc([C@@H](C)c2cc3c(cc2OC/C(C)=N\NC(N)=O)OCO3)cc1 17175872 JDFMUFLXSNRXNM-IKTNTUJMSA-N 385.420 2.999 50 40 GFGB CCNC(=O)/C(C#N)=C/c1c(Oc2ccc(OC)cc2)nc2ccccn2c1=O 2345009 SRBJOXIQPZPQIX-WYMLVPIESA-N 390.399 2.538 50 40 GFGB O=C(Cc1ccc2c(c1)OCCO2)N/N=C\c1ccc(O)c(Br)c1 409366304 UDVLQIGHFLUMRW-GRSHGNNSSA-N 391.221 2.619 50 40 GFGB N#C/C(=C\c1ccc(OCCN2CCOCC2)cc1)C(=O)Nc1ccccc1 15933700 IAEPKUJRCYIAER-KNTRCKAVSA-N 377.444 2.943 50 40 GFGB O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)[C@H]1CC(=O)N(Cc2ccco2)C1 13630377 DNWMSOGCJVWNIN-QPVSSGOPSA-N 396.230 2.791 50 40 GFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=N\NC(=O)Cc1ccc(OCC)cc1 408711883 OUAXUQMVGIXWNH-STZFKDTASA-N 381.388 2.698 50 40 GFGB CCc1ccc(N(CC(=O)N/N=C/c2ccccc2Cl)S(C)(=O)=O)cc1 409028311 LUEWFXQXVQWNSL-UDWIEESQSA-N 393.896 2.819 50 40 GFGB O=C(CCc1ccccc1)N/N=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1 409112074 BQLKFSRRZHFJIS-RCCKNPSSSA-N 382.420 2.514 50 40 GFGB CC1=NN(c2ccccc2)C(=O)[C@@]12[C@H](c1ccccc1)[C@@]2(C#N)C(N)=C(C#N)C#N 66089388 NQSUOEFTMHMRMG-OIBXWCBGSA-N 392.422 2.963 50 40 GFGB CCc1cc2cc(OC)ccc2nc1SCC(=O)NNC(=O)c1ccco1 4849358 GVNSGZZWKAVSKI-UHFFFAOYSA-N 385.445 2.952 50 40 GFGB O=C1Nc2ccc(Br)cc2/C1=N/NC(=O)c1cc(Cl)ccc1O 8163370 KDAWXRJQILAEID-UHFFFAOYSA-N 394.612 2.894 50 40 GFGB O=C(Cn1cnc2sc(-c3ccccc3)cc2c1=O)N/N=C/c1ccco1 1784254 VBVYWPNLDVGGHC-UFFVCSGVSA-N 378.413 2.868 50 40 GFGB COc1ccc(OC)c(/C=N\NC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3)C2)c1 409166380 DNPMSDYCOXJJQI-BDQMVGTNSA-N 381.432 2.515 50 40 GFGB CSc1ccc(/C=N\NC(=O)CN2CCN(Cc3ccccc3)CC2)cc1 32576935 AHFXXRQZMQWHST-JCMHNJIXSA-N 382.533 2.676 50 40 GFGB O=C(COc1ccccc1Cl)NNC(=O)c1ccc([N+](=O)[O-])cc1Cl 840356 SUUAOIHBZLWDOB-UHFFFAOYSA-N 384.175 2.742 50 40 GFGB C/C(=N\NC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(F)cc1 20755602 BUYCYFWHBPTBCD-KGENOOAVSA-N 389.452 2.764 50 40 GFGB CC(C)(O)C(=O)NN(C(=O)c1ccccc1)c1cccc(Br)c1 1410622 MIVPQLGPXKQJPF-UHFFFAOYSA-N 377.238 2.898 50 40 GFGB N#C/C(C(N)=O)=C1/S[C@H](Cc2cccc([N+](=O)[O-])c2)C(=O)N1c1ccccc1 2195971 NHXJZDNNJZFJMI-URTGMZOISA-N 394.412 2.506 50 40 GFGB Cc1sc2nc3n(c(=O)c2c1C)C[C@H](CI)S3 4176632 KAGYRJXMTNCWIE-ZETCQYMHSA-N 378.260 2.984 50 40 GFGB CC(C)CNC(=O)/C(C#N)=C1\N=C(NC(=O)c2cccs2)c2ccccc21 5205699 DQGNUZCXUIAABF-ICFOKQHNSA-N 378.457 2.945 50 40 GFGB CNc1ccc(S(=O)(=O)O)cc1P(=O)(c1ccccc1)c1ccccc1 97951053 LCZJWXLCBHJPKA-UHFFFAOYSA-N 387.397 2.614 50 40 GFGB O=C(Cl)[C@H]1CC(=O)N(c2cc(C(F)(F)F)ccc2N2CCOCC2)C1 45958593 QIFJEUODIPJYGI-JTQLQIEISA-N 376.762 2.660 50 40 GFGB COc1ccc(OCC(=O)N/N=C/c2cc(OC)ccc2Br)cc1 3167597 VCQHFYIYOYRANV-VXLYETTFSA-N 393.237 2.995 50 40 GFGB CCCCn1nc(C(=O)NNC(=O)c2ccc(C)cc2)c2ccccc2c1=O 9912602 STPDJSHICQTKQU-UHFFFAOYSA-N 378.432 2.580 50 40 GFGB C=CCc1ccccc1OCC(=O)N/N=C/c1ccc(OC)c(OC)c1OC 1424087 PQAWMRGAZLSKFD-LPYMAVHISA-N 384.432 2.970 50 40 GFGB CCc1ccc(OCC(=O)NNC(=O)Cc2coc3cc(OC)ccc23)cc1 3483414 RUMBOACGTHHTEZ-UHFFFAOYSA-N 382.416 2.773 50 40 GFGB CNC(=O)/C(C#N)=C\c1ccc(OCC(=O)Nc2ccccc2C)c(OC)c1 4739665 QYKJMQAZROUAGE-YBEGLDIGSA-N 379.416 2.674 50 40 GFGB CCc1cc(-c2n[nH]cc2-c2nc(C)cs2)c(O)cc1O[C@@H](C)C(=O)NN 9373696 FEZYVTWASXVQDS-JTQLQIEISA-N 387.465 2.534 50 40 GFGB COc1ccc(/C=N/NC(=O)c2ccc3c(c2)OCO3)cc1Br 8103778 IKAMXNKYOXWVIO-QGMBQPNBSA-N 377.194 2.950 50 40 GFGB CCCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(Cl)c2)cc1OC 7387621 QPMOCGGKXDXJBJ-UHFFFAOYSA-N 398.868 2.761 50 40 GFGB O=C(NN[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1=O)c1cccc(F)c1 100129742 HZFBSJXCDPXKLT-AWEZNQCLSA-N 396.205 2.699 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OC)cc1OC 408907075 LNFKEGXNZKIDIA-SDLXJUDFSA-N 399.447 2.511 50 40 GFGB O=C(NNc1ccc([N+](=O)[O-])cc1)c1cnc(-c2cccc([N+](=O)[O-])c2)nc1 408533687 RPCDJAAJMMHDEP-UHFFFAOYSA-N 380.320 2.717 50 40 GFGB COc1cc(OC)c(/C=N/NC(=O)CNC2CCCCC2)cc1Br 409386933 OQHJUFMHUQOPSR-KEBDBYFISA-N 398.301 2.839 50 40 GFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3ccccc3)CC2)cc1OC 409006865 RJXMIYLPPNOFJS-HZHRSRAPSA-N 395.459 2.706 50 40 GFGB O=C(NNC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2CC[C@@H]1C2)c1ccc(OC2CCCC2)cc1 6241638 OZLPYWOSLSDFOH-NONVJHHQSA-N 386.448 2.516 50 40 GFGB ClCCN(CCCl)c1ccc(/C=N/Nc2ccc3nncn3n2)cc1 2685661 ACYSHDOTZOVPNX-YBFXNURJSA-N 378.267 2.854 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(C)c([N+](=O)[O-])c1 408907397 NDURWKHMFBYCHF-RSZPVBOMSA-N 398.419 2.711 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(N(C)C)cc1 408906511 CDXABWCYESNLEB-OMNSNBSWSA-N 382.464 2.560 50 40 GFGB Cc1ccc(S(=O)(=O)N[C@H](CC(C)C)C(=O)N/N=C/c2ccccc2)cc1 15229772 FBGWKCREXIAPLT-KNGGAZFVSA-N 387.505 2.838 50 40 GFGB CCc1cc(C(=O)NNC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3CC[C@H]2C3=C(C)C)cs1 102618655 JOQGNRGLWIHDEO-SDADXPQNSA-N 376.478 2.765 50 40 GFGB O=C(Cn1c(C(F)(F)F)nc2ccccc21)N/N=C/c1ccc(C(=O)O)cc1 6315995 SKBNXNXWWNMXBL-LSFURLLWSA-N 390.321 2.904 50 40 GFGB C/C(=N\NC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O)c1ccc(F)cc1 20209576 VGUBWJMQBDZYOV-UDWIEESQSA-N 397.859 2.786 50 40 GFGB O=C(NCc1ccc(Cl)cc1Cl)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 408718400 LTJFWHWACJGBPK-AWQFTUOYSA-N 395.202 2.668 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1cc(OC)ccc1OC 408911897 OWUUHIDFJIJSAW-OVBDPADQSA-N 399.447 2.511 50 40 GFGB Cc1occc1C(=O)NNC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O 16515483 DEEREXXSLYZWOW-UHFFFAOYSA-N 394.309 2.573 50 40 GFGB CC(C)c1ccc(-n2cnnc2SCC(=O)NNC(=O)c2ccccc2)cc1 24429517 KFHGSETYIKJTAP-UHFFFAOYSA-N 395.488 2.944 50 40 GFGB N#C/C(=C\c1cccc(Oc2nc(Cl)ncc2F)c1)C(=O)N1CCOCC1 409062863 CBLLBIVUTZJLBH-MDWZMJQESA-N 388.786 2.827 50 40 GFGB CCOc1ccc(C(=O)NNC(=O)c2cc(-c3ccccc3)no2)cc1OC 32913639 CODGBPYYQYACRW-UHFFFAOYSA-N 381.388 2.824 50 40 GFGB COc1cccc(C(=O)N/N=C/c2cc3c(cc2Br)OCO3)c1 5720966 QUGKUYNVFFACHK-QGMBQPNBSA-N 377.194 2.950 50 40 GFGB Cc1ccc(C(=O)NNC(=O)CSc2nnc(-c3ccc(C)cc3)o2)cc1 873769 WOIRWOBRLWXKHG-UHFFFAOYSA-N 382.445 2.907 50 40 GFGB COC(=O)c1ccc(NC(=O)CCNC(=O)[C@@H](Br)C(C)(C)C)cc1 8733213 MDDLTBXFZXPAEC-CQSZACIVSA-N 399.285 2.728 50 40 GFGB COc1cc(C(=O)N/N=C\c2c[nH]nc2-c2ccc(OC)c(OC)c2)ccc1O 32565550 DQKDJQFUMORWSN-JJFYIABZSA-N 396.403 2.572 50 40 GFGB COc1cc(/C=N/NC(C)=O)ccc1OCCOCCOc1ccc(C)cc1 13940526 TYFAYWALHZHXAI-PXLXIMEGSA-N 386.448 2.948 50 40 GFGB COc1cc(OC)cc(C(=O)N/N=C/c2cc(Br)ccc2O)c1 5670054 QRXADVSGAASLOW-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB Cc1ccccc1NCC(=O)N/N=C/c1ccc(I)o1 919128 ILVWAKHSLCRZNC-CAOOACKPSA-N 383.189 2.755 50 40 GFGB Cc1ccc(CC(=O)N/N=C/c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1C 408591832 VMYNPFKMVSWZFG-HYARGMPZSA-N 396.447 2.741 50 40 GFGB CCn1c(NNC(=O)c2cc(-c3cccs3)on2)nc2ccccc2c1=O 69585771 UZFGHDHPNKUDMH-UHFFFAOYSA-N 381.417 2.890 50 40 GFGB CC(C)(C)C(=O)OC(=O)NCc1ccc(C(=O)NCCCCCC(=O)O)cc1 616581118 WXGAQGWYNRGBPI-UHFFFAOYSA-N 392.452 2.860 50 40 GFGB COC(=O)C1=C(C)NC(SCC(=O)NC2CC2)=C(C#N)[C@H]1c1cccs1 19597350 AWORQOGIZFENRB-INIZCTEOSA-N 389.502 2.629 50 40 GFGB C=C(C)C(=O)OCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1ccccc1F 2276072 SOSKDNLMQSFZOY-KRWDZBQOSA-N 386.379 2.570 50 40 GFGB N#C/C(=C\c1cc([N+](=O)[O-])c(Cl)cc1Cl)c1nn(CCO)c(N)c1C#N 408721751 YAWUEGXDMFOXDK-YCRREMRBSA-N 393.190 2.608 50 40 GFGB COc1cc(C(=O)NNC(=O)c2ccoc2C)ccc1OCc1c(C)noc1C 8271896 BNBACWNHPAODGQ-UHFFFAOYSA-N 399.403 2.855 50 40 GFGB Cc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccc(Cl)cc3)CC2=O)c(C)c1 408639082 FCVHJKZHGBAANL-OAHLLOKOSA-N 385.851 2.771 50 40 GFGB C=CCc1cc(/C=C(/C#N)C(=O)NC(C)C)cc(OCC)c1OCC(=O)OC 408776543 PESAVFUUYWWCMN-YVLHZVERSA-N 386.448 2.797 50 40 GFGB COc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(C[C@H]4CCCO4)c(=O)c32)c1 1476102 FTIQCCNOWCXKQZ-VQIMIIECSA-N 393.443 2.563 50 40 GFGB C=CCN1C(=O)[C@@]2(C(C#N)=C(N)Oc3ccccc32)C(C(=O)OC(C)(C)C)=C1C 4517038 JRSCVNSNSLIAMS-QFIPXVFZSA-N 393.443 2.655 50 40 GFGB CN(C)NC(=O)CCCN1C(=O)/C(=C/c2ccccc2Cl)SC1=S 5552632 CECJWANQSAVBNV-RAXLEYEMSA-N 383.926 2.914 50 40 GFGB CCOC(=O)c1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)n(CC)n1 253400264 KXZIEVRMUUQBJD-INIZCTEOSA-N 384.436 2.531 50 40 GFGB COc1ccc(F)c([C@H]2[C@@H]3CN(C(C)C)CC=C3C(C#N)=C(N)C2(C#N)C#N)c1 27297645 OSPJDKSVHFHVON-QUCCMNQESA-N 391.450 2.968 50 40 GFGB C/C(CC(=O)Nc1ccccn1)=N/NC(=O)c1ccc(Br)cc1 101155997 IIZUVLUQDXUDJY-JAIQZWGSSA-N 375.226 2.979 50 40 GFGB O=C(Oc1ccc(/C=N/NC(=O)[C@H]2COc3ccccc3O2)cc1)c1ccco1 1092637 MHLGFPXTIIQACD-VVJWVBNBSA-N 392.367 2.789 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C\c2cc(OC)c(O)c([N+](=O)[O-])c2)cc1 408815345 HLHDHAURDRLNNH-AUWJEWJLSA-N 383.360 2.541 50 40 GFGB COc1cc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc([N+](=O)[O-])c1O 408543054 OPWNVHDMDYKGJX-XGICHPGQSA-N 383.316 2.553 50 40 GFGB CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)NN(c1ccccc1)c1ccccc1 408999484 CZSSFZMQXDTDCM-QGZVFWFLSA-N 398.463 2.625 50 40 GFGB COc1cc(N2CCOCC2)ccc1/C=C(\C#N)C(=O)NCc1cccs1 1092670 NJLKKPAUODKEKN-LFIBNONCSA-N 383.473 2.817 50 40 GFGB Cc1cc2c(c(=O)n1C[C@H]1CCCO1)[C@@H](c1cccc(F)c1)C(C#N)=C(N)O2 1266458 ZYLUYHNECDPIQX-QAPCUYQASA-N 381.407 2.693 50 40 GFGB CCOc1cc(/C=N\NC(=O)COc2cc(C)cc(C)c2)cc([N+](=O)[O-])c1O 30895850 RFFURNJTMMTWQQ-JMIUGGIZSA-N 387.392 2.845 50 40 GFGB CCc1ccc(OCC(=O)NC(=S)NNC(=O)c2ccc(Cl)cc2)cc1 6450675 YAHRPRCUZKLSJI-UHFFFAOYSA-N 391.880 2.617 50 40 GFGB COc1ccccc1NC(=O)NNC(=O)COc1cccc(Br)c1 3425137 RGPOESHWJGTMCJ-UHFFFAOYSA-N 394.225 2.689 50 40 GFGB Cc1ccc(S(=O)(=O)N[C@H](C(=O)N/N=C/c2ccccc2C)C(C)C)cc1 408758959 VNLMMXZDMNBEAC-IOVUBPJKSA-N 387.505 2.757 50 40 GFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1ccccc1OCC#N)c1ccccc1 409003807 VBKWJRQUZMDWOJ-MMTNMYCKSA-N 394.431 2.917 50 40 GFGB Cc1ccc(-n2nc(C(=O)N/N=C/c3cccs3)c(C)c(C#N)c2=O)cc1C 409059022 QKYAUYQSIDNVLM-SSDVNMTOSA-N 391.456 2.855 50 40 GFGB COc1cc(/C=N\NC(=O)c2ccc(C)nc2)ccc1OC(=O)c1ccco1 30803052 YETFLGFRRDFGOF-JJFYIABZSA-N 379.372 2.975 50 40 GFGB O=C(NNC(=O)c1cc(Br)ccc1Cl)c1ccc2c(c1)OCO2 3406496 GGFBEMWAJZAJLK-UHFFFAOYSA-N 397.612 2.906 50 40 GFGB CC(C)c1ccc(S(=O)(=O)NNC(=O)c2cncn2-c2ccccc2)cc1 7131726 DXEDOSIFHJYUKN-UHFFFAOYSA-N 384.461 2.619 50 40 GFGB C/C(CCc1ccccc1)=N\NC(=O)CN(c1cccc(F)c1)S(C)(=O)=O 409111393 CLFBGZLMXJLJSS-RCCKNPSSSA-N 391.468 2.717 50 40 GFGB CC(C)Oc1ccc(/C=N/NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1 409129523 GJFLNHBDKOBIBY-DEDYPNTBSA-N 389.477 2.634 50 40 GFGB CS(=O)(=O)[C@@H](I)C(=O)c1ccc(Cl)cc1Cl 96517930 ONBAFWXFMQEWQD-SECBINFHSA-N 393.029 2.982 50 40 GFGB C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](OC(=O)CCC(=O)O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 100012297 FIHJKUPKCHIPAT-HXMLZIBGSA-N 384.425 2.602 50 40 GFGB in-vitro CN(C)c1ccc(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)cc1 13923080 ZBQIRKHVKRCHQK-SSDVNMTOSA-N 378.354 2.860 50 40 GFGB O=C(CSc1ccncc1)NNC(=O)CSc1nc2ccccc2s1 40161061 TUVZCDKAMANUGS-UHFFFAOYSA-N 390.515 2.723 50 40 GFGB O=C1NC[C@H](c2ccccc2)[C@H]1C(=O)N/N=C\c1ccc(Cl)c(Cl)c1 30885234 BYEYZZODDDCIDU-PMENJSNESA-N 376.243 2.973 50 40 GFGB CC(=O)Nc1ccccc1NC(=O)C/C(C)=N/NC(=O)c1cccc(C)c1O 4713820 RWWMMDFXRFWPFE-YDZHTSKRSA-N 382.420 2.794 50 40 GFGB CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C/NNC(=O)c1ccccc1[N+](=O)[O-] 101148294 IPUHLWLYTSCFLH-XNTDXEJSSA-N 399.794 2.789 50 40 GFGB Cc1nc2ccccn2c1C(=O)NNC(=O)c1nc(-c2ccco2)sc1C 32423393 XKVRYWVIPISHFZ-UHFFFAOYSA-N 381.417 2.742 50 40 GFGB CCOc1ccccc1/C=N\NC(=O)Cn1cnc2sc(CC)cc2c1=O 16872846 JOXKIAFFBLZPIS-FBHDLOMBSA-N 384.461 2.569 50 40 GFGB N#Cc1ccc(C(=O)NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)cc1 5505975 NZKBAXBZDBKIDS-UHFFFAOYSA-N 396.406 2.937 50 40 GFGB C/C(=N\NC(=O)CN(c1cc(C)ccc1C)S(C)(=O)=O)c1ccc(C)cc1 408775945 KSIGGPGPUPAGBI-HEHNFIMWSA-N 387.505 2.918 50 40 GFGB O=C(NNC(=O)c1ccc[n+]([O-])c1)c1ccc(COc2ccc(Cl)cc2)cc1 22023926 BLCCEPPCNJKKOB-UHFFFAOYSA-N 397.818 2.627 50 40 GFGB COC(=O)c1ccc(/C=N/NC(=O)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 59101912 ZZYRMIPNYHXJNO-AWQFTUOYSA-N 394.214 2.869 50 40 GFGB CCOc1ccccc1OCC(=O)NNC(=O)c1cc(F)c(F)cc1Cl 12808624 FTCGMRMUYQLEJI-UHFFFAOYSA-N 384.766 2.857 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)c2ccc(COCC(F)(F)F)cc2)cc1 32869137 OBRLHSHIJXHGRS-UHFFFAOYSA-N 396.365 2.914 50 40 GFGB Cc1ccc(S(=O)(=O)N2CCC(C(=O)N/N=C/c3cccs3)CC2)cc1 5173081 DLCVYUYLXUMNLT-CPNJWEJPSA-N 391.518 2.608 50 40 GFGB CCOC(=O)CSC1=C(C#N)[C@H](c2ccccc2Cl)[C@H](C#N)C(=O)N1 9089225 UNUYGJHEVDOABG-XHDPSFHLSA-N 375.837 2.725 50 40 GFGB COc1ccc(/C=N\NC(=O)C[n+]2ccccc2)cc1OCc1ccccc1 33402773 JALBUDFWRYQDKL-HAHDFKILSA-O 376.436 2.712 50 40 GFGB Cc1cc(C)cc(N(CC(=O)N/N=C/c2sccc2C)S(C)(=O)=O)c1 20208585 PEUCMCOOICGHBV-VCHYOVAHSA-N 379.507 2.590 50 40 GFGB CC(C)CCOc1ccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1 3296228 LSKFRENPRRDSKH-UHFFFAOYSA-N 384.432 2.730 50 40 GFGB C#CCOc1ccccc1/C=N/NC(=O)COc1ccccc1Br 2190256 BTFSXASNKWCQAW-UDWIEESQSA-N 387.233 2.990 50 40 GFGB COc1cccc(/C=N/NC(=O)c2cc3c(OC)ccc(OC)c3[nH]2)c1OC 2365312 HAESMRQMTUQSEV-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB O=C(CCCn1c(=O)oc2ccccc21)NNc1cc(C(=O)O)ccc1Cl 8279107 DAJDVNYYJMLGDA-UHFFFAOYSA-N 389.795 2.870 50 40 GFGB CCN(CC)C(=O)COc1ccc(/C(C)=N/NC(=O)c2ccccc2O)cc1 6593952 MDXHMQHYPSJCQY-PXLXIMEGSA-N 383.448 2.793 50 40 GFGB O=C(NNC(=O)c1ccc(COc2ccccc2)o1)c1ccc2c(c1)COCO2 78965189 MHEORINPBVHHML-UHFFFAOYSA-N 394.383 2.800 50 40 GFGB CCOc1ccc(/C(C)=N/NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1 409148971 VENZDSBSBFDLCZ-XSFVSMFZSA-N 389.477 2.635 50 40 GFGB CCOc1cc(/C=N/NC(=O)N/N=C/c2ccc(O)c(OCC)c2)ccc1O 711470 RPHOHFJYJKFTJR-HGEIODPWSA-N 386.408 2.562 50 40 GFGB O=C(COc1ccc(/C=N\NC(=O)c2ccc(F)cc2)cc1)NCc1ccco1 58883085 AKICZSFQJGGALB-MSXFZWOLSA-N 395.390 2.878 50 40 GFGB COc1ccc(CC(=O)NNC(=O)c2cnn(-c3cccc(C)c3)c2C)cc1 12853509 COFKAEHGCJJACF-UHFFFAOYSA-N 378.432 2.501 50 40 GFGB Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc[nH]c3=O)c3ccccc3n2)cc1 12872743 HHXQTHPPBVQGHW-UHFFFAOYSA-N 398.422 2.973 50 40 GFGB COc1ccc(N2C(=O)[C@@H]3SC(N)=C(C#N)C4(CCCCC4)[C@@H]3C2=O)cc1 6648663 DNVFWJVHBSHAPN-JKSUJKDBSA-N 383.473 2.944 50 40 GFGB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NNC(=O)Cc1cccc2ccccc12 9894218 MJUFSFACOOESTO-HXUWFJFHSA-N 393.443 2.577 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccccc1I 671559 IZAKUIFRJIITHH-VGOFMYFVSA-N 385.117 2.556 50 40 GFGB C[C@@H](Oc1ccccc1Br)C(=O)N/N=C/c1ccc([N+](=O)[O-])o1 1085452 LROCDUWWLQADBZ-PTPOTIKZSA-N 382.170 2.868 50 40 GFGB CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)C(=O)N/N=C/c1cccnc1 6022861 HNCQWJFJLBTWMU-XNQWGTPPSA-N 398.463 2.642 50 40 GFGB C/C(CC(=O)Nc1ccccc1Cl)=N\NC(=O)c1cc(N)cc([N+](=O)[O-])c1 100981135 AVIPMKLHJNQWFG-UFFVCSGVSA-N 389.799 2.965 50 40 GFGB C[C@@H](C(=O)NNC(=O)c1ccccc1)N(C)CCOc1ccc(Cl)cc1 12984986 ULVQHBIIMFFLMO-AWEZNQCLSA-N 375.856 2.500 50 40 GFGB CCOc1ccc(C(=O)NNC(=O)c2[nH]c3c(c2C)C(=O)CC(C)(C)C3)cc1 28582095 QYZRUIFQHJNYFW-UHFFFAOYSA-N 383.448 2.952 50 40 GFGB C=C(C)C(=O)OCCOC(=O)C1=C(N)OC(C)=C(C#N)[C@@H]1c1ccc(CC)cc1 5911715 QYBWTNKIAJBCTR-SFHVURJKSA-N 396.443 2.993 50 40 GFGB CCCn1c(O)c(C(=O)NNC(=O)c2ccc(C)cc2)c(=O)c2ccccc21 5509314 OOZOMJWUMVFDHS-UHFFFAOYSA-N 379.416 2.500 50 40 GFGB COc1cccc(/C=N/NC(=O)c2cc(Br)ccc2O)c1OC 59447264 ZBIZILAOXWMBLB-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB CN(c1ccc(C(=O)N/N=C/c2ccncc2)cc1)S(=O)(=O)c1ccccc1 20232849 FNOPSOQXJNYQAI-PXLXIMEGSA-N 394.456 2.671 50 40 GFGB COc1c(O)cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1[N+](=O)[O-] 8783203 VZWRNJMUDUYWDP-HNNXBMFYSA-N 385.376 2.760 50 40 GFGB CCCC1=C(C(=O)OCC)[C@@]2(C(=O)Nc3ccc(Cl)cc32)C(C#N)=C(N)O1 850917 RDYOXLJHMBIHPQ-IBGZPJMESA-N 387.823 2.871 50 40 GFGB Cc1cc(Cl)ccc1OCC(=O)NNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 5750117 OSIPQFGXRKRCBE-UHFFFAOYSA-N 380.744 2.987 50 40 GFGB COC(=O)c1cccc(-c2ccc(/C=N/NC(=O)[C@@H](O)c3ccccc3)o2)c1 409139239 AMWIWQAZPBIESK-MEGCXXLRSA-N 378.384 2.917 50 40 GFGB O=C(NNC(=O)[C@H]1CCCO1)c1ccc(CSc2nc3ccccc3[nH]2)cc1 12544307 FPLPIZSGVSWGFV-QGZVFWFLSA-N 396.472 2.795 50 40 GFGB C=CCc1cc(/C=N\NC(=O)CN2CCOCC2)ccc1OCc1ccccc1 59247087 ZKWQKOKOFPUKPA-JLPGSUDCSA-N 393.487 2.776 50 40 GFGB Cc1cc(C(=O)NNC(=O)c2ccccc2)c2cnn(Cc3cccs3)c2n1 12736119 PELIWCXAFQZTCT-UHFFFAOYSA-N 391.456 2.924 50 40 GFGB CCOc1cc(/C=N/NC(=O)c2nonc2N)ccc1OCc1ccccc1F 408974643 FWVSGAZJHMBFPB-LSHDLFTRSA-N 399.382 2.533 50 40 GFGB CCCCOc1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1OC 6784944 MGOBVSKOISWTOI-UHFFFAOYSA-N 386.404 2.678 50 40 GFGB Cc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1cccc(OCC(=O)O)c1 408925935 VBUVNOYORJRTDT-VGOFMYFVSA-N 381.344 2.912 50 40 GFGB COc1ccccc1OCC(=O)NNC(=O)COc1cc(C)c(Cl)c(C)c1 2064421 JQWFHJBZBYYAPF-UHFFFAOYSA-N 392.839 2.571 50 40 GFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(Cl)cc(Cl)c1 59101623 IYSRQVZCHUMEEA-QGMBQPNBSA-N 381.175 2.990 50 40 GFGB C#CCOc1c(Br)cc(/C=C(/C#N)C(=O)N(C)C)cc1OCC 59334684 GWYJZKQOTZCIPY-JYRVWZFOSA-N 377.238 2.855 50 40 GFGB Cc1ccc(C)c(OCC(=O)NNC(=O)c2c[nH]nc2-c2ccc(F)cc2)c1 12540209 XNDHKBJHLLTMRR-UHFFFAOYSA-N 382.395 2.673 50 40 GFGB O=C(CN1CCOCC1)N/N=C/c1cccc(OCc2ccccc2Cl)c1 408735388 PIHZMCCIYNIUBR-LPYMAVHISA-N 387.867 2.701 50 40 GFGB O=C(N/N=C/c1ccccc1C(=O)O)c1cccc(I)c1 408926129 XSZOIEAWACVMBH-RQZCQDPDSA-N 394.168 2.753 50 40 GFGB CC(C)(C)OC(=O)N[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)CBr 113897772 DTNHUDDLCVNQFM-LBPRGKRZSA-N 387.230 2.995 50 40 GFGB Cn1cccc1CC(=O)NN[C@@H](C(=O)Nc1ccc(F)cc1)c1ccccc1 40007495 OXTBOPGGGXSRTH-HXUWFJFHSA-N 380.423 2.708 50 40 GFGB CCOc1cc(/C=N/NC(=O)OC)ccc1OC(=O)c1cccc([N+](=O)[O-])c1 4526001 NUGZRCLLYGEBHV-YBFXNURJSA-N 387.348 2.903 50 40 GFGB Cc1cc(/C=N/NC(=O)C(=O)NCc2ccco2)c(C)n1-c1ccc(F)cc1 408973230 XRJMSRGICUBTNS-FOKLQQMPSA-N 382.395 2.593 50 40 GFGB CCn1nc(C(=O)N/N=C/c2ccc(OC(F)F)cc2)c2ccccc2c1=O 6685809 JWOOGTCWZIJYJN-SSDVNMTOSA-N 386.358 2.782 50 40 GFGB C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(Br)cc1 5637636 JPSBGDCYMBITJE-SNVBAGLBSA-N 381.201 2.817 50 40 GFGB COc1cccc(/C=N\NC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3)C2)c1OC 409151954 IIHKHRRDNQJSMQ-BDQMVGTNSA-N 381.432 2.515 50 40 GFGB CNC(=O)/C(C#N)=C\c1ccc(OCC(=O)Nc2ccc(C)cc2)c(OC)c1 96501196 ICNIMSYMOBNKQA-YBEGLDIGSA-N 379.416 2.674 50 40 GFGB COc1cc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)ccc1OCC(=O)O 408962949 LJJBNNBOIUTNPW-LSFURLLWSA-N 396.321 2.941 50 40 GFGB O=C(N/N=C/c1cc(Br)c(N2CCOCC2)o1)c1ccccc1F 59302693 AEPWSEZMDBGGBN-VXLYETTFSA-N 396.216 2.782 50 40 GFGB C=CCOc1ccc(/C=C(/C#N)C(=O)N(C)C)cc1I 59334208 QGRAJTJJCBBGKR-WQLSENKSSA-N 382.201 2.851 50 40 GFGB Cn1c(=O)n(C)c2cc(/C=N/NC(=O)c3ccc(Cl)c(Cl)c3)ccc21 408886175 DWAUSSCOUZSLQJ-AWQFTUOYSA-N 377.231 2.948 50 40 GFGB COc1cc(/C=N/NC(=O)[C@H](O)c2ccccc2)cc(Br)c1OC 1092580 USTIAKRBICDUIR-GDXCHIGESA-N 393.237 2.650 50 40 GFGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2cc(C)cc(C)c2[nH]c1=O 876514 VWMAQCYOBOZDER-QGZVFWFLSA-N 379.416 2.790 50 40 GFGB Cc1n[nH]c2c1[C@H](c1cc3cc4c(cc3nc1Cl)OCO4)C(C#N)=C(N)O2 933854 PJVBLMGMBSBHGV-OAHLLOKOSA-N 381.779 2.867 50 40 GFGB Cc1cc(C)c(C#N)c(SCC(=O)/C(C#N)=C2/NC(=O)c3ccccc3N2)n1 101094995 HLMTZXAYDOGPPQ-OBGWFSINSA-N 389.440 2.822 50 40 GFGB Cc1cc(C)nc(NNC(=O)NCc2ccc(CN3C[C@@H](C)O[C@H](C)C3)cc2)n1 45786327 GGIOWFZQWYCOAC-IAGOWNOFSA-N 398.511 2.529 50 40 GFGB O=C(N/N=C/c1ccc(Br)cc1)[C@@H]1CC(=O)N(c2ccccc2)C1 9235141 LWTIFBHJAVNUHK-XLTHYULKSA-N 386.249 2.952 50 40 GFGB CN(C1CCCCC1)S(=O)(=O)c1ccc(NC(=O)CBr)cc1 35604965 DBUOTKQANPYLGL-UHFFFAOYSA-N 389.315 2.973 50 40 GFGB CCCCOc1ccc(C(=O)N/C(=C/c2ccc(OC)cc2)C(=O)NN)cc1 2286019 GKBDSOATLWNPJC-XMHGGMMESA-N 383.448 2.635 50 40 GFGB C[C@@H](Oc1ccc(/C=N/NC(=O)COc2ccccc2Cl)cc1)C(=O)O 4508970 OXCDATFCOXSYJC-HMASQMOLSA-N 376.796 2.721 50 40 GFGB COc1ccc(CCCC(=O)N/N=C/c2cccc(OCC(=O)O)c2)c(C)c1 408911459 ZLDSPVJIJWMUSH-LPYMAVHISA-N 384.432 2.940 50 40 GFGB CN(CCCl)C[C@@H]1O[C@H](c2ccccc2)O[C@H]2[C@@H]1O[C@@H]1OC(C)(C)O[C@H]21 4801877 CZXLGGHMQXFZRL-OXODIDRGSA-N 383.872 2.516 50 40 GFGB COc1cc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)cc(OC)c1O 59332925 HJTTVBVXIUGIRV-ATVHPVEESA-N 393.443 2.665 50 40 GFGB O=C(COC(=O)CSc1ccc2ccccc2c1)NNC(=O)c1ccccc1 3450364 DLAHVXFJGPGISU-UHFFFAOYSA-N 394.452 2.936 50 40 GFGB O=C(NNC(=O)c1cccs1)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1 16839316 WIKOHJYJZDVBGM-UHFFFAOYSA-N 387.848 2.686 50 40 GFGB COc1ccc(/C=N/NC(=O)c2ccc(NC(=O)CCCC(=O)O)cc2)cc1 1085618 NPTVQDDDYSNYCR-FYJGNVAPSA-N 383.404 2.653 50 40 GFGB C[C@H](Cl)CN(C[C@H](C)Cl)C(=O)Oc1ccc(C[C@H](N)C(=O)O)cc1 5353405 JCZBYODVXLGJTG-MJVIPROJSA-N 377.268 2.696 50 40 GFGB Cc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccccc3Cl)CC2=O)c(C)c1 7928093 YYIAPNFQRVVNJN-CQSZACIVSA-N 385.851 2.771 50 40 GFGB Cc1cc(C(=O)NNC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)c(C)o1 8769585 ZAFROAFOCSEILV-UHFFFAOYSA-N 391.427 2.754 50 40 GFGB CCOc1ccc2nnc(CNC(=O)CCCC[C@H]3CCSS3)n2n1 238971957 ZMLFTGQPZLSHHS-LBPRGKRZSA-N 381.527 2.853 50 40 GFGB O=C(COc1ccccc1Cl)NC(=S)NNC(=O)c1ccc(Cl)cc1 6528769 AWTZZMIWDLUOKC-UHFFFAOYSA-N 398.271 2.708 50 40 GFGB Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@@H]1Cc2ccccc2O1 7964976 ZBOWGOUIUWSYDE-INIZCTEOSA-N 379.441 2.883 50 40 GFGB O=C(CNC(=O)c1ccccc1Br)N/N=C\c1ccc(Cl)cc1 32926487 PMQOGLWOOWNYRI-UKWGHVSLSA-N 394.656 2.983 50 40 GFGB COc1ccc(OCC(=O)N/N=C/c2cccc(O)c2)c(Br)c1 1444591 SQLIRBUEJIABJY-GIJQJNRQSA-N 379.210 2.692 50 40 GFGB COc1ccc(/C=N/NC(=O)c2cc(-c3cccs3)n[nH]2)c(OC)c1OC 946270 GCEPSZCRGXIVSI-VXLYETTFSA-N 386.433 2.928 50 40 GFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)c1cccc([N+](=O)[O-])c1 100522778 GOBUCCHCQXVMCV-CIAFOILYSA-N 398.375 2.501 50 40 GFGB C/C(=N\NC(=O)CN(c1c(C)cccc1C)S(C)(=O)=O)c1ccc(F)cc1 20213932 SYSZZNVWOIVIKK-RCCKNPSSSA-N 391.468 2.749 50 40 GFGB C/C(=N\NC(=O)CN(c1cccc(F)c1)S(C)(=O)=O)c1ccc(Cl)cc1 409111549 CPPXPQXADZYWSW-UDWIEESQSA-N 397.859 2.786 50 40 GFGB Cc1ccc2nc(SCC(=O)NNC(=O)Cc3ccccc3)c(C#N)cc2c1 4993964 VLCNPEPUBUAYHW-UHFFFAOYSA-N 390.468 2.897 50 40 GFGB CCCN1C(=O)[C@]2(C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)c2ccccc21 9926814 VSJNRLJIZHCADW-QHCPKHFHSA-N 399.406 2.922 50 40 GFGB Cc1ccsc1/C=N/NC(=O)Cn1cnc2sc3c(c2c1=O)CCCC3 958316 MFVHEFMBZUHPGJ-DNTJNYDQSA-N 386.502 2.857 50 40 GFGB CCOc1ccccc1OCC(=O)NNC(=O)Cc1cccc(C(F)(F)F)c1 12806299 AZCUXAZUBFHCRA-UHFFFAOYSA-N 396.365 2.873 50 40 GFGB O=C(Cc1nc2ccccc2[nH]1)NNC(=O)c1ccc(C(=O)c2ccccc2)cc1 7138123 SIMMPBIEOUXMRX-UHFFFAOYSA-N 398.422 2.798 50 40 GFGB CCOc1c(Br)cc(/C=C(\C#N)C(=O)N2CCOCC2)cc1OC 408761554 GQYKTLQDQMIDFY-MDWZMJQESA-N 395.253 2.622 50 40 GFGB O=C(CCc1ccccc1)N/N=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 408588268 ISXNSDPQCROHRS-RCCKNPSSSA-N 382.420 2.514 50 40 GFGB CCOc1c(Cl)cc(C(=O)NNC(=O)COc2cccc(C)c2)cc1OC 12792902 ZFJFAYIXORSGCP-UHFFFAOYSA-N 392.839 2.896 50 40 GFGB Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)c3cccnc3)cc2)n1 12814372 IMJSCFNILOMHFS-UHFFFAOYSA-N 393.472 2.856 50 40 GFGB O=C(CSc1nnc(C2CC2)n1-c1ccccc1)NNC(=O)c1ccccc1 4889993 JSMZYMOEYHAAEW-UHFFFAOYSA-N 393.472 2.698 50 40 GFGB COCCN1C(N)=C(C#N)[C@@H](c2cccc([N+](=O)[O-])c2)C2=C1CC(C)(C)CC2=O 409135936 REPOGXTZPLYJGX-GOSISDBHSA-N 396.447 2.977 50 40 GFGB COc1cc(/C=C/C(=O)NNC(=O)CSc2ccccc2F)cc(OC)c1 7964400 PWWOAJCIMSIJIQ-BQYQJAHWSA-N 390.436 2.796 50 40 GFGB CCOc1cc(/C=N\NC(=O)N/N=C\c2ccc(O)c(OCC)c2)ccc1O 103293495 RPHOHFJYJKFTJR-ACXSEBCSSA-N 386.408 2.562 50 40 GFGB COc1cc(/C=C/C(=O)NNC(N)=S)ccc1OCc1ccc(Cl)cc1 62715149 KEFWZJJBTMYSBX-WEVVVXLNSA-N 391.880 2.805 50 40 GFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(C)c(OC)c1 408608435 WIHVTNWLPPKMKN-INIZCTEOSA-N 384.461 2.952 50 40 GFGB COc1ccc(CC(=O)N/N=C(\C)c2ccc(OC)c([N+](=O)[O-])c2)cc1OC 5638629 MIHMXDZVIUEOGS-UDWIEESQSA-N 387.392 2.704 50 40 GFGB CCOc1ccc(C(=O)NNC(=O)c2ccc(-c3nc(C)no3)cc2)cc1OC 32909622 RIBQAOGMXGJTCN-UHFFFAOYSA-N 396.403 2.527 50 40 GFGB CCCc1[nH]nc2c1C1(CCN(C(=O)c3ccccc3)CC1)C(C#N)=C(N)O2 5130056 XNDWZWUQEOVLPK-UHFFFAOYSA-N 377.448 2.622 50 40 GFGB CCCn1c(C)cc(/C=C(\C#N)C(=O)NCCNC(=O)Cc2ccccc2)c1C 96402591 WUIZWCQVDSZBNC-RCCKNPSSSA-N 392.503 2.897 50 40 GFGB CCCCCCC(=O)Nc1nnc(CC(=O)N/N=C/c2cccc(O)c2)s1 408732323 UNHRCOGALYLRMS-XDHOZWIPSA-N 389.481 2.845 50 40 GFGB COC(=O)[C@@H]1CCC(=O)N1/C(C)=N/NC(=O)Nc1ccc(Cl)c(Cl)c1 17197216 MZAIMLDRPPQLPG-KEGHGJGQSA-N 387.223 2.612 50 40 GFGB COc1cc([C@@H]2ON=C(C(=O)N/N=C/c3cccc(F)c3)[C@H]2C)cc2c1OCO2 15085846 FKAOOHCPBVJUHX-KYQLCRPWSA-N 399.378 2.777 50 40 GFGB CCCN(CCC)CN1C(=O)/C(=N/NC(=O)c2ccncc2)c2ccccc21 100180257 KOHMXGBDFMWAMM-FCDQGJHFSA-N 379.464 2.642 50 40 GFGB COc1cc(OC)c([C@@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)cc1OC 40544852 RIAQACXBDKIYPR-IBGZPJMESA-N 382.372 2.659 50 40 GFGB COc1cc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)ccc1OC(C)C 8030415 VZOHBVNCQNDFTR-UHFFFAOYSA-N 394.431 2.743 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccc2Br)cc(OC)c1O 1102893 VVKIZEHBHHQUQT-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB Cc1ccc(NCC(=O)NNC(=O)c2cc(C3CC3)nc3onc(C)c23)c(C)c1 12543023 YUSNOVVBDPNWBR-UHFFFAOYSA-N 393.447 2.899 50 40 GFGB CNC(=O)/C(C#N)=C1\S[C@H](Cc2ccc(F)cc2)C(=O)N1c1ccccc1 16689692 MBQXLERWRONYIG-XUMLYMLNSA-N 381.432 2.998 50 40 GFGB CCOc1cccc(/C=N\NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)c1O 17126182 NNZVOPPZPAAXRN-YVNNLAQVSA-N 395.337 2.899 50 40 GFGB O=C(N/N=C\c1ccccc1[N+](=O)[O-])C(O)(c1ccccc1)c1ccccc1 5515733 PIJHXQYMACFIFH-JCMHNJIXSA-N 375.384 2.981 50 40 GFGB CCOC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)C1 30599692 QGLYTKXKWWTQAU-OAHLLOKOSA-N 375.469 2.614 50 40 GFGB C/C(=N/NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])o1 4697706 QQPQWJOBBVGHJA-STZFKDTASA-N 379.372 2.964 50 40 GFGB CN1[C@@H]2C=C3C(C#N)=C(N)C(C#N)(C#N)[C@@H](c4c(F)cccc4F)[C@H]3[C@H]1CC2 6785878 JBPGDEKLKIFDTA-GIYVSIDVSA-N 377.398 2.851 50 40 GFGB COc1cc(/C=N/NC(=O)C(=O)Nc2cccc(Cl)c2)cc(Cl)c1O 59475507 DZOSXJBKVOZPHG-UFWORHAWSA-N 382.203 2.796 50 40 GFGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@@H]2CCCC[C@@H]2C(=O)O)c1 4000809 YLWGTLSJKNJWCJ-CVEARBPZSA-N 376.453 2.536 50 40 GFGB CC1=C(C#N)[C@](NC(=O)c2cncc(Br)c2)(C(F)(F)F)C(O)=N1 40288378 QEYYHKXBUJZFRN-GFCCVEGCSA-N 389.131 2.643 50 40 GFGB O=C(N/N=C/c1c(Cl)cccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1 58884994 IJTXDIFWEGEDBM-QGMBQPNBSA-N 381.175 2.990 50 40 GFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)c2ccc(OC)cc2OC)cc1 100522616 RPRMFNHOADBKSR-OEAKJJBVSA-N 399.447 2.525 50 40 GFGB Cc1ccc(NCC(=O)NNC(=O)c2c(C)oc(-n3cccc3)c2C#N)c(C)c1 12534597 NLQAWFIKLBYQRK-UHFFFAOYSA-N 391.431 2.740 50 40 GFGB CCCCN1C(=O)/C(=N\NC(=O)c2c(C)nc3ccccn23)c2ccccc21 3221957 OBDNTRZLLASMCH-NKFKGCMQSA-N 375.432 2.924 50 40 GFGB CC(=O)c1c(C)[nH]c(C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)c1C 12767785 FMOZFZXBPMPCLX-UHFFFAOYSA-N 385.464 2.972 50 40 GFGB O=C(O)COc1ccccc1/C=N/NC(=O)CNc1ccc2ccccc2c1 4663186 JRSZKZJTECNYGV-FSJBWODESA-N 377.400 2.865 50 40 GFGB C/C(=N\NC(=O)CN(c1cccc(C)c1C)S(C)(=O)=O)c1ccc(C)cc1 408921573 IWVYUNLVZRJYEB-HEHNFIMWSA-N 387.505 2.918 50 40 GFGB Cc1cc(C)nc(SCC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)n1 5788735 ZKLLTQPPJAGWCP-UHFFFAOYSA-N 388.537 2.939 50 40 GFGB CCOc1ccc(/C=N\NC(=O)CNc2ccc3c(c2)OCO3)cc1OCC 408872095 KHSBTXYLWRHQKW-JJFYIABZSA-N 385.420 2.775 50 40 GFGB CCCCCCC(=O)NN/C=C1/C(=O)N(C2CCCCC2)C(=S)N=C1O 38169610 GWPAQXZYMRSHRW-WYMLVPIESA-N 380.514 2.878 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2ccc3ccccc3c2)cc1OC 3083927 GSGGSBSPGRSLMP-LPYMAVHISA-N 377.400 2.946 50 40 GFGB Cc1ccc(/C=N\NC(=O)c2nn(-c3ccccc3C)c(=O)c(C#N)c2C)cc1 30834269 AMRSJAKRORGYCL-CFRMEGHHSA-N 385.427 2.793 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](Cc3ccccc3)[C@H]2C1 4452984 MBUHITNHCISTPZ-RBUKOAKNSA-N 387.443 2.644 50 40 GFGB CCOc1ccc(C(=O)NC(=S)NNC(=O)c2cccs2)cc1Cl 6595886 TZLWOVIBFAXUKL-UHFFFAOYSA-N 383.882 2.750 50 40 GFGB Cc1ccc(/C=N/NC(=O)CNc2ccc(I)cc2)o1 59720922 UUROVYIYZOXLTI-CAOOACKPSA-N 383.189 2.755 50 40 GFGB CSCC[C@H](NC(=O)c1ccccc1)C(=O)N/N=C/c1ccc(N(C)C)cc1 2072537 KOVGICHQKPKXKM-OMNSNBSWSA-N 398.532 2.754 50 40 GFGB O=C(Cc1nnc(NC(=O)c2ccccc2)s1)N/N=C/c1ccc(F)cc1 2305147 PMGWIPSNLGSQJT-RGVLZGJSSA-N 383.408 2.622 50 40 GFGB N#C/C(=C/c1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc2c(c1)OCCO2 96669614 LUADRAIUCNDQAP-LGMDPLHJSA-N 391.427 2.840 50 40 GFGB O=C(COc1ccc2ccccc2c1)NNS(=O)(=O)c1ccccc1Cl 32855689 CONDKLOHMZLQQX-UHFFFAOYSA-N 390.848 2.882 50 40 GFGB COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NC2CCCCC2)c1C 13163999 HXIOVYPUXAAUQG-LDADJPATSA-N 387.480 2.650 50 40 GFGB CCOc1cc2c(cc1/C=N/NC(=O)COc1cccc(Cl)c1)OCO2 409103060 DAMSPYPROCLZPX-AWQFTUOYSA-N 376.796 2.997 50 40 GFGB COc1cc(/C=N/NC(=O)[C@H]2COc3ccc(C(C)(C)C)cc3O2)ccc1O 2347754 FETAWLRDNIIYCH-AZHVYHFMSA-N 384.432 2.988 50 40 GFGB CNC(=O)/C(C#N)=C1/S[C@H](Cc2ccc(F)cc2)C(=O)N1c1ccccc1 4995686 MBQXLERWRONYIG-PBEQFFAXSA-N 381.432 2.998 50 40 GFGB O=C(CNc1ccccc1)N/N=C/c1ccccc1I 6867003 LOCFYOLCWZKLQS-VCHYOVAHSA-N 379.201 2.853 50 40 GFGB COc1ccc(OCC(=O)N/N=C/c2cccn2-c2cccc(C(=O)O)c2)cc1 6320109 SLIGISOBSVTVPY-LPYMAVHISA-N 393.399 2.713 50 40 GFGB Cc1ccc(C(=O)NNC(=O)[C@@H](C)Nc2nc3ccccc3s2)cc1[N+](=O)[O-] 8984352 GFHZRZODFFFDCV-LLVKDONJSA-N 399.432 2.775 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)Nc2cccc(Cl)c2)ccc1OCC(N)=O 408735596 UWGFCSGNIVAEOJ-NTUHNPAUSA-N 385.807 2.758 50 40 GFGB COc1cc(/C=C(/C#N)C(=O)NC(C)C)c(Br)cc1OCC#N 408785794 ZKFBWJMMAYNXMW-SDQBBNPISA-N 378.226 2.792 50 40 GFGB COc1ccc(/C=N/NC(=O)c2ccc(Br)cc2)cc1C(=O)O 5558849 ULFCKAXSYGZSOB-GIJQJNRQSA-N 377.194 2.920 50 40 GFGB CCOC(=O)CSC1=C(C#N)[C@@H](c2ccccc2Cl)[C@H](C#N)C(=O)N1 9089226 UNUYGJHEVDOABG-NHYWBVRUSA-N 375.837 2.725 50 40 GFGB CCOc1cc(/C=N\NC(=O)c2sc(N)nc2C)cc(Br)c1O 31833843 LIMCSRBULYSYLD-FMQZQXMHSA-N 399.270 2.664 50 40 GFGB Cc1ccc(C(=O)NNC(=O)c2ccccc2I)cc1 866234 SBVDGZNCXIXCKG-UHFFFAOYSA-N 380.185 2.674 50 40 GFGB O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2C(=O)O)o1)c1ccncc1 409038029 DFMSUTIJUVSGFB-KEBDBYFISA-N 380.316 2.712 50 40 GFGB CCc1ccccc1N(CC(=O)N/N=C/c1ccc(Cl)cc1)S(C)(=O)=O 408788823 HZZARVNUSQDILE-UDWIEESQSA-N 393.896 2.819 50 40 GFGB CC(C)(C)NNC(=O)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1 1628555 NYXYILHCWMNLJS-LGMDPLHJSA-N 382.420 2.785 50 40 GFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)COc2ccc(OC)cc2)cc1 13590306 OFYNCNDGYBNEPQ-HYARGMPZSA-N 385.420 2.604 50 40 GFGB CC1(C)[C@@]2(C)CC[C@@]1(C(=O)NCCN1CCCCC1)[C@H](Br)C2=O 100868379 PLSNWPRDSCYRJM-BVGQSLNGSA-N 385.346 2.747 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc([N+](=O)[O-])c1O 59485029 OAUYROIWKYFTMO-VZUCSPMQSA-N 384.304 2.763 50 40 GFGB C=C(C)C(=O)OCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1ccc(CC)cc1 2274616 NUUOUAVKRIPXTO-IBGZPJMESA-N 396.443 2.993 50 40 GFGB CCOc1cc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)ccc1OCC(N)=O 409202752 UNJKLYWPRQZFMO-YBEGLDIGSA-N 379.416 2.804 50 40 GFGB COc1cc(Cl)c(/C=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1OC 408588830 JXWSVSLKGKYZEU-VXLYETTFSA-N 377.784 2.958 50 40 GFGB COc1cc(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)ccc1O 3059277 YRLNSYYZNLYHFT-ZVBGSRNCSA-N 381.310 2.508 50 40 GFGB COc1ccc(/C=N/NC(=O)CNC(=O)c2cc(Cl)ccc2Cl)cc1 4079642 MHYANGKELSOPEZ-ZVBGSRNCSA-N 380.231 2.882 50 40 GFGB Cc1cccc(C(=O)N[C@H](C(=O)N/N=C\c2ccc([N+](=O)[O-])cc2)C(C)C)c1 101506567 SHRFYRWFCYVNNZ-UMUMUWHJSA-N 382.420 2.808 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)N(C)C)ccc1OCc1ccc(C(=O)O)cc1 408761367 IXRAPOIVPZPOCU-LICLKQGHSA-N 380.400 2.968 50 40 GFGB COc1ccc(C(=O)NNC(=O)c2ccccc2NC(=O)c2ccco2)cc1 16509523 GLWUPBNGCNIYTF-UHFFFAOYSA-N 379.372 2.615 50 40 GFGB COC(=O)[C@@H]1/C(=N/NC(=O)c2ccccc2)C[C@@](C)(O)C[C@@H]1c1ccccc1 100249739 UXDWCDGUZQAGFL-XYTCSZDDSA-N 380.444 2.890 50 40 GFGB CC(C)(C)c1ccc2c(c1)O[C@H](C(=O)N/N=C\c1ccc(C(=O)O)cc1)CO2 31853573 MNLSWXXIUIOFKC-JGVLGKFESA-N 382.416 2.972 50 40 GFGB CCc1cc(C(=O)NNC(=O)CSc2nnc(C3CC3)n2CC)sc1C 6879117 UMQAGZYOZUQDBI-UHFFFAOYSA-N 393.538 2.661 50 40 GFGB COc1ccc(CC(=O)NNC(=O)COc2ccc(Cl)c(C)c2C)cc1 1926733 SPWQMCAUDSUGLU-UHFFFAOYSA-N 376.840 2.734 50 40 GFGB Cc1ccc(OCC(=O)N/N=C2\C(=O)N(CCCC#N)c3ccccc32)cc1 6199418 NSLOMXDAODYBMY-GFMRDNFCSA-N 376.416 2.545 50 40 GFGB COc1cc(/C=N/NC(=O)COc2ccc(C)cc2[N+](=O)[O-])cc(Cl)c1O 6189940 IPNKWTRBMYURMO-UFWORHAWSA-N 393.783 2.800 50 40 GFGB O=C(Cn1nc(C(F)F)cc1C(F)F)NNC(=S)Nc1ccc(F)cc1 8681012 FUFPPULQPVUEQM-UHFFFAOYSA-N 393.341 2.915 50 40 GFGB COc1ccc2[nH]c(C(=O)NNC(=O)Cn3c(C)cc4ccccc43)cc2c1 4746757 ZJNVFPGESFTNOC-UHFFFAOYSA-N 376.416 2.901 50 40 GFGB CCN(NC(=O)c1cn(-c2ccc3c(c2)OCCO3)nn1)c1ccc(C)cc1 40079675 NAQUWLGWRZKAGA-UHFFFAOYSA-N 379.420 2.518 50 40 GFGB CCOc1cc(/C=N/NC(=O)[C@H](C#N)c2ccccc2)ccc1OCCOC 6961165 JNOIWCMZWCOMKU-MMTNMYCKSA-N 381.432 2.868 50 40 GFGB CCOc1cc(/C=N/NC(=O)c2cccc(N(C)C)c2)ccc1O[C@H](C)C(=O)O 4677916 WMTQEYVYDSWEPE-CYGNYLSHSA-N 399.447 2.767 50 40 GFGB COc1ccc(NC(=O)/C(C#N)=C/c2cccc(OCC(=O)O)c2)c([N+](=O)[O-])c1 408922200 DYGAQZHREVESOF-NTUHNPAUSA-N 397.343 2.612 50 40 GFGB O=C(NNC(=O)c1cccc(NC(=O)c2ccco2)c1)c1ccc([N+](=O)[O-])cc1 4682247 OPYSXWYEPLZRPW-UHFFFAOYSA-N 394.343 2.515 50 40 GFGB N#C/C(=C\c1ccc(OCc2cccc(C(=O)O)c2)cc1)C(=O)N1CCOCC1 4723482 JZCJZAMTICCZBM-XDHOZWIPSA-N 392.411 2.730 50 40 GFGB COc1cc(/C=N/NC(=O)c2cccnc2)ccc1OCc1ccc(C(=O)O)o1 9667887 BULOEYHDSVQRMZ-LSHDLFTRSA-N 395.371 2.724 50 40 GFGB COc1ccc(Br)cc1C(=O)NNC(=S)NCc1ccccc1 158351308 CKMFSMHKRWRQPT-UHFFFAOYSA-N 394.294 2.767 50 40 GFGB CCCCCCOc1ccc(C(=O)NNS(=O)(=O)c2c(C)noc2C)cc1 7520386 ISFKOUUZGKIQKN-UHFFFAOYSA-N 395.481 2.874 50 40 GFGB COc1ccc(/C=N\NC(=O)COc2cccc3cccnc23)c(OC)c1OC 409023835 RRORINMLSAKURJ-FMCGGJTJSA-N 395.415 2.790 50 40 GFGB COc1ccc(CC(=O)N/N=C(\C)CC(=O)Nc2ccc(F)cc2)cc1OC 100028975 JGCBVLLUWSZFMD-YDZHTSKRSA-N 387.411 2.906 50 40 GFGB COc1cc(C(=O)N/N=C/c2ccc(N(C)CCO)cc2)ccc1OC(C)C 21274393 GKSRZIRCPQSRHI-HYARGMPZSA-N 385.464 2.675 50 40 GFGB NC(=O)N/N=C/c1cccc(OCCOc2ccc(Br)cc2)c1 4551716 ZKBPVTJBYVOKQE-YBFXNURJSA-N 378.226 2.909 50 40 GFGB Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1ccc2c(c1)OCO2 6790282 PFGAGNJMUIQZLF-GFCCVEGCSA-N 390.823 2.914 50 40 GFGB CCOC(=O)CCC(=O)NNC(=O)CSc1cc(Cl)ccc1Cl 15465103 LVNMDYXKNMFFPB-UHFFFAOYSA-N 379.265 2.576 50 40 GFGB O=C1Oc2ccc([N+](=O)[O-])cc2CN1S(=O)(=O)Oc1ccc(Cl)cc1 255189543 QNQGYZMYQPLXGR-UHFFFAOYSA-N 384.753 2.886 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1cc(Cl)ccc1O 408912885 RULXKGONPRQSRE-GKXUUXLPSA-N 389.839 2.853 50 40 GFGB C#CCN1C(=O)/C(=N\NC(=O)CNc2cccc3ccccc23)c2ccccc21 18136726 LPECJBGGSLWYRQ-ROMGYVFFSA-N 382.423 2.752 50 40 GFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(OC)cc1C 408606138 OQBCHHOTSWFCJU-INIZCTEOSA-N 384.461 2.952 50 40 GFGB O=C(N/N=C/c1ccc(CNS(=O)(=O)c2ccccc2)o1)c1ccccc1 408775418 PXGSQMMDPHASLG-DEDYPNTBSA-N 383.429 2.522 50 40 GFGB CCOC(=O)c1nn(-c2ccccc2)c(=O)c2c(NC(=O)CCl)scc12 4121250 RYGJQCLNMSIWPH-UHFFFAOYSA-N 391.836 2.801 50 40 GFGB Cc1c(Cl)cccc1NC(=O)CCC(=O)NNC(=O)COc1ccccc1 2132118 ARYWJXIGJLIFCU-UHFFFAOYSA-N 389.839 2.594 50 40 GFGB Cc1cccc(C)c1N1C[C@H](C(=O)NNC(=O)c2ccccc2Cl)CC1=O 7928369 DKKNPEGDOCXRIA-CQSZACIVSA-N 385.851 2.771 50 40 GFGB COc1ccccc1C(=O)N/N=C(\C)CC(=O)Nc1ccccc1NC(C)=O 100530296 ATCONRTUMKCFNC-YDZHTSKRSA-N 382.420 2.788 50 40 GFGB Cc1ccc2c(c1)[C@@]1(C(=O)N2)C(C#N)=C(N)Oc2c1c(C)nn2-c1ccccc1 3223904 NCWJWOVDQVNJBD-JOCHJYFZSA-N 383.411 2.814 50 40 GFGB COc1ccc(C(=O)N/N=C(\C)c2ccc(N3CCOCC3)cc2)cc1OC 5164078 RFXNWGIXWFZUOD-PXLXIMEGSA-N 383.448 2.694 50 40 GFGB O=C(Cc1nnc(NC(=O)Nc2ccccc2)s1)N/N=C/c1cccc(O)c1 1885954 FOQARZBIXKZICM-YBFXNURJSA-N 396.432 2.581 50 40 GFGB O=C(NNC(=O)[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)O)c1ccc(OC2CCCC2)cc1 102204733 OZLPYWOSLSDFOH-USJZOSNVSA-N 386.448 2.516 50 40 GFGB COc1ccc(C(=O)Oc2ccc(/C=N/NC(=O)c3cc(C)n[nH]3)cc2)cc1 8026424 WRLXVKNLBBDCOE-CIAFOILYSA-N 378.388 2.710 50 40 GFGB COc1ccccc1OCC(=O)NNC(=O)C(C)(C)Oc1ccc(Cl)cc1 12808306 QSICOWINKKBZSB-UHFFFAOYSA-N 392.839 2.732 50 40 GFGB O=C(CCC(=O)c1ccc(F)cc1)NNC(=O)c1cncn1-c1ccc(F)cc1 8294268 RQTWBBCTNMJPND-UHFFFAOYSA-N 398.369 2.575 50 40 GFGB C[C@H](NNC(=O)c1ccccc1Br)C(=O)Nc1sccc1C#N 8777370 XBCASYSYVORGFL-VIFPVBQESA-N 393.266 2.644 50 40 GFGB Cc1c(C)c(C)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)c(C)c1C 7428749 BEOIAANXZAWXCL-UHFFFAOYSA-N 390.461 2.581 50 40 GFGB NNC(=O)c1cn(C(=O)COc2ccc(Br)cc2)c2ccccc12 218741076 BRDDBSJCKJTKRH-UHFFFAOYSA-N 388.221 2.727 50 40 GFGB O=C(CNc1ccc(Br)cc1)N/N=C/c1ccc([N+](=O)[O-])cc1 3148135 NNQYWYDZCLBNFR-GIJQJNRQSA-N 377.198 2.920 50 40 GFGB CCc1cc(-c2n[nH]cc2-c2nc(C)cs2)c(O)cc1O[C@H](C)C(=O)NN 9329270 FEZYVTWASXVQDS-SNVBAGLBSA-N 387.465 2.534 50 40 GFGB O=C1[C@H]2[C@@H]3C[C@H]([C@@H](Br)[C@H]3Br)[C@@H]2C(=O)N1c1ccccc1 100181237 JNUMSHAQCAUPTM-RHIYVLOFSA-N 399.082 2.969 50 40 GFGB CCCCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2)c(OC)c1 408607895 FLZMXJMDMWETMP-OEAKJJBVSA-N 383.448 2.641 50 40 GFGB C#CCOc1cc(Br)c(/C=C(/C#N)C(=O)NC(C)C)cc1OC 408768088 SUTUFAAUIPIGJX-QPEQYQDCSA-N 377.238 2.901 50 40 GFGB O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)NNC(=O)c1ccccc1 6172300 GKSRWURFVHPERS-UHFFFAOYSA-N 388.836 2.943 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2ccc(OC3CSC3)cc2)cc1OC 6761895 ZDKFRGGRPKQQCH-SRZZPIQSSA-N 386.473 2.891 50 40 GFGB I[C@@H]1[C@@H]2[C@H]3[C@@H]4[C@H]1[C@@H]1[C@@H]2[C@H]([C@@H]3I)[C@@H]41 104282172 CTOZWVMTSCJSMU-DANGZQMRSA-N 383.998 2.591 50 40 GFGB Cc1ccc(O[C@@H](C)C(=O)NNC(=O)CCC(=O)Nc2ccc(C)cc2C)cc1 12292678 XZVGGRWIPIUDAH-KRWDZBQOSA-N 397.475 2.945 50 40 GFGB C/C(=N\NC(=O)c1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)c(F)c1 8103215 LRXUMHPYBMWBPI-LPYMAVHISA-N 385.395 2.545 50 40 GFGB CCCCCn1nc(C(=O)NNC(=O)c2ccoc2C)c2ccccc2c1=O 17397998 XNDLZQOJRNXRTG-UHFFFAOYSA-N 382.420 2.563 50 40 GFGB O=C(Cl)CCCCCOC(=O)COCC(=O)OCCCCCC(=O)Cl 142103734 PWHRLEHFGKEEMH-UHFFFAOYSA-N 399.267 2.741 50 40 GFGB C#CCOc1ccccc1/C=N/NC(=O)COc1ccc(Br)cc1 3088776 WGSRQDROQMYAQM-UDWIEESQSA-N 387.233 2.990 50 40 GFGB N#CC1=C(N)N(N2CCOCC2)C2=C(C(=O)CCC2)[C@@H]1c1cccc(Cl)c1 691477 ZSGQMKQIYRYNQJ-GOSISDBHSA-N 384.867 2.687 50 40 GFGB COC(=O)COc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1 818638 QCLQLZOIQSHBPW-GOSISDBHSA-N 382.416 2.689 50 40 GFGB N#C/C(=C/c1ccc(OCc2ccccc2)cc1)C(=O)NCCN1CCOCC1 24061642 WEYMSURLYHWICM-PGMHBOJBSA-N 391.471 2.621 50 40 GFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)cc(OC)c1OC 2502491 LLTPNRJVRNURSX-SFHVURJKSA-N 382.372 2.659 50 40 GFGB CC1=C(C#N)C(=O)NC(=O)/C1=C\NC(=O)Nc1c2ccccc2nc2ccccc12 100959094 RJUXMEHGJLBXIZ-WJDWOHSUSA-N 397.394 2.890 50 40 GFGB COCCCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2c(C)cccc2C)c1C 58914048 OSVWIFKNKLVHNN-OYKKKHCWSA-N 398.507 2.704 50 40 GFGB CCOC(=O)[C@H](CC)/C(C)=N/NC(=O)CCC(=O)Nc1ccc(OCC)cc1 13146030 HHRXRTVCQJQMFY-FEMWLQECSA-N 391.468 2.885 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2O)cc(OC)c1OC 5020873 RDRIOEUEHCUDGC-WUXMJOGZSA-N 399.359 2.872 50 40 GFGB CC(=O)Oc1ccccc1/C=N/NC(=O)C(O)(c1ccccc1)c1ccccc1 4503217 XJNFKVQPYHABPB-LFVJCYFKSA-N 388.423 2.998 50 40 GFGB COc1ccc(CC(=O)NNC(=O)COc2ccc(Cl)cc2Cl)cc1 5917014 FZMOZRGLBVIJMO-UHFFFAOYSA-N 383.231 2.771 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](Cc3ccccc3)[C@H]2C1 804116 MBUHITNHCISTPZ-OALUTQOASA-N 387.443 2.644 50 40 GFGB C=CCc1cccc2cc(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c(=O)oc12 841023 ZTAHXAPPQPZHIT-UHFFFAOYSA-N 393.355 2.505 50 40 GFGB N#C/C(=C/N1CCN(Cc2ccc3c(c2)OCO3)CC1)C(=O)Nc1ccccc1 100676505 HUFXYOPIFYBPLH-SDXDJHTJSA-N 390.443 2.579 50 40 GFGB NC(=O)Cn1cc(/C=N/NC(=O)c2ccccc2Br)c2ccccc21 6616430 YWFKEDNEZFPPMR-ZVBGSRNCSA-N 399.248 2.653 50 40 GFGB N#CC1=C(N)[C@H](C#N)C(c2cccc(Br)c2)=N[C@@H]1Br 100252814 YMZFTOISGRWCPC-ZANVPECISA-N 380.043 2.849 50 40 GFGB CC(=O)NNC(=O)c1csc(-n2nc(C(F)(F)F)cc2-c2ccccc2)n1 1415714 KELVUCPKXDZLLA-UHFFFAOYSA-N 395.366 2.796 50 40 GFGB COc1ccc(C)cc1CC(=O)NNC(=O)[C@H](C)Nc1nc2ccccc2s1 10675654 GVVVWKQPHXEVEL-ZDUSSCGKSA-N 398.488 2.804 50 40 GFGB Cn1c(=O)n(C)c2cc(/C=N/NC(=O)c3cccc(C(F)(F)F)c3)ccc21 4742973 DHNXKJUQHWRPJU-LSHDLFTRSA-N 376.338 2.660 50 40 GFGB COc1cc(N2CCCC2)ccc1/C=N\NC(=O)Cc1ccccc1[N+](=O)[O-] 34759854 JEWUDPSMTVJIKN-STZFKDTASA-N 382.420 2.896 50 40 GFGB COc1ccc(OC)c(C=NNC(=O)COc2ccc(Br)cc2)c1 245238514 SDEBPSZKKKEGAN-UHFFFAOYSA-N 393.237 2.995 50 40 GFGB COC(=O)c1cc(OC)c(OC)cc1N/C=C(/C#N)C(=O)NC1CCCCC1 102673274 JOLYREPIHLJEDV-SEYXRHQNSA-N 387.436 2.759 50 40 GFGB COC(=O)C1=C(N)SS/C1=C(\N=N/c1ccc([N+](=O)[O-])cc1)[N+](=O)[O-] 104231906 GSHWXXRIRNDXEU-VDRCGHCRSA-N 383.367 2.863 50 40 GFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc(Br)c1OC 800528 QMHPVKNTPMNVPE-CYBMUJFWSA-N 391.225 2.716 50 40 GFGB O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NNC(=O)c1cccs1 8709198 MFLBNCGRZXVRML-UHFFFAOYSA-N 379.441 2.606 50 40 GFGB O=C(CCSc1ccc(F)cc1)NNS(=O)(=O)c1cccc(Cl)c1 7387248 XOKUNWFZAMAYOA-UHFFFAOYSA-N 388.873 2.971 50 40 GFGB Cc1csc(CC(=O)NNC(=O)CN2CC(C)(C)c3c(Cl)cccc32)n1 78716854 SJOWUBPQVWTTNR-UHFFFAOYSA-N 392.912 2.593 50 40 GFGB Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)COc3ccccc3Cl)cc2)n1 2639589 QLSCHOIXNNQYQN-UHFFFAOYSA-N 398.850 2.983 50 40 GFGB CCOC(=O)c1csc(N(NC(=O)CCl)C(=O)Nc2ccccc2)n1 1415214 LKZRCCJVYRYATC-UHFFFAOYSA-N 382.829 2.628 50 40 GFGB C[C@@H]1CN(CCC(=O)NNC(=O)c2ccc(-c3ccccc3)cc2)C[C@@H](C)O1 12849683 WQKRWPSGFZRFKA-IAGOWNOFSA-N 381.476 2.614 50 40 GFGB COc1ccc2cc(C(=O)NNC(=O)CNc3ccccc3OC)ccc2c1 8707259 KBCJDNCNHVGQHP-UHFFFAOYSA-N 379.416 2.730 50 40 GFGB Cc1cccc(C)c1NC(=O)C(=O)N/N=C/c1cc(Br)ccc1O 3072707 FPQNHGQJWLTQAS-DJKKODMXSA-N 390.237 2.860 50 40 GFGB COc1cc(/C=C(/C#N)C(=O)N(C)C)ccc1OCc1cccc(C(=O)O)c1 59303002 RTAVCTRYTKKBCP-MFOYZWKCSA-N 380.400 2.968 50 40 GFGB O=C(NNC(=O)c1c[nH]nc1-c1ccc2c(c1)OCCO2)c1cccc(Cl)c1 12548181 QHIFJISNZJGQEA-UHFFFAOYSA-N 398.806 2.576 50 40 GFGB CCOc1cc(/C=N/NC(=O)c2ccc3c(c2)OCCO3)cc(Cl)c1O 2295604 PFTGDYMHIFMERL-KEBDBYFISA-N 376.796 2.979 50 40 GFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccccc3Br)[C@@H]2C1 13513002 JYWYZPCDJFDJOE-NVXWUHKLSA-N 394.276 2.804 50 40 GFGB COC(=O)COc1cccc(/C=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 408862614 GZDAOXRBCDXEOD-DJKKODMXSA-N 391.767 2.564 50 40 GFGB C=CCOc1ccc(CN(C)CC(=O)NNC(=O)c2ccccc2Cl)cc1 15450292 BACRNZLOARWLDD-UHFFFAOYSA-N 387.867 2.798 50 40 GFGB Cc1ccccc1[C@H]1C(C#N)=C(N)OC2=C1S(=O)(=O)N(C)c1ccccc12 20558346 MPTOIIXFHZCHNT-KRWDZBQOSA-N 379.441 2.951 50 40 GFGB Cc1cccc([C@H]2C(C#N)=C(N)OC3=C2S(=O)(=O)N(C)c2ccccc23)c1 20558349 NBNSAFGSFSRWOF-KRWDZBQOSA-N 379.441 2.951 50 40 GFGB COc1cc(/C=N/NC(=O)COc2c(C)cccc2C)c([N+](=O)[O-])cc1OC 8496853 OMSXKNJZBJDWQK-KEBDBYFISA-N 387.392 2.758 50 40 GFGB C=CCOc1c(Br)cc(Br)cc1/C=N/NC(N)=O 2748931 QOWRBOAMYKKRNZ-GIDUJCDVSA-N 377.036 2.779 50 40 GFGB COC(=O)COc1ccccc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 818643 CCADMCHJGICWFI-GOSISDBHSA-N 382.416 2.689 50 40 GFGB COc1ccc(OC)c(NC(=O)C(=O)N/N=C/c2c(O)ccc3ccccc23)c1 59435620 VASNAVMBKBUEAW-WSDLNYQXSA-N 393.399 2.651 50 40 GFGB O=C(C[C@@H]1CCS(=O)(=O)C1)N/N=C1/C[C@H](c2ccccc2)Oc2ccccc21 38323573 YYIFVMHODGLJNA-LIDPWFMUSA-N 398.484 2.856 50 40 GFGB C=CCOc1ccc(C(=O)N/N=C\c2ccc(OCC(=O)O)cc2)cc1OCC 409335848 PHVDOXOOXXVNMK-XKZIYDEJSA-N 398.415 2.877 50 40 GFGB CC(C)OC(=O)COc1ccc(/C=N/NC(=O)c2cccc(N(C)C)c2)cc1 6327973 PTHUYAZJDCBTCK-LPYMAVHISA-N 383.448 2.847 50 40 GFGB COc1cc(OC)cc(C(=O)NNC(=O)c2ccccc2Br)c1 3021034 XJOABTVJPIWOPB-UHFFFAOYSA-N 379.210 2.541 50 40 GFGB CCCN1C(=O)[C@@]2(C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)c2ccccc21 9926815 VSJNRLJIZHCADW-HSZRJFAPSA-N 399.406 2.922 50 40 GFGB CC(=O)N[C@H](C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2)C(C)C 8420767 BETSLDGOPTXLQT-YOEHRIQHSA-N 393.553 2.821 50 40 GFGB O=C(N/N=C/c1ccc(N2CCOCC2)o1)c1ccccc1Br 409013708 DHQVEOABUGSYOC-WOJGMQOQSA-N 378.226 2.643 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1Sc1ncccn1)c1ccncc1 409091924 VSNOUBBTUHGQGU-SRZZPIQSSA-N 380.389 2.695 50 40 GFGB O=C(N/N=C\c1cc([N+](=O)[O-])cc(Br)c1O)c1cccc(O)c1 409093951 BVYHWGTYGUSQBQ-APSNUPSMSA-N 380.154 2.532 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)cc1OC 36290052 CYSMWRDBWZIWGF-RGVLZGJSSA-N 386.477 2.909 50 40 GFGB CC(C)(C)c1cc(/C=N\NC(=O)CN2CCOCC2)cc(C(C)(C)C)c1O 83261931 FUMNZWMMYSHVJU-XKZIYDEJSA-N 375.513 2.770 50 40 GFGB COc1ccc(/C=N/NC(=O)COc2cccc(Cl)c2)c(OC)c1OC 1425064 BFOJZNKGPGBWRC-KEBDBYFISA-N 378.812 2.895 50 40 GFGB O=C(N/N=C/c1ccccc1O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 7008138 RQGRZPQVVDQMDG-OEAKJJBVSA-N 398.426 2.858 50 40 GFGB CC(=O)Oc1ccc(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)cc1 101588613 IRRXBVCYUCIEDI-FSJBWODESA-N 387.395 2.876 50 40 GFGB COC(=O)c1ccc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1 3169749 IOPLBLQSRMPXIP-LFVJCYFKSA-N 388.423 2.859 50 40 GFGB COc1cc(OC)c(OC)cc1/C=C(\C#N)C(=O)Nc1ccc(C(=O)O)cc1 13060116 CMTLRXQFMSQEJR-RIYZIHGNSA-N 382.372 2.956 50 40 GFGB CO[C@H](C(=O)N/N=C1\C(=O)Nc2ccc(Br)cc21)c1ccccc1 5483063 AKZCSGRIWZFQFO-HNNXBMFYSA-N 388.221 2.609 50 40 GFGB COc1cc([C@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)cc(OC)c1OC 2502492 LLTPNRJVRNURSX-GOSISDBHSA-N 382.372 2.659 50 40 GFGB CCc1ccc(OCC(=O)NNC(=O)CCCOc2ccc(OC)cc2)cc1 8876425 ONBREEYBOWSIBN-UHFFFAOYSA-N 386.448 2.643 50 40 GFGB COc1ccc(OC)c(-c2n[nH]cc2/C=N/NC(=O)c2ccc(N(C)C)cc2)c1 972569 MUEJAMRUPOVOOG-YDZHTSKRSA-N 393.447 2.924 50 40 GFGB COc1ccc2c(CC(=O)NNC(=O)COc3ccccc3Cl)coc2c1 3553256 OQKQFQVPPQBCGF-UHFFFAOYSA-N 388.807 2.864 50 40 GFGB O=C(N/N=C\c1cc(Br)ccc1O)[C@H]1OCCc2ccccc21 26503713 ZXICQBDIXKIGTH-WSLMLHKMSA-N 375.222 2.919 50 40 GFGB C#CCOc1ccc(/C=N\NC(=O)c2ccc(OCC)c(OC)c2)cc1OC 409314066 FADKTFRKJRPIMD-HMAPJEAMSA-N 382.416 2.878 50 40 GFGB C/C(CC(=O)Nc1ccc(Br)cc1)=N/NC(=O)c1cccnc1 16136644 BPOVSYKYGBPNDH-JAIQZWGSSA-N 375.226 2.979 50 40 GFGB Cc1nc(-c2ccccc2)sc1C(=O)NNS(=O)(=O)c1cccc(C#N)c1 7387409 YKTKKYVZGMKGLY-UHFFFAOYSA-N 398.469 2.614 50 40 GFGB C[C@@]1(C(=O)N/N=C/c2ccc([N+](=O)[O-])o2)CC1(Br)Br 2100714 OJMKDDVNHXYWDF-CAOVNBRZSA-N 395.007 2.534 50 40 GFGB O=C(NNS(=O)(=O)c1csc(-c2ccc(F)cc2)n1)c1ccccc1F 58368674 CMCPFIRUVSAZHB-UHFFFAOYSA-N 395.412 2.712 50 40 GFGB Cc1cccc(C)c1OCC(=O)NNC(=O)N(C)Cc1ccc(F)cc1F 12981206 CGZWQRJVYNLMAF-UHFFFAOYSA-N 377.391 2.833 50 40 GFGB Cc1c(Cl)c([N+](=O)[O-])nn1Cc1ccc(C(=O)N/N=C\c2ccccn2)o1 4615114 AXBSGCKFCPZWAT-UWVJOHFNSA-N 388.771 2.553 50 40 GFGB CCN(CC)C(=O)/C(C#N)=C\c1cc(Br)c(N2CCOCC2)o1 408843302 DFBGDWGOJFLCDH-XFXZXTDPSA-N 382.258 2.654 50 40 GFGB CCOC(=O)[C@H](C(C)=O)[C@H](c1cccc(Cl)c1)[C@@H](C#N)C(N)=C(C#N)C#N 78547498 SJRRGLZPTOMYCZ-BRWVUGGUSA-N 384.823 2.592 50 40 GFGB C[C@H](S[C@@H](C)C(=O)N/N=C/c1ccccc1)C(=O)N/N=C/c1ccccc1 5641164 FPCODJQCYPMUTI-RMPARNTDSA-N 382.489 2.797 50 40 GFGB C=CCNc1nc2[nH]c(=O)c3c(c2s1)OC(N)=C(C#N)[C@H]3c1cccs1 15085069 MQDIOKXNSSLQGZ-JTQLQIEISA-N 383.458 2.862 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2sccc2C)S(C)(=O)=O)c(C)c1 20208196 KZFSVCSOSDGQBL-VCHYOVAHSA-N 379.507 2.590 50 40 GFGB COc1cc(OC)c(OC)cc1/C=N/NC(=O)c1ccc(Br)o1 994034 MOCKEDLEKUNIKX-CAOOACKPSA-N 383.198 2.832 50 40 GFGB CCc1ccc(N2C[C@H](C(=O)N/N=C\c3ccc(OC)cc3OC)CC2=O)cc1 409154662 HDYQJYSOLOPOPT-SUVVMJBMSA-N 395.459 2.769 50 40 GFGB COc1ccc(C)cc1CC(=O)NNC(=O)[C@@H](C)Nc1nc2ccccc2s1 10675648 GVVVWKQPHXEVEL-CYBMUJFWSA-N 398.488 2.804 50 40 GFGB CC(C)Cn1c(/C=N/NC(=O)CNC(=O)c2ccccc2)nc2ccccc21 4107574 IVLOPJNWBGMJMU-FSJBWODESA-N 377.448 2.572 50 40 GFGB COc1ccc(N2C(=O)[C@H]3SC(N)=C(C#N)C4(CCCCC4)[C@H]3C2=O)cc1 102222116 DNVFWJVHBSHAPN-CVEARBPZSA-N 383.473 2.944 50 40 GFGB Cc1ccc(NCC(=O)NNC(=O)c2cc(F)ccc2Br)cc1 12610053 JDJBWKVMWOFJPQ-UHFFFAOYSA-N 380.217 2.770 50 40 GFGB COc1ccc(Cl)cc1C(=O)NNC(=O)[C@@H]1Cc2cc(Cl)ccc2O1 12784443 LKJGLFIVZYVXOV-HNNXBMFYSA-N 381.215 2.767 50 40 GFGB Cc1ccc(NCc2nnc(S[C@H](C)C(=O)NN)n2-c2ccccc2)cc1 66324380 LUZIOMUXFKMISY-CQSZACIVSA-N 382.493 2.658 50 40 GFGB N#C/C(=C\c1ccc(OCCN2CCOCC2)cc1)C(=O)NC1CCCCC1 17078325 OHPHLBGQKKMBEG-KNTRCKAVSA-N 383.492 2.753 50 40 GFGB CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OS(=O)(=O)c1ccc(C)cc1 408765098 KEMPIDUTZSYRSV-XNTDXEJSSA-N 386.429 2.554 50 40 GFGB C[C@H](SCc1ccccc1)C(=O)NNC(=O)c1cc(Br)c[nH]1 40144398 XZJSFHKUOZAWHQ-JTQLQIEISA-N 382.283 2.860 50 40 GFGB CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@]12C(=O)Nc1ccccc12 717156 FISINVDFAFZXNV-QFIPXVFZSA-N 387.395 2.575 50 40 GFGB C=CCN1C(=O)[C@]2(C(C#N)=C(N)Oc3ccccc32)C(C(=O)OC(C)(C)C)=C1C 4517039 JRSCVNSNSLIAMS-JOCHJYFZSA-N 393.443 2.655 50 40 GFGB O=C(CSc1nc(-c2ccccc2Cl)n[nH]1)NNC(=O)c1ccccc1 9198404 FHZAPIVJAQLTFY-UHFFFAOYSA-N 387.852 2.678 50 40 GFGB O=C1[C@@H]2[C@@H]3C[C@H]([C@H](Br)[C@@H]3Br)[C@@H]2C(=O)N1c1ccccc1 100181231 JNUMSHAQCAUPTM-LVTVNPDKSA-N 399.082 2.969 50 40 GFGB COC(=O)COc1ccccc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 818642 CCADMCHJGICWFI-SFHVURJKSA-N 382.416 2.689 50 40 GFGB O=C(COC(=O)c1cc2c(s1)CCC2)NNC(=O)c1ccc(Cl)cc1 4462289 IVRBTZAJADQXMC-UHFFFAOYSA-N 378.837 2.508 50 40 GFGB COc1cccc(C(=O)N/N=C\c2cc(Br)cc([N+](=O)[O-])c2O)c1 32138832 QPDPGMUBWRIDRE-IUXPMGMMSA-N 394.181 2.835 50 40 GFGB N#CC1=C(N)[C@@H](C#N)C(c2cccc(Br)c2)=N[C@@H]1Br 100252822 YMZFTOISGRWCPC-RNCFNFMXSA-N 380.043 2.849 50 40 GFGB C/C(CC(=O)NC(C)(C)C)=N\NC(=O)COc1ccc(Br)cc1 101459952 FCBILYPLGAGHFH-YBFXNURJSA-N 384.274 2.625 50 40 GFGB Cc1cc(Br)ccc1OCC(=O)NNC(=O)Cc1ccccc1 724174 XCNJSHKVIYBEQC-UHFFFAOYSA-N 377.238 2.526 50 40 GFGB COc1cccc(N(CC(=O)NN=C(C)C)S(=O)(=O)c2ccc(C)cc2)c1 408773849 SYRGSXYEWWXUEN-UHFFFAOYSA-N 389.477 2.711 50 40 GFGB Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)c1cc(C2CC2)[nH]n1 12535711 PKCRUZKERLKLPK-UHFFFAOYSA-N 376.844 2.869 50 40 GFGB N#C/C(=C/c1cc(Br)ccc1OCC(=O)O)C(=O)NC1CCCC1 409196505 ZVXVXLZBWSQRGP-GHXNOFRVSA-N 393.237 2.878 50 40 GFGB C/C(=N\NC(=O)C1CC1)c1cccc(S(=O)(=O)NC2CCCCCC2)c1 8104084 ISHWCUVKTOHPOR-XSFVSMFZSA-N 377.510 2.938 50 40 GFGB Cc1cc([N+](=O)[O-])ccc1NC(=O)CCC(=O)N/N=C/c1ccc2c(c1)OCO2 5925494 NVQCBNGXKIPSFG-KEBDBYFISA-N 398.375 2.501 50 40 GFGB COC(=O)COc1ccc(/C=N/NC(=O)c2ccc(Br)cc2)cc1 408831294 PVLQZSMTGOOTSH-VXLYETTFSA-N 391.221 2.765 50 40 GFGB N#CCOc1ccccc1/C=N/NC(=O)CNc1ccc(Br)cc1 409353645 OYNDBJOEAGTSFB-SRZZPIQSSA-N 387.237 2.914 50 40 GFGB C/C(CC(=O)Nc1cccc(Br)c1)=N\NC(=O)c1cccnc1 101159439 MXARMVDIUYQBEJ-RGVLZGJSSA-N 375.226 2.979 50 40 GFGB O=C(N/N=C1/C(=O)N([C@H]2OC(=O)c3ccccc32)c2ccccc21)c1ccco1 101274512 GSKHRIKINZUCMX-RWVGPTSPSA-N 387.351 2.630 50 40 GFGB NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(Oc3ccccc3)cc2)c1 225501075 RGWGMWYFVXKCAX-UHFFFAOYSA-N 383.429 2.883 50 40 GFGB CCCn1c(=O)c(C(=O)N/N=C/c2ccccc2[N+](=O)[O-])c(O)c2ccccc21 100673953 PMVRBVNVAKUGPE-CIAFOILYSA-N 394.387 2.789 50 40 GFGB O=C(COc1ccc(Cl)cc1)NC(=S)NNC(=O)c1ccc(Cl)cc1 6883044 SUYHOAAAFLBIRF-UHFFFAOYSA-N 398.271 2.708 50 40 GFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1cc(Br)ccc1O 107820584 FXAFYJCVTIQTEU-MFOYZWKCSA-N 378.182 2.756 50 40 GFGB CCN(Cc1cccs1)C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O 10026631 OFONAJMYOURZFR-UHFFFAOYSA-N 385.449 2.516 50 40 GFGB CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1O 36020241 ZQOFIJVYJWVGFD-LLZYCUEYSA-N 398.419 2.595 50 40 GFGB Cc1cc(Cl)ccc1N1C(=O)C[C@H](NNC(=O)c2cccc(Cl)c2)C1=O 2199039 DWKZNBUADSITII-AWEZNQCLSA-N 392.242 2.868 50 40 GFGB C/C(=N\NC(=O)CN(c1ccc(C)c(Cl)c1)S(C)(=O)=O)c1ccccc1 408771893 KYLMZZCSFGDRDJ-XSFVSMFZSA-N 393.896 2.955 50 40 GFGB Cc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccccc3Cl)CC2=O)c(C)c1 7928094 YYIAPNFQRVVNJN-AWEZNQCLSA-N 385.851 2.771 50 40 GFGB O=C(COc1ccc2ccccc2c1Br)NNC(=O)C(F)(F)F 4589648 RTIALSGUUVQTJG-UHFFFAOYSA-N 391.143 2.691 50 40 GFGB CN1C(=O)/C(=N/NC(=O)[C@H]2COc3ccc(C(C)(C)C)cc3O2)c2ccccc21 5460866 FYAZGIUEKVVHNX-KYLWWAFNSA-N 393.443 2.621 50 40 GFGB O=C(N/N=C(/CNC(=O)c1ccccc1F)c1ccccc1)c1ccncc1 18191609 NQECFXJACZNBFS-PLRJNAJWSA-N 376.391 2.785 50 40 GFGB Cc1cccc(/C=N\NC(=O)CN(C)S(=O)(=O)c2ccc3ccccc3c2)c1 39986738 LKQMJEAIMPDIBT-HMAPJEAMSA-N 395.484 2.919 50 40 GFGB I[C@@H]1[C@@H]2[C@H]3[C@H]4[C@@H]5[C@H]([C@@H]14)[C@@H]2[C@@H]5[C@@H]3I 104282175 CTOZWVMTSCJSMU-IHMHPTRGSA-N 383.998 2.591 50 40 GFGB CCOC(=O)N1CC=C2[C@H](C1)[C@H](c1cccc(F)c1)C(C#N)=C(N)C2(C#N)C#N 664265 VAIFQJDSWFLXHA-FUHWJXTLSA-N 391.406 2.708 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)NCc2ccc3c(c2)OCO3)cc(OC)c1OC 8110077 BZDXECUHTVKNIP-GIDUJCDVSA-N 396.399 2.664 50 40 GFGB CCCCn1nc(C(=O)NNc2ccccc2[N+](=O)[O-])c2ccccc2c1=O 33026393 XRUJKOSLIKJNOJ-UHFFFAOYSA-N 381.392 2.862 50 40 GFGB CS(=O)(=O)Nc1cccc(C2=NN(C(=O)CCl)[C@H](c3ccccc3)C2)c1 23175901 DKNPWKKVOUSDJK-KRWDZBQOSA-N 391.880 2.975 50 40 GFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1cc(O)ccc1Br 3026937 VWGHSFHPIKVOOI-CAOOACKPSA-N 394.181 2.592 50 40 GFGB COc1c([C@@H]2C(C#N)=C(N)Oc3cc(N(C)C)ccc32)cc2c(c1OC)OCO2 35325990 JHAPKZPCYGOREM-QGZVFWFLSA-N 395.415 2.717 50 40 GFGB COc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc([N+](=O)[O-])s2)cc1 1848175 YBFDJQJJPQZLMR-LICLKQGHSA-N 376.394 2.534 50 40 GFGB Cc1cc2c(c(=O)n1Cc1cccs1)[C@@H](c1cccnc1)C(C#N)=C(N)O2 4179058 QPJLLVXGTKVOKI-KRWDZBQOSA-N 376.441 2.880 50 40 GFGB O=C(COCC(=O)N/N=C\C=C\c1ccccc1)N/N=C\C=C/c1ccccc1 17024701 WABIMDOQELJJMK-UECFSMFRSA-N 390.443 2.634 50 40 GFGB COc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)cc1OC 100201184 PZTVOOQTXWAIHC-KRWDZBQOSA-N 388.379 2.845 50 40 GFGB O=C(NNC(=O)c1cc(-c2cccc(Cl)c2)[nH]n1)c1cccc([N+](=O)[O-])c1 28833144 SULHPZVTBCDLSF-UHFFFAOYSA-N 385.767 2.713 50 40 GFGB Cc1cccc(-n2ncc(C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)c2C)c1 13011653 ZVJDZQPMSANVAZ-HNNXBMFYSA-N 396.422 2.857 50 40 GFGB CCOC(=O)COc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc1 408543078 ORJYNIBWVOTMSV-YBEGLDIGSA-N 394.383 2.872 50 40 GFGB COc1cc(Br)c(O)c(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c1 408599140 PHCFNUDKFYEXTG-CAOOACKPSA-N 394.181 2.835 50 40 GFGB CC(C)=NNC(=O)CN(c1cc(C(F)(F)F)ccc1Cl)S(C)(=O)=O 408913887 UWTFVIIAWMPBMP-UHFFFAOYSA-N 385.795 2.637 50 40 GFGB CC[C@@H](C)Oc1c(I)cc(/C=N/NC(C)=O)cc1OC 409013315 MWKKOLFVESTSLN-PTPOTIKZSA-N 390.221 2.947 50 40 GFGB C/C(=N/NC(=O)CSCC(=O)N/N=C(\C)c1ccccc1)c1ccccc1 17287353 PEFXBZPWWBKCKP-KBNZVFGVSA-N 382.489 2.800 50 40 GFGB C/C(CC(=O)Nc1cccnc1)=N\NC(=O)c1ccc([N+](=O)[O-])cc1Cl 100924769 JGZFDVIBZLAEEC-KEBDBYFISA-N 375.772 2.778 50 40 GFGB CNC(=O)/C(C#N)=C/c1cccn1-c1ccc(I)cc1 2800809 IZVMAIKPPXOFNI-PKNBQFBNSA-N 377.185 2.735 50 40 GFGB CCOC(=O)/C(C#N)=C/c1cn(CCC(=O)O)nc1-c1ccc(OC)c(OC)c1 3273777 MXUACKCJWHJOEM-NTEUORMPSA-N 399.403 2.512 50 40 GFGB NS(=O)(=O)c1cc(C(=O)NN(Cc2ccccc2)c2ccccc2)cs1 65551030 VCBKYCPOHUKXNV-UHFFFAOYSA-N 387.486 2.747 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1cc(Cl)ccc1O 408912890 RULXKGONPRQSRE-SVZNOHIVSA-N 389.839 2.853 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1 409263332 BQMAIBBREKSZFE-OHHQFBAHSA-N 381.407 2.894 50 40 GFGB CCOc1cc(/C=N/NC(=O)Cc2ccc(C)cc2C)ccc1OCC(=O)O 20195194 CMECIFBSMPLOFO-WSDLNYQXSA-N 384.432 2.858 50 40 GFGB COc1ccc(/C=C(\C#N)C(=O)NCc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] 1092682 OHUTXIQJPQTZOR-MKMNVTDBSA-N 381.344 2.555 50 40 GFGB COc1ccccc1/C=N/NC(=O)c1cc2cc(OC)c(OC)c(OC)c2[nH]1 2232866 LKEKUILATIHTQA-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB Cc1cc(=O)oc2cc(OCC(=O)N/N=C/c3ccccc3[N+](=O)[O-])ccc12 4871627 JGUADSFMLMTENH-KEBDBYFISA-N 381.344 2.539 50 40 GFGB C/C(=N\NC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1 19861407 BMJVGNKXIQWVGD-HAVVHWLPSA-N 384.911 2.998 50 40 GFGB NNC(=O)c1cc2c(Cl)c3sc(C(=O)NN)cc3c(Cl)c2s1 255190418 XCYBJUYHZGEUJZ-UHFFFAOYSA-N 375.262 2.630 50 40 GFGB CNC(=O)/C(C#N)=C/c1c(Oc2ccccc2Cl)nc2ccccn2c1=O 2422804 NPVYNEMPDHYCTF-ZRDIBKRKSA-N 380.791 2.793 50 40 GFGB CC(C)(C)c1ccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccoc3)C2)cc1 28409309 RISXNBJQUWOYPA-INIZCTEOSA-N 397.475 2.891 50 40 GFGB CC(C)(C)C(=O)Nc1ccc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 3059010 GVCWUGXCUWGRNI-UHFFFAOYSA-N 384.392 2.654 50 40 GFGB COc1cccc(N2C(=O)[C@@H](Cc3ccc(F)cc3)S/C2=C(/C#N)C(N)=O)c1 2372257 BEZRRNWAJDVSPU-XUMLYMLNSA-N 397.431 2.746 50 40 GFGB COc1ccc(CC(=O)NNC(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)cc1 10890176 FZOQVPMWISNDTJ-UHFFFAOYSA-N 386.407 2.910 50 40 GFGB COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 4660252 HXSAKOSCALIWSZ-NTEUORMPSA-N 381.344 2.936 50 40 GFGB CCOC(=O)CN1C(=O)/C(=C(\C#N)C(=O)Nc2ccc(C)cc2)c2ccccc21 409388701 NIACBXJDIWKATM-LVZFUZTISA-N 389.411 2.821 50 40 GFGB COC(=O)[C@H]1N(S(=O)(=O)c2ccc(C)cc2)C(C(Cl)Cl)=NC1(C)C 68571824 CAMPTDDVOBXURK-LLVKDONJSA-N 393.292 2.522 50 40 GFGB biogenic O=C(COC(=O)C(c1ccccc1)c1ccccc1)NNC(=O)c1ccccc1 5611737 VSGHPJJYBQLKEX-UHFFFAOYSA-N 388.423 2.823 50 40 GFGB COc1cc(/C=N/NC(=O)C(=O)Nc2cc(Cl)cc(Cl)c2)ccc1O 13923483 YYBDAKXGVGKPBC-UFWORHAWSA-N 382.203 2.796 50 40 GFGB COc1cccc(/C=N/NC(=O)C(=O)Nc2cc(Cl)ccc2C)c1OC 59515544 LOVBPEPDLXIBKM-KEBDBYFISA-N 375.812 2.754 50 40 GFGB O=C(NNC(=O)c1cc2ccccc2oc1=O)c1cccc(Br)c1 1064040 CSSNFCYVFJXYEA-UHFFFAOYSA-N 387.189 2.630 50 40 GFGB CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(C(F)(F)F)cc1 3428708 ZJOPCQTXGLAQHH-UHFFFAOYSA-N 382.338 2.944 50 40 GFGB Cc1cccc(C(=O)N[C@@H](C(=O)N/N=C\c2ccc([N+](=O)[O-])cc2)C(C)C)c1 34378705 SHRFYRWFCYVNNZ-UZQMFHLOSA-N 382.420 2.808 50 40 GFGB N#C/C(=C/c1ccc(OCc2cccc(C(=O)O)c2)cc1)C(=O)N1CCOCC1 33340995 JZCJZAMTICCZBM-UNOMPAQXSA-N 392.411 2.730 50 40 GFGB Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)n[nH]2)s1 32794890 STBONPFQNNATEF-NSHDSACASA-N 388.424 2.814 50 40 GFGB O=C(COc1ccc2ccccc2c1)NNC(=O)c1cc2ccccc2oc1=O 1064042 RABVOCZPZJVOIX-UHFFFAOYSA-N 388.379 2.786 50 40 GFGB O=C(CCNC(=O)c1ccccc1Cl)NNC(=O)c1ccc(Cl)cc1 3449063 NUPGYGIOKFESCE-UHFFFAOYSA-N 380.231 2.575 50 40 GFGB COc1cccc(/C=N/NC(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)c1 409007610 YFUOVZQPTIBPBH-OEAKJJBVSA-N 383.423 2.837 50 40 GFGB COC(=O)COc1ccc(/C=C(\C#N)C(=O)N2CCCC2)cc1Br 409368245 QCXRGWCQQPXELA-MDWZMJQESA-N 393.237 2.530 50 40 GFGB CC(C)(C)NC(=O)CC1(C(=O)NNC(=O)c2c[nH]c3ccccc23)CCCC1 40069660 GJTJGSCMYUSKLV-UHFFFAOYSA-N 384.480 2.794 50 40 GFGB COc1ccc(/C(C[C@H]2OC(=O)c3ccccc32)=N\NC(=O)C[N+](C)(C)C)cc1 5832206 UFHWSDAVPJUQDQ-LBMWUGKUSA-O 396.467 2.524 50 40 GFGB CCN(CC)c1ccc(C(=O)NNS(=O)(=O)c2ccc(Cl)s2)cc1 2644946 HOHKMWVEWAGARH-UHFFFAOYSA-N 387.914 2.871 50 40 GFGB COc1ccc(/C=N/NC(=O)COc2cc(C)cc(C)c2)cc1COC(C)=O 668498 GQSKNZTZHQABEI-SSDVNMTOSA-N 384.432 2.904 50 40 GFGB C[C@]1(C(=O)N/N=C/c2ccc([N+](=O)[O-])o2)CC1(Br)Br 2100718 OJMKDDVNHXYWDF-QKJUNADDSA-N 395.007 2.534 50 40 GFGB O=C(NNC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O)c1sc2ccccc2c1Cl 12809863 CGLPZOPWUVDQGV-ZJUUUORDSA-N 378.837 2.983 50 40 GFGB COc1ccc(/C=N/NC(=O)C2CCN(C(=O)c3ccc(OC)cc3)CC2)cc1 409007149 TXLJJTPNKUOTDH-HZHRSRAPSA-N 395.459 2.706 50 40 GFGB O=C(N/N=C\c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1ccc(Cl)cc1 223150313 GNIUBTCKGBMNLN-LSCVHKIXSA-N 381.175 2.990 50 40 GFGB COc1cc(/C=N/NC(=O)Cc2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC 46589799 OQZVCPJGFLRONY-VXLYETTFSA-N 377.784 2.958 50 40 GFGB COc1cc(OC)cc(C(=O)NN/C(C)=C2\C(=O)N(c3ccccc3)N=C2C)c1 103916681 HXEOTNIORNJMCW-UYRXBGFRSA-N 394.431 2.635 50 40 GFGB CCc1cc(C(=O)NNC(=O)[C@H]2[C@@H]3CC[C@H](C3=C(C)C)[C@@H]2C(=O)O)cs1 102210932 JOQGNRGLWIHDEO-VDERGJSUSA-N 376.478 2.765 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)ccc1OC(=O)c1ccco1 2628087 BWZRMBQWTKWAFH-KMPOOHAWSA-N 396.399 2.710 50 40 GFGB COc1ccc(-c2nc(N3CCOCC3)sc2C(C#N)=C(C#N)C#N)cc1 59155118 HSTLPZHZZAQFCU-UHFFFAOYSA-N 377.429 2.980 50 40 GFGB CN(C)c1cccc(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1 12553582 NZEGXLKHJSSQDL-UHFFFAOYSA-N 379.416 2.999 50 40 GFGB O=C(N/N=C/c1ccc(Cl)s1)C(=O)N/N=C/c1ccc(Cl)s1 2091850 ALXBEYNXMJXVDS-IAGONARPSA-N 375.262 2.717 50 40 GFGB COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1cc(Cl)ccc1OC 408605135 KQZQIVKMOXXGSZ-CQSZACIVSA-N 390.852 2.906 50 40 GFGB CC[C@H](C)Oc1c(I)cc(/C=N/NC(C)=O)cc1OC 409013318 MWKKOLFVESTSLN-VKPPLCHCSA-N 390.221 2.947 50 40 GFGB O=C(N/N=C\c1cccc(I)c1)c1cccc([N+](=O)[O-])c1 33325888 BCYKWINKKXGBSI-SXGWCWSVSA-N 395.156 2.963 50 40 GFGB COc1ccc(NCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1 4119023 JYDBWIDHTFOVFZ-LPYMAVHISA-N 397.435 2.766 50 40 GFGB C/C(CC(=O)Nc1ccccc1C#N)=N\NC(=O)C(=O)Nc1cc(C)ccc1C 16290967 FSEGSZIFIKWJAX-MFKUBSTISA-N 391.431 2.635 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(F)cc3)[C@@H]2C1 803614 IKNJFPNMQLFUEI-QZTJIDSGSA-N 391.406 2.708 50 40 GFGB Cc1cccc(-n2ncc(C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)c2C)c1 13011652 ZVJDZQPMSANVAZ-OAHLLOKOSA-N 396.422 2.857 50 40 GFGB N#CC1=C(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)NC(=O)C[C@H]1c1ccco1 9012711 RWAGFKKAUNNLAX-CYBMUJFWSA-N 398.400 2.898 50 40 GFGB COc1cc(C(=O)N/N=C(\CCC(=O)O)c2ccccc2)cc(OC)c1OC 5526618 VYOJFUHKJLXNNJ-RCCKNPSSSA-N 386.404 2.711 50 40 GFGB O=C(NCCCNS(=O)(=O)CCl)c1ccccc1Oc1ccccc1 72310024 CLIDABNKABMERH-UHFFFAOYSA-N 382.869 2.715 50 40 GFGB O=C(CCC(=O)NNC(=O)Cn1ccc2ccccc21)NCCC1=CCCCC1 199428252 MGHLSIGBLRFVCQ-UHFFFAOYSA-N 396.491 2.576 50 40 GFGB CC(=O)Nc1cccc(C(=O)N/N=C/c2ccc(I)o2)c1 6293860 CQRRZFDQCWZBPK-LZYBPNLTSA-N 397.172 2.607 50 40 GFGB CCOc1ccc(N2C[C@@H](C(=O)N/N=C/c3cccc(OC)c3)CC2=O)cc1 6962986 QMDSNMLLYDFJEV-QPNANDPSSA-N 381.432 2.597 50 40 GFGB C=CCNC(=O)C(=O)N/N=C/c1cc(C)n(-c2ccccc2C(F)(F)F)c1C 58911478 FSPWSSQMKORZTR-BHGWPJFGSA-N 392.381 2.865 50 40 GFGB COc1ccc(Cl)cc1C(=O)NNC(=O)[C@H]1Cc2cc(Cl)ccc2O1 12784448 LKJGLFIVZYVXOV-OAHLLOKOSA-N 381.215 2.767 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(C)cc2)cc(Cl)c1OCC(=O)O 409362360 JDFWNNNFRFILRJ-AWQFTUOYSA-N 376.796 2.884 50 40 GFGB COc1ccc(C(=O)NCC(=O)N/N=C(/C)c2ccc(Cl)cc2)cc1OC 4808456 ALFQCZDTSWLFJF-UUYOSTAYSA-N 389.839 2.627 50 40 GFGB COc1cc(/C=N/NC(=O)CSc2ccccn2)cc(Br)c1O 13284483 JKQOKFFYXZMAGH-QGMBQPNBSA-N 396.266 2.801 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2cc(Cl)ccc2C)cc1OC 3168911 CVAHVVUZKSUOIM-KEBDBYFISA-N 375.812 2.754 50 40 GFGB CCN(CC)c1ccc(C(=O)NN[C@H](C(=O)NC2CC2)c2ccccc2)cc1 12636376 GHYUUMREGRCOFP-FQEVSTJZSA-N 380.492 2.787 50 40 GFGB CCCCC(=O)NN/C=C1/C(=O)N(c2ccc(Cl)cc2)C(=S)N=C1O 4811546 GVWDBBDOPKOOMM-FMIVXFBMSA-N 380.857 2.623 50 40 GFGB COc1cccc(C(=O)N2CCC(C(=O)N/N=C/c3ccccc3F)CC2)c1 409006869 RLGFSIAIFAMQDO-OEAKJJBVSA-N 383.423 2.837 50 40 GFGB CCOC(=O)COc1ccc(/C=C(/C#N)C(=O)NC2CCCC2)cc1OCC 409195438 UMJNJPWCDLDWNK-WJDWOHSUSA-N 386.448 2.993 50 40 GFGB CCCCC(=O)NN/C=C1\C(=O)N(c2cccc3ccccc23)C(=O)N=C1O 38168422 PDLZJRNOSVCZST-QINSGFPZSA-N 380.404 2.958 50 40 GFGB COc1cccc(C(=O)N/N=C/c2ccc(OCC(=O)N3CCCCC3)cc2)c1 59437002 CKRQWTDYBBCLSH-HZHRSRAPSA-N 395.459 2.850 50 40 GFGB COc1ccc(-c2ccc(/C=N/NC(=O)Cc3nnc(N)s3)o2)cc1Cl 722430 UNJGYMZFKKOMBA-UFWORHAWSA-N 391.840 2.735 50 40 GFGB CCCCOc1ccc(/C=N/NC(=O)c2nn(C)c(=O)c3ccccc23)cc1 6507304 UURRJODGBSZOCX-HYARGMPZSA-N 378.432 2.876 50 40 GFGB C[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 5578319 LTIKKZRUVAPZTI-NMULQXRXSA-N 398.463 2.766 50 40 GFGB Cc1cccc(N(CC(=O)N/N=C/c2ccco2)S(=O)(=O)c2ccccc2)c1 19948016 XACMWBGMRZZDKD-KGENOOAVSA-N 397.456 2.934 50 40 GFGB COCC1=C(C#N)[C@@H](SS[C@H]2NC(C)=CC(COC)=C2C#N)NC(C)=C1 22000164 XCWSRBBDKFQLEX-QZTJIDSGSA-N 390.534 2.967 50 40 GFGB CCn1c(C)nc2cc(C(=O)NNC(=O)COc3ccc(C)c(C)c3)ccc21 2628388 YWXNICNCEYLJEV-UHFFFAOYSA-N 380.448 2.821 50 40 GFGB CCCCOc1ccc(C(=O)NNC(=O)c2ccnc(NC3CC3)c2)cc1OC 58015816 NBEYURXSUGWTCW-UHFFFAOYSA-N 398.463 2.918 50 40 GFGB COc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1 3396570 RMWHEVHDCJTWIB-NSHDSACASA-N 380.491 2.505 50 40 GFGB Cc1cc(OCC(=O)N/N=C/c2ccccc2OCC(=O)O)ccc1Cl 5379184 VNTJETQOOPJHOZ-AWQFTUOYSA-N 376.796 2.641 50 40 GFGB COc1ccc(Br)c(/C=N/NC(=O)COc2ccccc2OC)c1 3174474 BPLVCLQNCQRCKQ-VXLYETTFSA-N 393.237 2.995 50 40 GFGB COc1ccc(C(=O)N/N=C/c2cc3c(cc2Br)OCO3)cc1 5359183 BBOTULVBHNJTMU-QGMBQPNBSA-N 377.194 2.950 50 40 GFGB O=C(N/N=C/c1cc2cc3c(cc2[nH]c1=O)OCCO3)[C@H]1C[C@H]1c1ccccc1 8769195 BLSQYRCXVHCDSQ-GOVKSTLWSA-N 389.411 2.553 50 40 GFGB COCCCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2cc(C)ccc2C)c1C 58914051 INCIUMGBEIBEIO-OYKKKHCWSA-N 398.507 2.704 50 40 GFGB C[C@@H](Oc1ccc(/C=N/NC(=O)Cc2nnc(N)s2)cc1)c1ccccc1 1253293 HTIXXAIZTRPPAK-LNOXHEFASA-N 381.461 2.953 50 40 GFGB C/C(=N\NC(=O)c1cc2c(s1)C[C@H](C)CC2)c1ccc(OCC(N)=O)cc1 17078709 NSBLSOABDISXFB-IHYLXSPPSA-N 385.489 2.891 50 40 GFGB Cc1ccc2c(c1)/C(=N/NC(=O)c1c(C)nc3n(C)c4ccccc4n13)C(=O)N2 2221564 OIPFTPFZYNOENC-UHFFFAOYSA-N 386.415 2.529 50 40 GFGB N#CC1=C(N)C(C#N)(C#N)[C@H](c2c(F)cccc2F)[C@H]2CC3(CC=C12)OCCO3 19852945 DLJYRDMGGUMXOM-UGSOOPFHSA-N 394.381 2.911 50 40 GFGB COc1cc(/C=N\NC(=O)Cc2ccc3c(c2)OCCO3)cc(Cl)c1O 409366054 SMCNWZKWDSVEKN-JMIUGGIZSA-N 376.796 2.518 50 40 GFGB COC(=O)COc1ccc(/C=N\NC(=O)c2cc3ccccc3cc2O)cc1 39978036 KJCNUWRPIGQFNY-UUYOSTAYSA-N 378.384 2.861 50 40 GFGB Cc1ccc(O[C@@H](C)C(=O)NNC(=O)CNc2nc3ccccc3s2)cc1 14161613 JLJFXKDMEXHWBJ-ZDUSSCGKSA-N 384.461 2.632 50 40 GFGB O=C(COc1ccccc1)N/N=C\c1cc(Br)cc([N+](=O)[O-])c1O 4952307 WNKPFSKKKSRDGL-IUXPMGMMSA-N 394.181 2.592 50 40 GFGB CCOc1ccccc1N(CC(=O)NN=C1CCCCCC1)S(C)(=O)=O 20210442 HKLOADPNBAJWPW-UHFFFAOYSA-N 381.498 2.678 50 40 GFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3ccccc3F)CC2)cc1 409006402 NPZZCECABZBQDP-OEAKJJBVSA-N 383.423 2.837 50 40 GFGB O[C@@]12[C@@H]3[C@H]4[C@@H]5C[C@H]([C@@H]4[C@H]1Br)[C@@H]2[C@@H]5C3(Br)Br 100938854 WZBOKYFPZUQGLI-GVJOFLKQSA-N 398.920 2.739 50 40 GFGB COc1ccc(OC)c([C@@H]2CC(=O)N3C(=C2C#N)SC[C@]3(O)c2ccco2)c1 12276262 GSAIAQWKFTUTHP-RBZFPXEDSA-N 398.440 2.940 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2cc(C)ccc2C)cc1OC 59516015 NBKVCYVPBSLGSC-LPYMAVHISA-N 381.432 2.966 50 40 GFGB Cc1ccc(C(=O)N/N=C\c2cc(Br)cc([N+](=O)[O-])c2O)cn1 4724806 UURQWQURNVGICW-IDUWFGFVSA-N 379.170 2.530 50 40 GFGB CCOC(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)C1 30599696 QGLYTKXKWWTQAU-HNNXBMFYSA-N 375.469 2.614 50 40 GFGB C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)COc1ccccc1 4852668 GNQNAVNKRMPSHR-LLVKDONJSA-N 383.231 2.987 50 40 GFGB COc1cc(/C=N/NC(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)ccc1O 1095080 LGCXMHDTTZXTSU-YDZHTSKRSA-N 399.422 2.542 50 40 GFGB CC(C)(C)OC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1 12544761 ZRSCKZVDWXNTTQ-UHFFFAOYSA-N 391.449 2.657 50 40 GFGB CC(=O)N[C@@H](CC(=O)NNC(=O)c1ccccc1-n1cccc1)c1ccccc1 8180545 UECGSENROFBFLY-IBGZPJMESA-N 390.443 2.506 50 40 GFGB Cc1n[nH]c2c1[C@]1(C(=O)N(Cc3ccccc3)c3ccccc31)C(C#N)=C(N)O2 4741511 BAAFUFAXHQSCRP-JOCHJYFZSA-N 383.411 2.637 50 40 GFGB CCOC(=O)N/N=C/c1ccc(OCC(=O)N2CCCCC2)c(OCC)c1 7948435 BIDHJQZOSDWRJA-DEDYPNTBSA-N 377.441 2.557 50 40 GFGB O=C(COc1ccccc1)N/N=C/c1cccc(I)c1 59502287 IIIOWQMHCWKHBG-LICLKQGHSA-N 380.185 2.820 50 40 GFGB COc1ccc(C(=O)N/N=C2/C(=O)N(CN3CCCCC3)c3ccccc32)cc1 100496640 MLLDGFWQDWTURE-BSYVCWPDSA-N 392.459 2.619 50 40 GFGB O=C(CC(=O)N/N=C/c1cccc(Br)c1)NCCc1ccccc1 59516031 VNFIPUTUWIWVIW-FYJGNVAPSA-N 388.265 2.648 50 40 GFGB COC(=O)CSC1=C(C#N)[C@H](c2ccc(Br)cc2)CC(=O)N1 2196751 VSOFQKLZZVUXER-NSHDSACASA-N 381.251 2.694 50 40 GFGB O=C(N/N=C/c1c(F)cccc1F)c1cccc(S(=O)(=O)N2CCCC2)c1 3470346 HJMORBGYWPJPMU-CIAFOILYSA-N 393.415 2.513 50 40 GFGB O=C(Cc1coc2cc(O)ccc12)NNC(=O)c1ccc(Br)s1 7787096 QUURFYYUWVKFKX-UHFFFAOYSA-N 395.234 2.966 50 40 GFGB CC(C)CNC(=O)/C(C#N)=C/c1ccc(OCC(=O)NCc2ccco2)cc1 408789131 ODKZGNYRCBETMU-LICLKQGHSA-N 381.432 2.654 50 40 GFGB O=C(CNc1ccc(Br)cc1)N/N=C/c1cc([N+](=O)[O-])ccc1O 36047198 DVHKSICWQDGJSP-QGMBQPNBSA-N 393.197 2.625 50 40 GFGB CCN(CC)C[C@@H](O)Cn1cc(/C=N/NC(=O)c2ccncc2)c2ccccc21 5521170 TYVBJDZPQXPOEI-NZYROCMPSA-N 393.491 2.503 50 40 GFGB COc1ccc(O)c(/C=N/NC(=O)COc2ccc(Br)cc2)c1 1429063 FDVSVDDIMQYUQQ-GIJQJNRQSA-N 379.210 2.692 50 40 GFGB O=C(CNc1cccc(Br)c1)N/N=C/c1cccc([N+](=O)[O-])c1 1434345 BLMCVPDRWCTLLG-GIJQJNRQSA-N 377.198 2.920 50 40 GFGB C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc2cc(C)ccc2[nH]c1=O 4131444 BAZCHLSIZMHHDF-SFHVURJKSA-N 377.400 2.647 50 40 GFGB Cc1cc(C)nc(NNC(=O)[C@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)n1 32889354 MHQRDPWMASMVBG-LBPRGKRZSA-N 393.369 2.608 50 40 GFGB Cc1cccn2c(=O)c(/C=C(\C#N)C(N)=O)c(Oc3ccc(Cl)cc3)nc12 2199246 GLMLZUQFVHCWGF-FMIVXFBMSA-N 380.791 2.841 50 40 GFGB Cc1noc(C)c1COc1ccc(CC(=O)NNC(=O)OC(C)(C)C)cc1 6946019 UTZYVOMOQDPSEX-UHFFFAOYSA-N 375.425 2.969 50 40 GFGB CCCCc1ccc(NC(=O)C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2O)cc1 38166537 COXLGBMQBXQGGY-UDWIEESQSA-N 384.392 2.732 50 40 GFGB O=C(NNC(=O)C1CCN(C(=O)Nc2ccccc2)CC1)c1ccc(F)cc1 5703887 GMVJWTFLJUBZMU-UHFFFAOYSA-N 384.411 2.531 50 40 GFGB CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccc(C(=O)O)cc2)N2NC=C(C#N)C2=N1 36569251 QPKGIQAXIWKJRK-IBGZPJMESA-N 399.410 2.978 50 40 GFGB O=C1[C@H]2[C@@H](C(=O)N1c1ccccc1)[C@@H]1C[C@H]2[C@@H](Br)[C@H]1Br 6096749 JNUMSHAQCAUPTM-BCFCROPCSA-N 399.082 2.969 50 40 GFGB CCN(CC)c1ccc(/C=N/NC(=O)CCC(=O)NCc2ccccc2)c(O)c1 4090181 SCYGJRMMVPVNGP-LFVJCYFKSA-N 396.491 2.785 50 40 GFGB CCc1ccc(OCC(=O)NNC(=O)COc2ccc(Cl)c(C)c2)cc1 5877792 WICFALCAXAYXMA-UHFFFAOYSA-N 376.840 2.816 50 40 GFGB C#CCOc1ccc([C@H]2C(C#N)=C(N)N(C)C3=C2C(=O)CCC3)cc1OCC 409139559 OEOUTCARSXARGR-FQEVSTJZSA-N 377.444 2.827 50 40 GFGB COc1ccc(C(=O)N/N=C/c2cc3c(cc2Br)OCO3)c(O)c1 409393509 XXVYOFHBFOXCGF-CNHKJKLMSA-N 393.193 2.656 50 40 GFGB O=C(CNc1ccccc1)N/N=C/c1ccc(I)cc1 409375658 NPMHTJYCLATOIE-VCHYOVAHSA-N 379.201 2.853 50 40 GFGB CCc1ccc(CC(=O)N/N=C/c2cn(CCC(N)=O)c3ccccc23)cc1 409363693 MJKMOGSLJFRALQ-ZVHZXABRSA-N 376.460 2.772 50 40 GFGB COC(=O)[C@@H]1CCC(=O)N1/C(C)=N\NC(=O)Nc1ccc(Cl)c(Cl)c1 1624536 MZAIMLDRPPQLPG-SEAWGRMISA-N 387.223 2.612 50 40 GFGB CC1=C/C(=N\C(=O)CBr)C=C/C1=N\S(=O)(=O)c1ccccc1 104214321 KBZGGWYMBUCHAU-DNNBKRBVSA-N 381.251 2.695 50 40 GFGB CN(C)C(=O)/C(C#N)=C\c1cc(Cl)c(OCC(=O)O)c(Br)c1 59334032 PSTFJUFGJIFPQP-OQFOIZHKSA-N 387.617 2.561 50 40 GFGB O=C(NNS(=O)(=O)c1cccc(Br)c1)c1ccccc1Cl 8940152 VULXKIAWKIYLFA-UHFFFAOYSA-N 389.658 2.726 50 40 GFGB CCOc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCC(C)C)c2C)cc1 58903887 BNNBGSWFKUVVRB-YDZHTSKRSA-N 384.480 2.715 50 40 GFGB COc1ccc(CC(=O)NNc2ncnc3c2cnn3-c2ccc(C)cc2)cc1 1246802 FXJPCOOIORFZSQ-UHFFFAOYSA-N 388.431 2.818 50 40 GFGB O=C(CN1CCCCC1)N/N=C/c1cc2ccc([N+](=O)[O-])cc2nc1Cl 408728739 SGOWGFPDFIPMIQ-VXLYETTFSA-N 375.816 2.732 50 40 GFGB O=C(NNC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O)c1cccs1 12680479 SUAVCUDWGQFXED-UHFFFAOYSA-N 396.350 2.733 50 40 GFGB O=[N+]([O-])c1ccc(OCCO)c(P(=O)(c2ccccc2)c2ccccc2)c1 17544503 RRWCLCHPDZOUMX-UHFFFAOYSA-N 383.340 2.605 50 40 GFGB CN1C(=O)/C(=N/NC(=O)[C@@H]2COc3ccc(C(C)(C)C)cc3O2)c2ccccc21 5460837 FYAZGIUEKVVHNX-BUIMCUSZSA-N 393.443 2.621 50 40 GFGB O=C(NNC(=S)Nc1cccc(Br)c1)c1n[nH]c2ccccc12 16107819 GGOUJVPHQHLJDV-UHFFFAOYSA-N 390.266 2.957 50 40 GFGB COC(=O)COc1ccc(/C=N/NC(=O)c2ccc(C)cc2Cl)cc1OC 409052544 UTBLZHFNJSOUDP-UFFVCSGVSA-N 390.823 2.973 50 40 GFGB CCOC(=O)COc1ccc(/C=C(/C#N)C(=O)NCc2ccc(OC)cc2)cc1 408812155 BMUDAJNZLYHIDY-PDGQHHTCSA-N 394.427 2.860 50 40 GFGB O=C(NNC(=O)C1CC1)c1cc2nc(-c3cccs3)cc(C(F)(F)F)n2n1 708707 YLXHEADCDHOWKX-UHFFFAOYSA-N 395.366 2.648 50 40 GFGB O=C(CCOc1cccc(Br)c1)NNC(=O)c1ccccc1F 3341094 ZRNIAJFRJRYHJB-UHFFFAOYSA-N 381.201 2.818 50 40 GFGB CCOC(=O)N/N=C(/CP(=O)(OC)OC)c1cc2ccccc2oc1=O 4419169 PZGZUDTWBCIHCG-LGMDPLHJSA-N 382.309 2.729 50 40 GFGB COc1cc2ccccc2cc1C(=O)N/N=C/c1ccc2c(c1)n(C)c(=O)n2C 33606763 AXCMTZLKXXNZMM-YDZHTSKRSA-N 388.427 2.803 50 40 GFGB C=CCNC(=O)C(=O)N/N=C/c1cc(C)n(-c2ccc(OC)c(Cl)c2)c1C 408972638 QDXWINGLVQQPLE-SSDVNMTOSA-N 388.855 2.508 50 40 GFGB COc1ccc(O)c(/C=N/NC(=O)c2cc(Br)ccc2OC)c1 5206414 ZNHPDCHKBAMOLQ-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB Cc1cccc(C)c1N(CC(=O)N/N=C/c1cccc(Cl)c1)S(C)(=O)=O 19955348 PSDWUIHYUBBMQS-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB Cn1cc(Cl)cc1C(=O)NNC(=O)Cc1ccc(OC(F)(F)F)cc1 40120546 CRWPFRKLUYFYIA-UHFFFAOYSA-N 375.734 2.581 50 40 GFGB COc1ccc(CSCC(=O)N/N=C/c2ccc(OC)c([N+](=O)[O-])c2)cc1 59473229 XEPAHDMKLAECTO-VXLYETTFSA-N 389.433 2.996 50 40 GFGB CCOc1ccc(C(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1OCC 12578570 ZSPDJOBPUWUVFA-UHFFFAOYSA-N 388.420 2.576 50 40 GFGB CC(C)(C)c1ccc2c(c1)O[C@H](C(=O)N/N=C1/C(=O)Nc3ccccc31)CO2 5669460 FPXYCULZQIESCM-KRWDZBQOSA-N 379.416 2.597 50 40 GFGB Cc1nn2c3ccccc3n(C)c2c1C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 5446812 YVJJTYSOBFWLCC-RGVLZGJSSA-N 376.376 2.807 50 40 GFGB COc1ccc(S(=O)(=O)O)cc1P(=O)(c1ccccc1)c1ccccc1 38141382 LNVVCADBOPFPEJ-UHFFFAOYSA-N 388.381 2.581 50 40 GFGB CCN1C(=O)[C@]2(C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)c2ccccc21 4753741 DZHDSRQEWQPJSE-QFIPXVFZSA-N 385.379 2.532 50 40 GFGB Cc1cc(C(=O)NNS(=O)(=O)c2ccccc2)c(C)n1-c1ccc(F)cc1 12634136 RHJIMQJNEJTQMX-UHFFFAOYSA-N 387.436 2.857 50 40 GFGB CC(C)(C)c1cc(C(=O)N/N=C/c2cc3c(cc2Br)OCO3)[nH]n1 4811403 KSWUDVHEPISKKX-CNHKJKLMSA-N 393.241 2.962 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)c1ccc(N2CCCC2)cc1 408678364 XPXKUUGPRRRCQI-YBFXNURJSA-N 399.363 2.573 50 40 GFGB CN(C)c1ccc([N+](=O)[O-])cc1/C=N/NC(=O)COc1ccc(Cl)cc1 4180670 MDCBGOBFNYFPCQ-VXLYETTFSA-N 376.800 2.843 50 40 GFGB NC(=O)COc1ccc(/C=N/NC(=O)CSCc2ccccc2Cl)cc1 59159246 HYJSQHSTOSBRBV-ZVBGSRNCSA-N 391.880 2.588 50 40 GFGB O=C(Cc1ccc(Br)cc1)N/N=C/c1ccc(O)c([N+](=O)[O-])c1 36239640 KVULBEFWLHTMBR-RQZCQDPDSA-N 378.182 2.756 50 40 GFGB Cc1noc2nc(C3CC3)cc(C(=O)N/N=C/c3ccn(CC(F)(F)F)n3)c12 252479218 BBHZHBBTCIKFBV-QPSGOUHRSA-N 392.341 2.931 50 40 GFGB CCOc1ccc(/C=N/NC(=O)c2sc(NC(C)=O)c(C#N)c2C)cc1O 6155790 UWTIVOCUJHWTGA-AWQFTUOYSA-N 386.433 2.755 50 40 GFGB COc1cc(Br)ccc1OCC(=O)N/N=C/C(=O)c1ccccc1 3087299 JHXGSTVNXDQKAE-VXLYETTFSA-N 391.221 2.821 50 40 GFGB C#CCn1cc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)c2ccccc21 6964293 RLLDINCALRYUMP-SRZZPIQSSA-N 377.473 2.924 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2OCC)cc1OC 7869816 NVXNEZHSNWWECC-HYARGMPZSA-N 397.431 2.748 50 40 GFGB C[S@](=O)c1ccc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cc1 67337767 VLIYHVJSPRVCMW-HHHXNRCGSA-N 399.394 2.587 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)n2nc(C)cc2C)cc(Cl)c1OCC(=O)O 409377448 IBWFXQWABIXTGE-WLRTZDKTSA-N 389.795 2.873 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C\c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 408817390 XQWMHFSCCVNQKP-NVNXTCNLSA-N 397.387 2.844 50 40 GFGB C/C(=N\NC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(-c2ccccc2F)s1 46414849 DHROZGRGDLZGMT-ZGXHQARYSA-N 380.466 2.829 50 40 GFGB CN1C(=O)/C(=N/NC(=O)COc2ccc(Cl)cc2Cl)c2ccccc21 100436054 FTZUSZXLZMCFFX-LTGZKZEYSA-N 378.215 2.869 50 40 GFGB CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(/C)NNC(=O)c1ccccc1 103916636 KQODYPVCYOZNEH-ATVHPVEESA-N 379.376 2.526 50 40 GFGB Cc1noc(C)c1COc1ccccc1C(=O)NNC(=O)c1ccccc1O 12740646 FUVSRQAWSOEEBT-UHFFFAOYSA-N 381.388 2.651 50 40 GFGB Cc1cccc(OCC(=O)NNC(=O)CCC(=O)Nc2ccc(C)cc2C)c1 4523844 BVOCICKPBUZVDC-UHFFFAOYSA-N 383.448 2.557 50 40 GFGB Cc1cc(C(=O)CCC(=O)NNC(=O)COc2ccccc2F)c(C)s1 7653428 ARSKWALTSINHSK-UHFFFAOYSA-N 378.425 2.693 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2ccc(F)cc2)S(C)(=O)=O)cc1Cl 408777212 WKJUQPVXACLDHI-KEBDBYFISA-N 397.859 2.704 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2cccc(Cl)c2)S(C)(=O)=O)cc1C 408782994 JEHDGCBSSPAIPI-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB COc1cc(C(=O)NNC(=O)c2ccc(C(F)(F)F)cc2)cc(OC)c1OC 3392767 WWPFZXNHJHLWAK-UHFFFAOYSA-N 398.337 2.806 50 40 GFGB O=C(CCc1ccccc1O)NNC(=O)CSc1cccc2cccnc12 12851526 UZAUOPFRZOTWNA-UHFFFAOYSA-N 381.457 2.813 50 40 GFGB Cc1cc(C(=O)CCC(=O)NNC(=O)Cc2nc3ccccc3n2C)c(C)s1 5268907 QVTPFPKPQSAZOV-UHFFFAOYSA-N 398.488 2.605 50 40 GFGB CCc1nc2ccccc2n1CC(=O)NNC(=O)Cc1c(F)cccc1Cl 6509762 DYKDNWPGICKRHZ-UHFFFAOYSA-N 388.830 2.781 50 40 GFGB O=C(N/N=C/c1cccnc1)c1ccn(Cc2ccc(Br)cc2)n1 1091944 DYOZGHKQNAWALY-RGVLZGJSSA-N 384.237 2.853 50 40 GFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1cc2c(cc1Cl)OCO2 6170600 ZQUMFXIPLMKFBL-CNHKJKLMSA-N 377.740 2.749 50 40 GFGB Cc1cc(/C=N/NC(=O)c2ccc(O)cc2)c(C)n1NC(=O)c1ccccc1 8334500 BAGYUFUZVPNRID-LPYMAVHISA-N 376.416 2.958 50 40 GFGB N#C/C(=C\c1ccc(-c2cccc(Cl)c2)o1)C(=O)N[C@H]1CCS(=O)(=O)C1 26966560 LMOLFTVPLBIKDT-GLNPCMGASA-N 390.848 2.810 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OC)c(C)c1 408906170 ASMLJDDQTVMMPO-OVBDPADQSA-N 383.448 2.811 50 40 GFGB COc1ccccc1OCC(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1 7649883 XJOALXLKGPXTQL-OAHLLOKOSA-N 394.427 2.842 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(C)c([N+](=O)[O-])c1 408907398 NDURWKHMFBYCHF-VYVDHXHBSA-N 398.419 2.711 50 40 GFGB Cc1nc(-c2cccs2)ccc1C(=O)NNC(=O)c1ccc2c(c1)OCO2 26690536 BBJKRMUHJSQMKG-UHFFFAOYSA-N 381.413 2.922 50 40 GFGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2ccc(C)c(C)c2[nH]c1=O 876500 XCQAKZOLYRRGHQ-QGZVFWFLSA-N 379.416 2.790 50 40 GFGB COc1ccc(C(=O)NNC(=O)CCn2cnc3cc(C)c(C)cc32)cc1OC 880783 QCVHVQHFTINDPF-UHFFFAOYSA-N 396.447 2.522 50 40 GFGB C/C(CC(=O)Nc1ccc(N(C)C)cc1)=N\NC(=O)c1ccc([N+](=O)[O-])cc1 100523001 OJCNVMZUZCVQQE-FYJGNVAPSA-N 383.408 2.795 50 40 GFGB COc1ccccc1/C=N/NC(=O)C1CCN(C(=O)c2ccc(F)cc2)CC1 409005429 IOPKQJZUABTMLH-OEAKJJBVSA-N 383.423 2.837 50 40 GFGB CO[C@@H]1CC[C@@H](OC(=O)c2ccccc2)[C@H](CI)O1 5080738 CLMYZZZCONXZSG-AGIUHOORSA-N 376.190 2.799 50 40 GFGB CCCCNC(=S)NNC(=O)c1cc(C2CC2)nc2c1c(C1CC1)nn2C 17078981 QEUMTVYFUKAOAZ-UHFFFAOYSA-N 386.525 2.632 50 40 GFGB O=C(CNC(=O)c1ccc(Cl)cc1Cl)N/N=C/c1ccc2c(c1)OCO2 4551201 VAXPTHCNIUNWFW-QPSGOUHRSA-N 394.214 2.602 50 40 GFGB COc1ccc(S(=O)(=O)N(CC(=O)NN=C(C)C)c2ccc(C)cc2)cc1 408908701 XYZGOMWAFHNZIR-UHFFFAOYSA-N 389.477 2.711 50 40 GFGB COc1ccc(C(=O)NNC(=O)COC(=O)CCCC2CCCCC2)cc1 20821883 WZIXOHLZAJKCEW-UHFFFAOYSA-N 376.453 2.750 50 40 GFGB COc1cc(CCC(=O)NNC(=O)c2cccc(Cl)c2)cc(OC)c1OC 2627233 QUEFMNJYSRVOOY-UHFFFAOYSA-N 392.839 2.760 50 40 GFGB Cc1cccc(NC(=O)NNC(=O)c2cccn(Cc3cccc(F)c3)c2=O)c1 23136118 GEKPEARGKFWHSQ-UHFFFAOYSA-N 394.406 2.811 50 40 GFGB C=CCN1C(=O)[C@@]2(c3ccccc31)[C@@H]1CCCC=C1C(C#N)=C(N)C2(C#N)C#N 20161019 ZNGKIVGFDJUHRB-HXOBKFHXSA-N 381.439 2.967 50 40 GFGB COc1ccc(CC(=O)N/N=C(\C)CC(=O)NC2CCCCCC2)cc1OC 101531845 FCGLNIZCVHPQBK-HZHRSRAPSA-N 389.496 2.968 50 40 GFGB CC1(C)CC(=O)C2=C(C1)N(N1CCOCC1)C(N)=C(C#N)[C@@H]2c1ccsc1 691043 AWFXDGIGUVISGL-KRWDZBQOSA-N 384.505 2.732 50 40 GFGB Cc1cccc(N2C[C@@H](C(=O)NNC(=O)c3ccccc3Cl)CC2=O)c1C 28772996 MFXVILKRSIPVMY-AWEZNQCLSA-N 385.851 2.771 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccco1)c1cc(Cl)ccc1Cl 409025084 QIAILCHHRSTTOE-CAOOACKPSA-N 390.248 2.503 50 40 GFGB COc1cc(Br)cc(/C=C(\C#N)C(=O)NCc2ccco2)c1O 408820200 UMZJFVZLWDCJQA-VZUCSPMQSA-N 377.194 2.980 50 40 GFGB C=C(C)C(=O)OCCOC(=O)C1=C(N)OC(C)=C(C#N)[C@@H]1c1ccccc1F 5791496 CDBSCMDLFVGZME-INIZCTEOSA-N 386.379 2.570 50 40 GFGB CCc1ccc(NC(=O)C(=O)N/N=C(\C)CC(=O)Nc2ccc(F)cc2)cc1 4416539 CNTUZWWIOLEELD-ZMOGYAJESA-N 384.411 2.848 50 40 GFGB O=C(CCSCCC(=O)N/N=C/c1ccccc1)N/N=C/c1ccccc1 1577635 FMVOKYHMOJAAIR-YHARCJFQSA-N 382.489 2.800 50 40 GFGB C=CCn1c(SCC(=O)NNC(=O)c2ccccc2)nnc1-c1ccccc1 4285444 AZVNEVDKCBEYGX-UHFFFAOYSA-N 393.472 2.684 50 40 GFGB CCN(Cc1ccc(OC)c(F)c1)[C@@H](C)C(=O)NNC(=O)c1ccc(F)cc1 8324992 IZJTVOPNCMDPDI-ZDUSSCGKSA-N 391.418 2.645 50 40 GFGB C[C@H]1CCc2c(C(=O)NNC(=O)[C@H]3[C@@H](C(=O)O)[C@H]4C=C[C@H]3CC4)csc2C1 102220616 IUKBUXKYOYNLOF-GYUMKREUSA-N 388.489 2.547 50 40 GFGB C[C@H]1CCc2c(sc3ncn(CC(=O)N/N=C/c4cccs4)c(=O)c23)C1 1783501 NAJHPBISLHDWPY-FEQLDZPWSA-N 386.502 2.795 50 40 GFGB Cc1cc(C)cc(OCCC(=O)NNC(=O)c2cc(Br)c[nH]2)c1 44744756 LGDXEDHIVYMJJQ-UHFFFAOYSA-N 380.242 2.624 50 40 GFGB Cn1nc(C(=O)NNC(=O)c2ccc(-c3ccccc3)cc2)c2ccccc2c1=O 12783884 KEIBJXNHUQMFEL-UHFFFAOYSA-N 398.422 2.675 50 40 GFGB CCc1ccc2c(CC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)coc2c1 12814361 MJDNVMLZDNRKIV-IBGZPJMESA-N 380.400 2.525 50 40 GFGB N#C/C(C(=O)NC1CCCC1)=C1/N=C(NC(=O)c2cccnc2)c2ccccc21 8519283 JHAIYQXFGCCQJX-HNENSFHCSA-N 385.427 2.565 50 40 GFGB CCOc1ccc(N(CC(=O)NN=C(C)C)S(=O)(=O)c2ccccc2)cc1 19950844 GLMQGMBMYODQOX-UHFFFAOYSA-N 389.477 2.793 50 40 GFGB NC(=O)c1cc2ccccc2o/c1=N\NC(=O)c1ccc(Br)cc1 6243969 ONVFRWAQJGIMQT-FXBPSFAMSA-N 386.205 2.540 50 40 GFGB O=C(O)COc1ccccc1/C=N/NC(=O)CSc1nc2ccccc2o1 710347 MIFHLPOXOYZFCU-DJKKODMXSA-N 385.401 2.534 50 40 GFGB CCN(CC)c1ccc(C(=O)NNC(=O)CCc2cccc(OC)c2OC)cc1 7283868 OGOSSAVCARAAPJ-UHFFFAOYSA-N 399.491 2.944 50 40 GFGB CCOc1ccc(C(=O)NNC(=O)Cc2cccc3cccnc23)cc1OC 40051510 KWUPFWRKHNNAHX-UHFFFAOYSA-N 379.416 2.646 50 40 GFGB CCOC(=O)C1=C(Nc2ccccc2)OC/C1=N\NC(=O)Cc1ccccc1 17198031 KIGJRDRBHQFHRV-HAVVHWLPSA-N 379.416 2.618 50 40 GFGB Cc1cccc(O[C@H](C)C(=O)NNC(=O)COc2ccccc2Cl)c1C 6510516 MYRATBOBRNSCPG-CQSZACIVSA-N 376.840 2.951 50 40 GFGB Cn1ccnc1Sc1ccc(/C=N/NC(=O)c2ccncc2)cc1[N+](=O)[O-] 5387409 IEXUZKQJQREQGR-RGVLZGJSSA-N 382.405 2.638 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C/N2CCN(c3ccccc3)CC2)cc1 5485702 KIUTYPYNQRITOI-HTXNQAPBSA-N 376.460 2.541 50 40 GFGB O=C(N/N=C1\C(=O)N(Cc2ccc(Cl)cc2)c2ccccc21)[C@H]1CCCO1 84576887 LZNVRXHDNQPCSU-RTAFMGCNSA-N 383.835 2.886 50 40 GFGB CCOc1cc(/C=N/NC(C)=O)c(Br)c(Br)c1O 409010923 GHFSEDOILZXHME-LHHJGKSTSA-N 380.036 2.786 50 40 GFGB CCOC(=O)Cn1c(C)c(/C=N/NC(=O)c2ccccc2O)c2ccccc21 409040001 FAYGCSIJDCSFNY-WSDLNYQXSA-N 379.416 2.982 50 40 GFGB CCOc1cc([N+](=O)[O-])cc(/C=N/NC(=O)COc2ccc(C)c(C)c2)c1O 36245427 JPAKVEXDQUFCCD-KEBDBYFISA-N 387.392 2.845 50 40 GFGB O=C(Cc1nc2ccccc2[nH]c1=O)N/N=C/c1ccc(Cl)cc1Cl 5729193 GBDVHPXUKXTDSX-AWQFTUOYSA-N 375.215 2.923 50 40 GFGB COc1ccc(C(=O)N/N=C2/c3ccccc3-n3c2nc2ccccc2c3=O)cc1 5800059 YTKCBGBWHPLHDW-QQTULTPQSA-N 396.406 2.890 50 40 GFGB CCOc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4cccnc4)c32)ccc1O 8569225 PSEMKGPRYYTIAY-INIZCTEOSA-N 375.388 2.794 50 40 GFGB C[C@@H](Oc1ccc(/C=N/NC(=O)COc2cccc3cccnc23)cc1)C(=O)O 59679615 ZNDFHXPYKNWSQI-CHOFVFFHSA-N 393.399 2.616 50 40 GFGB O=C(N/N=C/c1ccccc1[N+](=O)[O-])[C@@H](O)c1ccc(Br)cc1 1444107 NFWJXURSAXRRIG-VEJKBTLKSA-N 378.182 2.541 50 40 GFGB Cc1cc(C)cc(OCC(=O)NNC(=O)COc2ccc(Cl)c(C)c2)c1 1800461 KHEYQQXCLXUSDX-UHFFFAOYSA-N 376.840 2.870 50 40 GFGB COc1cc2cc(C(=O)N/N=C/c3cccc(OC)c3OC)[nH]c2cc1OC 2203263 NHXVOGAWQSNTPM-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB O=C(Cc1cccs1)N/N=C\c1cc(Br)cc([N+](=O)[O-])c1O 4504827 HFQIUXCGRKVKOB-CHHVJCJISA-N 384.211 2.817 50 40 GFGB C/C(=N\NC(=O)CN(c1ccc(C)cc1C)S(C)(=O)=O)c1ccc(C)cc1 408783031 JMBPRKBCUPMUJH-HEHNFIMWSA-N 387.505 2.918 50 40 GFGB COc1cccc(/C=N/NC(=O)C(=O)Nc2ccc(C)c(Cl)c2)c1OC 5547213 YJHZUVBBSOARNH-KEBDBYFISA-N 375.812 2.754 50 40 GFGB O[C@@]12[C@@H](Br)[C@H]3[C@@H]4C[C@H]5[C@H]3[C@H]1C(Br)(Br)[C@H]5[C@H]42 253476499 WZBOKYFPZUQGLI-FMEQBBHISA-N 398.920 2.739 50 40 GFGB O=C(N/N=C/c1cc(Br)c(N2CCOCC2)o1)c1cccc(F)c1 59247727 KKVORAPVXYOBNT-VXLYETTFSA-N 396.216 2.782 50 40 GFGB COc1ccc(C)cc1NC(=O)C(=O)N/N=C/c1cccc(Br)c1 58884753 BPJDQOUVDMVPMV-VXLYETTFSA-N 390.237 2.855 50 40 GFGB O=C(NNC(=O)c1nc(-c2ccc(F)cc2)n2c1CCCCC2)c1ccccn1 24959206 UQMLMMTXNHKNDV-UHFFFAOYSA-N 393.422 2.885 50 40 GFGB COC(=O)COc1c(Cl)cc(/C=N/NC(=O)c2cccc(C)c2)cc1OC 409255643 ICXSOZKSSDWNRJ-UFFVCSGVSA-N 390.823 2.973 50 40 GFGB I[C@H]1CC[C@H]2O[C@@H]1CC[C@@H]2I 5542154 JGRCXIKSKJDSQB-RULNZFCNSA-N 377.991 2.935 50 40 GFGB CCOc1cc(/C=N/NC(=O)CC#N)ccc1Oc1nc(Cl)ncc1F 5906594 MNMHEHMSIBQHTM-ODCIPOBUSA-N 377.763 2.824 50 40 GFGB N#C/C(=C\c1ccc(-c2ccccc2Cl)o1)C(=O)N[C@@H]1CCS(=O)(=O)C1 26966800 QKKYPSCUKSWMQB-CNELAYHGSA-N 390.848 2.810 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])c2cccnc2c1O)c1cccc([N+](=O)[O-])c1 59459108 ZNOSRGICKZJMRW-DJKKODMXSA-N 381.304 2.521 50 40 GFGB COc1cc(/C=N\NC(=O)c2cccnc2)ccc1Oc1ccc([N+](=O)[O-])cn1 31842152 QKOOKNGYGHHZQQ-YVNNLAQVSA-N 393.359 2.950 50 40 GFGB CN1/C(=C(\C#N)C(=O)CSc2n[nH]c(=O)n2C2CC2)Sc2ccccc21 103979679 FTXXPYCNIADKRJ-PTNGSMBKSA-N 385.474 2.545 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)C(=O)Nc2ccc(Cl)cc2C)c1 3060068 DMKILNJZXGEKSU-KEBDBYFISA-N 375.812 2.754 50 40 GFGB N#CCOc1ccc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)cc1 59472803 RQQOSBQIOINTMO-RGVLZGJSSA-N 384.417 2.881 50 40 GFGB CCc1ccc(N(CC(=O)N/N=C(\C)c2ccc(F)cc2)S(C)(=O)=O)cc1 409028939 UXQMGLSHOKCGBU-KGENOOAVSA-N 391.468 2.695 50 40 GFGB Cn1cc(C(=O)NNS(=O)(=O)c2ccc(C(F)(F)F)cc2)c2ccccc21 7907468 ADZPZEUIBXLRTJ-UHFFFAOYSA-N 397.378 2.820 50 40 GFGB CCCn1nc(C(=O)N/N=C/c2ccc(OC)c(OC)c2)c2ccccc2c1=O 6509281 BFDHCPIGKABSNI-LPYMAVHISA-N 394.431 2.588 50 40 GFGB COc1ccc(C(=O)N/N=C/c2ccc(O)c(I)c2)cc1 5744466 PNHMLESODMWRKC-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB COc1ccc(C(=O)Oc2ccc(/C=C(\C#N)C(=O)N3CCOCC3)cc2)cc1 408767566 YOPLJPJHKQLNGZ-NBVRZTHBSA-N 392.411 2.680 50 40 GFGB O=C(NC/C(=N/NC(=O)c1ccncc1)c1ccccc1)c1ccc(F)cc1 12345975 JUEAOGUUHICSCM-PLRJNAJWSA-N 376.391 2.785 50 40 GFGB COc1ccc(OC)c(/C=N\NC(=O)c2cc(Br)ccc2O)c1 12419820 OMQMTGRVIGLFKP-NVMNQCDNSA-N 379.210 2.936 50 40 GFGB N#C/C(C(N)=O)=C1/S[C@@H](Cc2ccc(F)cc2)C(=O)N1c1ccc(F)cc1 16758878 GMVYCOUTOUXLQN-JQSQVVPISA-N 385.395 2.876 50 40 GFGB O=C(N/N=C1/CCCc2ccccc21)c1cccc(S(=O)(=O)N2CCCC2)c1 103209105 PIOBQWCRTJDHLU-XDOYNYLZSA-N 397.500 2.942 50 40 GFGB COc1ccc(C(=O)NNC(=O)CCCSc2nc3ccccc3[nH]2)cc1 12538578 IOCYQORPANTRTJ-UHFFFAOYSA-N 384.461 2.905 50 40 GFGB O=C(N/N=C(/CNC(=O)c1ccccc1F)c1ccccc1)c1cccnc1 18191607 CRCJMKRLORSLKP-PLRJNAJWSA-N 376.391 2.785 50 40 GFGB Cc1ccc(S(=O)(=O)Oc2ccc(/C=N/NC(=O)c3ccccn3)cc2)cc1 5363466 XXHANNURJZWUEE-HYARGMPZSA-N 395.440 2.922 50 40 GFGB CCn1c(C)nc2cc(C(=O)NNC(=O)CCOc3ccccc3OC)ccc21 5688616 QWJIKVLTFWHLFK-UHFFFAOYSA-N 396.447 2.603 50 40 GFGB O=C(NNC(=O)c1cc(Cl)c2c(c1)OCCCO2)c1ccc(Cl)nc1 95360807 YUFYPZNVASDKCK-UHFFFAOYSA-N 382.203 2.625 50 40 GFGB Cc1cc(Cl)ccc1N(CC(=O)N/N=C/c1ccc(F)cc1)S(C)(=O)=O 408781193 ASTDRKCRWFTQSM-KEBDBYFISA-N 397.859 2.704 50 40 GFGB COc1ccc(NC(=S)NNC(=O)COc2cccc3cccnc23)cc1 408585925 KZZXQUKVLQOITB-UHFFFAOYSA-N 382.445 2.640 50 40 GFGB COc1ccccc1OCCC(=O)OCC(=O)C(C#N)=C1Nc2ccccc2N1 5781843 KFNDPJFMYDTQOI-UHFFFAOYSA-N 393.399 2.849 50 40 GFGB COC(=O)COc1ccc(Br)cc1/C=C(\C#N)C(=O)N1CCCC1 409368947 UHFCQXNITFMDMA-MDWZMJQESA-N 393.237 2.530 50 40 GFGB CCOc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1 20764423 FQMRSMXVXLYRDU-KGENOOAVSA-N 398.419 2.594 50 40 GFGB Cc1cc(=O)n(CCCCBr)c(=O)n1CCCCBr 2565452 VWLPDCZRYYZYCU-UHFFFAOYSA-N 396.123 2.669 50 40 GFGB Cc1ccc(C)n1-c1cccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)c1 7379454 ZGDSTKFXWDUTNR-UHFFFAOYSA-N 391.427 2.712 50 40 GFGB Cc1cccc2c1NC(=O)[C@]21C=C2c3cc4c(cc3CCN2C(N)=C1C#N)OCO4 5451209 BYTIEFZTZIEHPC-HSZRJFAPSA-N 398.422 2.520 50 40 GFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC#N)c(OC)c2)cc1 408799289 YOEQDNNGGBHQKC-LFIBNONCSA-N 391.383 2.930 50 40 GFGB O=C(COc1cccc(Br)c1)N/N=C\c1ccc(O)c([N+](=O)[O-])c1 38373432 BWETYRKAPNAQKA-IUXPMGMMSA-N 394.181 2.592 50 40 GFGB COc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(C[C@@H]4CCCO4)c(=O)c32)c1 1476104 FTIQCCNOWCXKQZ-QFBILLFUSA-N 393.443 2.563 50 40 GFGB COCCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc3c(c2)OCO3)c1C 8078230 WLJWLOPABSPRPH-LICLKQGHSA-N 381.432 2.883 50 40 GFGB COc1ccc2c(c1)/C(=N\NC(=O)COc1cc(C)ccc1C(C)C)C(=O)N2 59472615 SVTFDCABCLKZQW-UHFFFAOYSA-N 381.432 2.978 50 40 GFGB Cc1ccc(-c2c(C(=O)N/N=C/C3CCCCC3)nnn2-c2nonc2N)cc1 6788578 VDQHTBABDNEMQD-SRZZPIQSSA-N 394.439 2.504 50 40 GFGB COc1ccc(CCNC(=O)C(=O)NN=C2CCCCCCC2)cc1OC 4871607 SDIYHYFYDYFCHN-UHFFFAOYSA-N 375.469 2.579 50 40 GFGB COc1cc([C@@H]2ON=C(C(=O)N/N=C/c3ccc(F)cc3)[C@H]2C)cc2c1OCO2 15085853 NOLSIEJLPQXROM-KYQLCRPWSA-N 399.378 2.777 50 40 GFGB COC(=O)COc1ccc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 408796583 YQXDCRVDPPLQGC-NTEUORMPSA-N 381.344 2.692 50 40 GFGB CCN(CC)S(=O)(=O)c1cccc(C(=O)N/N=C/c2ccc(F)c(F)c2)c1 33042651 BRTWFNQEJIMQOC-CIAFOILYSA-N 395.431 2.759 50 40 GFGB COc1ccc(NC(=O)/C(C#N)=C/c2ccc(O)c([N+](=O)[O-])c2)c([N+](=O)[O-])c1 98087420 JPQFERHQNDEELG-IZZDOVSWSA-N 384.304 2.763 50 40 GFGB COc1cc(/C=C(/C#N)C(=O)N(C)C)ccc1OCc1ccc2c(c1)OCO2 59334238 OGGGTGWVYDGATD-PXNMLYILSA-N 380.400 2.998 50 40 GFGB CCCC[C@@H](CCC(=O)NNC(=O)Cc1ccccc1Br)C(=O)O 26807735 SSXQAUSBLNPGHX-LBPRGKRZSA-N 399.285 2.810 50 40 GFGB COc1ccc(/C=N/NC(=O)c2ccncc2)cc1Cn1nnc2ccccc21 1243100 LIJKYIOUVAQPTF-YDZHTSKRSA-N 386.415 2.647 50 40 GFGB Cc1ccc(C)c(OCC(=O)NNC(=O)CCC(=O)Nc2ccc(C)c(C)c2)c1 4575786 LYUWWZJYTOPKOD-UHFFFAOYSA-N 397.475 2.865 50 40 GFGB C#CCOc1ccc(/C=N\NC(=O)c2ccc(OC)c(OC)c2)cc1OCC 409323144 NWKTVAOXJPGBSQ-HMAPJEAMSA-N 382.416 2.878 50 40 GFGB CC(C)NC(=O)COc1ccc(/C=C(\C#N)C(=O)NCc2ccccc2)cc1 408793633 PUMFILARBVQLCY-XDHOZWIPSA-N 377.444 2.813 50 40 GFGB O=C(NN/C=C1/C(=O)N(CCC2=CCCCC2)C(=O)N=C1O)c1ccccc1 38168674 BSOYHBVXLXBSIA-DTQAZKPQSA-N 382.420 2.614 50 40 GFGB COc1ccc(O)c(/C=N/NC(=O)CNc2ccc(Br)cc2)c1 1501001 AFZSDSNIDKQGCZ-DJKKODMXSA-N 378.226 2.726 50 40 GFGB COc1ccccc1/C=N/NC(=O)CNC(=O)c1cc(Cl)ccc1Cl 4079640 IIZXTLIRNGZSCA-ZVBGSRNCSA-N 380.231 2.882 50 40 GFGB Cc1ccc(/C=N/NC(=O)CN(c2ccc(F)cc2)S(C)(=O)=O)c(C)c1C 20211981 QGGURJVGDZPZAQ-SRZZPIQSSA-N 391.468 2.667 50 40 GFGB COc1ccc(CCN/C(N)=C(C#N)/C=C2\Nc3ccccc3C2=O)cc1OC 1299918 LSGBAZBLUBKMRQ-ZRQCHXNDSA-N 390.443 2.722 50 40 GFGB O=C(Cc1ccccc1)NN=C1CCC(=NNC(=O)Cc2ccccc2)CC1 4091065 JCUMKLPFSXKBPQ-UHFFFAOYSA-N 376.460 2.990 50 40 GFGB CN1CCN(c2ccc([N+](=O)[O-])cc2/C=N/NC(=O)Nc2ccccc2)CC1 4106506 NKUWORLJLXKSOF-XSFVSMFZSA-N 382.424 2.502 50 40 GFGB CCOc1cc(/C=N/NC(N)=O)ccc1OCCCOc1ccc(OC)cc1 4677275 HVRHYMGAVNNGLU-HYARGMPZSA-N 387.436 2.944 50 40 GFGB COc1ccccc1OCC(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1 7649882 XJOALXLKGPXTQL-HNNXBMFYSA-N 394.427 2.842 50 40 GFGB C=CCOc1cccc(/C=N/NC(=O)c2ccc(CN3CCOCC3)cc2)c1 19848264 WUOKGVHHMJXASS-XQNSMLJCSA-N 379.460 2.848 50 40 GFGB CC1(CC(=O)N/N=C/c2cccc(OCc3ccc([N+](=O)[O-])cc3)c2)OCCO1 409049821 XTCWQHWTBHNDKI-FYJGNVAPSA-N 399.403 2.777 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)ccc1OCC(N)=O 408819995 ZSMWKVOLGGNAKS-HZZLXMEWSA-N 385.464 2.551 50 40 GFGB CCCCCCCNC(=O)CCC(=O)NNC(=O)Cn1ccc2ccccc21 98045109 SFYTVDGPUXPWOW-UHFFFAOYSA-N 386.496 2.656 50 40 GFGB COc1ccc(NC(=O)/C(C#N)=C/N2CCN(Cc3ccccc3)CC2)cc1 20572166 PCWUDLNTKOFSAD-HTXNQAPBSA-N 376.460 2.859 50 40 GFGB CC(C)(C)N1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CCN3CCCCl)C1=O 2604399 GKDYSUKVEUYVEI-NTCAYCPXSA-N 389.883 2.938 50 40 GFGB CCOC(=O)c1c(C)[nH]c(NC(=O)NNC(=O)c2ccccc2Cl)c1C 2685901 ILUHWBISEHCDDA-UHFFFAOYSA-N 378.816 2.928 50 40 GFGB Cc1ccc(C(=O)N/N=C/c2ccc(OCC(=O)NC(C)C)cc2)cc1[N+](=O)[O-] 28215720 FJDGOGMLLMSWIB-SRZZPIQSSA-N 398.419 2.571 50 40 GFGB COCCNC(=O)/C(C#N)=C/c1ccc(OCC(=O)Nc2ccc(C)cc2)cc1 408804220 DIJLHFPSESORBS-QGOAFFKASA-N 393.443 2.682 50 40 GFGB CCn1c(SCC(=O)N/N=C/c2cccnc2)nnc1-c1ccc(C)cc1 1293487 SSSXXJVWWQADFK-CIAFOILYSA-N 380.477 2.911 50 40 GFGB CC1(C)CC(=O)C2=C(C1)N(N1CCOCC1)C(N)=C(C#N)[C@H]2c1ccc(F)cc1 690854 JSGFITBBNDGQFO-LJQANCHMSA-N 396.466 2.809 50 40 GFGB COc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)cc1[N+](=O)[O-] 724178 LVVSGPMAFACKNA-UHFFFAOYSA-N 384.175 2.985 50 40 GFGB COCCNC(=O)CC(=O)N/N=C/c1ccc(-c2ccc(Cl)c(Cl)c2)o1 58914834 SAFAWUHSKSHQNR-UFFVCSGVSA-N 398.246 2.856 50 40 GFGB CC1=C(C#N)C(=O)NC(=O)/C1=C\c1ccc(-c2ccc(C(=O)OCC#N)cc2)o1 12630388 GMRMGIRWASIOFQ-YBEGLDIGSA-N 387.351 2.507 50 40 GFGB COc1cc(/C=N/NC(=O)COc2ccccc2)cc(Br)c1O 2675492 MBDCVDQHUAQNLB-GIJQJNRQSA-N 379.210 2.692 50 40 GFGB O=C(Cc1csc(N2CCOCC2)n1)N/N=C/c1ccc(Cl)cc1Cl 3248566 HQSPAFFJTSFACZ-DJKKODMXSA-N 399.303 2.979 50 40 GFGB O=C(CCSc1ccc(Cl)cc1)NNC(=O)[C@H]1COc2ccccc2O1 3352557 LNYMWNXDYWEHRM-MRXNPFEDSA-N 392.864 2.810 50 40 GFGB COc1ccc(C)cc1NCC(=O)NNC(=O)c1ccccc1Br 7973001 PXYUGDDNKCCRBE-UHFFFAOYSA-N 392.253 2.639 50 40 GFGB Cc1cc(C(=O)NNC(=O)CCNC(=O)c2ccc(C(C)(C)C)cc2)c(C)o1 6560384 FBNRPVOHDULKGM-UHFFFAOYSA-N 385.464 2.775 50 40 GFGB COc1ccc(S(=O)(=O)/C(C#N)=C/Nc2ccc(F)c([N+](=O)[O-])c2)cc1 6661134 GUPNGTCYOATNDS-GXDHUFHOSA-N 377.353 2.993 50 40 GFGB C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)COc1ccccc1C#N 6602191 BXGCZKSYYYZVBL-OAHLLOKOSA-N 389.411 2.705 50 40 GFGB CCOC(=O)Cn1cc(/C=N/NC(=O)CNC2CCCCC2)c2ccccc21 409378994 UAUWQENDYLAVRQ-FSJBWODESA-N 384.480 2.577 50 40 GFGB COc1ccc(/C=N\NC(=O)c2cc(Br)ccc2O)c(OC)c1 83259527 VCMYXTPPUSBWPM-NVMNQCDNSA-N 379.210 2.936 50 40 GFGB COC(=O)c1ccccc1NC(=O)C/C(C)=N/NC(=O)COc1ccc(C)cc1 4409432 PHNNVCOPGHVNIZ-HZHRSRAPSA-N 397.431 2.681 50 40 GFGB C/C(=N\NC(=O)CNC(=O)c1cccc(F)c1)c1ccc(Br)cc1 5221482 ROONOQCXLMZFNZ-SRZZPIQSSA-N 392.228 2.858 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)COc2ccc(Br)cc2)c1 940905 SDEBPSZKKKEGAN-VXLYETTFSA-N 393.237 2.995 50 40 GFGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 3369745 NEWOXYHRBZAYRD-UHFFFAOYSA-N 384.175 2.985 50 40 GFGB CCNC(=O)COc1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)cc1OC 7158375 BCUDEAFCMUNDHR-LBHDEGOLSA-N 399.491 2.812 50 40 GFGB CC(=O)C1=C(c2cccc(I)c2)OC(N)=C(C#N)[C@@H]1C 40166076 PEMBWGHDJIUCAP-QMMMGPOBSA-N 380.185 2.951 50 40 GFGB COc1ccc(/C=N/NC(=O)COc2ccc(Br)cc2OC)cc1 1444827 LLLQSEXTYCFCNF-VXLYETTFSA-N 393.237 2.995 50 40 GFGB O=C(CC12C[C@@H]3C[C@@H](CC(Br)(C3)C1)C2)NNC(=O)c1ccncc1 15272744 PWEXPTJFQJENNS-NLKGSNSHSA-N 392.297 2.967 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccc2Br)cc([N+](=O)[O-])c1O 36236335 RHISIWUTNWIIQQ-CAOOACKPSA-N 394.181 2.835 50 40 GFGB CS(=O)(=O)[C@H](I)C(=O)c1ccc(Cl)cc1Cl 96517929 ONBAFWXFMQEWQD-VIFPVBQESA-N 393.029 2.982 50 40 GFGB CN1C(=O)[C@@]2(C(C#N)=C(N)N3C(=C2C#N)Sc2ccccc23)c2ccccc21 207047353 OBDVQHCXJCAJBH-OAQYLSRUSA-N 383.436 2.956 50 40 GFGB Cc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)n[nH]2)s1 32795741 MYCNWBATGLPSCB-LLVKDONJSA-N 388.424 2.814 50 40 GFGB COC(=O)[C@@H]1/C(=N/NC(=O)c2ccccc2O)C[C@](C)(O)C[C@H]1c1ccccc1 104505557 JPQOGYMVEBZUHB-YSCJLLNZSA-N 396.443 2.596 50 40 GFGB C[C@@H]1CCc2c(C(=O)NNC(=O)[C@@H]3[C@@H](C(=O)O)[C@H]4C=C[C@H]3CC4)csc2C1 102220618 IUKBUXKYOYNLOF-BTDZUBADSA-N 388.489 2.547 50 40 GFGB CCOCCOCc1cccc(NC(=O)NNC(=O)c2cc(C)oc2C)c1 95985646 ZRZYEODEGGQOMX-UHFFFAOYSA-N 375.425 2.916 50 40 GFGB CC(C)c1ccc(N(CC(=O)N/N=C/c2ccccc2F)S(C)(=O)=O)cc1 408773470 RJCJIRQDCXNMGX-CIAFOILYSA-N 391.468 2.865 50 40 GFGB Cc1ccc(C(=O)NNC(=O)c2ccc(OCc3nccn3C)cc2)c(C)c1 44876280 ZWWCEVDQKJYVDW-UHFFFAOYSA-N 378.432 2.691 50 40 GFGB C/C(CC(C)(C)N=C=S)=N/N1C(=O)[C@H](C)N2C(=S)NC(C)(C)C[C@@]12C 5533057 KQSJLFGAGPZNPJ-ACURSXFJSA-N 381.571 2.940 50 40 GFGB O=C(NNC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2CC[C@@H]1C2)c1ccc(OC2CCCC2)cc1 6241646 OZLPYWOSLSDFOH-BODMPHMZSA-N 386.448 2.516 50 40 GFGB Cn1cnnc1Sc1ccc(/C=N\NC(=O)OC(C)(C)C)cc1[N+](=O)[O-] 33417112 ILKMVNMBGCMORZ-PXNMLYILSA-N 378.414 2.733 50 40 GFGB COc1cc(/C=N/NC(=O)Cn2cc(C#N)c3ccccc32)cc(OC)c1OC 2175389 ZAZNRRCUFLVFKQ-FOKLQQMPSA-N 392.415 2.689 50 40 GFGB CC(=O)Nc1ccc(C(=O)N/N=C/c2cc(Br)c(N(C)C)o2)cc1 6158798 VKLZFVZIXVWTBT-GIJQJNRQSA-N 393.241 2.830 50 40 GFGB Cc1ccc(N2C(=O)C[C@H](NNC(=O)c3cccc(Cl)c3)C2=O)cc1Cl 100097040 VXXNZVMHUDIHKM-HNNXBMFYSA-N 392.242 2.868 50 40 GFGB Cc1cc(C(=O)NNC(=O)c2cnn3c(-c4ccccc4)ccnc23)c(C)o1 40143524 ZLPFPKDXMDMODB-UHFFFAOYSA-N 375.388 2.681 50 40 GFGB CC(=O)N1CCN(c2c(Cl)cccc2[C@H]2C[C@@H](C(=O)Cl)CC2=O)CC1 57328056 PQKMQDKBWGWISS-TZMCWYRMSA-N 383.275 2.837 50 40 GFGB CC(C)c1ccc(/C=N/NC(=O)c2[nH]ncc2I)cc1 4015901 JQKFEJVKMDPZFP-FRKPEAEDSA-N 382.205 2.902 50 40 GFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccccc3Br)[C@H]2C1 13513005 JYWYZPCDJFDJOE-DOTOQJQBSA-N 394.276 2.804 50 40 GFGB Cc1cc(SCC(=O)NNC(=O)c2ccc3c(c2)OCO3)nc2ccccc12 7181251 JMOHTDAUMFLAPO-UHFFFAOYSA-N 395.440 2.825 50 40 GFGB O=C(COC(=O)Cc1c(Cl)cccc1Cl)NNC(=O)c1cccs1 8187174 JAYNURHVTCKJBK-UHFFFAOYSA-N 387.244 2.602 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc(Br)c1OC 408734935 LRHWLVKQXHGXDR-UWUHSAQLSA-N 395.253 2.668 50 40 GFGB CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1 36833841 KHCQQPJQWOISQC-HNNXBMFYSA-N 387.455 2.896 50 40 GFGB O=C(COCC(=O)N/N=C/C=C\c1ccccc1)N/N=C\C=C/c1ccccc1 17024699 WABIMDOQELJJMK-BMCGREMXSA-N 390.443 2.634 50 40 GFGB COC(=O)C1=C(C)NC(S)=C(C#N)[C@@H]1c1cc(OC)c(OC)c(OC)c1 20528824 GHDUFBAGTBFWQK-HNNXBMFYSA-N 376.434 2.511 50 40 GFGB biogenic,in-vitro COc1ccc(OCC(=O)NNC(=O)COc2ccc(Cl)c(C)c2C)cc1 1926748 RQBHRXXZERTISW-UHFFFAOYSA-N 392.839 2.571 50 40 GFGB O=C(CC[C@H]1Cc2ccccc2NC1=O)NNC(=O)c1c[nH]c2ccccc12 28662736 DDRMJJUYSQUIBZ-AWEZNQCLSA-N 376.416 2.520 50 40 GFGB CCn1ncc2c(C(=O)NNC(=O)c3ccco3)cc(-c3ccccc3)nc21 12974820 GEGVTXDHINLJKE-UHFFFAOYSA-N 375.388 2.786 50 40 GFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)CNc1ccc(Cl)cc1 409359252 ASJZANHSNUWFKG-AWQFTUOYSA-N 392.799 2.828 50 40 GFGB COc1cc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)cc([N+](=O)[O-])c1O 36656914 SUPWSRPRCGQCSY-AWQFTUOYSA-N 387.392 2.763 50 40 GFGB COC(=O)c1ccc(-c2ccc(/C=N/NC(=O)CC3(C)OCCCO3)o2)cc1 805323 NHSRIEYOJMTMAL-FYJGNVAPSA-N 386.404 2.727 50 40 GFGB NC(=O)Cn1cc(/C=N/NC(=O)Cc2cccc3ccccc23)c2ccccc21 6258188 XOHRRYYFJQEJLN-DHRITJCHSA-N 384.439 2.973 50 40 GFGB O=C(CNc1ccc(I)cc1)N/N=C/c1ccccc1 1424081 PRHBZSGSLLYWRI-VCHYOVAHSA-N 379.201 2.853 50 40 GFGB Cc1ccc(-c2ccsc2C(=O)NNC(=O)Cn2nnc3ccccc32)cc1 14244908 LMOZFQKZIGATFJ-UHFFFAOYSA-N 391.456 2.929 50 40 GFGB COc1ccc2c(CC(=O)NNC(=O)COc3c(C)cccc3C)coc2c1 18069877 XTEULDAJYOFZIK-UHFFFAOYSA-N 382.416 2.827 50 40 GFGB CCOC(=O)CSC1=C(C#N)[C@H](c2ccccc2Cl)[C@@H](C#N)C(=O)N1 9332269 UNUYGJHEVDOABG-IAQYHMDHSA-N 375.837 2.725 50 40 GFGB COc1ccc(C(=O)Oc2c(Cl)cc(/C=N/NC(N)=O)cc2OC)cc1 2726852 OAROSAXVBVLOKI-AWQFTUOYSA-N 377.784 2.579 50 40 GFGB N#C/C(=C\c1cc([N+](=O)[O-])ccc1N1CCOCC1)C(=O)NC1CCCCC1 5660010 MGQDEFCIMXYCGJ-FOWTUZBSSA-N 384.436 2.787 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)ccc1OCC(N)=O 408819994 ZSMWKVOLGGNAKS-BCZNVCAVSA-N 385.464 2.551 50 40 GFGB CCOC(=O)Cn1c(C)c(/C=N/NC(=O)CNC2CCCCC2)c2ccccc21 409380358 LNDMHKZEUJXBRY-ZMOGYAJESA-N 398.507 2.885 50 40 GFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2cc(Br)ccc2O)n1 5541498 AUUIFPYVWIASCS-REZTVBANSA-N 395.282 2.804 50 40 GFGB COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)c(OC)c1 18223113 PDIQZSIOPAXTNA-KRWDZBQOSA-N 375.384 2.763 50 40 GFGB COc1cccc(C2=N[C@@](NC(=O)c3ccccc3)(C(Cl)Cl)C(=O)N2)c1 101435295 MJNJYRJNDFOFMD-GOSISDBHSA-N 392.242 2.502 50 40 GFGB CC(C)(C)c1ccc(/C=C/C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 24765952 MDCWORJHDOGFGG-YFPIXMDGSA-N 380.444 2.985 50 40 GFGB Cc1ccc(C)c(NC(=O)CCC(=O)NNC(=O)COc2cc(C)ccc2C)c1 2135146 DMFDPURUNQQTEC-UHFFFAOYSA-N 397.475 2.865 50 40 GFGB N#C/C(C(=O)NCc1ccccc1)=C1/S[C@H](CCO)C(=O)N1c1ccccc1 2235002 VOYIKNKCDBBBND-QUWSGOTNSA-N 393.468 2.569 50 40 GFGB COc1cccc(/C=N/NC(=O)c2ccc(CSc3nncn3C)cc2)c1 3284700 SNAYJKVSTXHAAS-RGVLZGJSSA-N 381.461 2.880 50 40 GFGB COc1ccc(C(=O)Oc2ccc([N+](=O)[O-])cc2)cc1S(=O)(=O)NC(C)C 8726767 CQLMMBXHFCVTNX-UHFFFAOYSA-N 394.405 2.509 50 40 GFGB CC(C)n1cc(/C=N/NC(=O)CNC(=O)COc2ccccc2)c2ccccc21 409163250 OHFSOORHRUUCEH-WYMPLXKRSA-N 392.459 2.868 50 40 GFGB CCOC(=O)CN1CSC2=C(C#N)[C@@H](c3ccc(Cl)cc3)CC(=O)N2C1 20348105 CSTMPMZVDDOADY-CQSZACIVSA-N 391.880 2.918 50 40 GFGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc2c(C)ccc(C)c2[nH]c1=O 876524 TXACEQFZYWJGDW-KRWDZBQOSA-N 379.416 2.790 50 40 GFGB Cc1ccc(C)c(N2C[C@H](C(=O)N/N=C/c3ccc([N+](=O)[O-])cc3)CC2=O)c1 59417683 OTONJWBDRRXPOJ-BTZNOAQDSA-N 380.404 2.715 50 40 GFGB O=C(N/N=C/c1ccccc1[N+](=O)[O-])c1ccc(I)cc1 10118445 XCLWMXXAWRICII-CXUHLZMHSA-N 395.156 2.963 50 40 GFGB COc1ccc2cc(C(=O)N/N=C/c3ccc(OC)c(OC)c3OC)[nH]c2c1 2241566 NTXQVQFWIRHIQS-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB O=C(Cn1cnc2ccccc21)N/N=C/c1ccc(N2CCCC2)c([N+](=O)[O-])c1 5266850 XDTMURORSOJEKN-WSDLNYQXSA-N 392.419 2.695 50 40 GFGB CC(=O)N/N=C1/NC(=O)/C(=C/c2ccc(-c3cccc([N+](=O)[O-])c3C)o2)S1 14162180 STFOGALGDHJMBC-NVNXTCNLSA-N 386.389 2.774 50 40 GFGB COc1cc(C=C(C#N)C#N)ccc1OS(=O)(=O)c1ccccc1[N+](=O)[O-] 4511363 SRUQQDKKZJGGKU-UHFFFAOYSA-N 385.357 2.802 50 40 GFGB CN(CC(=O)N/N=C\c1ccccc1)S(=O)(=O)c1ccc2ccccc2c1 33654254 AZXCFULLMJTZAV-STZFKDTASA-N 381.457 2.611 50 40 GFGB COC[C@@H](Cl)/C(N)=N/S(=O)(=O)c1cc(Cl)c(Cl)cc1Cl 2577773 XXWKNZXHVRWAOA-MRVPVSSYSA-N 380.080 2.947 50 40 GFGB N#CC1=C(N)Oc2cnccc2[C@@H]1c1cccc(I)c1 5338054 XJNHDDYYEFDXHL-AWEZNQCLSA-N 375.169 2.904 50 40 GFGB O=C(NNS(=O)(=O)c1cc(F)ccc1F)c1cc2c(s1)CCCCC2 8109061 VWRPWHXPBTXROO-UHFFFAOYSA-N 386.445 2.919 50 40 GFGB COC(=O)Nc1nnc(SSc2nnc(NC(=O)OC)s2)s1 3152499 CYXCDEMSOQOGME-UHFFFAOYSA-N 380.458 2.546 50 40 GFGB CCCCn1nc(C(=O)NNC(=O)c2cccc(Cl)c2)c2ccccc2c1=O 3395097 HZHJQSBEHLAVLM-UHFFFAOYSA-N 398.850 2.925 50 40 GFGB O=C(COC(=O)c1ccc(F)c(C(F)(F)F)c1)NNC(=O)c1cccs1 64211136 XFHDXGPTHJNQDQ-UHFFFAOYSA-N 390.314 2.524 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2cccc3ccccc23)c(OC)c1 3059999 SSNZJIKLVCMZRD-LPYMAVHISA-N 377.400 2.946 50 40 GFGB CCc1ccc(OCC(=O)NNC(=O)c2cnn(-c3cccc(C)c3)c2C)cc1 12948575 NQKKCWFIJVOIAI-UHFFFAOYSA-N 392.459 2.892 50 40 GFGB Cc1cc(=O)oc2cc(NC(=S)NNC(=O)[C@@H](C)Oc3ccccc3)ccc12 50124344 AULXUMCSCGBKJN-CYBMUJFWSA-N 397.456 2.887 50 40 GFGB COc1cc(OC)c(C(=O)NNC(=O)c2ccccc2-n2cccc2)cc1OC 5689765 NBVGJJYMOYKTIO-UHFFFAOYSA-N 395.415 2.578 50 40 GFGB COc1ccccc1NC(=O)COc1ccc(/C=C(/C#N)C(N)=S)cc1OC 408541515 BONGYBAPJPHRBL-ZROIWOOFSA-N 397.456 2.914 50 40 GFGB CCOC(=O)NNC(=O)c1cn(Cc2ccccc2)nc1-c1cccc(OC)c1 32747778 FPSZUPPXKDWXFD-UHFFFAOYSA-N 394.431 2.998 50 40 GFGB Cc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccoc2C)c(Br)c1 40140397 DMGPTSURXNSUFV-LLVKDONJSA-N 381.226 2.887 50 40 GFGB CS(=O)(=O)[C@H](I)[C@H](O)c1ccc(Cl)cc1Cl 96519204 LDWMBHUCMDRACG-BDAKNGLRSA-N 395.045 2.833 50 40 GFGB Cc1ccc2cc(C#N)c(SCC(=O)NNC(=O)Cc3ccccc3)nc2c1 651136 KSQLFKPELFJGQI-UHFFFAOYSA-N 390.468 2.897 50 40 GFGB COc1ccc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1O 3030222 HHIGEADRXACTGL-HZHRSRAPSA-N 376.412 2.787 50 40 GFGB O=C(Cn1c(COc2ccc(Cl)cc2)nc2ccccc21)NNC(=O)C1CC1 12535063 DLBYRNLWKUZERB-UHFFFAOYSA-N 398.850 2.826 50 40 GFGB O=C(COc1ccc(Cl)cc1Cl)NNC(=O)Cc1noc2ccccc12 12923298 YHYZSJVKKZJYLH-UHFFFAOYSA-N 394.214 2.904 50 40 GFGB COCCN1C(=O)C(C#N)=C(C)/C(=C/Nc2ccccc2Br)C1=O 8993686 MOUOLUSLIZCYOX-RAXLEYEMSA-N 390.237 2.600 50 40 GFGB O=C(/C=C/c1ccccc1OC(=O)c1ccccc1)NNC(=O)c1ccco1 409034609 ICYFLCKSHQYANO-OUKQBFOZSA-N 376.368 2.973 50 40 GFGB COc1ccc(OCc2cc(C(=O)OCC(=O)/C(C#N)=C(/C)N)c(C)o2)cc1 96505288 TXZKCBKPVJJXHM-PDGQHHTCSA-N 384.388 2.658 50 40 GFGB COc1ccc(Br)cc1C(=O)N/N=C/c1ccc2c(c1)OCO2 5206316 RSZJBYJKNYFKKE-QGMBQPNBSA-N 377.194 2.950 50 40 GFGB Cc1cc(Br)cc(/C=N/NC(=O)c2ccc3c(c2)OCCO3)c1O 1437609 IBCIDEYGZQAZMQ-DJKKODMXSA-N 391.221 2.998 50 40 GFGB Cc1cccc2sc(NNC(=O)c3ccc(S(=O)(=O)N(C)C)cc3)nc12 4121297 KUJHCPZLCOVOBE-UHFFFAOYSA-N 390.490 2.612 50 40 GFGB O=C(COc1ccc(/C=N/NC(=O)Nc2ccccc2)cc1)NC[C@@H]1CCCO1 28215629 HAOLTKRRTKTXOC-QMFLXTPQSA-N 396.447 2.516 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1cccc(OCC)c1 408907083 LRCPFKYMJYPJAM-OMNSNBSWSA-N 383.448 2.893 50 40 GFGB CC1=NN(c2cccc(C)c2)C(=O)/C1=C\NNC(=O)c1ccc(C)c([N+](=O)[O-])c1 408536790 BCHSDEYOFSNAHL-BOPFTXTBSA-N 393.403 2.753 50 40 GFGB Cc1nn(-c2ccccc2)c2c1[C@@]1(C(=O)Nc3ccc(F)cc31)C(C#N)=C(N)O2 1022896 XZNNIOPALKTHKZ-NRFANRHFSA-N 387.374 2.644 50 40 GFGB COC(=O)[C@@]12C(=O)Oc3ccc([N+](=O)[O-])cc3[C@@H]1[C@@]2(C)C(=O)c1ccccc1 101740529 UKNKZORBGHIYAD-UIAACRFSSA-N 381.340 2.660 50 40 GFGB O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C/c1cccc2c1OCCO2 58915703 OCFMLUGXPFDJBR-VXLYETTFSA-N 387.417 2.750 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccc(Cl)cc1 6257531 QFQHFCJAZZPGDU-UDWIEESQSA-N 388.811 2.849 50 40 GFGB CC[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3cccc(C#N)c3)cc2C1 7403060 HCQBLWFNQDRDEQ-LBPRGKRZSA-N 389.502 2.758 50 40 GFGB Cc1cccc[n+]1[C@@H]1[C@@H](c2ccccc2)C(C#N)=C([C-](C#N)C#N)N[C@@]1(O)C1CC1 169303337 BHQKVVGNCAIGEQ-QPTUXGOLSA-N 395.466 2.709 50 40 GFGB O=S(=O)(O)c1ccc(SSc2ccc(S(=O)(=O)O)cc2)cc1 1646852 LUENVHHLGFLMFJ-UHFFFAOYSA-N 378.474 2.979 50 40 GFGB COc1ccccc1/C=C/C=C1/C(=O)N(CCCOC(C)=O)C(=O)C(C#N)=C1C 100963465 FNZUCDRZILBPTR-XICJKMHVSA-N 394.427 2.797 50 40 GFGB CCOc1ccc(/C(C)=N/NC(=O)Cc2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] 409361432 HGCLBMXGYMIAIB-FYJGNVAPSA-N 399.403 2.848 50 40 GFGB COc1cc(SC)ccc1C(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1 6653056 GZUNJLLXHMOISC-UHFFFAOYSA-N 382.445 2.882 50 40 GFGB C/C(=N\NC(=O)CN(c1ccc(C)c(C)c1)S(C)(=O)=O)c1cccs1 5684130 GPZBHTCHLMYXJQ-NBVRZTHBSA-N 379.507 2.671 50 40 GFGB O=C(N/N=C/c1ccc(O)cc1)c1cc([N+](=O)[O-])nn1Cc1ccc(Cl)cc1 695592 UQJZEUFGODDDOR-KEBDBYFISA-N 399.794 2.963 50 40 GFGB O=C(CCCl)Nc1nnc(SCC(=O)N2CCc3ccccc32)s1 2451440 RUFBNBGLCBNEGN-UHFFFAOYSA-N 382.898 2.787 50 40 GFGB C[C@H](CCC(=O)ON1C(=O)CCC1=O)SSc1ccc([N+](=O)[O-])cn1 101715727 JFSJKWBYKAONEH-SECBINFHSA-N 385.423 2.506 50 40 GFGB COc1ccccc1/C=N/NC(=O)COc1ccc(Br)cc1OC 1434441 CRRXGPRKUQHOCR-VXLYETTFSA-N 393.237 2.995 50 40 GFGB C=C(C)C(=O)OCCOC(=O)C1=C(N)OC(C)=C(C#N)[C@@H]1c1cccc(F)c1 5791493 ICWUKYGQCLKDEY-INIZCTEOSA-N 386.379 2.570 50 40 GFGB COc1cccc(C(=O)N/N=C/c2cc(Cl)c(OCC(=O)O)c(OC)c2)c1 14134342 SKVPKNFRLMYGNT-AWQFTUOYSA-N 392.795 2.585 50 40 GFGB COc1cc(C)ccc1C(=O)N/N=C/c1cccc(OC)c1O[C@@H](C)C(=O)O 409225206 JVSPRGXXGZVRIA-PUFAJPFRSA-N 386.404 2.628 50 40 GFGB CO[C@@H](C(=O)N/N=C/c1ccc(OCC(=O)NC(C)(C)C)cc1)c1ccccc1 408993085 CDHGHYOVCLIRGT-RXULLKCLSA-N 397.475 2.818 50 40 GFGB COc1cc([N+](=O)[O-])cc(/C=N/NC(=O)c2cccc(Br)c2)c1O 1947411 XQKGYMNJZPYCSJ-CAOOACKPSA-N 394.181 2.835 50 40 GFGB C#CCOc1c(Cl)cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc1OCC 4616910 WCWAFWRVBNQPQM-LRQZKABGSA-N 388.851 2.953 50 40 GFGB C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)COc1ccccc1C#N 6602190 BXGCZKSYYYZVBL-HNNXBMFYSA-N 389.411 2.705 50 40 GFGB O=C1N=C([n+]2ccc3ccccc3c2)/C(=C/NNC(=O)c2ccccc2O)S1 15884995 YCIICBOANOURBY-UHFFFAOYSA-O 391.432 2.722 50 40 GFGB O=C1[C@H]2[C@H](C(=O)N1c1ccccc1)[C@H]1C[C@H]2[C@H](Br)[C@H]1Br 216009320 JNUMSHAQCAUPTM-PTEOKISQSA-N 399.082 2.969 50 40 GFGB Cc1occc1C(=O)NNC(=O)[C@H]1CCCN(c2nc3ccccc3s2)C1 40140403 ISNLGBMAPUYWMC-ZDUSSCGKSA-N 384.461 2.875 50 40 GFGB Cc1ccc(C(=O)Nc2nnc(CC(=O)N/N=C/c3ccccc3)s2)cc1 1501738 JIDCALPFYFTNBO-UDWIEESQSA-N 379.445 2.792 50 40 GFGB COc1ccc(OC)c2sc(NNC(=O)c3ccc4c(c3)OCCO4)nc12 5025726 YXVKOIAPTSWKDS-UHFFFAOYSA-N 387.417 2.842 50 40 GFGB Cc1cc2c(c(=O)n1C[C@H]1CCCO1)[C@H](c1ccccc1F)C(C#N)=C(N)O2 1268757 SPHCTPLOWQTOKR-FZKQIMNGSA-N 381.407 2.693 50 40 GFGB COc1cc(/C=N/NC(=O)[C@@H]2COc3ccc(C(C)(C)C)cc3O2)ccc1O 2347759 FETAWLRDNIIYCH-QKXOWGBTSA-N 384.432 2.988 50 40 GFGB Cc1cccn2c(=O)c(/C=C(\C#N)C(N)=O)c(Oc3ccccc3Cl)nc12 2410976 XOLKGINRZZXVRF-FMIVXFBMSA-N 380.791 2.841 50 40 GFGB C/C(=N\NC(=O)CN(c1ccc(C)c(C)c1)S(C)(=O)=O)c1ccc(F)cc1 20208782 LJFYABIURNYSJT-RCCKNPSSSA-N 391.468 2.749 50 40 GFGB O=C(CC(=O)N/N=C/c1cc2ccccc2[nH]1)N/N=C/c1cc2ccccc2[nH]1 5669427 ZISMIQUXHRFWFR-FWSOMWAYSA-N 386.415 2.640 50 40 GFGB O=C(Cc1cccc2ccccc12)NNC(=S)NC(=O)c1ccc(F)cc1 2551586 RZFRTFUZDDPXFM-UHFFFAOYSA-N 381.432 2.857 50 40 GFGB C/C(=N\NC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccc(C)o1 4964627 AYJYYYIZBFFUMO-HMMYKYKNSA-N 389.477 2.917 50 40 GFGB CCOc1ccc(-c2cc(C(=O)N/N=C\c3ccccc3O)[nH]n2)cc1OC 1745016 AJCCKNATBGLDIP-MTJSOVHGSA-N 380.404 2.954 50 40 GFGB C[C@H](Sc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1 58244424 MIJUYLLXGMHYBY-ZDUSSCGKSA-N 391.518 2.751 50 40 GFGB O=C(NNC(=S)NC(=O)C(c1ccccc1)c1ccccc1)c1ccncc1 27906597 TYWALVLOSKMAKN-UHFFFAOYSA-N 390.468 2.549 50 40 GFGB CCOc1cccc2cc(C(=O)NNC(=O)c3cccc(Cl)c3)c(=O)oc12 11565755 KMVOYQGCCWIVTK-UHFFFAOYSA-N 386.791 2.920 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2cc(Cl)ccc2C)cc1[N+](=O)[O-] 59459769 GOROMCMRLBZVNR-DJKKODMXSA-N 390.783 2.654 50 40 GFGB COC(=O)C1=C(C)NC(S)=C(C#N)[C@H]1c1cc(OC)c(OC)c(OC)c1 20528826 GHDUFBAGTBFWQK-OAHLLOKOSA-N 376.434 2.511 50 40 GFGB biogenic,in-vitro C=CCOc1ccc(/C=N\NC(=O)[C@@H]2CC(=O)N(c3ccc(OC)cc3)C2)cc1 409266785 RJIXEISSBFNAOW-NQRZERFFSA-N 393.443 2.763 50 40 GFGB Cc1cc(NCC(=O)N/N=C/c2ccco2)ccc1I 1081759 NZPLQBMVIRYDHN-CAOOACKPSA-N 383.189 2.755 50 40 GFGB C/C(CC(=O)Nc1ccc(Br)cc1)=N/NC(=O)c1ccncc1 5369782 WGIZFJWWAOWGCR-JAIQZWGSSA-N 375.226 2.979 50 40 GFGB O=C(O)COc1cccc(/C=N/NC(=O)Cc2ccc(Br)cc2)c1 9204370 RMWGRJCQWPCQJT-VXLYETTFSA-N 391.221 2.605 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)[C@@H](O)c2ccc(Br)cc2)c1 704550 TWANPAGFQVOSID-JJLFXSABSA-N 393.237 2.650 50 40 GFGB COCCNC(=O)/C(C#N)=C\C1=C(N2CCOCC2)/C(=C/c2ccccc2)CC1 33733412 LZSWWESZZXSPMJ-HZKYKWALSA-N 393.487 2.663 50 40 GFGB COc1ccc(N2C(N)=C(C#N)C(C#N)(C#N)[C@H]2c2cccc([N+](=O)[O-])c2)cc1 1647950 RFHSTAWCVDYMAA-GOSISDBHSA-N 386.371 2.892 50 40 GFGB COc1ccc(NC(=O)C(=O)N/N=C/c2ccccc2C(F)(F)F)c(OC)c1 4699053 WGVXIQJCQABAHS-LSHDLFTRSA-N 395.337 2.811 50 40 GFGB COc1cc([C@H]2ON=C(C(=O)N/N=C/c3cccc(F)c3)[C@H]2C)cc2c1OCO2 15085847 FKAOOHCPBVJUHX-ZFKZHXNTSA-N 399.378 2.777 50 40 GFGB O=C(Cn1c(COc2ccccc2)nc2ccccc21)NNC(=O)c1ccco1 26812278 DCRSISCSKHGXNS-UHFFFAOYSA-N 390.399 2.670 50 40 GFGB C=CCc1cc(/C=N\NC(=O)COc2ccccc2[N+](=O)[O-])cc(OCC)c1O 408820870 ZZAMSVVPQYKSHN-MTJSOVHGSA-N 399.403 2.957 50 40 GFGB O=C(O)COc1ccccc1/C=N/NC(=O)CNc1cccc(C(F)(F)F)c1 3476539 RBDCUGCCMKXTMX-NUGSKGIGSA-N 395.337 2.731 50 40 GFGB Cn1cccc1/C=N/NC(=O)CCCCCCCC(=O)N/N=C/c1cccn1C 6223985 HAIFGUQFAJRCKY-LKNRODPVSA-N 398.511 2.695 50 40 GFGB COc1ccc(O)c(/C=N/NC(=O)CCC(=O)Nc2ccc(Cl)cc2)c1 1949717 ZCTFBMIKCFBXOI-RGVLZGJSSA-N 375.812 2.923 50 40 GFGB C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)COc1ccccc1 4852666 GNQNAVNKRMPSHR-NSHDSACASA-N 383.231 2.987 50 40 GFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(N2CCCC2=O)cc1 5065631 PRBWANWDTBPQQE-UHFFFAOYSA-N 381.476 2.791 50 40 GFGB O=C(NNS(=O)(=O)c1ccc(F)cc1)c1ccc(COc2ccccc2)o1 14198177 RZGPUZAPWSCNNC-UHFFFAOYSA-N 390.392 2.621 50 40 GFGB CCN(CC)c1ccc(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])c(O)c1 4608578 KGGATACANGGZPH-UDWIEESQSA-N 386.408 2.676 50 40 GFGB O=C(COc1ccc(/C=N/NC(=O)Nc2ccccc2)cc1)NC[C@H]1CCCO1 28215631 HAOLTKRRTKTXOC-QNDYCBLQSA-N 396.447 2.516 50 40 GFGB C/C(=N\NC(=O)[C@H](C)N(c1ccccc1)S(C)(=O)=O)c1ccc(F)cc1 408921560 IUMCMIZUDRYECY-ZXOFLVKFSA-N 377.441 2.521 50 40 GFGB O=C(NNC(=O)c1nn(-c2ccccc2)c2c1CCCCC2)c1ccccn1 40142860 FJWJUXPCWIAFTH-UHFFFAOYSA-N 375.432 2.611 50 40 GFGB N#CC1=C(N)Oc2[nH]nc(-c3cccc([N+](=O)[O-])c3)c2[C@@H]1c1ccc(O)cc1 4125684 KKSRKNMRUUTOBZ-OAHLLOKOSA-N 375.344 2.909 50 40 GFGB COc1cccc(/C=N/NC(=O)C(=O)Nc2ccc(Cl)cc2C)c1OC 3060071 MHRBDVMAPVRDEZ-KEBDBYFISA-N 375.812 2.754 50 40 GFGB CC(=O)Nc1ccc(C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)cc1 4672225 BREQLLUWQYAHEA-UHFFFAOYSA-N 383.448 2.917 50 40 GFGB CC(C)(C)OC(=O)N1CCOC[C@@]2(CC[C@@H](CI)O2)C1 95698565 GXDDETCOIZTESK-SMDDNHRTSA-N 397.253 2.607 50 40 GFGB in-vitro COc1ccc(CC(=O)N/N=C(\C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 5417439 FJBALMSYIVGOJO-HYARGMPZSA-N 398.419 2.975 50 40 GFGB CC(=O)Oc1ccccc1/C=N/NC(=O)COc1cccc(Br)c1 14921450 YKKDSMGGRJUPCJ-VXLYETTFSA-N 391.221 2.904 50 40 GFGB O=C(NN[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1=O)c1ccccc1 100097313 KRNBJSREVFVVBO-CQSZACIVSA-N 378.215 2.560 50 40 GFGB CCCC1=NN(c2ccc(OC)cc2)C(=O)/C1=C(/C)NNC(=O)c1cccnc1 100423286 KDTHDUWXXHVORI-RGEXLXHISA-N 393.447 2.802 50 40 GFGB CC(C)CCOc1ccc(C(=O)NNC(=O)CCNC(=O)c2ccccc2)cc1 10628225 UPCGHQPVWUEOFV-UHFFFAOYSA-N 397.475 2.693 50 40 GFGB Cc1cccc(C(=O)NNC(=O)[C@@H](C)Nc2nc3ccccc3s2)c1[N+](=O)[O-] 14075649 MUPUKYPKUACNEZ-LLVKDONJSA-N 399.432 2.775 50 40 GFGB Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2)n1 9376529 NBQOYJKAZKQNOL-UHFFFAOYSA-N 387.443 2.974 50 40 GFGB COc1cccc(C(=O)NNC(=O)COc2ccc(Br)c(C)c2)c1 4838843 JPMMDGMOCMTOJO-UHFFFAOYSA-N 393.237 2.606 50 40 GFGB Cc1c([C@H]2C(C#N)=C(N)N(c3ccccc3C#N)C3=C2C(=O)CCC3)cnn1C 696076 ZCFLXRQEYCOUSV-HXUWFJFHSA-N 384.443 2.905 50 40 GFGB CC(C)COC(=O)[C@@H]1/C(=N/NC(=O)CC#N)C[C@@](C)(O)C[C@@H]1c1ccccc1 106782873 CIPFSKNBWXNURT-NSEFSGQESA-N 385.464 2.516 50 40 GFGB COc1ccccc1OCC(=O)NNC(=O)c1cc(F)c(Cl)cc1Cl 12764097 UNHMOQGCWVFXTD-UHFFFAOYSA-N 387.194 2.981 50 40 GFGB Cc1cc(O)cc(O)c1/C=N\NC(=O)[C@@H]1COc2ccc(C(C)(C)C)cc2O1 13810612 XVPZDBDBYCZZLE-QSLAWHRQSA-N 384.432 2.994 50 40 GFGB COc1ccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c(OC)c1OC 6449231 WZDLNGTYUBZUHU-UHFFFAOYSA-N 388.464 2.690 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2sccc2C)S(C)(=O)=O)cc1C 20208792 RHGLRJWPSGYSDQ-VCHYOVAHSA-N 379.507 2.590 50 40 GFGB Cc1ccc(S(=O)(=O)N2CCC(C(=O)N/N=C/c3ccccc3)CC2)cc1 3095344 HLKXMHOGAIMDDI-RCCKNPSSSA-N 385.489 2.546 50 40 GFGB O=C(N/N=C/c1cccc(Cl)c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1 58885146 IRCMBWTVCBIQQI-QGMBQPNBSA-N 381.175 2.990 50 40 GFGB O=C(Cc1ccc(Br)cc1)N/N=C/c1cccc([N+](=O)[O-])c1O 4735283 NHUCSPFFDDZAEY-RQZCQDPDSA-N 378.182 2.756 50 40 GFGB Cc1c(Cl)cccc1N(CC(=O)N/N=C/c1ccccc1F)S(C)(=O)=O 408770900 AXNJQXDHYYZXMS-KEBDBYFISA-N 397.859 2.704 50 40 GFGB Cc1cc(C)n(CCCNC(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)n1 9532402 ISMWWEXRYBBJGY-LBPRGKRZSA-N 389.525 2.721 50 40 GFGB C[C@@H]1Oc2ccccc2N(CC(=O)NNc2cccc(C(F)(F)F)c2)C1=O 14200686 KGIKLWLKCZKYPC-NSHDSACASA-N 379.338 2.963 50 40 GFGB O=C(N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O)c1cccc(F)c1 59421113 QLSXWVAYGHFUHF-REZTVBANSA-N 382.145 2.966 50 40 GFGB O=C(N/N=C(\Cn1cncn1)c1ccc(F)cc1F)c1ccc(F)cc1F 1057252 ITDPMKOEIOOBKS-LFVJCYFKSA-N 377.301 2.669 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(Cl)cc2C)cc1[N+](=O)[O-] 59459768 YPIBHOJIGAJJHF-DJKKODMXSA-N 390.783 2.654 50 40 GFGB CCOC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(=O)N3CCOCC3)o2)cc1 1514402 GQQZSIGAIIEMNE-GHRIWEEISA-N 380.400 2.889 50 40 GFGB COc1cccc(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)c1OC 106505467 HLOJDODPKSINPS-FSJBWODESA-N 389.411 2.968 50 40 GFGB C=CCN1C(=O)[C@]2(c3ccccc31)[C@H]1CCCC=C1C(C#N)=C(N)C2(C#N)C#N 2218714 ZNGKIVGFDJUHRB-GAJHUEQPSA-N 381.439 2.967 50 40 GFGB O=C(NNC(=O)[C@@H]1COc2ccccc2O1)C(c1ccccc1)c1ccccc1 3453809 QTHZFODQRAGSAV-FQEVSTJZSA-N 388.423 2.806 50 40 GFGB CCOC(=O)c1sc(NC(C)=O)c(C(=O)OCC)c1CBr 18195532 LICHMWNIPYGOSC-UHFFFAOYSA-N 378.244 2.955 50 40 GFGB C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3cc(F)ccc3F)cc2C1 8108548 DRTMUMHVXFZEKE-VIFPVBQESA-N 386.445 2.774 50 40 GFGB COC(=O)[C@@H](Cc1ccccc1)NC(=O)/C(C#N)=C\c1ccc(N(C)C)cc1 96993361 UXKZQDAPYGERJI-MTGKDYNDSA-N 377.444 2.560 50 40 GFGB CN(CC(=O)N/N=C\c1ccc(F)cc1)S(=O)(=O)c1ccc2ccccc2c1 39986730 XMOTVWRBABTETO-XKZIYDEJSA-N 399.447 2.750 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1cccc(I)c1 919189 MGXPUOUGXXTJQT-CXUHLZMHSA-N 395.156 2.963 50 40 GFGB CCOc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc([N+](=O)[O-])s2)cc1 1858037 UPPXPXRNVLKMMB-WOJGMQOQSA-N 390.421 2.924 50 40 GFGB COc1cccc(N2C(=O)[C@H](Cc3cccc(C)c3)S/C2=C(/C#N)C(N)=O)c1 5070836 SWOLUEXKDORTIP-HGBKYHTQSA-N 393.468 2.915 50 40 GFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)c1ccc([N+](=O)[O-])cc1 100522780 VZSYDIBMDSHWCX-CIAFOILYSA-N 398.375 2.501 50 40 GFGB N#CCC(=O)N/N=C/c1cn(-c2ccccc2)nc1-c1ccc2c(c1)OCCO2 3313138 WPJGWQRWIBZWIN-YDZHTSKRSA-N 387.399 2.674 50 40 GFGB COCCn1c(C)cc2c(c1=O)[C@@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 2326918 QSBKOJDZRLLOCM-OAHLLOKOSA-N 389.814 2.814 50 40 GFGB O=C(NNC(=O)[C@H]1CCCO1)c1cc(-c2ccc(F)cc2)nc2ccccc12 39975601 LEECMYDAEXQXGC-LJQANCHMSA-N 379.391 2.981 50 40 GFGB O=C(N/N=C/c1ccccc1OS(=O)(=O)c1ccccc1)c1ccncc1 4508470 QKZYHJUEYSNFLY-KGENOOAVSA-N 381.413 2.613 50 40 GFGB C[C@@H](NC(=O)/C(C#N)=C\c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)c1ccccc1 409240250 PEYORSUHJLSDGJ-DKTFCQPKSA-N 382.332 2.993 50 40 GFGB CCN1C(=O)/C(=N\NC(=O)C(O)(c2ccccc2)c2ccccc2)c2ccccc21 15658619 GLFVGOZFHFXXBB-DAFNUICNSA-N 399.450 2.810 50 40 GFGB O=C(O)COc1cccc(/C=N/NC(=O)c2cccc(Br)c2)c1 5632745 QPELSQVVGKGRIH-GIJQJNRQSA-N 377.194 2.676 50 40 GFGB Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c2ccccc2)cc1 15229773 FBGWKCREXIAPLT-ORTNRGLGSA-N 387.505 2.838 50 40 GFGB CC[C@H](C)Oc1cccc(C(=O)NC(=S)NNC(=O)c2cccs2)c1 6603731 REOFNWFFLQOPMS-NSHDSACASA-N 377.491 2.875 50 40 GFGB N#CCOc1ccc(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)cc1 108904693 GSBFBOKKVYKGQR-ZMOGYAJESA-N 384.395 2.853 50 40 GFGB CC1=NN(c2ccc(C)cc2C)C(=O)/C1=C/NNC(=O)c1ccc([N+](=O)[O-])cc1 15962088 LZEFPFQTMDXJDD-GZTJUZNOSA-N 393.403 2.753 50 40 GFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1nn(-c2ccccc2)cc1O 9516556 MOBYAXAZCHGWOJ-UHFFFAOYSA-N 380.448 2.555 50 40 GFGB Cc1ccc(CC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1C 408592034 XEMXKPFKACWHKR-HYARGMPZSA-N 396.447 2.741 50 40 GFGB O=C(N/N=C\c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc(N2CCCC2)cc1 408676518 JWFHPGOMMRSCIH-JAIQZWGSSA-N 382.376 2.688 50 40 GFGB O=C(NNC(=O)Nc1cccc2nsnc12)Nc1ccc2nsnc2c1 13371673 MGZLTVUMFVYWKR-UHFFFAOYSA-N 386.422 2.554 50 40 GFGB CN(CCOc1ccccc1Cl)CC(=O)NNC(=O)c1ccccc1Cl 15103399 WSHZUAFKLHIKCZ-UHFFFAOYSA-N 396.274 2.765 50 40 GFGB O=C(N[C@@]1(C(Cl)Cl)N=C(c2ccccc2)NC1=O)c1ccc(F)cc1 102436030 VDFKKWAGMHAICI-QGZVFWFLSA-N 380.206 2.632 50 40 GFGB O=C(CNc1ccc(Br)cc1)N/N=C/c1ccc(O)c([N+](=O)[O-])c1 409365374 ZGJAMDPXXINELW-QGMBQPNBSA-N 393.197 2.625 50 40 GFGB C=CCc1cc(/C=C(/C#N)C(=O)NC(C)C)cc(OC)c1OCC(=O)OCC 408769109 NZOXNBJPWXSEDZ-YVLHZVERSA-N 386.448 2.797 50 40 GFGB CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(Cl)c2)c1 12853660 QXJODZSWGMYISY-UHFFFAOYSA-N 395.868 2.702 50 40 GFGB O=C(c1ccc(N2CCOCC2)cc1)[C@H](Br)CBr 575358751 PZSOBDZECHCNRN-GFCCVEGCSA-N 377.076 2.864 50 40 GFGB C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc2cccc(C)c2[nH]c1=O 4131439 AMOMAENWNVYZHX-KRWDZBQOSA-N 377.400 2.647 50 40 GFGB N#CC(C(=O)COC(=O)c1cc(=O)[nH]c2ccccc12)=C1Nc2ccccc2N1 15587182 AWRRETIGMMFTTG-UHFFFAOYSA-N 386.367 2.527 50 40 GFGB Cc1cc(C(=O)O)ccc1-n1c(C)cc(/C=C(/C#N)C(=O)N2CCOCC2)c1C 408912504 HQGTWJLJJGOMTQ-UNOMPAQXSA-N 393.443 2.867 50 40 GFGB O=C1[C@H]2C[C@@H](Br)[C@@H](Br)C[C@H]2C(=O)N1c1nccs1 408672936 PKGSWLQSPQMASE-SOSBWXJGSA-N 394.088 2.570 50 40 GFGB CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(N3CCOCC3)o2)cc1 408794573 JNRJAVSVQYRJAC-DTQAZKPQSA-N 395.415 2.839 50 40 GFGB Cc1cc(NS(=O)(=O)c2ccc(NC(=O)CCCCCl)cc2)nn1C 585138355 IVEPAFZKUUYZLG-UHFFFAOYSA-N 384.889 2.877 50 40 GFGB O=C(Cc1ccc(Cl)cc1)N/N=C/C=N/NC(=O)Cc1ccc(Cl)cc1 101733557 QGSNAMLNLXHCLV-VGENTYGXSA-N 391.258 2.983 50 40 GFGB CN(C)c1ccc(/C=C(/C#N)C(=O)NC[C@@H]2CCCO2)cc1Br 13939781 WOTCQSVLEJYWPO-MQJVFOOVSA-N 378.270 2.717 50 40 GFGB O=C(CCC(=O)Nc1cccc(C(F)(F)F)c1)NNC(=O)Cc1cccs1 4681846 CJFSXXAXEQWRRJ-UHFFFAOYSA-N 399.394 2.876 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccc2O)cc(Br)c1OC 1106573 RNLXQNPTTANEQK-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB CC1(C)CC(=O)C2=C(C1)N(N1CCOCC1)C(N)=C(C#N)[C@H]2c1cccs1 691062 KCFBLAQLXYTPKO-KRWDZBQOSA-N 384.505 2.732 50 40 GFGB N#C/C(=C\c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(N2CCOCC2)cc1 3376485 NPOBSCGHMUWBFR-DTQAZKPQSA-N 378.388 2.977 50 40 GFGB C#CCOc1ccc(/C=N\NC(=O)c2ccc(OC)c(OCC)c2)cc1OC 409315301 UYZYNRSSQRIFFY-HMAPJEAMSA-N 382.416 2.878 50 40 GFGB Cc1cc2c(c(=O)n1Cc1ccccn1)[C@@H](c1ccc(O)cc1)C(C#N)=C(N)O2 5324383 RDEMDHYQQTZXKZ-IBGZPJMESA-N 386.411 2.524 50 40 GFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)COc1ccc(C)cc1 4691406 YZMBQHYWGAYNDX-HZHRSRAPSA-N 397.431 2.666 50 40 GFGB Cc1cc2c(c(=O)n1Cc1ccccn1)[C@H](c1cccs1)C(C#N)=C(N)O2 37866370 YSCXJFNLMBPUHQ-KRWDZBQOSA-N 376.441 2.880 50 40 GFGB CCc1ccc(/C(C)=N/NC(=O)CNC(=O)/C=C/c2ccccc2OC)cc1 4587322 MQXWPMOBHQZPPC-DRMWGEEFSA-N 379.460 2.927 50 40 GFGB C/C(=N\NC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1)c1ccccc1 4524546 NMBVRHPFEJIYFH-LTGZKZEYSA-N 385.489 2.628 50 40 GFGB C[C@@H](NC(=O)c1ccccc1F)C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 2713490 WUGCDJBUQDBPOE-CYBMUJFWSA-N 385.439 2.703 50 40 GFGB O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2cccs2)C1)c1c[nH]c2ccccc12 32759075 RXALKGACRFUCBD-CYBMUJFWSA-N 396.472 2.543 50 40 GFGB COc1cc(/C=N/NC(=O)CNc2ccc(Br)cc2)ccc1O 59720793 QHAHSRGJJDVPDQ-DJKKODMXSA-N 378.226 2.726 50 40 GFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)COc1c(C)cccc1C 1435638 UCYGDLDZJTYQIH-KEBDBYFISA-N 387.392 2.758 50 40 GFGB C[C@]1(C(=O)N/N=C2\C(=O)Nc3ccc(Br)cc32)CC1(Cl)Cl 6795225 WNNDOGCLUOQJHI-GFCCVEGCSA-N 391.052 2.805 50 40 GFGB CC(=O)N(/N=C/c1ccc(C)cc1)c1nc(CSc2nnnn2C)cs1 5981094 CEJSDBJUEIHRBW-CAOOACKPSA-N 387.494 2.654 50 40 GFGB Cc1ccc(/C=N/NC(=O)CN(c2cccc(Cl)c2)S(C)(=O)=O)cc1 408768259 VLTBDKWITYKZQN-YBFXNURJSA-N 379.869 2.565 50 40 GFGB COc1ccc(OC)c([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccncc4)c32)c1 8566716 RIPJWWAAMSOOIX-MRXNPFEDSA-N 375.388 2.707 50 40 GFGB COc1cc(/C=N\NC(=O)c2ccc3c(c2)OCO3)cc(Br)c1O 30702568 BOFGOTRJDBIFGJ-WSVATBPTSA-N 393.193 2.656 50 40 GFGB CC(C)=C1[C@H]2CC[C@H]1[C@@H](C(=O)NNC(=O)c1csc(C)c1C)[C@H]2C(=O)O 102198218 WCKKBTDCLNSGBU-BHTHQVBYSA-N 376.478 2.819 50 40 GFGB CC(C)(C)c1ccc2c(c1)O[C@H](C(=O)N/N=C\c1cc(O)ccc1[N+](=O)[O-])CO2 34703935 DUWNPYFGYOYNGV-OIQMFWTRSA-N 399.403 2.888 50 40 GFGB O=C(NNC(=O)[C@@H]1CC=CC[C@H]1C(=O)O)c1sc2ccccc2c1Cl 12809859 CGLPZOPWUVDQGV-NXEZZACHSA-N 378.837 2.983 50 40 GFGB O=C(Cc1ccc(Br)cc1)N/N=C/c1cc([N+](=O)[O-])ccc1O 4735282 IOFUVEMRIRIQDD-RQZCQDPDSA-N 378.182 2.756 50 40 GFGB C=CCOc1c(I)cc(/C=C(\C#N)C(N)=O)cc1OCC 408866266 GWHSWFBRSSHVQY-IZZDOVSWSA-N 398.200 2.647 50 40 GFGB COC(=O)C1=C2S[C@@H](C)C(=O)N2C(N)=C(C#N)[C@H]1c1c(F)cccc1Cl 5478198 SHVSKEYZHWLYLG-CPCISQLKSA-N 393.827 2.619 50 40 GFGB O=C(N/N=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)N1CCCCCC1 34798497 GRPYPKRJDFMLLP-MOSHPQCFSA-N 384.392 2.708 50 40 GFGB Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2ccc3nc4n(c3c2)CCC4)c1C 40119053 ZVDLILVPESUCMM-OAHLLOKOSA-N 392.459 2.828 50 40 GFGB COc1ccc(/C=N/NC(=O)c2cccc(Br)c2)cc1C(=O)O 59484955 LTLSKCSYPYJDNY-GIJQJNRQSA-N 377.194 2.920 50 40 GFGB C=CCOc1c(I)cc(/C=N/NC(C)=O)cc1OCC 409012549 KFIXNWKJABJWRX-CXUHLZMHSA-N 388.205 2.725 50 40 GFGB COc1cc(Br)c([C@@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)cc1OC 409125342 NCXXAHOVGCKNFM-CQSZACIVSA-N 391.225 2.716 50 40 GFGB CCOc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)N3CCCCC3)c2C)cc1 58912500 JMZDJXBNABEAKW-HZHRSRAPSA-N 396.491 2.955 50 40 GFGB CCOc1ccc2ccccc2c1/C=N/NC(=O)CSc1nnc(N)s1 1791625 IBDNMEJHACFXKZ-DJKKODMXSA-N 387.490 2.915 50 40 GFGB CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1O 36020240 ZQOFIJVYJWVGFD-YGSFLGPOSA-N 398.419 2.595 50 40 GFGB COC(=O)c1cccc(-c2ccc(/C=N/NC(=O)[C@H](O)c3ccccc3)o2)c1 409139240 AMWIWQAZPBIESK-PPRFWAEMSA-N 378.384 2.917 50 40 GFGB COC(=O)C1=C(C(=O)OC)[C@]2(Cl)C(Cl)=C(Cl)[C@@]1(Cl)C2Cl 45070754 PTHAIDJVSTZQHP-FGWVZKOKSA-N 380.438 2.908 50 40 GFGB O=C(N/N=C1/C(=O)N([C@@H]2OC(=O)c3ccccc32)c2ccccc21)c1ccco1 101274510 GSKHRIKINZUCMX-LCMCWVSWSA-N 387.351 2.630 50 40 GFGB CSc1ccc(/C=N/NC(=O)Cn2nnc(-c3ccccc3Cl)n2)cc1 408734745 CUOMBVGPESGEMW-VXLYETTFSA-N 386.868 2.866 50 40 GFGB COC(=O)COc1cccc(/C=N/NC(=O)c2ccc(Br)cc2)c1 408863964 RIKYIMNWHNWKQJ-VXLYETTFSA-N 391.221 2.765 50 40 GFGB CSc1nc(C)cc(OCC(=O)N/N=C/c2ccc(Br)cc2)n1 1052675 XPNVYAXJUYMTPW-CAOOACKPSA-N 395.282 2.799 50 40 GFGB O=C(N/N=C/c1cnc(N2CCN(c3ccccc3)CC2)s1)c1cccnc1 1406058 PEOMBWQZLAPKKN-HZHRSRAPSA-N 392.488 2.629 50 40 GFGB COc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)cc1OC 4742382 PZTVOOQTXWAIHC-QGZVFWFLSA-N 388.379 2.845 50 40 GFGB CCOc1cc(/C=N/NC(=O)c2sc(N)nc2C)cc(Br)c1O 952317 LIMCSRBULYSYLD-UBKPWBPPSA-N 399.270 2.664 50 40 GFGB N#Cc1ccc(OCC(=O)NNC(=O)C23C[C@H]4C[C@@H](CC(Cl)(C4)C2)C3)cc1 102186172 LBWITXVPXDEYFQ-SNEKZUEESA-N 387.867 2.662 50 40 GFGB O=C(CNC(=O)c1ccc(Cl)cc1)NNc1c(F)c(F)cc(F)c1F 3401756 QCXISLGMRVHWAH-UHFFFAOYSA-N 375.709 2.770 50 40 GFGB Cc1ccc(-n2nc(C(=O)N/N=C/c3cccs3)c(C)c(C#N)c2=O)cc1 409059302 WBUVZYOXLMTREC-SRZZPIQSSA-N 377.429 2.546 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1nc2sc3c(c2c(=O)[nH]1)CCCC3 3140646 CKCAGGYYZJTRTC-DJKKODMXSA-N 397.416 2.536 50 40 GFGB COc1ccc(/C(C)=N/NC(=O)c2cncc(Br)c2)cc1[N+](=O)[O-] 4599683 XHDVOZKYTABPLG-GIJQJNRQSA-N 393.197 2.915 50 40 GFGB N#C/C(=C\c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1)C(=O)NC[C@@H]1CCCO1 2800820 UWBRMAXVXNACRF-KAPURRDVSA-N 394.387 2.984 50 40 GFGB Cc1cccc(-n2nc(C(=O)N/N=C\c3ccc(F)cc3)c(C)c(C#N)c2=O)c1 409057943 XBCOKWXCYMHZOJ-MSXFZWOLSA-N 389.390 2.624 50 40 GFGB Cc1c(C(=O)N/N=C/c2ccccc2)nn(-c2ccc(Cl)cc2)c(=O)c1C#N 5535939 SAFYIKJCASZSOQ-FSJBWODESA-N 391.818 2.830 50 40 GFGB NC(=O)[C@@H]1C(=O)c2cccc3c2[C@@]1(Br)[C@H](Br)CCC3 4991206 RGHFSKXWVJLVKI-PUYPPJJSSA-N 387.071 2.674 50 40 GFGB COc1ccc(NC(=O)[C@H](C)SC2=C(C#N)C(C)(C)[C@H](C#N)C(=O)N2)cc1 12622501 VYKGLLQMYWSPPX-SMDDNHRTSA-N 384.461 2.786 50 40 GFGB Cc1ccc(C)c(N2C[C@H](C(=O)NNC(=O)c3ccccc3Cl)CC2=O)c1 408638634 CWGRLCBEARVESX-CQSZACIVSA-N 385.851 2.771 50 40 GFGB C#CCOc1ccc([C@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)cc1Br 409140309 RFHXAFHKJGUBFD-HNNXBMFYSA-N 385.221 2.711 50 40 GFGB CN(C)c1ccc(/C=N/NC(=O)C2CCN(C(=O)c3ccccc3)CC2)cc1 409006848 QYLHCMMEMIDVOP-XQNSMLJCSA-N 378.476 2.755 50 40 GFGB Cn1ccnc1COc1ccc(C(=O)NNC(=O)c2cc3c(s2)CCC3)cc1 40119791 OLIBAGNIHZVJBR-UHFFFAOYSA-N 396.472 2.624 50 40 GFGB O=Cc1s/c(=N\S(=O)(=O)c2ccccc2)n(CCCCl)c1Cl 84558643 LLKYUKDABCWPOE-SSZFMOIBSA-N 379.290 2.934 50 40 GFGB Cc1cccc(-n2ncc3c(NNC(=O)c4cccc([N+](=O)[O-])c4)ncnc32)c1 9518714 JQDKISGZALVEEP-UHFFFAOYSA-N 389.375 2.789 50 40 GFGB Cc1cccc(C(=O)NN[C@@H]2CC(=O)N(c3cc(Cl)cc(Cl)c3)C2=O)c1 18222671 LGRDEYLOXFWVJU-OAHLLOKOSA-N 392.242 2.868 50 40 GFGB Cc1ccc(NC(=O)COC(=O)c2ccc(/C=C(/C#N)C(N)=S)cc2)cc1 408542236 HXDUGZXIKWNMCA-YBEGLDIGSA-N 379.441 2.984 50 40 GFGB CC1=NN(c2ccc(C(=O)NNC(=O)c3cc(-c4ccccc4)n[nH]3)cc2)CC1 40144766 OSLDQLADMCQIGY-UHFFFAOYSA-N 388.431 2.738 50 40 GFGB COC(=O)c1cc(OC)c(OC)cc1N/C=C(\C#N)C(=O)Nc1ccccc1 11692034 XJYSUDRTNRDBPX-OUKQBFOZSA-N 381.388 2.948 50 40 GFGB CCOc1ccc(/C(C)=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 5316748 CXJVRRLSRVLEGB-XDHOZWIPSA-N 386.364 2.985 50 40 GFGB CCc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccccc3Cl)CC2=O)cc1 8203736 CDMHVHXQDXWWSH-AWEZNQCLSA-N 385.851 2.717 50 40 GFGB CC(=O)c1c(NNC(=O)COc2ccc(Cl)cc2Cl)oc(C)cc1=O 27525948 HZLDSWJORDZVHU-UHFFFAOYSA-N 385.203 2.980 50 40 GFGB O=C(O)COc1ccc(/C=N\NC(=O)COc2ccccc2Cl)cc1Cl 408851249 APPPIQULNYVDRG-ZBKNUEDVSA-N 397.214 2.986 50 40 GFGB CCOc1cc(/C=C(/C#N)C(N)=O)ccc1OCC(=O)Nc1ccccc1C 218425639 MMQMCEHBOPXTEA-YBEGLDIGSA-N 379.416 2.804 50 40 GFGB CCO[C@H]1CCCN(S(=O)(=O)c2ccc(OCCBr)cc2)C1 95993346 JLTVWWRTQPOLRU-AWEZNQCLSA-N 392.315 2.650 50 40 GFGB COc1ccc(CCNC(=S)NNC(=O)c2cc3ccccc3cc2O)cc1 7985981 WQOVKVIYOWEOAA-UHFFFAOYSA-N 395.484 2.906 50 40 GFGB Cc1ccccc1OCc1nnc(SCC(=O)NNC(=O)c2ccccc2)o1 9198708 QXHSBJODPAGMSK-UHFFFAOYSA-N 398.444 2.510 50 40 GFGB O=C(COC(=O)CCSc1ccc(Cl)cc1)NNC(=O)c1cccs1 3412612 HDLNVKXCABETQY-UHFFFAOYSA-N 398.893 2.888 50 40 GFGB O=C(CCC(=O)N(c1ccccc1)c1ccccc1)NNC(=O)c1ccccn1 4616933 NAUMPYUYNUSSNX-UHFFFAOYSA-N 388.427 2.988 50 40 GFGB Cc1cc(Cl)c(C)c(S(=O)(=O)NNC(=O)c2cccc(O)c2)c1Cl 7382932 AQEJAUXJYMBDDO-UHFFFAOYSA-N 389.260 2.939 50 40 GFGB Cc1cccc(/C=N\NC(=O)c2nn(-c3ccc(F)cc3)c(=O)c(C#N)c2C)c1 409075279 YIJMFWJOQFBISH-MSXFZWOLSA-N 389.390 2.624 50 40 GFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3ccccc3OC)CC2)cc1 409006887 RTEIQBUYWRSUOW-HZHRSRAPSA-N 395.459 2.706 50 40 GFGB CCCOc1ccc(NC(=O)C(=O)N/N=C/c2cc(Cl)ccc2O)cc1 409255608 HYTKJLNNGGCTCL-RGVLZGJSSA-N 375.812 2.923 50 40 GFGB Cc1cc2c(cc1Cl)SC(NNC(=O)c1ccccc1)=NS2(=O)=O 1638041 WFWOCBJXJZWHOJ-UHFFFAOYSA-N 381.866 2.733 50 40 GFGB Cc1noc(C)c1CSc1ccccc1C(=O)NNC(=O)[C@H]1CCCO1 32261112 ZFNNBPSFIHNZHE-OAHLLOKOSA-N 375.450 2.524 50 40 GFGB O=C(Cc1cn2ccsc2n1)NNC(=S)Nc1ccc(OC(F)F)cc1 8642861 IAHZEPNXSXHWFD-UHFFFAOYSA-N 397.432 2.558 50 40 GFGB COc1ccc(CC(=O)NNC(=O)CSc2ccc3ccccc3n2)cc1 4623808 AZRRVTHYDOAXKE-UHFFFAOYSA-N 381.457 2.726 50 40 GFGB COc1cc(/C=N/NC(=O)C(=O)Nc2ccccc2Cl)cc(Cl)c1O 8109228 FLTBLJOCINMQSL-UFWORHAWSA-N 382.203 2.796 50 40 GFGB CN(CCCl)C[C@@H]1O[C@H](c2ccccc2)O[C@@H]2[C@@H]1O[C@@H]1OC(C)(C)O[C@@H]12 4801879 CZXLGGHMQXFZRL-UIGZQWRCSA-N 383.872 2.516 50 40 GFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)c1ccc(I)cc1 10118446 TVGGALHDVWAXMW-CXUHLZMHSA-N 395.156 2.963 50 40 GFGB CC(C)Oc1ccc(C(=O)NNC(=O)c2cccnc2OCC(F)(F)F)cc1 24488754 SJJCNROGCWAYIM-UHFFFAOYSA-N 397.353 2.885 50 40 GFGB CCOc1ccccc1Oc1c(-c2ccc(OCC(=O)NN)cc2O)n[nH]c1C 8973206 BXQBOGWHYLTTCB-UHFFFAOYSA-N 398.419 2.650 50 40 GFGB N#C/C(=C/c1cn(CC(=O)O)c2ccccc12)C(=O)Nc1cccc(C(=O)O)c1 408544488 WLMQQWZGWLWFHI-ZSOIEALJSA-N 389.367 2.970 50 40 GFGB Cc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1ccc(OCC(=O)O)cc1 408889834 JQEAXEAXRACXMB-RIYZIHGNSA-N 381.344 2.912 50 40 GFGB CCOc1ccc(NC(=O)C(=O)N/N=C/c2ccc(Br)cc2)cc1 3061760 XIVSUAPZXXFBCU-YBFXNURJSA-N 390.237 2.937 50 40 GFGB CCN(CC)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 778256 RZLSZLNTOVUKBQ-DTQAZKPQSA-N 398.488 2.726 50 40 GFGB O=C(/C=C1\NC2(CCCC2)Cc2ccccc21)C(=O)N/N=C/c1ccccc1O 5032590 SHLDCKYNIKUHDQ-VZYOJXNXSA-N 389.455 2.911 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)Nc2ccccc2C(=O)O)cc(OC)c1OC 13345015 MRMCFZGOSIVIMK-MDWZMJQESA-N 382.372 2.956 50 40 GFGB Cc1c(C(=O)N/N=C\c2ccccc2)nn(-c2ccc(Cl)cc2)c(=O)c1C#N 34901695 SAFYIKJCASZSOQ-FMCGGJTJSA-N 391.818 2.830 50 40 GFGB CCCCOc1ccc(C(=O)NC(=S)NNC(=O)c2cccs2)cc1 6592583 YTCDZUYSUSTHKS-UHFFFAOYSA-N 377.491 2.876 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccccc3F)[C@@H]2C1 5564639 WRFYMFOHZTWKMN-AEFFLSMTSA-N 391.406 2.708 50 40 GFGB CC(=O)c1ccc(OCCCC(=O)NNC(=O)COc2cccc(C)c2)cc1 10026728 NPGGIPNVLDTTAB-UHFFFAOYSA-N 384.432 2.583 50 40 GFGB COC(=O)c1ccc(NC(=O)CCNC(=O)[C@H](Br)C(C)(C)C)cc1 8733214 MDDLTBXFZXPAEC-AWEZNQCLSA-N 399.285 2.728 50 40 GFGB Cc1cc(Br)ccc1OCC(=O)N/N=C/c1ccc(O)cc1O 4691483 PUDHMPBYORHQRZ-QGMBQPNBSA-N 379.210 2.698 50 40 GFGB CCCNC(=O)NN(C(=O)Nc1ccccc1)c1nc(C(=O)OCC)cs1 3768109 KPGWDPGTOCYOIO-UHFFFAOYSA-N 391.453 2.983 50 40 GFGB C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)c1ccc(O)c(O)c1 1060848 ZKLHQJMDQBSTAO-QMMMGPOBSA-N 385.203 2.633 50 40 GFGB COC(=O)[C@@H]1/C(=N/NC(=O)c2ccccc2)C[C@@](C)(O)C[C@H]1c1ccccc1 100249741 UXDWCDGUZQAGFL-FRQZCCJISA-N 380.444 2.890 50 40 GFGB CC(C)COc1ccc(C(=O)NC(=S)NNC(=O)c2cccs2)cc1 6357988 PNKOQGBAMFNRJJ-UHFFFAOYSA-N 377.491 2.732 50 40 GFGB O=C(CN1CCCCCC1=O)NNC(=O)C1(c2ccc(Cl)cc2)CCCC1 60794947 JOTYMVADSKTRIK-UHFFFAOYSA-N 391.899 2.702 50 40 GFGB COc1cccc([C@H]2CC(=O)N3C(=C2C#N)SC[C@]3(O)c2ccco2)c1OC 12275693 QDJDZSCVFWBMRU-XCLFUZPHSA-N 398.440 2.940 50 40 GFGB COc1ccc(/C=N/OCC(=O)C(C#N)=C2Nc3ccccc3N2)cc1OC 6240064 SFNFYTLRDMRUHB-SSDVNMTOSA-N 378.388 2.896 50 40 GFGB C[C@@H](Sc1nnc(C2CC2)n1C1CC1)C(=O)NNC(=O)c1ccc(F)cc1 9614245 INCSAITVMACHSD-SNVBAGLBSA-N 389.456 2.571 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccco1)c1cccc(Cl)c1Cl 408926544 UNYLBOSEOMWFED-CAOOACKPSA-N 390.248 2.503 50 40 GFGB CCOc1cc(/C=C(/C#N)C(=O)Nc2ccccc2OC)ccc1OCC(N)=O 409211120 HXRLCYCGSKIVJO-GDNBJRDFSA-N 395.415 2.504 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2C)ccc1OCC(N)=O 8369014 TVOWMZPFWFUNKN-CXUHLZMHSA-N 379.416 2.722 50 40 GFGB COc1cc(OC)c(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc1Br 6180457 QEAONFGIDAOLIU-UWUHSAQLSA-N 395.253 2.668 50 40 GFGB COc1ccc(-c2n[nH]cc2/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c(OC)c1 721781 YSXSSBQEZUJVHD-SRZZPIQSSA-N 395.375 2.766 50 40 GFGB COc1ccc(/C(C)=N/NC(=O)c2ccc(CN3CCOCC3)cc2)cc1OC 23382555 PZBSZMIBSXOGET-XQNSMLJCSA-N 397.475 2.690 50 40 GFGB COc1cc(C(=O)NNC(=O)c2cccc(O)c2)cc(Cl)c1OC(C)C 12902903 FRBNVIYZXORBLI-UHFFFAOYSA-N 378.812 2.916 50 40 GFGB COc1cc(OC)c(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)cc1Cl 408591303 STXPHKPTKKZKFA-ODCIPOBUSA-N 391.811 2.648 50 40 GFGB O=C(N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21)[C@@H]1CCCO1 84504728 DYSWJCFMTBMDKY-CZEALIGGSA-N 383.835 2.886 50 40 GFGB Cc1ccc(/C=N/NC(=O)[C@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)cc1 408763050 NGBGARHAUKXHEH-DBRLUCFCSA-N 387.505 2.757 50 40 GFGB COC(=O)c1cnc(NNC(=O)C(Cl)=C(Cl)Cl)nc1C(F)(F)F 2157471 HVDWXSFHSUROPD-UHFFFAOYSA-N 393.536 2.611 50 40 GFGB Cc1n[nH]c2c1[C@@H](c1cc3cc4c(cc3nc1Cl)OCO4)C(C#N)=C(N)O2 933855 PJVBLMGMBSBHGV-HNNXBMFYSA-N 381.779 2.867 50 40 GFGB COc1ccc([C@@H]2CC(=O)NC(SCC(=O)N3CCCCC3)=C2C#N)cc1 6441560 DNDOQIQRCIOEPE-INIZCTEOSA-N 385.489 2.780 50 40 GFGB N#Cc1ccccc1S(=O)(=O)NNC(=O)c1cc2c(s1)CCCCC2 12907821 MWTIEBWWDWVLCW-UHFFFAOYSA-N 375.475 2.512 50 40 GFGB COc1ccc(NC(=O)N/N=C\c2ccc(O[C@@H](C)C(=O)O)c(OC)c2)cc1 409020256 NFQMXNFAXFCMAU-OEKFUPINSA-N 387.392 2.711 50 40 GFGB O=C(N/N=C/c1ccc(S(=O)(=O)O)o1)C1c2ccccc2Oc2ccccc21 4475525 XHQHAPTUMPYPEQ-RGVLZGJSSA-N 398.396 2.914 50 40 GFGB Cc1cccc(OCC(=O)NNC(=O)c2ccc(-n3nc(C)cc3C)cc2)c1 3333160 BFNFEODWGATSQU-UHFFFAOYSA-N 378.432 2.638 50 40 GFGB CC(C)(C)c1ccc(C(=O)NNC(=O)COc2ccc3c(c2)CCC(=O)N3)cc1 32905580 HCKPYFHJNVDUJF-UHFFFAOYSA-N 395.459 2.709 50 40 GFGB NNC(=O)c1cc2c(s1)c(Cl)c(Cl)c1cc(C(=O)NN)sc12 255188873 MDKGSEQRVYJNTL-UHFFFAOYSA-N 375.262 2.630 50 40 GFGB CC(C)OC(=O)COc1ccc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 6327969 MOYBKIMDORNNAZ-RGVLZGJSSA-N 385.376 2.689 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)NCC(C)C)ccc1OCc1ccccc1 5464447 VMUYRAOWNAFSJP-ZVHZXABRSA-N 397.475 2.887 50 40 GFGB C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2cc(CC)ccc2[nH]c1=O 4131446 NMPKICWJKOAHPL-LJQANCHMSA-N 391.427 2.901 50 40 GFGB CC1=NN(c2ccccc2)C(=O)[C@H]1/C(=N/NC(=O)c1cccnc1)C(F)(F)F 100922191 IDFLOCDOHWKNJH-AMIRFAGSSA-N 389.337 2.769 50 40 GFGB CCCCOC(=O)CSC1=C(C#N)[C@H](c2ccc3c(c2)OCO3)CC(=O)N1 2312289 PWGCYZQOYHYJEN-ZDUSSCGKSA-N 388.445 2.830 50 40 GFGB CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(COC)c32)cc1OCC 6162517 DRIQEKAGNZPFGC-KRWDZBQOSA-N 384.436 2.962 50 40 GFGB CCc1ccc(NC(=O)C(=O)N/N=C(\C)CC(=O)Nc2cccc(OC)c2)cc1 4416523 CHAPPQHWVIIUJK-ZVHZXABRSA-N 396.447 2.717 50 40 GFGB C/C(=N\NC(=O)CNc1ccc(Br)cc1)c1ccc(O)cc1O 409359863 YMNOYFKZPIMVSO-VXLYETTFSA-N 378.226 2.813 50 40 GFGB C[C@@H](Br)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1 616587989 BHXSJGQNXOTMIL-GFCCVEGCSA-N 389.315 2.973 50 40 GFGB CCOc1ccc(C(=O)NNC(=O)c2ccc(OC[C@H]3CCCO3)cc2)cc1 28701260 NKHKPSJYFGKISS-LJQANCHMSA-N 384.432 2.718 50 40 GFGB O=C(CNC(=O)c1ccccc1Br)N/N=C/c1ccccc1Cl 3080407 WKWIGZQPIBMXHZ-AWQFTUOYSA-N 394.656 2.983 50 40 GFGB COc1ccc(OC)c([C@H]2CC(=O)N3C(=C2C#N)SC[C@@]3(O)c2ccco2)c1 12276260 GSAIAQWKFTUTHP-ZUOKHONESA-N 398.440 2.940 50 40 GFGB Cc1cc(C(=O)NNS(=O)(=O)c2ccccc2C#N)c(C)n1-c1ccccc1 12609447 CNOLBPYLTNYHOX-UHFFFAOYSA-N 394.456 2.589 50 40 GFGB O=C(CSc1ccc(Cl)cc1)NNCC(=O)Nc1ccc(F)cc1F 6566275 IBIDQMBFQCPOGE-UHFFFAOYSA-N 385.823 2.970 50 40 GFGB CC(=O)N[C@H](CC(=O)NNC(=O)c1ccccc1-n1cccc1)c1ccccc1 8180546 UECGSENROFBFLY-LJQANCHMSA-N 390.443 2.506 50 40 GFGB Cc1ccc(CSCCNC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1 32801998 RQPISHVCCZHEPQ-UHFFFAOYSA-N 397.504 2.829 50 40 GFGB CNC(=O)/C(C#N)=C\c1cccn1-c1ccc(I)cc1 4467571 IZVMAIKPPXOFNI-LUAWRHEFSA-N 377.185 2.735 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](Cc3ccccc3)[C@@H]2C1 804112 MBUHITNHCISTPZ-RTBURBONSA-N 387.443 2.644 50 40 GFGB O=C(CC[C@@H]1Cc2ccccc2NC1=O)NNC(=O)c1c[nH]c2ccccc12 28662732 DDRMJJUYSQUIBZ-CQSZACIVSA-N 376.416 2.520 50 40 GFGB N#C/C(=C\c1ccc(O)c(O)c1)c1nnc(N2CCOCC2)n1-c1ccccc1 13069720 OEVRMKVLKREHBF-FOWTUZBSSA-N 389.415 2.579 50 40 GFGB COC(=O)C1=C2S[C@H](C)C(=O)N2C(N)=C(C#N)[C@H]1c1c(F)cccc1Cl 5478197 SHVSKEYZHWLYLG-HQJQHLMTSA-N 393.827 2.619 50 40 GFGB CCOc1cccc(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)c1O 1574195 NNZVOPPZPAAXRN-LSHDLFTRSA-N 395.337 2.899 50 40 GFGB C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc2ccc(C)cc2[nH]c1=O 4131442 WPBJAQHBGWQBAK-SFHVURJKSA-N 377.400 2.647 50 40 GFGB CCSc1ncc(Br)c(C(=O)NNC(=O)c2ccccc2C)n1 28287086 PXCREKXHNIHISP-UHFFFAOYSA-N 395.282 2.734 50 40 GFGB O=C(COC(=O)/C=C/c1cccc(C(F)(F)F)c1)NNC(=O)c1ccccc1 3300600 RTHDWGBYYQTODG-MDZDMXLPSA-N 392.333 2.723 50 40 GFGB Cc1c(C(=O)NC(=O)NNc2ccc([N+](=O)[O-])cc2)cnn1-c1ccccc1 4154712 JQZAGTJECBMEPP-UHFFFAOYSA-N 380.364 2.555 50 40 GFGB CCOc1cc(/C=N/NC(C)=O)cc(I)c1OC(C)C 409014421 POXMYTFALHAFOD-LZYBPNLTSA-N 390.221 2.947 50 40 GFGB CCc1ccc(N(CC(=O)N/N=C/c2ccc(Cl)cc2)S(C)(=O)=O)cc1 409029096 VVQQGALTHQLXRL-UDWIEESQSA-N 393.896 2.819 50 40 GFGB CCOc1ccc(/C=N/NC(=O)c2ccccn2)cc1I 408905257 VZZSPMUHSASLGV-VCHYOVAHSA-N 395.200 2.849 50 40 GFGB CCCc1n[nH]c2c1[C@@H](c1cc(OC)c(OC(C)=O)c(OC)c1)C(C#N)=C(N)O2 806432 GVJYJSFOEHJIQG-INIZCTEOSA-N 398.419 2.523 50 40 GFGB biogenic,in-vitro Cc1cc(OCC(=O)N/N=C/c2cc3c(cc2[N+](=O)[O-])OCO3)ccc1Cl 3140425 RERDRJLEHXQTFE-FBCYGCLPSA-N 391.767 2.814 50 40 GFGB CCOc1ccc(CC(=O)N/N=C/c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 10475839 HUCWUWDVUZUYGB-UDWIEESQSA-N 387.392 2.704 50 40 GFGB O=C(NN/C=C1/C(=O)N(Cc2ccccc2)C(=O)c2ccccc21)c1cccnc1 38165653 ISFBUHKLGKVGDR-XSFVSMFZSA-N 398.422 2.540 50 40 GFGB N#CCCCN1C(=O)/C(=N/NC(=O)c2cc(Cl)ccc2O)c2ccccc21 6231318 TUCPKVIKPOCZJS-OQKWZONESA-N 382.807 2.830 50 40 GFGB CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc3c(s2)CCC3)C1 17446125 GSZYCWAMONNHHK-CYBMUJFWSA-N 393.509 2.645 50 40 GFGB COC(=O)/C(C#N)=C/c1c(Oc2ccccc2OC)nc2ccccn2c1=O 4205516 ZEDLPIFBCQBIHN-ACCUITESSA-N 377.356 2.575 50 40 GFGB COc1cc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc2c1OCO2 408967653 WKPMATLZNLRFQA-UFWORHAWSA-N 383.316 2.842 50 40 GFGB COc1cc(OC)c(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc1Br 6180459 QEAONFGIDAOLIU-XEVNVYFWSA-N 395.253 2.668 50 40 GFGB CCOc1ccc(CC(=O)N/N=C/c2ccc(I)o2)cc1 10475772 RWGWMVHFURQYID-LICLKQGHSA-N 398.200 2.976 50 40 GFGB COc1cc(/C=N/NC(=O)COc2cccc(Cl)c2)cc(OC)c1OC 1021141 MEGQXPYWKQCKPQ-KEBDBYFISA-N 378.812 2.895 50 40 GFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)COc1ccccc1C 4690492 XIXYKELQAPSYGI-HZHRSRAPSA-N 397.431 2.666 50 40 GFGB CCCC(=O)NN(C(=O)NC1CCCCC1)c1nc(C(=O)OCC)cs1 71405282 CQPXKZIAJSSVOE-UHFFFAOYSA-N 382.486 3.000 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1cccc(OCC)c1 408907084 LRCPFKYMJYPJAM-QTCOBDOFSA-N 383.448 2.893 50 40 GFGB O=C(CCC(=O)c1ccc(F)cc1)NNC(=O)c1cc(-c2ccccc2)n[nH]1 5269801 DHPJQABGNWWFBI-UHFFFAOYSA-N 380.379 2.640 50 40 GFGB CCCCOc1ccc(C(NC(=O)CCl)NC(=O)CCl)cc1OC 2696678 JFTOIFHEBSVKAD-UHFFFAOYSA-N 377.268 2.583 50 40 GFGB N#C/C(C(N)=O)=C1\S[C@@H](Cc2cccc([N+](=O)[O-])c2)C(=O)N1c1ccccc1 13647427 NHXJZDNNJZFJMI-DAMBIUFKSA-N 394.412 2.506 50 40 GFGB COc1ccccc1CCC(=O)NNC(=O)c1sc2nc(C)cc(C)c2c1N 8144395 DTLMFIBANZNHAO-UHFFFAOYSA-N 398.488 2.898 50 40 GFGB CCOc1ccccc1/C=N/NC(=O)C(=O)Nc1cc(Cl)ccc1OC 59434269 HIHQWUJXJIUMNA-RGVLZGJSSA-N 375.812 2.836 50 40 GFGB O=C(Cn1nnc(-c2ccccc2)n1)NN=C1c2ccccc2-c2ccccc21 3236607 MTSZUHGCTIILLU-UHFFFAOYSA-N 380.411 2.889 50 40 GFGB CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cc(OC)ccc3F)[C@H]2C1 19852025 VLMDZHBTHOFQAH-AZUAARDMSA-N 391.450 2.970 50 40 GFGB Cc1c(C(=O)N/N=C/c2cc(Br)ccc2O)sc(N)c1C#N 408723891 ZHNXVXYLXDIRFY-NGYBGAFCSA-N 379.239 2.742 50 40 GFGB C[C@H](Oc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc1)C(=O)O 39557409 YCKWJKRDWNBAIY-QDBSGRMGSA-N 376.796 2.721 50 40 GFGB CCc1cccc(CC)c1N1C[C@H](C(=O)NNC(=O)c2ccccc2)CC1=O 7928237 UNOKAADETLMZJD-GOSISDBHSA-N 379.460 2.626 50 40 GFGB CCOc1cc(/C=C(/C#N)C(=O)N(C)C)cc(Br)c1OCC#N 59334682 VEJPRRRRJMXPQY-GHXNOFRVSA-N 378.226 2.745 50 40 GFGB CSc1ccc(/C=N/NC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1 19682584 GDYAYEXSUPHZMB-HZHRSRAPSA-N 396.560 2.985 50 40 GFGB CN(c1ccc(C(=O)N/N=C/c2c(F)cccc2Cl)cc1)S(C)(=O)=O 409121033 XUHPYDOONZJYKH-VXLYETTFSA-N 383.832 2.639 50 40 GFGB Cc1ccc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)s1 95946372 JNROQOVEDDZLOM-UHFFFAOYSA-N 397.501 2.698 50 40 GFGB COc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NC(C)C)c2C)cc1Cl 408970115 AVGXNVRSKJAPAL-UFFVCSGVSA-N 390.871 2.731 50 40 GFGB COc1cc(OC)c([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1Br 818662 RYFDKBWJROAUIJ-AWEZNQCLSA-N 391.225 2.716 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)c1 105991460 GVCHLYRCDREWIU-FSJBWODESA-N 389.411 2.968 50 40 GFGB O=C(N/N=C/c1ccncc1)c1nn(Cc2ccccc2)c(=O)c2ccccc12 3279608 OWQCBRKDIXARQU-ZVHZXABRSA-N 383.411 2.604 50 40 GFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(C[C@H]4CCCO4)c(=O)c32)cc1 2252882 UQKCQZAOQHPMPQ-VQIMIIECSA-N 393.443 2.563 50 40 GFGB Cc1cc2occ(CC(=O)OCC(=O)NNC(=O)c3cccs3)c2cc1C 3443239 SHSHQSFIUMXTNL-UHFFFAOYSA-N 386.429 2.658 50 40 GFGB O=C(CSc1nnc(C2CC2)n1-c1ccccc1)NNC(=O)c1cccs1 6822337 PWXRTIKQGHMFFD-UHFFFAOYSA-N 399.501 2.760 50 40 GFGB COc1cc(/C=N/NC(=O)C(=O)Nc2ccc(C)c(C)c2)cc(Cl)c1O 409152139 JPOGTGZRLPQSKX-AWQFTUOYSA-N 375.812 2.760 50 40 GFGB C/C(CC(=O)NC(C)(C)C)=N\NC(=O)COc1ccc(C)cc1Br 4416279 QGOCAXRCODAPME-UDWIEESQSA-N 398.301 2.933 50 40 GFGB Cc1cc2c(c(=O)n1C)[C@@H](c1ccc(OC(F)(F)F)cc1)C(C#N)=C(N)O2 20086818 ZCLHEEFLNHAPIZ-AWEZNQCLSA-N 377.322 2.811 50 40 GFGB O=C(NNC(=O)c1ccccc1)/C(=C\c1cccs1)NC(=O)c1ccccc1 4853255 LRIRPSVGYPUFPF-NBVRZTHBSA-N 391.452 2.980 50 40 GFGB COc1ccc(Cl)cc1C(=O)NC(=S)NNC(=O)c1ccc(Cl)cc1 6457858 OAKZHBRFXJBJBX-UHFFFAOYSA-N 398.271 2.951 50 40 GFGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1cncc(Br)c1 2630780 IEAJHZWCXQXHOG-UHFFFAOYSA-N 384.617 2.581 50 40 GFGB CCOc1ccccc1NC(=O)C(=O)N/N=C/c1cccc(Br)c1 3127119 TVOOLDMJYSRTCO-YBFXNURJSA-N 390.237 2.937 50 40 GFGB Cc1cc(C)nc(NNC(=O)[C@@H](NC(=O)c2ccccc2Cl)C(C)C)n1 14512441 LLFUBGVYUGWBPH-HNNXBMFYSA-N 375.860 2.645 50 40 GFGB CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cc(OC)ccc3F)[C@@H]2C1 36006926 VLMDZHBTHOFQAH-QUCCMNQESA-N 391.450 2.970 50 40 GFGB CCC(=O)NC(=S)Nc1ccc(NC(=S)NC(=O)CCCCl)cc1 6709416 ZMYZFGPWLWUIFC-UHFFFAOYSA-N 386.930 2.742 50 40 GFGB COc1cc(/C=N/NC(=O)CNC2CCCCC2)cc(Br)c1O 409378659 RDUVXEYUDABACO-DJKKODMXSA-N 384.274 2.536 50 40 GFGB Cc1c(Cl)cccc1N(CC(=O)N/N=C/c1ccc(F)cc1)S(C)(=O)=O 16249956 UHUZDNTVYVDJDH-KEBDBYFISA-N 397.859 2.704 50 40 GFGB COc1cccc(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)c1O 106505463 KZPZEMLNRSQOIF-SSDVNMTOSA-N 375.384 2.665 50 40 GFGB CCOC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1OC 24923473 ACVUWLWTVJABJH-UHFFFAOYSA-N 380.404 2.939 50 40 GFGB C=CCOc1ccc(C(=O)NNc2nc3ccccc3c(=O)n2CC)cc1OC 8982189 QGLFUKLOUGWLNC-UHFFFAOYSA-N 394.431 2.747 50 40 GFGB COC(=O)c1c(NC(=S)NNC(=O)c2ccco2)sc2c1CCCC2 6735078 JGEZZLDMJWVUAF-UHFFFAOYSA-N 379.463 2.638 50 40 GFGB O=C(Cn1cc(C(F)(F)F)ccc1=O)N/N=C/c1c(O)ccc2ccccc12 3188396 XXEJSASKSCMBLL-NUGSKGIGSA-N 389.333 2.876 50 40 GFGB C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc2c(C)ccc(C)c2[nH]c1=O 4131456 PRDGGAAQSFJJNY-SFHVURJKSA-N 391.427 2.956 50 40 GFGB O=C(NNC(=O)c1cncn1-c1ccc(F)cc1)c1c(F)cccc1Cl 12541357 PKLQBPMVCOJQBI-UHFFFAOYSA-N 376.750 2.879 50 40 GFGB CCc1ccc(OCC(=O)NNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 3431133 FUVCCKZKODHSJB-UHFFFAOYSA-N 377.784 2.651 50 40 GFGB O=C(N/N=C1\C(=O)N(Cc2ccc(Cl)cc2)c2ccccc21)[C@@H]1CCCO1 84576886 LZNVRXHDNQPCSU-CZEALIGGSA-N 383.835 2.886 50 40 GFGB N#CC1=C(N)C(C#N)(C#N)[C@H](c2ccc(C(=O)O)cc2[N+](=O)[O-])[C@@H]2CCCC=C12 33706700 WPKLQXQKRAKGAO-DYVFJYSZSA-N 389.371 2.887 50 40 GFGB C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1Cl 32795737 NQBUZZUVBHONCY-VXGBXAGGSA-N 380.803 2.861 50 40 GFGB CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccc(C(=O)O)cc2)N2NC=C(C#N)C2=N1 36569252 QPKGIQAXIWKJRK-LJQANCHMSA-N 399.410 2.978 50 40 GFGB C=CCNC(=O)/C(C#N)=C/c1c(Oc2ccc(F)cc2)nc2ccccn2c1=O 2400015 MOIZFAPJDOCPGO-WYMLVPIESA-N 390.374 2.835 50 40 GFGB Cc1c(C(=O)N/N=C/c2cccs2)nn(-c2ccc(Cl)cc2)c(=O)c1C#N 409061041 ZPRYQZXLMUKHPJ-UFFVCSGVSA-N 397.847 2.891 50 40 GFGB Cc1cc(C)nc(NNC(=O)NCc2ccc(CN3C[C@H](C)O[C@H](C)C3)cc2)n1 45786324 GGIOWFZQWYCOAC-CALCHBBNSA-N 398.511 2.529 50 40 GFGB COc1ccc(/C=N/NC(=O)[C@H](C)Sc2nc(C)cc(C)n2)cc1[N+](=O)[O-] 59503040 HFWRTHAFBJUIQX-BEAUZRKQSA-N 389.437 2.641 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2cc(C)ccc2OC)cc1OC 59433978 DHZMZUJEGRFMJP-LPYMAVHISA-N 397.431 2.666 50 40 GFGB Cc1cccc(C)c1N1C[C@H](C(=O)NNC(=O)c2ccc(Cl)cc2)CC1=O 408649264 ZVUNMZJMGKKDMA-OAHLLOKOSA-N 385.851 2.771 50 40 GFGB Cc1ccccc1OCC(=O)N[C@H](CC(C)C)C(=O)N/N=C/c1ccccc1O 408970523 AUTZMTDEATXMEL-ZMPUUUETSA-N 397.475 2.761 50 40 GFGB O=C(CN1CCCCC1)N/N=C/c1ccc(OCC(=O)Nc2ccccc2)cc1 28214304 AOJZAFTYCFQQPT-HZHRSRAPSA-N 394.475 2.640 50 40 GFGB CCOc1ccccc1/C=N\NC(=O)Cn1cnc2sc(C)c(C)c2c1=O 31783410 XHBYGPJCHABLOQ-NKVSQWTQSA-N 384.461 2.624 50 40 GFGB CCOc1cc(/C=N\NC(=O)c2ccccc2N)cc(Br)c1O 169894027 QRPSFDBNZROZNO-OCKHKDLRSA-N 378.226 2.900 50 40 GFGB CSc1nc(N2CCCC2)c2cnn(CCNC(=O)C(C)(C)CCl)c2n1 8946426 OAJGLSIMFQUHHI-UHFFFAOYSA-N 396.948 2.530 50 40 GFGB Cc1cc(=O)oc2cc(NC(=S)NNC(=O)[C@H](C)Oc3ccccc3)ccc12 50124345 AULXUMCSCGBKJN-ZDUSSCGKSA-N 397.456 2.887 50 40 GFGB COc1ccc(/C=C/C(=O)NC(=S)NNC(=O)[C@H]2C[C@@H]2c2ccccc2)cc1 5025120 PRKWZEMKCVOTJH-KQSNUMSTSA-N 395.484 2.534 50 40 GFGB Cn1c(=O)n(C)c2cc(/C=N/NC(=O)CSc3ccc(Cl)cc3)ccc21 409202605 SAFZCPAFNZCJOV-KEBDBYFISA-N 388.880 2.773 50 40 GFGB Cc1ccc(C)c(N2C[C@H](C(=O)NNC(=O)c3ccc(Cl)cc3)CC2=O)c1 7882265 UZDDWOZKCYUCEI-OAHLLOKOSA-N 385.851 2.771 50 40 GFGB COc1c(O)cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1[N+](=O)[O-] 8783202 VZWRNJMUDUYWDP-OAHLLOKOSA-N 385.376 2.760 50 40 GFGB COc1ccc(C)cc1NC(=O)C(=O)N/N=C/c1ccccc1Br 59433942 VBRKFJZMASECLC-VXLYETTFSA-N 390.237 2.855 50 40 GFGB COCCOC(=O)c1cccc(NC(C#N)=C2C(=O)c3ccccc3C2=O)c1 1783395 VOLWAWYNQAFEEC-UHFFFAOYSA-N 376.368 2.759 50 40 GFGB COC(=O)COc1ccc(/C=N/NC(=O)c2ccccc2Br)cc1 20760131 BICMKBWYJLLNHW-VXLYETTFSA-N 391.221 2.765 50 40 GFGB O=C(NNc1ccccc1[N+](=O)[O-])C1CCN(C(=O)Nc2ccccc2)CC1 15502425 LCLOCHIPPRWOAY-UHFFFAOYSA-N 383.408 2.982 50 40 GFGB COCCN1C(=O)C(C#N)=C(C)/C(=C/Nc2ccc(OC(F)(F)F)cc2)C1=O 9306780 HENPLRXLXZJWNS-GDNBJRDFSA-N 395.337 2.736 50 40 GFGB O=C(CCC(=O)N(c1ccccc1)c1ccccc1)NNC(=O)c1cccnc1 9434478 RXKRUUIMQFLIGP-UHFFFAOYSA-N 388.427 2.988 50 40 GFGB CC(=O)Nc1ccc(C(=O)NN2C(=O)[C@@H](Cl)[C@@H]2/C=C\c2ccccc2)cc1 34073047 VJBMUESHSPZPMA-NBVOKZNISA-N 383.835 2.821 50 40 GFGB CCOc1cc(/C=N/NC(=O)c2cccc(Cl)c2)ccc1OCC(=O)O 408750206 XWHBITRGHURDJE-KEBDBYFISA-N 376.796 2.966 50 40 GFGB NNC(=O)CCc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(Br)c1 226345427 XULFRCKRFKPWOT-UHFFFAOYSA-N 394.225 2.859 50 40 GFGB CCC(=O)Nc1ccc(C(=O)NNC(=O)c2ccccc2Br)cc1 1088077 SZVUSVPXMWPXJY-UHFFFAOYSA-N 390.237 2.872 50 40 GFGB Cc1cc(C)nc(/C(=N/NC(N)=O)C(=O)Nc2nc3ccc(C)cc3s2)c1 104291634 HOSHRYQTNMVWQA-HAHDFKILSA-N 382.449 2.628 50 40 GFGB Cc1cccc(C)c1OCC(=O)NNC(=S)NC(=O)c1ccc(Cl)cc1 2136048 NMFXUAPKIJWRRR-UHFFFAOYSA-N 391.880 2.671 50 40 GFGB CCCCCC(=O)Nc1nnc(CC(=O)N/N=C/c2ccc(OC)cc2)s1 408730820 IWBIOMQGIMIEMW-XDHOZWIPSA-N 389.481 2.758 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C)c(Cl)c2)c(OC)c1 5547210 LNOOQTBAMOGRJL-KEBDBYFISA-N 375.812 2.754 50 40 GFGB CC(=O)C1=C(c2cccc(I)c2)OC(N)=C(C#N)[C@H]1C 40166075 PEMBWGHDJIUCAP-MRVPVSSYSA-N 380.185 2.951 50 40 GFGB C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2ccc(C)cc2[nH]c1=O 4131441 WPBJAQHBGWQBAK-GOSISDBHSA-N 377.400 2.647 50 40 GFGB Cc1ccc(COc2ccc(/C=N/NC(=O)Cc3nnc(N)s3)cc2)cc1 6788244 KGJLNMAGJGRUFG-SRZZPIQSSA-N 381.461 2.701 50 40 GFGB CCOc1cc(/C=N/NC(=O)CC2(C)SCCS2)cc([N+](=O)[O-])c1O 6958972 LXWQOZJOJIEIBH-CXUHLZMHSA-N 385.467 2.736 50 40 GFGB CCOC(=O)C1=C(Nc2ccccc2)OC/C1=N/NC(=O)Cc1ccccc1 100296464 KIGJRDRBHQFHRV-QJOMJCCJSA-N 379.416 2.618 50 40 GFGB C=CCOc1cccc(/C=N/NC(=O)COc2nc(C)cc(COC)c2C#N)c1 59427736 MJWTUYCLVABXHG-FSJBWODESA-N 394.431 2.502 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)N[C@@H](C)c2ccc(OC)cc2)cc1 59459671 ZUFZXNKTVQWEJD-WXUSHSQQSA-N 381.432 2.588 50 40 GFGB CCOC(=O)COc1ccc(/C=N/NC(=O)Cc2ccc(C)cc2C)cc1OC 20195111 GZZLUIOHBUXWKG-YDZHTSKRSA-N 398.459 2.947 50 40 GFGB Cc1cc(NCC(=O)N/N=C/c2cccnc2)ccc1I 1081741 ZNQYSHPPSGFUEG-DJKKODMXSA-N 394.216 2.557 50 40 GFGB CCOC(=O)Cn1c(C)c(/C=N/NC(=O)c2ccccc2N)c2ccccc21 6318970 BMYZLCXVLCUPAJ-FSJBWODESA-N 378.432 2.859 50 40 GFGB C/C(CC(=O)Nc1ccccc1)=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 14923539 ODHDXVJNXYDIKY-UDWIEESQSA-N 399.363 2.566 50 40 GFGB COc1cc([C@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)cc(OC)c1O 3014081 QBNQKFKLKRVKAE-INIZCTEOSA-N 392.367 2.734 50 40 GFGB COc1ccc([C@H]2CC(=O)NC(SCC(=O)N3CCCCC3)=C2C#N)cc1 6441568 DNDOQIQRCIOEPE-MRXNPFEDSA-N 385.489 2.780 50 40 GFGB O=C(NNC(=S)NCCc1ccccc1)c1ccccc1Br 2783872 LLSMYXJSCNAIKB-UHFFFAOYSA-N 378.295 2.801 50 40 GFGB Cc1cccc(C(=O)NNC(=O)c2ccccc2I)c1 1087247 WSVNSWGXPXMHDR-UHFFFAOYSA-N 380.185 2.674 50 40 GFGB Cc1nn(C)c2nc(C3CC3)cc(C(=O)NNC(=S)Nc3ccccc3)c12 17077800 NOAYDXHBNSKWRZ-UHFFFAOYSA-N 380.477 2.786 50 40 GFGB N#C/C(=C\c1ccccc1OS(=O)(=O)c1ccc2ccccc2c1)C(N)=O 4503946 SVAMVDHSEBVAON-GZTJUZNOSA-N 378.409 3.000 50 40 GFGB Nc1cc(C(=O)N/N=C/c2cc(Br)ccc2F)cc([N+](=O)[O-])c1 7781659 XKQHQNCPBXUGPK-CNHKJKLMSA-N 381.161 2.843 50 40 GFGB CS(=O)(=O)N(CC(=O)NN=C1CCCCCCC1)c1cccc([N+](=O)[O-])c1 409025200 NMYBDFFHNSFNAA-UHFFFAOYSA-N 396.469 2.577 50 40 GFGB O=C(N/N=C\c1cc(Br)c(N2CCOCC2)o1)c1cccs1 408815738 RXOLIOBQHPXRKC-SXGWCWSVSA-N 384.255 2.704 50 40 GFGB O=C(/C=C/c1ccccc1)NNC(=O)c1ccccc1I 1087106 KLQOIDYWYYRKLK-ZHACJKMWSA-N 392.196 2.766 50 40 GFGB N#CC1=C(N)Oc2c(oc(CO)cc2=O)[C@@H]1c1ccc(SC(F)(F)F)cc1 1427371 RXRKWTUAXHCMPA-CYBMUJFWSA-N 396.346 2.962 50 40 GFGB O[C@@]12[C@@H]3[C@@H]4[C@H]5C[C@H]3[C@H]([C@H]5[C@@H]1C4(Br)Br)[C@@H]2Br 100019699 WZBOKYFPZUQGLI-BKAISBMCSA-N 398.920 2.739 50 40 GFGB O[C@@]12[C@H]3[C@@H]4C[C@H]5[C@H]([C@@H]1C(Br)(Br)[C@@H]53)[C@@H]4[C@@H]2Br 100019697 WZBOKYFPZUQGLI-WQEHYGLSSA-N 398.920 2.739 50 40 GFGB CCN(CC)S(=O)(=O)c1ccc(N2CCCCC2)c(NC(=O)CCl)c1 3886358 RUQGYEMKCZWADO-UHFFFAOYSA-N 387.933 2.885 50 40 GFGB CCOC(=O)c1ccc(NC(=O)C(=O)N/N=C\c2c(F)cccc2Cl)cc1 408990258 WNWVAOMWUIBQKC-FBHDLOMBSA-N 391.786 2.745 50 40 GFGB O=C(Cc1ccc(F)cc1)N/N=C\c1cc([N+](=O)[O-])cc(Br)c1O 409249596 UUQZRULGOYSBBA-LSCVHKIXSA-N 396.172 2.895 50 40 GFGB COc1cc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)ccc1O 1083264 SPEDEJGBJBUXRJ-HZHRSRAPSA-N 376.412 2.787 50 40 GFGB Cc1csc(CC(=O)NNC(=O)c2ccc(C#Cc3ccccc3)cc2)n1 14185511 GCCBQRSEJRVFJQ-UHFFFAOYSA-N 375.453 2.855 50 40 GFGB Cc1cccc(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)c1[N+](=O)[O-] 6537214 JTZJAYVQDHSUIF-UHFFFAOYSA-N 378.344 2.902 50 40 GFGB COc1cc(/C=N/NC(=O)c2cncn2-c2ccc(F)cc2)cc2c1OCO2 7738463 VUBYSRJOXKGNST-GZIVZEMBSA-N 382.351 2.513 50 40 GFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1cc(Cl)c(O)c(OC)c1 409176090 HAYSVLBNEUPQMO-QGMBQPNBSA-N 379.756 2.735 50 40 GFGB CCCOc1ccc(C(=O)N/N=C\c2ccc(OCC(N)=O)cc2)cc1OCC 409303721 ODNNCGLMGJHJKF-QRVIBDJDSA-N 399.447 2.502 50 40 GFGB COc1ccc(C[C@H]2S/C(=C(/C#N)C(N)=O)N(c3ccccc3)C2=O)cc1 4539968 GFTRNTQGMMQFIF-XUMLYMLNSA-N 379.441 2.607 50 40 GFGB C=CCc1ccccc1OCC(=O)N/N=C/c1cc(OC)cc([N+](=O)[O-])c1O 36020184 ZGPYWVRANFXITJ-RGVLZGJSSA-N 385.376 2.567 50 40 GFGB O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNc1cccc(C(F)(F)F)c1 102964117 BUOXYPPZCCOKAJ-ZIAGYGMSSA-N 383.370 2.714 50 40 GFGB O=C(NNC(=O)C1CCCCC1)c1occc1CS(=O)(=O)c1ccccc1 22021401 YXGNEBYHANGCNH-UHFFFAOYSA-N 390.461 2.595 50 40 GFGB COc1cc(/C=N\NC(=O)[C@H]2COc3ccc(C(C)(C)C)cc3O2)ccc1O 36093508 FETAWLRDNIIYCH-VCYKRWNGSA-N 384.432 2.988 50 40 GFGB Cc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)c(C)n1-c1ccc(C(=O)O)cc1 409207433 WTCDPHFSTRMBKT-OBXYEHHASA-N 393.443 2.995 50 40 GFGB Cc1ccc(C)c(N(CC(=O)N/N=C/c2ccccc2Cl)S(C)(=O)=O)c1 408772647 GMHOSYDNTHWVRN-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB O=C(N/N=C/c1ccco1)[C@@H]1CC(=O)N(c2ccc(Br)cc2)C1 409169643 QOFCBGBWVNGNDB-PBFYJAPKSA-N 376.210 2.545 50 40 GFGB N#C/C(=C/c1ccc2c(c1)OCCO2)C(=O)N1CCN(c2ccccc2)CC1 192595328 QVLDVWOYWSEBSY-JXAWBTAJSA-N 375.428 2.714 50 40 GFGB O=C(CCCC[C@H]1CCSS1)N[C@@H]1CCN(c2nccn3cnnc23)C1 575414457 HVMKVJIXAFUTKU-KGLIPLIRSA-N 392.554 2.533 50 40 GFGB N[P@](=O)(OCCC(=O)OCc1ccccc1)N(CCCl)CCCl 1762320 URRQYEVJTAKGKS-QHCPKHFHSA-N 383.212 2.983 50 40 GFGB in-vitro COc1ccc([C@@H]2CC(=O)NC(SCC(=O)NCc3ccco3)=C2C#N)cc1 6441561 IMOYUBZCUVMNJN-INIZCTEOSA-N 397.456 2.676 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)c2cc(F)ccc2Br)cc1 12772671 DIKLYYWVLROBPE-UHFFFAOYSA-N 381.201 2.737 50 40 GFGB CCOC(=O)[C@H]1CCC/C1=N\NC(=O)CSCc1ccc([N+](=O)[O-])cc1 408719231 AFSPWWYBNHRANJ-ZWPWWNDZSA-N 379.438 2.663 50 40 GFGB O=C(NNC(=O)[C@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1)C1CC1 72272661 ZVBIFSGLMVGISZ-FPOVZHCZSA-N 391.471 2.724 50 40 GFGB CO[C@H]1CC[C@@H](OC(=O)c2ccccc2)[C@H](CI)O1 5080739 CLMYZZZCONXZSG-FRRDWIJNSA-N 376.190 2.799 50 40 GFGB COc1ccccc1[C@H]1C(C#N)=C(N)OC2=C1S(=O)(=O)N(C)c1ccccc12 20558299 KXNBJQHMKCLDLA-KRWDZBQOSA-N 395.440 2.651 50 40 GFGB Cc1ccc(S(=O)(=O)N[C@@H](C(=O)N/N=C/c2ccc(F)cc2)C(C)C)cc1 408756315 YWJIRRKEFADMBK-AGKWGAAGSA-N 391.468 2.587 50 40 GFGB O=C(COc1ccccc1F)NNS(=O)(=O)c1c(Cl)cccc1Cl 9315527 QRCOPGGTDCCWNY-UHFFFAOYSA-N 393.223 2.521 50 40 GFGB O=C(CNc1ccc2c(c1)OCO2)N/N=C/c1cc([N+](=O)[O-])ccc1Cl 409149768 QHWXAHVUSNGCHY-FBCYGCLPSA-N 376.756 2.539 50 40 GFGB COc1cccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)c1OC 408776934 SHTNTIVPZXMLCC-SDXDJHTJSA-N 377.444 2.960 50 40 GFGB Cc1cc(C)c(N2C(=O)N=C(O)/C(=C/NNC(=O)c3ccccc3)C2=O)c(C)c1 38166283 UHUQDDYTTZIIMV-WJDWOHSUSA-N 392.415 2.853 50 40 GFGB O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccccc1)N/N=C/c1ccco1 16479510 OIHKPXYEZHOMRW-KGENOOAVSA-N 397.456 2.621 50 40 GFGB CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)NNC(=O)c1csc(C)c1C)[C@@H]2C(=O)O 17076995 WCKKBTDCLNSGBU-UAXWRAGISA-N 376.478 2.819 50 40 GFGB O=C(Cc1nnc(NC(=O)Nc2ccccc2)s1)N/N=C/c1ccc(O)cc1 1885958 VIULSWNNWJWCRR-YBFXNURJSA-N 396.432 2.581 50 40 GFGB C[C@H](OC(=O)/C(C#N)=C/c1ccc(N(C)C)cc1)C(=O)NC1(C#N)CCCCC1 6985835 SJZOKFFNIMSMMU-HZGBGQKMSA-N 394.475 2.934 50 40 GFGB O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccccc1OC[C@H]1CCCO1 22873570 DBGNRANACCJPIS-MRXNPFEDSA-N 393.443 2.729 50 40 GFGB COc1ccc(C(C)=O)cc1CC(=O)NNC(=O)[C@H](C)Oc1cccc(C)c1C 12761006 FOVVDJDPFFINSE-INIZCTEOSA-N 398.459 2.672 50 40 GFGB NC(=O)N/N=C/c1ccccc1OCCOc1ccc(Br)cc1 4511153 XCWRLPFNSGSEME-YBFXNURJSA-N 378.226 2.909 50 40 GFGB O=C(CC(=O)N/N=C\c1ccc2c(c1)CCC2)N/N=C\c1ccc2c(c1)CCC2 31672968 JIZLYCTYDDBFHB-MQDDAKQZSA-N 388.471 2.655 50 40 GFGB Cc1cc(C)nc(NNC(=O)c2nn(-c3ccc(F)c(F)c3)c3c2CCC3)n1 40145258 RNZBWXOVSWLRBM-UHFFFAOYSA-N 384.390 2.803 50 40 GFGB COc1cc(/C=N/NC(=O)c2cccc(Cn3cccn3)c2)cc(OC)c1OC 1081763 GMSXZAJTGNFFPK-LPYMAVHISA-N 394.431 2.721 50 40 GFGB CCn1c(SCC(=O)N/N=C/c2ccncc2)nnc1-c1ccc(C)cc1 1261573 IGYLHYZBARDSBA-CIAFOILYSA-N 380.477 2.911 50 40 GFGB CCOc1cc(/C=N/NC(=O)c2ccc(CN3CCOCC3)cc2)ccc1OC 19848261 DNVDAFYAUXUSPD-HZHRSRAPSA-N 397.475 2.690 50 40 GFGB C/C(=N\NC(=O)CN(c1ccccc1)S(C)(=O)=O)c1ccc(Cl)cc1 19954150 RWZRSZVTYUVDEA-CPNJWEJPSA-N 379.869 2.646 50 40 GFGB O=C(NNC(=O)c1cnccn1)c1ccc(COc2ccc(Cl)cc2)cc1 8327104 DBTBTPWGOURDRJ-UHFFFAOYSA-N 382.807 2.784 50 40 GFGB Cc1cc2c(c(=O)n1Cc1ccccn1)[C@H](c1ccccc1F)C(C#N)=C(N)O2 2258015 COIVLILXJVYWSS-LJQANCHMSA-N 388.402 2.957 50 40 GFGB Cc1ccc(O[C@H](C)C(=O)NNC(=O)CCC(=O)Nc2cc(C)ccc2C)cc1 12292686 GNSVAHKGHGDICN-QGZVFWFLSA-N 397.475 2.945 50 40 GFGB C/C(N)=C(\C#N)C(=O)CSc1nnc(-c2ccccc2Br)o1 104862652 INWWRUCJESAMAN-NTMALXAHSA-N 379.239 2.917 50 40 GFGB COc1cc(/C=N/NC(=O)CNc2cccc(C(F)(F)F)c2)cc(OC)c1O 3278884 GZRJLTRHGVZIRN-NUGSKGIGSA-N 397.353 2.990 50 40 GFGB NC(=O)COc1ccc(/C=N/NC(=O)CSCc2cccc(Cl)c2)cc1 28213727 DCGLVFJVRBZTFC-ZVBGSRNCSA-N 391.880 2.588 50 40 GFGB C[C@H](SCc1ccc(Br)cc1)C(=O)NNC(=O)c1ccccn1 7475533 WWPVVXUOXHEMRJ-NSHDSACASA-N 394.294 2.927 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)NCc2ccc(C)cc2)cc(Cl)c1O 409264529 LWCSHMKJKUBHAJ-SSDVNMTOSA-N 389.839 2.519 50 40 GFGB C/C(=N\NC(=O)CN1CCCCC1)c1cccc(I)c1 20248329 AZBFYBSWLHJSTQ-SFQUDFHCSA-N 385.249 2.617 50 40 GFGB CCn1c(C)nc2cc(C(=O)NNC(=O)CCC(=O)c3cccs3)ccc21 9883657 AITFJIISBLVQGO-UHFFFAOYSA-N 384.461 2.850 50 40 GFGB CN1CCN(c2ccc([N+](=O)[O-])cc2/C=C(\C#N)C(=O)NC2CCCCC2)CC1 409007905 RPCGIFYTOMWIBW-GHRIWEEISA-N 397.479 2.702 50 40 GFGB COc1ccc(/C(C[C@@H]2OC(=O)c3ccccc32)=N/NC(=O)C[N+](C)(C)C)cc1 16958128 UFHWSDAVPJUQDQ-LOKSUBMMSA-O 396.467 2.524 50 40 GFGB O=C(CN(c1ccccn1)S(=O)(=O)c1ccccc1)NN=C1CCCCC1 19951246 SVZWXHKDLVZKAO-UHFFFAOYSA-N 386.477 2.713 50 40 GFGB O=C(CCCC[C@H]1CCSS1)NCCn1c(O)nc2ccsc2c1=O 238845430 IEXTXPNZWCPZOB-NSHDSACASA-N 399.563 2.994 50 40 GFGB Cc1ccccc1N1C(=O)C[C@H](NNC(=O)c2oc3ccccc3c2C)C1=O 2656216 ZXLZTHVGCLHUEO-HNNXBMFYSA-N 377.400 2.616 50 40 GFGB CCOc1ccc2[nH]c(=O)c(/C=N/NC(=O)c3ccc([N+](=O)[O-])cc3)cc2c1 89269826 DLTWWBZIMMGHFR-RGVLZGJSSA-N 380.360 2.599 50 40 GFGB CCOC(=O)N1CC=C2[C@@H](C1)[C@@H](c1ccccc1F)C(C#N)=C(N)C2(C#N)C#N 20026567 HYBBJNYCZZCGFX-QAPCUYQASA-N 391.406 2.708 50 40 GFGB Cc1ccc(-n2nc(C(=O)N/N=C\c3cccc(C)c3)c(C)c(C#N)c2=O)cc1 409051786 FCWFIOLPGCFOLZ-CFRMEGHHSA-N 385.427 2.793 50 40 GFGB COc1cc(Br)cc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)c1O 805135 NKOZSNQOQFKRIX-CAOOACKPSA-N 394.181 2.835 50 40 GFGB COc1ccc(Br)cc1C(=O)n1cc(C(=O)NN)c2ccccc21 226367139 GQSKRWPQERCHJM-UHFFFAOYSA-N 388.221 2.704 50 40 GFGB NC(=O)[C@@H]1C(=O)c2cccc3c2[C@]1(Br)[C@H](Br)CCC3 4991208 RGHFSKXWVJLVKI-OLUVUFQESA-N 387.071 2.674 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc([N+](=O)[O-])c1 3174063 IMYPLDOQEWIVTE-QGMBQPNBSA-N 380.263 2.868 50 40 GFGB CC(C)NC(=O)COc1ccc(/C=N/NC(=O)CSCc2ccccc2)cc1 28213551 BFEYCXXDXUYOMP-WSDLNYQXSA-N 399.516 2.974 50 40 GFGB CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(Cl)cc2)cc1 7384284 JUOXGAYIXMNSDV-GFCCVEGCSA-N 398.868 2.516 50 40 GFGB Cc1ccsc1/C=N/NC(=O)CN(c1c(C)cccc1C)S(C)(=O)=O 20213954 XGJABTOQSQIFSX-VCHYOVAHSA-N 379.507 2.590 50 40 GFGB COc1cc(/C=N/NC(=O)CNc2ccc(F)cc2)cc(Br)c1O 5915539 NVYQGANDLNJROR-DNTJNYDQSA-N 396.216 2.865 50 40 GFGB CCN(CC)S(=O)(=O)c1ccc(C(=O)N(CCCl)CCCl)cc1 5500662 MUSDRKIMSUBHRX-UHFFFAOYSA-N 381.325 2.637 50 40 GFGB Cc1cc(/C=N/NC(=O)C(=O)NCc2ccccc2)c(C)n1-c1ccccc1F 408970508 AQAPJTCYHCDILG-AFUMVMLFSA-N 392.434 3.000 50 40 GFGB COc1ccc(F)c([C@H]2[C@H]3CN(C(C)C)CC=C3C(C#N)=C(N)C2(C#N)C#N)c1 5408147 OSPJDKSVHFHVON-ICSRJNTNSA-N 391.450 2.968 50 40 GFGB COc1ccc(CCNC(=O)[C@@H]2CCCO[C@H]2C(Cl)Cl)cc1OC 1578198 OCMXCMKHBVNKJT-IUODEOHRSA-N 376.280 2.961 50 40 GFGB O=C1c2ccccc2C(=O)N1CSSCN1C(=O)c2ccccc2C1=O 3082483 GDKGHUCOZFKJGM-UHFFFAOYSA-N 384.438 2.875 50 40 GFGB CCCC[C@H](CCC(=O)NNC(=O)Cc1ccccc1Br)C(=O)O 26807741 SSXQAUSBLNPGHX-GFCCVEGCSA-N 399.285 2.810 50 40 GFGB COc1cc(/C=N/NC(=O)CNc2ccc(Cl)cc2)cc([N+](=O)[O-])c1O 409366608 XAQDBDGMAOVLOT-UFWORHAWSA-N 378.772 2.525 50 40 GFGB CCOC(=O)/C(C#N)=C\c1ccc(OS(=O)(=O)c2ccccc2)c(OC)c1 4511462 KLIGNXJGOLUXLH-PTNGSMBKSA-N 387.413 2.933 50 40 GFGB COC(=O)[C@@H]1/C(=N/NC(=O)c2ccccc2)C[C@](C)(O)C[C@@H]1c1ccccc1 100249740 UXDWCDGUZQAGFL-CFPNKWSMSA-N 380.444 2.890 50 40 GFGB Cc1ccc(OCC(=O)NC(=S)NNC(=O)c2ccc(Cl)cc2)cc1C 6503766 UMASQVTYOUENHV-UHFFFAOYSA-N 391.880 2.671 50 40 GFGB NC(=O)Cn1cc(/C=N\NC(=O)c2cccc(-n3cccc3)c2)c2ccccc21 107791076 ZDUUZDIOZOFXFU-CFRMEGHHSA-N 385.427 2.681 50 40 GFGB CCOC(=O)C1=C(CCl)OC(N)=C(C#N)[C@@H]1c1cc(OC)ccc1OC 1480503 AOWYPPRUOCIDKY-HNNXBMFYSA-N 378.812 2.567 50 40 GFGB Cc1ccc(/C=N/NC(=O)[C@@H](CC(C)C)NC(=O)COc2ccccc2C)o1 408972579 PDYMZKXGQWGKMR-FNLSEGDXSA-N 385.464 2.956 50 40 GFGB CCNC(=O)C(=O)N/N=C/c1cc(Cl)c(OCc2ccccc2)c(OC)c1 408609812 LPAPKRAZFLGHNO-SSDVNMTOSA-N 389.839 2.514 50 40 GFGB COc1ccc(/C=N/NC(=O)c2ccccc2Br)cc1C(=O)O 5527221 FHUMCILULQNLJP-GIJQJNRQSA-N 377.194 2.920 50 40 GFGB CCN(CC)C(=O)Nc1ccc(OC[C@H](O)CBr)c(C(C)=O)c1 39305647 COVQKIDNDABIDX-CYBMUJFWSA-N 387.274 2.898 50 40 GFGB in-vitro CCOC(=O)CN1CSC2=C(C#N)[C@H](c3ccc(Cl)cc3)CC(=O)N2C1 20348106 CSTMPMZVDDOADY-AWEZNQCLSA-N 391.880 2.918 50 40 GFGB C=CCn1c(SCC(=O)NNC(=O)c2ccc(F)cc2)nc2ccccc21 11650839 VNYWEHUYFUBQMO-UHFFFAOYSA-N 384.436 2.915 50 40 GFGB Cc1ccsc1/C=N/NC(=O)CN(c1ccccc1Cl)S(C)(=O)=O 4509048 RQJYOSWSBLZLCF-RQZCQDPDSA-N 385.898 2.626 50 40 GFGB O=C(NNC(=O)c1ccco1)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 408839726 VUQPOJOOIAZMGT-UHFFFAOYSA-N 394.343 2.515 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])cc(Br)c1O)c1ccc(O)cc1 409071847 LTJAGDPPBZREQB-FRKPEAEDSA-N 380.154 2.532 50 40 GFGB COc1cc(C(=O)NNC(=O)c2cc(C(C)(C)C)oc2C)cc(OC)c1O 408766305 BPRAHPMUOOBLKN-UHFFFAOYSA-N 376.409 2.683 50 40 GFGB Cc1cc(OCC(=O)NNC(=O)c2cccc(C)c2O)ccc1Br 5943065 PRTPPFKEVQSODD-UHFFFAOYSA-N 393.237 2.612 50 40 GFGB C/C(=N\NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccc(O)cc1O 5288012 JCLLURIAIMOCAR-HZHRSRAPSA-N 376.412 2.874 50 40 GFGB N#CC1=C(N)[C@@H](C#N)C(c2cccc(Br)c2)=N[C@H]1Br 100252825 YMZFTOISGRWCPC-NOZJJQNGSA-N 380.043 2.849 50 40 GFGB N#CC(C#N)=C(N1CCOCC1)[C@]1(C#N)[C@H](c2ccccc2Cl)C1(C#N)C#N 66089428 PGOALIYKPGHXRO-XLIONFOSSA-N 388.818 2.614 50 40 GFGB Cc1ccc(/C=N/NC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)cc1 408763054 NGBGARHAUKXHEH-IOVUBPJKSA-N 387.505 2.757 50 40 GFGB O=C(N/N=C/c1ccccc1I)c1ccccc1[N+](=O)[O-] 5678751 SRDICSXDHNPOQZ-CXUHLZMHSA-N 395.156 2.963 50 40 GFGB CCCc1nn(C)c2c(=O)[nH]c(-c3cc([C@@H](O)CCl)ccc3OCC)nc12 77293467 QFQLUTUWAYYGSV-AWEZNQCLSA-N 390.871 2.947 50 40 GFGB in-vitro CCCC(=O)Nc1nnc(CC(=O)N/N=C/c2c(C)[nH]c3ccccc23)s1 1958319 UPYPEDFAEWGWQE-VXLYETTFSA-N 384.465 2.759 50 40 GFGB NC(=O)Cn1cc(/C=N/NC(=O)c2ccccc2-n2cccc2)c2ccccc21 6896914 DXKJHPGSYTUXHV-ZMOGYAJESA-N 385.427 2.681 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C(C)C)cc2)cc1[N+](=O)[O-] 59459758 ONRPPCQMBLXEPH-RGVLZGJSSA-N 384.392 2.816 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(Br)cc2)c(O)c([N+](=O)[O-])c1 59513185 FYFPYYOLSJHJAM-CAOOACKPSA-N 394.181 2.835 50 40 GFGB O=C(N/N=C/c1cc(Br)c(N2CCOCC2)o1)c1ccc(F)cc1 59303227 JEDJAUIYHYHBGL-VXLYETTFSA-N 396.216 2.782 50 40 GFGB O=C(N/N=C1/c2ccccc2-n2c1nc1ccccc1c2=O)c1ccccc1O 5451628 UUVBOSUWGUSGPH-CLCOLTQESA-N 382.379 2.587 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)NC)ccc1OCc1ccc(Cl)cc1 408611423 QXCAUDJOMZSKAT-SSDVNMTOSA-N 389.839 2.514 50 40 GFGB CN(CC(=O)N/N=C\c1cccc(F)c1)S(=O)(=O)c1ccc2ccccc2c1 39986719 HWDHPLIGTYDYSJ-XKZIYDEJSA-N 399.447 2.750 50 40 GFGB N#Cc1ccccc1OCC(=O)NNC(=O)CCc1ccc(-c2ccccc2)o1 6981837 PMABBPIBMGRHAB-UHFFFAOYSA-N 389.411 2.977 50 40 GFGB COc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc(Br)c1OC 800529 QMHPVKNTPMNVPE-ZDUSSCGKSA-N 391.225 2.716 50 40 GFGB COC(=O)CSC1=C(C#N)[C@@H](c2ccc(Cl)cc2)[C@H](C(=O)OC)C(O)=N1 2300866 YFSHYHLNKSDTRS-KGLIPLIRSA-N 394.836 2.824 50 40 GFGB CCCOc1ccc(C(=O)N/N=C\c2ccccc2OCC(=O)O)cc1OC 409315321 UXEARRYYXPGDCK-MTJSOVHGSA-N 386.404 2.711 50 40 GFGB COc1cc([C@@H](C)NC(=O)NCCNC(=O)[C@@H](C)Cl)ccc1OC(C)C 65607584 ULKWWAMIUFZXET-CHWSQXEVSA-N 385.892 2.586 50 40 GFGB COc1ccccc1[C@@H]1C(C#N)=C(N)N(c2nc[nH]n2)C2=C1C(=O)CC(C)(C)C2 5408207 ZVHGTYKKRFDVEP-QGZVFWFLSA-N 390.447 2.754 50 40 GFGB N#C/C(=C\c1ccc(Br)c([N+](=O)[O-])c1)C(=O)NC[C@H]1CCCO1 32787547 RGVASSPDEDYTGG-IGEMTJHASA-N 380.198 2.559 50 40 GFGB COC(=O)C1=C(C(=O)c2ccc(OC)cc2)[C@H](c2ccccc2)C(C#N)=C(N)O1 66088025 CDHNQIOJLWYGMY-QGZVFWFLSA-N 390.395 2.813 50 40 GFGB O=C(O)COc1ccccc1/C=N/NC(=O)c1ccccc1Br 1078817 SZHLPOGJXVOLEG-GIJQJNRQSA-N 377.194 2.676 50 40 GFGB O=C(CCl)Nc1nnc(SCC(=O)Nc2ccc(F)c(F)c2F)s1 2570332 IJHGNILHFBPYEY-UHFFFAOYSA-N 396.803 2.864 50 40 GFGB CCOC1(OCC)[C@@]2(Cl)C(Cl)=C(Cl)[C@@]1(Cl)[C@H]1C(=O)OC(=O)[C@H]12 103916333 KSLULRFUPXQXQY-CGNYCVOOSA-N 390.046 2.743 50 40 GFGB O=C(Cl)c1nnc2sc(-c3cccc(I)c3)nn12 57338967 MHFHCYJRDNMDOX-UHFFFAOYSA-N 390.593 2.836 50 40 GFGB O=C(COc1cccc(Br)c1)N/N=C/c1ccccc1C(=O)O 6594254 WPFHOTRZZIDSJV-GIJQJNRQSA-N 377.194 2.676 50 40 GFGB O=C(N/N=C/c1ccc(C(=O)O)cc1)C(=O)Nc1cc(Cl)cc(Cl)c1 408971043 GHHXSTQYEYOWMN-UFWORHAWSA-N 380.187 2.780 50 40 GFGB Cc1cc2c(cc1Br)NC(=O)/C2=N\NC(=O)C1[C@H]2CCCC[C@@H]12 13477634 ILMPHLNZHCSWIC-XFLKPENQSA-N 376.254 2.966 50 40 GFGB CCc1ccc(OCC(=O)NNC(=O)/C=C/c2ccc(OC)c(OC)c2)cc1 6124173 GEYHVTKZCCONNM-XYOKQWHBSA-N 384.432 2.506 50 40 GFGB COc1ccc(C(=O)NNC(=O)COc2ccc3ccccc3c2)cc1OC 829242 UHUUIFWLCDCBHH-UHFFFAOYSA-N 380.400 2.697 50 40 GFGB CC(=O)c1ccc(NC(=O)CSC2=C(C#N)C(C)(C)[C@@H](C#N)C(=O)N2)cc1 1438360 LYDRIJSGZPKEPE-AWEZNQCLSA-N 382.445 2.592 50 40 GFGB Cc1cc(Cl)ccc1N(CC(=O)N/N=C/c1ccccc1F)S(C)(=O)=O 408776398 NRGSLXQVDIAARC-KEBDBYFISA-N 397.859 2.704 50 40 GFGB COC(=O)c1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1 5586281 GFHUZQOVRBKVMX-CYVLTUHYSA-N 375.428 2.729 50 40 GFGB Cc1c(Cl)cccc1NC(=O)CCC(=O)N/N=C1\C(=O)Nc2ccccc21 5439498 LMKZXTWKEGZNJT-UHFFFAOYSA-N 384.823 2.840 50 40 GFGB O=C1NC[C@@H](c2ccccc2)[C@H]1C(=O)N/N=C\c1ccc(Cl)c(Cl)c1 30885240 BYEYZZODDDCIDU-MZHLSSEJSA-N 376.243 2.973 50 40 GFGB CCc1cc(C(=O)NNC(=O)[C@@H]2[C@@H]3CC[C@@H](C3=C(C)C)[C@@H]2C(=O)O)cs1 225590474 JOQGNRGLWIHDEO-CLWVCHIJSA-N 376.478 2.765 50 40 GFGB COc1cccc(/C=N/NC(=O)c2ccccc2Cl)c1O[C@@H](C)C(=O)O 409233401 VVUPVMXCPWLRAR-KKBVUKDESA-N 376.796 2.964 50 40 GFGB CCOc1ccc(/C=N\NC(=O)Cc2ccc3c(c2)OCCO3)cc1OCC 409359240 AOKIKLSWYNICGR-HMAPJEAMSA-N 384.432 2.948 50 40 GFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2)c(OC)c1 408970164 BUQGSKICUJOYRS-IKMPRTQCSA-N 383.448 2.639 50 40 GFGB COC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1ccccc1I 1515268 OFFRQPPKFGRENT-CYBMUJFWSA-N 396.184 2.546 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccc2N)ccc1OC(=O)c1ccco1 27489402 NEGNKXOASQJFNY-WSDLNYQXSA-N 379.372 2.854 50 40 GFGB O=C(Cc1ccccc1)N/N=C1\C(=O)N(CN2CCCCCC2)c2ccccc21 2236649 ZURFDAIYPFKATF-LVWGJNHUSA-N 390.487 2.930 50 40 GFGB CCNC(=O)/C(C#N)=C/c1c(Oc2ccc(F)cc2)nc2ccccn2c1=O 2400741 CAUJIYJMLAXPSF-ACCUITESSA-N 378.363 2.669 50 40 GFGB Cc1ccc(SCC(=O)NNS(=O)(=O)c2ccc(F)c(F)c2F)cc1 7387090 OBARRZFNVGQCNU-UHFFFAOYSA-N 390.408 2.514 50 40 GFGB COC(=O)COc1ccc(/C=N/NC(=O)c2cc3cccc(OC)c3o2)cc1 408970800 KMXCMHGKJIROIO-SRZZPIQSSA-N 382.372 2.757 50 40 GFGB CCOC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@]21C(=O)Nc2ccccc21 4728083 MNJAPSDADMKGSG-IBGZPJMESA-N 381.413 2.558 50 40 GFGB CCOC(=O)Cn1c(C)c(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)c2ccccc21 876127 QHTOLWMMKIAFOX-ABPVARSCSA-N 395.459 2.715 50 40 GFGB O=C(N/N=C/c1ccc(Br)o1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 2676414 CWJREPQUXAXGTP-MKMNVTDBSA-N 383.114 2.622 50 40 GFGB Cc1cc(C)c(S(=O)(=O)NCC(=O)N/N=C/c2ccc(Cl)cc2)c(C)c1 6607275 XYCBCUGJEBHUMX-KEBDBYFISA-N 393.896 2.694 50 40 GFGB COCCOC(=O)/C(C#N)=C\c1ccc(Sc2nccn2C)c([N+](=O)[O-])c1 33462850 UPCLKMSXXMKQCE-LCYFTJDESA-N 388.405 2.576 50 40 GFGB CCC(=O)Nc1ccc(C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 59514910 RBEVTUHBHYZURT-VCHYOVAHSA-N 385.336 2.615 50 40 GFGB CCCCCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 13021782 MGXKTFDELYUNRW-UHFFFAOYSA-N 392.463 2.730 50 40 GFGB O=C(CCC(=O)NNC(=O)c1ccc(Cl)cc1Cl)NCc1ccccc1 4523991 NHESTUUNEUVCGK-UHFFFAOYSA-N 394.258 2.851 50 40 GFGB CC/C(NNC(=O)c1ccccc1)=C1\C(=O)N(C2CCCCC2)C(=O)N=C1O 5111700 FLEXKPIDOCLQIA-FOCLMDBBSA-N 384.436 2.837 50 40 GFGB C=CCN1C(=O)/C(=N/NC(=O)c2cccnc2)c2cc(Br)ccc21 13118263 OGRIZBCLWMAECB-HMMYKYKNSA-N 385.221 2.511 50 40 GFGB COC(=O)COc1ccc(/C=C(/C#N)C(=O)NCCCc2ccccc2)cc1 409228991 IELBJXLJLVEQEW-RGEXLXHISA-N 378.428 2.894 50 40 GFGB COc1cc(/C=N/NC(=O)CNc2ccccc2)cc(Br)c1O 5335028 IHGYXUAGLACUND-DJKKODMXSA-N 378.226 2.726 50 40 GFGB COCCn1c(SCC(=O)/C(C#N)=C(/C)N)nnc1-c1ccc(Cl)cc1 104704309 KNLLPIHXYCLJEH-KAMYIIQDSA-N 391.884 2.662 50 40 GFGB NC(=S)NNC(=O)c1sccc1OCc1cccc(C(F)(F)F)c1 1395896 XCNDJSMOLQXLKL-UHFFFAOYSA-N 375.397 2.824 50 40 GFGB COc1cc(OC)c(/C=N/NC(=O)COc2ccccc2)cc1Br 3152266 BNJQLAUJEKNDFS-VXLYETTFSA-N 393.237 2.995 50 40 GFGB Cc1ccc(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])o2)c(Br)c1 711619 MNBUXZKOZGEWKD-FRKPEAEDSA-N 382.170 2.788 50 40 GFGB Cc1cccc(N(CC(=O)N/N=C/c2ccc(C)c(C)c2C)S(C)(=O)=O)c1 20207842 KLWYZHUYXXKAIV-CIAFOILYSA-N 387.505 2.837 50 40 GFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1ccc(O)c(OC)c1)c1ccccc1 408980510 ROMRAFGNSYVELF-WMRWHDLOSA-N 385.420 2.728 50 40 GFGB C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CSCc1ccc(F)cc1 24977342 YSAOZJVZNDAGFF-LBPRGKRZSA-N 380.416 2.813 50 40 GFGB Cc1c(/C=N/NC(=O)Cn2c(C(F)(F)F)nc3ccccc32)cc(C#N)n1C 13146240 RQCQFFKBASWGJJ-NUGSKGIGSA-N 388.353 2.724 50 40 GFGB O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NNc1cccc(Cl)c1 30614182 SZGQGQTWRKQXMT-ZRDIBKRKSA-N 379.869 2.764 50 40 GFGB N#C/C(C(=O)NCc1ccccc1)=C1\S[C@H](CCO)C(=O)N1c1ccccc1 2235001 VOYIKNKCDBBBND-DTBMRADHSA-N 393.468 2.569 50 40 GFGB CC1(C)CC(=O)C2=C(C1)N(N1CCOCC1)C(N)=C(C#N)[C@@H]2c1cccs1 691059 KCFBLAQLXYTPKO-QGZVFWFLSA-N 384.505 2.732 50 40 GFGB O=C(N/N=C/c1cccnc1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 6288597 GZXLIPRTXHPCLX-OEAKJJBVSA-N 383.415 2.547 50 40 GFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)c1cccc(C)c1O 4691112 UIMLVXOYIXZRES-LPYMAVHISA-N 383.404 2.606 50 40 GFGB O=C(CCCCl)Nc1nc(CCN2C(=O)c3ccccc3C2=O)cs1 6927981 NUSLJBHONRUMOR-UHFFFAOYSA-N 377.853 2.939 50 40 GFGB Cc1ccc(C)n1NC(=O)/C(C#N)=C/c1cn(CCC(N)=O)c2ccccc12 409382273 QRPKDRCRBKCDHQ-LFIBNONCSA-N 375.432 2.612 50 40 GFGB O=C(NNC(=O)c1cccnc1)C1=NN(c2ccccc2)[C@H](c2ccccc2)C1 40068106 IEGYOFFSWBYQEP-FQEVSTJZSA-N 385.427 2.850 50 40 GFGB CCOc1cc(/C=C(/C#N)C(=O)NC(C)C)cc(Cl)c1OCC(=O)OC 408780277 AMJKBEHVQLPPET-MLPAPPSSSA-N 380.828 2.722 50 40 GFGB CCOc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)N[C@@H](C)CC)c2C)cc1 408940057 NVDZAYZKYFYPMV-KOUDTOEKSA-N 384.480 2.858 50 40 GFGB CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cccc(OCC(=O)O)c2)cc1 408923433 ILSZHVSRFCMTML-MHWRWJLKSA-N 394.383 2.872 50 40 GFGB O=C(NNC(=O)c1ccc[nH]c1=O)c1ccc(COc2ccc(Cl)cc2)cc1 12863069 OLEWVWJPCFSDPF-UHFFFAOYSA-N 397.818 2.682 50 40 GFGB O=C(N/N=C1\CCCc2ccccc21)c1cccc(S(=O)(=O)N2CCCC2)c1 13098700 PIOBQWCRTJDHLU-LSDHQDQOSA-N 397.500 2.942 50 40 GFGB Cn1cc([C@@H]2C(C#N)=C(N)N(c3ccc([N+](=O)[O-])cc3)C3=C2C(=O)CCC3)cn1 5590392 OJORGHOKUAXFEG-GOSISDBHSA-N 390.403 2.633 50 40 GFGB O=C(CC(=O)N/N=C/c1ccc2c(c1)CCC2)N/N=C\c1ccc2c(c1)CCC2 31672971 JIZLYCTYDDBFHB-WJVNUPORSA-N 388.471 2.655 50 40 GFGB Cc1ccc(C(=O)NNC(=O)CSc2nnc(-c3ccc(C)cc3)n2C)cc1 876295 QBKXDQZBABBNAU-UHFFFAOYSA-N 395.488 2.652 50 40 GFGB Cc1cccc(C)c1N1C[C@@H](C(=O)NNC(=O)c2ccccc2Cl)CC1=O 7928370 DKKNPEGDOCXRIA-AWEZNQCLSA-N 385.851 2.771 50 40 GFGB COc1ccc(Br)cc1/C=N/NC(=O)CC(=O)NC1CCCCC1 59516055 PMWXCMPFHGTVKE-YBFXNURJSA-N 396.285 2.747 50 40 GFGB CN(NC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)c1ccccc1 8357879 JFVMBQAENHVSBI-UHFFFAOYSA-N 393.896 2.906 50 40 GFGB O=C(COC(=O)c1cc2cc(Cl)ccc2o1)NNC(=O)c1ccccc1F 7378553 RGNPENQXUXOSBZ-UHFFFAOYSA-N 390.754 2.843 50 40 GFGB Cc1cc(C)n2nc(SCC(=O)N/N=C/c3c(F)cccc3Cl)nc2n1 680265 KVZHIPWFIWGEGC-FBCYGCLPSA-N 392.847 2.776 50 40 GFGB CCc1ccc(Cc2nnc(SCC(=O)NNC(=O)c3ccccc3)o2)cc1 20197199 MELDUBSAONDYFD-UHFFFAOYSA-N 396.472 2.776 50 40 GFGB O=C(NNC(=O)c1ccco1)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O 12744552 BOORUVNFCKULFX-GOSISDBHSA-N 376.368 2.809 50 40 GFGB COC(=O)c1cc(OC)c(OC)cc1N/C=C(\C#N)C(=O)NC1CCCCC1 11692038 JOLYREPIHLJEDV-OUKQBFOZSA-N 387.436 2.759 50 40 GFGB COc1ccc(/C=C(\C#N)C(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc1O 2708573 SZTMPYCLETYYKL-XYOKQWHBSA-N 397.456 2.986 50 40 GFGB Cc1cc(C(=O)NN[C@H]2CC(=O)N(c3ccc4ccccc4c3)C2=O)c(C)o1 101651265 RCIKLJLCEILQRK-SFHVURJKSA-N 377.400 2.616 50 40 GFGB C/C(=N\NC(=O)c1cc(Br)c[nH]1)[C@H]1Cc2ccccc2C(=O)O1 54293565 DIDQDZOHGMCPAX-MRGVZLDZSA-N 376.210 2.665 50 40 GFGB CC(=O)N1CCN(c2c(Cl)cccc2[C@@H]2C[C@H](C(=O)Cl)CC2=O)CC1 57328050 PQKMQDKBWGWISS-JSGCOSHPSA-N 383.275 2.837 50 40 GFGB C[C@H](C(=O)N/N=C/c1ccccc1Cl)N(c1ccccc1)S(C)(=O)=O 408911380 NGVVPDHSADBTMR-KZKLBEMASA-N 379.869 2.645 50 40 GFGB O=C(CBr)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1 35604942 HPCRIQLRTIGNLW-UHFFFAOYSA-N 375.288 2.585 50 40 GFGB CCOc1ccc(NC(=O)C(=O)N/N=C\c2ccccc2Br)cc1 34705322 BUACJJPLUAQJDT-ODLFYWEKSA-N 390.237 2.937 50 40 GFGB COC(=O)COc1cccc(/C=N/NC(=O)c2ccccc2Br)c1 20760725 MNHHNGULHYBEHR-VXLYETTFSA-N 391.221 2.765 50 40 GFGB O=C(CC(=O)Nc1cccc(C(F)(F)F)c1)N/N=C/c1ccc2c(c1)OCO2 3093590 NQPWXZVSVFZICT-LSFURLLWSA-N 393.321 2.913 50 40 GFGB CN(C)c1ccc(/C=N/NC(=O)CSc2nnc(-c3ccccc3)n2C)cc1 2320405 VQXIQABZQMVXAZ-FYJGNVAPSA-N 394.504 2.791 50 40 GFGB COc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OCCCBr)cc1 4065372 JMUQEOLNEBQREN-CQSZACIVSA-N 383.242 2.651 50 40 GFGB COc1ccc(NC(=S)NNC(=O)CSc2ccc(OC)cc2)cc1 408588739 YFXVPJPXFBLRHS-UHFFFAOYSA-N 377.491 2.814 50 40 GFGB COc1ccc(/C=N/NC(=O)C2CCN(C(=O)c3ccccc3)CC2)c(OC)c1 409006450 NYBYPMMWUUJARB-HZHRSRAPSA-N 395.459 2.706 50 40 GFGB COc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cc(OC)c2c(c1OC)OCO2 85409569 PWJUVXSGKRLKIG-INIZCTEOSA-N 382.372 2.659 50 40 GFGB C=CCOC(=O)C1=C(C)NC(SCC(N)=O)=C(C#N)[C@@H]1c1ccc(C)cc1 20066037 BTFMMMYEMRSVRK-SFHVURJKSA-N 383.473 2.639 50 40 GFGB N#C/C(=C\c1ccc(-c2ccccc2Cl)o1)C(=O)N[C@H]1CCS(=O)(=O)C1 26966805 QKKYPSCUKSWMQB-SRXBQZRASA-N 390.848 2.810 50 40 GFGB CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc3c(s2)CCC3)C1 17446126 GSZYCWAMONNHHK-ZDUSSCGKSA-N 393.509 2.645 50 40 GFGB CCOc1cc(/C=N/NC(=O)COc2ccc(C)cc2[N+](=O)[O-])ccc1OC 13847814 QLLAUYUGYAHHPZ-RGVLZGJSSA-N 387.392 2.840 50 40 GFGB O=C(N/N=C/c1ccc(OCC(=O)N2CCCCC2)cc1)c1ccccc1O 4502794 DPMDSHXMYDEILM-HYARGMPZSA-N 381.432 2.547 50 40 GFGB COc1ccc(NC(=O)CSC2=C(C#N)[C@H](c3ccco3)CC(=O)N2)cc1 409133357 SPIHONIOLNVOQV-CQSZACIVSA-N 383.429 2.999 50 40 GFGB C[C@@H]1[C@H](OC(=O)CCC(=O)O)O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]1[C@]42OO3 254142618 FIHJKUPKCHIPAT-JHDSDJNSSA-N 384.425 2.602 50 40 GFGB CCOc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NC(C)(C)C)c2C)cc1 58911389 JEHXBEUPPPLUPA-LPYMAVHISA-N 384.480 2.858 50 40 GFGB COc1ccc2ccccc2c1/C=N/NC(=O)Cn1nnc(-c2ccccc2)n1 805655 UGGUYXFHWBAHRK-LPYMAVHISA-N 386.415 2.652 50 40 GFGB CCN(CC)S(=O)(=O)c1ccc(C(=O)Oc2ccc([N+](=O)[O-])cc2)cc1 6433181 RXSKSLSQWVZGLV-UHFFFAOYSA-N 378.406 2.845 50 40 GFGB CN(C)c1cccc(C(=O)N/N=C\c2ccc(OCC(=O)O)c(Cl)c2)c1 30803295 RFGQLQQUMSPKQP-JMIUGGIZSA-N 375.812 2.633 50 40 GFGB Cc1ccc(CC(=O)N/N=C/c2cn(CCC(N)=O)c3ccccc23)cc1C 408565880 CATALOCFKFASKX-ZMOGYAJESA-N 376.460 2.826 50 40 GFGB CCn1nc(C)c2c(C(=O)N/N=C/c3ccn(CC(F)(F)F)n3)cc(C)nc21 252483045 DTEFNHSBLATNQH-ODCIPOBUSA-N 393.373 2.591 50 40 GFGB O=C(NNC(=O)[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)O)c1ccc(OC2CCCC2)cc1 102204729 OZLPYWOSLSDFOH-ZZCKCESHSA-N 386.448 2.516 50 40 GFGB COc1ccc(N2C(=O)[C@H]3[C@@H](SC(N)=C(C#N)C34CCCCC4)C2=O)cc1 102222122 DNVFWJVHBSHAPN-HZPDHXFCSA-N 383.473 2.944 50 40 GFGB CC(C)COc1cccc(C(=O)NC(=S)NNC(=O)c2cccs2)c1 6358000 XMLLSUYCPZILSL-UHFFFAOYSA-N 377.491 2.732 50 40 GFGB O=C(NNC(=O)c1c[nH]nc1-c1ccccc1)c1ccccc1Br 8706465 ZBTDYLUBMKZZPM-UHFFFAOYSA-N 385.221 2.914 50 40 GFGB N#C/C(=C/c1ccncc1)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1 33689412 DAPZPGXZJQJNSZ-LGMDPLHJSA-N 396.472 2.802 50 40 GFGB COc1ccc(C(=O)NNC(=S)NC(=O)c2ccc(Cl)cc2Cl)cc1 2135521 HEPGBNDABKHDHR-UHFFFAOYSA-N 398.271 2.951 50 40 GFGB C/C(=N\NC(=O)CN(c1cc(Cl)ccc1C)S(C)(=O)=O)c1ccccc1 408785838 ZVIFFAMLQHGZBQ-XSFVSMFZSA-N 393.896 2.955 50 40 GFGB N#C/C(=C\N1CCN(c2ccc(F)cc2)CC1)C(=O)NCCc1ccccc1 5488649 FYBOZOBACQYORK-HTXNQAPBSA-N 378.451 2.714 50 40 GFGB NNC(=O)COc1ccc(Br)cc1-c1ccnn1-c1ccccc1 19863109 LPGNUAVXOGNUII-UHFFFAOYSA-N 387.237 2.671 50 40 GFGB CC/C(=N/NC(=O)c1ccccc1)c1ccc(OCCN2CCOCC2)cc1 19841424 JPJLIKYMMVYIAH-LNVKXUELSA-N 381.476 2.942 50 40 GFGB COC(=O)c1ccc(-c2ccc(/C=N/NC(=O)[C@@H](O)c3ccccc3)o2)cc1 409267853 YBEQSNGZDOYIFG-MEGCXXLRSA-N 378.384 2.917 50 40 GFGB O=C(N/N=C\c1ccc(O)c([N+](=O)[O-])c1)c1cc(Br)ccc1O 408877729 UDDYJWWNEXDTCT-APSNUPSMSA-N 380.154 2.532 50 40 GFGB Cc1cccc(/C=N/NC(=O)CN(c2ccc(C)c(Cl)c2)S(C)(=O)=O)c1 408775148 FGNGKDDPMHAVDY-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB Cc1cc(/C=N/NC(=O)c2ccccc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 408964576 DRQPENIMFSUWTK-LPYMAVHISA-N 396.472 2.505 50 40 GFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(Cl)c([N+](=O)[O-])c1 36009244 HEPUVQITLNENBR-IUXPMGMMSA-N 378.728 2.686 50 40 GFGB CN(C)c1ccc(/C=N/NC(=O)[C@H](O)c2ccccc2)cc1Br 14134647 JANIOMNBDQPHGC-YDDPGSGASA-N 376.254 2.699 50 40 GFGB CC(C)[C@@H](NC(=O)C1CCCCC1)C(=O)NNC(=O)c1cccc(Cl)c1 14181227 QICHRZURGSQMIP-MRXNPFEDSA-N 379.888 2.822 50 40 GFGB Cc1cc(C)nc(NNC(=O)[C@H](NC(=O)c2ccccc2Cl)C(C)C)n1 14512438 LLFUBGVYUGWBPH-OAHLLOKOSA-N 375.860 2.645 50 40 GFGB O=C(COC(=O)c1cc2c(s1)CCCCC2)NNC(=O)c1cccs1 6999803 OCMYOKWVXWUMAW-UHFFFAOYSA-N 378.475 2.697 50 40 GFGB C/C(=N\NC(=O)c1ccc(I)cc1)c1ccc(O)cc1O 408711696 GMGMJVUJBOQVPF-RQZCQDPDSA-N 396.184 2.856 50 40 GFGB CC(C)=NNC(=O)CN(c1ccc(Cl)c(C(F)(F)F)c1)S(C)(=O)=O 408787079 QUXVDTAXXWLELS-UHFFFAOYSA-N 385.795 2.637 50 40 GFGB O=C(CN1CCOCC1)N/N=C/c1cccc(OCc2ccc(Cl)cc2)c1 408735917 YLNMIDHHLGQSAM-LPYMAVHISA-N 387.867 2.701 50 40 GFGB Cc1ccc(S(=O)(=O)CN(CCBr)CCBr)cc1 1562990 VSUHOXSSZBSHKX-UHFFFAOYSA-N 399.148 2.818 50 40 GFGB CCc1cc(C(=O)NNC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3CC[C@H]2C3=C(C)C)cs1 102618659 JOQGNRGLWIHDEO-UGQVUOCMSA-N 376.478 2.765 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(C)cc2OC)ccc1O[C@H](C)C(=O)O 409021180 YTCHISVTTKYGGU-SRRANQMSSA-N 386.404 2.628 50 40 GFGB COc1cc(OC)cc(C(=O)N/N=C(\C)CC(=O)NCc2ccc(F)cc2)c1 5027192 QNMUUDWPASIPMU-YDZHTSKRSA-N 387.411 2.655 50 40 GFGB N#C/C(=C/c1ccc(OCC(=O)N2CCOCC2)cc1)c1nc2ccccc2[nH]1 15008964 WSWPOXHYTPAZEE-LGMDPLHJSA-N 388.427 2.865 50 40 GFGB CCOc1ccccc1/C=N/NC(=O)CN1CCN(Cc2ccc(C)cc2)CC1 19682550 IPOBULFHSAZDKL-LFVJCYFKSA-N 394.519 2.662 50 40 GFGB Cc1ccc(Oc2cc(NNC(=O)[C@@H]3COc4ccccc4O3)ncn2)cc1 632577 RRQABKLRUAEWOY-KRWDZBQOSA-N 378.388 2.860 50 40 GFGB Cc1ccccc1[C@@H]1C(C#N)=C(N)N(N2CCOCC2)C2=C1C(=O)CC(C)(C)C2 691004 KJIIIRNHHBUEPE-HXUWFJFHSA-N 392.503 2.979 50 40 GFGB CC(C)c1ccccc1N1/C(=N\C(=O)CCl)S[C@@H]2CS(=O)(=O)C[C@@H]21 101316741 YDWLWZPHMIKNSQ-GGNAOWBESA-N 386.926 2.650 50 40 GFGB O=C(CCCNC(=O)c1cccs1)NNC(=O)C12CC3CC(CC(C3)C1)C2 12752752 LEPDNAFXQMMVPZ-UHFFFAOYSA-N 389.521 2.622 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)Cc2csc(-c3ccccc3)n2)cc1 6788857 RUGPOTOLJNXKKY-UHFFFAOYSA-N 381.457 2.887 50 40 GFGB CCCNC(=O)NN(C(=O)NC1CCCCC1)c1nc(C(=O)OCC)cs1 8169736 KFZWOWVYEALUOW-UHFFFAOYSA-N 397.501 2.793 50 40 GFGB CCOC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(Cl)c2)c1 12812718 CEBKQVFANYPVFV-UHFFFAOYSA-N 397.840 2.532 50 40 GFGB COc1cccc(NC(=O)C(=O)N/N=C\c2ccccc2Br)c1 107455515 WGYGQWLOOGLVAL-ZDLGFXPLSA-N 376.210 2.547 50 40 GFGB Cc1ccsc1/C=N/NC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O 20209587 RRDLMYFZFPTJLK-RQZCQDPDSA-N 385.898 2.626 50 40 GFGB O=C(Cc1ccc(Br)cc1)N/N=C\c1cc([N+](=O)[O-])ccc1O 13595252 IOFUVEMRIRIQDD-MFOYZWKCSA-N 378.182 2.756 50 40 GFGB Cc1ccc(OCC(=O)N/N=C/c2ccc(O)cc2O)c(Br)c1 1021240 QMXFJNUPCCQGSM-QGMBQPNBSA-N 379.210 2.698 50 40 GFGB COc1ccc(C(C)=O)cc1CC(=O)NNC(=O)[C@@H](C)Oc1cccc(C)c1C 12761000 FOVVDJDPFFINSE-MRXNPFEDSA-N 398.459 2.672 50 40 GFGB CCCCN(CCCC)C(=O)[C@@H]1[C@H]2C[C@@H]([C@H](O)[C@@H]2Br)[C@H]1C(=O)O 252444361 KCBNELBBVDYUQJ-OJVARPOJSA-N 390.318 2.506 50 40 GFGB COC(=O)c1ccc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)cc1 831181 NHGJSKQNNZDABL-VXLYETTFSA-N 387.417 2.765 50 40 GFGB C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc2ccc(C)c(C)c2[nH]c1=O 4131449 GDSBKCAFXPVDEM-SFHVURJKSA-N 391.427 2.956 50 40 GFGB CN(CC(=O)N/N=C/c1cccc2ccccc12)S(=O)(=O)c1ccc(F)cc1 6544582 DOOKRURKFOICOO-LPYMAVHISA-N 399.447 2.750 50 40 GFGB CN1C(=O)/C(=N\NC(=O)c2ccc(COc3ccccc3)o2)c2ccccc21 46590894 NXOPVDORNBCJAM-QOCHGBHMSA-N 375.384 2.969 50 40 GFGB Cc1ccc(C)c(NC(=S)NNC(=O)[C@H](C)n2nc(C)c([N+](=O)[O-])c2C)c1 2794734 LWTKWIXOELFQPJ-ZDUSSCGKSA-N 390.469 2.604 50 40 GFGB CN(C)c1cccc(C(=O)NNC(=O)CCC(=O)c2ccc3c(c2)CCC3)c1 12734378 MPNSXKXZXVILEB-UHFFFAOYSA-N 379.460 2.665 50 40 GFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1cccc(OC)c1 408607458 SDIFKXHSLZTYRN-QGZVFWFLSA-N 397.504 2.948 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)[C@H]2COc3ccccc3O2)cc1OCC 5464422 UOPCCGZUPNXNNP-CCULFSDZSA-N 382.416 2.940 50 40 GFGB CN(NC(=O)c1ccc(NC(=O)CSc2nccn2C)cc1)c1ccccc1 7117789 BJXOWGNFMMDUMB-UHFFFAOYSA-N 395.488 2.932 50 40 GFGB Cc1nnc(NC(=O)CCCC(=O)O[C@@H](CCl)C(=O)c2ccccc2)s1 8474318 AOLOETOJZXXKJA-ZDUSSCGKSA-N 395.868 2.989 50 40 GFGB CCOC(=O)C1=C(C)NC(SCC(N)=O)=C(C#N)[C@@H]1c1ccc(Cl)cc1 22521105 FNGGBONZQHQKGA-INIZCTEOSA-N 391.880 2.818 50 40 GFGB C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CCc1nc2ccccc2s1 7813689 VOVYMTKJHIBEQF-LBPRGKRZSA-N 387.436 2.983 50 40 GFGB O=C(N/N=C/c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccc2c(c1)OCO2 5688186 REOOHLJDGQBCFE-RGVLZGJSSA-N 382.376 2.688 50 40 GFGB CC1=C(C#N)C(=O)N(CCCN2CCCC2=O)C(=O)/C1=C\Nc1ccccc1C 8990260 ZFRNGOUUFNEQRL-JXAWBTAJSA-N 392.459 2.512 50 40 GFGB Cc1cc(Cl)c(C)c(S(=O)(=O)NNC(=O)c2ccccc2O)c1Cl 9154061 KRRLOBWWDMEOBD-UHFFFAOYSA-N 389.260 2.939 50 40 GFGB C/C(=N\NC(=O)c1cc(Br)cn1C)[C@@H]1Cc2ccccc2C(=O)O1 54294399 FNGJJZQOBYJXDE-RPJLVFAOSA-N 390.237 2.675 50 40 GFGB CC(=O)N1C(=O)/C(=N\NC(=O)COc2ccc3ccccc3c2)c2ccccc21 100069349 GSFDNZOWEZDCFR-FLFQWRMESA-N 387.395 2.632 50 40 GFGB O=C(CCCCCNC(=O)c1ccccc1)N/N=C/c1ccccc1C(=O)O 44965638 LEQZOQKPRTUZSY-HZHRSRAPSA-N 381.432 2.825 50 40 GFGB Cn1cc(C(=O)NNS(=O)(=O)c2cccc(C(F)(F)F)c2)c2ccccc21 7907348 SQKLEAJCPQKTEV-UHFFFAOYSA-N 397.378 2.820 50 40 GFGB CCOC(=O)COc1ccc(/C=C(\C#N)C(=O)NCCc2ccccc2)cc1 408803198 MHLHTIZJOBLILX-XMHGGMMESA-N 378.428 2.894 50 40 GFGB Cc1cc(/C=N/NC(=O)C(=O)NCc2ccco2)c(C)n1-c1ccccc1F 408969358 MPGVFQWZBXKUJF-FOKLQQMPSA-N 382.395 2.593 50 40 GFGB COc1cc(N2CCOCC2)ccc1/C=C(/C#N)C(=O)NCc1ccccc1 409251085 SYEQWRBFAGOBPB-UYRXBGFRSA-N 377.444 2.755 50 40 GFGB C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2c(C)ccc(C)c2[nH]c1=O 4131455 PRDGGAAQSFJJNY-GOSISDBHSA-N 391.427 2.956 50 40 GFGB CCc1cc(C(=O)NNC(=O)[C@H]2[C@H]3CC[C@@H](C3=C(C)C)[C@H]2C(=O)O)cs1 102618663 JOQGNRGLWIHDEO-DARAHFNDSA-N 376.478 2.765 50 40 GFGB COc1ccc(NC(=O)[C@@H](C)SC2=C(C#N)C(C)(C)[C@H](C#N)C(=O)N2)cc1 12622498 VYKGLLQMYWSPPX-BXUZGUMPSA-N 384.461 2.786 50 40 GFGB COc1cc(OC)c(OC)cc1/C=N\NC(=O)COc1cccc2cccnc12 409018817 VOIUNXBRKNIIQO-FMCGGJTJSA-N 395.415 2.790 50 40 GFGB O=C(Cl)[C@@H]1CC(=O)N(c2cc(C(F)(F)F)ccc2N2CCOCC2)C1 45958590 QIFJEUODIPJYGI-SNVBAGLBSA-N 376.762 2.660 50 40 GFGB COc1ccc(/C=N/NC(=O)c2cc3cc(OC)c(OC)c(OC)c3[nH]2)cc1 2341257 GRBDAZGKDLQACR-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB O=C(N/N=C/c1ccccc1[N+](=O)[O-])C(=O)Nc1cc(Cl)cc(Cl)c1 6226823 GRKVPDGIXUWMLC-QGMBQPNBSA-N 381.175 2.990 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1cccc(OC)c1OC 408908845 SLUPNELARFGJNR-FEMWLQECSA-N 399.447 2.511 50 40 GFGB C#CCOc1ccc2ccccc2c1/C=N/NC(=O)CNC(=O)c1ccccc1 408814362 GXHMBMSWIBKBFA-MFKUBSTISA-N 385.423 2.732 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2cccc(C)c2)cc(Cl)c1O 6958763 GONDNUOLRCIJOR-KEBDBYFISA-N 375.812 2.842 50 40 GFGB COCCCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2ccc(C)cc2C)c1C 58914030 VCGAIUPJDGJKDJ-OYKKKHCWSA-N 398.507 2.704 50 40 GFGB CCCn1nc(C(=O)NNC(=O)c2ccc(Cl)cc2)c2ccccc2c1=O 6258526 MOHAHNMMJIRZNX-UHFFFAOYSA-N 384.823 2.535 50 40 GFGB CCOC(=O)C1=C(C(=O)OCC)[C@H](c2ccccc2Cl)C(C#N)=C(N)O1 4836941 LHSYDQAUJHTHIN-CYBMUJFWSA-N 376.796 2.528 50 40 GFGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1 5858569 LVSIBDJJJJNNSK-UHFFFAOYSA-N 384.432 2.730 50 40 GFGB Cc1oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2c1C(=O)NN 41124577 HKWZRXMDHPLNDP-UHFFFAOYSA-N 379.825 2.799 50 40 GFGB COC(=O)[C@@H](CCBr)CCOS(=O)(=O)c1ccc(C)cc1 642882547 KQTRAYGVQAKYOJ-LBPRGKRZSA-N 379.272 2.665 50 40 GFGB C[C@@H]1Cc2cc(C(=O)Oc3ccc([N+](=O)[O-])cc3)ccc2N1S(C)(=O)=O 97971387 HPZMGPSNDUCIIA-LLVKDONJSA-N 376.390 2.525 50 40 GFGB O=C(N/N=C/c1ccc2c(c1)OCO2)C(=O)Nc1cc(Cl)cc(Cl)c1 13921601 RYCOFPGSXVHOOP-FBCYGCLPSA-N 380.187 2.811 50 40 GFGB CCc1c(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cnn1-c1ccc(C)cc1 12983744 HFILDRSCNARMKA-UHFFFAOYSA-N 393.403 2.726 50 40 GFGB Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Cc2sc(=S)[nH]c2C)c1C 18103696 LGJQMOOCUVGJPG-LBPRGKRZSA-N 379.507 2.888 50 40 GFGB O=C(COc1ccc(O)cc1)NNC(=O)COc1ccccc1-c1ccccc1 78808964 HUAYAAJEWUBCFS-UHFFFAOYSA-N 392.411 2.664 50 40 GFGB Cn1ncc(Br)c1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253407124 VPMVTLNIRVVCOP-GFCCVEGCSA-N 377.242 2.633 50 40 GFGB CCOc1cccc(C(=O)NNC(=O)CCC(=O)Nc2ccc(C)c(C)c2)c1 14042059 QJTYHQYHUVQORI-UHFFFAOYSA-N 383.448 2.882 50 40 GFGB CN(CC(=O)N/N=C\c1ccccc1F)S(=O)(=O)c1ccc2ccccc2c1 16187484 KKNHFRLRUFQEGW-XKZIYDEJSA-N 399.447 2.750 50 40 GFGB CCN(CC)C[C@H](O)Cn1cc(/C=N/NC(=O)c2ccncc2)c2ccccc21 5521168 TYVBJDZPQXPOEI-BBMHEYIBSA-N 393.491 2.503 50 40 GFGB Cc1ccc(/C=N/NC(=O)CN(c2ccc(C)c(Cl)c2)S(C)(=O)=O)cc1 408773021 OQMLVEKDTGHSCX-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB COc1ccc(/C(C[C@@H]2OC(=O)c3ccccc32)=N\NC(=O)C[N+](C)(C)C)cc1 5832214 UFHWSDAVPJUQDQ-ZNCVUUBVSA-O 396.467 2.524 50 40 GFGB C=CCc1cc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)cc(OC)c1O 8336649 QVTMTHQBPZJXCI-KEBDBYFISA-N 386.477 2.779 50 40 GFGB N#C/C(=C\c1cccc(Oc2ccccc2)c1)C(=O)N[C@@H]1CCS(=O)(=O)C1 26966623 AITPJPKCOJUUFV-ABPVARSCSA-N 382.441 2.689 50 40 GFGB Cc1ccc(S(=O)(=O)N[C@@H](CC(=O)NCCCl)c2ccccc2)cc1 408979622 NJYWYWRLTDTDJG-KRWDZBQOSA-N 380.897 2.760 50 40 GFGB COc1ccc(/C=N\NC(=O)c2cc(Br)ccc2O)cc1OC 33339160 ZWBVZENHCZAZKT-NVMNQCDNSA-N 379.210 2.936 50 40 GFGB COc1cc(Br)ccc1OCC(=O)N/N=C/c1ccc(O)cc1 712045 MQJDQZYHLVEECT-GIJQJNRQSA-N 379.210 2.692 50 40 GFGB O=C(OCCBr)c1ccccc1C(=O)OCCBr 1685849 YIPZLVOEEKYMLF-UHFFFAOYSA-N 380.032 2.790 50 40 GFGB Cc1cc(Cl)ccc1OCC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F 7652757 XORNRDZSRSJCHZ-GFCCVEGCSA-N 380.803 2.781 50 40 GFGB CC(C)c1ccc(N2/C(=N\C(=O)CCl)S[C@@H]3CS(=O)(=O)C[C@H]32)cc1 101302552 MRSOXHPOSUCGAW-QJGXAYKQSA-N 386.926 2.650 50 40 GFGB O=C(Cc1cccc2ccccc12)NNS(=O)(=O)c1ccc(F)c(F)c1 12773546 ZAHJWEGKXSEPME-UHFFFAOYSA-N 376.384 2.670 50 40 GFGB COc1cccc(CC(=O)N/N=C\c2cccn2-c2ccc(C(=O)O)cc2)c1 409236598 TWESCHDVWOEWCD-HMAPJEAMSA-N 377.400 2.877 50 40 GFGB N/C(=N\NC(=O)c1ccc(Br)cc1)c1cc2ccccc2oc1=O 32601244 ZBAVCALOCKCPOL-UHFFFAOYSA-N 386.205 2.606 50 40 GFGB COc1cc(/C=N/NC(=O)[C@@H](O)c2ccccc2)cc(Br)c1OC 1092582 USTIAKRBICDUIR-RPJLVFAOSA-N 393.237 2.650 50 40 GFGB Cc1cc(C)nc(NNC(=O)[C@@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)n1 32889356 MHQRDPWMASMVBG-GFCCVEGCSA-N 393.369 2.608 50 40 GFGB C[C@H]1C[C@@H]1c1ccc(CCC(=O)NNC(=O)c2cc(Br)c[nH]2)o1 53175967 HTJJRYBKADKIED-CABZTGNLSA-N 380.242 2.887 50 40 GFGB COc1ccc(S(=O)(=O)/C(C#N)=C\Nc2ccc([N+](=O)[O-])c(F)c2)cc1 101379081 IITAORVBQJUENJ-UVTDQMKNSA-N 377.353 2.993 50 40 GFGB CC1(C)[C@]2(C)CC[C@@]1(C(=O)NCCN1CCCCC1)[C@@H](Br)C2=O 2172604 PLSNWPRDSCYRJM-VHSSKADRSA-N 385.346 2.747 50 40 GFGB C/C(=N\NC(=O)c1cc(O)cc(O)c1)c1cccc(NC(=O)C(F)(F)F)c1 13322223 SAPKIFRFAOZJQF-LSFURLLWSA-N 381.310 2.753 50 40 GFGB O=C(O)COc1ccc(/C=N/NC(=O)CSc2nc3ccccc3o2)cc1 408888963 DBJYKDWQJVKMEM-DJKKODMXSA-N 385.401 2.534 50 40 GFGB COc1ccc(CCNC(=S)NNC(=O)c2ccccc2Cl)cc1OC 5274159 KJBUIUOZZFYNDB-UHFFFAOYSA-N 393.896 2.709 50 40 GFGB NC(=O)N/N=C/c1ccc(Sc2n[nH]c(-c3ccccc3)n2)c([N+](=O)[O-])c1 409191970 RIVNXDFZGZVUCR-GIJQJNRQSA-N 383.393 2.533 50 40 GFGB COc1cccc(C(=O)N/N=C\c2cc([N+](=O)[O-])cc(Br)c2O)c1 408875155 DMBLUQRDWWNDEX-IUXPMGMMSA-N 394.181 2.835 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])cc(Br)c1O)c1ccccc1F 5867011 YLECJJGEQKZLCX-REZTVBANSA-N 382.145 2.966 50 40 GFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccccc1OC 4502838 SODRECSLPXUAQV-QGZVFWFLSA-N 397.504 2.948 50 40 GFGB Cc1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3C(F)(F)F)cc2O)o1 13987914 GTTBRPPGKFVBHW-UHFFFAOYSA-N 394.309 2.573 50 40 GFGB C#CCOc1ccc(/C=C(/C#N)C(=O)NC(C)C)cc1I 408779280 CRMSOCSIACJTKO-JYRVWZFOSA-N 394.212 2.735 50 40 GFGB Cc1ccc(-n2nc(C(=O)N/N=C\c3ccccc3)c(C)c(C#N)c2=O)cc1C 409052947 FMXGDZIZYDZRHV-CFRMEGHHSA-N 385.427 2.793 50 40 GFGB COc1cccc(/C=N/NC(=O)CNc2ccc(C)c(C)c2)c1O[C@@H](C)C(=O)O 409238252 CZIKHRBEBKYWHC-QCXKMSLLSA-N 399.447 2.726 50 40 GFGB C/C(Cl)=C\Cn1c(SCCCCCl)nc2c1c(=O)[nH]c(=O)n2C 19893600 NITDKHANLGZLFL-WEVVVXLNSA-N 377.297 2.677 50 40 GFGB CCOc1ccc(NC(=O)C/C(C)=N/NC(=O)COc2ccc(OC)cc2)cc1 4412107 HFPODVATQNDWEZ-HZHRSRAPSA-N 399.447 2.994 50 40 GFGB O=C(N/N=C/c1c[nH]c2ccccc12)c1c(O)c2cccc3c2n(c1=O)CCC3 100912479 FPJDDOQIOLGJBV-WYMPLXKRSA-N 386.411 2.899 50 40 GFGB CCOc1ccc([C@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)cc1OC(=O)C1CC1 4040722 GYGQYYUWPUQNBB-KRWDZBQOSA-N 380.404 2.650 50 40 GFGB aggregator COc1cc(/C=C(\C#N)C(=O)Nc2sc3c(c2C(N)=O)CCCC3)ccc1O 4339585 QTVSXRZAHCEXAD-XYOKQWHBSA-N 397.456 2.986 50 40 GFGB CC(=O)N[C@@H](C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2)C(C)C 8420770 BETSLDGOPTXLQT-RHSMWYFYSA-N 393.553 2.821 50 40 GFGB COc1c(O)ccc(/C=N/NC(=O)c2cccc(Br)c2)c1[N+](=O)[O-] 9668326 WBZNJHSRQGAOPX-CAOOACKPSA-N 394.181 2.835 50 40 GFGB CCC(=O)N1CCc2cc(C(=O)NNC(=O)c3cc4c(s3)CCC4)ccc21 40144173 YFKZPXLOVNDDIW-UHFFFAOYSA-N 383.473 2.611 50 40 GFGB O=C(N/N=C/c1ccccc1I)c1ccc2c(c1)OCO2 3576516 XMCIOHHKKIWSIY-CAOOACKPSA-N 394.168 2.784 50 40 GFGB COc1cccc(OC)c1/C=N/NC(=O)C(=O)Nc1cccc(C(F)(F)F)c1 6451797 XGRQYYCZVPLJGT-LSHDLFTRSA-N 395.337 2.811 50 40 GFGB CC1=C(C#N)C(O)=NC(=O)/C1=C\c1ccc(-c2ccc(S(=O)(=O)O)cc2)o1 12630885 VWJXFRIOSOZKEU-ZSOIEALJSA-N 384.369 2.913 50 40 GFGB COc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(C)n(C[C@@H]3CCCO3)c(=O)c21 2246981 QVSCHRZXAANOFC-LIRRHRJNSA-N 393.443 2.563 50 40 GFGB CCCN1C(=O)/C(=N/NC(=O)c2ccccn2)c2cc(Br)ccc21 17136197 WKXAXLXYTJLVFG-HMMYKYKNSA-N 387.237 2.735 50 40 GFGB Cc1cc(C)cc(N(CC(=O)N/N=C/c2ccccc2Cl)S(C)(=O)=O)c1 408767812 OVZGQXJLHRDCEZ-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB O=C(NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCC3)c1ccc2ccccc2c1 7757814 FYQTUOYVHPRFFG-UHFFFAOYSA-N 398.422 2.571 50 40 GFGB O=C(NNC(=O)c1ccccc1C(=O)c1ccccc1)c1cccc([N+](=O)[O-])c1 3169699 NATBGSCDMYBNTP-UHFFFAOYSA-N 389.367 2.901 50 40 GFGB COc1ccc(-c2n[nH]cc2/C=N/NC(=O)CCc2ccc(O)c(O)c2)cc1 6694034 KIKOSSNUBPWLGT-SRZZPIQSSA-N 380.404 2.579 50 40 GFGB Cc1ccc(C(=O)NCC(=O)NNC(=S)Nc2cccc(C)c2C)cc1C 5689757 KOSNOUNTRHYPQG-UHFFFAOYSA-N 384.505 2.668 50 40 GFGB COc1ccc(OCC(=O)N/N=C\c2cccn2-c2cccc(C(=O)O)c2)cc1 33502303 SLIGISOBSVTVPY-XKZIYDEJSA-N 393.399 2.713 50 40 GFGB COc1ccc(OCC(=O)N/N=C/c2cc(Br)ccc2OC)cc1 1431095 YPQKSIQPDQXSCJ-VXLYETTFSA-N 393.237 2.995 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(I)cc1 10476131 AFQCCMNXDKHWQP-VGOFMYFVSA-N 385.117 2.556 50 40 GFGB CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)C(=O)N/N=C/c1ccco1 408977383 DCMPUIFYKIIYKW-RHLNUJDMSA-N 387.436 2.840 50 40 GFGB O=C(O)COc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc1Cl 6526843 KYVZKTDNSKTZET-DNTJNYDQSA-N 397.214 2.986 50 40 GFGB Cc1cccc(NCC(=O)N/N=C2\C(=O)N(CCCC#N)c3ccccc32)c1 5705381 WZPOYGSNWCNTPI-QQTULTPQSA-N 375.432 2.578 50 40 GFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1cc(C(=O)O)ccc1Nc1ccccc1C 408709313 ZICBRVGCIOOLFC-OFJBCHTGSA-N 396.447 2.802 50 40 GFGB O=C(NCc1ccc(Cl)cc1Cl)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 5569022 WXSXJNMVEMOKKS-DNTJNYDQSA-N 395.202 2.668 50 40 GFGB COc1ccc2c(c1)nc(SCC(=O)N/N=C/c1ccc3c(c1)OCO3)n2C 30822800 XQCAHFSJUPMNKT-AWQFTUOYSA-N 398.444 2.553 50 40 GFGB CC(C)(C)C(=O)NCCC(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1 32906359 NMZJLJLUKOIYBY-UHFFFAOYSA-N 391.468 2.868 50 40 GFGB COc1cccc(N(CC(=O)NN=C2CCCCCCC2)S(C)(=O)=O)c1 8167587 MQGJKXKQUURPSA-UHFFFAOYSA-N 381.498 2.678 50 40 GFGB Cc1ccccc1OCC(=O)NCC(=O)N/N=C/c1cccc(Cl)c1Cl 2121957 PMMZWXASPRRYJC-LSFURLLWSA-N 394.258 2.947 50 40 GFGB COc1cc(/C=N/NC(C)=O)ccc1OS(=O)(=O)c1cc(C)ccc1C 3402089 GROASDRGENJLME-YBFXNURJSA-N 376.434 2.550 50 40 GFGB Cc1cc(C)n2c(SCC(=O)C(C#N)=C3Nc4ccccc4N3)nnc2n1 4015286 LJBNMMQJSUAPLV-UHFFFAOYSA-N 377.433 2.675 50 40 GFGB CNC(=O)C(=O)N/N=C/c1cc(Br)ccc1Nc1ccc(F)cc1 408708346 PGZBJQLYPHZSSF-AWQFTUOYSA-N 393.216 2.528 50 40 GFGB CC(C)(C)OC(=O)COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1 1015046 BEVWRVXZLQYLSI-LPYMAVHISA-N 384.432 2.936 50 40 GFGB O=C(CNC(=O)c1ccc(Cl)cc1Cl)NNC(=O)Nc1ccccc1F 1755661 SJFQTNJCHADHJI-UHFFFAOYSA-N 399.209 2.715 50 40 GFGB CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCCOc1ccccc1OC 4600052 DXMRHUTWIFJILF-FOWTUZBSSA-N 382.416 2.944 50 40 GFGB CCOc1cc(/C=N/NC(C)=O)cc(I)c1OCC 409014328 XGVAXQIPQKAWHP-OVCLIPMQSA-N 376.194 2.559 50 40 GFGB O=C(N/N=C\c1cccc([N+](=O)[O-])c1)c1ccccc1I 32109904 PHQGUSILUDAGIB-SXGWCWSVSA-N 395.156 2.963 50 40 GFGB COc1ccc(C(=O)NNC(=O)COc2ccc(C)cc2Br)cc1 832001 LCLUMGJKSLMWQG-UHFFFAOYSA-N 393.237 2.606 50 40 GFGB COC(=O)CSC1=C(C#N)[C@H](c2cccc(Br)c2)CC(=O)N1 6440821 YCZUBWVKTFLBOU-NSHDSACASA-N 381.251 2.694 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OC)cc1C 408912655 QSYMHSCGOZTPLD-KWJZBXMYSA-N 383.448 2.811 50 40 GFGB CC/C(=N\NC(=O)c1ccoc1C)c1ccc(OCCN2CCOCC2)cc1 20551606 IEJWDTNRNPEJQX-LSDHQDQOSA-N 385.464 2.843 50 40 GFGB O=C(O)COc1cccc(/C=N/NC(=O)CSc2nc3ccccc3o2)c1 408924307 MRTLDEOGAWYDEF-DJKKODMXSA-N 385.401 2.534 50 40 GFGB COc1ccc(Cl)cc1N(CC(=O)NN=C1CCCCC1)S(C)(=O)=O 408784517 UAINFJZKWDGBLY-UHFFFAOYSA-N 387.889 2.551 50 40 GFGB CC[C@@H](C)NC(=O)/C(C#N)=C/c1ccc(OCC(=O)O)c(Br)c1 408805343 AHKKEVNTSLELEY-HAAVITCDSA-N 381.226 2.734 50 40 GFGB N#C/C(=C\c1ccc(-c2ccc(F)cc2F)o1)c1nn(CCO)c(N)c1C#N 4503483 ONXIFSZMIKJHIL-YRNVUSSQSA-N 381.342 2.932 50 40 GFGB O=C(CN(Cc1ccco1)S(=O)(=O)c1ccccc1)NN=C1CCCCC1 59435389 GKQSMPCQPCUNRB-UHFFFAOYSA-N 389.477 2.907 50 40 GFGB CCN(CC)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(C)cc2)nc1 12543760 RFAGOYJZJUSBAQ-UHFFFAOYSA-N 377.470 2.569 50 40 GFGB CCCCN1C(=O)N=C(O)/C(=C(/CC)NNC(=O)c2ccccc2Cl)C1=O 16977335 BNEUTPWUEYBFAI-BUHFOSPRSA-N 392.843 2.957 50 40 GFGB O=C(O)c1cc(C(=O)O)cc(-c2ccc(/C=N/NC(=O)c3cccnc3)o2)c1 409007981 SPGPTUSVVAXGNY-UFFVCSGVSA-N 379.328 2.502 50 40 GFGB COc1cccc(/C=N/NC(=O)C2CCN(C(=O)c3cccc(OC)c3)CC2)c1 409006949 SXFOUSGPDRHIFQ-HZHRSRAPSA-N 395.459 2.706 50 40 GFGB CC(C)COC(=O)[C@@H]1/C(=N/NC(=O)CC#N)C[C@@](C)(O)C[C@H]1c1ccccc1 254511943 CIPFSKNBWXNURT-XGAPFTQDSA-N 385.464 2.516 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2cc(Cl)ccc2C)ccc1O 3168478 MBFHEYJNBXBOJN-KEBDBYFISA-N 375.812 2.842 50 40 GFGB C/C(=N\NC(=O)COc1ccc([N+](=O)[O-])cc1Br)c1ccco1 4672033 SQFIVOJOUBJRNJ-CXUHLZMHSA-N 382.170 2.870 50 40 GFGB COC(=O)c1cccc(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)c1 408973554 YURJDAXMJZGILE-LSHDLFTRSA-N 393.321 2.581 50 40 GFGB O=C(N/N=C/c1cccs1)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 408851110 IJJUOXMDPXPHQF-LZNAANCOSA-N 397.909 2.705 50 40 GFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(N2CCCC2)c(F)c1 409104660 GQEDFFLNJKXZFT-MTJSOVHGSA-N 386.383 2.863 50 40 GFGB CCOC(=O)c1c(NC(=O)CCl)sc2c1CC[C@H](Br)C2=O 101023408 NECWIIUUGDEJCI-ZETCQYMHSA-N 394.674 2.995 50 40 GFGB CC(C)(CCC(=O)ON1C(=O)CCC1=O)SSc1ccc([N+](=O)[O-])cn1 101782268 AQKHEWNNTCBJPY-UHFFFAOYSA-N 399.450 2.896 50 40 GFGB N#CC1=C(N)Oc2c(oc(CO)cc2=O)[C@H]1c1ccc(SC(F)(F)F)cc1 1427372 RXRKWTUAXHCMPA-ZDUSSCGKSA-N 396.346 2.962 50 40 GFGB COc1ccc(CNC(=O)C(=O)N/N=C/c2ccc(Cl)c(Cl)c2)cc1 59459573 CMJMLUFCMCARQU-UFFVCSGVSA-N 380.231 2.769 50 40 GFGB COc1ccc(-c2n[nH]cc2/C=N\NC(=O)c2ccc(OC)c(OC)c2)cc1 5634357 YFTYTPFYYJNBBN-UUYOSTAYSA-N 380.404 2.866 50 40 GFGB CCc1nc2ccccc2n1CC(=O)NNC(=O)CCC(=O)c1ccc(C)cc1 9912263 GIRXJKMUHSKELQ-UHFFFAOYSA-N 392.459 2.718 50 40 GFGB CNC(=O)C(=O)N/N=C/c1cccc(OCc2c(Cl)cccc2Cl)c1 408608079 GKHNOSXZMZUUNT-ZVBGSRNCSA-N 380.231 2.769 50 40 GFGB O=C(COc1cccc2cccnc12)N/N=C\c1ccc(N2CCOCC2)cc1 409017032 VPDDMSYHSKALGU-IWIPYMOSSA-N 390.443 2.601 50 40 GFGB O=C(CCCC[C@@H]1CCSS1)NCCn1nnc2ccccc2c1=O 238872345 NFFXMDRKJPYVGR-CYBMUJFWSA-N 378.523 2.622 50 40 GFGB CCCn1c(SCC(=O)NNC(=O)c2ccc(C)cc2)nnc1-c1ccco1 1364398 FUPIUEMCCKLXCD-UHFFFAOYSA-N 399.476 2.810 50 40 GFGB COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(SC)cc2OC)c1 2630723 SKGYSZFMBARGBR-UHFFFAOYSA-N 376.434 2.509 50 40 GFGB O=C(CNc1cccc(C(F)(F)F)c1)NNC(=S)NCc1ccccc1 4124713 YULDIELPYJPVQR-UHFFFAOYSA-N 382.411 2.813 50 40 GFGB COc1cccc(/C=N/NC(=O)COc2ccc3c(C)cc(=O)oc3c2)c1OC 1300143 JAAJVNOBBCMOSO-SSDVNMTOSA-N 396.399 2.648 50 40 GFGB Cc1ncc([N+](=O)[O-])n1CC(=O)N/N=C/c1ccc(-c2ccc(F)cc2F)o1 108041495 ZWJARBAENAGZQE-QPSGOUHRSA-N 389.318 2.788 50 40 GFGB O=C(Nc1ccccc1)Nc1ccc(C(=O)NNC(=O)c2cccnc2)cc1 27634794 CVRDUUANUPSPFC-UHFFFAOYSA-N 375.388 2.800 50 40 GFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1cncc(Br)c1 6449222 QTPTUOIDQKGWAL-UHFFFAOYSA-N 378.270 2.822 50 40 GFGB Cc1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1 7383444 ZNQKYZLLYJQPBS-OAHLLOKOSA-N 384.457 2.925 50 40 GFGB C=CCOc1ccc(/C=N\NC(=O)[C@H]2CC(=O)N(c3ccc(OC)cc3)C2)cc1 409266789 RJIXEISSBFNAOW-PGECNJAHSA-N 393.443 2.763 50 40 GFGB C/C(=N\NC(=O)c1ccc(N(C)S(C)(=O)=O)cc1)c1ccc(Cl)cc1 409137392 WXIBKIYZQCIJFO-XDHOZWIPSA-N 379.869 2.890 50 40 GFGB Cc1ccccc1N(CC(=O)N/N=C/c1ccccc1Cl)S(C)(=O)=O 19954667 IZCFUNNFTQGXAF-YBFXNURJSA-N 379.869 2.565 50 40 GFGB CCOc1cc(C(=O)NNC(=O)c2cccs2)cc(Br)c1OC 6790704 LREMMDLKOSTFNV-UHFFFAOYSA-N 399.266 2.993 50 40 GFGB COc1ccc(C(=O)NNC(=O)COc2ccc(Cl)cc2Cl)cc1OC 840339 PNVPUNTUFUYVRP-UHFFFAOYSA-N 399.230 2.851 50 40 GFGB CC1=NN(c2ccccc2)C(=O)/C1=C(/C)NNC(=O)c1ccc([N+](=O)[O-])cc1 100510005 ZEVLOVNDSPJWMC-ATVHPVEESA-N 379.376 2.526 50 40 GFGB Cn1c(SCC(=O)N/N=C/c2cccnc2)nnc1-c1ccc(Cl)cc1 2316033 IDZDAGBAUASRLX-KEBDBYFISA-N 386.868 2.773 50 40 GFGB CCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(Cl)cc2)c(OC)c1 408611993 TUKIMPUBUKARSO-SSDVNMTOSA-N 389.839 2.514 50 40 GFGB COc1ccc(C(=O)N/N=C/c2ccc(OC)c(Br)c2)c(O)c1 409393750 ZWCNKKNISZYXJG-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB C#CCOc1ccc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc1OCC 33763034 HTQXHDFFCIPOMT-STZFKDTASA-N 381.388 2.698 50 40 GFGB O=C(NN[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1=O)c1ccccc1 3671964 KRNBJSREVFVVBO-AWEZNQCLSA-N 378.215 2.560 50 40 GFGB COc1ccc(Br)cc1/C=C/C(=O)NNC(=O)c1cccs1 6646890 WDWWLDNYPGDSOF-QPJJXVBHSA-N 381.251 2.994 50 40 GFGB N#CC1=C(N)N(N2CCOCC2)C2=C(C(=O)CCC2)[C@H]1c1cccc(Cl)c1 691475 ZSGQMKQIYRYNQJ-SFHVURJKSA-N 384.867 2.687 50 40 GFGB COc1ccc(C(=O)NNC(=O)c2ccccc2Br)cc1OC 3098060 LRYNLQPFTVKDKN-UHFFFAOYSA-N 379.210 2.541 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccc2O)ccc1OC(=O)c1ccco1 3526686 JZGKEXAXWZFIPC-CIAFOILYSA-N 380.356 2.977 50 40 GFGB Cc1ccc(C)c(N2C[C@@H](C(=O)NNC(=O)c3ccccc3Cl)CC2=O)c1 408638632 CWGRLCBEARVESX-AWEZNQCLSA-N 385.851 2.771 50 40 GFGB Cc1ccccc1-n1nc(C(=O)N/N=C\c2ccc(F)cc2)c(C)c(C#N)c1=O 409062668 YSDAAVSQQDKLCO-MSXFZWOLSA-N 389.390 2.624 50 40 GFGB O=C(CN1CCOCC1)N/N=C\c1cc(C23CC4CC(CC(C4)C2)C3)ccc1O 409087818 HVUQJGMVYPUJJA-OYKKKHCWSA-N 397.519 2.642 50 40 GFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1cccc(OC)c1O)c1ccccc1 408981720 WJKKVJMJCFOFCJ-WMRWHDLOSA-N 385.420 2.728 50 40 GFGB COc1cc(Br)c(O)c(/C=N/NC(=O)c2ccc3c(c2)OCO3)c1 408587270 FCHNNLXJRIDVEN-CNHKJKLMSA-N 393.193 2.656 50 40 GFGB COC(=O)COc1ccc(/C=N/NC(=O)c2ccc(C)c(Cl)c2)cc1OC 409050821 AMGZIYJVSCNDDF-UFFVCSGVSA-N 390.823 2.973 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2sccc2C)S(C)(=O)=O)cc1Cl 20213147 HLTXXBXUNCMHDV-GIJQJNRQSA-N 399.925 2.935 50 40 GFGB N#CCC(=O)N/N=C(\CNC(=O)c1ccc(Br)cc1)c1ccccc1 18191634 QAQTWJSVCQHSCS-CJLVFECKSA-N 399.248 2.613 50 40 GFGB CCOc1cc(/C=C(/C#N)C(=O)Nc2ccc(OC)cc2)ccc1OCC(N)=O 409198965 AQPAZYHSUDQHGX-GDNBJRDFSA-N 395.415 2.504 50 40 GFGB CCCCN(CCCC)C(=O)[C@H]1[C@@H](C(=O)O)[C@H]2C[C@H]1[C@@H](Br)[C@H]2O 252444359 KCBNELBBVDYUQJ-LACSLYJWSA-N 390.318 2.506 50 40 GFGB COC(=O)/C(C#N)=C/c1ccc(OC(=O)c2ccc([N+](=O)[O-])cc2)c(OC)c1 951068 NAVIOFUTDXFBAM-NTEUORMPSA-N 382.328 2.903 50 40 GFGB COc1ccc(C(=O)N/N=C/c2cc(Br)cc([N+](=O)[O-])c2O)cc1 4753656 TXAOUIJZINPUGN-CAOOACKPSA-N 394.181 2.835 50 40 GFGB CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1ccccc1F)C(C#N)=C(N)C2(C#N)C#N 20026569 HYBBJNYCZZCGFX-YJBOKZPZSA-N 391.406 2.708 50 40 GFGB O=C(COc1ccccc1Cl)NNC(=S)NCCCc1ccccc1 408585663 HXAFRLORSRPAOM-UHFFFAOYSA-N 377.897 2.847 50 40 GFGB Cc1noc(C)c1COc1ccc(CC(=O)NNC(=O)c2cccs2)cc1 7653266 MFCIEZSTTAFPAC-UHFFFAOYSA-N 385.445 2.936 50 40 GFGB COc1cc(/C=C(\C#N)C(N)=O)ccc1OCC(=O)Nc1cc(C)ccc1C 98086989 JCJSCUAIZBTQCJ-CXUHLZMHSA-N 379.416 2.722 50 40 GFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1cc(Br)ccc1O 409267285 MZRMPKUPLJIQTD-CAOOACKPSA-N 394.181 2.835 50 40 GFGB CCOc1ccc(CC(=O)N/N=C/c2cn(CC(=O)OC)c3ccccc23)cc1 408711669 DTAAOWKKKKQOEC-YDZHTSKRSA-N 393.443 2.906 50 40 GFGB O=C(O)c1cc(C(=O)O)cc(-c2ccc(/C=N/NC(=O)c3ccncc3)o2)c1 409004637 AYFPAILGGFWKSH-UFFVCSGVSA-N 379.328 2.502 50 40 GFGB CC(C)NC(=O)/C(C#N)=C\c1ccc(OCC#N)c(I)c1 408773305 QOGOXXRNRVNYPW-GHXNOFRVSA-N 395.200 2.625 50 40 GFGB CC1=C(C)C[C@@H](C(=O)NNC(=O)[C@H](C)Oc2ccc(C)c(C)c2)[C@@H](C(=O)O)C1 6033408 YDGQPLKUDJGWBS-JQHSSLGASA-N 388.464 2.665 50 40 GFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1)c1ccc(Cl)cc1 7882223 IDVFHCVMSARBJH-GFCCVEGCSA-N 392.242 2.808 50 40 GFGB Cc1ccc(C)c(OCC(=O)N/N=C2\CCS(=O)(=O)c3ccc(F)cc32)c1 21188063 VDNWGKLLWOIYBY-LTGZKZEYSA-N 390.436 2.519 50 40 GFGB COc1cccc(N2C(=O)[C@@H](Cc3cccc(C)c3)S/C2=C(/C#N)C(N)=O)c1 5070832 SWOLUEXKDORTIP-QUWSGOTNSA-N 393.468 2.915 50 40 GFGB Cc1ccc(C(=O)NNC(=O)COc2ccc(Br)cc2C)cc1 4568517 FGRSUQOUUBVHIF-UHFFFAOYSA-N 377.238 2.906 50 40 GFGB CCc1ccc(N2C[C@H](C(=O)N/N=C\c3cccc(OC)c3OC)CC2=O)cc1 409152353 FASLWFNJZIDCFH-SUVVMJBMSA-N 395.459 2.769 50 40 GFGB O=C(COc1cccc(Br)c1)N/N=C/c1ccc([N+](=O)[O-])s1 969255 LXEIAFZWBWPXCG-VIZOYTHASA-N 384.211 2.948 50 40 GFGB O=C(NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccs1)c1cccs1 6508935 AZVJJPYVOOQUCY-AWEZNQCLSA-N 399.497 2.612 50 40 GFGB C=CCN1C(=O)/C(=N/NC(=O)c2ccccn2)c2cc(Br)ccc21 13617535 NVKGFKJIKUVJFW-HMMYKYKNSA-N 385.221 2.511 50 40 GFGB CCOc1ccc(/C=N/NC(=O)C(=O)Nc2cc(Cl)ccc2OC)cc1 13922473 MQFKAEXCVVWAAS-RGVLZGJSSA-N 375.812 2.836 50 40 GFGB COc1cc(/C=N/NC(=O)C[n+]2ccccc2)ccc1OCc1ccccc1 2705159 BMKNOHWCIGPIIA-HZHRSRAPSA-O 376.436 2.712 50 40 GFGB CCn1cc(Cl)c(C(=O)N/N=C(/C)c2c(Br)cnn2CC)n1 6636162 JTMXRDPVYVTOIG-IUXPMGMMSA-N 387.669 2.689 50 40 GFGB Cc1cc(C)cc(CSCC(=O)N/N=C/c2ccc(OCC(N)=O)cc2)c1 28213654 ICYXFYUNZJPUMB-LSHDLFTRSA-N 385.489 2.551 50 40 GFGB CCOC(=O)Cn1cc(/C=N/NC(=O)c2ccc(OC)cc2O)c2ccccc21 409391171 HOAVHDLQCICXRT-SSDVNMTOSA-N 395.415 2.683 50 40 GFGB CCc1ccc(N2C[C@@H](C(=O)N/N=C\c3ccc(OC)cc3OC)CC2=O)cc1 409154660 HDYQJYSOLOPOPT-ICODJCHTSA-N 395.459 2.769 50 40 GFGB CCOc1ccc(/C(C)=N/NC(=O)Cc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] 409149839 SBYJEHZBDXDMQP-UDWIEESQSA-N 385.376 2.805 50 40 GFGB COc1cc(/C=N/NC(=O)COc2ccc(Cl)c(C)c2)cc([N+](=O)[O-])c1O 35655048 MIJRWHANKOFTLK-UFWORHAWSA-N 393.783 2.800 50 40 GFGB N#C/C(=C\c1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(S(N)(=O)=O)cc1 778304 AHVKZAPYKWPPSQ-XYOKQWHBSA-N 395.362 2.898 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2ccccc2I)cc1 5526929 CPGOOPUCOIVMLW-WOJGMQOQSA-N 394.212 2.993 50 40 GFGB CCOC(=O)NNC(=O)c1cn(-c2ccccc2)nc1-c1ccc(OC)cc1 14795060 SRKKFFHTSIZJKJ-UHFFFAOYSA-N 380.404 2.939 50 40 GFGB Cc1ccc(NC(=O)NNC(=O)c2cccn(Cc3cccc(F)c3)c2=O)cc1 23136121 MJKICQHRYBIZLH-UHFFFAOYSA-N 394.406 2.811 50 40 GFGB Cc1ccc2nc(NC(=O)C(=O)NNC(=O)c3ccc(Cl)cc3)sc2c1 2447241 OHJBTRQAWVILKT-UHFFFAOYSA-N 388.836 2.658 50 40 GFGB CCN(CC)C(=O)[C@H](N)Cc1ccc(OC)c(N(CCCl)CCCl)c1 1714224 KTMGOKIBEXZNAD-OAHLLOKOSA-N 390.355 2.717 50 40 GFGB CCCCN1C(=O)[C@@]2(C(C#N)=C(N)Oc3[nH]nc(CCC)c32)c2ccccc21 8567996 SPCHUWNZRRYICF-OAQYLSRUSA-N 377.448 2.881 50 40 GFGB CCOc1ccc(NC(=O)CCC(=O)NNC(=O)Cc2ccccc2C)cc1 14562471 FAPZSVHSAVWWJL-UHFFFAOYSA-N 383.448 2.503 50 40 GFGB Cc1cccc(NCC(=O)N/N=C/c2ccc(I)o2)c1 4746717 RWPUHCIOIVZAIY-CAOOACKPSA-N 383.189 2.755 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)NC)ccc1OCc1ccccc1Cl 409000440 YGIYZNZJRRWHPX-SSDVNMTOSA-N 389.839 2.514 50 40 GFGB CCn1c(SCC(=O)N/N=C/c2cccc(O)c2)nnc1-c1ccccc1 863928 BAVZUFQBCAYJDP-UDWIEESQSA-N 381.461 2.913 50 40 GFGB CC(=O)N[C@@H](CC(=O)NNC(=O)c1ccc(OC(C)C)cc1)c1ccc(C)cc1 22901536 CIDMESJZRAYYGR-FQEVSTJZSA-N 397.475 2.811 50 40 GFGB O=C(N/N=C/c1sc(N2CCOCC2)nc1-c1ccccc1)c1ccccn1 3246387 ZPPLRYAUULKPNT-HYARGMPZSA-N 393.472 2.806 50 40 GFGB CC(C)(C)c1ccc(C(=O)NCC(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 4673329 MZSZECWIKSLXKX-FOKLQQMPSA-N 381.432 2.593 50 40 GFGB Cc1ccc(NCC(=O)N/N=C2/C(=O)Nc3ccc(Br)cc32)cc1 5696103 GTMQHTSKNWEDBI-UHFFFAOYSA-N 387.237 2.642 50 40 GFGB CNC(=O)C(=O)N/N=C/c1ccc(OCc2c(Cl)cccc2Cl)cc1 408607410 CQCOZMPIGHVKSF-ZVBGSRNCSA-N 380.231 2.769 50 40 GFGB ClC[Sn](c1ccccc1)(c1ccccc1)c1ccccc1 195778099 UFBWJWPCHIDYMK-UHFFFAOYSA-N 399.509 2.935 50 40 GFGB Cc1cccc(OCC(=O)NCC(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1 2121974 RAZRWBNRVSHFQA-WYMPLXKRSA-N 397.475 2.675 50 40 GFGB Cc1ncc(CO)c(/C=N/NC(=O)CSc2cc(C)c3ccccc3n2)c1O 6719182 AFTBNBBCXVPFMW-LSFURLLWSA-N 396.472 2.687 50 40 GFGB CO[C@H](C(=O)N/N=C/c1ccc(OCC(=O)NC(C)(C)C)cc1)c1ccccc1 408993084 CDHGHYOVCLIRGT-BTVXTAIASA-N 397.475 2.818 50 40 GFGB Cc1ccc(C)c(NC(=O)C(=O)N/N=C/c2cc(Br)ccc2O)c1 3127148 OLSCTRNKNJZYRY-DJKKODMXSA-N 390.237 2.860 50 40 GFGB COc1cc(C(=O)NNC(=O)COc2c(C)cccc2C)ccc1OC(C)C 8411748 JAQVWHFAZQRTMU-UHFFFAOYSA-N 386.448 2.939 50 40 GFGB COC(=O)c1ccc(/C=N/NC(=O)C(=O)Nc2ccc3ccccc3c2)cc1 3082739 JOHSHSBFHSWMCC-LPYMAVHISA-N 375.384 2.715 50 40 GFGB O=C(CN1CCOCC1)N/N=C/c1ccc(OCc2ccccc2Cl)cc1 59437053 AQWSFTSQXHPHOK-LPYMAVHISA-N 387.867 2.701 50 40 GFGB Cc1ccc(N2C(=O)C[C@@H](NNC(=O)c3cccc(Cl)c3)C2=O)cc1Cl 70461117 VXXNZVMHUDIHKM-OAHLLOKOSA-N 392.242 2.868 50 40 GFGB CCNC(=S)NNC(=O)c1ccc(COc2cccc3cccnc23)cc1 7779187 DOJMOHYZWLRXRE-UHFFFAOYSA-N 380.473 2.943 50 40 GFGB Cc1cccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCc3cccnc3)c2C)c1 408971279 FFGHDQVOXWSWLM-AFUMVMLFSA-N 389.459 2.564 50 40 GFGB O=C(NNS(=O)(=O)c1cccnc1Oc1ccc(F)cc1)C1CCCC1 585138486 VRZYRGBEFDRPPS-UHFFFAOYSA-N 379.413 2.513 50 40 GFGB COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(N3CCOCC3)cc2)cc1 2632651 BNXBQKIFWFFCBW-NBVRZTHBSA-N 391.427 2.855 50 40 GFGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2cc(OCC)ccc2[nH]c1=O 876624 REPBOZNFHNUZHB-GOSISDBHSA-N 395.415 2.572 50 40 GFGB C[C@@H](c1ccccc1)N1C[C@H](C(=O)NNC(=O)c2ccc(Cl)cc2)CC1=O 7882071 HTHOYYIZTMZUGO-XJKSGUPXSA-N 385.851 2.711 50 40 GFGB COc1ccc(C(O)(C(=O)NNC2CCCCC2)c2ccc(OC)cc2)cc1 2303488 MFYYSJDOVQZLIX-UHFFFAOYSA-N 384.476 2.893 50 40 GFGB O=C(NNS(=O)(=O)c1cc(F)cc(F)c1)c1cc2c(s1)CCCCC2 12856788 DGPISMVSZFCMAX-UHFFFAOYSA-N 386.445 2.919 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OC)cc1OC 408907074 LNFKEGXNZKIDIA-OVBDPADQSA-N 399.447 2.511 50 40 GFGB N#C/C(=C\c1ccc2c(c1)OCO2)C(=O)OCC(=O)NCc1ccccc1Cl 3238646 SGGRPROMHKVLAQ-VIZOYTHASA-N 398.802 2.835 50 40 GFGB CC(C)c1ccc(C(=O)NNC(=O)c2ccc3c(=O)n4c(nc3c2)CCC4)cc1 6981959 MJAVYPYLABXXGK-UHFFFAOYSA-N 390.443 2.541 50 40 GFGB N#Cc1ccc(/C=N/NC(=O)c2ccc(I)cc2)cc1 10118455 BTFDIVMNDRAJHA-VCHYOVAHSA-N 375.169 2.927 50 40 GFGB O=C(CN(Cc1ccco1)S(=O)(=O)c1ccccc1)N/N=C/c1ccccc1 59435379 LUAJDSWUPWPHQR-KGENOOAVSA-N 397.456 2.621 50 40 GFGB Cc1ccc(CC(=O)N/N=C/c2cn(CCC(N)=O)c3ccccc23)c(C)c1 20194545 DROGTIWUKFRIAP-ZMOGYAJESA-N 376.460 2.826 50 40 GFGB CCC(=O)N1CCc2cc(C(=O)NNC(=O)c3ccc4ccccc4n3)ccc21 40142824 KBMVQNAFOMBAJO-UHFFFAOYSA-N 388.427 2.609 50 40 GFGB C[C@@H]1CCc2c(C(=O)NNC(=O)[C@H]3[C@@H]4C=C[C@@H](CC4)[C@@H]3C(=O)O)csc2C1 225659237 IUKBUXKYOYNLOF-FRDNIWNGSA-N 388.489 2.547 50 40 GFGB C/C(N)=C(/C#N)C(=O)CSc1nnc(-c2ccncc2)n1Cc1ccccc1 5982322 KPIQXALRHMGTLD-SAPNQHFASA-N 390.472 2.806 50 40 GFGB Cc1noc(C)c1CSc1ncccc1C(=O)NNC(=O)c1ccccc1O 12741800 VBYPJGOARJTKII-UHFFFAOYSA-N 398.444 2.759 50 40 GFGB COc1ccc(C)cc1NC(=O)[C@H](NNC(=O)c1cccn1C)c1ccccc1 32814701 CEKRIBUBRGSEAY-HXUWFJFHSA-N 392.459 2.957 50 40 GFGB Cn1cnnc1SCc1ccc(C(=O)NNC(=O)C[C@H]2C[C@H]3CC[C@H]2C3)cc1 103941834 RMKSKUWJHIEUFY-BHYGNILZSA-N 399.520 2.695 50 40 GFGB O=C(N/N=C/c1ccc(F)cc1F)c1cccc(S(=O)(=O)N2CCCC2)c1 3470167 WBXMAIBKJYGFNE-CIAFOILYSA-N 393.415 2.513 50 40 GFGB COCCNC(=O)/C(C#N)=C/c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1 408816029 SHRBEZDHZAUZDX-FOWTUZBSSA-N 397.406 2.513 50 40 GFGB CC(C)OC(=O)COc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1 409188472 ZNZOMAPBYORNCZ-RGVLZGJSSA-N 385.376 2.689 50 40 GFGB COC(=O)c1ccccc1-c1ccc(/C=N/NC(=O)[C@H](O)c2ccccc2)o1 1102822 PMRJPZYGPQLUKZ-PPRFWAEMSA-N 378.384 2.917 50 40 GFGB CCOc1cccc(/C=N/NC(=O)COc2c(C)cc([N+](=O)[O-])cc2C)c1O 903991 RTCLJBIHWJPFRG-KEBDBYFISA-N 387.392 2.845 50 40 GFGB N#C/C(=C\c1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(C(=O)O)cc1 6209965 FWAGZDAQNDPKKX-GHRIWEEISA-N 377.400 2.767 50 40 GFGB CCOc1ccc(NC(=O)CCC(=O)N/N=C/c2cccc(OC)c2O)cc1 2393832 GIRPJUFDYAKUIV-FYJGNVAPSA-N 385.420 2.669 50 40 GFGB O=C(N/N=C/c1ccncc1)c1ccc(NS(=O)(=O)c2cccs2)cc1 6146871 YNCYYSHFLXMWCX-XDHOZWIPSA-N 386.458 2.708 50 40 GFGB Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(OCc3ccccc3)cc2)n1 6649131 CHZAFSFVJHDGHM-UHFFFAOYSA-N 378.432 2.540 50 40 GFGB Cc1ccc(C)c(N2N=C(C(=O)NNc3oc(C(C)C)nc3C#N)CCC2=O)c1 69981869 WIJGJNAMWGJSMG-UHFFFAOYSA-N 394.435 2.913 50 40 GFGB CC(=O)N[C@H](CC(=O)NNC(=O)c1cc2ccccc2cc1O)c1ccccc1 12813418 ZDKDHEOCTHVKEN-LJQANCHMSA-N 391.427 2.574 50 40 GFGB COc1ccc(O)c(/C=N/NC(=O)CNc2cccc(Br)c2)c1 1434493 MZQCPHKDRTVZDQ-DJKKODMXSA-N 378.226 2.726 50 40 GFGB O=C(NNC(=O)c1nc(NCCc2ccccc2)ncc1Cl)c1ccccc1 40128297 XAJQAIRQOHKORZ-UHFFFAOYSA-N 395.850 2.859 50 40 GFGB CCN(CC)c1ccc(C(=O)NNC(=O)Nc2cccc(C(=O)OC)c2)cc1 12590028 NYVLAUHQCADJJX-UHFFFAOYSA-N 384.436 2.786 50 40 GFGB CN(C)c1ccc(/C=N/NC(=O)c2cncn2-c2ccc(F)cc2)cc1[N+](=O)[O-] 40161342 HOBBAJAAUADRDS-LSHDLFTRSA-N 396.382 2.750 50 40 GFGB C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1c[nH]nc1-c1ccc(F)cc1 10099049 WZCUJTPUUSPUTQ-LLVKDONJSA-N 386.358 2.583 50 40 GFGB Cc1cc(C)c2c3c(c(=O)oc2c1)[C@@]1(C(=O)Nc2ccccc21)C(C#N)=C(N)O3 104766201 HGWCWSWKYMAZHO-QFIPXVFZSA-N 385.379 2.734 50 40 GFGB CCOC(=O)N/N=C/c1ccc(OS(=O)(=O)c2ccc(C)cc2)c(OC)c1 3402099 IEOAHUZSSBFRIK-XDHOZWIPSA-N 392.433 2.851 50 40 GFGB Cc1nn(-c2ccccc2)c(C)c1/C=C(\C#N)C(=O)OCC(=O)NC1CCCC1 6946112 ZDFZNFFFYAPJSH-SFQUDFHCSA-N 392.459 2.998 50 40 GFGB COC(=O)[C@@H]1CCC[C@@H](C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)C1 106921584 AQSMJEVAVKJJIH-JHJVBQTASA-N 378.494 2.613 50 40 GFGB O=C(COc1ccc(/C=N/NC(=O)c2ccncc2)cc1)NC1CCCCC1 28214932 AVGVTFXHSRHJGO-OEAKJJBVSA-N 380.448 2.673 50 40 GFGB Cc1cc(C)n(CCC(=O)NNC(=S)Nc2ccc(Br)cc2)n1 5613321 GNWUNHBFPXCPDJ-UHFFFAOYSA-N 396.314 2.670 50 40 GFGB CCOc1cc2c(cc1/C=N\NC(=O)COc1cccc3cccnc13)OCO2 409022190 ICPKOAJXLAPXFU-KSEXSDGBSA-N 393.399 2.891 50 40 GFGB COc1ccc(OC)c([C@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)c1 96563339 VCLPZCRLCHHVBD-KRWDZBQOSA-N 388.379 2.845 50 40 GFGB COCC1=C(C#N)[C@H](SS[C@H]2NC(C)=CC(COC)=C2C#N)NC(C)=C1 15133830 XCWSRBBDKFQLEX-HDICACEKSA-N 390.534 2.967 50 40 GFGB COc1ccc(/C=N\NC(=O)c2ccc(C)nc2)cc1I 30802958 AVYMGWQWWCSFPF-LSCVHKIXSA-N 395.200 2.767 50 40 GFGB COc1ccc(C(=O)NC(=S)NNC(=O)c2ccc(Cl)cc2)cc1Cl 6457866 RJAWNOOIECXIAU-UHFFFAOYSA-N 398.271 2.951 50 40 GFGB CC(C)(C)c1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1 408614792 ICWSIXXOBBAZAO-HNNXBMFYSA-N 397.450 2.937 50 40 GFGB O=C(Cc1csc(-c2ccc(F)cc2)n1)NNS(=O)(=O)c1ccccc1 8754205 AHTHMNWYPXOILO-UHFFFAOYSA-N 391.449 2.501 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccc2)ccc1OCC(N)=O 4616251 PVXXPFWSPSTDTD-LZNAANCOSA-N 393.443 2.734 50 40 GFGB COc1ccccc1NC(=O)N/N=C\c1cccc(OC)c1O[C@H](C)C(=O)O 409229443 PAABVGBQYHPJEC-WXYNYTDUSA-N 387.392 2.711 50 40 GFGB O=C(CCCC[C@@H]1CCSS1)NCCn1c(=O)c(=O)[nH]c2ccccc21 79495620 LJSIRYBWAMTTSH-CYBMUJFWSA-N 393.534 2.520 50 40 GFGB COc1cc(OC)cc(C(=O)N/N=C\c2cc([N+](=O)[O-])ccc2N2CCCC2)c1 33767973 NBNFIXDQXHERJK-BKUYFWCQSA-N 398.419 2.976 50 40 GFGB Cc1ccc(COc2ccc(C(=O)NN)cc2I)cc1 216820721 QZNJEYVDNXTJHV-UHFFFAOYSA-N 382.201 2.782 50 40 GFGB CC(C)n1c(SCC(=O)NNC(=O)c2ccccc2)nc2ccccc2c1=O 3567008 CNHSAAMADUFFMR-UHFFFAOYSA-N 396.472 2.531 50 40 GFGB O=C(NNS(=O)(=O)c1cc(Cl)c(Cl)cc1Cl)c1cccnc1 1048276 UOUGNILDAKXQCQ-UHFFFAOYSA-N 380.640 2.665 50 40 GFGB Cc1c(C(=O)NNC(=O)c2ccc3c(c2)OCO3)cnn1-c1ccc(Cl)cc1 13011638 PURGMBDUZOIHCK-UHFFFAOYSA-N 398.806 2.638 50 40 GFGB O=C(N/N=C/c1ccn(CC(F)(F)F)n1)c1cc(-c2ccc(O)cc2)on1 252505082 VNYCTXOTQQFTBE-DNTJNYDQSA-N 379.298 2.570 50 40 GFGB O=C(NNC(=O)[C@H]1[C@H]2CC[C@H](C2)[C@@H]1C(=O)O)c1ccc(OC2CCCC2)cc1 17078831 OZLPYWOSLSDFOH-DACLVMHWSA-N 386.448 2.516 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)c2ccc(CN3CCOCC3)cc2)cc1 20161127 AFRFEPGWDOMZKU-XQNSMLJCSA-N 379.460 2.848 50 40 GFGB CC(C)(C)c1ccc2c(c1)O[C@@H](C(=O)N/N=C\c1ccc(C(=O)O)cc1)CO2 31853576 MNLSWXXIUIOFKC-DSDJNCIMSA-N 382.416 2.972 50 40 GFGB Cc1csc(CC(=O)NNC(=O)CN(C)Cc2ccc(C(C)(C)C)cc2)n1 21671454 MHKCNXZIXNUMQF-UHFFFAOYSA-N 388.537 2.571 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)NCc2ccc(C(C)C)cc2)cc1OC 7785466 IFFRRLIQCLCNFH-YDZHTSKRSA-N 383.448 2.594 50 40 GFGB C/C(N)=C(\C#N)C(=O)COC(=O)/C=C/c1c(C)nn(Cc2ccccc2)c1Cl 104877637 DBUJRRKKKQTUEX-JFDDMYJUSA-N 398.850 2.775 50 40 GFGB CN1[C@H]2C=C3C(C#N)=C(N)C(C#N)(C#N)[C@@H](c4c(F)cccc4F)[C@H]3[C@H]1CC2 103610851 JBPGDEKLKIFDTA-ZSDNKIRRSA-N 377.398 2.851 50 40 GFGB O=C(CNc1ccc2c(c1)OCO2)N/N=C/c1ccc(Br)cc1 408725711 IYGRAHJPECFHSV-UFWORHAWSA-N 376.210 2.740 50 40 GFGB Cc1c(C(=O)N/N=C/c2ccc(Br)o2)sc2ncnc(N)c12 408972496 CXHYIMKXIJUIMB-JJPRUIFNSA-N 380.227 2.701 50 40 GFGB CCOC(=O)C1=C(CCl)NC(=O)N[C@@H]1c1ccc(F)c(Br)c1 57509018 HDEYYMPMKLQVFY-GFCCVEGCSA-N 391.624 2.998 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C/c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 59297249 LKNPVRRFMHOWAD-MKMNVTDBSA-N 381.344 2.555 50 40 GFGB O=C(N/N=C\c1ccc(Br)c([N+](=O)[O-])c1)c1ccc2c(c1)OCO2 28616294 PNLOSPQTOKXOQJ-IDUWFGFVSA-N 392.165 2.850 50 40 GFGB CC(C)(C)OC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccoc3)[C@H]2C1 4149682 XKGMYZMREOPCPI-IRXDYDNUSA-N 391.431 2.940 50 40 GFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)COc1ccc(C)c(C)c1 1445350 ZZNRFXHLRFUDAO-KEBDBYFISA-N 387.392 2.758 50 40 GFGB CCCC1CC(=O)C(=CNNC(=O)c2ccc(Br)cc2)C(=O)C1 7260897 JNWXXCNJBPDXIR-UHFFFAOYSA-N 379.254 2.916 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)c2cccc(Br)c2)c(C)c1 5744761 VRGIDCXVEVCPTO-UHFFFAOYSA-N 377.238 2.906 50 40 GFGB COc1cc(/C=N/NC(N)=O)cc(Br)c1OC(=O)c1ccccc1 13747406 KFTWXKLIQIXKLZ-DJKKODMXSA-N 392.209 2.679 50 40 GFGB Cc1nc(Cl)c(C[C@@H](Br)CBr)c(NCCO)n1 2254733 CSTQNFUDUSOIRH-SSDOTTSWSA-N 387.503 2.544 50 40 GFGB Cc1cc(C)c(S(=O)(=O)N(C)CC(=O)N/N=C/c2cccc(F)c2)c(C)c1 6606991 VWZMJMYUJNZBOC-SRZZPIQSSA-N 391.468 2.522 50 40 GFGB C[C@@H]1C[C@H]1c1ccc(CCC(=O)NNC(=O)c2cc(Br)c[nH]2)o1 53175968 HTJJRYBKADKIED-BXKDBHETSA-N 380.242 2.887 50 40 GFGB Cc1cccc(C(=O)NNC(=O)c2cccc(I)c2)c1 1060166 NSMOPDWXRPSFOC-UHFFFAOYSA-N 380.185 2.674 50 40 GFGB Cc1ccccc1N1C(=O)c2ccc(C(=O)NNC(=O)c3ccccc3)cc2C1=O 14824948 QAFHEWOFHXIJJY-UHFFFAOYSA-N 399.406 2.870 50 40 GFGB COc1cccc(/C=N/NC(=O)CNc2ccc(C)c(C)c2)c1O[C@H](C)C(=O)O 409238255 CZIKHRBEBKYWHC-QHBIDGPYSA-N 399.447 2.726 50 40 GFGB N#C/C(=C\c1ccc(OS(=O)(=O)c2ccc3ccccc3c2)cc1)C(N)=O 408765759 NRZVKVDEZUXFCU-GZTJUZNOSA-N 378.409 3.000 50 40 GFGB C#CCOc1ccc(/C=N/NC(=O)c2cc(OC)cc(OC)c2)cc1OCC 33664628 NFJVOHJSBANPBN-HYARGMPZSA-N 382.416 2.878 50 40 GFGB Cc1cc(C)nc(NNC(=O)NCc2ccc(CN3C[C@H](C)O[C@@H](C)C3)cc2)n1 45786330 GGIOWFZQWYCOAC-IRXDYDNUSA-N 398.511 2.529 50 40 GFGB CCOC(=O)COc1ccccc1/C=C(/C#N)C(=O)Nc1cccc(C(=O)O)c1 6154510 JGQVFOLZKQRGGB-YBEGLDIGSA-N 394.383 2.872 50 40 GFGB CCOc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)N3CCCC3)c2C)cc1 58912453 KENIFGXYJOAHEW-HYARGMPZSA-N 382.464 2.565 50 40 GFGB Cc1cc(I)cc(/C=N/NC(=O)Cc2ccccc2)c1O 4702555 YFVOGJSZLKRXFV-VCHYOVAHSA-N 394.212 2.998 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)NCc2ccc(C(C)C)cc2)ccc1O 409252627 UGYVNFBTGIVDDZ-YDZHTSKRSA-N 383.448 2.681 50 40 GFGB O=C(O)c1cccc(-c2ccc(/C=N/NC(=O)c3ccc([N+](=O)[O-])cn3)o2)c1 1759806 JBNCXCFLLLZPIV-KEBDBYFISA-N 380.316 2.712 50 40 GFGB C=CCSCC(=O)Oc1ccc(/C=N\NC(=O)c2ccncc2)cc1OC 33735551 FTANUDRWAOHIHO-MTJSOVHGSA-N 385.445 2.679 50 40 GFGB Cc1n[nH]c2c1[C@H](c1cccc(I)c1)C(C#N)=C(N)O2 704429 CNDATPKHSNFUQD-GFCCVEGCSA-N 378.173 2.541 50 40 GFGB N#C/C(=C/c1ccc(Oc2nc(Cl)ncc2F)cc1)C(=O)N1CCOCC1 3771772 ROISTVNYQAYZQY-LCYFTJDESA-N 388.786 2.827 50 40 GFGB CCCC[C@@H](C[C@H](O)COCCC)C(=O)NNC(=S)Nc1ccccc1 4793991 UDLQODXYXADENG-RDJZCZTQSA-N 381.542 2.988 50 40 GFGB Cc1nn(-c2ccccc2)c(O)c1/C(=N/NC(=O)c1cccnc1)C(F)(F)F 5488115 JEEQCVGMDBLPIW-HAHDFKILSA-N 389.337 2.978 50 40 GFGB COc1cc(C(=O)N/N=C/c2ccc(O)cc2)ccc1I 408747821 UGMIDFXVVRJTGX-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB O=C(COCC(=O)N/N=C\C=C/c1ccccc1)N/N=C\C=C/c1ccccc1 17024696 WABIMDOQELJJMK-XFCGXQGLSA-N 390.443 2.634 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(F)cc3)[C@H]2C1 4452853 IKNJFPNMQLFUEI-ROUUACIJSA-N 391.406 2.708 50 40 GFGB O=C(N/N=C1\C(=O)N(CN2CCCC2)c2ccccc21)c1ccc2ccccc2n1 2396647 MZBNGWRBFRUPIJ-DAFNUICNSA-N 399.454 2.769 50 40 GFGB Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O 13255498 IJOFUJDKSGANEQ-YUELXQCFSA-N 394.855 2.539 50 40 GFGB COc1ccccc1NC(=O)[C@H](C)SC1=C(C#N)C(C)(C)[C@H](C#N)C(=O)N1 7252356 VDEAEJBZEGNKAM-NWDGAFQWSA-N 384.461 2.786 50 40 GFGB O=C(N/N=C/c1ccccc1)[C@@H]1CC(=O)N(c2ccc(Br)cc2)C1 409153858 IWNIMSGWALVHHP-XLTHYULKSA-N 386.249 2.952 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])c(O)cc1O)c1cccc(Br)c1 35240392 WTFQANSOEFQYDT-FRKPEAEDSA-N 380.154 2.532 50 40 GFGB CCCN(CCC)CN1C(=O)/C(=N\NC(=O)c2cccnc2)c2ccccc21 19882724 NKOWCVYBMKYJMB-NMWGTECJSA-N 379.464 2.642 50 40 GFGB COc1cccc(/C=N/NC(=O)C(=O)Nc2cccc(Br)c2)c1 3067275 NEPWRFBAZVNDSQ-VCHYOVAHSA-N 376.210 2.547 50 40 GFGB COc1ccc(C(=O)NNC(=O)Cn2c(C(F)(F)F)nc3ccccc32)cc1 5178514 BQVXSBVSVSLYPD-UHFFFAOYSA-N 392.337 2.525 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2cccc(OC3CSC3)c2)cc1OC 4616589 FYSQXOZJRMFSDH-SRZZPIQSSA-N 386.473 2.891 50 40 GFGB C=CCNc1nc(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)cs1 6996946 KZGAJZFEIWAVJF-UHFFFAOYSA-N 381.417 2.740 50 40 GFGB O=C(NCCSc1ccc(Br)cc1)NNC(=O)c1cccnc1 10275862 SSXGJBYGBFCKQZ-UHFFFAOYSA-N 395.282 2.580 50 40 GFGB CC1(C)[C@H]2CC[C@]1(C)/C(=N/NC(=O)Cn1cc(Br)ccc1=O)C2 49890508 SRILXCFODCURSQ-UCORRZAPSA-N 380.286 2.929 50 40 GFGB Cc1cc(/C=N/NC(=O)C(=O)NCc2ccccc2)c(C)n1-c1ccc(F)cc1 408970180 CERSVYAGQXALSH-AFUMVMLFSA-N 392.434 3.000 50 40 GFGB CCOc1ncccc1C(=O)NNC(=O)CSc1nc2ccccc2s1 5938347 VVSYKISDDJSEAS-UHFFFAOYSA-N 388.474 2.643 50 40 GFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)c1ccccc1 408979804 OOZDOOBSEFAQMZ-UOBPLZBXSA-N 384.392 2.922 50 40 GFGB I[C@@H]1[C@@H]2[C@@H]3[C@@H]4[C@H]5C[C@H]3[C@@H]1[C@@H]5[C@H]2[C@@H]4I 261361227 NMQHCEGZBHEZIR-FOOPBILSSA-N 398.025 2.981 50 40 GFGB CC(=O)Nc1ccc(C(=O)NN2C(=O)[C@@H](Cl)[C@H]2/C=C/c2ccccc2)cc1 5663486 VJBMUESHSPZPMA-JVGUAYRASA-N 383.835 2.821 50 40 GFGB O=C(NNC(=S)NC(=O)c1ccc(-c2ccccc2)cc1)c1ccncc1 8381664 KTSUPNIYSUFVJF-UHFFFAOYSA-N 376.441 2.698 50 40 GFGB CCOC(=O)c1cccc(-c2ccc(/C=N/NC(=O)CC3(C)OCCO3)o2)c1 1086328 JJDBBKBVXKRGIS-FYJGNVAPSA-N 386.404 2.727 50 40 GFGB O=C(NNS(=O)(=O)c1ccc(Cl)cc1)c1cc(-c2ccccc2)on1 14141707 ZZZCTGLFDUQRBN-UHFFFAOYSA-N 377.809 2.618 50 40 GFGB CC(C)(C)c1ccc2c(c1)O[C@H](C(=O)N/N=C\c1ccc(O)c([N+](=O)[O-])c1)CO2 30702427 YWCZBTOYUSTUHS-OIQMFWTRSA-N 399.403 2.888 50 40 GFGB N#CC1=C(N)N(c2ccc(F)cc2)C2=C([C@@H]1c1ccc(O)cc1)S(=O)(=O)CC2 1429885 XEKBBHLTGFJQJJ-GOSISDBHSA-N 397.431 2.859 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)NC2CC2)ccc1OCc1ccc(F)cc1 408610631 OPYSVQVADVTZGT-FSJBWODESA-N 399.422 2.532 50 40 GFGB C[C@@H](Oc1ccc(/C=N\NC(=O)COc2ccccc2Cl)cc1)C(=O)O 33935556 OXCDATFCOXSYJC-SVKBEJCWSA-N 376.796 2.721 50 40 GFGB COc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)c(OC)c1 96563338 XPMKVRCFMACIMG-KRWDZBQOSA-N 388.379 2.845 50 40 GFGB O=C1Nc2c(Br)cc(Cl)cc2/C1=N/NC(=O)c1ccncc1 13583873 BQUMLGVXNHFVRL-UHFFFAOYSA-N 379.601 2.584 50 40 GFGB O=C(N/N=C/c1ccc(OC(=O)c2ccco2)c([N+](=O)[O-])c1)c1ccncc1 1440657 VUXZGSZOGIYYDH-RGVLZGJSSA-N 380.316 2.566 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(Cl)cc2C)c(OC)c1 3060064 LXFIKXVKCBMBTB-KEBDBYFISA-N 375.812 2.754 50 40 GFGB C=CCNC(=S)NNC(=O)c1ccc(CSc2nc(C)cc(C)n2)cc1 3242186 QBMNXLQXCJIOME-UHFFFAOYSA-N 387.534 2.681 50 40 GFGB COc1ccc(-c2n[nH]cc2/C=C(/C#N)C(=O)NCc2ccco2)cc1OC 17077345 HAYRQOLBKFXRKZ-ZSOIEALJSA-N 378.388 2.910 50 40 GFGB CCOc1ccc(/C=N/NC(=O)c2cccnc2)cc1I 408905447 YPUBRTDOMQXOKO-GIJQJNRQSA-N 395.200 2.849 50 40 GFGB NC(=O)CCn1cc(/C=N/NC(=O)Cc2ccc(Cl)cc2)c2ccccc21 409368520 ABGGWQVWNDJNOO-FSJBWODESA-N 382.851 2.863 50 40 GFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1ccc(O)c(Br)c1 408567677 PHADXUXNZMRORT-CAOOACKPSA-N 394.181 2.835 50 40 GFGB COc1cccc(CC(=O)N/N=C\c2ccc(OCC(=O)O)c(Cl)c2)c1 408855523 NSLSMWJEBPYXHR-JMIUGGIZSA-N 376.796 2.505 50 40 GFGB COCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2ccc3c(c2)OCO3)c1C 5959698 LBKXBBGXJWOPBA-VCHYOVAHSA-N 381.432 2.703 50 40 GFGB O=C(NNC(=O)c1ccccc1F)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1 16839300 XKPHYFBQFOWHNO-UHFFFAOYSA-N 399.809 2.764 50 40 GFGB CN1c2ccccc2C2=C([C@@H](c3cccc(F)c3)C(C#N)=C(N)O2)S1(=O)=O 20558305 PDLRMILIMGGOJT-INIZCTEOSA-N 383.404 2.782 50 40 GFGB Cc1nnc(NC(=O)CCC(=O)O[C@@H](CCl)C(=O)c2ccccc2)s1 8474450 IZQJLUZPJRLQMK-LBPRGKRZSA-N 381.841 2.599 50 40 GFGB N#C/C(C(N)=O)=C1/S[C@@H](Cc2cccc([N+](=O)[O-])c2)C(=O)N1c1ccccc1 2195973 NHXJZDNNJZFJMI-JQSQVVPISA-N 394.412 2.506 50 40 GFGB CC(C)(C)c1ccc(NC(=O)C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2O)cc1 408998476 QQSKDMWMUBEQNX-RGVLZGJSSA-N 384.392 2.687 50 40 GFGB CN1C(=C(C#N)C(=O)COc2ccc(Cl)cc2C(N)=O)N(C)c2ccccc21 11115249 HZEYNFVNXZEQJT-UHFFFAOYSA-N 396.834 2.708 50 40 GFGB COc1ccc(C(=O)N/N=C/c2cc(Br)c(O)c(OC)c2)c(O)c1 409393226 VZYCZEXOSJHZPA-QGMBQPNBSA-N 395.209 2.641 50 40 GFGB CN(C)C(=O)CSc1ccccc1C(=O)NNC(=O)c1ccc(Cl)cc1 8074161 WRNSZLLXGUMWDL-UHFFFAOYSA-N 391.880 2.595 50 40 GFGB O=C(CCCC[C@@H]1CCSS1)N[C@@H]1CCN(c2nccn3cnnc23)C1 575414459 HVMKVJIXAFUTKU-ZIAGYGMSSA-N 392.554 2.533 50 40 GFGB O=C(CNc1cccc([N+](=O)[O-])c1)NN=Cc1cc([N+](=O)[O-])ccc1Cl 1083148217 JFWRYQYCPZNMDT-UHFFFAOYSA-N 377.744 2.719 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2cc(Cl)ccc2C)c(OC)c1 6997108 AWFTYNWYDSRWKI-KEBDBYFISA-N 375.812 2.754 50 40 GFGB CCOc1cc(/C=N/NC(=O)c2ccc(C)cc2OC)ccc1OCC(=O)O 408748869 IMZNXUMMUMTEDW-SRZZPIQSSA-N 386.404 2.630 50 40 GFGB COc1cc(/C=N\NC(=O)[C@@H]2COc3ccc(C(C)(C)C)cc3O2)ccc1O 36093507 FETAWLRDNIIYCH-SNINMWPCSA-N 384.432 2.988 50 40 GFGB Cc1cc(C)c2c3c(c(=O)oc2c1)[C@]1(C(=O)Nc2ccccc21)C(C#N)=C(N)O3 104766205 HGWCWSWKYMAZHO-JOCHJYFZSA-N 385.379 2.734 50 40 GFGB CC(=O)NNC(=O)CSc1nc(C(C)C)nc2sc3c(c12)CCCC3 1378849 FLHSHFBGEGCNEC-UHFFFAOYSA-N 378.523 2.953 50 40 GFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1ccc2c(c1)OCO2)c1ccccc1 408980212 PVPHVDZUQCYXNH-SVZNOHIVSA-N 383.404 2.743 50 40 GFGB Cc1cc(Cl)ccc1N(CC(=O)N/N=C/c1cccs1)S(C)(=O)=O 20212420 UEKQQGUTWIHVSE-RQZCQDPDSA-N 385.898 2.626 50 40 GFGB Cc1n[nH]c2c1[C@H](c1c(C)c([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C)C(C#N)=C(N)O2 8439205 OYZABICRNNHEKX-ZDUSSCGKSA-N 384.352 2.678 50 40 GFGB COC(=O)c1ccc(OCC(=O)NN=Cc2cccc(Br)c2)cc1 239274716 APLUEPJLVFBWDE-UHFFFAOYSA-N 391.221 2.765 50 40 GFGB O=C(COC(=O)c1ccc2[nH]c3c(c2c1)CCCC3)NNC(=O)c1ccccc1 7779581 RZIHQVIVGIPFBQ-UHFFFAOYSA-N 391.427 2.665 50 40 GFGB Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CC(C)C)c2)c1 10160920 INCAKJBCDHYFFS-UHFFFAOYSA-N 389.477 2.603 50 40 GFGB C/C(CC(=O)Nc1ccc2ccccc2c1)=N\NC(=O)Cc1csc(N)n1 4812530 GALLFOBVTLIBOD-FSJBWODESA-N 381.461 2.942 50 40 GFGB O=C(CCNC(=O)Nc1ccccc1)NNC(=O)c1cc(Cl)ccc1Cl 7786955 BOUWZHMIWSIYIR-UHFFFAOYSA-N 395.246 2.966 50 40 GFGB CCOc1ccc(C(=O)NNC(=O)CCC(=O)c2ccc3c(c2)CCC3)cc1 17270519 NRYAAGVBTWPXHO-UHFFFAOYSA-N 380.444 2.998 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2cc(OC)cc(Br)c2O)cc1 408592508 YUGXHCKJFXQCRL-VXLYETTFSA-N 393.237 2.865 50 40 GFGB O=C(CCN1C(=O)CSc2ccccc21)NNC(=O)c1ccc(Cl)cc1 8074135 LFZMLJYUZUKCFA-UHFFFAOYSA-N 389.864 2.630 50 40 GFGB COc1cccc(/C=C(/C#N)C(=O)NCc2ccccc2)c1O[C@H](C)C(=O)O 409231153 HYLLAUCGHRQJPG-RQNDZEIBSA-N 380.400 2.770 50 40 GFGB Cc1ccsc1/C=N/NC(=O)CN(c1cccc(C)c1C)S(C)(=O)=O 408906005 CAMBCDLWAKQZHX-VCHYOVAHSA-N 379.507 2.590 50 40 GFGB Cc1cccc(C(=O)NNC(=O)COc2cccc(Br)c2)c1C 15507406 GAURIRHVZXWDHI-UHFFFAOYSA-N 377.238 2.906 50 40 GFGB O=C(NNC(=O)c1c(F)cccc1Cl)c1ccc(=O)n(Cc2ccccc2)c1 23109464 XEOJXPOINYJTEI-UHFFFAOYSA-N 399.809 2.764 50 40 GFGB CCOC(=O)[C@H](CC)/C(C)=N\NC(=O)CCC(=O)Nc1ccc(OCC)cc1 5875685 HHRXRTVCQJQMFY-VVRYKASASA-N 391.468 2.885 50 40 GFGB Cc1ccc2nc(NNC(=O)c3ccc(S(=O)(=O)N(C)C)cc3)sc2c1 4121382 XVIBWUBQIYLVAG-UHFFFAOYSA-N 390.490 2.612 50 40 GFGB COc1ccccc1OCCOc1c(Cl)cc(/C=N/NC(N)=O)cc1OC 5880637 OUQJHIMAIYVEAP-SRZZPIQSSA-N 393.827 2.817 50 40 GFGB COC(=O)CSC1=C(C#N)[C@@H](c2cccc(Br)c2)CC(=O)N1 6440826 YCZUBWVKTFLBOU-LLVKDONJSA-N 381.251 2.694 50 40 GFGB Cc1cc(C)c(OCC(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)c(C)c1 6651807 WGXRAKZXENUXRB-UHFFFAOYSA-N 378.432 2.842 50 40 GFGB CCCCOC(=O)CSC1=C(C#N)[C@H](c2ccccc2OC)[C@@H](C#N)C(=O)N1 9331792 AVHZEYDDGTUYIT-RDTXWAMCSA-N 399.472 2.860 50 40 GFGB O=C(N/N=C/c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1 58884989 QDCOMVNXRJEMJG-QGMBQPNBSA-N 381.175 2.990 50 40 GFGB Cc1ccc(Br)cc1S(=O)(=O)NNC(=O)c1ccccc1F 7419454 ZNFCHZKHDSRJCD-UHFFFAOYSA-N 387.230 2.520 50 40 GFGB C/C(=N/NC(=O)CCNC(=O)c1ccccc1Cl)c1ccc([N+](=O)[O-])cc1 33586467 YLFFCZMSBANBOR-MTJSOVHGSA-N 388.811 2.909 50 40 GFGB Cc1ccc(Cn2cc(C(=O)NNC(=O)Nc3ccc(F)cc3)ccc2=O)cc1 23136178 AYVDUMWIDLPOMR-UHFFFAOYSA-N 394.406 2.811 50 40 GFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2cn(CC#N)c3ccccc23)n1 6964295 SJDRKGGSHSWMMH-UFFVCSGVSA-N 378.461 2.814 50 40 GFGB CN1C(=O)[C@]2(C(C#N)=C(N)N(c3cccnc3)C3=C2C(=O)CCC3)c2ccccc21 4417973 OCNSTZBRVJWTMA-QHCPKHFHSA-N 397.438 2.517 50 40 GFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(OC)cc1 408602332 BRVVHEDVMRQWBM-QGZVFWFLSA-N 397.504 2.948 50 40 GFGB N#C/C(C(=O)NCc1ccccc1)=C1/C(=O)Nc2ccc(Br)cc21 39555991 XQUPAHFMIMEKDG-PEZBUJJGSA-N 382.217 2.995 50 40 GFGB COc1ccc(CCNC(=O)/C(C#N)=C/c2c(OC)cccc2OC)cc1OC 269911800 JXKVDPQJDLKNPH-DTQAZKPQSA-N 396.443 2.987 50 40 GFGB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C/NNC(=O)c1ccccc1[N+](=O)[O-] 100149326 ZPWIXBBRNAYNOT-XNTDXEJSSA-N 399.794 2.789 50 40 GFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)COc2ccccc2)c(OC)c1 100522962 WTWUWKLYTOGTPV-HYARGMPZSA-N 385.420 2.604 50 40 GFGB I[C@H]1CC[C@@H]2O[C@@H]1CC[C@H]2I 104262703 JGRCXIKSKJDSQB-KVFPUHGPSA-N 377.991 2.935 50 40 GFGB C/C(=N\NC(=O)CN(c1cc(C)cc(C)c1)S(C)(=O)=O)c1cccs1 408866669 HUWBUSYSEDEQTC-NBVRZTHBSA-N 379.507 2.671 50 40 GFGB C/C(=N\NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C)c1ccc(-n2cccc2)cc1 5249827 QGSFONJSOIFSFC-DEDYPNTBSA-N 380.408 2.739 50 40 GFGB CN(CCOc1ccc(Cl)cc1)CC(=O)NNC(=O)c1ccccc1Cl 14245877 ZJKSYJGVMTWNHK-UHFFFAOYSA-N 396.274 2.765 50 40 GFGB CCOc1ccc(C(=O)NNC(=O)CSc2ccccc2F)cc1OC 15465739 CVQAEEJYZGBYSQ-UHFFFAOYSA-N 378.425 2.786 50 40 GFGB CC(C)(C)c1cc[n+](-c2[nH]c(=O)sc2/C=N\NC(=O)c2ccccc2)cc1 15985610 QALBXSLEGIZYDF-UHFFFAOYSA-O 381.481 2.775 50 40 GFGB O=C(NNC(=O)c1cc(Br)c(Br)s1)c1ccco1 8354480 JPPHAIRNKHIFIJ-UHFFFAOYSA-N 394.044 2.941 50 40 GFGB O=C(NNC(=S)NC(=O)c1sc2ccccc2c1Cl)c1cccnc1 18191265 HOTFTFAWHHNATI-UHFFFAOYSA-N 390.877 2.899 50 40 GFGB C/C(=N/NC(=O)COc1ccc(C)cc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 4694186 YSXXNGMRMVCISM-MOSHPQCFSA-N 385.376 2.594 50 40 GFGB COc1cccc(CC(=O)N/N=C\c2ccc(OCC(=O)OC(C)C)cc2)c1 409189677 MTNJYXRTGAPOPU-XKZIYDEJSA-N 384.432 2.718 50 40 GFGB Cc1cc(/C=N\NC(=O)COc2ccccc2[N+](=O)[O-])c(C)n1-c1ccccn1 409249591 KNMSQGKLUVUACL-UUYOSTAYSA-N 393.403 2.926 50 40 GFGB O=C(Cc1ccc(Br)cc1)N/N=C/c1cc(O)ccc1[N+](=O)[O-] 36239643 FASAPIKZYCQWAQ-RQZCQDPDSA-N 378.182 2.756 50 40 GFGB COc1cc(/C=N/NC(=O)Nc2cccc3nsnc23)cc(OC)c1OC 822450 QKDUTIJNYHZOPW-GIJQJNRQSA-N 387.421 2.873 50 40 GFGB C/C(=N/NC(=O)C(N)=O)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1 4646898 GNWZIFPGNZXFPD-AFPJDJCSSA-N 393.230 2.571 50 40 GFGB CCOc1ccccc1OCC(=O)N/N=C/c1cc(Cl)cc(OC)c1O 20100890 KQQJOYMFHCUHQG-KEBDBYFISA-N 378.812 2.982 50 40 GFGB O=C(NC(=S)NNC(=O)C(c1ccccc1)c1ccccc1)C(Cl)Cl 2690713 NFLOYUIBESXEAF-UHFFFAOYSA-N 396.299 2.644 50 40 GFGB CN(c1ccc(C(=O)N/N=C/c2ccccn2)cc1)S(=O)(=O)c1ccccc1 20232869 BXBGMCCXBUKUOW-PXLXIMEGSA-N 394.456 2.671 50 40 GFGB O=C(Cc1ccccc1)N/N=C/c1cc([N+](=O)[O-])cc(Br)c1O 3031312 JYIMNGQKKQXPPP-RQZCQDPDSA-N 378.182 2.756 50 40 GFGB Cn1c(SCC(=O)N/N=C/c2cccnc2)nnc1-c1cccc(Cl)c1 2195068 FGLRDFIHUZGLKJ-KEBDBYFISA-N 386.868 2.773 50 40 GFGB COC(=O)CSC1=C(C#N)[C@H](c2ccc(Cl)cc2)[C@H](C(=O)OC)C(O)=N1 2300868 YFSHYHLNKSDTRS-KBPBESRZSA-N 394.836 2.824 50 40 GFGB CO[C@@H](C(=O)N/N=C(\C)CC(=O)Nc1ccc(N(C)C)cc1)c1ccccc1 18996710 RJLXJBCWHRXLFK-KMUCBOENSA-N 382.464 2.961 50 40 GFGB CC(C)NC(=O)/C(C#N)=C/c1ccc(OCC(=O)NCCc2ccccc2)cc1 408789881 SFUDJGRMAYWUID-XSFVSMFZSA-N 391.471 2.856 50 40 GFGB COc1ccc(/C=N/NC(=O)c2cncc(Br)c2)cc1[N+](=O)[O-] 3148123 IVITVMJDIDFANE-UBKPWBPPSA-N 379.170 2.525 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2ccc(C)cc2)cc(Cl)c1O 6958759 ANIXITUBBFEISF-KEBDBYFISA-N 375.812 2.842 50 40 GFGB CCN1C(=O)/C(=N/NC(=O)c2ccc(C)nc2)c2cc(Br)ccc21 5791783 AOTRWYSXVWOFCY-HMMYKYKNSA-N 387.237 2.653 50 40 GFGB C[C@H](Nc1nc2ccccc2s1)C(=O)NNC(=O)c1cc(F)cc(F)c1 8984339 IERHMTXSEHPXLZ-VIFPVBQESA-N 376.388 2.836 50 40 GFGB Cc1cc(-n2cncn2)ccc1C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2 78877947 XDEBNQGVCJJIKA-UHFFFAOYSA-N 393.491 2.943 50 40 GFGB N#C/C(=C\c1ccc(O)c([N+](=O)[O-])c1)C(=O)N1CCN(c2ccccc2)CC1 37613799 BNMHAXAFUSTAHN-FOWTUZBSSA-N 378.388 2.556 50 40 GFGB CC(C)(C)NC[C@H](O)Cn1cc(/C=N/NC(=O)c2ccncc2)c2ccccc21 95117206 AHWJNNWMRCVLHH-SAMQYFKISA-N 393.491 2.549 50 40 GFGB CC(C)(C)c1ccc(OCC(=O)N/N=C/c2ccccc2OCC(=O)O)cc1 5379985 AAJPOAWVJNLKDZ-WSDLNYQXSA-N 384.432 2.977 50 40 GFGB C/C(CC(=O)NCc1ccco1)=N\NC(=O)c1ccc(Br)cc1 100510161 FWPYOLHEJZJMPL-YBFXNURJSA-N 378.226 2.854 50 40 GFGB O=C(N/N=C/c1cccs1)c1ccc(C(=O)N/N=C/c2cccs2)nc1 2065257 HLTPEDBLNUOHED-ROUMAOROSA-N 383.458 2.732 50 40 GFGB CCn1cc(C(=O)O)c(=O)c2cc(F)c(NNC(=O)C3CCCCC3)cc21 2349474 NBLKSJVSYBEUKS-UHFFFAOYSA-N 375.400 2.882 50 40 GFGB COC(=O)c1c(C)[nH]c(C(=O)NNC(=O)CSc2ccc(Cl)cc2)c1C 12815595 PMMAVHXYTRQZPZ-UHFFFAOYSA-N 395.868 2.625 50 40 GFGB COc1cc(OC)cc(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)c1 6016612 ZZZSMLLTTIXSIR-UHFFFAOYSA-N 379.372 2.702 50 40 GFGB CCCn1c(C)cc(/C=C(\C#N)C(=O)OCn2nnc3ccccc3c2=O)c1C 5870612 GMCDJAPHXTWEDY-GZTJUZNOSA-N 391.431 2.728 50 40 GFGB O=C(Cc1ccc2c(c1)OCCO2)N/N=C\c1cccc(Br)c1 409361458 HIKYGZQNMKREPJ-ODLFYWEKSA-N 375.222 2.913 50 40 GFGB COc1cc(OC)c(OC)cc1/C=C(/C#N)C(=O)Nc1cccc(C(=O)O)c1 33410110 MHTAWEOQEQDKKU-AUWJEWJLSA-N 382.372 2.956 50 40 GFGB CCOc1c(I)cc(/C=C(\C#N)C(N)=S)cc1OC 35146017 BFBQSELLOOWUNB-RUDMXATFSA-N 388.230 2.892 50 40 GFGB O=C(N/N=C\c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)c1cc2ccccc2cc1O 71328727 APYJZHWOOOQLKX-OCKHKDLRSA-N 396.315 2.831 50 40 GFGB O=C(NNC(=S)Nc1cccc(OC(F)(F)F)c1)c1cc(O)ccc1O 1616040743 WHIOOGLBUGOJKS-UHFFFAOYSA-N 387.339 2.628 50 40 GFGB Cc1ccccc1-n1c(C)cc(/C=N/NC(=O)C(=O)NCc2ccco2)c1C 17472563 HHFYYBBBODJZAQ-FSJBWODESA-N 378.432 2.762 50 40 GFGB O=C(O)COc1ccc(/C=N/NC(=O)CNc2cccc(C(F)(F)F)c2)cc1 3577074 XOPXNIRIBZVWAC-NUGSKGIGSA-N 395.337 2.731 50 40 GFGB CCOc1ccc2[nH]c(=O)c([C@@H]3C(C#N)=C(N)OC4=C3C(=O)CCC4)cc2c1 876555 RYROGWBFHWMKAW-GOSISDBHSA-N 377.400 2.742 50 40 GFGB CCCN1C(=O)/C(=N/NC(=O)COc2ccc(C)cc2[N+](=O)[O-])c2ccccc21 5894506 ZYGHSNDXVRMDKX-ZBJSNUHESA-N 396.403 2.559 50 40 GFGB COc1cc(OC)c(/C=N\NC(=O)Cc2ccc3c(c2)OCCO3)cc1Cl 409360798 FWEAVJSPYMVWON-NHDPSOOVSA-N 390.823 2.821 50 40 GFGB COC(=O)c1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2[N+](=O)[O-])cc1 904042 RUGJTWNUHDQSOC-DJKKODMXSA-N 391.767 2.564 50 40 GFGB Cc1nc(Nc2nc3ccccc3o2)ncc1C(=O)NNC(=O)c1ccccc1 10157610 UISWMJSPGFYQPT-UHFFFAOYSA-N 388.387 2.745 50 40 GFGB O=C(N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2)c1cc2ccccc2cc1O 705567 DFCJNARKRDQYNW-AWQFTUOYSA-N 379.328 2.946 50 40 GFGB COc1cc(/C=N/NC(=O)CNc2ccc(Cl)cc2)c(O)c([N+](=O)[O-])c1 59720914 VMRWPMAAQIYKGX-UFWORHAWSA-N 378.772 2.525 50 40 GFGB O=C(CN1CCCCCC1=O)NNC(=O)c1ccccc1Nc1ccccc1 12554563 VMQIYIOCBLNEAR-UHFFFAOYSA-N 380.448 2.594 50 40 GFGB O=C(NNS(=O)(=O)c1cccc(Cl)c1)c1ccccc1-n1cccc1 7060111 HXVIFLXUESNORP-UHFFFAOYSA-N 375.837 2.754 50 40 GFGB O=C(N/N=C/c1cc2c(cc1Cl)OCO2)c1cncc(Br)c1 847884 ILGIBMVJVLXFAF-BLLMUTORSA-N 382.601 2.990 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1OC(=O)c1ccccc1)c1cccnc1 1435108 IOJIGHQDFUVJLD-LPYMAVHISA-N 390.355 2.973 50 40 GFGB CCn1c(SCC(=O)N/N=C\c2ccncc2)nnc1-c1ccc(C)cc1 30742899 IGYLHYZBARDSBA-MTJSOVHGSA-N 380.477 2.911 50 40 GFGB N#C/C(=C\c1ccc(-c2ccc(Cl)cc2)o1)C(=O)N[C@@H]1CCS(=O)(=O)C1 26966836 AHEWJIPNNWXSGP-BMQCOBNYSA-N 390.848 2.810 50 40 GFGB O=C(COc1ccc2c(c1)CCC2)NNC(=O)c1ccccc1-n1cccc1 6623548 DABCZDBIERWFOO-UHFFFAOYSA-N 375.428 2.806 50 40 GFGB Cc1ncc(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)n1-c1ccccc1 78965127 STACMCZPKVCEIR-ZDUSSCGKSA-N 382.395 2.548 50 40 GFGB CCOc1cc(/C=N/NC(=O)Cc2ccc3c(c2)OCO3)cc(Cl)c1O 409042997 PAKGDCYUMSVWKX-AWQFTUOYSA-N 376.796 2.866 50 40 GFGB COc1ccc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)cc1OC 1437739 DGLUOPOXNTZBNX-VXLYETTFSA-N 389.433 2.996 50 40 GFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)Nc2ccc(N(C)C)cc2)c(OC)c1 100035407 VUIKSCNZISZPCD-OEAKJJBVSA-N 398.463 2.904 50 40 GFGB NC(=O)N[C@H](CC(=O)NNC(=O)c1cc(Cl)ccc1Cl)c1ccccc1 11507467 XVWHQGUYDZDMQT-CQSZACIVSA-N 395.246 2.554 50 40 GFGB CCOc1ccc(NC(=O)CCC(=O)N/N=C(\C)c2ccc(O)cc2O)cc1 5873155 UTXJBAJVFJXZBR-LPYMAVHISA-N 385.420 2.756 50 40 GFGB C[C@H](Oc1ccccc1Br)C(=O)N/N=C/c1ccc([N+](=O)[O-])o1 1085450 LROCDUWWLQADBZ-VKPPLCHCSA-N 382.170 2.868 50 40 GFGB O=C(NNC(=O)c1ccccc1-n1cccc1)c1cnn(Cc2ccccc2)c1 12516739 XADOMZBRWGCOFR-UHFFFAOYSA-N 385.427 2.797 50 40 GFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2cccn2-c2ccc(O)cc2)n1 1101052 HUCQFCSSPIPZHE-RGVLZGJSSA-N 381.461 2.832 50 40 GFGB CN(NC(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O)c1ccccc1 3216726 NYKQOJNTZPEETI-UHFFFAOYSA-N 392.436 2.845 50 40 GFGB C[C@@H](C(=O)N/N=C/c1c(F)cccc1Cl)N(c1ccccc1)S(C)(=O)=O 4543731 QNFGKARWVBYJHQ-DQAKUKQTSA-N 397.859 2.784 50 40 GFGB COc1cc(C(=O)NNC(=O)COc2ccc3c(c2)CCC3)ccc1OC(C)C 6542189 FOCHZZPAYXLKAG-UHFFFAOYSA-N 398.459 2.811 50 40 GFGB Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1ccc2c(c1)OCO2 6560215 CWBLSRBFIICOFT-UHFFFAOYSA-N 381.413 2.922 50 40 GFGB CCO[C@@H]1CCCN(S(=O)(=O)c2ccc(OCCBr)cc2)C1 95993345 JLTVWWRTQPOLRU-CQSZACIVSA-N 392.315 2.650 50 40 GFGB CNC(=O)/C(C#N)=C1/S[C@@H](Cc2ccc(F)cc2)C(=O)N1c1ccccc1 4995682 MBQXLERWRONYIG-BJMRFWQKSA-N 381.432 2.998 50 40 GFGB COc1cc(OC)cc(C(=O)NNC(=O)COc2ccc3ccccc3c2)c1 829243 YVYZVZWBYYCXAS-UHFFFAOYSA-N 380.400 2.697 50 40 GFGB Cc1nnc(NC(=O)CCC(=O)O[C@H](CCl)C(=O)c2ccccc2)s1 8474454 IZQJLUZPJRLQMK-GFCCVEGCSA-N 381.841 2.599 50 40 GFGB Cc1cc(C)nc(NNC(=O)CCc2c(C)nc3c4ccccc4nn3c2C)n1 11334779 NYJGLWAPEIQOBK-UHFFFAOYSA-N 389.463 2.982 50 40 GFGB COC(=O)COc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(C(=O)OC)cc1 408795153 URPWVENGAACBPE-LFIBNONCSA-N 394.383 2.571 50 40 GFGB COC(=O)COc1ccccc1/C=N\NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 408903910 BCVDAZQLBFPVCY-JMIUGGIZSA-N 397.343 2.657 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1cc(OC)ccc1OC 408911900 OWUUHIDFJIJSAW-SDLXJUDFSA-N 399.447 2.511 50 40 GFGB O=C(/C=C/c1cc(Cl)cc(Cl)c1)NNC(=O)[C@@H]1COc2ccccc2O1 12609653 AZKLZZZBEIEVLI-JFDDCEBESA-N 393.226 2.994 50 40 GFGB O=C(N/N=C/c1ccc(N2CCCCC2)o1)c1ccc(CN2CCOCC2)cc1 408995635 MQLKFYYSYCMWDN-XQNSMLJCSA-N 396.491 2.866 50 40 GFGB Cc1ccsc1/C=N/NC(=O)CN(c1cccc(Cl)c1C)S(C)(=O)=O 20212971 PGWPUKPUVBUNMQ-GIJQJNRQSA-N 399.925 2.935 50 40 GFGB O=C(Cn1c(-c2ccccn2)nc2ccccc21)N/N=C/c1ccc2c(c1)OCO2 1501382 LWFYAEODLJXUQB-WYMPLXKRSA-N 399.410 2.977 50 40 GFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)COc2ccccc2C)c(OC)c1 4697864 OYFZTFOCNDOXBC-HZHRSRAPSA-N 399.447 2.912 50 40 GFGB CC(=O)Oc1c(Br)cc(/C=C(\C#N)C(N)=O)cc1Br 408756281 YNGRAZMAXDCMNY-KRXBUXKQSA-N 388.015 2.529 50 40 GFGB C/C(=N\NC(=O)c1cc2c(s1)C[C@@H](C)CC2)c1ccc(OCC(N)=O)cc1 17078710 NSBLSOABDISXFB-GLXUHCQUSA-N 385.489 2.891 50 40 GFGB BrCCOC(OCCBr)OCCBr 1083809179 TWDDYFFUYACEBC-UHFFFAOYSA-N 384.890 2.505 50 40 GFGB Cc1ccc(Cn2cc(C(=O)NNC(=O)Nc3cccc(C)c3)ccc2=O)cc1 23136172 QCJBYSCIZBDDKC-UHFFFAOYSA-N 390.443 2.980 50 40 GFGB O=C(COc1ccc(/C=N/NC(=O)c2ccncc2)cc1)NCc1ccccc1 28214944 FEHNJSNTONXUBS-MFKUBSTISA-N 388.427 2.541 50 40 GFGB COc1ccc(/C=C(\C#N)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1 5156328 QKLWUHQXCNIHHT-MDWZMJQESA-N 381.344 2.920 50 40 GFGB Nc1c(Cl)c(Cl)nc(C(=O)N/N=C/c2ccc(O)cc2O)c1Cl 84350701 ZZWNHAQZGUBEFI-JJPRUIFNSA-N 375.599 2.799 50 40 GFGB CC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(O)c(Br)c2)cc1 110140547 ILOLKXKLUIWKPF-GIJQJNRQSA-N 376.210 2.877 50 40 GFGB C/C(=N\NC(=O)CSCc1ccc([N+](=O)[O-])cc1)c1cc(O)ccc1O 5282454 VBMVQYQQYXDULB-WOJGMQOQSA-N 375.406 2.780 50 40 GFGB C/C(N)=C(\C#N)C(=O)CSc1nnc(-c2ccncc2)n1Cc1ccccc1 104832346 KPIQXALRHMGTLD-VKAVYKQESA-N 390.472 2.806 50 40 GFGB O=C1NN(c2ccccc2)C(=O)/C1=C/c1ccc(OCCBr)cc1 2120703 SPZYJJJJELJXIY-FOWTUZBSSA-N 387.233 2.922 50 40 GFGB N#C/C(=C/c1ccc2c(c1)OCO2)C(=O)OCC(=O)NCc1ccccc1Cl 6438496 SGGRPROMHKVLAQ-CHHVJCJISA-N 398.802 2.835 50 40 GFGB CCCN1C(=O)/C(=N/NC(=O)c2cccnc2)c2cc(Br)ccc21 17952188 FALSGUCWDMXJMF-HMMYKYKNSA-N 387.237 2.735 50 40 GFGB O=C(NNc1c(F)c(F)c(F)c(F)c1F)[C@@H]1CC(=O)N(Cc2ccccc2)C1 8705952 WLVDNLFPNNZUHV-SNVBAGLBSA-N 399.319 2.874 50 40 GFGB Cc1ccccc1C(=O)N/N=C/c1ccc(CNS(=O)(=O)c2ccccc2)o1 408782557 KDDQVVKFCONQCO-FYJGNVAPSA-N 397.456 2.830 50 40 GFGB Cc1cccc(/C=N/NC(=O)CN(c2cccc(Cl)c2C)S(C)(=O)=O)c1 408777213 WXBSVOWLHUWOLX-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB CCOc1cc(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)cc(Cl)c1O 409159929 BYADVFQYTLDHKN-ODCIPOBUSA-N 391.811 2.735 50 40 GFGB COc1c(Br)cc(/C=N/NC(=O)CC#N)cc1Br 861843 GRGJTQNQNJOLNA-GIDUJCDVSA-N 375.020 2.584 50 40 GFGB CC1=C(C(=O)OC(C)(C)C)[C@@]2(C(=O)Nc3ccc(Cl)cc32)C(C#N)=C(N)O1 1081574 VVVFSNZYSMKLIM-IBGZPJMESA-N 387.823 2.870 50 40 GFGB COc1ccnc(NNC(=O)Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)n1 52582290 KOGACOVDLKJVDS-UHFFFAOYSA-N 386.843 2.627 50 40 GFGB C#CCOc1ccc(/C=N/NC(=O)c2cccc(NC(C)=O)c2)cc1OCC 6656591 ZZVORLYXVZXXEY-HYARGMPZSA-N 379.416 2.820 50 40 GFGB N#C/C(=C\c1cc([N+](=O)[O-])ccc1N1CCOCC1)C(=O)Nc1ccc(O)cc1 107574245 MHDOVISTDVMRAW-RVDMUPIBSA-N 394.387 2.683 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(Br)o2)cc(OC)c1OC 687056 BSFZLXWSCASSPX-CAOOACKPSA-N 383.198 2.832 50 40 GFGB COc1ccccc1OCC(=O)NNC(=O)c1cc(C)nc2ccc(C)cc12 24830032 HXCYKTVCSPIZFC-UHFFFAOYSA-N 379.416 2.700 50 40 GFGB C/C(CC(=O)Nc1cccc(Cl)c1C)=N\NC(=O)Cc1csc(N)n1 4455766 LCWODFMUVPVFBR-ZVBGSRNCSA-N 379.873 2.751 50 40 GFGB COc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)c(OC)c1 409156135 SBQVHKPQIIRWHM-FZJZADEZSA-N 395.459 2.824 50 40 GFGB COC(=O)Oc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2C)cc1OC 408838046 QWGTVNMPKQEGPE-VXLYETTFSA-N 387.348 2.821 50 40 GFGB C[C@@H](SCc1ccccc1)C(=O)NNC(=O)c1cc(Br)c[nH]1 40144399 XZJSFHKUOZAWHQ-SNVBAGLBSA-N 382.283 2.860 50 40 GFGB CC(C)c1ccc2c(c1)/C(=N\NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C(=O)N2 3220356 SOTNGZOMSYGHNH-UHFFFAOYSA-N 397.347 2.713 50 40 GFGB CCCNC(=O)CSC1=C(C#N)[C@@H](c2ccc(OC)c(Cl)c2)CC(=O)N1 6324072 HFUKPPHGQRIPEL-GFCCVEGCSA-N 393.896 2.947 50 40 GFGB Cc1c(Cl)cccc1N(CC(=O)N/N=C/c1cccs1)S(C)(=O)=O 20212841 RJDIGUBDRVEZRH-RQZCQDPDSA-N 385.898 2.626 50 40 GFGB Cc1cccc(C(=O)NNC(=O)COc2ccc(Br)cc2C)c1 4568516 LOAHVVTYDAGPNV-UHFFFAOYSA-N 377.238 2.906 50 40 GFGB N#CC(C#N)=C(N1CCOCC1)[C@@]1(C#N)[C@H](c2ccccc2Cl)C1(C#N)C#N 66089424 PGOALIYKPGHXRO-YLJYHZDGSA-N 388.818 2.614 50 40 GFGB COc1cc(Br)cc(/C=N\NC(=O)Cc2ccc(F)cc2)c1O 409223462 FXTBSZYBLGUNRI-OCKHKDLRSA-N 381.201 2.995 50 40 GFGB COc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1cccc(OCC(=O)O)c1 408926908 ZAWHMAGXTLFYHH-NTUHNPAUSA-N 397.343 2.612 50 40 GFGB CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)NN(c1ccccc1)c1ccccc1 408999482 CZSSFZMQXDTDCM-KRWDZBQOSA-N 398.463 2.625 50 40 GFGB O=C(/C=C\c1ccccc1)NNC(=O)c1cccn(Cc2ccc(F)cc2)c1=O 23109351 XHQHKACRXKCKEQ-RAXLEYEMSA-N 391.402 2.510 50 40 GFGB CC1(C)Cc2ccccc2/C(=C\C(=O)C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)N1 101363317 CCMOGXCSJUCDAY-PJZUGINESA-N 392.415 2.579 50 40 GFGB N#C/C(C(=O)NCc1ccco1)=C1/N=C(NC(=O)c2ccco2)c2ccccc21 5272659 ZRPKZKJISCABCF-VLGSPTGOSA-N 386.367 2.614 50 40 GFGB CS(=O)(=O)Cc1cccc(C(=O)NNc2c(F)c(F)c(F)c(F)c2F)c1 14169362 PFFBIUZWMDGIPG-UHFFFAOYSA-N 394.321 2.684 50 40 GFGB CCc1ccccc1N1C[C@H](C(=O)NNC(=O)c2ccccc2Cl)CC1=O 41779234 OIEALIIXCUEOCT-CQSZACIVSA-N 385.851 2.717 50 40 GFGB COc1cccc(/C=N/NC(=O)C2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)c1 5559033 HJVLNTBRZIPOFA-HYARGMPZSA-N 396.447 2.966 50 40 GFGB CCCCCOc1ccc(C(NC(=O)CCl)NC(=O)CCl)cc1OC 4301820 FZBIYAGXIUIBPD-UHFFFAOYSA-N 391.295 2.973 50 40 GFGB COc1ccc(S(=O)(=O)NNC(=O)c2ccc(-n3c(C)ccc3C)cc2)cc1 1043406 JGROSYKKBOTYJM-UHFFFAOYSA-N 399.472 2.726 50 40 GFGB I[C@@H]1[C@@H]2[C@@H]3[C@@H](I)[C@H]4[C@H]2[C@@H]2[C@@H]1[C@@H]3[C@H]42 104282163 CTOZWVMTSCJSMU-DMXTVJFXSA-N 383.998 2.591 50 40 GFGB COc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1 13042021 JKRBYOKVXQQTPO-UHFFFAOYSA-N 380.491 2.649 50 40 GFGB Cc1ccc(N2C(=O)/C(=C\NNC(=O)c3cccnc3)c3ccccc3C2=O)cc1 6528850 DAFKNCQXLZBABF-ZHZULCJRSA-N 398.422 2.853 50 40 GFGB COc1cc(Br)cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)c1O 4702436 BKIFULVYYQEPPU-CAOOACKPSA-N 394.181 2.835 50 40 GFGB Cc1ccc(/C=C/C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1 15945936 SGZZJINZFCSTNO-OUKQBFOZSA-N 390.443 2.760 50 40 GFGB CCOC(=O)N/N=C/c1ccc(OS(=O)(=O)c2ccccc2)c(OCC)c1 408957312 UDEVIELNQMAQCF-CPNJWEJPSA-N 392.433 2.933 50 40 GFGB COc1ccc(/C=N/NC(=O)C2CCN(C(=O)c3cccc(OC)c3)CC2)cc1 409005700 JXQRPGIZZBWOHJ-HZHRSRAPSA-N 395.459 2.706 50 40 GFGB CC(C)(C)c1ccccc1OCC(=O)N/N=C/c1ccccc1OCC(=O)O 18192112 ULKRPLGIEKJZPT-WSDLNYQXSA-N 384.432 2.977 50 40 GFGB C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccc(F)cc1 12891604 BGWVDONHWHZHSQ-ZDUSSCGKSA-N 388.420 2.756 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2ccc(Cl)cc2)S(C)(=O)=O)cc1C 408788812 HRVYSHBHYCLOIM-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB CNC(=O)/C(C#N)=C1\S[C@@H](Cc2ccc(F)cc2)C(=O)N1c1ccccc1 16689691 MBQXLERWRONYIG-IMGOXIFKSA-N 381.432 2.998 50 40 GFGB COc1ccc(S(=O)(=O)NNC(=O)Nc2ccc(C(C)C)cc2)cc1OC 17080372 POPGVHSNCHSQQB-UHFFFAOYSA-N 393.465 2.842 50 40 GFGB COCCNC(=O)/C(C#N)=C/c1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1 408809926 IRZFHKICAGJVKY-SFQUDFHCSA-N 381.388 2.843 50 40 GFGB C/C(=N\NC(=O)COc1ccc(Cl)cc1Cl)c1c(O)cc(C)oc1=O 4155204 JDNYAEHSBXXOBO-DJKKODMXSA-N 385.203 2.880 50 40 GFGB O=C(Oc1ccc([N+](=O)[O-])cc1)c1cccc(S(=O)(=O)N2CCCCC2)c1 1230306 ZCNWFFUANPSKSH-UHFFFAOYSA-N 390.417 2.989 50 40 GFGB COc1ccc(-c2nnc(SCC(=O)NN)n2-c2ccc(Cl)cc2)cc1 36724714 FULJBWUELVZLMD-UHFFFAOYSA-N 389.868 2.678 50 40 GFGB CCCNC(=O)N(NC(=O)c1ccc(C)cc1)c1nc(C(=O)OCC)cs1 3768067 XVYIXIBGPSLSRC-UHFFFAOYSA-N 390.465 2.899 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccc2)ccc1OCC(=O)O 9434911 RHHMJYXLNQUGGX-FBJMNJBLSA-N 380.400 2.943 50 40 GFGB COc1cccc(CNC(=O)COC(=O)/C(C#N)=C\c2ccc(N(C)C)cc2)c1 97664015 GWHUYSPBEIYWKF-WQRHYEAKSA-N 393.443 2.528 50 40 GFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1ccc(OCC#N)cc1)c1ccccc1 408977084 CULZDHZXORYDIP-CKMDTHJYSA-N 394.431 2.917 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C\c2ccc(OCC#N)c(OC)c2)cc1 408812573 PBEFATRIRYAQOE-BOPFTXTBSA-N 377.400 2.830 50 40 GFGB N#C/C(=C\c1ccc(-c2cc(C(=O)O)cc(C(=O)O)c2)o1)C(=O)N1CCCC1 409372267 MHROMOBYDACWOA-XNTDXEJSSA-N 380.356 2.872 50 40 GFGB COc1cc(/C=N\NC(=O)COc2ccc(Cl)cc2)cc(OC)c1OC 33344689 PHOJSBQQUSIPJO-JMIUGGIZSA-N 378.812 2.895 50 40 GFGB CC(=O)Nc1ccc(C(=O)NN2C(=O)[C@@H](Cl)[C@@H]2/C=C/c2ccccc2)cc1 5663513 VJBMUESHSPZPMA-FWAGDVOXSA-N 383.835 2.821 50 40 GFGB O=C(NNC(=O)N1CCN(c2ccccc2F)CC1)c1ccc(Cl)cc1 8164516 YYDYFIQRTUCBJZ-UHFFFAOYSA-N 376.819 2.656 50 40 GFGB CCOc1ccc(NCC(=O)N/N=C/c2cc(OC)c(OC)c(OC)c2)cc1 993676 JYMWNJNFWGKOHN-WSDLNYQXSA-N 387.436 2.673 50 40 GFGB CCOc1ccc(NC(=O)[C@H]2[C@@H]3C[C@H]4[C@H](OC(=O)[C@@H]42)[C@@H]3Br)cc1 8474748 RYLVDSDJJUYXRX-HGPDSQILSA-N 380.238 2.595 50 40 GFGB O=C(COc1ccc(Br)cc1Cl)NNC(=O)c1ccccc1 3444998 RGYFDRDGHDENRA-UHFFFAOYSA-N 383.629 2.943 50 40 GFGB O=C(Cn1c2ccccc2c(=O)c2ccccc21)N/N=C/c1ccc(O)c(O)c1 4179531 MBRARPOZIJINGL-FSJBWODESA-N 387.395 2.716 50 40 GFGB C=CCN1C(=O)[C@@]2(c3ccccc31)[C@H]1CCCC=C1C(C#N)=C(N)C2(C#N)C#N 20161016 ZNGKIVGFDJUHRB-SBUREZEXSA-N 381.439 2.967 50 40 GFGB COc1ccc(N[C@H](C)C(=O)N/N=C/c2cc(OC)c(OC)c(OC)c2)cc1 662716 OAXXGBPKCOOBQU-LNOXHEFASA-N 387.436 2.672 50 40 GFGB COc1cc(OC)cc(C(=O)N2CCC(C(=O)N/N=C/c3ccccc3)CC2)c1 59953115 ROWIHOBDELPWSQ-HZHRSRAPSA-N 395.459 2.706 50 40 GFGB CCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(OC)c(Cl)c2)cc1 59516246 CIRXJPHFXBAJEO-RGVLZGJSSA-N 375.812 2.836 50 40 GFGB N#C/C(=C\c1ccc(OCc2ccc(C(=O)O)cc2)cc1)C(=O)N1CCOCC1 2198652 QAXYUSADKGYMNZ-CPNJWEJPSA-N 392.411 2.730 50 40 GFGB COc1ccc(CC(=O)N/N=C\c2ccc(O)c(Br)c2)cc1OC 409361097 GQJWOOPAXKUSKA-GRSHGNNSSA-N 393.237 2.865 50 40 GFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)cc1OC 18222757 VXNHGVFHOFYSQD-QGZVFWFLSA-N 375.384 2.763 50 40 GFGB Cc1cc2c(c(=O)n1CCCn1ccnc1)[C@@H](c1ccccc1)C(C#N)=C(N)O2 1471843 OTKVAQBLNGTETR-IBGZPJMESA-N 387.443 2.662 50 40 GFGB C/C(CC(=O)NCc1ccc(Cl)cc1)=N\NC(=O)c1ccc(O)cc1O 100090556 PQYNNONZJQWIQZ-SRZZPIQSSA-N 375.812 2.563 50 40 GFGB O=C(N/N=C1\C(=O)N(Cc2ccccc2)c2ccccc21)c1ccc(/C=N/O)nc1 6229364 USJZESREOVRVJR-DEVPUXRUSA-N 399.410 2.571 50 40 GFGB O=C(COc1ccc(Br)cc1)N/N=C/c1cccc([N+](=O)[O-])c1O 409107910 YBQWKVJFPJWASI-CAOOACKPSA-N 394.181 2.592 50 40 GFGB COC(=O)c1cc(OC)c(OC)cc1N/C=C(/C#N)C(=O)Nc1ccccc1 102673263 XJYSUDRTNRDBPX-SEYXRHQNSA-N 381.388 2.948 50 40 GFGB CC(C)CCN1C(=O)/C(=N\NC(=O)c2ccc3c(c2)OCO3)c2ccccc21 102979347 YMUXYRVFQXPTQM-QOCHGBHMSA-N 379.416 2.942 50 40 GFGB N#C/C(=C/N1CCN(c2ccc(F)cc2)CC1)C(=O)NCCc1ccccc1 102820842 FYBOZOBACQYORK-ZPHPHTNESA-N 378.451 2.714 50 40 GFGB Cc1cc2c(c(=O)n1Cc1ccco1)[C@H](c1ccc([N+](=O)[O-])o1)C(C#N)=C(N)O2 2363800 GHOYPGPZZLTNDG-INIZCTEOSA-N 394.343 2.517 50 40 GFGB CSc1ccc(/C=N/NC(=O)[C@@H](C)N(c2ccccc2)S(C)(=O)=O)cc1 408911896 OWEVSFYDGGTSHG-NFECSFHCSA-N 391.518 2.713 50 40 GFGB Cc1cc2c(c(=O)n1C[C@@H]1CCCO1)[C@H](c1cccc(F)c1)C(C#N)=C(N)O2 4247920 ZYLUYHNECDPIQX-MAUKXSAKSA-N 381.407 2.693 50 40 GFGB C[C@H](Oc1ccc(/C=N/NC(=O)COc2ccccc2Cl)cc1)C(=O)O 4508968 OXCDATFCOXSYJC-QDBSGRMGSA-N 376.796 2.721 50 40 GFGB NC(=O)N/N=C/c1ccc(OCc2ccc([N+](=O)[O-])cc2)c(Br)c1 409383823 JLCHIJXJCGSXAL-QGMBQPNBSA-N 393.197 2.939 50 40 GFGB NNC(=O)c1ccc(OCc2ccc(F)cc2)c(I)c1 216820507 SPCXDGFFDDZALN-UHFFFAOYSA-N 386.164 2.613 50 40 GFGB COc1cc(/C=N/NC(=O)CCC(=O)Nc2ccccc2C)cc(OC)c1OC 1960322 KLNBUJAOWZOWBL-LPYMAVHISA-N 399.447 2.890 50 40 GFGB biogenic,in-vitro O=C(N/N=C/c1ccc(OC2=NS(=O)(=O)c3ccccc32)cc1)c1ccco1 59383484 DIKXKQKPFWZPNC-UDWIEESQSA-N 395.396 2.571 50 40 GFGB Cc1ccc2c(c1Br)/C(=N/NC(=O)C1[C@H]3CCCC[C@@H]13)C(=O)N2 18031950 PALHEPDOGAHVEN-DHHPTOIESA-N 376.254 2.966 50 40 GFGB CCOC(=O)[C@@H](C(C)=O)[C@H](c1cccc(Cl)c1)[C@@H](C#N)C(N)=C(C#N)C#N 78547501 SJRRGLZPTOMYCZ-IXDOHACOSA-N 384.823 2.592 50 40 GFGB CCOc1ccc2ccccc2c1/C=N/NC(=O)CNC(=O)c1cccnc1 2268454 OTLIBMLDXNLDHS-ZMOGYAJESA-N 376.416 2.514 50 40 GFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(C4CC4)c(=O)c32)cc1OC 2430928 GAHBLNQYOVVQRL-GOSISDBHSA-N 379.416 2.727 50 40 GFGB C#CCOc1c(/C=C(\C#N)C(=O)N2CCCC2)cc(Br)cc1OC 409372261 MHMJLXLRUSRQJY-NTEUORMPSA-N 389.249 2.999 50 40 GFGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@H]2CCCC[C@@H]2C(=O)O)c1 4000808 YLWGTLSJKNJWCJ-HOTGVXAUSA-N 376.453 2.536 50 40 GFGB CCOC(=O)/C=C(/CP(=O)(c1ccccc1)c1ccccc1)N1CCOCC1 103431118 RDUYODAUWOZFSX-ZPHPHTNESA-N 399.427 2.780 50 40 GFGB O=C(Cc1cccs1)NC(=S)NNC(=O)c1ccc(Cl)cc1Cl 2370411 PWONFDDREXFSDS-UHFFFAOYSA-N 388.301 2.933 50 40 GFGB CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(Cl)cc2)cc1 7384281 JUOXGAYIXMNSDV-LBPRGKRZSA-N 398.868 2.516 50 40 GFGB COc1ccc(NC(=S)NNC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1 408588646 XNAKCFGHQDYTLK-UHFFFAOYSA-N 392.462 2.713 50 40 GFGB CCN(CC)C(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2)c(OC)c1 408970829 KVOYQVYJZFUESU-HYARGMPZSA-N 383.448 2.593 50 40 GFGB Cc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])cc(Br)c2O)cn1 5342804 HWMHMHWJXBHJAA-REZTVBANSA-N 379.170 2.530 50 40 GFGB O=C(NN/C=C1/C(=O)N(CCC2=CCCCC2)C(=S)N=C1O)c1ccccc1 5025657 KVFBUGRAAWCNBR-DTQAZKPQSA-N 398.488 2.779 50 40 GFGB Cc1cc(Br)cc(/C=N\NC(=O)[C@@H]2COc3ccccc3O2)c1O 13598328 TYTXGDTZSORILQ-CPIUSTHESA-N 391.221 2.753 50 40 GFGB O=C(CSc1nnc(-c2ccco2)o1)NNC(=O)c1ccc(Cl)cc1 2623226 CNTBXIOCHAPHAT-UHFFFAOYSA-N 378.797 2.536 50 40 GFGB COc1ccccc1NCC(=O)NNC(=O)CCC(=O)c1ccc(C)c(C)c1 32883661 SCPAGSKMSASKDL-UHFFFAOYSA-N 383.448 2.534 50 40 GFGB CC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(/C)NNC(=O)c1ccncc1 102655808 JIYIZWKMSIZHRK-WJDWOHSUSA-N 392.444 2.622 50 40 GFGB CCOC(=O)c1ccc(-c2ccc(/C=N/NC(=O)CC3(C)OCCO3)o2)cc1 1079054 GINFPQZLCQZEBX-FYJGNVAPSA-N 386.404 2.727 50 40 GFGB O=C1Nc2c(Cl)cc(Cl)cc2/C1=N/NC(=O)c1ccc([N+](=O)[O-])cc1 6505965 VPNPYIDZFOSQKG-UHFFFAOYSA-N 379.159 2.988 50 40 GFGB O=C(N/N=C/c1ccccc1O)c1nc2ccccc2c(=O)n1Cc1ccccc1 28218114 PUWASVPTSBFBDF-ZVHZXABRSA-N 398.422 2.914 50 40 GFGB C/C(=N\NC(=O)CN(c1ccccc1C)S(C)(=O)=O)c1ccc(Cl)cc1 19954841 VEYGMCZBWNEMTG-XSFVSMFZSA-N 393.896 2.955 50 40 GFGB N#CC(C(=O)COC(=O)c1cc(=O)c2ccccc2o1)=C1Nc2ccccc2N1 2659091 FIFCKKMOSKLNAN-UHFFFAOYSA-N 387.351 2.792 50 40 GFGB C=CCOc1cccc(/C=N/NC(=O)C(=O)Nc2ccc(C(=O)OCC)cc2)c1 59434146 IVMSIYGRFDMNBH-HYARGMPZSA-N 395.415 2.517 50 40 GFGB COc1ccc(CCNC(=O)C/C(C)=N/NC(=O)c2cccs2)cc1OC 100523089 SRYPYPZLBZNSFR-FYJGNVAPSA-N 389.477 2.620 50 40 GFGB C=CCc1cc(/C=N/NC(=O)c2ccc(F)cc2)cc(OC)c1OCC(=O)O 59303241 WDPFEYZQGZMNSW-SSDVNMTOSA-N 386.379 2.790 50 40 GFGB Cc1cc(OCC(=O)NNC(=O)CCc2ccc3c(c2)OCO3)ccc1Cl 12612473 VJICPGDMPUNWLC-UHFFFAOYSA-N 390.823 2.536 50 40 GFGB CN(C)S(=O)(=O)c1ccc(C(=O)NNc2cccc(C(F)(F)F)c2)cc1 14907602 UWOSQRPRGVILBJ-UHFFFAOYSA-N 387.383 2.713 50 40 GFGB CCn1cccc1/C=N\NC(=O)COc1ccccc1I 408939649 TVJYODLQJZRSSZ-YVLHZVERSA-N 397.216 2.642 50 40 GFGB Cc1ccccc1-n1nc(C(=O)N/N=C/c2cccs2)c(C)c(C#N)c1=O 409056467 GTTFJNCOHUROQI-SRZZPIQSSA-N 377.429 2.546 50 40 GFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)c2ccc(OC)cc2OC)cc1 16137108 UDKPZSNYOXHAEJ-LPYMAVHISA-N 385.420 2.847 50 40 GFGB Cc1cc(C)nc(NNC(=O)c2ccc(S(=O)(=O)Nc3ccccc3)cc2)n1 11265757 SERYNTIENVAWCC-UHFFFAOYSA-N 397.460 2.651 50 40 GFGB CCN1C(=O)/C(=N/NC(=O)Cc2ccccc2)c2cc(Br)ccc21 5791775 KYMZUDSZMACTPH-HEHNFIMWSA-N 386.249 2.879 50 40 GFGB C#CCOc1ccc(Br)cc1/C=C(\C#N)C(=O)NCCCOC 408807631 DATVVPBCTBZZIW-GXDHUFHOSA-N 377.238 2.521 50 40 GFGB O=C1NC[C@H](c2ccccc2)[C@H]1C(=O)N/N=C/c1c(Cl)cccc1Cl 4322485 UDIGMDRWTCTARS-YXQRBYMXSA-N 376.243 2.973 50 40 GFGB Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)[C@H](C)n3ccnc3)cc12 40143226 RCYAPUFSRZEYSI-ZDUSSCGKSA-N 394.460 2.614 50 40 GFGB COc1ccc(/C=N\NC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3)C2)c(OC)c1 409154637 HBKATAMTQVDGTG-YSUUHWHMSA-N 381.432 2.515 50 40 GFGB Cc1oc(-c2cccs2)nc1CC(=O)NNC(=O)COc1ccc(F)cc1 29226518 PHDXKKWYAUWBHD-UHFFFAOYSA-N 389.408 2.620 50 40 GFGB COc1ccc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc1Cn1nc(C)cc1C 44790534 MSQVQITWZBPTJJ-CYEGBWLXSA-N 394.475 2.759 50 40 GFGB Cc1cc2c(c(=O)n1C[C@@H]1CCCO1)[C@@H](c1ccccc1F)C(C#N)=C(N)O2 1268758 SPHCTPLOWQTOKR-UGSOOPFHSA-N 381.407 2.693 50 40 GFGB Cn1c(-c2ccc(F)cc2)cnc1SCC(=O)NNC(=O)Cc1ccccc1 924788 CPAHLYBOUREWFL-UHFFFAOYSA-N 398.463 2.708 50 40 GFGB CCCCCCC(=O)NN/C=C1\C(=O)N(CCc2ccccc2)C(=O)N=C1O 38169922 CKTGYQLCFXGQNG-PEZBUJJGSA-N 386.452 2.623 50 40 GFGB COc1cccc(CNC(=O)COC(=O)/C(C#N)=C/c2ccc(N(C)C)cc2)c1 6534405 GWHUYSPBEIYWKF-WOJGMQOQSA-N 393.443 2.528 50 40 GFGB COc1ccc(/C=C(\C#N)C(=O)OCC(=O)Nc2ccc3c(c2)OCCO3)cc1 3221778 XAASVSVSDSKTID-XNTDXEJSSA-N 394.383 2.555 50 40 GFGB COc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)cc1OC 2399221 TYPXYVAUIIVAPY-FZJZADEZSA-N 395.459 2.824 50 40 GFGB COc1cc(/C=N\NC(=O)Cc2ccc(C)cc2)cc(Cl)c1OCC(=O)O 409363591 USIBLRJXOYBMGJ-FBHDLOMBSA-N 390.823 2.813 50 40 GFGB Cc1cccc(-n2nc(C(=O)N/N=C/c3cccs3)c(C)c(C#N)c2=O)c1 409062333 SAJWMNMVTLAXPW-SRZZPIQSSA-N 377.429 2.546 50 40 GFGB O=C(Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 97983112 SUSPWGMMPQBPKI-UHFFFAOYSA-N 378.209 2.539 50 40 GFGB CC1(C)CC(=O)C2=C(C1)N(c1nc[nH]n1)C(N)=C(C#N)[C@@H]2c1ccc(F)cc1 5408214 WNXFBHXHAVLWCR-INIZCTEOSA-N 378.411 2.885 50 40 GFGB CCOC(=O)c1cc(C(=O)N/N=C/c2ccc(OC)c(OC)c2)c(C)nc1C 2696836 VRRZIKILRABGAD-SRZZPIQSSA-N 385.420 2.656 50 40 GFGB O=C(NNC(=O)C1CCCCC1)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1 16839334 ZNCASMFVNLPYGF-UHFFFAOYSA-N 387.867 2.891 50 40 GFGB C/C(=N\NC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(-c2ccccc2F)s1 46414851 DHROZGRGDLZGMT-MKFNJMOCSA-N 380.466 2.829 50 40 GFGB NC1=C(c2nc3ccccc3[nH]2)C(=O)[C@H](Br)N1c1cccc(O)c1 103851951 ZILATKLRLDTELQ-OAHLLOKOSA-N 385.221 2.706 50 40 GFGB CN(C)NC(=O)Nc1ccc2nc(N3C(=O)c4ccccc4C3=O)sc2c1 409143904 OJOVRHMKRNEKEB-UHFFFAOYSA-N 381.417 2.695 50 40 GFGB CCOC(=O)COc1ccc(/C=C(/C#N)C(=O)NC(C)C)cc1Br 408783445 PFWGIADMMRZJSI-QPEQYQDCSA-N 395.253 2.823 50 40 GFGB C=CCN1C(=O)[C@@]2(C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)c2ccccc21 989166 FHXYIGJNHAFDTE-HSZRJFAPSA-N 397.390 2.698 50 40 GFGB COC(=O)COc1ccc(/C=N/NC(=O)CSCc2ccccc2C)cc1 408833188 WMDHBFVEQHMDMJ-SRZZPIQSSA-N 386.473 2.930 50 40 GFGB CCN(CC)Cc1ccc(CNC(=O)NNC(=O)Cc2ccc(F)cc2)cc1 10413024 LFTSCVOXWRDMSM-UHFFFAOYSA-N 386.471 2.741 50 40 GFGB CCOc1ccc(N2C[C@H](C(=O)N/N=C/c3ccccc3OC)CC2=O)cc1 6962946 HNTQKCTUTLWZRW-QLPFJNHISA-N 381.432 2.597 50 40 GFGB CC(=O)Nc1ccc(C(=O)NNC(=O)COc2ccc(Cl)c(C)c2C)cc1 1926725 QZKVUKLWFXJYEC-UHFFFAOYSA-N 389.839 2.755 50 40 GFGB C#CCN1C(=O)/C(=N/NC(=O)CNc2ccc3ccccc3c2)c2ccccc21 18122051 XWGPPXADUKCRNC-XTCLZLMSSA-N 382.423 2.752 50 40 GFGB CC/C(=N\NC(=O)Cc1nc2ccccc2n1C)c1ccc2c(c1)OCCO2 98055016 JUOLVVXNWLPJJK-HZHRSRAPSA-N 378.432 2.818 50 40 GFGB O=C(COc1ccccc1)N/N=C/c1ccc(OCC(=O)N2CCCCC2)cc1 409185378 YBYZKNPZXUOMNN-HZHRSRAPSA-N 395.459 2.607 50 40 GFGB COc1ccc(N(CC(=O)NN=C(C)C)S(=O)(=O)c2ccc(C)cc2)cc1 20059829 NKJLWLYUZILFBU-UHFFFAOYSA-N 389.477 2.711 50 40 GFGB O=C(NNc1ccccc1[N+](=O)[O-])[C@@H]1CCCN(C(=O)Nc2ccccc2)C1 15423306 MKNKSHXINABLSA-CQSZACIVSA-N 383.408 2.982 50 40 GFGB O=C(N/N=C/c1cccs1)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 408851109 IJJUOXMDPXPHQF-CLXYIWAZSA-N 397.909 2.705 50 40 GFGB COc1ccc(OCC(=O)N/N=C\c2cc(Br)c(N(C)C)o2)cc1 408855913 HEHWYKLTGXIILY-NVMNQCDNSA-N 396.241 2.646 50 40 GFGB CC(C)C(=O)Nc1ccc(C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 59514917 KDNAPPGEQLVLMR-VXLYETTFSA-N 399.363 2.861 50 40 GFGB COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(C)n(C[C@H]4CCCO4)c(=O)c32)cc1 2252881 UQKCQZAOQHPMPQ-APWZRJJASA-N 393.443 2.563 50 40 GFGB COc1cc([N+](=O)[O-])cc(/C=C(/C#N)C(=O)NCCCc2ccccc2)c1O 409223238 DTNXQYDLRWBLKK-YBEGLDIGSA-N 381.388 2.965 50 40 GFGB COc1cccc(C(=O)N/N=C/c2cc(Br)cc([N+](=O)[O-])c2O)c1 138299141 QPDPGMUBWRIDRE-CAOOACKPSA-N 394.181 2.835 50 40 GFGB O=C(COc1ccc(C(F)(F)F)cc1)NNC(=O)Cc1c[nH]c2ccccc12 40144411 LRCFZDFVZFCVIC-UHFFFAOYSA-N 391.349 2.956 50 40 GFGB COc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cc2c(c([N+](=O)[O-])c1)OCCO2 85412802 QVYRQKKGHDPAFT-KRWDZBQOSA-N 381.344 2.593 50 40 GFGB CC(=O)c1ccc(Cl)c(S(=O)(=O)NC(=O)/C(C#N)=C\c2ccco2)c1 584907966 XVDDMMHMMOKMGS-GHXNOFRVSA-N 378.793 2.548 50 40 GFGB O=C(N/N=C/c1ccccc1OC(=O)c1ccc2c(c1)OCO2)c1cccnc1 1063910 IPHVNNYQFBEXHC-FSJBWODESA-N 389.367 2.793 50 40 GFGB Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNc3ccc(F)cc3)C2)s1 32903820 UODKMRIEWFJBKJ-ZDUSSCGKSA-N 397.497 2.740 50 40 GFGB C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1ccc(F)cc1 12891599 BGWVDONHWHZHSQ-CYBMUJFWSA-N 388.420 2.756 50 40 GFGB COc1cc(N2CCCC2)c(OC)cc1/C=N/NC(=O)c1cccc([N+](=O)[O-])c1 409107154 QMEINQQNNZJYRL-FYJGNVAPSA-N 398.419 2.976 50 40 GFGB CCn1c(NNC(=O)/C=C/c2cc(OC)cc(OC)c2)nc2ccccc2c1=O 32754794 AURGTUWJDLTHRB-MDZDMXLPSA-N 394.431 2.590 50 40 GFGB O=C(COc1cccc(Br)c1)N/N=C/c1ccc2c(c1)OCO2 3149908 VIDBRWWRINYVKE-QGMBQPNBSA-N 377.194 2.707 50 40 GFGB CNNC(=O)c1ccc(NC(=O)CSc2nc3ccccc3nc2C)cc1 16265522 AVFAGFILKGJMFF-UHFFFAOYSA-N 381.461 2.533 50 40 GFGB CCc1ccc(NC(=O)C(=O)N/N=C(\C)CC(=O)Nc2ccc(OC)cc2)cc1 4416527 CJSCDVGZLMOFLO-ZVHZXABRSA-N 396.447 2.717 50 40 GFGB C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc2cc(C)cc(C)c2[nH]c1=O 4131454 AORKXGUQOWHDQU-SFHVURJKSA-N 391.427 2.956 50 40 GFGB C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cccc(F)c1 12816262 QYNGSALUUINWPU-SNVBAGLBSA-N 381.201 2.817 50 40 GFGB COc1ccc(OC)c([C@H]2NC(=O)NC(C)=C2C(=O)OCCCCCl)c1 4064534 PZUFAZSMHNKLJJ-MRXNPFEDSA-N 382.844 2.894 50 40 GFGB CCOc1ccccc1NC(=O)[C@H]1[C@H]2C(=O)O[C@H]3[C@@H]2C[C@H]1[C@H]3Br 408689145 XRTBCIFPTLVWJL-UPOJRHOVSA-N 380.238 2.595 50 40 GFGB COc1ccc(/C=N/NC(=O)Cc2ccc3c(c2)OCO3)cc1Br 409085143 YTFYDNHPPQMXOP-DJKKODMXSA-N 391.221 2.879 50 40 GFGB C[C@H](Oc1ccccc1Cl)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1F 12984047 XVQYHRDFNRFMPG-NWDGAFQWSA-N 380.803 2.861 50 40 GFGB CCOC(=O)Cn1c(C)c(/C=N/NC(=O)[C@@H](O)c2ccccc2)c2ccccc21 14134692 FTGUOSAHSUPMEP-DUYDGHCJSA-N 393.443 2.697 50 40 GFGB CCNc1nc2[nH]c(=O)c3c(c2s1)OC(N)=C(C#N)[C@H]3c1ccc(OC)cc1 15082505 HWXYWALLTRGMGC-GFCCVEGCSA-N 395.444 2.643 50 40 GFGB N#Cc1ccc(/C=N/NC(=O)c2ccccc2I)cc1 1507628 SRSVBSIDXFTBKO-VCHYOVAHSA-N 375.169 2.927 50 40 GFGB N#CC(C(=O)COC(=O)/C=C/c1ccc2c(c1)OCO2)=C1Nc2ccccc2N1 3282543 IHVUXSUDCRKTKU-SOFGYWHQSA-N 389.367 2.814 50 40 GFGB COc1ccc(N2C(N)=C(C#N)C(C#N)(C#N)[C@@H]2c2cccc([N+](=O)[O-])c2)cc1 1825475 RFHSTAWCVDYMAA-SFHVURJKSA-N 386.371 2.892 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(C)cc2Cl)ccc1OCC(=O)O 409051248 JREMJIQPUSGFII-AWQFTUOYSA-N 376.796 2.884 50 40 GFGB O=C(Cn1c2ccccc2c(=O)c2ccccc21)N/N=C/c1ccc([N+](=O)[O-])o1 408735366 OXPFCHVJXGWHFW-SRZZPIQSSA-N 390.355 2.806 50 40 GFGB O=C(NNS(=O)(=O)c1c(F)cc(F)cc1Br)C1CCCCC1 9386658 SFXBRFCREDKAFL-UHFFFAOYSA-N 397.241 2.617 50 40 GFGB O=C(/C=C/c1ccc(F)cc1)NC(=S)NNC(=O)[C@H]1C[C@@H]1c1ccccc1 5033035 KCLJFVMVZBCLNP-MXDRFRHJSA-N 383.448 2.665 50 40 GFGB CN(CC(=O)N/N=C\c1cccs1)S(=O)(=O)c1ccc2ccccc2c1 16187539 FRRKZWHMTJCHRK-UNOMPAQXSA-N 387.486 2.672 50 40 GFGB C/C(CC(=O)Nc1ccc(Cl)c(Cl)c1)=N/NC(=O)C[n+]1ccccc1 5503131 YLIFYQBWKRNFFU-MTJSOVHGSA-O 380.255 2.802 50 40 GFGB CN(CCCl)C[C@@H]1O[C@H](c2ccccc2)O[C@@H]2[C@@H]3OC(C)(C)O[C@H]3O[C@H]12 4801878 CZXLGGHMQXFZRL-ONTMVUMWSA-N 383.872 2.516 50 40 GFGB COCCOc1ccccc1C(=O)NNC(=O)c1ccc(OCC(C)C)cc1 12138188 PNOOWASLPUUQPO-UHFFFAOYSA-N 386.448 2.821 50 40 GFGB O=C(NN[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1=O)c1ccc(Cl)cc1 100572056 DMAGIWGHCDMFQH-AWEZNQCLSA-N 378.215 2.560 50 40 GFGB COc1cc(/C=N/NC(=O)COc2cccc3cccnc23)ccc1OC(C)=O 408764476 TZGLMTVBPVNVSA-FSJBWODESA-N 393.399 2.698 50 40 GFGB COc1cc(OC)c(/C=N\NC(=O)c2ccccc2O)cc1Br 33333586 CISYVFJTYWIKRN-NVMNQCDNSA-N 379.210 2.936 50 40 GFGB C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@H](C)Oc1ccccc1Cl 12984049 XVQYHRDFNRFMPG-RYUDHWBXSA-N 380.803 2.861 50 40 GFGB CCOC(=O)[C@H]1C[C@@H](Cl)[C@H]([S@@](=O)c2ccccc2)C[C@@H]1C(=O)OCC 12413117 CMYFIVFGISYXSM-RLUSJJAASA-N 386.897 2.923 50 40 GFGB C/C(=N\NC(=O)CN(c1ccc(C)c(C)c1)S(C)(=O)=O)c1ccc(C)cc1 408772456 LSIBJQWXJAFKAN-HEHNFIMWSA-N 387.505 2.918 50 40 GFGB Cc1occc1C(=O)NNC(=O)[C@@H]1CCCN(c2nc3ccccc3s2)C1 40140402 ISNLGBMAPUYWMC-CYBMUJFWSA-N 384.461 2.875 50 40 GFGB Cc1cc(C(F)F)nn1[C@H](C)C(=O)N/N=C\c1ccn(CC(F)(F)F)n1 253406575 UTAKZABWYGVPKQ-SEFZHCMGSA-N 378.305 2.599 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccn2)ccc1OCc1ccc(C(=O)O)o1 8207143 BGVSZKNRZMIPNZ-SSDVNMTOSA-N 395.371 2.724 50 40 GFGB CCN(CC)CN1C(=O)/C(=N\NC(=O)c2ccc(N(C)C)cc2)c2ccccc21 20292437 HJIAAINLFKUZIR-ATJXCDBQSA-N 393.491 2.533 50 40 GFGB CCOc1ccc2[nH]c(=O)c([C@H]3C(C#N)=C(N)OC4=C3C(=O)CCC4)cc2c1 876554 RYROGWBFHWMKAW-SFHVURJKSA-N 377.400 2.742 50 40 GFGB I[C@@H]1[C@@H]2[C@@H]3[C@@H](I)[C@@H]4[C@@H]5[C@H]3[C@H]1[C@H]5[C@@H]24 104282167 CTOZWVMTSCJSMU-HUNDITLASA-N 383.998 2.591 50 40 GFGB COc1ccc(Cl)cc1C(=O)NNC(=S)NC(=O)c1ccc(F)c(F)c1 2363126 XUOWBMHCOFPKBB-UHFFFAOYSA-N 399.806 2.576 50 40 GFGB O=C(C[C@@H]1CCS(=O)(=O)C1)N/N=C1/C[C@@H](c2ccccc2)Oc2ccccc21 38323569 YYIFVMHODGLJNA-CWJMMFKHSA-N 398.484 2.856 50 40 GFGB COc1cc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)ccc1O 831207 WWYDXWLISLARGD-GIJQJNRQSA-N 375.406 2.693 50 40 GFGB CC(=O)Nc1cccc(C(=O)N/N=C/c2ccc(O)c(Br)c2)c1 6293859 NCUOVCNJCPRESN-GIJQJNRQSA-N 376.210 2.877 50 40 GFGB CN(C)c1ccc(/C=N/NC(=O)C(=O)Nc2cccc(Br)c2)cc1 59515640 ROGJVUMHYTZUIS-YBFXNURJSA-N 389.253 2.604 50 40 GFGB O=C(N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O)c1ccc(F)cc1 5177078 VQIGSBZJQICQRJ-REZTVBANSA-N 382.145 2.966 50 40 GFGB COc1ccc(/C=N/NC(=O)C2CCN(C(=O)c3ccccc3)CC2)cc1OC 409004408 CNKMLHLCWXOMCF-HZHRSRAPSA-N 395.459 2.706 50 40 GFGB CCOc1cc(/C=N\NC(=O)[C@@H]2COc3ccccc3O2)cc(Cl)c1O 31871160 GELNCYIAVWIUJC-DMOKECBHSA-N 376.796 2.734 50 40 GFGB O=C1S[C@H](Nc2ccc(I)cc2)C(=O)N1CCCl 36626566 LYBOYNQAODWMEA-VIFPVBQESA-N 396.637 2.963 50 40 GFGB O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)N/N=C/c1cccs1 19682723 BKIPBAVVQAIHHA-UDWIEESQSA-N 376.913 2.669 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccc2C)cc(Cl)c1OCC(=O)O 9200772 YPBRLAMVOUBVDA-AWQFTUOYSA-N 376.796 2.884 50 40 GFGB C=C(C)C(=O)OCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1ccccc1F 2276073 SOSKDNLMQSFZOY-QGZVFWFLSA-N 386.379 2.570 50 40 GFGB CCCC1=C(C(=O)OCC)[C@H](c2cc(OC)c3c(c2)OCO3)C(C#N)=C(N)O1 2247690 PFNNZORRJCQLGC-MRXNPFEDSA-N 386.404 2.849 50 40 GFGB CC(C)(C)c1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1 408614793 ICWSIXXOBBAZAO-OAHLLOKOSA-N 397.450 2.937 50 40 GFGB CC(C)c1ccc(/C=N/NC(=O)CN(c2cccc(F)c2)S(C)(=O)=O)cc1 409109549 HCTMARRSVADQAP-CIAFOILYSA-N 391.468 2.865 50 40 GFGB O=C(CNc1ccc(F)cc1)N/N=C/c1cccc(I)c1 409356094 DXDAVMCQURBGTQ-DJKKODMXSA-N 397.191 2.993 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)ccc1OCC(=O)OC 408798788 WYFZINRFNYSWEC-XNTDXEJSSA-N 396.399 2.888 50 40 GFGB COC[C@@H](C)NC(=O)COC(=O)/C(C#N)=C/c1cc(C)n(CCC(C)C)c1C 32944997 ZMEWTCKMBBUTGO-GDXCHIGESA-N 389.496 2.752 50 40 GFGB N#Cc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1 7404854 AHMQLSCEXAPQHJ-UHFFFAOYSA-N 375.475 2.512 50 40 GFGB Cc1c(/C=C(/C#N)C(=O)NC(N)=O)c2ccccc2n1Cc1ccccc1C#N 409240163 JWZAHTIROCHHNR-YVLHZVERSA-N 383.411 2.972 50 40 GFGB COc1cccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)c1OC 409168407 MEHGTOLGRKAFPL-UXHMZNKVSA-N 395.459 2.824 50 40 GFGB Cc1ccc(S(=O)(=O)N[C@H](C(=O)N/N=C/c2ccc(F)cc2)C(C)C)cc1 408756317 YWJIRRKEFADMBK-IUOVYFEOSA-N 391.468 2.587 50 40 GFGB CCOC(=O)C1=C(CCl)NC(C)=C(C(=O)OC)[C@H]1c1cccc([N+](=O)[O-])c1 34241691 JYPZKAWYVKYCOE-OAHLLOKOSA-N 394.811 2.785 50 40 GFGB biogenic CN(CC(=O)N/N=C/c1cccc2ccccc12)S(=O)(=O)c1ccccc1 6544586 HWINBCGYXZTOSX-KGENOOAVSA-N 381.457 2.611 50 40 GFGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 33906507 RKFUNKZSIWOQGA-VXLYETTFSA-N 385.336 2.615 50 40 GFGB Cc1occc1C(=O)NNC(=O)[C@H]1CC(c2ccc(Cl)cc2Cl)=NO1 54884139 FVFOUPMQBGIHCO-CQSZACIVSA-N 382.203 2.849 50 40 GFGB Cc1ccc(C)c(NC(=O)CCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2O)c1 35812673 JAQZBYQVFMGKSB-RGVLZGJSSA-N 384.392 2.786 50 40 GFGB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C/NNC(=O)c1ccc([N+](=O)[O-])cc1 4413354 MFYZEXLJPKPEMJ-WOJGMQOQSA-N 393.403 2.753 50 40 GFGB O=C(N/N=C/c1cc2cc3c(cc2[nH]c1=O)OCCO3)[C@@H]1C[C@@H]1c1ccccc1 16007013 BLSQYRCXVHCDSQ-RFTFHOITSA-N 389.411 2.553 50 40 GFGB COC(=O)c1ccc(NC(=O)COc2ccc(C=C(C#N)C#N)cc2OC)cc1 873383 WDYVFUADIQQITI-UHFFFAOYSA-N 391.383 2.930 50 40 GFGB Cn1c(SSc2nc(=O)c3ccccc3n2C)nc(=O)c2ccccc21 3077653 KOGDAXPYBZCNNG-UHFFFAOYSA-N 382.470 2.980 50 40 GFGB CCN1C(=O)/C(=N/NC(=O)c2cc(Br)ccc2O)c2ccccc21 100192281 DMFKYVQLUXGTFM-XDJHFCHBSA-N 388.221 2.655 50 40 GFGB CNC(=O)C(=O)N/N=C/c1cc(Br)ccc1Nc1cccc(C)c1 408706975 GDKKAPATFQAGLD-KEBDBYFISA-N 389.253 2.697 50 40 GFGB Cc1ccc(S(=O)(=O)N(C)CC(=O)NNc2cccc(Cl)c2)cc1C 30615874 ZOCIYEHREBLEEU-UHFFFAOYSA-N 381.885 2.721 50 40 GFGB C/C(CC(=O)Nc1ccc(Cl)c(Cl)c1)=N\NC(=O)C[n+]1ccccc1 16957799 YLIFYQBWKRNFFU-CIAFOILYSA-O 380.255 2.802 50 40 GFGB Cc1ccc2nc(SCC(=O)NNC(=O)c3ccccc3)c(C#N)cc2c1 1222328 FHJJRACLOIIJAP-UHFFFAOYSA-N 376.441 2.968 50 40 GFGB COc1ccc(/C=C(/C#N)C(=O)NC[C@@H]2CCCO2)cc1Cn1nc(C)cc1C 17080613 MSQVQITWZBPTJJ-JYWRCUDFSA-N 394.475 2.759 50 40 GFGB COc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc(C)n(C[C@H]3CCCO3)c(=O)c21 2246979 QVSCHRZXAANOFC-KUHUBIRLSA-N 393.443 2.563 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)c1 409159118 QATZQKOJPHZZRE-UXHMZNKVSA-N 395.459 2.824 50 40 GFGB CCOc1cc(/C=N/NC(N)=O)ccc1OCCCOc1cccc(OC)c1 4600261 HDBUWXWBEKEAKN-HYARGMPZSA-N 387.436 2.944 50 40 GFGB CC(C)c1ccc(/C=N/NC(=O)CN(c2ccc(F)cc2)S(C)(=O)=O)cc1 408781318 BKDYBVKQCUYSIG-CIAFOILYSA-N 391.468 2.865 50 40 GFGB CC(C)(C)c1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 408614811 IITIPAVTNAFXJB-MRXNPFEDSA-N 379.460 2.798 50 40 GFGB C[C@H](NC(=O)Nc1ccccc1)C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 40161104 OITSVIVEPFMYAH-AWEZNQCLSA-N 382.464 2.955 50 40 GFGB C[C@H]1CCc2sc(C(=O)NNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)cc2C1 43934300 GFUNDNBXCCVIQG-WDEREUQCSA-N 381.498 2.547 50 40 GFGB O=C(CN1CCN(Cc2ccccc2Cl)CC1)N/N=C/C=C\c1ccco1 96307069 FAIPPBJHVWAHBS-LKOHMNKRSA-N 386.883 2.866 50 40 GFGB CCN(CC)c1ccc2cc(C(N)=O)/c(=N/NC(=O)c3cccs3)oc2c1 3198298 DUMBXYNDUQFRNR-QOCHGBHMSA-N 384.461 2.685 50 40 GFGB C=CCn1c(CNc2ccccc2)nnc1SCC(=O)N/N=C/c1ccco1 695720 LOSDNYYBDYPBAA-CIAFOILYSA-N 396.476 2.912 50 40 GFGB CC(C)=NNC(=O)CN(CCc1ccccc1)S(=O)(=O)c1ccc(C)cc1 59515887 HQBDREXZMOLOHG-UHFFFAOYSA-N 387.505 2.740 50 40 GFGB CCOc1cc(/C=N/NC(=O)CNC2CCCCC2)cc(Br)c1O 409388393 UZVGIZISAWGBDQ-KEBDBYFISA-N 398.301 2.926 50 40 GFGB N#CCC(=O)N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 4513356 BIZQMSXDLCXZAX-CAOOACKPSA-N 377.154 2.981 50 40 GFGB COc1ccc(C(=O)NNC(=O)c2cccc(NC(=O)c3ccco3)c2)cc1 4682245 TYKUPXMDSUIGMY-UHFFFAOYSA-N 379.372 2.615 50 40 GFGB COc1c([C@H]2C(C#N)=C(N)Oc3cc(N(C)C)ccc32)cc2c(c1OC)OCO2 35325986 JHAPKZPCYGOREM-KRWDZBQOSA-N 395.415 2.717 50 40 GFGB COC(=O)COc1c(Cl)cc(/C=C(/C#N)C(=O)NC2CCCC2)cc1OC 409193062 HRHUWURHOPVFHZ-QPEQYQDCSA-N 392.839 2.866 50 40 GFGB Cc1cccc(/C=N/NC(=O)Cc2nnc(NC(=O)c3ccccc3)s2)c1 17160261 ZYAYJKHZIGNDIV-UDWIEESQSA-N 379.445 2.792 50 40 GFGB Cc1cc(I)cc(/C=N/NC(=O)c2ccccc2O)c1O 4827663 REOFJHIDMAIHNW-CAOOACKPSA-N 396.184 2.775 50 40 GFGB Cc1ccccc1OCC(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c1cccc(O)c1 408971685 JLMTXEMIOATKLE-QMFLXTPQSA-N 397.475 2.761 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2ccccc2Cl)S(C)(=O)=O)cc1C 408778447 GBKXWQHTRAXJAY-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB O=C(N/N=C\c1cc(Br)cc([N+](=O)[O-])c1O)c1ccccc1O 96921097 BHORJYIKSANAES-APSNUPSMSA-N 380.154 2.532 50 40 GFGB C/C(=N\NC(=O)CN(c1ccc(C)cc1)S(C)(=O)=O)c1ccc(Cl)cc1 19954618 XFQMGQBQDMWVOC-XSFVSMFZSA-N 393.896 2.955 50 40 GFGB C[C@H](Oc1ccc(Cl)cc1Br)C(=O)NNC(=O)c1ccco1 12868993 QFLJUXGMBKBWDC-QMMMGPOBSA-N 387.617 2.924 50 40 GFGB Cc1cc(C(=O)NNC(=O)c2ccccc2SCC(=O)NC(C)C)c(C)o1 8036341 QPOOHNHCIDQJLX-UHFFFAOYSA-N 389.477 2.588 50 40 GFGB COc1ccc(Br)cc1C(=O)N/N=C/c1ccc(O)c([N+](=O)[O-])c1 408905590 ZPDHWFNYYRGIRJ-CAOOACKPSA-N 394.181 2.835 50 40 GFGB O=C(N/N=C/c1cc(Cl)ccc1O)c1ccn(Cc2ccc([N+](=O)[O-])cc2)n1 1089295 ZGOBWZWEKBHYKY-KEBDBYFISA-N 399.794 2.963 50 40 GFGB Cc1cccc[n+]1[C@@H]1[C@@H](c2ccccc2)C(C#N)=C([C-](C#N)C#N)N[C@]1(O)C1CC1 100023582 BHQKVVGNCAIGEQ-QTJGBDASSA-N 395.466 2.709 50 40 GFGB CN(NC(=O)/C=C/c1cccc(C(F)(F)F)c1)c1cnn(C)c(=O)c1Cl 40155336 MLMUEKUXNSMPLQ-VOTSOKGWSA-N 386.761 2.633 50 40 GFGB CCOc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(OCC)cc3)C2)cc1 6962049 OIJFNFWUFLQHSH-DMGPTTAYSA-N 395.459 2.987 50 40 GFGB O[C@]12[C@@H](Br)[C@H]3[C@H]4C[C@H]5[C@@H]3[C@@H]1C(Br)(Br)[C@@H]5[C@H]42 100019693 WZBOKYFPZUQGLI-QXLQIKPOSA-N 398.920 2.739 50 40 GFGB Cc1nc2c(cnn2C(C)C)c(C)c1CCC(=O)NNC(=O)Cc1ccccc1 26862223 MEHXMKNBRWMEMR-UHFFFAOYSA-N 393.491 2.952 50 40 GFGB Cc1cc(S(=O)(=O)NNC(=O)Nc2ccc3c(c2)OCO3)c(C)cc1Cl 13323936 PFXYZGLBRVZNMM-UHFFFAOYSA-N 397.840 2.701 50 40 GFGB CNC(=O)C(=O)N/N=C/c1ccccc1OCc1ccc(Cl)c(Cl)c1 408610636 OQNBQLQTSFKANG-ZVBGSRNCSA-N 380.231 2.769 50 40 GFGB CCOc1ccc(/C=N\NC(=O)C(=O)Nc2ccc(Cl)cc2)cc1OC 223149984 OPCXYNHDVJZHOY-JAIQZWGSSA-N 375.812 2.836 50 40 GFGB Cc1ccccc1OCC(=O)N/N=C1\C(=O)N(CCCC#N)c2ccccc21 6208332 IDUZQUDGIYEWBE-GFMRDNFCSA-N 376.416 2.545 50 40 GFGB CC(C)(CC(=O)NNC(=O)c1ccccn1)CC(=O)Nc1ccc(Cl)cc1 199421994 XTYWWZUCIMSDEL-UHFFFAOYSA-N 388.855 2.941 50 40 GFGB O=C1[C@@H]2[C@H]3C[C@@H]([C@H](Br)[C@@H]3Br)[C@@H]2C(=O)N1c1ccccc1 245377318 JNUMSHAQCAUPTM-HKLHZYFVSA-N 399.082 2.969 50 40 GFGB Cc1ccc(C(=O)NC(=S)NNC(=O)c2ccc(Cl)cc2)cc1[N+](=O)[O-] 6846513 PUXZNGZYFYRWSU-UHFFFAOYSA-N 392.824 2.506 50 40 GFGB COc1ccc(N[C@@H](C)C(=O)N/N=C/c2cc(OC)c(OC)c(OC)c2)cc1 662713 OAXXGBPKCOOBQU-XMOVILSBSA-N 387.436 2.672 50 40 GFGB C/C(CC(=O)Nc1ccccc1Br)=N\NC(=O)c1cccnc1 100089679 RWRWSFZHPOLXOX-RGVLZGJSSA-N 375.226 2.979 50 40 GFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccccc3Br)[C@@H]2C1 35895452 JYWYZPCDJFDJOE-WBVHZDCISA-N 394.276 2.804 50 40 GFGB COc1ccc(/C=N/NC(=O)c2n[nH]c3c2CCc2ccccc2-3)cc1OC 8683428 FJVRNILHLSRSBJ-WSDLNYQXSA-N 376.416 2.956 50 40 GFGB Cc1cc2c(c(=O)n1CCN(C)C)[C@H](c1ccccc1Cl)C(C#N)=C(N)O2 2253727 KUDRFKLMVUZVHN-QGZVFWFLSA-N 384.867 2.590 50 40 GFGB COc1ccc(NC(=O)C(=O)N/N=C/c2cccc3ccccc23)cc1OC 59459665 LVBCODNMRNKJFM-LPYMAVHISA-N 377.400 2.946 50 40 GFGB CCOC(=O)CSC1=C(C#N)[C@@H](c2ccc(C)cc2)[C@H](C(=O)OC)C(O)=N1 2310477 MRGOIXJTSQMIPQ-CVEARBPZSA-N 388.445 2.869 50 40 GFGB CCCC[C@@H](CCC(=O)NNC(=O)c1ccccc1Br)C(=O)O 2340078 NRTYFPNEWCDGAT-NSHDSACASA-N 385.258 2.881 50 40 GFGB CCC[C@H](C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccccc1 12918360 YNNGNBIUZVLMJI-KRWDZBQOSA-N 378.432 2.923 50 40 GFGB Cc1ccccc1C(=O)Nc1nnc(CC(=O)N/N=C/c2cccs2)s1 4511418 DPFRSEORCFVJIP-VCHYOVAHSA-N 385.474 2.853 50 40 GFGB CCCOc1ccc(/C=N\NC(=O)[C@@H]2CC(=O)N(c3ccc(OC)cc3)C2)cc1 409271525 MCCWVPLIQGJNRH-NQRZERFFSA-N 395.459 2.987 50 40 GFGB Cc1cc(Br)cc(/C=N\NC(=O)[C@H]2COc3ccccc3O2)c1O 13598331 TYTXGDTZSORILQ-XXZGICNZSA-N 391.221 2.753 50 40 GFGB COc1cc2c(cc1OC)[C@H](C1C(=O)CC(C)CC1=O)N(C(=O)CCl)CC2 17835598 FIUXBGOBUVXMRB-ULAOFWDASA-N 393.867 2.553 50 40 GFGB CCc1nc(SCC(=O)NNC(=O)c2ccc(OC)cc2)c2ccccc2n1 1332526 ZAQWDOVEFXKWFO-UHFFFAOYSA-N 396.472 2.754 50 40 GFGB COc1ccc(OC)c(NC(=O)C(=O)N/N=C/c2ccccc2C(F)(F)F)c1 59433837 FAVNDANBBCQUJS-LSHDLFTRSA-N 395.337 2.811 50 40 GFGB COc1ccc(C(=O)N/N=C/c2cc3c(cc2Br)OCCO3)cc1 13014141 NVHFLBWWLJRPTB-VXLYETTFSA-N 391.221 2.993 50 40 GFGB Cc1cc2c(c(=O)n1Cc1ccccn1)[C@H](c1ccc(O)cc1)C(C#N)=C(N)O2 5324382 RDEMDHYQQTZXKZ-LJQANCHMSA-N 386.411 2.524 50 40 GFGB C/C(CC(=O)Nc1cccc([N+](=O)[O-])c1)=N\NC(=O)c1ccc([N+](=O)[O-])cc1 16137096 YLYBZHWUKRKMKW-YBFXNURJSA-N 385.336 2.638 50 40 GFGB O[C@]12[C@@H](Br)[C@@H]3[C@@H]4[C@@H]5C[C@@H]3[C@@H]1[C@@H]5C(Br)(Br)[C@H]42 253476502 WZBOKYFPZUQGLI-UWGYQBDASA-N 398.920 2.739 50 40 GFGB O=C(COc1ccccc1)NN=C1CSc2sc(=O)sc2SC1 4565487 XIIXCDNFOQAISP-UHFFFAOYSA-N 384.529 2.919 50 40 GFGB O=C(NNc1ncnc2c1cnn2-c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 9518717 VUUYYSJYCSOHCE-UHFFFAOYSA-N 393.338 2.620 50 40 GFGB COc1cc([C@@H]2C(C#N)=C(N)N(N(C)C)C3=C2C(=O)CC(C)(C)C3)ccc1O 1440868 WNULWQDVXSBGLN-GOSISDBHSA-N 382.464 2.614 50 40 GFGB COc1cc(Br)c(O)c(/C=N/NC(=O)CNc2ccc(F)cc2)c1 408692200 GYLAZESTDQIYMD-DNTJNYDQSA-N 396.216 2.865 50 40 GFGB Cc1ccc(/C=N\NC(=O)CN(C)S(=O)(=O)c2ccc3ccccc3c2)cc1 35394739 IRHSCFUIYMFSNO-HMAPJEAMSA-N 395.484 2.919 50 40 GFGB O=C(CCl)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)CCl)cc1C2=O 5765880 UOWJONPWYDMJFO-UHFFFAOYSA-N 391.210 2.817 50 40 GFGB O=C(NN/C=C1/C(=O)N(c2ccc(Cl)cc2)C(=O)N=C1O)c1ccccc1 9013751 BWJIADMYNBZHQN-GXDHUFHOSA-N 384.779 2.582 50 40 GFGB CCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2ccc(OC(C)C)cc2)c1C 17293678 RJYJNNNTTPYJEX-UHFFFAOYSA-N 387.436 2.670 50 40 GFGB Cc1cccc(Cn2cc(/C=N\NC(=O)CN3CCOCC3)c3ccccc32)c1 59246487 MSJFLJAYLCVUJM-OYKKKHCWSA-N 390.487 2.780 50 40 GFGB C=CCc1cc(/C=N/NC(=O)c2ccc(OC)cc2)cc(OC)c1OCC(=O)O 59247923 HNAFTHYYAUENIV-WSDLNYQXSA-N 398.415 2.660 50 40 GFGB COc1cccc(/C=N/NC(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)c1O 409004429 CVPTXGVJSFLICZ-YDZHTSKRSA-N 399.422 2.542 50 40 GFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1ccc(O)c(OC)c1)c1ccccc1 408980509 ROMRAFGNSYVELF-REIAIGDLSA-N 385.420 2.728 50 40 GFGB O=C(Cc1ccc2c(c1)OCO2)N/N=C/c1ccc(O)c(Br)c1 409159830 AFZPELFUZFRLAT-QGMBQPNBSA-N 377.194 2.576 50 40 GFGB CCOc1cc2c(cc1/C=N\NC(=O)COc1ccc(Cl)cc1)OCO2 409102589 YUMAIZWQEVSDFD-UKWGHVSLSA-N 376.796 2.997 50 40 GFGB O=C(O)c1cccc(-n2cccc2/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)c1 409100244 VPZOEBPDQUERFM-UDWIEESQSA-N 378.344 2.848 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)NC(C)C)ccc1OCc1ccccc1 8217951 REAXYMBZCMZNKP-LPYMAVHISA-N 383.448 2.639 50 40 GFGB O=C(O)CSC/C(=N/NC(=O)c1ccc(Br)o1)c1ccccc1 18194401 SGDHDWNUCIPDFY-BOPFTXTBSA-N 397.250 2.994 50 40 GFGB Cc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCc3ccco3)c2C)cc1 7918632 IDGXLJBDLFCKDY-FSJBWODESA-N 378.432 2.762 50 40 GFGB Cc1ccc2c(c1Br)/C(=N/NC(=O)C1[C@@H]3CCCC[C@@H]13)C(=O)N2 100505630 PALHEPDOGAHVEN-NXEZZACHSA-N 376.254 2.966 50 40 GFGB O=C(Cc1csc(N2CCOCC2)n1)N/N=C/c1ccc(C(F)(F)F)cc1 3360576 ZHXVSCBJIVQABK-UFFVCSGVSA-N 398.410 2.691 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccc2Cl)ccc1O[C@@H](C)C(=O)O 409009309 DBUYHSXMJTVDAB-KKBVUKDESA-N 376.796 2.964 50 40 GFGB Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2)c1 12764822 QBHGQVVZNUDWOG-AWEZNQCLSA-N 376.840 2.951 50 40 GFGB CCOc1ccc(NC(=O)[C@@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)cc1 102620410 RYLVDSDJJUYXRX-YRKSKIDTSA-N 380.238 2.595 50 40 GFGB Cc1cccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(Cl)cc3)CC2=O)c1C 7882396 CRSWLECZZBCILI-HNNXBMFYSA-N 385.851 2.771 50 40 GFGB Cc1ccccc1C(=O)N1CCC(C(=O)N/N=C/c2ccccc2[N+](=O)[O-])CC1 409006141 MOQWCBTWYOMMLV-HYARGMPZSA-N 394.431 2.906 50 40 GFGB O=C(NNc1nc(N2CCCCC2)nc(N2CCCCC2)n1)c1ccccc1 17379930 ZKOUOULSHHQRIJ-UHFFFAOYSA-N 381.484 2.609 50 40 GFGB CCOc1cc2c(cc1/C=N/NC(=O)COc1ccccc1Cl)OCO2 409102383 ZDXRZVOWMGQKPL-AWQFTUOYSA-N 376.796 2.997 50 40 GFGB O=C(COc1cccc2ccccc12)N/N=C\c1ccc(N2CCOCC2)o1 409020832 UMOXSQPBJUZZGF-HMAPJEAMSA-N 379.416 2.799 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)Nc2ccccc2Cl)ccc1OCC(N)=O 8112946 UFCKCEAPUGSQSR-MDWZMJQESA-N 385.807 2.758 50 40 GFGB C/C(CC(=O)NC1CCCCC1)=N\NC(=O)C(=O)Nc1cccc(Cl)c1C 5378357 KOZSOHJNEKFCFS-FSJBWODESA-N 392.887 2.918 50 40 GFGB COc1cccc([C@@H]2CC(=O)N3C(=C2C#N)SC[C@@]3(O)c2ccco2)c1OC 12275685 QDJDZSCVFWBMRU-RNODOKPDSA-N 398.440 2.940 50 40 GFGB O=C(N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc(Br)cc1 710969 YTEILZHOWSGIQF-REZTVBANSA-N 392.165 2.850 50 40 GFGB Nc1ncc(C[PH](c2ccccc2)(c2ccccc2)c2ccccc2)c(N)n1 104169857 ISMUQQSIHLTPDY-UHFFFAOYSA-N 386.439 2.867 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])cc(Br)c1O)c1ccc(F)cc1 9190233 PCRHPEIZSRJCHV-REZTVBANSA-N 382.145 2.966 50 40 GFGB C/C(=N\NC(=O)c1cc(Br)c[nH]1)c1ccc(N2CCOCC2)cc1 7862988 APFVMUVOQZZDTM-UDWIEESQSA-N 391.269 2.768 50 40 GFGB O=C(Cc1cccc(C(F)(F)F)c1)N/N=C\c1ccc(N2CCOCC2)o1 409013127 MOIDXUIJAHTAGR-UUYOSTAYSA-N 381.354 2.828 50 40 GFGB N#C/C(C(N)=O)=C1/C(=O)N(Cc2ccccc2)c2ccc(Br)cc21 409111400 IPCZTDKQKRNAEI-PEZBUJJGSA-N 382.217 2.758 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)Nc2ccccc2F)ccc1OCC(N)=O 408815350 QDASCHUWKHDZOF-NTEUORMPSA-N 383.379 2.634 50 40 GFGB COc1ccc(NCC(=O)NNC(=O)CCc2ncc(-c3ccccc3)o2)cc1 12759891 YDHBKJLCRDEMIO-UHFFFAOYSA-N 394.431 2.542 50 40 GFGB COc1ccc(CC(=O)NNC(=O)c2occc2COc2ccccc2)cc1 10417474 RPWZHSGWCUFCQR-UHFFFAOYSA-N 380.400 2.871 50 40 GFGB COc1cc([N+](=O)[O-])cc(/C=N/NC(=O)c2cc(C)nc3ccccc23)c1O 1798909 NALIIICREMKATF-KEBDBYFISA-N 380.360 2.930 50 40 GFGB Cc1ccccc1-n1c(C)cc(/C=N/NC(=O)C(=O)NCc2ccccn2)c1C 408968710 BOBRNKCZLCMAMH-DHRITJCHSA-N 389.459 2.564 50 40 GFGB CC1=NN(c2ccccc2)C(=O)/C1=C\NNC(=O)c1ccc(Br)cc1 34222275 XXOZVVZELQHTRG-WJDWOHSUSA-N 399.248 2.990 50 40 GFGB COc1cc(/C=C/C(=O)NNC(=O)c2ccc(Cl)cc2)ccc1OCC#N 6549945 JIAVXUFTCYEWOJ-YCRREMRBSA-N 385.807 2.725 50 40 GFGB O=C(COc1ccc(Cl)cc1Cl)N/N=C/c1ccc(N2CCOCC2)o1 409000855 NKXOPEPKZZIKHA-KEBDBYFISA-N 398.246 2.952 50 40 GFGB Cc1ccc(NCC(=O)N/N=C/c2ccc(OCC(=O)O)c(Cl)c2)cc1C 59303049 AFCSEKMOAKMZRJ-LSFURLLWSA-N 389.839 2.982 50 40 GFGB CCc1nc2ccccc2n1CC(=O)NNC(=O)CCC(=O)c1ccc(F)cc1 6651354 NVPCVUOMPIJCCN-UHFFFAOYSA-N 396.422 2.548 50 40 GFGB CCCCc1ccc(NC(=O)C(=O)N/N=C/c2ccc(C(=O)OC)cc2)cc1 3081917 KKXJHSFPAKZCST-HYARGMPZSA-N 381.432 2.905 50 40 GFGB COc1cccc(/C=N/NC(=O)[C@H](O)c2ccc(Br)cc2)c1OC 3167406 IVERBLJCASRXLK-GDXCHIGESA-N 393.237 2.650 50 40 GFGB COc1cccc(/C=N/NC(=O)COc2ccc(Br)cc2OC)c1 1433721 SUKINEJWCPMQER-VXLYETTFSA-N 393.237 2.995 50 40 GFGB CCOc1ccc(Br)c(/C=N/NC(=O)c2ncc(OCC)o2)c1 2754197 QWQOIHFJQKPGHV-QGMBQPNBSA-N 382.214 2.998 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)Cc2ccc(Br)cc2)cc1 8327515 REVAXYPWHPEDCN-UHFFFAOYSA-N 377.238 2.526 50 40 GFGB O=C(CCc1nc2ccccc2[nH]1)NNC(=O)c1ccc(Br)cc1 12551005 SYSYKWXQPMPIIJ-UHFFFAOYSA-N 387.237 2.719 50 40 GFGB O=C(CN1CCOCC1)N/N=C/c1ccc(-c2ccccc2C(F)(F)F)o1 409214945 VITFFZNUQPCOGZ-SSDVNMTOSA-N 381.354 2.748 50 40 GFGB Cc1ccccc1S(=O)(=O)N1CCC[C@H](C(=O)N/N=C/c2ccccc2)C1 18192675 RHRVVLOBAXABSY-SXZORUHJSA-N 385.489 2.546 50 40 GFGB COc1cc(OC)c(/C=N/NC(=O)[C@H](O)c2ccccc2)cc1Br 409264680 PBVPNPBPLSDWRS-MWJIIQFGSA-N 393.237 2.650 50 40 GFGB O=C(N/N=C\c1ccc(I)cc1)c1cccc([N+](=O)[O-])c1 33532690 CXKGWJMVHZWXRQ-SXGWCWSVSA-N 395.156 2.963 50 40 GFGB CCCNC(=O)C/C(C)=N/NC(=O)COc1ccc(C)cc1Br 4416274 AHMRKQAXCZSUPC-XDHOZWIPSA-N 384.274 2.545 50 40 GFGB C/C(=N\NC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O)c1ccc(C)cc1 408782985 ZXHMWUFJUMEMCZ-XSFVSMFZSA-N 393.896 2.955 50 40 GFGB N#CC(C(=O)CSc1nnnn1-c1ccccc1)=C1Nc2ccccc2N1 6506776 JUHVVSCMUCAYMJ-UHFFFAOYSA-N 375.417 2.596 50 40 GFGB Cc1cc(C(=O)NNC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)c(C)o1 6508938 GXLIEOXSLWPRMQ-UHFFFAOYSA-N 384.436 2.602 50 40 GFGB O=C(COc1cccc(Cl)c1)N/N=C\c1cc2c(cc1[N+](=O)[O-])OCO2 4724122 IDPIVVVYEPEPSF-WSVATBPTSA-N 377.740 2.506 50 40 GFGB CCOC(=O)COc1ccc(/C=C(\C#N)C(=O)n2nc(C)cc2C)cc1OC 408975666 BXOBHNREAJNYJB-CXUHLZMHSA-N 383.404 2.698 50 40 GFGB CCOC(=O)COc1ccc(/C=C(/C#N)C(=O)NCc2ccccc2)cc1OC 408747902 VNNCLWWLZHTSSJ-WQRHYEAKSA-N 394.427 2.860 50 40 GFGB CCC(=O)NNC(=O)c1ccccc1NC(=O)c1ccc(Br)cc1 409000166 XJEYHAQNNUSKOB-UHFFFAOYSA-N 390.237 2.872 50 40 GFGB COc1ccc(CC(=O)N/N=C\c2cc(Cl)c(O)c(OC)c2)cc1OC 96912463 QADAJZJOCYUSJC-JMIUGGIZSA-N 378.812 2.764 50 40 GFGB CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)O)[C@@H]2C(=O)NNC(=O)c1csc(C)c1C 17076996 WCKKBTDCLNSGBU-NOXHYTERSA-N 376.478 2.819 50 40 GFGB CNc1nc2[nH]c(=O)c3c(c2s1)OC(N)=C(C#N)[C@@H]3c1ccccc1Cl 15082507 YIESDKNHGKBVIB-JTQLQIEISA-N 385.836 2.898 50 40 GFGB N#CC1=C(N)OC2=C(C(=O)CCC2)[C@H]1c1cc2c(cc1Br)OCO2 873836 CPLNBMUYDFUCTH-HNNXBMFYSA-N 389.205 2.993 50 40 GFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1ccccc1C(=O)N(C)C1CCCCC1 104865765 GOMMJAACTATILN-JXAWBTAJSA-N 383.448 2.573 50 40 GFGB O=C(Cc1n[nH]c(=NC(=O)c2ccc(Cl)cc2)s1)N/N=C/c1ccccc1 408731691 PDBZGBXTOYOXFR-RGVLZGJSSA-N 399.863 2.559 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C\[C@H]2C(=O)N(c3ccccc3)N=C2C)cc1 408812982 CMQNXYXIEZBVSB-MJLBXUHQSA-N 388.427 2.800 50 40 GFGB Cn1ccnc1COc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2)cc1 40119762 JENNOUYCJWZYCK-UHFFFAOYSA-N 384.823 2.727 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])cc(Br)c1O 5720138 SNSVFHYUSAIREI-CAOOACKPSA-N 394.181 2.835 50 40 GFGB O=C(N/N=C/c1ccccc1I)c1ccc([N+](=O)[O-])cc1 13954284 PNEMBASDTDRRDV-CXUHLZMHSA-N 395.156 2.963 50 40 GFGB O=C(OC(=O)[C@H](Br)C(F)(F)F)[C@H](Br)C(F)(F)F 885164272 ZVCBCAPTWMUSNK-LWMBPPNESA-N 395.875 2.708 50 40 GFGB COc1ccc([N+](=O)[O-])cc1OCC(=O)C(C#N)=C1N(C)c2ccccc2N1C 31673992 CVSBDWJEUNSRIF-UHFFFAOYSA-N 394.387 2.873 50 40 GFGB Cc1nnc(SCC(=O)N/N=C/c2ccccc2[N+](=O)[O-])n1-c1ccccc1 2736926 BPTYOLQRWWKUTJ-YBFXNURJSA-N 396.432 2.726 50 40 GFGB CCOc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)ccc1O 8017775 NDDJONWVQBFBBG-QGZVFWFLSA-N 375.384 2.851 50 40 GFGB O=C(COC(=O)Cc1ccc(Cl)cc1)NNC(=O)c1ccccc1Cl 8433762 CCJNORITXDJIPM-UHFFFAOYSA-N 381.215 2.540 50 40 GFGB COC(=O)COc1ccc(/C=N/NC(=O)Cc2ccc(C)cc2C)cc1OC 20195108 ARZFGWSRWJYQAN-WSDLNYQXSA-N 384.432 2.557 50 40 GFGB CS(=O)(=O)Nc1cc(NC(=O)/C(C#N)=C\c2ccc(F)cc2)ccc1F 98007787 LYJZRLHJXPXLCX-WQLSENKSSA-N 377.372 2.882 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccc2N)cc(Br)c1OC 408726893 CTMOBPSPSPHAOP-DJKKODMXSA-N 378.226 2.812 50 40 GFGB COc1cc([C@H]2C(C#N)=C(N)Oc3cc(N(C)C)ccc32)c(OC)c2c1OCO2 36559102 PCKCXOUJKPGAJK-KRWDZBQOSA-N 395.415 2.717 50 40 GFGB COc1ccc(/C=C/C(=O)NNC(=O)CSc2ccc(C)cc2)cc1OC 8293886 ZKILOLJNQHTRNR-YRNVUSSQSA-N 386.473 2.965 50 40 GFGB COc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3)C2)cc1OC 5544446 JTQNRHYTHPZVHB-BFTVFPACSA-N 381.432 2.515 50 40 GFGB Cc1ccc(OCCC(=O)NNC(=O)c2cncn2-c2ccccc2)cc1C 29855970 TXVBVKXRYNLBHV-UHFFFAOYSA-N 378.432 2.719 50 40 GFGB Cc1cc(Br)ccc1OCC(=O)NNC(=O)/C=C/c1ccccc1 2187996 AKEQXOWCVYVAPN-JXMROGBWSA-N 389.249 2.997 50 40 GFGB C=CCOc1ccc(Br)cc1/C=N/NC(=O)CC1(C)OCCO1 408918675 NQCYEELTWLAYRT-WOJGMQOQSA-N 383.242 2.617 50 40 GFGB CCN(CC)c1ccc2cc(C(N)=O)/c(=N\NC(=O)c3ccccc3)oc2c1 27495757 XOQFEUBPURHWJI-DARPEHSRSA-N 378.432 2.624 50 40 GFGB N#CC1=C[C@@H]2[C@H]3C(=O)N(c4ccccc4)C(=O)[C@H]3[C@@H](C(=O)c3ccccc3)N2C=C1 20065373 LVWKLDZQKHREEU-NCYKPQTJSA-N 395.418 2.705 50 40 GFGB O=C(NNC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2)c1sc2ccccc2c1Cl 102634445 UVYBJWBVCIOOHJ-VDUILEQBSA-N 390.848 2.839 50 40 GFGB CC[C@H](C)Oc1ccc(C(=O)NC(=S)NNC(=O)c2cccs2)cc1 6603724 PASAJGIOZMADGD-NSHDSACASA-N 377.491 2.875 50 40 GFGB CCOC(=O)COc1cccc(/C=N/NC(=O)Cc2ccc(OCC)cc2)c1 10475959 HXZUHKUPHZAILA-HYARGMPZSA-N 384.432 2.720 50 40 GFGB O=C(N/N=C/c1ccccc1[N+](=O)[O-])[C@H](O)c1ccc(Br)cc1 1444105 NFWJXURSAXRRIG-IREQLNLFSA-N 378.182 2.541 50 40 GFGB CCc1nn2c(=O)cc(COc3ccc(C=C(C#N)C#N)cc3OC)nc2s1 20332154 ZRSIUMVJDOOVFS-UHFFFAOYSA-N 393.428 2.732 50 40 GFGB O=C(N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O)c1ccccc1O 3100143 BHORJYIKSANAES-FRKPEAEDSA-N 380.154 2.532 50 40 GFGB N#C/C(C(=O)NCc1ccccc1)=C1/S[C@@H](CCO)C(=O)N1c1ccccc1 2235005 VOYIKNKCDBBBND-HGBKYHTQSA-N 393.468 2.569 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)CCc2ncc(-c3ccccc3)o2)cc1 11404692 LXCLCXQHTDXPAS-UHFFFAOYSA-N 379.416 2.809 50 40 GFGB O=C(CCSc1ccc(Cl)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 3352555 LNYMWNXDYWEHRM-INIZCTEOSA-N 392.864 2.810 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C/N2CCN(c3ccc(F)cc3)CC2)cc1 5488397 GUWKNZFWANWZDP-FBMGVBCBSA-N 394.450 2.680 50 40 GFGB COc1ccccc1N(CC(=O)NN=C1CCCCCCC1)S(C)(=O)=O 408906595 ICDJFZMIWKNBNS-UHFFFAOYSA-N 381.498 2.678 50 40 GFGB COc1ccc(/C=N/NC(=O)c2ccn(Cc3ccc([N+](=O)[O-])cc3)n2)cc1 1089142 IFDBDBZIFLCWFZ-UDWIEESQSA-N 379.376 2.612 50 40 GFGB CCOc1ncccc1C(=O)NNC(=O)COc1ccc(Cl)cc1Cl 8326196 HSYPAGOBLIQSAH-UHFFFAOYSA-N 384.219 2.627 50 40 GFGB C/C(Cn1nc([N+](=O)[O-])cc1C)=N\NC(=O)c1cccc(Br)c1 686991 GFJVYQLTCMVKEU-CXUHLZMHSA-N 380.202 2.668 50 40 GFGB COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(Br)c(O)c1 89426702 APKOHGOLAASXPV-UHFFFAOYSA-N 399.628 2.892 50 40 GFGB CCCOc1ccc(NC(=O)C(=O)N/N=C/c2ccc(O)c(OCC)c2)cc1 409260080 KKRDKRNLIKLCEJ-FYJGNVAPSA-N 385.420 2.669 50 40 GFGB Cc1ccc(C(=O)N/N=C2\C(=O)N(CN3CCCCC3)c3ccccc32)cc1 100603729 KMDSVQKZWCZVBC-ATJXCDBQSA-N 376.460 2.919 50 40 GFGB C/C(=N\NC(=O)c1ccc(CN2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1 23358544 KFSOQBATMWTPLS-RCCKNPSSSA-N 382.420 2.581 50 40 GFGB CCOc1ccc(/C=N/NC(=O)COc2ccc(C)cc2[N+](=O)[O-])cc1OC 13847793 UQVLTMBMEZUFAZ-RGVLZGJSSA-N 387.392 2.840 50 40 GFGB CCOC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@@]21C(=O)N(C)c2ccccc21 4742200 IHTOBSIWBJQHML-HXUWFJFHSA-N 395.440 2.582 50 40 GFGB Cc1cc(C)nc(SCC(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)n1 7785121 YXAANUCCKZGITM-UHFFFAOYSA-N 395.444 2.571 50 40 GFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)CC1(C)SCCS1 409259490 ZXJASYZEUZMNCZ-CXUHLZMHSA-N 385.467 2.648 50 40 GFGB CN(NC(=O)/C=C/c1cc(Cl)ccc1Cl)c1cnn(C)c(=O)c1Cl 40155331 VLXLVVCYIIDJMD-ZZXKWVIFSA-N 387.654 2.921 50 40 GFGB O=C(NCc1ccc(Cl)cc1)C(=O)N/N=C/c1c(O)ccc2ccccc12 7813120 CVBJOIZGIMKALG-FSJBWODESA-N 381.819 2.965 50 40 GFGB N#C/C(=C/c1ccc(O)c(I)c1)C(=O)NC1CCCC1 409190170 LVSOMGBINNAODW-XFFZJAGNSA-N 382.201 2.963 50 40 GFGB O=C(NNC(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2)c1ccc(F)cc1 14205673 ULFAQMHLRHZMBP-UHFFFAOYSA-N 382.370 2.714 50 40 GFGB O=C(N/N=C/c1ccccc1O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 6839438 TYONWZSUYZXQIE-ZVHZXABRSA-N 398.422 2.914 50 40 GFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1ccc(OC(C)=O)cc1)c1ccccc1 408999254 QJEFZWFWTOZLTL-VZMFNRANSA-N 397.431 2.940 50 40 GFGB C[C@@H]1Cc2cc(S(=O)(=O)NC(=O)/C(C#N)=C\c3ccco3)cc(Cl)c2O1 584906931 DJTDLVYCWPDPPQ-GWHHBTOMSA-N 392.820 2.668 50 40 GFGB NC(=O)Cn1cc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)c2ccccc21 6269956 QAPUWNQOFGVKEF-PGGKNCGUSA-N 388.349 2.909 50 40 GFGB CC(=O)N1CCN(c2c(Cl)cccc2[C@@H]2C[C@@H](C(=O)Cl)CC2=O)CC1 57328055 PQKMQDKBWGWISS-OCCSQVGLSA-N 383.275 2.837 50 40 GFGB Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNS(=O)(=O)c1cccs1 12801849 VOXPEHSABBIFCU-LLVKDONJSA-N 388.898 2.795 50 40 GFGB O=C(NNC(=O)c1ccc(F)c(C(F)(F)F)c1)c1ccc2c(c1)OCCO2 84452084 NDOHKQVJAXXCAM-UHFFFAOYSA-N 384.285 2.691 50 40 GFGB CCc1ccc(N(CC(=O)N/N=C/c2cccc(Cl)c2)S(C)(=O)=O)cc1 409023997 GOFDMZZTVMCIQU-UDWIEESQSA-N 393.896 2.819 50 40 GFGB CCCCCCC(=O)Nc1nnc(CC(=O)N/N=C/c2ccc(O)cc2)s1 408732143 SSKWNEHNCQCDFZ-XDHOZWIPSA-N 389.481 2.845 50 40 GFGB O=C(N/N=C\c1cc(Br)ccc1O)C(=O)Nc1ccc(Cl)cc1 83328654 NHJNUKHYCJLLJO-LSCVHKIXSA-N 396.628 2.897 50 40 GFGB Cc1cc2c(c(=O)n1C)[C@H](c1ccc(OC(F)(F)F)cc1)C(C#N)=C(N)O2 20086816 ZCLHEEFLNHAPIZ-CQSZACIVSA-N 377.322 2.811 50 40 GFGB Cc1cccc(O[C@@H](C)C(=O)NNC(=O)COc2ccccc2Cl)c1C 6510515 MYRATBOBRNSCPG-AWEZNQCLSA-N 376.840 2.951 50 40 GFGB COc1ccc(NC(=O)NNC(=O)CSCc2ccc(F)cc2)cc1OC 17080357 AWVMRARDQGDNPI-UHFFFAOYSA-N 393.440 2.929 50 40 GFGB COc1ccc(OC)c(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)c1 408773794 MDEILBVLCHDAPY-JXAWBTAJSA-N 377.444 2.960 50 40 GFGB C/C(=N\NC(=O)CN(c1ccccc1Cl)S(C)(=O)=O)c1ccccc1 20493203 MHTZXHSVIBWVNL-CPNJWEJPSA-N 379.869 2.646 50 40 GFGB O=C(O)c1cccc(-c2ccc(/C=N\NC(=O)c3ccc([N+](=O)[O-])cn3)o2)c1 31829230 JBNCXCFLLLZPIV-JMIUGGIZSA-N 380.316 2.712 50 40 GFGB O=[N+]([O-])c1cccc(P(=O)(c2ccccc2)c2ccccc2)c1OCCO 101525684 YZUKFDLUROHFTB-UHFFFAOYSA-N 383.340 2.605 50 40 GFGB COCCCNC(=O)/C(C#N)=C/c1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 408809658 HPUGJJBYPGNIBA-JLHYYAGUSA-N 385.376 2.923 50 40 GFGB CCOc1ccc(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])cc1OCC 4551424 SUUWRFMKOFXGQD-UDWIEESQSA-N 387.392 2.921 50 40 GFGB COc1ccc(/C(C)=N/NC(=O)CCC(=O)NCc2ccccc2)c(OC)c1 4656953 MZHKJKVFDBJTBZ-HZHRSRAPSA-N 383.448 2.641 50 40 GFGB O=C(O)COc1ccccc1/C=N/NC(=O)c1cccc(Br)c1 9668346 XSMRGYZVVYDHBM-GIJQJNRQSA-N 377.194 2.676 50 40 GFGB COc1ccc(N(CC(=O)NN=C2CCCCCCC2)S(C)(=O)=O)cc1 20210238 DTOKCEADUOTYQM-UHFFFAOYSA-N 381.498 2.678 50 40 GFGB CS(=O)(=O)N(CC(=O)NN=C1CCCC1)c1ccc(Cl)c(Cl)c1 408922999 DIZAVCNUDILRLV-UHFFFAOYSA-N 378.281 2.806 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc2ccccc12)c1ccccc1 19954080 KYWCAGACRPEPAX-KGENOOAVSA-N 381.457 2.756 50 40 GFGB Cc1ccc(O[C@@H](C)C(=O)NNC(=O)CCC(=O)Nc2cc(C)ccc2C)cc1 12292689 GNSVAHKGHGDICN-KRWDZBQOSA-N 397.475 2.945 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2ccccc2C)cc(Cl)c1O 6958776 DKEDYSLQRPDWBH-KEBDBYFISA-N 375.812 2.842 50 40 GFGB CN1CCN(c2ccc([N+](=O)[O-])cc2/C=C(\C#N)C(=O)Nc2ccccc2)CC1 409006695 KEOUDTJYXGPUNB-GHRIWEEISA-N 391.431 2.892 50 40 GFGB CCOc1cc(/C=N/NC(C)=O)ccc1OCC(=O)Nc1ccccc1OC 409018827 ZLASXSJBMIGMOA-CIAFOILYSA-N 385.420 2.581 50 40 GFGB O=C(Cc1ccc2c(c1)OCCO2)N/N=C\c1cc([N+](=O)[O-])ccc1Cl 409359699 BTHIBUISYNVAGN-GRSHGNNSSA-N 375.768 2.712 50 40 GFGB CCCCN(CCCC)C(=O)[C@@H]1[C@H]2C[C@@H]([C@H](O)[C@H]2Br)[C@H]1C(=O)O 252444360 KCBNELBBVDYUQJ-MBIARJLFSA-N 390.318 2.506 50 40 GFGB O=C(N/N=C/c1ccncc1)c1ccn(Cc2ccc(Br)cc2)n1 1091889 MPJBSHUYGIPMAR-RGVLZGJSSA-N 384.237 2.853 50 40 GFGB Cc1cc(/C=N/NC(N)=O)c(C)n1-c1ccc(I)cc1 3469337 RDWHBLDTORHDDZ-CAOOACKPSA-N 382.205 2.701 50 40 GFGB COc1ccc(C(=O)n2cc(C(=O)NN)c3ccccc32)cc1Br 226367880 URBLUJNVCIIWCV-UHFFFAOYSA-N 388.221 2.704 50 40 GFGB Cc1cc(I)ccc1NCC(=O)N/N=C/c1ccccn1 994000 LUXODQZESSRSLI-DJKKODMXSA-N 394.216 2.557 50 40 GFGB CNC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(Cl)cc2Cl)cc1 9232161 FBQRLDRMBGTLFD-ZVBGSRNCSA-N 380.231 2.769 50 40 GFGB COc1ccc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)c(OC)c1 1444692 PQTBYANIIIXBNW-VXLYETTFSA-N 389.433 2.996 50 40 GFGB Cc1cc(Cl)ccc1OCC(=O)NN[C@@H](C(=O)NC1CC1)c1ccccc1 12784056 KMFHIGVJAGEBQI-LJQANCHMSA-N 387.867 2.668 50 40 GFGB Cc1cc(C)c(C#N)c(SCC(=O)/C(C#N)=C2\NC(=O)c3ccccc3N2)n1 18061236 HLMTZXAYDOGPPQ-SDXDJHTJSA-N 389.440 2.822 50 40 GFGB N#C/C(C(N)=O)=C1/S[C@H](Cc2ccc(F)cc2)C(=O)N1c1ccc(F)cc1 16758881 GMVYCOUTOUXLQN-URTGMZOISA-N 385.395 2.876 50 40 GFGB COc1ccc(CC(=O)N/N=C\c2cccn2-c2ccc(C(=O)O)cc2)cc1 409231857 LBIPPDWADSTTHF-HMAPJEAMSA-N 377.400 2.877 50 40 GFGB CC(C)CNC(=O)COc1ccc(/C=N/NC(=O)CCc2ccccc2)cc1 409112437 GHJQUKRRZIDTDC-BUVRLJJBSA-N 381.476 2.921 50 40 GFGB CCOc1cc([N+](=O)[O-])cc(/C=N\NC(=O)COc2ccccc2Cl)c1O 96610929 NEAMRVMXFCYHIT-OCKHKDLRSA-N 393.783 2.882 50 40 GFGB Cc1cc(Br)cc(/C=N/NC(=O)[C@H]2COc3ccccc3O2)c1O 2348021 TYTXGDTZSORILQ-ODGHKMFZSA-N 391.221 2.753 50 40 GFGB O=C(COc1ccc(C(=O)c2ccccc2)cc1)NNC(=O)c1ccccc1F 3424891 DPXLCKFMBIPEHN-UHFFFAOYSA-N 392.386 2.897 50 40 GFGB CCCOc1ccc(/C=N/NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1 409119510 SPRYNRCPZULMRN-XSFVSMFZSA-N 389.477 2.635 50 40 GFGB CCOc1cc(/C=N/NC(=O)COc2c(C)cccc2C)cc([N+](=O)[O-])c1O 36245425 LPTSYDHNBUTKTB-KEBDBYFISA-N 387.392 2.845 50 40 GFGB COc1cc(/C=N/NC(=O)c2cccnc2)ccc1Oc1ccc([N+](=O)[O-])cn1 2285231 QKOOKNGYGHHZQQ-LSHDLFTRSA-N 393.359 2.950 50 40 GFGB COc1cc(OC)c(/C=N\NC(=O)COc2cccc3cccnc23)c(OC)c1 13143819 URWHVXNSHLIOHV-FMCGGJTJSA-N 395.415 2.790 50 40 GFGB N#CC(C(=O)COC(=O)/C=C/c1cccc([N+](=O)[O-])c1)=C1Nc2ccccc2N1 3376845 VBUZKRIGCHJCLJ-CMDGGOBGSA-N 390.355 2.993 50 40 GFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cc(OC)c(O)c([N+](=O)[O-])c2)cc1 409214798 YHRPUXGCLAGWSG-NTUHNPAUSA-N 397.343 2.641 50 40 GFGB CN(C)c1ccc(/C=C(/C#N)C(=O)NC[C@H]2CCCO2)cc1Br 13939783 WOTCQSVLEJYWPO-YLHGKKIISA-N 378.270 2.717 50 40 GFGB O=C(NNc1ccccc1[N+](=O)[O-])[C@H]1CCCN(C(=O)Nc2ccccc2)C1 15423308 MKNKSHXINABLSA-AWEZNQCLSA-N 383.408 2.982 50 40 GFGB CCCC[C@@H](C[C@@H](O)COCCC)C(=O)NNC(=S)Nc1ccccc1 4793999 UDLQODXYXADENG-DOTOQJQBSA-N 381.542 2.988 50 40 GFGB Cc1nc(-c2ccccc2)sc1C(=O)NNS(=O)(=O)c1ccc(C#N)cc1 7387413 BHHWHJDXHGIOBC-UHFFFAOYSA-N 398.469 2.614 50 40 GFGB Cc1[nH]c(=O)c(C#N)c(C)c1CCC(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 17518460 HZHMSJOPSJWJEE-UHFFFAOYSA-N 394.475 2.555 50 40 GFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2cc3c(cc2Cl)OCO3)n1 8336667 SNVXPCLCGYGKKN-NGYBGAFCSA-N 378.841 2.718 50 40 GFGB C[C@H]1C[C@H]1c1ccc(CCC(=O)NNC(=O)c2cc(Br)c[nH]2)o1 53175969 HTJJRYBKADKIED-JOYOIKCWSA-N 380.242 2.887 50 40 GFGB CNC(=O)/C(C#N)=C/c1c(Oc2ccccc2F)nc2c(C)cccn2c1=O 3644219 AQSHTNPVPRQCIL-JLHYYAGUSA-N 378.363 2.587 50 40 GFGB CCCOc1ccc(C(=O)N/N=C/c2ccc(OCC(=O)O)c(OC)c2)cc1 20197898 HOYSNCDJDWZANU-CIAFOILYSA-N 386.404 2.711 50 40 GFGB CCNc1sc2c3c(c(=O)[nH]c2c1C#N)[C@@H](c1ccncc1)C(C#N)=C(N)O3 15085097 ANTBZXXONOTVPZ-LBPRGKRZSA-N 390.428 2.506 50 40 GFGB N#Cc1cccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCC3)c1 7404852 AWWQWTUHOFFRJM-UHFFFAOYSA-N 375.475 2.512 50 40 GFGB CC(C)c1ccc2c(c1)/C(=N\NC(=O)c1nn(C)c(=O)c3ccccc13)C(O)=N2 8236229 MHGBJVVBEYGBFD-UHFFFAOYSA-N 389.415 2.793 50 40 GFGB COc1cccc(/C=N/NC(=O)CC(=O)Nc2cccc(C(F)(F)F)c2)c1O 3082231 IWBIXXURESOYAV-LSHDLFTRSA-N 395.337 2.899 50 40 GFGB C/C(CC(=O)Nc1ccc(Cl)cc1Cl)=N\NC(=O)C(=O)NCC(C)C 4401988 YXNYRBVEKCCDCY-UFFVCSGVSA-N 387.267 2.586 50 40 GFGB Cc1cc2c(c(=O)n1C)[C@@H](c1ccc(F)c(Br)c1)C(C#N)=C(N)O2 20086752 XFDPZUTYJAPRNG-AWEZNQCLSA-N 390.212 2.814 50 40 GFGB Cc1cc(Cl)ccc1N1C(=O)C[C@@H](NNC(=O)c2cccc(Cl)c2)C1=O 100858821 DWKZNBUADSITII-CQSZACIVSA-N 392.242 2.868 50 40 GFGB O=C(Cc1ccccc1)NCCC(=O)NNC(=O)c1cc(Cl)ccc1Cl 32879173 ZXAXJJXPEUXVBN-UHFFFAOYSA-N 394.258 2.503 50 40 GFGB CCOC(=O)C1=C(CCl)OC(N)=C(C#N)[C@H]1c1cccc(OC)c1OC 1302290 BGZBNYUBMHCSAR-CQSZACIVSA-N 378.812 2.567 50 40 GFGB COc1cc(OC)cc(C(=O)N/N=C(\C)CC(=O)NCc2ccccc2OC)c1 100924778 VPOJROSQFQFNGW-OEAKJJBVSA-N 399.447 2.525 50 40 GFGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@]12C(=O)Nc1ccc(Cl)cc12 9305217 PPVTWZVPSWKGRQ-HXUWFJFHSA-N 391.770 2.771 50 40 GFGB N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)C(=O)Nc1cccc(C(=O)O)c1 408542326 KRSISELZZKEGDB-UUILKARUSA-N 381.300 2.567 50 40 GFGB Cc1c(C(=O)N/N=C\c2ccccc2Cl)nn(-c2ccccc2)c(=O)c1C#N 409052844 IREDTHNIGWPEAK-FMCGGJTJSA-N 391.818 2.830 50 40 GFGB O=C(O)c1cccc(-n2cccc2/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)c1 409097627 MYUGKPVBVFYMNX-UDWIEESQSA-N 378.344 2.848 50 40 GFGB CCN(CCCNC(=O)NNC(=O)c1c(C)nc2ccccn12)c1ccccc1 32795522 KBZUXKONBBXXQV-UHFFFAOYSA-N 394.479 2.503 50 40 GFGB Cc1ccc(C)c(NC(=S)NNC(=O)[C@@H](C)n2nc(C)c([N+](=O)[O-])c2C)c1 2794733 LWTKWIXOELFQPJ-CYBMUJFWSA-N 390.469 2.604 50 40 GFGB COc1cccc2cc(C(=O)N/N=C/c3cn(CC(N)=O)c4ccccc34)oc12 6545272 PRQURYUAMFAWQL-AUEPDCJTSA-N 390.399 2.645 50 40 GFGB CN(C)c1cccc(OCC(=O)N/N=C\c2cccn2-c2ccc(O)cc2)c1 409022169 HLJUCBLRWSARAN-HMAPJEAMSA-N 378.432 2.778 50 40 GFGB C/C(Cc1ccccc1)=N\NC(=O)CNC(=O)c1cccc(Br)c1 4826255 KEBXPFAGRKKALO-FYJGNVAPSA-N 388.265 2.914 50 40 GFGB Cc1cccc(-n2ncc(C(=O)NNC(=O)COc3c(C)cccc3C)c2C)c1 12894835 WQUNTEAWWLLJPJ-UHFFFAOYSA-N 392.459 2.946 50 40 GFGB N#C/C(=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1 5589749 MEOZVEUWYRBPSL-VBKFSLOCSA-N 378.388 2.977 50 40 GFGB Cc1ccc(OCC(=O)NC(=S)NNC(=O)c2ccc(Cl)cc2)c(C)c1 6501593 NYMRTXNXQIFVTL-UHFFFAOYSA-N 391.880 2.671 50 40 GFGB COc1cc(/C=C/C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)ccc1O 6016622 FWBGGOXZBLVRQI-VQHVLOKHSA-N 391.383 2.799 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)c1 3059260 SRFBQFKIXMFJEE-LSHDLFTRSA-N 395.337 2.811 50 40 GFGB O=C(NNC(=O)[C@@H]1CCCO1)c1ccc(CSc2nc3ccccc3[nH]2)cc1 12544306 FPLPIZSGVSWGFV-KRWDZBQOSA-N 396.472 2.795 50 40 GFGB CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCC(=O)c2cccs2)cc1 8208688 KOQDITIDPLHXJS-CYBMUJFWSA-N 390.461 2.725 50 40 GFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1O)C(O)(c1ccccc1)c1ccccc1 3027167 IBPMEFGNWVTWGZ-HYARGMPZSA-N 391.383 2.687 50 40 GFGB COCCn1c(C)cc2c(c1=O)[C@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 2326920 QSBKOJDZRLLOCM-HNNXBMFYSA-N 389.814 2.814 50 40 GFGB C[C@H]1Oc2ccccc2N(CC(=O)NNc2cccc(C(F)(F)F)c2)C1=O 14200687 KGIKLWLKCZKYPC-LLVKDONJSA-N 379.338 2.963 50 40 GFGB COc1cc(/C=N\NC(=O)c2ccc(Cl)cc2)cc(Cl)c1OCC(N)=O 409256097 NVRARGSTXRGUPF-WNFQYIGGSA-N 396.230 2.630 50 40 GFGB COc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cc(OC)c2c(c1OC)OCO2 85409570 PWJUVXSGKRLKIG-MRXNPFEDSA-N 382.372 2.659 50 40 GFGB O=C(CCc1ccccc1)NNC(=O)c1ccccc1I 840957 YQTMXXGAXQMTIP-UHFFFAOYSA-N 394.212 2.685 50 40 GFGB CCOC1(OCC)[C@@]2(Cl)C(Cl)=C(Cl)[C@@]1(Cl)[C@H]1C(=O)OC(=O)[C@@H]12 103916326 KSLULRFUPXQXQY-OTGTWEQSSA-N 390.046 2.743 50 40 GFGB CCCCOC(=O)CSC1=C(C#N)[C@@H](c2ccccc2OC)[C@H](C#N)C(=O)N1 9089028 AVHZEYDDGTUYIT-KSSFIOAISA-N 399.472 2.860 50 40 GFGB COc1cc(OC)cc(C(=O)NNC(=O)Cc2cccc(C(F)(F)F)c2)c1 4603412 WBBLCZBLPRZPSF-UHFFFAOYSA-N 382.338 2.726 50 40 GFGB COc1cc(Br)c(O)c(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)c1 408590022 NWYXHXQWRBIPIP-CAOOACKPSA-N 394.181 2.835 50 40 GFGB CCc1cc(C)cc(OCC(=O)N/N=C\c2ccc(O[C@H](C)C(=O)O)cc2)c1 408852099 IDODFLYZKWFKMD-SRMCNWIXSA-N 384.432 2.938 50 40 GFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)cc2c1OCO2 3191456 FAUSBUVVPQMSNS-MRXNPFEDSA-N 390.351 2.748 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)c2cc3c(OC)c(OC)ccc3[nH]2)c1 2215576 GPENIIFDIDZPRT-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB COc1ccccc1-c1cc(C(F)(F)F)n(-c2nc(C(=O)NN)cs2)n1 25186046 BUZJWRKQTAABNR-UHFFFAOYSA-N 383.355 2.627 50 40 GFGB Cc1noc(C)c1COc1cccc(C(=O)NNC(=O)c2ccc(O)cc2)c1 6053828 TVLSTBQHMRHBDB-UHFFFAOYSA-N 381.388 2.651 50 40 GFGB COc1ccc(C(=O)N/N=C/c2ccc(OCC(=O)N3CCCCC3)cc2)cc1 408720327 YZNGLJTVPDNGBZ-HZHRSRAPSA-N 395.459 2.850 50 40 GFGB CCC[C@@H](Br)C(=O)NCCC(=O)Nc1cccc(C(=O)OCC)c1 8733221 ORNFFCSQRLEXRP-CQSZACIVSA-N 399.285 2.872 50 40 GFGB N#CC(C#N)=C(N1CCOCC1)[C@]1(C#N)[C@@H](c2ccccc2Cl)C1(C#N)C#N 66089430 PGOALIYKPGHXRO-PXNSSMCTSA-N 388.818 2.614 50 40 GFGB CC(C)Oc1ccc(C(=O)NNC(=O)c2cccnc2N2CCCCC2)cc1 40143878 VVRATFZEMNXRJQ-UHFFFAOYSA-N 382.464 2.934 50 40 GFGB C/C(=N\NC(=O)CN(c1cc(C)cc(C)c1)S(C)(=O)=O)c1ccc(F)cc1 8335591 AZUIZJQZOVODLY-RCCKNPSSSA-N 391.468 2.749 50 40 GFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(OC(F)(F)F)cc3)[C@H]2C1 6785858 RLVZZTGXWWZSDP-DLBZAZTESA-N 399.376 2.940 50 40 GFGB O=C(CSc1nnc(-c2cccc(Cl)c2)o1)NNC(=O)c1ccccc1 5170438 UNQMMDKPIRNLJO-UHFFFAOYSA-N 388.836 2.943 50 40 GFGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2c(C)ccc(C)c2[nH]c1=O 876523 TXACEQFZYWJGDW-QGZVFWFLSA-N 379.416 2.790 50 40 GFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2cccc(Cl)c2Cl)C1)c1ccccc1 7928410 RNNZTPJZQYGQGH-LBPRGKRZSA-N 392.242 2.808 50 40 GFGB Cc1occc1C(=O)NNC(=O)c1ccccc1OCc1cn2ccccc2n1 27403101 ZRGIXUXLGIVSHD-UHFFFAOYSA-N 390.399 2.890 50 40 GFGB Cc1cc(Br)ccc1SCC(=O)NNC(=O)c1ccncc1 5423368 AOLORZROJQPLQS-UHFFFAOYSA-N 380.267 2.706 50 40 GFGB COc1ccc(C(=O)N/N=C/c2cc(Br)c(O)c(OC)c2)cc1 826801 SFJDFPDRDCARJA-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB O=C(N/N=C/c1cccc(OC(=O)c2ccc([N+](=O)[O-])cc2)c1)c1ccncc1 1433866 SWQDHNFPEXUREC-LPYMAVHISA-N 390.355 2.973 50 40 GFGB C[C@H](NC(=O)c1ccccc1F)C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 2713487 WUGCDJBUQDBPOE-ZDUSSCGKSA-N 385.439 2.703 50 40 GFGB O=C(CN1CCN(Cc2ccccc2Cl)CC1)N/N=C\c1ccc(F)cc1 32576961 ZOAYLVIYOJXOBO-QRVIBDJDSA-N 388.874 2.747 50 40 GFGB C/C(=C\C(=O)C(F)(F)C(F)(F)C(F)(F)F)NNC(=O)c1ccccc1O 6013685 JARRJFMVZNBCFV-VOTSOKGWSA-N 388.239 2.932 50 40 GFGB CCNc1nc2[nH]c(=O)c3c(c2s1)OC(N)=C(C#N)[C@H]3c1ccc(C)cc1 8672050 SAMOSELYGDJNJZ-GFCCVEGCSA-N 379.445 2.943 50 40 GFGB Cc1cc(C)c2c(c1)/C(=N/NC(=O)c1cc(Br)ccc1O)C(=O)N2 5442316 YAYIXQNPLFTBOY-UHFFFAOYSA-N 388.221 2.858 50 40 GFGB CCOc1ccccc1OCC(=O)N/N=C/c1cc(Cl)cc([N+](=O)[O-])c1O 5467286 LXRSYLOIUIARJP-DJKKODMXSA-N 393.783 2.882 50 40 GFGB Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NNC(=O)CSc1ccc(Cl)cc1 72297061 CAHRHHUJBNRHCX-LLVKDONJSA-N 394.928 2.809 50 40 GFGB CN(C)c1ccc(/C=N/NC(=O)[C@@H](O)c2ccccc2)cc1Br 14134645 JANIOMNBDQPHGC-ZVCOJXFSSA-N 376.254 2.699 50 40 GFGB COCC1=C(C#N)[C@H](SS[C@@H]2NC(C)=CC(COC)=C2C#N)NC(C)=C1 22000158 XCWSRBBDKFQLEX-ROUUACIJSA-N 390.534 2.967 50 40 GFGB CN1[C@@H]2C=C3C(C#N)=C(N)C(C#N)(C#N)[C@H](c4c(F)cccc4F)[C@H]3[C@@H]1CC2 100817044 JBPGDEKLKIFDTA-XNKSSIQNSA-N 377.398 2.851 50 40 GFGB COc1cc([N+](=O)[O-])cc(/C=N/NC(=O)c2ccccc2Br)c1O 3040570 YJPQVNKGMXKUFX-CAOOACKPSA-N 394.181 2.835 50 40 GFGB COc1ccccc1OCC(=O)N/N=C\c1cccn1-c1ccc(C(=O)O)cc1 28615460 IXNRSEYMOOGVOL-XKZIYDEJSA-N 393.399 2.713 50 40 GFGB COc1ccc(-c2ccc(/C=C3\C(=O)NC(=O)C(C#N)=C3C)o2)c([N+](=O)[O-])c1 18126105 BKQPJWFIKJMVSX-AUWJEWJLSA-N 379.328 2.743 50 40 GFGB Cc1cccc(N(CC(=O)N/N=C/c2ccccc2Cl)S(C)(=O)=O)c1C 408922451 BAESJEOGAFVVAH-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1ccccc1OCC#N)c1ccccc1 409003806 VBKWJRQUZMDWOJ-FSTGKYBXSA-N 394.431 2.917 50 40 GFGB O=C(CCSCCC(=O)N/N=C/c1ccccc1)N/N=C\c1ccccc1 31623562 FMVOKYHMOJAAIR-KBNZVFGVSA-N 382.489 2.800 50 40 GFGB O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)c1ccccn1 40142854 WDGODCMWHPKTPM-UHFFFAOYSA-N 378.344 2.857 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2ccc(Cl)cc2C)ccc1O 3060058 APDDOSSJVKTWLN-KEBDBYFISA-N 375.812 2.842 50 40 GFGB CCC[C@@H](C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12)c1ccccc1 6454728 ABXQOQKJVVPOSX-MRXNPFEDSA-N 392.459 2.761 50 40 GFGB COc1ccc(Br)cc1/C=C(\C#N)C(=O)NCCCn1ccnc1 102623549 CBJAFFMHLNXCMJ-NTEUORMPSA-N 389.253 2.768 50 40 GFGB O=C(CNc1ccc(I)cc1)N/N=C/c1cccc(O)c1 59514223 CRNWDDQYIZIKPJ-GIJQJNRQSA-N 395.200 2.559 50 40 GFGB COc1ccc(NC(=O)[C@@H](C)SC2=C(C#N)C(C)(C)[C@@H](C#N)C(=O)N2)cc1 12622494 VYKGLLQMYWSPPX-RISCZKNCSA-N 384.461 2.786 50 40 GFGB C[C@@H](NC(=O)c1ccccc1)C(=O)N/N=C/c1c(F)c(F)c(F)c(F)c1F 2322918 FUHGWXGZBXAUJB-FVYVAXIKSA-N 385.292 2.651 50 40 GFGB O=C(NN[C@@H](C(=O)NC1CC1)c1ccccc1)c1ccccc1Br 12784048 BSESOUXSYMSTER-MRXNPFEDSA-N 388.265 2.703 50 40 GFGB CCC[C@@H](C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccccc1 12918355 YNNGNBIUZVLMJI-QGZVFWFLSA-N 378.432 2.923 50 40 GFGB COc1cccc(CC(=O)N/N=C\c2ccc(I)o2)c1 408996519 PUNUGCUQVUAJMU-SXGWCWSVSA-N 384.173 2.586 50 40 GFGB COCCOC(=O)/C(C#N)=C/c1cc(Br)c(Br)o1 408955349 WYGCJKCHLJAMLM-QPJJXVBHSA-N 379.004 2.901 50 40 GFGB C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CCc1nc2ccccc2s1 7813690 VOVYMTKJHIBEQF-GFCCVEGCSA-N 387.436 2.983 50 40 GFGB O=C(N/N=C\c1cc2c(cc1[N+](=O)[O-])OCO2)c1cc2cc([N+](=O)[O-])ccc2o1 408963250 YLIYNVJBYJDQLJ-WSVATBPTSA-N 398.287 2.742 50 40 GFGB COc1cc(OC)c(OC)cc1/C=N/NC(=O)Nc1cccc2nsnc12 822456 GVNXQGVKBSZNHO-GIJQJNRQSA-N 387.421 2.873 50 40 GFGB O=C(N/N=C/c1cc2c(cc1Br)OCO2)c1ccc2c(c1)OCO2 5582850 PSBXUNAABVIWNB-NGYBGAFCSA-N 391.177 2.670 50 40 GFGB C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2cc(C)cc(C)c2[nH]c1=O 4131451 AORKXGUQOWHDQU-GOSISDBHSA-N 391.427 2.956 50 40 GFGB Cc1nn(-c2cccc(C(F)(F)F)c2)c(C)c1CC(=O)NNc1ncccn1 48231472 WVJGNRSNMGIJKX-UHFFFAOYSA-N 390.369 2.984 50 40 GFGB O=C(CNc1ccc2c(c1)OCO2)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 409182512 LYFWIMQEHMJMCN-FBCYGCLPSA-N 376.756 2.539 50 40 GFGB Cc1cccc(C(=O)NNC(=O)c2ccc(=O)n(Cc3ccc(Cl)cc3)c2)c1 16839338 BJAIRLMTCNJLCR-UHFFFAOYSA-N 395.846 2.933 50 40 GFGB COc1ccc(Br)cc1/C=C(/C#N)C(=O)NCCCn1ccnc1 26770324 CBJAFFMHLNXCMJ-ZROIWOOFSA-N 389.253 2.768 50 40 GFGB CCCCCC/C=N\NC(=O)CSc1nc(C)cc(N2CCOCC2)n1 102987547 SETJUVHLSZFZSG-UWVJOHFNSA-N 379.530 2.786 50 40 GFGB C#CCN1C(=O)/C(=N/NC(=O)COc2ccc(C(C)C)cc2)c2ccccc21 5690148 JQFINZSFERXQAS-DARPEHSRSA-N 375.428 2.689 50 40 GFGB COc1cc(C(=O)NNS(=O)(=O)c2ccccc2Cl)ccc1OC(C)C 7387889 OLLGNNDAJFKTSB-UHFFFAOYSA-N 398.868 2.759 50 40 GFGB COc1ccc(/C(C)=N\NC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1 19363574 UYNYEXSCXFMTHY-CLCOLTQESA-N 394.519 2.662 50 40 GFGB C[C@@H]1CCc2c(C(=O)NNC(=O)[C@H]3[C@@H](C(=O)O)[C@H]4C=C[C@H]3CC4)csc2C1 102220610 IUKBUXKYOYNLOF-XJSUSFSXSA-N 388.489 2.547 50 40 GFGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1cn(CC(N)=O)c2ccccc12 818719 ONPXMSKLNNMOOY-LJQANCHMSA-N 390.443 2.577 50 40 GFGB COc1ccc(N2C[C@@H](C(=O)N/N=C\c3ccc(SC)cc3)CC2=O)cc1 409175661 UEOOVSLYCPJRTP-RANIVTSPSA-N 383.473 2.920 50 40 GFGB COc1cccc(C(=O)N/N=C/c2cc(OC)cc(Br)c2O)c1 408589303 LGVFEPXJHMTORH-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB NNC(=O)/C(=C/c1ccc(Br)cc1)NC(=O)c1ccccc1Cl 4858238 DNVJXYDRTKTVRC-ZROIWOOFSA-N 394.656 2.863 50 40 GFGB Cc1ccc(O[C@H](C)C(=O)NNC(=O)CCC(=O)Nc2ccc(C)cc2C)cc1 12292675 XZVGGRWIPIUDAH-QGZVFWFLSA-N 397.475 2.945 50 40 GFGB C=CCOc1ccc(C(=O)NNC(=O)CNc2ccc(C)cc2C)cc1OC 12534266 LDADUCTUUBNVGH-UHFFFAOYSA-N 383.448 2.750 50 40 GFGB O=C(N/N=C\c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1cc2ccccc2o1 408952583 VJKPBPKBGKGRCP-BKUYFWCQSA-N 394.387 2.942 50 40 GFGB CCOc1ccc(OCCCC(=O)NNC(=O)COc2ccccc2F)cc1 12615004 MIYWFHMKNDLKQU-UHFFFAOYSA-N 390.411 2.610 50 40 GFGB O=C(N/N=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)N1CCCCCC1 4525747 GRPYPKRJDFMLLP-DEDYPNTBSA-N 384.392 2.708 50 40 GFGB O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)Nc1cccc2ccccc12 2760987 OUPAOZBBESVOIZ-UHFFFAOYSA-N 380.360 2.980 50 40 GFGB COc1ccc(CC(=O)NNc2ncnc3c2cnn3Cc2ccccc2)cc1 2343041 HYLUPGCFMLEVBR-UHFFFAOYSA-N 388.431 2.569 50 40 GFGB CCOc1cc(/C=C(/C#N)C(N)=S)cc(Br)c1OCC(=O)OC 408541621 CKFCZVSNNSKPGT-WMZJFQQLSA-N 399.266 2.593 50 40 GFGB CCOC(=O)c1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)NCCOC)c2C)cc1 28355818 LYFGCZFDJKBLCT-CPNJWEJPSA-N 395.459 2.940 50 40 GFGB CCCOc1ccccc1C(=O)NNC(=S)NC(=O)c1ccccc1F 8562174 XABMNJJRLFVUDI-UHFFFAOYSA-N 375.425 2.564 50 40 GFGB COc1cccc(NC(=O)CSC2=C(C#N)[C@H](c3ccco3)CC(=O)N2)c1 409131165 MELUAIZUTGCZEI-CQSZACIVSA-N 383.429 2.999 50 40 GFGB COC(=O)c1ccc(-c2ccc(/C=C3/C(=O)N(C)C(=O)C(C#N)=C3C)o2)cc1 33334169 DZIHCHTWXCNIOZ-MHWRWJLKSA-N 376.368 2.955 50 40 GFGB COc1ccc(S(=O)(=O)/C(C#N)=C\Nc2ccc(F)c([N+](=O)[O-])c2)cc1 102692785 GUPNGTCYOATNDS-UVTDQMKNSA-N 377.353 2.993 50 40 GFGB C=C(C)C(=O)OCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1ccc(CC)cc1 2274617 NUUOUAVKRIPXTO-LJQANCHMSA-N 396.443 2.993 50 40 GFGB COc1ccccc1OCC(=O)NNC(=O)COc1ccc(C(C)(C)C)cc1 4698758 PSVRCHKCSMFUIY-UHFFFAOYSA-N 386.448 2.598 50 40 GFGB CN(c1ccc(C(=O)N/N=C/c2cccc(C(F)(F)F)c2)cc1)S(C)(=O)=O 409119285 SOGRWHNAFGKLGC-SRZZPIQSSA-N 399.394 2.865 50 40 GFGB C[C@@H]1CCc2sc(C(=O)NNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)cc2C1 43934296 GFUNDNBXCCVIQG-GHMZBOCLSA-N 381.498 2.547 50 40 GFGB Cc1cc2c(c(=O)n1Cc1ccco1)[C@@H](c1ccc([N+](=O)[O-])o1)C(C#N)=C(N)O2 2363798 GHOYPGPZZLTNDG-MRXNPFEDSA-N 394.343 2.517 50 40 GFGB Cc1ccc(S(=O)(=O)Oc2ccc3ccccc3c2/C=N/NC(N)=O)cc1 408926759 YGBXJKSRZDZVHG-CIAFOILYSA-N 383.429 2.918 50 40 GFGB O=C(NNC(=O)c1cc(-c2ccccc2Cl)on1)c1cccc([N+](=O)[O-])c1 40086723 PVAMPFFUMHTLQG-UHFFFAOYSA-N 386.751 2.978 50 40 GFGB O=C(NN[C@@H]1CC(=O)N(c2ccccc2)C1=O)c1ccc(Cl)cc1Cl 100128045 BTSWTVVDNLSYKP-CQSZACIVSA-N 378.215 2.560 50 40 GFGB Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNc3ccc(F)cc3)C2)s1 32903819 UODKMRIEWFJBKJ-CYBMUJFWSA-N 397.497 2.740 50 40 GFGB CC(C)c1ccc(N2/C(=N\C(=O)CCl)S[C@H]3CS(=O)(=O)C[C@H]32)cc1 101302545 MRSOXHPOSUCGAW-KRGDBVFUSA-N 386.926 2.650 50 40 GFGB O=C(CCC(=O)c1cccs1)NNC(=O)c1ccc(Br)cc1 3612127 WADWWEBYBRWLOI-UHFFFAOYSA-N 381.251 2.935 50 40 GFGB Cc1cc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)C(N)=O)ccc1Cl 4205463 OBEWZIWHELJSNT-FMIVXFBMSA-N 380.791 2.841 50 40 GFGB CC1(C)Cc2ccccc2/C(=C/C(=O)C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)N1 4729618 CCMOGXCSJUCDAY-URUQAVFTSA-N 392.415 2.579 50 40 GFGB C[C@@H](NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1 12788616 MDXWLEXDKJHQBF-LLVKDONJSA-N 391.468 2.866 50 40 GFGB CCn1c(C)nc2cc(C(=O)N/N=C/c3cc4c(cc3[N+](=O)[O-])OCO4)ccc21 3469218 HLDWKWYIRSAJRC-AWQFTUOYSA-N 395.375 2.765 50 40 GFGB O=C(CCC(=O)Nc1ccccc1)NNC(=O)COc1ccc2ccccc2c1 4508675 MTXGDSRPMHXOLG-UHFFFAOYSA-N 391.427 2.785 50 40 GFGB COC(=O)c1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)cc1 409265147 NYRKZNKPFUBAIE-BYWZACNXSA-N 393.443 2.593 50 40 GFGB COc1cc([N+](=O)[O-])cc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)c1O 855670 JMNJEFFNORNTOL-AWQFTUOYSA-N 387.392 2.763 50 40 GFGB COc1cccc([C@H]2C(C#N)=C(N)Oc3cc(C)n(C[C@@H]4CCCO4)c(=O)c32)c1 1476103 FTIQCCNOWCXKQZ-LPHOPBHVSA-N 393.443 2.563 50 40 GFGB Cc1ccc(Cl)cc1N(CC(=O)N/N=C/c1sccc1C)S(C)(=O)=O 20212795 NGEOIEMKYZLUGD-GIJQJNRQSA-N 399.925 2.935 50 40 GFGB Cc1ccc(S(=O)(=O)/C(C#N)=C\N2CCN(Cc3ccccc3)CC2)cc1 60212412 NNDIBAKLZNJWHD-FXBPSFAMSA-N 381.501 2.952 50 40 GFGB CCN(C(=O)COC(=O)/C(C#N)=C\c1ccc2c(c1)OCO2)c1ccccc1 6177358 ALAPXLUYSXGOLN-YBEGLDIGSA-N 378.384 2.919 50 40 GFGB C=CCc1cccc(/C=N/NC(=O)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)c1O 5725886 YBKSYQHDKUBMES-FYJGNVAPSA-N 396.403 2.898 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)cc1OC 408871563 HIOCFRANWLBTDI-VXLYETTFSA-N 377.784 2.958 50 40 GFGB Cc1nc2ccccn2c1C(=O)NNC(=O)N(C)Cc1ccc(Cl)s1 9467407 XVSKAJZWUXNBLD-UHFFFAOYSA-N 377.857 2.844 50 40 GFGB COc1cccc(/C=N/NC(=O)c2cccc(Cl)c2)c1O[C@H](C)C(=O)O 409232293 PXBGFPNOZYIUFO-JZOCJUILSA-N 376.796 2.964 50 40 GFGB Cc1c(C(=O)N/N=C/c2ccc(O)c(Br)c2)sc(N)c1C#N 843046 VUVMTYDFRBVXAN-NGYBGAFCSA-N 379.239 2.742 50 40 GFGB COc1cc(/C=N/NC(=O)c2cncc(Br)c2)cc(Cl)c1O 2338529 WGGJJMLMSXIAJO-BLLMUTORSA-N 384.617 2.976 50 40 GFGB CCOc1ccc(C(=O)N/N=C/c2cn(CCC(N)=O)c3ccccc23)cc1 20764136 OLIWBTCVELKGAZ-YDZHTSKRSA-N 378.432 2.679 50 40 GFGB O=C(C[C@H]1CCS(=O)(=O)C1)N/N=C1/C[C@H](c2ccccc2)Oc2ccccc21 38323574 YYIFVMHODGLJNA-AEHDNIJVSA-N 398.484 2.856 50 40 GFGB COc1cc(C)ccc1C(=O)N/N=C/c1ccc(I)o1 408994558 HZFSQODJFUCFFW-LZYBPNLTSA-N 384.173 2.965 50 40 GFGB NNC(=O)c1cccc(S(=O)(=O)N(Cc2ccccc2)Cc2ccccc2)c1 225501480 YCPHTTVTKGENFZ-UHFFFAOYSA-N 395.484 2.681 50 40 GFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)c(OC)c1 18223112 PDIQZSIOPAXTNA-QGZVFWFLSA-N 375.384 2.763 50 40 GFGB Cn1cccc1CC(=O)NN[C@H](C(=O)Nc1ccc(F)cc1)c1ccccc1 40007493 OXTBOPGGGXSRTH-FQEVSTJZSA-N 380.423 2.708 50 40 GFGB CCOc1cc(/C=C(/C#N)C(=O)N(C)C)c(Br)cc1OCC#N 59334739 NDSYDLBMVYMUNE-GHXNOFRVSA-N 378.226 2.745 50 40 GFGB CC1=NN(c2ccccc2)C(=O)/C1=C(/NNC(=O)c1ccncc1)C(F)(F)F 17087255 BPVKVXADVGQPAC-CCEZHUSRSA-N 389.337 2.555 50 40 GFGB C#CCOc1c(Br)cc(/C=C(/C#N)C(=O)NC(C)C)cc1OC 408772105 CWEKYKFRLMQEDL-QPEQYQDCSA-N 377.238 2.901 50 40 GFGB N#CCCn1ncc([P+](c2ccccc2)(c2ccccc2)c2ccccc2)c1N 102137828 MPBGRMBDYJGITR-UHFFFAOYSA-N 397.442 2.998 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])c(O)c2ncccc12)c1cccc([N+](=O)[O-])c1 59459147 YOVACNPSRXLVBL-DJKKODMXSA-N 381.304 2.521 50 40 GFGB O=C(NNS(=O)(=O)c1cccc(OC(F)(F)F)c1)c1c[nH]c2ccccc12 12741000 BBIKRHDBUSWUEN-UHFFFAOYSA-N 399.350 2.690 50 40 GFGB C/C(=N\NC(=O)CCNC(=O)c1ccccc1Cl)c1ccc([N+](=O)[O-])cc1 5620829 YLFFCZMSBANBOR-CIAFOILYSA-N 388.811 2.909 50 40 GFGB C/C(CC(=O)NCC(C)C)=N\NC(=O)COc1ccc(C)cc1Br 4416281 JFTAEGMRDRXUGW-DEDYPNTBSA-N 398.301 2.791 50 40 GFGB COc1ccc(C(=O)Nc2cccc(C(=O)NNC(=O)c3ccco3)c2)cc1 8116991 MWVMQRPHRQFZRD-UHFFFAOYSA-N 379.372 2.615 50 40 GFGB O=C(NNC(=O)c1ccccc1OCCOc1ccccc1)c1cccnc1 14242514 IVJKQWQBNHFZDW-UHFFFAOYSA-N 377.400 2.614 50 40 GFGB COc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)c(O)c1 18050612 RNFISHVIWYFBCK-ZDUSSCGKSA-N 380.400 2.783 50 40 GFGB O=C(N/N=C\c1ccc([N+](=O)[O-])o1)c1cccc(I)c1 32256116 OCQAUBCMRVCEMD-AUWJEWJLSA-N 385.117 2.556 50 40 GFGB COc1ccc(-n2cc(C(=O)NNc3cccc(Br)c3)nn2)cc1 1631029993 ZJMCHVDHLFKBSW-UHFFFAOYSA-N 388.225 2.795 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1ccn(Cc2ccc([N+](=O)[O-])cc2)n1 8780764 FIEBHSVTHLVXQD-YBFXNURJSA-N 394.347 2.512 50 40 GFGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1cn(CC(N)=O)c2ccccc12 818720 ONPXMSKLNNMOOY-IBGZPJMESA-N 390.443 2.577 50 40 GFGB CCc1ccc(-c2nc(C(=O)NNS(=O)(=O)c3ccccc3)cs2)cc1 12853878 IVVOAGYQXVBAJZ-UHFFFAOYSA-N 387.486 2.996 50 40 GFGB CC(C)CN(CC(C)C)C(=O)CSC1=C(C#N)C(C)(C)[C@@H](C#N)C(=O)N1 7250967 PVDJWPATGBTUOX-AWEZNQCLSA-N 376.526 2.891 50 40 GFGB CCOc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)ccc1OCC(=O)O 408746900 HKZXNTDYKUSSCV-YVLHZVERSA-N 380.400 2.772 50 40 GFGB COc1ccc(/C=N\NC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3)C2)c(OC)c1 409154634 HBKATAMTQVDGTG-BDQMVGTNSA-N 381.432 2.515 50 40 GFGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc2cc(C)cc(C)c2[nH]c1=O 876515 VWMAQCYOBOZDER-KRWDZBQOSA-N 379.416 2.790 50 40 GFGB O=C(CNc1ccccc1)N/N=C/c1cc2c(cc1Br)OCO2 989514 DJEIKDGJNCZHAH-UFWORHAWSA-N 376.210 2.740 50 40 GFGB CCc1ccccc1N(CC(=O)N/N=C(\C)c1ccc(F)cc1)S(C)(=O)=O 20208965 KWHPDHAUQXFMSW-KGENOOAVSA-N 391.468 2.695 50 40 GFGB COc1cc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc(OC)c1O 408965633 WQMJNKWATWPBMZ-DJKKODMXSA-N 385.332 2.828 50 40 GFGB CCCc1n[nH]c2c1[C@H](c1cc(OC)c(OC(C)=O)c(OC)c1)C(C#N)=C(N)O2 806431 GVJYJSFOEHJIQG-MRXNPFEDSA-N 398.419 2.523 50 40 GFGB biogenic,in-vitro CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)NNC(=O)c1csc(C)c1C)[C@H]2C(=O)O 5697397 WCKKBTDCLNSGBU-OJDYBEQGSA-N 376.478 2.819 50 40 GFGB Cn1cnnc1Sc1ccc(/C=N\NC(=O)c2cccs2)cc1[N+](=O)[O-] 33415255 XNPMMRMEZUWXHY-PXNMLYILSA-N 388.434 2.700 50 40 GFGB CC(=O)c1cccc(-c2ccc(/C=C3/C(=O)N(CCO)C(=O)C(C#N)=C3C)o2)c1 101139244 YPLPHGBHWFQQOB-WOJGMQOQSA-N 390.395 2.734 50 40 GFGB C=CCN1C(=O)[C@]2(C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)c2ccccc21 989165 FHXYIGJNHAFDTE-QHCPKHFHSA-N 397.390 2.698 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccn2)ccc1Oc1ccc([N+](=O)[O-])cn1 2304157 MPWARNIUNCXYOT-SSDVNMTOSA-N 393.359 2.950 50 40 GFGB CCOc1ccc(N([C@@H](C)C(=O)NN=C2CCCCC2)S(C)(=O)=O)cc1 6554307 RXRUFBXYJJNGIS-AWEZNQCLSA-N 381.498 2.676 50 40 GFGB COc1ccc(Br)cc1C(=O)N/N=C/c1cccc([N+](=O)[O-])c1O 409096914 LJQQIXIRCHJZMW-CAOOACKPSA-N 394.181 2.835 50 40 GFGB O=C(CNC1CCCCC1)N/N=C/c1cc2c(cc1Br)OCO2 409386228 LXSLDDMKASGIPE-UFWORHAWSA-N 382.258 2.550 50 40 GFGB Cc1ccc(-c2cc(C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)n[nH]2)s1 32794889 STBONPFQNNATEF-LLVKDONJSA-N 388.424 2.814 50 40 GFGB COc1cc([C@H]2ON=C(C(=O)N/N=C/c3ccc(F)cc3)[C@@H]2C)cc2c1OCO2 15085851 NOLSIEJLPQXROM-NMIDASLBSA-N 399.378 2.777 50 40 GFGB O=C(COc1ccccc1Cl)N/N=C\c1ccc(N2CCOCC2)c(F)c1 409144432 FRDKGAHXUWQNOR-UUYOSTAYSA-N 391.830 2.845 50 40 GFGB C/C(CCc1ccccc1)=N\NC(=O)CN(c1ccc(C)cc1)S(C)(=O)=O 19954587 QFWPJBKQYRGUSY-HEHNFIMWSA-N 387.505 2.886 50 40 GFGB COc1cc(/C=N/NC(=O)c2cccc(Br)c2)cc(OC)c1O 5526599 RANRAYVNUCUMKA-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2cc(Br)c(C)o2)n1 408861316 QHLVRCINMYPEEJ-OMCISZLKSA-N 383.271 3.000 50 40 GFGB COC(=O)C1=C(C(=O)c2ccc(OC)cc2)[C@@H](c2ccccc2)C(C#N)=C(N)O1 66088023 CDHNQIOJLWYGMY-KRWDZBQOSA-N 390.395 2.813 50 40 GFGB O=C(NNS(=O)(=O)c1ccccc1F)c1cc(-c2ccccn2)ccc1F 1529012642 MEEPCBKNIVBIRA-UHFFFAOYSA-N 389.383 2.650 50 40 GFGB CC(C)(C)c1cc(CCC(=O)NNC(=O)/C=C/C(=O)O)cc(C(C)(C)C)c1O 3199337 LIYNUQGJQCPOGJ-MDZDMXLPSA-N 390.480 2.708 50 40 GFGB COC(=O)COc1c(Cl)cc(/C=N/NC(=O)Cc2ccccc2)cc1OC 8110985 VRJCXCPPEOIDFS-SRZZPIQSSA-N 390.823 2.593 50 40 GFGB C[C@@H](CCC(=O)ON1C(=O)CCC1=O)SSc1ccc([N+](=O)[O-])cn1 101715724 JFSJKWBYKAONEH-VIFPVBQESA-N 385.423 2.506 50 40 GFGB Nc1nnc(CC(=O)N/N=C/c2cn(Cc3ccccc3)c3ccccc23)s1 1243786 WXZKSNFUWAOUTP-SSDVNMTOSA-N 390.472 2.816 50 40 GFGB C/C(=N\NC(=O)[C@@H](C)Oc1cccc(C)c1C)c1ccc2c(c1)NC(=O)CO2 8105571 HJGYMENYTUFRFY-QKIXXSFTSA-N 381.432 2.942 50 40 GFGB Cc1ccc(OCCC(=O)NNC(=O)c2ccc(Br)cc2)cc1 3293786 KIFSVIAABFUXPM-UHFFFAOYSA-N 377.238 2.988 50 40 GFGB CCOC(=O)N1CC=C2[C@@H](C1)[C@H](c1ccccc1F)C(C#N)=C(N)C2(C#N)C#N 20026570 HYBBJNYCZZCGFX-CRAIPNDOSA-N 391.406 2.708 50 40 GFGB COc1ccc(C(=O)N/N=C/c2ccc(OCC(=O)NC(C)(C)C)cc2)cc1 408996480 PLOLJLLQLDUQRT-LPYMAVHISA-N 383.448 2.753 50 40 GFGB Cc1cc2nnc(SCC(=O)NNC(=O)c3cccs3)n2c2ccccc12 4843459 OMUZUAOQTZNRPY-UHFFFAOYSA-N 397.485 2.806 50 40 GFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1Cl 409182599 MZGHDTWZKUWSKD-CAOOACKPSA-N 378.728 2.929 50 40 GFGB O=C(NNS(=O)(=O)c1cccc(C(F)(F)F)c1)c1cc2c(s1)CCC2 7379621 HQTXSVVYIYXXQY-UHFFFAOYSA-N 390.408 2.879 50 40 GFGB N#CC1=C(N)N=C(SCC(=O)c2ccccc2)[C@@H](C(N)=O)C12CCCCC2 102413868 NDXFUXRUXPCGLW-MRXNPFEDSA-N 382.489 2.760 50 40 GFGB CCOC(=O)N1CC=C2[C@H](C1)[C@H](c1ccccc1F)C(C#N)=C(N)C2(C#N)C#N 20026572 HYBBJNYCZZCGFX-MAUKXSAKSA-N 391.406 2.708 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc(Br)c1OC 408734936 LRHWLVKQXHGXDR-XEVNVYFWSA-N 395.253 2.668 50 40 GFGB CCc1c(C(=O)NNC(=O)Cc2ccc(OC)cc2)cnn1-c1ccc(C)cc1 12985497 YQJOMNPUVFUDBH-UHFFFAOYSA-N 392.459 2.755 50 40 GFGB Cc1ccc(/C=N\NC(=O)c2nn(-c3ccc(C)cc3)c(=O)c(C#N)c2C)cc1 409059967 SWNLRUJUYUMDAV-CFRMEGHHSA-N 385.427 2.793 50 40 GFGB O=C(NNc1ccc([N+](=O)[O-])cc1)c1ccccc1I 4309558 XGDCUKNFYRFFNZ-UHFFFAOYSA-N 383.145 2.956 50 40 GFGB COCCN1C(=O)C(C#N)=C(C)/C(=C/Nc2cccc(Br)c2)C1=O 9422641 GBVSMOKCSSKRDZ-GDNBJRDFSA-N 390.237 2.600 50 40 GFGB O=C(Cn1cc(C(F)(F)F)ccc1=O)N/N=C/c1ccccc1OC(F)F 3186642 YZTUSVWTAZVUSO-QPJQQBGISA-N 389.280 2.619 50 40 GFGB N#C/C(=C\c1cccc(Oc2ccccc2)c1)C(=O)N[C@H]1CCS(=O)(=O)C1 26966635 AITPJPKCOJUUFV-YTBHAWNYSA-N 382.441 2.689 50 40 GFGB C=CCc1cc(/C=N/NC(=O)c2ccccc2OC)cc(OC)c1OCC(=O)O 59679495 IRZADBSYDNMQQI-WSDLNYQXSA-N 398.415 2.660 50 40 GFGB C[C@@H](Sc1ccccc1)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1 58244426 MIJUYLLXGMHYBY-CYBMUJFWSA-N 391.518 2.751 50 40 GFGB C[C@H](NC(=O)c1ccccc1)C(=O)N/N=C/c1c(F)c(F)c(F)c(F)c1F 2322915 FUHGWXGZBXAUJB-AGAGKTNKSA-N 385.292 2.651 50 40 GFGB O=C(NNc1ccc(F)cc1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1 45971738 VKPFYCVZTDSYER-UHFFFAOYSA-N 395.431 2.896 50 40 GFGB CCOc1ccc(NC(=O)CCC(=O)NNC(=S)Nc2ccccc2)cc1 4551322 OLSFLJXSZIFXQL-UHFFFAOYSA-N 386.477 2.822 50 40 GFGB O=C(N/N=C/c1ccccc1)[C@H]1CC(=O)N(c2ccc(Br)cc2)C1 409153856 IWNIMSGWALVHHP-HXJASHHUSA-N 386.249 2.952 50 40 GFGB COc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1ccc(OCC(=O)O)cc1 408892757 CHBNIRMEBWLENB-MDWZMJQESA-N 397.343 2.612 50 40 GFGB N#CCOc1ccccc1/C=N/NC(=O)C(O)(c1ccccc1)c1ccccc1 408818151 PBQZQJOHPOVJNN-KOEQRZSOSA-N 385.423 2.975 50 40 GFGB O=C(Cc1c[nH]c2ccccc12)NNC(=O)c1ccccc1OC[C@@H]1CCCO1 22873564 DBGNRANACCJPIS-INIZCTEOSA-N 393.443 2.729 50 40 GFGB Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)NNC(=O)c1cccc(N(C)C)c1 12515825 QDXBIUKNHVVANH-UHFFFAOYSA-N 395.438 2.769 50 40 GFGB NNC(=O)c1ccc2oc(-c3cccc(I)c3)nc2c1 225615151 LEVMSQDVCMZLCV-UHFFFAOYSA-N 379.157 2.703 50 40 GFGB N#C/C(=C\c1cc(Br)c2c(c1)OCO2)C(=O)NCc1ccco1 20885568 ZIRHRQUPBFVTDH-NYYWCZLTSA-N 375.178 2.994 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2Br)cc1 2747615 BWDRQLQRWNKBGF-VCHYOVAHSA-N 376.210 2.547 50 40 GFGB Cc1nnc(SCC(=O)N/N=C/c2cc(Br)ccc2O)s1 2353666 SHDCVHWNROVDBN-LHHJGKSTSA-N 387.284 2.557 50 40 GFGB Cc1cccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCc3ccccn3)c2C)c1 408973146 SGCSGABDBZWVQH-DHRITJCHSA-N 389.459 2.564 50 40 GFGB C=C(C)C(=O)OCCOC(=O)C1=C(N)OC(C)=C(C#N)[C@H]1c1ccc(CC)cc1 5911706 QYBWTNKIAJBCTR-GOSISDBHSA-N 396.443 2.993 50 40 GFGB Cc1ccc(-c2[nH]nc3c2[C@@]2(C(=O)Nc4ccc(F)cc42)C(C#N)=C(N)O3)cc1 664647 WRZXXWMCCIBJKY-NRFANRHFSA-N 387.374 2.849 50 40 GFGB NS(=O)(=O)c1cc(C(=O)N/N=C/C(Cl)=C/c2ccccc2)ccc1Cl 7990810 ZHGPFPSQHSTURO-UEKDOHQUSA-N 398.271 2.983 50 40 GFGB COc1cc(C(=O)N/N=c2/c(=O)c3cccc4cccc2c43)cc(OC)c1OC 3359547 BDWIDTAKANPMNB-FCDQGJHFSA-N 390.395 2.500 50 40 GFGB CC(C)(C)OC(=O)N[C@H](CSSc1ncccc1[N+](=O)[O-])C(=O)O 2560675 OVTLOLNDKQUMRH-MRVPVSSYSA-N 375.428 2.708 50 40 GFGB O=C(COc1ccccc1Cl)N/N=C\c1cc2c(cc1[N+](=O)[O-])OCO2 4592497 DFUKBPMPFWOVMX-WSVATBPTSA-N 377.740 2.506 50 40 GFGB Cc1ccc(S(=O)(=O)N[C@H](CC(=O)NCCCl)c2ccccc2)cc1 408979623 NJYWYWRLTDTDJG-QGZVFWFLSA-N 380.897 2.760 50 40 GFGB CN(C)c1ccc(C(=O)N/N=C2\C(=O)Nc3ccc(Br)cc32)cc1 6027038 ZHFHQCXNAQHBGX-UHFFFAOYSA-N 387.237 2.601 50 40 GFGB CCc1cc(C(=O)NNC(=O)[C@@H]2[C@@H](C(=O)O)[C@@H]3CC[C@H]2C3=C(C)C)cs1 17076979 JOQGNRGLWIHDEO-XRGAULLZSA-N 376.478 2.765 50 40 GFGB CCOC(=O)[C@H]1C[C@@H](Cl)[C@H]([S@@](=O)c2ccccc2)C[C@H]1C(=O)OCC 12413116 CMYFIVFGISYXSM-GZDJWIMXSA-N 386.897 2.923 50 40 GFGB O=C(COc1cccc([N+](=O)[O-])c1)N/N=C/c1cc2c(cc1Cl)OCO2 3060361 YCTBFDKVMNTKOI-CNHKJKLMSA-N 377.740 2.506 50 40 GFGB CCc1sc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccco3)C2)cc1C 12740957 AUUFUJSZJKTNQG-ZDUSSCGKSA-N 389.477 2.525 50 40 GFGB O=C(N/N=C/c1ccc(O)c(Br)c1)c1ccc2c(c1)OCCO2 1437599 DJJKVQUWCDOFHB-GIJQJNRQSA-N 377.194 2.690 50 40 GFGB C/C(=N\NC(=O)c1nc2nc(C)cc(C)n2n1)c1ccc(Br)cc1 1301646 HFEXGAWCYSOVOL-RGVLZGJSSA-N 387.241 2.658 50 40 GFGB CCOC(=O)COc1c(Cl)cc(/C=C(/C#N)C(=O)N(C)C)cc1OCC 59334656 GAWJEKITQKBJOD-QPEQYQDCSA-N 380.828 2.676 50 40 GFGB Cc1ccc(Cl)cc1N(CC(=O)N/N=C/c1cccs1)S(C)(=O)=O 20212646 MOSKDMDSPXPMKI-RQZCQDPDSA-N 385.898 2.626 50 40 GFGB O=C(N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O)c1ccc(O)cc1 409121367 YCEZIEJMKGWZDP-FRKPEAEDSA-N 380.154 2.532 50 40 GFGB CC/C(=N\NC(=O)CCN1CCN(c2ccccc2)CC1)c1cc(F)ccc1O 5692473 DDAMCCMFFFQINX-HIXSDJFHSA-N 398.482 2.974 50 40 GFGB CC(C)(CCl)C(=O)Nc1cc(C2CC2)nn1-c1nc2c(c(=O)[nH]1)CCCC2 12130245 DKZKYUGNUVBWTA-UHFFFAOYSA-N 389.887 2.915 50 40 GFGB Cc1ccc(-c2noc(SCC(=O)NNC(=O)Cc3ccccc3)n2)cc1 7604756 HHFNKHTYLJQENZ-UHFFFAOYSA-N 382.445 2.527 50 40 GFGB O=C(N/N=C\c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)c1ccccc1-n1cccc1 71335771 TUDTVODTPDMFKX-ODLFYWEKSA-N 395.331 2.763 50 40 GFGB CCOC(=O)Cn1c(C)c(/C=N/NC(=O)[C@H](O)c2ccccc2)c2ccccc21 14134693 FTGUOSAHSUPMEP-GWJNGDFSSA-N 393.443 2.697 50 40 GFGB O=C(N/N=C/c1ccc(Cl)cc1Cl)C(=O)Nc1ccc2c(c1)OCO2 5582986 CJLYOVMKGNGNBW-FBCYGCLPSA-N 380.187 2.811 50 40 GFGB O=C(N/N=C/c1ccccc1[N+](=O)[O-])c1ccccc1I 668320 HABWKLPEKRCRGJ-CXUHLZMHSA-N 395.156 2.963 50 40 GFGB C[C@H]1Cc2ccccc2N1C(=O)COC(=O)/C(C#N)=C\c1ccc2c(c1)OCO2 6383335 RZYVNDKCQYFMLH-DUPVFGOHSA-N 390.395 2.843 50 40 GFGB COc1ccc(-c2n[nH]cc2/C=C(\C#N)C(=O)NCc2cccnc2)cc1OC 5728362 SKZOMPBBISGSAI-LZYBPNLTSA-N 389.415 2.712 50 40 GFGB O=C(Oc1ccc([N+](=O)[O-])cc1/C=N\NC(=O)c1ccccc1O)c1ccco1 409219108 NGVZAYYIEMKWMS-JAIQZWGSSA-N 395.327 2.877 50 40 GFGB O=C(NNC(=O)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1)C1CC1 72272658 ZVBIFSGLMVGISZ-TZIWHRDSSA-N 391.471 2.724 50 40 GFGB Cc1cccc(/C=N\NC(=O)c2nn(-c3cccc(C)c3)c(=O)c(C#N)c2C)c1 409051595 AZNJTSAERBUWBE-CFRMEGHHSA-N 385.427 2.793 50 40 GFGB COc1cc(/C=N\NC(=O)Cc2ccc(OC)c(Br)c2)ccc1O 31895840 APNMYQGOJYKNDP-GRSHGNNSSA-N 393.237 2.865 50 40 GFGB Cc1cccc(N2C(=O)CS/C2=N\NC(=O)c2ccc([N+](=O)[O-])cc2)c1C 5027618 LIJNHIRAVQEUQU-ZZEZOPTASA-N 384.417 2.992 50 40 GFGB O[C@]12[C@@H](Br)[C@H]3[C@H]4[C@@H]1C(Br)(Br)[C@H]1[C@@H]4C[C@H]3[C@H]12 169795851 WZBOKYFPZUQGLI-PPEFCJDOSA-N 398.920 2.739 50 40 GFGB CC(=O)Nc1ccc(C(=O)N/N=C/c2cc(Br)ccc2O)cc1 5378360 TVOOSQBQUHYYOC-GIJQJNRQSA-N 376.210 2.877 50 40 GFGB Cc1onc(-c2ccccc2)c1C(=O)NNC(=S)NC(=O)c1ccc(F)cc1 2253121 JMAORDZXAYVRGJ-UHFFFAOYSA-N 398.419 2.738 50 40 GFGB Cc1c(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)cccc1[N+](=O)[O-] 6509331 ULRZUIJFWMZQBC-UHFFFAOYSA-N 378.344 2.902 50 40 GFGB COc1cc(SC#N)ccc1N/C=C1/C(=O)NC(=O)N(c2ccccc2)C1=O 6906596 FAPGVAJILQHGFC-UVTDQMKNSA-N 394.412 2.847 50 40 GFGB Cc1occc1C(=O)NNC(=O)/C=C/c1cc(Cl)c2c(c1)OCCCO2 7780328 ZGLSFNZHYZBDRX-ONEGZZNKSA-N 376.796 2.877 50 40 GFGB COc1ccc(CSCC(=O)N/N=C/c2ccc(N3CCOCC3)o2)cc1 408996271 CUKDUBYYNHDMIX-UDWIEESQSA-N 389.477 2.508 50 40 GFGB CCOc1cc(/C=N\NC(=O)c2ccc(C)cc2)cc(Cl)c1OCC(N)=O 409261920 FXTXBPVEJPLDGK-YVNNLAQVSA-N 389.839 2.675 50 40 GFGB O=C(Cn1nc(C(F)F)cc1C1CC1)N/N=C/c1ccn(CC(F)(F)F)n1 252482990 DRYSBBDLXBVTSN-AERZKKPOSA-N 390.316 2.607 50 40 GFGB CC(C)(CCl)C(=O)Nc1cc(C2CC2)nn1-c1nc2c(c(=O)[nH]1)CCC2 12129336 HZUXTGYWHMJHOZ-UHFFFAOYSA-N 375.860 2.525 50 40 GFGB Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)[C@@H](C)n3ccnc3)cc12 40143223 RCYAPUFSRZEYSI-CYBMUJFWSA-N 394.460 2.614 50 40 GFGB O=C(NNC(=S)NCc1ccco1)c1cccc(OC(F)(F)C(F)F)c1 2793910 KQUOVNVNXCOESE-UHFFFAOYSA-N 391.346 2.825 50 40 GFGB C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc2cc(CC)ccc2[nH]c1=O 4131447 NMPKICWJKOAHPL-IBGZPJMESA-N 391.427 2.901 50 40 GFGB O=C(N/N=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)Nc1ccccc1 58914508 KSHFESUEYVHLJC-NDENLUEZSA-N 378.344 2.944 50 40 GFGB CCCn1c(O)c(C(=O)NNC(=O)c2ccccc2Cl)c(=O)c2ccccc21 2306003 GDXIQGWXXAFAOU-UHFFFAOYSA-N 399.834 2.845 50 40 GFGB O=C(NNS(=O)(=O)c1ccccc1C(F)(F)F)c1cc2c(s1)CCC2 7379635 LXHOUSXCQWJMGM-UHFFFAOYSA-N 390.408 2.879 50 40 GFGB Cn1cc(C(=O)NNS(=O)(=O)c2ccc(Cl)cc2F)c2ccccc21 7907430 WIRXEYIXBDLFJL-UHFFFAOYSA-N 381.816 2.594 50 40 GFGB COC(=O)COc1ccc(/C=N\NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 408904220 GQDJYCTWBMKIHE-JMIUGGIZSA-N 397.343 2.657 50 40 GFGB CCOC(=O)c1c(NC(=O)CCl)sc2c1CC[C@@H](Br)C2=O 101023409 NECWIIUUGDEJCI-SSDOTTSWSA-N 394.674 2.995 50 40 GFGB Cc1csc(SCC(=O)NNC(=O)c2ccc(Br)cc2)n1 2620049 SRFYWCCGSHZPKW-UHFFFAOYSA-N 386.296 2.767 50 40 GFGB COc1cccc([C@H]2CC(=O)N3C(=C2C#N)SC[C@@]3(O)c2ccco2)c1OC 12275687 QDJDZSCVFWBMRU-ZUOKHONESA-N 398.440 2.940 50 40 GFGB COc1cc(OC)c(OC)cc1/C=C(\C#N)C(=O)Nc1cccc(C(=O)O)c1 3255490 MHTAWEOQEQDKKU-VGOFMYFVSA-N 382.372 2.956 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccsc3)[C@H]2C1 1803228 KUQNRDWGSIFKAO-JKSUJKDBSA-N 379.445 2.630 50 40 GFGB C/C(N)=C(\C#N)C(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(F)cc1 103091573 ROPMQKFLKZWCIV-VBKFSLOCSA-N 394.431 2.942 50 40 GFGB CC(C)COc1ccc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NN)cc1 2244828 XCADQIRCXQIMHU-FQEVSTJZSA-N 394.475 2.534 50 40 GFGB O=C(Cn1ccc2ccccc21)NNC(=O)c1ccc(OC[C@H]2CCCO2)cc1 13619775 URJWNUKDXIAYCH-LJQANCHMSA-N 393.443 2.660 50 40 GFGB NC(=O)COc1ccc(/C=N/NC(=O)c2ccc(C(F)(F)C(F)F)cc2)cc1 4507161 KPUVQMDFFOLYQW-PGGKNCGUSA-N 397.328 2.672 50 40 GFGB CN(NC(=O)c1ccc(Cl)c(S(=O)(=O)NC2CC2)c1)c1ccccc1 8358587 MYQPXMFPOWFJQA-UHFFFAOYSA-N 379.869 2.562 50 40 GFGB CCc1ccc(N(CC(=O)N/N=C(\C)c2ccc(C)cc2)S(C)(=O)=O)cc1 409028756 RNCYQCUEZZTMHT-LTGZKZEYSA-N 387.505 2.864 50 40 GFGB CCOc1ccc(/C=N\NC(=O)[C@H]2CC(=O)N(c3ccc(OC)cc3)C2)cc1 409167982 KNQOYSCILMSCRY-GLFIFPSUSA-N 381.432 2.597 50 40 GFGB Cn1cc(Br)c(C(=O)N/N=C/c2ccc(Br)cc2)n1 1088950 VIZFXUSTZASYMT-GIDUJCDVSA-N 386.047 2.709 50 40 GFGB COc1ccccc1/C=N/NC(=O)C(=O)Nc1ccccc1Br 59435812 FFSLRWAKENZCDD-VCHYOVAHSA-N 376.210 2.547 50 40 GFGB O=C(NNC(=O)c1cc2cc(Cl)cc(Cl)c2oc1=O)c1ccncc1 10384472 FFSAZARAANLXLK-UHFFFAOYSA-N 378.171 2.570 50 40 GFGB CCOc1ccc(N([C@H](C)C(=O)NN=C2CCCCC2)S(C)(=O)=O)cc1 6554308 RXRUFBXYJJNGIS-CQSZACIVSA-N 381.498 2.676 50 40 GFGB COc1cc(Br)c(OC)c(C(=O)NNc2nc(C)cc(C)n2)c1 40040043 QHOFRWSOHJUMJJ-UHFFFAOYSA-N 381.230 2.630 50 40 GFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)c2cc(Cl)ccc2O)cc1 100522597 OFBFPDCFFZJVPI-WSDLNYQXSA-N 389.839 2.866 50 40 GFGB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1oc2ccccc2c1C 12977674 FJCHQXQRSNQESL-UHFFFAOYSA-N 389.389 2.581 50 40 GFGB COc1c(O)ccc(/C=N/NC(=O)c2ccccc2Br)c1[N+](=O)[O-] 4673540 YENPVZPSCBOLFC-CAOOACKPSA-N 394.181 2.835 50 40 GFGB CCCn1nc(C(=O)NNC(=O)/C=C/c2ccc(C)s2)c2ccccc2c1=O 8304840 GEDMFMQZHQBYED-ZHACJKMWSA-N 396.472 2.651 50 40 GFGB CC(C)[C@H](NC(=O)c1ccco1)C(=O)NNC(=O)Cc1cccc2ccccc12 9894217 MJUFSFACOOESTO-FQEVSTJZSA-N 393.443 2.577 50 40 GFGB N#C/C(=C/c1ccc(O)c([N+](=O)[O-])c1)C(=O)N1CCN(c2ccccc2)CC1 111903191 BNMHAXAFUSTAHN-VBKFSLOCSA-N 378.388 2.556 50 40 GFGB COc1ccccc1C(=O)N/N=C\c1cc(Br)cc([N+](=O)[O-])c1O 83319314 ARLIVRWLCANSCR-IUXPMGMMSA-N 394.181 2.835 50 40 GFGB COc1cc(C(=O)NNC(=O)c2cccc3ccccc23)cc(OC)c1OC 3395471 SQUQJQRCAVRHSN-UHFFFAOYSA-N 380.400 2.940 50 40 GFGB COc1cccc(/C=N/NC(=O)c2cc3c(OC)cc(OC)c(OC)c3[nH]2)c1 2338700 QGWAQOCPXYJELY-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB C#CCOc1ccc(/C=C(\C#N)C(=O)NCc2ccc(OC)cc2OC)cc1 408880416 IVGLOYMJSVRQJT-LDADJPATSA-N 376.412 2.939 50 40 GFGB Cc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1ccc2c(c1)n(C)c(=O)n2C 408895906 OJSABSWLYSLRSH-RIYZIHGNSA-N 391.387 2.639 50 40 GFGB O=C(O)c1cccc(P(c2cccc(C(=O)O)c2)c2cccc(C(=O)O)c2)c1 95612005 QXJSYPPVFUFYNH-UHFFFAOYSA-N 394.319 2.539 50 40 GFGB CN(C)c1ccc([C@H]2C(C#N)=C(N)N(N(C)C)C3=C2C(=O)CC(C)(C)C3)cc1 1080470 OOMZDLYTSVOLSC-IBGZPJMESA-N 379.508 2.965 50 40 GFGB O=C(CCC(=O)c1ccc(F)cc1)NNC(=O)CSc1ccccc1F 6652497 CNELJTKMPSLSQM-UHFFFAOYSA-N 378.400 2.867 50 40 GFGB Cc1ccc(-n2c(NNC(=O)c3cccnn3)nc3ccccc3c2=O)c(C)c1 1586159016 GHLBPFIPWFWBOU-UHFFFAOYSA-N 386.415 2.549 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1cccc(I)c1 1059297 OCQAUBCMRVCEMD-VGOFMYFVSA-N 385.117 2.556 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc2ccccc12)Cc1ccccc1 6584682 VWBBJIUZKIKGBZ-HYARGMPZSA-N 395.484 2.752 50 40 GFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)COc1ccc(Cl)cc1 1434012 QJTRBWSTIQSAAG-DJKKODMXSA-N 393.783 2.795 50 40 GFGB O=C(N/N=C1/C(=O)N(CCc2ccccc2)c2ccccc21)[C@@H](O)c1ccccc1 6229232 LLYAVNCHYYXMBK-SCIJIFGBSA-N 399.450 2.830 50 40 GFGB COc1ccccc1/C(C)=N/NC(=O)CCN1CCN(c2ccccc2)CC1 15354065 SGMXXWGEDQIJFX-PTGBLXJZSA-N 380.492 2.748 50 40 GFGB N=C1NC(c2ccccc2)=N[C@@]1(NC(=O)Cc1ccccc1)C(Cl)Cl 101359247 LXBJFSLJFSHMJT-SFHVURJKSA-N 375.259 2.873 50 40 GFGB CN(CCCNC(=O)NNC(=O)c1cn(C)c2ccccc12)Cc1ccccc1 32795514 AHQDBEKVUCLJRR-UHFFFAOYSA-N 393.491 2.644 50 40 GFGB Cc1n[nH]c2c1[C@H](c1cc3cc4c(cc3nc1Cl)OCCO4)C(C#N)=C(N)O2 891986 JAJTXRUTNWOWAZ-MRXNPFEDSA-N 395.806 2.909 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)c2ccccc2Br)c(C)c1 3246999 QFDKGFROOXVMJB-UHFFFAOYSA-N 377.238 2.906 50 40 GFGB COc1ccc(C(=O)NNC(=O)CCC(=O)c2ccc3c(c2)CCC3)cc1OC 26962157 GXMOFKJCWICMKY-UHFFFAOYSA-N 396.443 2.617 50 40 GFGB CN(C)c1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2Br)cc1 59435827 GUCVOHCHEPGLKE-YBFXNURJSA-N 389.253 2.604 50 40 GFGB COc1ccc(-n2cccc2/C=N\NC(=O)COc2ccccc2[N+](=O)[O-])cc1 408848550 QZHQZYCVMLBTFV-BKUYFWCQSA-N 394.387 2.923 50 40 GFGB COc1ccc(NC(=O)N/N=C\c2ccc(O[C@H](C)C(=O)O)c(OC)c2)cc1 409020257 NFQMXNFAXFCMAU-WXYNYTDUSA-N 387.392 2.711 50 40 GFGB CCOC(=O)/C(C#N)=C\c1cc(OCC)c2oc(=O)c(C(=O)OCC)cc2c1 1096743 MYELBCKBXXCOBS-ZSOIEALJSA-N 385.372 2.838 50 40 GFGB COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(OC)c(Cl)c1 4771072 WWZCBDVVIHWOSZ-CQSZACIVSA-N 390.852 2.906 50 40 GFGB Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccccc2Br)c1 727799 AGZKRESHKZWWTG-UHFFFAOYSA-N 377.238 2.906 50 40 GFGB COc1cc(/C=N/NC(=O)[C@H](O)c2ccccc2)ccc1OC(=O)c1ccco1 1083354 JILPQLRYTVPBQC-PPRFWAEMSA-N 394.383 2.691 50 40 GFGB O=C(NNC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F)c1ccccc1O 24771910 VMKIEKMDVNQIPO-UHFFFAOYSA-N 390.321 2.672 50 40 GFGB Cc1cc(C)cc(-n2ccnc2SCC(=O)NNC(=O)Cc2ccccc2)c1 11544126 AIHDPDIJBSEQEN-UHFFFAOYSA-N 394.500 2.971 50 40 GFGB Cc1ccc2c(c1)[C@@]1(C=C3c4cc5c(cc4CCN3C(N)=C1C#N)OCO5)C(=O)N2 5427710 KUWSGSRQGQHIAI-HSZRJFAPSA-N 398.422 2.520 50 40 GFGB CC(C)c1ccc(N(CC(=O)N/N=C/c2ccc(F)cc2)S(C)(=O)=O)cc1 408775634 QVSUMWQBTOKNFD-CIAFOILYSA-N 391.468 2.865 50 40 GFGB COC(=O)c1ccc(OCC(=O)N/N=C\c2cccc(Br)c2)cc1 33382900 APLUEPJLVFBWDE-GRSHGNNSSA-N 391.221 2.765 50 40 GFGB CC1=C(C(=O)OC(C)(C)C)[C@]2(C(=O)Nc3ccc(Cl)cc32)C(C#N)=C(N)O1 1081575 VVVFSNZYSMKLIM-LJQANCHMSA-N 387.823 2.870 50 40 GFGB COc1cc(C(=O)NNC(=O)Cc2c(F)cccc2Cl)cc(OC)c1OC 3392643 NNZROZMRPACWOQ-UHFFFAOYSA-N 396.802 2.509 50 40 GFGB Cc1cc(NC(=O)NNC(=O)Cc2csc(-c3ccc(F)cc3)n2)no1 12747458 WIRFRUJLSDZVEG-UHFFFAOYSA-N 375.385 2.641 50 40 GFGB C/C(=N\NC(=O)CN(c1cccc(C)c1C)S(C)(=O)=O)c1ccc(F)cc1 5500737 KRGKYYBJXLNUBY-RCCKNPSSSA-N 391.468 2.749 50 40 GFGB Cc1ccccc1/C=N/NC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1 19682755 ZSFDSJFCCKAGRG-OEAKJJBVSA-N 384.911 2.916 50 40 GFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(OC)cc1 408602328 BRVVHEDVMRQWBM-KRWDZBQOSA-N 397.504 2.948 50 40 GFGB O=C(NC[C@@H]1CCCO1)C(=O)N/N=C/c1c2ccccc2cc2ccccc12 5777161 FIAAAHJYKVSLOH-ZZQPOVDQSA-N 375.428 2.738 50 40 GFGB C=CCN1C(=O)[C@]2(C(C#N)=C(N)Oc3[nH]nc(CCCC)c32)c2ccccc21 8568089 IHWYIPYRCHAFBT-NRFANRHFSA-N 375.432 2.657 50 40 GFGB C/C(=N\NC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O)c1ccccc1 408783397 OQGTZDWWHOYXHB-CPNJWEJPSA-N 379.869 2.646 50 40 GFGB COc1ccc(/C=N/NC(=O)c2cc(Br)ccc2O)cc1[N+](=O)[O-] 33690812 NNCYCYPHHKCBBI-CAOOACKPSA-N 394.181 2.835 50 40 GFGB Cc1ccc(-n2ncc(C(=O)NNC(=O)COc3cccc(C)c3)c2C)cc1 13019422 PWDSROWYKDPLFL-UHFFFAOYSA-N 378.432 2.638 50 40 GFGB Cc1cccc(/C=N/NC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)c1 20493223 OIBFOWHFJVROCA-YBFXNURJSA-N 379.869 2.565 50 40 GFGB Cc1ccc(C(=O)NNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 4455876 PAYZFDGPUGZMFX-UHFFFAOYSA-N 385.423 2.924 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCC1)c1cccc([N+](=O)[O-])c1 43776041 GQOLNISTERMDBK-XDHOZWIPSA-N 383.364 2.867 50 40 GFGB Cc1ccccc1N(CC(=O)N/N=C/c1ccco1)S(=O)(=O)c1ccccc1 16362838 AWUSMSDLDUVWTL-KGENOOAVSA-N 397.456 2.934 50 40 GFGB COC(=O)c1ccc(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)cc1 105378254 SPXXYJYVQWYSCV-FSJBWODESA-N 387.395 2.737 50 40 GFGB CCOC1(OCC)[C@]2(Cl)C(Cl)=C(Cl)[C@@]1(Cl)[C@H]1C(=O)OC(=O)[C@H]12 103916336 KSLULRFUPXQXQY-MJFHSKSMSA-N 390.046 2.743 50 40 GFGB Cc1cccn2c(=O)c(C=C(C#N)C#N)c(N3CCN(c4ccccc4)CC3)nc12 2199730 ZZTRPWKQYNXQAR-UHFFFAOYSA-N 396.454 2.760 50 40 GFGB Cc1cccc(OCCCC(=O)NNC(=O)c2cncn2-c2ccc(F)cc2)c1 6173625 NKDBRWUPLZWZJL-UHFFFAOYSA-N 396.422 2.940 50 40 GFGB O=C(NNS(=O)(=O)c1ccc2ccccc2c1)c1cncn1-c1ccccc1 9115920 JCTJYOPQDCZPFV-UHFFFAOYSA-N 392.440 2.649 50 40 GFGB CNC(=O)C(=O)N/N=C/c1ccccc1OCc1ccc(Cl)cc1Cl 408613289 YRANWLXRGBUPHP-ZVBGSRNCSA-N 380.231 2.769 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1Br)c1ccc2c(c1)OCO2 408592435 YDTIBZBIWJCWKZ-REZTVBANSA-N 392.165 2.850 50 40 GFGB CCOc1ccc(C(=O)NNC(=O)COc2ccc(CC)cc2)cc1OCC 15890792 WHCNENLSKUGNSG-UHFFFAOYSA-N 386.448 2.886 50 40 GFGB O=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C\c1cccc(O)c1 31892834 BMDNUNGSIXGMNR-MYYYXRDXSA-N 387.439 2.791 50 40 GFGB C[C@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1Cl 12984045 XVQYHRDFNRFMPG-NEPJUHHUSA-N 380.803 2.861 50 40 GFGB O=C1N(CN2CCc3ccccc3C2)c2ccccc2[C@]12OC[C@@H](CCl)O2 15218731 XEDFTGXKVQWEPB-DYESRHJHSA-N 384.863 2.856 50 40 GFGB COc1ccc(-c2[nH]ncc2/C=N\NC(=O)c2cccc([N+](=O)[O-])c2)cc1OC 19840339 AMKRVZMHUUDWTI-NHDPSOOVSA-N 395.375 2.766 50 40 GFGB CCOC(=O)C1=C(c2ccc(OC)cc2)OC(N)=C(C#N)[C@@H]1c1cccnc1 1305037 STLFPMADNKLVFJ-KRWDZBQOSA-N 377.400 2.872 50 40 GFGB CCOc1ccc(OCCC(=O)NNC(=O)c2cc(Cl)ccc2OC)cc1 6510503 XDKMSOMYLBHYKF-UHFFFAOYSA-N 392.839 2.977 50 40 GFGB CCOc1ccc(-n2c(C)cc(/C=N\NC(=O)CC(=O)NC(C)C)c2C)cc1 58913866 FNNJTBZKHUGNBE-XKZIYDEJSA-N 384.480 2.858 50 40 GFGB Cc1c(Cl)cccc1NC(=O)CCC(=O)NNC(=O)c1ccc(F)cc1 5006424 SCZDUFPJQDUISY-UHFFFAOYSA-N 377.803 2.967 50 40 GFGB CCOc1ccccc1OCC(=O)NNC(=O)COc1ccc(Cl)cc1C 6156103 RUBGNQPFWXHLKO-UHFFFAOYSA-N 392.839 2.652 50 40 GFGB CCc1ccccc1N(CC(=O)N/N=C/c1sccc1C)S(C)(=O)=O 20208990 YPXOCCUYJFGPMN-WOJGMQOQSA-N 379.507 2.535 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1cc2ccccc2o1 408956824 ZRLPGWKLWKPSFA-FYJGNVAPSA-N 394.387 2.942 50 40 GFGB CCN1C(=O)/C(=N\NC(=O)c2ccc3c(c2)nc(C)n3CC)c2ccccc21 6823012 YDGUWTFFWXRJLE-NMWGTECJSA-N 375.432 2.865 50 40 GFGB Cc1ccc(Cl)cc1N(CC(=O)N/N=C/c1ccccc1F)S(C)(=O)=O 408771408 GMODBBIXSGQOHR-KEBDBYFISA-N 397.859 2.704 50 40 GFGB COCCNC(=O)/C(C#N)=C/c1ccccc1OCc1ccc([N+](=O)[O-])cc1 408805558 GQMBRDKGFXNBGX-SFQUDFHCSA-N 381.388 2.843 50 40 GFGB COC(=O)C1=C(N)SS/C1=C(/N=N/c1ccc([N+](=O)[O-])cc1)[N+](=O)[O-] 17140195 GSHWXXRIRNDXEU-DVRQTUGZSA-N 383.367 2.863 50 40 GFGB Cc1ccc(Cc2nnc(SCC(=O)NNC(=O)c3ccccc3)o2)cc1 9199296 QUPUJCNWRBCFJN-UHFFFAOYSA-N 382.445 2.522 50 40 GFGB CCCC1=NN(c2ccc(OC)cc2)C(=O)/C1=C(/C)NNC(=O)c1ccncc1 103918432 SLSKMLQQPNUEBU-RGEXLXHISA-N 393.447 2.802 50 40 GFGB O=C(Cc1ccc(F)cc1)NNC(=O)c1ccc(OCc2cccnc2)cc1 23129618 LQEYCXQMHXGUSM-UHFFFAOYSA-N 379.391 2.803 50 40 GFGB CC(C)=C1[C@H]2CC[C@@H]1[C@H](C(=O)NNC(=O)c1csc(C)c1C)[C@H]2C(=O)O 5697399 WCKKBTDCLNSGBU-VZAMPYOESA-N 376.478 2.819 50 40 GFGB Cc1cccc(C)c1N(CC(=O)N/N=C/c1ccccc1Cl)S(C)(=O)=O 19955343 PKHJZJYJWJAOAL-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB COc1cc([C@H]2ON=C(C(=O)N/N=C/c3ccccc3F)[C@H]2C)cc2c1OCO2 15084055 FLWIMCMZBSHWSC-ZFKZHXNTSA-N 399.378 2.777 50 40 GFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1cc(Br)ccc1O 32528772 AHNRKJOOOKZPNU-CAOOACKPSA-N 394.181 2.592 50 40 GFGB CCn1c(SCC(=O)N/N=C/c2ccccn2)nnc1-c1ccc(C)cc1 1474349 MPHFEGWBVGMTRO-CIAFOILYSA-N 380.477 2.911 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)c2cc3c(OC)cc(OC)cc3[nH]2)c1 2223572 MVNRBKINADTNIO-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB CC(=O)Nc1ccc(/C(C)=N\NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 6014126 RKFUNKZSIWOQGA-GRSHGNNSSA-N 385.336 2.615 50 40 GFGB CCOc1cc([N+](=O)[O-])cc(/C=N/NC(=O)COc2cccc(C)c2C)c1O 36234126 GHTBAXFZCKMKDP-KEBDBYFISA-N 387.392 2.845 50 40 GFGB CC(=O)C1=C(OCc2ccccc2)OC(N)=C(C#N)[C@]12C(=O)Nc1ccccc12 49947119 GBSVEDJVXBQICE-QFIPXVFZSA-N 387.395 2.618 50 40 GFGB O=C(Cn1nnc(-c2ccccc2Cl)n1)N/N=C/c1ccccc1Cl 408732385 QKKDWSQEMOFGPF-DJKKODMXSA-N 375.219 2.797 50 40 GFGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2cc(C)c(C)cc2[nH]c1=O 876537 CMYQDXDVBZRRRI-GOSISDBHSA-N 379.416 2.790 50 40 GFGB Cc1nn(-c2ccccc2)c2c1[C@]1(C(=O)Nc3ccc(F)cc31)C(C#N)=C(N)O2 1022895 XZNNIOPALKTHKZ-OAQYLSRUSA-N 387.374 2.644 50 40 GFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1cccc(OC)c1 408607456 SDIFKXHSLZTYRN-KRWDZBQOSA-N 397.504 2.948 50 40 GFGB CC(C)N1C(=O)/C(=N\NC(=O)c2cncc(Br)c2)c2ccccc21 85928888 WAAWZCFTGKEOPZ-HKWRFOASSA-N 387.237 2.733 50 40 GFGB C[C@H]1CCc2c(C(=O)NNC(=O)[C@H]3[C@@H]4C=C[C@@H](CC4)[C@@H]3C(=O)O)csc2C1 225659267 IUKBUXKYOYNLOF-KOFBORESSA-N 388.489 2.547 50 40 GFGB CC1(C)CC(=O)C2=C(C1)N(N1CCOCC1)C(N)=C(C#N)[C@@H]2c1ccc(F)cc1 690852 JSGFITBBNDGQFO-IBGZPJMESA-N 396.466 2.809 50 40 GFGB O=C(Cc1c[nH]c2ccccc12)N/N=C1/C(=O)Nc2ccc(Br)cc21 2549856 VCWHTZJVDFBOOL-UHFFFAOYSA-N 397.232 2.946 50 40 GFGB Cc1ccc(SCC(=O)NNC(=O)c2cncc(Br)c2)cc1 6508660 LQDGHCCSVUEHBK-UHFFFAOYSA-N 380.267 2.706 50 40 GFGB Cc1cccc(O[C@H](C)C(=O)NNC(=O)Cc2sc(S)nc2C)c1C 18103695 LGJQMOOCUVGJPG-GFCCVEGCSA-N 379.507 2.514 50 40 GFGB CNC(=O)C(=O)N/N=C/c1cccc(OCc2ccc(Cl)c(Cl)c2)c1 408613333 ZCCGRQSLFDBMON-ZVBGSRNCSA-N 380.231 2.769 50 40 GFGB CCCCOc1ccc(NC(=O)C(=O)N/N=C/c2ccc(O)c(OC)c2)cc1 409267998 XQQPHCGNUDXSQR-FYJGNVAPSA-N 385.420 2.669 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C\c1cccc2ccccc12)C1CCCCC1 108280496 ZCANFUUAJMZALM-STZFKDTASA-N 387.505 2.884 50 40 GFGB COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCCC[C@H]2C)c1C 4494281 CXXBTBYZLROBJA-IYSPOMMRSA-N 387.480 2.603 50 40 GFGB Cn1cccc1CC(=O)N/N=C1/C(=O)N(CCc2ccccc2)c2ccccc21 4724635 WJMOGOYCMOAURC-YYDJUVGSSA-N 386.455 2.677 50 40 GFGB CCOC(=O)/C(C#N)=C\c1cc(Cl)c(OCC(=O)N(C)C)c(OCC)c1 96662776 ULJWQWZOSPQHQW-QPEQYQDCSA-N 380.828 2.676 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(C#N)cc2F)cc(Br)c1O 408968800 ZGJNOOMYIMDVKC-DNTJNYDQSA-N 392.184 2.938 50 40 GFGB Cc1cc(NCC(=O)N/N=C/c2ccncc2)ccc1I 1081747 QYSZUDCIISHVCB-DJKKODMXSA-N 394.216 2.557 50 40 GFGB COc1ccc(/C=N/NC(=O)COc2cccc(Br)c2)c(O)c1 3084577 FKSGKMSNKMYXTI-GIJQJNRQSA-N 379.210 2.692 50 40 GFGB CCCOc1ccc(C(=O)NNC(=O)c2cc(-c3ccccn3)no2)cc1OC 72307000 RBFDNQPRWZFYFW-UHFFFAOYSA-N 396.403 2.609 50 40 GFGB C/C(=N\NC(=O)CN1CCCc2ccccc21)c1ccc2c(c1)CCC(=O)N2 98054883 KDOIGQPZLPEWFT-BUVRLJJBSA-N 376.460 2.864 50 40 GFGB CCOc1cc(C(=O)NNC(=O)c2ccco2)ccc1OCc1cccnc1 32794909 RECOLDCAWYBQHE-UHFFFAOYSA-N 381.388 2.727 50 40 GFGB O=C(N/N=C/c1cccc(Br)c1)[C@@H]1CC(=O)N(c2ccccc2)C1 826019 YHIQTZMRDGDESP-XLTHYULKSA-N 386.249 2.952 50 40 GFGB N#C/C(=C\c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)C(=O)NC1CCCCC1 4663449 IXWSWWSTNUXEIR-FOWTUZBSSA-N 384.436 2.787 50 40 GFGB O=C(CCN1CCCC[C@@H]1c1cccnc1)N/N=C/c1ccc2c(c1)OCO2 4794444 LIKLIPIIWAWWLK-ZMPUUUETSA-N 380.448 2.878 50 40 GFGB COc1ccc(C2=NN(c3ccccc3)C(=O)/C2=C(/C)NNC(=O)C2CC2)cc1 17079627 CUTZQADAFZRCQO-RGEXLXHISA-N 390.443 2.751 50 40 GFGB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NNC(=O)c1cccc(Cl)c1 17248979 IPCALDKJRITXLB-UHFFFAOYSA-N 396.834 2.786 50 40 GFGB COc1ccc(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)c(OC)c1 6016633 NGYVZULTZFJPCD-UHFFFAOYSA-N 379.372 2.702 50 40 GFGB O=C(NCc1ccccc1)C(=O)N/N=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1 58914374 HHGRRBBESPKFJV-XKZIYDEJSA-N 392.371 2.621 50 40 GFGB COc1cc([N+](=O)[O-])cc(/C=N/NC(=O)COc2ccc(Cl)c(C)c2)c1O 35655054 QUBWDGKGEVTQHP-UFWORHAWSA-N 393.783 2.800 50 40 GFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)Nc2ccc3c(c2)OCO3)cc1OC 100785623 WAFUGWCNBSHGRP-WSDLNYQXSA-N 399.403 2.567 50 40 GFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccccc3OC(F)F)[C@H]2C1 19852494 KWGOGAPHPZLJRY-DOTOQJQBSA-N 381.386 2.643 50 40 GFGB Cc1cc(Br)cc2c1N(C)C(=O)/C2=N/NC(=O)c1cccc(O)c1 100024529 DAGOBAXHLXFFMW-XMHGGMMESA-N 388.221 2.574 50 40 GFGB O=C(N/N=C/c1cccc(Br)c1)[C@H]1CC(=O)N(c2ccccc2)C1 826017 YHIQTZMRDGDESP-HXJASHHUSA-N 386.249 2.952 50 40 GFGB CCNC(=O)/C(C#N)=C/c1c(Oc2ccccc2F)nc2ccccn2c1=O 2406954 UDDAXANTWIHUFN-ACCUITESSA-N 378.363 2.669 50 40 GFGB O=C(NCc1ccco1)C(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 8219928 RUCRFDWRRICGOI-YDZHTSKRSA-N 377.400 2.625 50 40 GFGB Cc1cccc(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)c1 12816277 AUNBHGPSQIYVSN-LBPRGKRZSA-N 377.238 2.986 50 40 GFGB O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)[C@@H]1CC(=O)N(Cc2ccco2)C1 13630376 DNWMSOGCJVWNIN-MFSHBQKOSA-N 396.230 2.791 50 40 GFGB C[C@@H]1Oc2ccccc2N(CC(=O)NNc2ccccc2C(F)(F)F)C1=O 14199538 MZFNUPONIGAPCP-NSHDSACASA-N 379.338 2.963 50 40 GFGB O=C(N/N=C1\C(=O)N(CN2CCCC2)c2ccccc21)c1ccccc1Cl 20530761 LKDXKTIIDOGCQJ-PYCFMQQDSA-N 382.851 2.874 50 40 GFGB NNC(=O)/C=C/c1ccc(OCc2ccc([N+](=O)[O-])cc2)c(Br)c1 226334705 HVHJWAAKLQHQIR-XBXARRHUSA-N 392.209 2.939 50 40 GFGB COc1ccc(OCC(=O)N/N=C/c2cc(Br)ccc2O)cc1 710826 ZXHNWXWMFMUWQT-GIJQJNRQSA-N 379.210 2.692 50 40 GFGB CCOC(=O)CSC1=C(C#N)[C@@H](c2ccc(OC(F)F)cc2)CC(=O)N1 874531 NOFBBFRNGCMREE-GFCCVEGCSA-N 382.388 2.923 50 40 GFGB Cc1ccc(NC(=O)[C@H]2CC(=O)N=C(NNC(=O)c3ccc(C)cc3)S2)cc1 2409473 MIPHGLQKCXJILF-MRXNPFEDSA-N 396.472 2.565 50 40 GFGB CNC(=O)/C(C#N)=C/c1ccc(OCC(=O)Nc2ccc(C)cc2)c(OC)c1 4600336 ICNIMSYMOBNKQA-MHWRWJLKSA-N 379.416 2.674 50 40 GFGB CC(C)=C(NC(=O)c1ccccc1)C(=O)N/N=C/c1coc2ccccc2c1=O 4855224 OTTVMIORMNGKBP-FSJBWODESA-N 389.411 2.967 50 40 GFGB O=C1Nc2ccccc2/C1=N\NC(=O)C(Oc1ccccc1)Oc1ccccc1 5647542 YKHQPKTWQSTYJQ-UHFFFAOYSA-N 387.395 2.943 50 40 GFGB Cc1ccc(/C=N/NC(=O)CN(c2ccc(Cl)cc2)S(C)(=O)=O)cc1 19954161 NPUMNLQXBFFQLH-YBFXNURJSA-N 379.869 2.565 50 40 GFGB O=C(NNC(=O)c1cccn(Cc2ccc(F)cc2)c1=O)c1cccc(Cl)c1 23109339 WSQWDCYJUBVHOJ-UHFFFAOYSA-N 399.809 2.764 50 40 GFGB Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2 72296529 OMGUIGCFEDDNAV-DOFBBEASSA-N 386.540 2.969 50 40 GFGB Cc1cc(/C=C(/C#N)C(=O)N(C)C)c(C)n1-c1ccc(N2CCOCC2)cc1 408776113 UHBFSPPMIBDVNN-RGEXLXHISA-N 378.476 2.926 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)ccc1OCC(=O)O 408795823 NFWCOILUCWCZOQ-NTUHNPAUSA-N 397.343 2.612 50 40 GFGB CCCOc1ccc(C(=O)N/N=C\c2ccc(OCC(=O)O)cc2)cc1OC 409318984 ZHVIYHBKNZVDLJ-MTJSOVHGSA-N 386.404 2.711 50 40 GFGB CCOC(=O)Cn1cc(/C=N/NC(=O)CNc2ccccc2)c2ccccc21 409381825 WKVOBHJPCPGLCY-FSJBWODESA-N 378.432 2.767 50 40 GFGB COc1ccc(N([C@H](C)C(=O)NN=C2CCCCCC2)S(C)(=O)=O)cc1 20214755 AOPRGHPXHWEYAF-CQSZACIVSA-N 381.498 2.676 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1ccc(I)cc1 10118447 SQTQSPXKJTZBQH-CXUHLZMHSA-N 395.156 2.963 50 40 GFGB Cc1ccc2c(c1)[C@@]1(C(=O)N2)C(C#N)=C(N)N(c2cccnc2)C2=C1C(=O)CCC2 4417977 KPQHSZAVMGOPAU-HSZRJFAPSA-N 397.438 2.801 50 40 GFGB CCOc1ccc(/C(C)=N/NC(=O)c2cc([N+](=O)[O-])ccc2O)cc1[N+](=O)[O-] 409052858 AZLYOXNOTRJFLP-VCHYOVAHSA-N 388.336 2.761 50 40 GFGB N#CC1=C(N)C(C#N)(C#N)[C@@H](c2ccc(C(=O)O)cc2[N+](=O)[O-])[C@@H]2CCCC=C12 33706701 WPKLQXQKRAKGAO-CXAGYDPISA-N 389.371 2.887 50 40 GFGB CC(=O)C1=C(OCc2ccccc2)OC(N)=C(C#N)[C@@]12C(=O)Nc1ccccc12 49947120 GBSVEDJVXBQICE-JOCHJYFZSA-N 387.395 2.618 50 40 GFGB CC(=O)N[C@@H](CC(=O)NNC(=O)c1cc2ccccc2cc1O)c1ccccc1 12813413 ZDKDHEOCTHVKEN-IBGZPJMESA-N 391.427 2.574 50 40 GFGB C[C@H](C(=O)N/N=C/c1cccc(Cl)c1)N(c1ccccc1)S(C)(=O)=O 408909812 IIUZMJJLSJOJCV-KZKLBEMASA-N 379.869 2.645 50 40 GFGB COc1cc(Cl)c(/C=N/NC(=O)Cc2ccc3c(c2)OCCO3)cc1OC 409362727 JYFIMIVPHSUYFJ-SRZZPIQSSA-N 390.823 2.821 50 40 GFGB CCOc1cc(/C=N\NC(=O)COc2ccc(C)cc2C)cc([N+](=O)[O-])c1O 30843557 BQAMAMCNAPONEZ-JMIUGGIZSA-N 387.392 2.845 50 40 GFGB C[C@H](Oc1ccc(/C=N/NC(=O)COc2cccc3cccnc23)cc1)C(=O)O 59679611 ZNDFHXPYKNWSQI-XMTZNVEYSA-N 393.399 2.616 50 40 GFGB Cc1nn(C)c(C)c1C[C@H](C)C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2 72296530 OMGUIGCFEDDNAV-SILWXDEPSA-N 386.540 2.969 50 40 GFGB O=C(c1ccc(F)cc1)[C@H](CCCl)OC(=O)[C@@H]1[C@H]2C[C@H]3OC(=O)[C@@H]1[C@H]3C2 408673068 WHFGZZJBKWIVEV-RPGGNQALSA-N 380.799 2.747 50 40 GFGB CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCc2nc3ccccc3[nH]2)cc1 16496419 PAUAXVHCKGXGBG-CQSZACIVSA-N 396.447 2.509 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(O)c(OCC)c1 408907567 NSFKETSCPZUYEF-FEMWLQECSA-N 399.447 2.598 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2cc(Cl)c(O)c(OC)c2)cc1OC 4735458 QADAJZJOCYUSJC-KEBDBYFISA-N 378.812 2.764 50 40 GFGB Cc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccccc3Cl)CC2=O)cc1C 408616147 WNKJNTMZIMHVAF-AWEZNQCLSA-N 385.851 2.771 50 40 GFGB C#CCN1C(=O)/C(=N\NC(=O)COc2cc(C)ccc2C(C)C)c2ccccc21 18203092 OBOVEZFJNOVZGK-LVWGJNHUSA-N 389.455 2.998 50 40 GFGB Cc1cc(C(=O)NNS(=O)(=O)c2cc(Br)ccc2C)c(C)o1 12680040 BZOLWSMIPLDRQA-UHFFFAOYSA-N 387.255 2.591 50 40 GFGB COC(=O)/C(C#N)=C/c1c(Oc2ccc(OC)cc2)nc2c(C)cccn2c1=O 2245011 KYSJCJFJXMNGHI-SDNWHVSQSA-N 391.383 2.884 50 40 GFGB CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C\NNC(=O)c1cccc([N+](=O)[O-])c1 95471479 MOEXVHKYCOMZHT-YBEGLDIGSA-N 399.794 2.789 50 40 GFGB O=C(CCCl)N(Cc1ccc2c(c1)OCO2)Cc1nc2ccccc2c(=O)[nH]1 6080213 CAGULJVCEDCOMU-UHFFFAOYSA-N 399.834 2.810 50 40 GFGB C/C(=N\NC(=O)c1cc(Br)cn1C)[C@H]1Cc2ccccc2C(=O)O1 54294402 FNGJJZQOBYJXDE-GDXCHIGESA-N 390.237 2.675 50 40 GFGB O=C(O)c1ccc(-n2cccc2/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 408933036 GVRWXSOLFQTOAA-UDWIEESQSA-N 378.344 2.848 50 40 GFGB CN1/C(=C\C=N\NC(=O)c2n[nH]c(=O)c3ccccc23)C(C)(C)c2ccccc21 6211075 GCEVPPYBVLBDOG-WVVFEJFTSA-N 387.443 2.950 50 40 GFGB O=C(NCc1ccco1)C(=O)N/N=C/c1ccc(OCc2ccc(F)cc2)cc1 408607182 CKDIORYVCYXBTC-WYMPLXKRSA-N 395.390 2.764 50 40 GFGB Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2cncn2-c2ccc(F)cc2)c1C 12752460 YRGKJXMPASXWTE-HNNXBMFYSA-N 396.422 2.857 50 40 GFGB CCOc1ccc(CC(=O)N/N=C/c2ccc(N3CCOCC3)c(F)c2)cc1 10315768 VUTCIBPGLXMYGU-HZHRSRAPSA-N 385.439 2.754 50 40 GFGB Cc1cccc(N2C[C@H](C(=O)NNC(=O)c3ccccc3Cl)CC2=O)c1C 28772999 MFXVILKRSIPVMY-CQSZACIVSA-N 385.851 2.771 50 40 GFGB O=C(CNc1ccccc1)N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O 59419185 CLYFKPBFRBCRDA-QGMBQPNBSA-N 393.197 2.625 50 40 GFGB CC(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(C)c(Br)c2)cc1 7778161 ITYBRVSSARDCPA-UHFFFAOYSA-N 390.237 2.791 50 40 GFGB O=C(NCc1ccccn1)C(=O)N/N=C\c1ccc(-c2cccc(Cl)c2)o1 58914457 QNRCYJSLDHIIGR-FMCGGJTJSA-N 382.807 2.762 50 40 GFGB CCOc1ccc(C(=O)NNC(=O)c2ccc(SC)cc2OC)cc1OC 6429683 LYVOVKLXFJJSJC-UHFFFAOYSA-N 390.461 2.899 50 40 GFGB C/C(=N\NC(=O)c1cc(C)nc2c1c(C)nn2-c1ccccc1)c1ccnn1C 17079091 NSMABNUOEFFBIL-ZVHZXABRSA-N 387.447 2.925 50 40 GFGB Cc1ccc(S(=O)(=O)Nc2ccccc2/C=N/NC(=O)c2ccncc2)cc1 16930694 DNPRVWWMZPNVNJ-HYARGMPZSA-N 394.456 2.955 50 40 GFGB CN1c2ccccc2C2=C([C@H](c3ccc(F)cc3)C(C#N)=C(N)O2)S1(=O)=O 20558314 XECMCCSFJFNILJ-MRXNPFEDSA-N 383.404 2.782 50 40 GFGB O=C(N/N=C/c1ccc(Br)c([N+](=O)[O-])c1)[C@@H](O)c1ccccc1 4150597 VHSUIUMLFCGXND-VEJKBTLKSA-N 378.182 2.541 50 40 GFGB CCn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nc2ccccc21 8807532 HWGPAEPIWOLCKC-UHFFFAOYSA-N 399.432 2.518 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2ccc(I)cc2)cc1 59426524 OJKNQFKERVGVTO-WOJGMQOQSA-N 394.212 2.993 50 40 GFGB COc1cc([C@H]2C(C#N)=C(N)Oc3cc(O)ccc32)c(OC)c(OC)c1OC 85409573 BZROCIVXYIFJLS-INIZCTEOSA-N 384.388 2.645 50 40 GFGB Cc1ccc(C2=N[C@](NC(=O)c3ccccc3)(C(Cl)Cl)C(=O)N2)cc1 101426551 PEWRANPDVUEPOW-SFHVURJKSA-N 376.243 2.801 50 40 GFGB CCOC(=O)[C@H](C(C)=O)[C@H](c1cccc(Cl)c1)[C@H](C#N)C(N)=C(C#N)C#N 257345182 SJRRGLZPTOMYCZ-GVDBMIGSSA-N 384.823 2.592 50 40 GFGB Cc1ccc(S(=O)(=O)Oc2ccc(Cl)cc2/C=C(\C#N)C(N)=O)cc1 408881332 MSZBJKYRUQAZAB-MDWZMJQESA-N 376.821 2.808 50 40 GFGB O=C(COc1cccc(Cl)c1)N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2 704582 IDPIVVVYEPEPSF-CNHKJKLMSA-N 377.740 2.506 50 40 GFGB Cc1ncsc1C(=O)NNC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 97212404 DZEGVPRHPSLWAC-UHFFFAOYSA-N 397.338 2.595 50 40 GFGB CC1(CC(=O)N/N=C/c2ccccc2OCc2ccc([N+](=O)[O-])cc2)OCCO1 408873107 MZRQSVMDJGINDJ-FYJGNVAPSA-N 399.403 2.777 50 40 GFGB COc1ccc(CC(=O)N/N=C\c2cc(Br)ccc2O)cc1OC 409362744 JZPPFXAQQZGPIU-GRSHGNNSSA-N 393.237 2.865 50 40 GFGB COc1cc(/C=N/NC(=O)CC2(C)SCCS2)c([N+](=O)[O-])cc1OC 6348123 PYMMNGJBLSXMJR-CXUHLZMHSA-N 385.467 2.648 50 40 GFGB O=C(N/N=C/c1ccc(O)cc1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 7008137 LADXXFGRCWZFLG-OEAKJJBVSA-N 398.426 2.858 50 40 GFGB C[C@H](NC(=O)C(C)(C)C)C(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1 12788621 MDXWLEXDKJHQBF-NSHDSACASA-N 391.468 2.866 50 40 GFGB C[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3cc(F)ccc3F)cc2C1 8108539 DRTMUMHVXFZEKE-SECBINFHSA-N 386.445 2.774 50 40 GFGB CCOc1ccc(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)c(OCC)c1 409147497 ZIAPPCLMZOFYIE-SSDVNMTOSA-N 385.420 2.775 50 40 GFGB O=C(N/N=C\c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccc([N+](=O)[O-])cc1 15018789 GEWYEWPSGYXXSI-UNOMPAQXSA-N 383.364 2.867 50 40 GFGB CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\NC(=O)Nc1cccc(Cl)c1Cl 16693810 REGWJKYTXOCXRK-YFHOEESVSA-N 379.203 2.837 50 40 GFGB COc1ccccc1/C=C/C(=O)NCC(=O)N/N=C/c1c(C)[nH]c2ccccc12 4824457 OXODQTLINVYBOZ-GHQMXAPVSA-N 390.443 2.765 50 40 GFGB C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(-c3ccccc3)cc2)C[C@H](C)O1 12849699 WQKRWPSGFZRFKA-IRXDYDNUSA-N 381.476 2.614 50 40 GFGB COc1cc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)c([N+](=O)[O-])cc1OC 33699401 SDYYNAJWUOVOQT-MLPAPPSSSA-N 397.343 2.856 50 40 GFGB O=C(NN[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1=O)c1cccc(Cl)c1 857207 ZCALFPRZACRJBO-CQSZACIVSA-N 378.215 2.560 50 40 GFGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1ccc2c(c1[N+](=O)[O-])OCO2 1437165 VRAIGTCMFMCCRX-CQSZACIVSA-N 383.360 2.774 50 40 GFGB O=C(N/N=C/c1ccc(Br)c([N+](=O)[O-])c1)[C@H](O)c1ccccc1 4150599 VHSUIUMLFCGXND-IREQLNLFSA-N 378.182 2.541 50 40 GFGB Cc1cc(C)cc(OCC(=O)NC(=S)NNC(=O)c2ccc(Cl)cc2)c1 6500833 HMUQIMDWTCRNDI-UHFFFAOYSA-N 391.880 2.671 50 40 GFGB Cc1cc(C(F)F)nn1[C@@H](C)C(=O)N/N=C/c1ccn(CC(F)(F)F)n1 252502789 UTAKZABWYGVPKQ-BRHDTMCYSA-N 378.305 2.599 50 40 GFGB COc1ccccc1NC(=O)N/N=C\c1cccc(OC)c1O[C@@H](C)C(=O)O 409229442 PAABVGBQYHPJEC-OEKFUPINSA-N 387.392 2.711 50 40 GFGB O=C(O)COc1ccccc1/C=N/NC(=O)COc1ccc2ccccc2c1 1433673 BJMJANGVMWSAQA-WSDLNYQXSA-N 378.384 2.832 50 40 GFGB O=C(N/N=C/c1cc(Br)ccc1O)c1cc([N+](=O)[O-])ccc1O 58900366 GTYOSLRWLTWBLZ-FRKPEAEDSA-N 380.154 2.532 50 40 GFGB CC1=NN(c2ccccc2)C(=O)/C1=C(\NNC(=O)c1ccccn1)C(F)(F)F 100509959 CGPFUPSOSXCSDU-PFONDFGASA-N 389.337 2.555 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2cccc(I)c2)cc1 59426507 GMTMXSYIWKCEMP-WOJGMQOQSA-N 394.212 2.993 50 40 GFGB Cc1ccc(S(=O)(=O)N[C@H](C(=O)N/N=C/c2cccc(C)c2)C(C)C)cc1 408754020 IFQOZDNPUBLLPE-IOVUBPJKSA-N 387.505 2.757 50 40 GFGB CN(C)c1ccc(C(=O)NNS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1 4676406 LRUKZWKWYSTUAR-UHFFFAOYSA-N 375.494 2.673 50 40 GFGB Cn1c(=O)n(C)c2cc(/C=N/NC(=O)c3ccc(Cl)cc3Cl)ccc21 979562 DHGVLLUVTIKAPP-AWQFTUOYSA-N 377.231 2.948 50 40 GFGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@H]2CCCC[C@H]2C(=O)O)c1 4000806 YLWGTLSJKNJWCJ-JKSUJKDBSA-N 376.453 2.536 50 40 GFGB COc1cc(NC(=O)C/C(C)=N/NC(=O)c2ccncc2)c(OC)cc1Cl 13562664 HERZGGAVRDWJCX-SSDVNMTOSA-N 390.827 2.887 50 40 GFGB COc1ccccc1N(CC(=O)NN=C(C)C)S(=O)(=O)c1ccc(C)cc1 4543759 NQTXQGKYYVTYHS-UHFFFAOYSA-N 389.477 2.711 50 40 GFGB C=CCN1C(=O)[C@]2(C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c2ccccc21 4592623 ANSDJHBWIXBPAV-QFIPXVFZSA-N 375.428 2.824 50 40 GFGB O=C(COc1ccccc1-c1ccccc1)NNC(=O)c1ccccc1C(=O)O 6598261 BIQYDUROSWGYOH-UHFFFAOYSA-N 390.395 2.892 50 40 GFGB COc1cc(OC)c(/C=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1Cl 408590777 QJRSMLOOGOPWBA-VXLYETTFSA-N 377.784 2.958 50 40 GFGB CC[C@H](C)NC(=O)/C(C#N)=C/c1ccc(OCC(=O)O)c(Br)c1 408805344 AHKKEVNTSLELEY-PQTFEYQYSA-N 381.226 2.734 50 40 GFGB O=C(Cc1nnc(NC(=O)c2ccc(Cl)cc2)s1)N/N=C/c1ccco1 33586973 IRBNDIXZEGKYNC-GIJQJNRQSA-N 389.824 2.730 50 40 GFGB CCOc1cc(C(=O)NNC(=O)c2ccccn2)ccc1OCc1cccnc1 32794995 WYLQUQQKJXPFFF-UHFFFAOYSA-N 392.415 2.529 50 40 GFGB O=C(NNC(=O)c1ccccc1I)c1ccc(F)cc1 853318 PSDWYCXDYGLBDN-UHFFFAOYSA-N 384.148 2.505 50 40 GFGB O=C(NNC(=O)c1cc2c(s1)CCC2)c1ccc(OCC(F)(F)F)nc1 14330384 BBFZQJDUFRLWRQ-UHFFFAOYSA-N 385.367 2.648 50 40 GFGB O=C(COc1ccc(I)cc1)N/N=C/c1ccccc1O 4705098 TUBYHAODJGEUTO-RQZCQDPDSA-N 396.184 2.526 50 40 GFGB O=C(N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21)[C@H]1CCCO1 84504729 DYSWJCFMTBMDKY-RTAFMGCNSA-N 383.835 2.886 50 40 GFGB CCNC(=O)COc1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)cc1OC 7158374 BCUDEAFCMUNDHR-GYTXZQQPSA-N 399.491 2.812 50 40 GFGB COc1ccccc1C(=O)N/N=C\c1cc([N+](=O)[O-])cc(Br)c1O 408952880 KTVFQRXHLIZHBX-IUXPMGMMSA-N 394.181 2.835 50 40 GFGB CCN1C(=O)/C(=N/NC(=O)c2ccccc2O)c2cc(Br)ccc21 6326027 HZDMHAUEJQHCCP-XDJHFCHBSA-N 388.221 2.655 50 40 GFGB CN1C(=C(C#N)C(=O)Cn2cccc(C(F)(F)F)c2=O)N(C)c2ccccc21 12539077 NUOAQALUOHVBBM-UHFFFAOYSA-N 388.349 2.758 50 40 GFGB Cc1ccccc1N(CC(=O)N/N=C/c1c(F)cccc1Cl)S(C)(=O)=O 20207622 ANAMLLHKTQZLLR-KEBDBYFISA-N 397.859 2.704 50 40 GFGB N#CC1=C(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)NC(=O)C[C@@H]1c1ccco1 9012712 RWAGFKKAUNNLAX-ZDUSSCGKSA-N 398.400 2.898 50 40 GFGB COc1cc(Cl)c(/C=N/NC(=O)Cc2ccc3c(c2)OCO3)cc1OC 408590239 OHZCAYMWKRYUKN-AWQFTUOYSA-N 376.796 2.779 50 40 GFGB COc1cc(Br)c(O)c(/C=N/NC(=O)COc2ccccc2)c1 408532766 QYBXVMFSRADGMA-GIJQJNRQSA-N 379.210 2.692 50 40 GFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1cccn1-c1cccc([N+](=O)[O-])c1 35198800 ZYQZWNVGPXMELS-MOSHPQCFSA-N 393.359 2.987 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc(F)cc1)c1cccc2ccccc12 19955166 NMFLGQVUFIOGNB-LPYMAVHISA-N 399.447 2.895 50 40 GFGB COc1cc([C@@H]2ON=C(C(=O)N/N=C/c3ccccc3F)[C@H]2C)cc2c1OCO2 15084053 FLWIMCMZBSHWSC-KYQLCRPWSA-N 399.378 2.777 50 40 GFGB Cn1cc(Br)c(C(=O)N/N=C/c2cc(Cl)cc(Cl)c2O)n1 1091984 USDBCBPQWBHYND-AYSLTRBKSA-N 392.040 2.959 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])s1)C(=O)Nc1ccccc1Br 2749016 BYMHEDVTHAAUFH-VIZOYTHASA-N 397.210 2.508 50 40 GFGB O=C(O)COc1ccc(Br)cc1/C=N/NC(=O)c1cccs1 4513501 KCSKSAXPGIGZQX-FRKPEAEDSA-N 383.223 2.738 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)NCc2ccc(Cl)cc2Cl)cc1 5513476 BPMCMRSJWNMPSA-ZVBGSRNCSA-N 380.231 2.769 50 40 GFGB CCCCNS(=O)(=O)c1ccc(/C(C)=N/NC(=O)c2ccc(N)cc2)cc1 7783791 WCTHVIJXAYSEHK-HYARGMPZSA-N 388.493 2.501 50 40 GFGB COc1cc(NC(=O)C/C(C)=N/NC(=O)c2ccccn2)c(OC)cc1Cl 100522707 KZSQMHPJCSRYGJ-SSDVNMTOSA-N 390.827 2.887 50 40 GFGB CC(C)(C)NC(=O)COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1 408997067 QMHNOWFOCCVXJS-LPYMAVHISA-N 383.448 2.509 50 40 GFGB O=C(Cc1ccc2c(c1)OCCO2)N/N=C\c1ccc(Br)cc1 409366774 YBWUATRPSKKSMO-ODLFYWEKSA-N 375.222 2.913 50 40 GFGB CCN(CC)c1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)CCl 12504929 OLYDVOSRTOHPBH-UHFFFAOYSA-N 375.922 2.741 50 40 GFGB in-vitro CS(=O)(=O)N(CC(=O)NN=C1CCCCC1)c1cccc(C(F)(F)F)c1 408775833 KITLWASWYZACFQ-UHFFFAOYSA-N 391.415 2.908 50 40 GFGB N#C/C(=C/c1ccccc1OCc1ccc(C(=O)O)cc1)C(=O)N1CCOCC1 408855499 NPKNAHQRMURDCR-UYRXBGFRSA-N 392.411 2.730 50 40 GFGB CCOc1cc(/C=N\NC(=O)[C@H]2COc3ccccc3O2)cc(Cl)c1O 31871162 GELNCYIAVWIUJC-PADWCVLASA-N 376.796 2.734 50 40 GFGB CC1(C)[C@]2(C(=O)NCCN3CCCCC3)CC[C@@]1(C)C(=O)[C@H]2Br 4185863 PLSNWPRDSCYRJM-JEBQAFNWSA-N 385.346 2.747 50 40 GFGB Cc1cc2c(c(=O)n1C[C@@H]1CCCO1)[C@@H](c1ccc(F)cc1)C(C#N)=C(N)O2 4247923 GBURLUKJKGSRCD-YJBOKZPZSA-N 381.407 2.693 50 40 GFGB COc1ccc(OCC(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cc1 5481556 DKAAYIXUSQYDKV-UHFFFAOYSA-N 386.448 2.598 50 40 GFGB Cc1c(C(=O)NNC(=O)c2ccco2)cnn1-c1ccccc1C(F)(F)F 12907586 IFCWCPFHSPPIOA-UHFFFAOYSA-N 378.310 2.867 50 40 GFGB CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\NNC(=O)c1ccc([N+](=O)[O-])cc1 16160686 JCMNOULUUYSGCX-YBEGLDIGSA-N 399.794 2.789 50 40 GFGB O=C(CNc1ccccc1)N/N=C/c1cc([N+](=O)[O-])cc(Br)c1O 59419174 ZZZXRWOLXVMZPI-QGMBQPNBSA-N 393.197 2.625 50 40 GFGB CO[C@H](C(=O)N/N=C(\C)CC(=O)Nc1ccc(N(C)C)cc1)c1ccccc1 100509597 RJLXJBCWHRXLFK-VRMLFSPKSA-N 382.464 2.961 50 40 GFGB COCCOCCOCCOCCNC(=O)CCCC[C@@H]1CCSS1 104530421 DVOKZPCLVOHRAR-MRXNPFEDSA-N 395.587 2.513 50 40 GFGB in-vitro C/C(N)=C(\C#N)C(=O)CSc1nnc(-c2cccs2)n1C[C@H]1CCCO1 104714824 HIYFMIRAQGVHEO-NPRUJURCSA-N 389.506 2.603 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)N2CCOCC2)cc(Br)c1OC 408756072 QSOSYFHOUFAYOR-MDWZMJQESA-N 395.253 2.622 50 40 GFGB CCCOc1ccc(C(=O)N/N=C\c2ccccc2OCC(N)=O)cc1OCC 409331610 GPVUAOCEDDTASE-QRVIBDJDSA-N 399.447 2.502 50 40 GFGB Cc1nn(C)c(C)c1CC(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1 10624995 VQGUPLXJVFDROP-UHFFFAOYSA-N 386.452 2.908 50 40 GFGB Cc1ccc(/C=N/NC(=O)Cc2nnc(NC(=O)c3ccccc3)s2)cc1 9166453 KCSKUGWMUOXENE-UDWIEESQSA-N 379.445 2.792 50 40 GFGB Cc1cc(OCC(=O)NNC(=O)COc2ccccc2Cl)ccc1Cl 6448397 MWRFKHZJEADVHP-UHFFFAOYSA-N 383.231 2.907 50 40 GFGB CCN(CC)c1ccc2cc(/C(N)=N/NC(=O)c3cccc(F)c3)c(=O)oc2c1 5446837 CHHOYDJUWXEZEV-UHFFFAOYSA-N 396.422 2.829 50 40 GFGB Cc1cccc2c1NC(=O)[C@@]21C=C2c3cc4c(cc3CCN2C(N)=C1C#N)OCO4 5451208 BYTIEFZTZIEHPC-QHCPKHFHSA-N 398.422 2.520 50 40 GFGB Cc1ccc(C)c(C(=O)CCC(=O)NNC(=O)Cc2nc3ccccc3n2C)c1 6648288 FLFIINYSWUKFTB-UHFFFAOYSA-N 392.459 2.543 50 40 GFGB CC(=O)N[C@H](C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2)C(C)C 8420769 BETSLDGOPTXLQT-PBHICJAKSA-N 393.553 2.821 50 40 GFGB CC(C)(C)c1ccc2c(c1)O[C@@H](C(=O)N/N=C\c1cc(O)ccc1[N+](=O)[O-])CO2 34703937 DUWNPYFGYOYNGV-BYSCUOHCSA-N 399.403 2.888 50 40 GFGB Cc1ccc(OCC(=O)N/N=C/c2ccc(I)o2)cc1 832141 JHXFGCUHYPTTMH-LZYBPNLTSA-N 384.173 2.722 50 40 GFGB CCc1ccc(/C=N/NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cc1 6542828 ALDUDAXUZBUOQN-UDWIEESQSA-N 393.896 2.673 50 40 GFGB CCc1ccccc1N(CC(=O)N/N=C(\C)c1ccc(C)cc1)S(C)(=O)=O 408768141 CHOYYPTUYYJNQY-LTGZKZEYSA-N 387.505 2.864 50 40 GFGB Cc1ccccc1C(=O)N1CCC(C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)CC1 409007401 WFSSHBPGZJVXEX-HYARGMPZSA-N 394.431 2.906 50 40 GFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(OC)cc1C 408606139 OQBCHHOTSWFCJU-MRXNPFEDSA-N 384.461 2.952 50 40 GFGB CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C\NNC(=O)c1ccccc1[N+](=O)[O-] 16160693 IPUHLWLYTSCFLH-GDNBJRDFSA-N 399.794 2.789 50 40 GFGB CCc1ccc(OCC(=O)NNC(=O)/C=C/c2cc(OC)cc(OC)c2)cc1 7958884 LOCCDFWXEUGFPJ-JXMROGBWSA-N 384.432 2.506 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2ccc(C)c(C)c2C)S(C)(=O)=O)cc1 3663444 PVYUCQCUHNFYQS-CIAFOILYSA-N 387.505 2.837 50 40 GFGB COc1ccc(N2N=C(c3ccccc3)/C(=C(\C)NNC(=O)C3CC3)C2=O)cc1 9484549 LFCROSARTGGUKC-RGEXLXHISA-N 390.443 2.751 50 40 GFGB Cc1ccc(C)c(OCC(=O)N/N=C/c2cc3c(cc2[N+](=O)[O-])OCO3)c1C 18209535 ZXFIYVFLCXLUJS-DNTJNYDQSA-N 385.376 2.778 50 40 GFGB C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CC1(C(=O)O)CCCCCC1 13255486 XPYAHEWALSXXTD-CYBMUJFWSA-N 380.416 2.556 50 40 GFGB CC(C)CC(=O)N/N=C/c1ccc(OCC(=O)NCCc2ccccc2)cc1 20244088 RJEYUNVQJGCJJW-BUVRLJJBSA-N 381.476 2.921 50 40 GFGB C/C(=N\NC(=O)CN1CCCCC1)c1ccc(I)cc1 20248500 NRXHGWVHTCVNSH-SFQUDFHCSA-N 385.249 2.617 50 40 GFGB N#CC1=C(S)N[C@@](O)(c2ccccc2)[C@H]([n+]2ccccc2)[C@H]1c1ccncc1 40194265 ZNEQCVUXICTZHQ-TUNNFDKTSA-O 387.488 2.807 50 40 GFGB C[C@@H](Oc1ccc(/C=N\NC(=O)COc2cccc(Cl)c2)cc1)C(=O)O 208349961 WOWNWHGYBOBHAX-SVKBEJCWSA-N 376.796 2.721 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)C1CCN(C(=O)c2ccccc2)CC1 409004410 CNTKBKYFJGZXSN-KGENOOAVSA-N 380.404 2.597 50 40 GFGB CCOc1ccc2cc(/C=N/NC(=O)c3ccc([N+](=O)[O-])cc3)c(=O)[nH]c2c1 855966 MRNQIJGGYLQNPL-RGVLZGJSSA-N 380.360 2.599 50 40 GFGB COc1ccc(Cl)cc1N(CC(=O)N/N=C(\C)C(C)(C)C)S(C)(=O)=O 408783524 OBILPIKJBVQVJC-WOJGMQOQSA-N 389.905 2.653 50 40 GFGB Cc1ccc(C)c(OCC(=O)N/N=C2/CCS(=O)(=O)c3ccc(F)cc32)c1 96708503 VDNWGKLLWOIYBY-PGMHBOJBSA-N 390.436 2.519 50 40 GFGB COc1ccc(/C=N/NC(=O)c2ccc3c(c2)NC(=O)C(C)(C)O3)cc1OC 1361208 GGUNCJUIRBZQKI-SRZZPIQSSA-N 383.404 2.577 50 40 GFGB O=C(NNC(=O)c1cccn(Cc2cccc(F)c2)c1=O)Nc1cccs1 23136148 XZFFTCZHPNQQRJ-UHFFFAOYSA-N 386.408 2.564 50 40 GFGB CCn1c(SCC(=O)N/N=C\c2ccccn2)nnc1-c1ccc(C)cc1 4680017 MPHFEGWBVGMTRO-MTJSOVHGSA-N 380.477 2.911 50 40 GFGB Cc1nc(-c2ccccc2)sc1C(=O)NNS(=O)(=O)c1cccc(F)c1 7387374 RJAYMGWTHMCYOE-UHFFFAOYSA-N 391.449 2.881 50 40 GFGB O=C(NNC(=O)[C@H]1CCCC[C@@H]1C(=O)O)C(c1ccccc1)c1ccccc1 17077753 GXJAMTYDNUGGRX-ROUUACIJSA-N 380.444 2.857 50 40 GFGB COc1ccc(OC)c([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccncc4)c32)c1 8566707 RIPJWWAAMSOOIX-INIZCTEOSA-N 375.388 2.707 50 40 GFGB Nc1nnc(CC(=O)N/N=C/c2ccccc2OCc2ccc(F)cc2)s1 1295155 MGGQDDBKVDYOFJ-UFFVCSGVSA-N 385.424 2.531 50 40 GFGB O=C(Cn1nnc(-c2ccccc2)n1)N/N=C/c1cccc(Cl)c1Cl 5604606 ORZAKIQSYKAGAU-DJKKODMXSA-N 375.219 2.797 50 40 GFGB CCOc1ccccc1OCC(=O)N/N=C/c1c(C)nn(-c2ccccc2)c1O 6933736 UTOJFQSEKCVALE-LPYMAVHISA-N 394.431 2.814 50 40 GFGB CCCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2OC)cc1OCC 7869461 CGFFUARMXBAEBE-HYARGMPZSA-N 399.447 2.972 50 40 GFGB CCOC(=O)COc1ccc(/C=N\NC(=O)Cc2ccc(OCC)cc2)cc1 408711889 PATBCBARNYLQRF-HMAPJEAMSA-N 384.432 2.720 50 40 GFGB COc1cccc(/C=N/NC(=O)C2CCN(C(=O)c3ccccc3C)CC2)c1O 409006573 PIRUXVMNGXCYKO-OEAKJJBVSA-N 395.459 2.712 50 40 GFGB C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2cc(C)ccc2[nH]c1=O 4131443 BAZCHLSIZMHHDF-GOSISDBHSA-N 377.400 2.647 50 40 GFGB O=C(N[C@]1(C(Cl)Cl)N=C(c2ccccc2)NC1=O)c1ccc(F)cc1 102436028 VDFKKWAGMHAICI-KRWDZBQOSA-N 380.206 2.632 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc2ccccc12)c1ccc(F)cc1 408784752 SKZGPBJUYUYKLW-LPYMAVHISA-N 399.447 2.895 50 40 GFGB COc1ccc(CC(=O)N/N=C2\C(=O)N(C(C)C)c3ccccc32)cc1OC 5563677 FINZWAGRKSBGGG-ATJXCDBQSA-N 381.432 2.522 50 40 GFGB Cc1cccc(OCc2nnc(SCC(=O)NNC(=O)c3ccccc3)o2)c1 5293745 LCADZSIARWGHFI-UHFFFAOYSA-N 398.444 2.510 50 40 GFGB COc1cc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc(OC)c1OC 6170018 GLSLYBOXCMYXNK-AUWJEWJLSA-N 382.372 2.956 50 40 GFGB CCN1C(=O)[C@@]2(C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)c2ccccc21 4302083 LHYCJLHQBCUQPC-HSZRJFAPSA-N 397.438 2.920 50 40 GFGB CC(C)CN(CC(C)C)C(=O)[C@@H](Br)[C@H](Br)C(=O)O 1685976 MHDIVHHUHBOMDP-UWVGGRQHSA-N 387.112 2.739 50 40 GFGB Cc1cc(C(=O)N/N=C/c2cccc(OC(=O)c3ccc([N+](=O)[O-])cc3)c2)[nH]n1 4566828 IOGRUFKQOZRHPU-RGVLZGJSSA-N 393.359 2.609 50 40 GFGB Cc1cc(/C=N/NC(=O)Cn2nnc(-c3ccccc3)n2)c(C)n1CC(C)C 6942728 VLMAQCNKJOIULQ-SRZZPIQSSA-N 379.468 2.565 50 40 GFGB COc1ccc(C[C@@H]2S/C(=C(\C#N)C(N)=O)N(c3cccc(C)c3)C2=O)cc1 11690290 LBQZFEZKZDONDK-KOXKPCSVSA-N 393.468 2.915 50 40 GFGB O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNc1cccc(C(F)(F)F)c1 14907611 BUOXYPPZCCOKAJ-KBPBESRZSA-N 383.370 2.714 50 40 GFGB O=C(N/N=C/c1ccccc1C(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1 58885093 CIOIRGCVVASXMF-AWQFTUOYSA-N 380.282 2.702 50 40 GFGB O=C(N/N=C/c1cccc(I)c1)c1ccc2c(c1)OCO2 59471539 RZRINUYTTYMJDT-CAOOACKPSA-N 394.168 2.784 50 40 GFGB Cc1ncc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)n1-c1ccccc1 78965118 STACMCZPKVCEIR-CYBMUJFWSA-N 382.395 2.548 50 40 GFGB CCCCCCOc1ccc(C(=O)NNC(=O)CC[C@@]2(C)CCC(=O)N2)cc1 95456799 UKIYQXYJYORXAI-OAQYLSRUSA-N 389.496 2.856 50 40 GFGB COc1ccccc1OCCC(=O)NNC(=O)c1cc(Cl)ccc1OC 2620962 PBBJVZCGVFLYGI-UHFFFAOYSA-N 378.812 2.587 50 40 GFGB CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)O)cc2)cc1 2774386 ZDPNQRXCLTWZJA-LFIBNONCSA-N 394.383 2.872 50 40 GFGB C#CCOc1ccc(Br)cc1/C=N/NC(=O)[C@@H](O)c1ccccc1 59471525 VJWSSEGMXCWLNN-RONKMWSCSA-N 387.233 2.645 50 40 GFGB COc1cc(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)ccc1O 105793421 HUDNOXOEDWZAHZ-SSDVNMTOSA-N 375.384 2.665 50 40 GFGB COCCCNC(=O)CC(=O)N/N=C/c1ccc(-c2cccc(Cl)c2)o1 58914844 ANMANMZUYSBKQZ-CIAFOILYSA-N 377.828 2.593 50 40 GFGB COc1cc(N2CCCC2)c(OC)cc1/C=N/NC(=O)c1ccc([N+](=O)[O-])cc1 409100071 POSZFVDLUWOENJ-FYJGNVAPSA-N 398.419 2.976 50 40 GFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1)c1ccccc1Cl 47080858 WPMZYMJTHSYFKE-NSHDSACASA-N 392.242 2.808 50 40 GFGB CCN(Cc1ccncc1)C(=O)NNC(=O)COc1ccc(Cl)c(C)c1 9377836 ZSNAEPOMFKWGLO-UHFFFAOYSA-N 376.844 2.685 50 40 GFGB O=C/C(=C\Nc1ccc(C(=O)N2CCOCC2)cc1)c1nc2ccccc2o1 666210 SHKPKOOIROFEED-DTQAZKPQSA-N 377.400 2.952 50 40 GFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1cc(Br)cs1 3151289 KAUFJCDHHUEYDR-GIDUJCDVSA-N 384.211 2.948 50 40 GFGB CCc1ccc([C@H]2C(C#N)=C(N)C(C#N)(C#N)C3=CCN(C(=O)OC)C[C@@H]32)cc1 5489500 BTYPKWUXHIMEQN-HKUYNNGSSA-N 387.443 2.741 50 40 GFGB O=C(N/N=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1ccccc1Cl 5740926 JOGFCEWEUVUNHE-UDWIEESQSA-N 388.811 2.849 50 40 GFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(C)[nH]c(=O)c32)cc1Br 18266076 WYXILXVSCBHPMS-CQSZACIVSA-N 388.221 2.673 50 40 GFGB COc1ccccc1C(=O)NNC(=O)COc1ccc(C)cc1Br 831999 UFJPBQDMCBSDIK-UHFFFAOYSA-N 393.237 2.606 50 40 GFGB Cc1c(C(=O)NNC(=O)c2ccc(Br)cc2)cccc1[N+](=O)[O-] 5724490 FESZGXPENALJRO-UHFFFAOYSA-N 378.182 2.741 50 40 GFGB CCc1ccccc1N(CC(=O)N/N=C(\C)c1cccs1)S(C)(=O)=O 20208875 NWNCCMPMHFVCFB-QGOAFFKASA-N 379.507 2.617 50 40 GFGB COC(=O)COc1ccc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)cc1 408678060 XEWKCZVTMYQPDQ-HYARGMPZSA-N 381.432 2.603 50 40 GFGB Cc1ccccc1-n1c(C)cc(/C=N/NC(=O)C(=O)NCc2ccncc2)c1C 408970902 AJCMBDURWRCCQJ-AFUMVMLFSA-N 389.459 2.564 50 40 GFGB O=C(CNC1CCCCC1)N/N=C/c1cccc(I)c1 409376433 YAHCJJJXHPDROG-VCHYOVAHSA-N 385.249 2.664 50 40 GFGB CNC(=O)c1ncc(Br)cc1C(Br)Br 1888994483 OSPOSWWNZLRISK-UHFFFAOYSA-N 386.869 2.992 50 40 GFGB COc1ccc(CCNC(=O)[C@@H]2CCCO[C@@H]2C(Cl)Cl)cc1OC 1578200 OCMXCMKHBVNKJT-DOMZBBRYSA-N 376.280 2.961 50 40 GFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(Br)cc3)[C@H]2C1 33335994 USLDAJCEQPIJJC-IRXDYDNUSA-N 394.276 2.804 50 40 GFGB CCOC(=O)c1csc(N(NC(=O)CCl)C(=O)Nc2ccc(C)cc2)n1 1415213 YDUFQUJSWYLTBX-UHFFFAOYSA-N 396.856 2.937 50 40 GFGB CCOc1cc(/C=C(/C#N)C(N)=O)ccc1OCC(=O)Nc1ccccc1OC 4599814 PAEKANDAWJFEDU-GDNBJRDFSA-N 395.415 2.504 50 40 GFGB CCc1ccc(NC(=O)C(=O)NNC(=O)COc2ccc(C(C)(C)C)cc2)cc1 5719403 ZUHCQEACYUZMID-UHFFFAOYSA-N 397.475 2.711 50 40 GFGB O=C(NN=C(c1ccccc1)c1ccccc1)c1cnc2n(c1=O)CCS2 51202229 WHPJYGMQIASASR-UHFFFAOYSA-N 376.441 2.531 50 40 GFGB O=C(NNC(=O)c1cccc(I)c1)c1ccc(F)cc1 670357 FSPAWGRBIPJCEI-UHFFFAOYSA-N 384.148 2.505 50 40 GFGB CCCCOC(=O)CSC1=C(C#N)[C@@H](c2ccc3c(c2)OCO3)CC(=O)N1 2312288 PWGCYZQOYHYJEN-CYBMUJFWSA-N 388.445 2.830 50 40 GFGB Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)c3ccccn3)cc12 8197963 IWWYSYUJQVHGAY-UHFFFAOYSA-N 377.429 2.865 50 40 GFGB CCCCCCC(=O)NN/C=C1\C(=O)N(C2CCCCC2)C(=S)N=C1O 5100221 GWPAQXZYMRSHRW-OWBHPGMISA-N 380.514 2.878 50 40 GFGB C[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 5578321 LTIKKZRUVAPZTI-UOXHMDDWSA-N 398.463 2.766 50 40 GFGB COC[C@H](Cl)/C(N)=N/S(=O)(=O)c1cc(Cl)c(Cl)cc1Cl 6302059 XXWKNZXHVRWAOA-QMMMGPOBSA-N 380.080 2.947 50 40 GFGB CCc1ccc(OCC(=O)N/N=C/c2cccc(OC)c2OC)c([N+](=O)[O-])c1 1052483 GPRXSUOOFAKDJJ-RGVLZGJSSA-N 387.392 2.704 50 40 GFGB COc1ccc(CCNC(=O)C/C(C)=N/NC(=O)OC(C)(C)C)cc1OC 100796023 QDGFYHUVXQTNJR-FYJGNVAPSA-N 379.457 2.653 50 40 GFGB Cc1ccccc1C(=O)N1CCC(C(=O)N/N=C/c2ccc(C(=O)O)cc2)CC1 1095054 XCSKBLDVHJUVTL-OEAKJJBVSA-N 393.443 2.696 50 40 GFGB CCOc1c(Br)cc(C(=O)NNC(=O)c2cccs2)cc1OC 6510365 VSPLIWQFAFKOGO-UHFFFAOYSA-N 399.266 2.993 50 40 GFGB CCNC(=O)COc1ccc(/C=C(\C#N)c2nnc3n2CCCCC3)cc1OC 7159087 RRZVRELAVZYICY-LFIBNONCSA-N 395.463 2.592 50 40 GFGB O=C(NNC(=O)c1c[nH]nc1-c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 8725585 AGKSPRJLNFTFNL-UHFFFAOYSA-N 385.767 2.713 50 40 GFGB CCOc1ccc(NC(=O)[C@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)cc1 102620405 RYLVDSDJJUYXRX-LACSLYJWSA-N 380.238 2.595 50 40 GFGB CCCCNC(=O)C(=O)N/N=C/c1cc(C(=O)O)ccc1Nc1ccccc1C 408706511 AMGALPCWFJOBEY-YDZHTSKRSA-N 396.447 2.803 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccncc2)ccc1OCCN1CCCCC1 655085 KZGINLIOXMLRJL-XQNSMLJCSA-N 382.464 2.719 50 40 GFGB COC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cccc(I)c1 2344792 QNRSSLSHYJBEFP-CYBMUJFWSA-N 396.184 2.546 50 40 GFGB Cc1ccsc1/C=N/NC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 3238659 FLYACVSGEKXYQR-CPNJWEJPSA-N 391.518 2.995 50 40 GFGB CCc1cccc(CC)c1N1C[C@@H](C(=O)NNC(=O)c2ccccc2)CC1=O 7928238 UNOKAADETLMZJD-SFHVURJKSA-N 379.460 2.626 50 40 GFGB CCOC1(OCC)[C@]2(Cl)C(Cl)=C(Cl)[C@@]1(Cl)[C@H]1C(=O)OC(=O)[C@@H]12 103916329 KSLULRFUPXQXQY-LNRQYXOOSA-N 390.046 2.743 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)C1CCN(C(=O)c2ccc(F)cc2)CC1 409004384 CFDSCLJEWGNNLK-LPYMAVHISA-N 398.394 2.736 50 40 GFGB CC1(C)OB(C(I)I)OC1(C)C 1535647305 JYEMEPSGEGEKBT-UHFFFAOYSA-N 393.799 2.814 50 40 GFGB CCCN1C(=O)/C(=N\NC(=O)COc2ccccc2OCC)c2ccccc21 18192947 DLIVBIQRZMOOJF-ATJXCDBQSA-N 381.432 2.741 50 40 GFGB CO[C@H]1CC[C@H](OC(=O)c2ccccc2)[C@H](CI)O1 5080737 CLMYZZZCONXZSG-RWMBFGLXSA-N 376.190 2.799 50 40 GFGB COc1ccc(O)c(/C=C(\C#N)C(=O)Nc2sc3c(c2C(N)=O)CCCC3)c1 5409330 RUISWHBWCRCOFI-XYOKQWHBSA-N 397.456 2.986 50 40 GFGB Cn1c(SCC(=O)C(C#N)=C2Nc3ccccc3N2)nnc1-c1ccncc1 6537288 GDIWBUWVKJPUPA-UHFFFAOYSA-N 389.444 2.811 50 40 GFGB CCc1ccc(NC(=O)C(=O)N/N=C/c2cc(Cl)c(O)c(OC)c2)cc1 8085933 MHQMERYLOWSAQH-KEBDBYFISA-N 375.812 2.705 50 40 GFGB CCOc1ccccc1/C=N/NC(=O)C(=O)Nc1ccccc1Br 59435814 URWQUWXINVQUFX-YBFXNURJSA-N 390.237 2.937 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(C)cc2OC)ccc1O[C@@H](C)C(=O)O 409021179 YTCHISVTTKYGGU-PUFAJPFRSA-N 386.404 2.628 50 40 GFGB COc1cc(Br)c(O)c(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)c1 408586440 CCKXQMXHULNWJC-CAOOACKPSA-N 394.181 2.835 50 40 GFGB COC(=O)COc1cccc(/C=N/NC(=O)CSCc2ccccc2C)c1 408863541 PBZQHQFOLDDZJI-SRZZPIQSSA-N 386.473 2.930 50 40 GFGB CCC(=O)N1CCc2cc(C(=O)NNC(=O)c3cc(C)c(CC)s3)ccc21 40144588 OOSDDFIQZNGXNV-UHFFFAOYSA-N 385.489 2.993 50 40 GFGB C[C@@H]1CCc2c(C(=O)NNC(=O)[C@@H]3[C@@H]4C=C[C@@H](CC4)[C@@H]3C(=O)O)csc2C1 225659184 IUKBUXKYOYNLOF-ZSSYSCPNSA-N 388.489 2.547 50 40 GFGB O=C(Cc1ccc(Cl)cc1)NNC(=O)c1ccc(=O)n(Cc2ccccc2)c1 16839289 NWZFCZHUMFGZCA-UHFFFAOYSA-N 395.846 2.554 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)ccc1O 3059281 FQODUPJIKSGQQY-LSHDLFTRSA-N 395.337 2.899 50 40 GFGB O=C(CSc1ncccn1)N/N=C/c1ccc(OC(=O)C2=CCCC=C2)cc1 4482161 WBVHKIXGARYVNY-YDZHTSKRSA-N 394.456 2.901 50 40 GFGB CCOC(=O)c1c(NC(=O)CCCCl)sc(C(=O)OCCOC)c1C 6787008 SOFKKUMVBRZGGM-UHFFFAOYSA-N 391.873 2.994 50 40 GFGB Cc1[nH]c2ccccc2c1/C=N/NC(=O)Cn1cc(C(F)(F)F)ccc1=O 12558402 PMWWQBHNNSJCFZ-GZIVZEMBSA-N 376.338 2.807 50 40 GFGB O=C(NNC(=O)[C@H]1CCCN(C(=O)c2cccs2)C1)c1c[nH]c2ccccc12 32759077 RXALKGACRFUCBD-ZDUSSCGKSA-N 396.472 2.543 50 40 GFGB O=C(N/N=C/c1c(O)ccc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1 58885120 VRPULGIXVCGJKR-RGVLZGJSSA-N 378.344 2.542 50 40 GFGB O=C(NN[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1=O)c1cccc(Cl)c1 100572054 ZCALFPRZACRJBO-AWEZNQCLSA-N 378.215 2.560 50 40 GFGB O=C(NNS(=O)(=O)c1cc(Cl)c(Cl)cc1Cl)c1ccncc1 226855719 GRHWCBJENZZJLQ-UHFFFAOYSA-N 380.640 2.665 50 40 GFGB O=C(COc1ccccc1)N/N=C/c1ccc([N+](=O)[O-])cc1Br 408533368 RYSLYIOLALAPGR-RQZCQDPDSA-N 378.182 2.886 50 40 GFGB Cn1c(=O)n(C)c2cc(/C=C(\C#N)C(=O)NCCc3c[nH]c4ccccc34)ccc21 1097102 ODRDSMHMQDQTRS-GZTJUZNOSA-N 399.454 2.624 50 40 GFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccc(Cl)cc1 69516232 YVDAJDASTLOIAG-LBPRGKRZSA-N 392.242 2.808 50 40 GFGB N#CCOc1ccc(/C=N/NC(=O)CSCc2cccc([N+](=O)[O-])c2)cc1 408725893 JDFVSNUBPPUNQC-RGVLZGJSSA-N 384.417 2.881 50 40 GFGB O=C(N/N=C\c1ccco1)c1ccc(S(=O)(=O)N2CCCCCC2)cc1 5864491 IPRZEGKJODFWIH-RGEXLXHISA-N 375.450 2.608 50 40 GFGB COc1ccc(/C=N/NC(=O)c2ccc3c(c2)OCCO3)cc1Br 1437613 VSSXEUUNOBHSDR-VXLYETTFSA-N 391.221 2.993 50 40 GFGB Cc1ccccc1OCC(=O)N/N=C1/C(=O)Nc2ccc(Br)cc21 18155417 DONUFUVRJNSXLD-UHFFFAOYSA-N 388.221 2.609 50 40 GFGB COc1ccc(O)c(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)c1 6453924 VXLWSPDHGGJLBC-HZHRSRAPSA-N 376.412 2.787 50 40 GFGB C[C@@H](C(=O)N/N=C/c1cccc(Cl)c1)N(c1ccccc1)S(C)(=O)=O 408909809 IIUZMJJLSJOJCV-HCZVKUGISA-N 379.869 2.645 50 40 GFGB Cc1ccc(C(=O)NNC(=O)[C@@H](NC(=O)c2ccc(F)cc2)C(C)C)c(C)c1 14093012 VQCKBUXKFOTBEE-SFHVURJKSA-N 385.439 2.658 50 40 GFGB CCCCn1nc(C(=O)N/N=C/c2ccc(OC)cc2)c2ccccc2c1=O 6790776 LRYJPQYUYVMWSW-HYARGMPZSA-N 378.432 2.969 50 40 GFGB CCOc1cc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc([N+](=O)[O-])c1O 408542867 LKSZYHWAVZSGKP-MLPAPPSSSA-N 397.343 2.943 50 40 GFGB COc1ccc(NC(=O)CCC(=O)N/N=C(\C)c2ccc(OC)cc2OC)cc1 5025607 GOXBFLAHUPSTMS-OEAKJJBVSA-N 399.447 2.972 50 40 GFGB COc1ccc(CNC(=O)C(=O)N/N=C/c2ccc(Cl)cc2Cl)cc1 5513726 VNNFIGNUVFJMGD-UFFVCSGVSA-N 380.231 2.769 50 40 GFGB COc1cccc(C2=N[C@](NC(=O)c3ccccc3)(C(Cl)Cl)C(=O)N2)c1 101435292 MJNJYRJNDFOFMD-SFHVURJKSA-N 392.242 2.502 50 40 GFGB C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cc1ccccc1F 8242877 DWIAAUJLPYBUEC-NSHDSACASA-N 395.228 2.746 50 40 GFGB CCCCN1C(=O)[C@]2(C(C#N)=C(N)Oc3[nH]nc(CCC)c32)c2ccccc21 8567994 SPCHUWNZRRYICF-NRFANRHFSA-N 377.448 2.881 50 40 GFGB CS(=O)(=O)N(CC(=O)NN=C1CCCC1)c1cccc(C(F)(F)F)c1 408783280 MCEWPSAYJQVGEB-UHFFFAOYSA-N 377.388 2.518 50 40 GFGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1cc2c(cc1[N+](=O)[O-])OCO2 856157 OCNARWYXAMJHCJ-MRXNPFEDSA-N 383.360 2.774 50 40 GFGB O=C1NC[C@H](c2ccccc2)[C@@H]1C(=O)N/N=C/c1c(Cl)cccc1Cl 4322487 UDIGMDRWTCTARS-JXQHFWJUSA-N 376.243 2.973 50 40 GFGB CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCC(=O)Nc1ccccc1OC 15008851 PAEKANDAWJFEDU-XNTDXEJSSA-N 395.415 2.504 50 40 GFGB Cc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C\c2cccc3ccccc23)cc1 16309260 ONSOMCRFIALYOY-HMAPJEAMSA-N 395.484 2.919 50 40 GFGB COc1ccc(CC(=O)NNC(=O)COc2ccc3ccccc3c2)cc1OC 829251 LUPGHPQUJVMNGN-UHFFFAOYSA-N 394.427 2.626 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)ccc1OCC(=O)O 408678407 YPCFCCSXOYQYSG-LPYMAVHISA-N 397.431 2.523 50 40 GFGB COC(=O)c1ccc(NC(=O)C(=O)N/N=C\c2c(Cl)cccc2Cl)cc1 223157743 AQOSBHWPJPZVTL-UKWGHVSLSA-N 394.214 2.869 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)CC(=O)Nc2cccc(Cl)c2)c1 1444634 BTMJXUFTUNOYFD-RGVLZGJSSA-N 375.812 2.836 50 40 GFGB CCOc1cc(/C=N\NC(=O)COc2cccc(C)c2C)cc([N+](=O)[O-])c1O 30843172 CDIFBVXYTXZJCZ-JMIUGGIZSA-N 387.392 2.845 50 40 GFGB CCCn1c(SCC(=O)NNC(=O)c2ccc(C)cc2)nnc1C(C)C 1364267 BBYOTVBKOGYIAU-UHFFFAOYSA-N 375.498 2.673 50 40 GFGB CCN1C(=O)/C(=N/NC(=O)c2ccccc2N)c2cc(Br)ccc21 5736645 ZJJLEIBUJHOJQA-HMMYKYKNSA-N 387.237 2.532 50 40 GFGB O=C(NNC(=O)c1ccccc1I)c1cccc(F)c1 6222327 PBWJGEVXZUCCLP-UHFFFAOYSA-N 384.148 2.505 50 40 GFGB Cc1cccc(N(CC(=O)N/N=C/c2ccccc2Cl)S(C)(=O)=O)c1 20060254 SBYAAVHODGWRNZ-YBFXNURJSA-N 379.869 2.565 50 40 GFGB CCCN(CCC)S(=O)(=O)c1ccc(NC(=O)CBr)cc1 35604967 PFVXLFJKQKNJQH-UHFFFAOYSA-N 377.304 2.831 50 40 GFGB COc1cc(OC)c([C@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)cc1OC 40544850 RIAQACXBDKIYPR-LJQANCHMSA-N 382.372 2.659 50 40 GFGB CC(C)(C)c1ccc(C(=O)NC(=S)NNC(=O)COc2ccccc2)cc1 2135406 NNARABJYXPIUME-UHFFFAOYSA-N 385.489 2.699 50 40 GFGB O=C(NCc1ccncc1)C(=O)N/N=C\c1ccc(-c2cccc(Cl)c2)o1 58914470 AYKQSQWBDHLHKL-FMCGGJTJSA-N 382.807 2.762 50 40 GFGB O=C(COc1ccc(Cl)cc1)N/N=C/c1ccc(N2CCOCC2)c(F)c1 409127791 HPWNAECQIFPXLO-WSDLNYQXSA-N 391.830 2.845 50 40 GFGB Cc1nn(CC(C)C)c(C)c1CC(=O)NNC(=O)c1ccc(OC(C)C)cc1 17294352 ACUIZSPQFOOHCR-UHFFFAOYSA-N 386.496 2.947 50 40 GFGB COc1ccc(C(=O)N/N=C/c2ccc(I)cc2)c(O)c1 409391569 JUENDRARCUJVGU-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB COc1ccc(N2C(=O)[C@H]3SC(N)=C(C#N)C4(CCCCC4)[C@@H]3C2=O)cc1 102222112 DNVFWJVHBSHAPN-HOTGVXAUSA-N 383.473 2.944 50 40 GFGB COc1ccccc1/C=N/NC(=O)C(=O)NCc1ccc(Cl)cc1Cl 5514962 FFUSRDZEQKXYOS-UFFVCSGVSA-N 380.231 2.769 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccc2-n2cccc2)ccc1OCC(=O)O 5529680 XHSAMNZSHXVDEI-LPYMAVHISA-N 393.399 2.713 50 40 GFGB N#CC1=C(N)Oc2[nH]nc(-c3cccc([N+](=O)[O-])c3)c2[C@H]1c1ccc(O)cc1 4125683 KKSRKNMRUUTOBZ-HNNXBMFYSA-N 375.344 2.909 50 40 GFGB COc1ccc(C(=O)NNC(=O)N(C)Cc2ccccc2Cl)cc1OC 32795423 KBCQEAPPWQHTBJ-UHFFFAOYSA-N 377.828 2.844 50 40 GFGB O=C(CNc1nc2ccccc2s1)NNC(=O)c1c[nH]nc1-c1ccccc1 23054974 FDKCWAYWGMJBDK-UHFFFAOYSA-N 392.444 2.560 50 40 GFGB COc1ccc2cc(C(=O)N/N=C/c3cc(OC)c(OC)c(OC)c3)[nH]c2c1 2225998 RDDFGQILXNBRAI-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB CCOc1ccc(C(=O)NNC(=O)CSCCc2ccccc2)cc1OC 12801022 UKPKYYCAPTXNDL-UHFFFAOYSA-N 388.489 2.831 50 40 GFGB CS(=O)(=O)N(C[C@@H](O)C[C@@H]1C=C(C=O)c2ccccc21)c1ccc(F)cc1 95117205 OWRMCIUZBKJUAB-KSSFIOAISA-N 389.448 2.722 50 40 GFGB CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)c1C 2662048 JBGDPKOUXXQAQQ-UHFFFAOYSA-N 378.388 2.833 50 40 GFGB O=C(c1ccc(N2CCOCC2)cc1)[C@@H](Br)CBr 575358761 PZSOBDZECHCNRN-LBPRGKRZSA-N 377.076 2.864 50 40 GFGB Cc1ccc([C@H]2C(C#N)=C(N)N(N3CCOCC3)C3=C2C(=O)CC(C)(C)C3)cc1 690771 BVHGOGFNGJOLRC-FQEVSTJZSA-N 392.503 2.979 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cccc(F)c3)[C@@H]2C1 803610 ORLOEAOYVWVBMJ-QZTJIDSGSA-N 391.406 2.708 50 40 GFGB O=C(N/N=C(\Cn1cncn1)c1ccc(F)c(F)c1)c1ccc(F)cc1F 1057371 BMBLDVGXMIDLLS-LFVJCYFKSA-N 377.301 2.669 50 40 GFGB Cn1c(NNC(=O)Cc2ccccc2)nc2sc3c(c2c1=O)CC(C)(C)OC3 2217747 FZUJNDQGIUQEPH-UHFFFAOYSA-N 398.488 2.532 50 40 GFGB COc1ccccc1NC(=O)C1=C(C)N=C2C(C#N)=CNN2[C@@H]1c1cccnc1 9423091 OAZMCVWCXOZGSZ-LJQANCHMSA-N 386.415 2.684 50 40 GFGB CCC(=O)N1CCN(c2ccc(N3C[C@H](C(=O)Cl)CC3=O)cc2Cl)CC1 57332473 KFRSFNZZZABDNE-GFCCVEGCSA-N 398.290 2.517 50 40 GFGB COc1ccc(CNC(=O)C(=O)N/N=C/c2cccc(Cl)c2Cl)cc1 59444307 GWTODPJZRKPDGG-UFFVCSGVSA-N 380.231 2.769 50 40 GFGB CCCOc1ccc(C(=O)N/N=C\c2cccc(OCC(N)=O)c2)cc1OCC 409317839 WHFUGSOIYDDGKF-QRVIBDJDSA-N 399.447 2.502 50 40 GFGB Cc1ccc(-c2[nH]nc3c2[C@]2(C(=O)Nc4ccc(F)cc42)C(C#N)=C(N)O3)cc1 664645 WRZXXWMCCIBJKY-OAQYLSRUSA-N 387.374 2.849 50 40 GFGB O=C(COc1ccc(I)cc1)N/N=C/c1ccccc1 4705101 FPJBCPUQFUURAJ-LICLKQGHSA-N 380.185 2.820 50 40 GFGB COc1ccc(C(=O)N/N=C/c2cc(OC)cc(Br)c2O)cc1 408587030 DPTFOEGDUFSROX-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB O=C(N/N=C\c1cc(I)ccc1O)c1ccc(F)cc1 30822005 UTHKINBTBCADGB-IUXPMGMMSA-N 384.148 2.900 50 40 GFGB O=C(CCBr)N1CCCN(c2ccc(C(F)(F)F)cn2)CC1 24738282 RTGMPBFLWPRCFA-UHFFFAOYSA-N 380.208 2.924 50 40 GFGB Cn1cc(C(=O)NNC(=O)NCCCn2cnc3ccccc32)c2ccccc21 54046984 PRZVJFYRKPFCIH-UHFFFAOYSA-N 390.447 2.562 50 40 GFGB O=C(NN[C@H](C(=O)NC1CC1)c1ccccc1)c1ccccc1Br 12784052 BSESOUXSYMSTER-INIZCTEOSA-N 388.265 2.703 50 40 GFGB C[S@@](=O)c1ccc(C(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cc1 67337762 VLIYHVJSPRVCMW-MHZLTWQESA-N 399.394 2.587 50 40 GFGB O=C(N/N=C\c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1cccc(Cl)c1 33934791 ZKLXYRBNMIULTE-NDENLUEZSA-N 388.811 2.849 50 40 GFGB CCCC(O)(CCC)C(=O)N/N=C1/C(=O)Nc2ccc(Br)cc21 85838451 YWIYYVQEYZETJD-UHFFFAOYSA-N 382.258 2.553 50 40 GFGB CCc1ccc(OCC(=O)NNC(=O)COc2cc(C)ccc2Cl)cc1 14138805 LEAWYLQQDGSGGC-UHFFFAOYSA-N 376.840 2.816 50 40 GFGB O=C(COC(=O)c1csc(-c2ccccc2)n1)NNC(=O)c1ccccc1F 7162260 QMOJTOXCPLIFCH-UHFFFAOYSA-N 399.403 2.567 50 40 GFGB Cc1ccc(COc2ccc(/C=N/NC(=O)C(=O)NCc3ccco3)cc2)cc1 7786535 BANYDFZEQLPWEV-ZMOGYAJESA-N 391.427 2.934 50 40 GFGB O=C(N/N=C/c1ccc(O)c(I)c1)c1ccc(F)cc1 1445534 CQLZJTGJZLELOE-CAOOACKPSA-N 384.148 2.900 50 40 GFGB O=C(NNC(=O)[C@H]1CC=CC[C@H]1C(=O)O)c1sc2ccccc2c1Cl 12809851 CGLPZOPWUVDQGV-VHSXEESVSA-N 378.837 2.983 50 40 GFGB Cc1occc1C(=O)NNC(=O)c1nn(-c2ccc(F)cc2)c2c1CCCC2 8708678 ORGPLCVYQOFPFG-UHFFFAOYSA-N 382.395 2.866 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2cc3c(cc2Br)OCO3)cc1 5513661 OPEHWXPAYUSELN-DJKKODMXSA-N 391.221 2.879 50 40 GFGB N#C/C(=C\c1ccc(N2CCOCC2)o1)C(=O)NCCc1c[nH]c2ccccc12 4723090 GAEVIVZGXCUYEX-GHRIWEEISA-N 390.443 2.863 50 40 GFGB biogenic,in-vitro CCNc1nc2[nH]c(=O)c3c(c2s1)OC(N)=C(C#N)[C@@H]3c1ccc(C)cc1 8672051 SAMOSELYGDJNJZ-LBPRGKRZSA-N 379.445 2.943 50 40 GFGB O=C(N/N=C/c1ccccc1[N+](=O)[O-])C1CCN(C(=O)c2ccc(F)cc2)CC1 409007854 ZUJWSVDCJSVPHU-LPYMAVHISA-N 398.394 2.736 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)c1 1421657 ABIXYDWWNGTXSG-VXLYETTFSA-N 389.433 2.996 50 40 GFGB O=C(COc1ccccc1-c1ccccc1)NNC(=O)CC1(O)CCCCC1 78808952 VOXUHOHPZVMPKR-UHFFFAOYSA-N 382.460 2.965 50 40 GFGB COC(=O)CCC(=O)NNc1nc(SC)nc2sc3c(c12)CCCC3 2351012 OBGYUDAFOBFYAU-UHFFFAOYSA-N 380.495 2.688 50 40 GFGB O=C(N/N=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1cccc(Cl)c1 15225685 ZKLXYRBNMIULTE-UDWIEESQSA-N 388.811 2.849 50 40 GFGB Cc1cccc(OCC(=O)NNC(=O)c2cc(C3CC3)nn2-c2ccccc2)c1 15667937 HGAMDQNEFCUEPQ-UHFFFAOYSA-N 390.443 2.898 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc2ccccc12)c1cccc(F)c1 409109986 OZWIKVQJGHKENC-LPYMAVHISA-N 399.447 2.895 50 40 GFGB COc1ccc(/C=N/NC(=O)c2cc(Br)ccc2OC)cc1O 408751665 BHIUDBZPNAGUJY-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccccc2)C1)c1ccc(Cl)c(Cl)c1 408614763 HLJNWEYKNZYTAX-GFCCVEGCSA-N 392.242 2.808 50 40 GFGB CN(C)c1cccc(C(=O)N/N=C/c2ccc(I)o2)c1 409000622 UKASQNMEPIZUHH-CXUHLZMHSA-N 383.189 2.714 50 40 GFGB Cc1cc(C)n(Cc2cccc(C(=O)N/N=C/c3cc([N+](=O)[O-])ccc3O)c2)n1 38178111 QJTDTNIMDUIFBB-SRZZPIQSSA-N 393.403 2.926 50 40 GFGB O=C(N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O)c1ccccc1F 5678895 CHJPXUJJJDHMSX-REZTVBANSA-N 382.145 2.966 50 40 GFGB Cc1nc(-c2ccccc2)sc1C(=O)NNS(=O)(=O)c1ccccc1F 7387383 ANFUMGPZBDJEIQ-UHFFFAOYSA-N 391.449 2.881 50 40 GFGB CC(C)COC(=O)[C@H]1/C(=N/NC(=O)CC#N)C[C@](C)(O)C[C@@H]1c1ccccc1 100249100 CIPFSKNBWXNURT-OVACIOSJSA-N 385.464 2.516 50 40 GFGB O=C(N/N=C/c1ccc2c(c1)OCCO2)c1ccc(O)c(Br)c1 903785 NVRBMGXGAVUWSI-GIJQJNRQSA-N 377.194 2.690 50 40 GFGB O=C(CCC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1Cl)NCc1ccccc1 4523894 RLJRKMWIFCNVBE-CIAFOILYSA-N 388.811 2.795 50 40 GFGB C=CCN1C(=O)[C@@]2(C(C#N)=C(N)Oc3[nH]nc(CCCC)c32)c2ccccc21 8568098 IHWYIPYRCHAFBT-OAQYLSRUSA-N 375.432 2.657 50 40 GFGB CC(=O)Nc1ccc(/C=C/C(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1 12972522 IQALZSVRDAYBCT-FMIVXFBMSA-N 390.399 2.774 50 40 GFGB COc1ccc(C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)c(OC)c1 15877830 JTQXXPBVHIMAES-UHFFFAOYSA-N 398.337 2.563 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1 409263327 BQMAIBBREKSZFE-DXRSZSRVSA-N 381.407 2.894 50 40 GFGB CCc1sc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccco3)C2)cc1C 12740954 AUUFUJSZJKTNQG-CYBMUJFWSA-N 389.477 2.525 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(C)c(Cl)c2)ccc1OCC(=O)O 59152913 GUXYYIQMTODRNQ-AWQFTUOYSA-N 376.796 2.884 50 40 GFGB C#CCOc1ccc(Br)cc1/C=C(\C#N)C(=O)NC[C@H]1CCCO1 408817084 KOSYQFUXSBZKNA-SCZPIIQISA-N 389.249 2.663 50 40 GFGB Cc1cccc(C(=O)N[C@H](C(=O)NNC(=O)c2ccc(Cl)cc2)C(C)C)c1 2726362 NPWXQTIBCXZJHH-KRWDZBQOSA-N 387.867 2.864 50 40 GFGB Cc1nc(COc2ccccc2C(=O)NNC(=O)c2ccccc2Cl)no1 22457893 MHHUXCOTFGUXHV-UHFFFAOYSA-N 386.795 2.685 50 40 GFGB C=CCN1C(=O)[C@@]2(C(C#N)=C(N)OC(C)=C2C(=O)OC(C)(C)C)c2ccccc21 1247363 ZZUDHNLUYVFYIV-JOCHJYFZSA-N 393.443 2.797 50 40 GFGB CCN1C(=O)[C@@]2(C(C#N)=C(N)Oc3[nH]nc(-c4ccccc4)c32)c2ccccc21 1272259 RKOJRVCFUMVKBJ-JOCHJYFZSA-N 383.411 2.816 50 40 GFGB COc1ccc(/C=N/NC(=O)c2cc(Br)ccc2O)cc1OC 1444756 ZWBVZENHCZAZKT-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB CCOc1ccc(NC(=O)C(=O)N/N=C\c2ccc(OCC)c(OC)c2)cc1 223152081 NLAUVNALZPIKBY-BKUYFWCQSA-N 385.420 2.581 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1OC 4359420 QFPRRODCACSQLA-LPYMAVHISA-N 381.432 2.966 50 40 GFGB Cc1ccccc1C(=O)NNC(=O)Cc1csc(NC(=O)c2ccoc2C)n1 40144670 CNHPIIPEDAFVRP-UHFFFAOYSA-N 398.444 2.609 50 40 GFGB CSc1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2cccs2)c1 6762856 GYRGFNARTJZVGU-UHFFFAOYSA-N 384.866 2.741 50 40 GFGB C[C@@H](C(=O)N/N=C/c1ccccc1Cl)N(c1ccccc1)S(C)(=O)=O 408911378 NGVVPDHSADBTMR-HCZVKUGISA-N 379.869 2.645 50 40 GFGB COc1ccc(C(=O)NNC(=O)Cc2cccc(C(F)(F)F)c2)cc1OC 2623808 VQVUYHJODPSXBG-UHFFFAOYSA-N 382.338 2.726 50 40 GFGB O=C(N/N=C/CSc1nnc(-c2ccc3c(c2)OCO3)o1)c1ccccc1 6889661 WEWSOBQENLTSOI-UFWORHAWSA-N 382.401 2.973 50 40 GFGB O=C(N/N=C\c1cccc(I)c1)c1ccc([N+](=O)[O-])cc1 33339629 MEQKXYLXWINIKX-SXGWCWSVSA-N 395.156 2.963 50 40 GFGB O=C(COc1ccc(Cl)cc1Cl)NCC(=O)N/N=C\c1ccc(F)cc1 36009153 BFZWCLFFHAQGTB-UYOCIXKTSA-N 398.221 2.778 50 40 GFGB CCc1ccc(NC(=O)CCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2O)cc1 36060024 GGIHRLROXGDOCL-UDWIEESQSA-N 384.392 2.732 50 40 GFGB COc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)N3CCCCC3)c2C)cc1 58912513 KFRADVUWCCXVFH-HYARGMPZSA-N 382.464 2.565 50 40 GFGB C/C(=N\NC(=O)CN(c1ccc(F)cc1)S(C)(=O)=O)c1ccc(Cl)cc1 408784759 USBYUPXIUBHAAZ-UDWIEESQSA-N 397.859 2.786 50 40 GFGB O=C(N/N=C/c1ccccc1C(=O)O)C(=O)Nc1cc(Cl)cc(Cl)c1 408969627 QYUPSXHGZPSFEC-UFWORHAWSA-N 380.187 2.780 50 40 GFGB COc1cc(Br)c([C@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)cc1OC 409125332 NCXXAHOVGCKNFM-AWEZNQCLSA-N 391.225 2.716 50 40 GFGB COCCCNC(=O)CSC1=C(C#N)[C@H](c2ccc(Cl)cc2)CC(=O)N1 6441090 JOIYHIUMAIUNQX-AWEZNQCLSA-N 393.896 2.565 50 40 GFGB COc1ccc2ccccc2c1/C=N\NC(=O)[C@H]1C(=O)NC[C@H]1c1ccccc1 4871430 PADFYJZDWRBMDP-PXFURARHSA-N 387.439 2.828 50 40 GFGB COc1ccc(SCC(=O)N/N=C\c2ccc(OCC#N)c(OC)c2)cc1 409378143 MMWIMWXDKQFQCL-MTJSOVHGSA-N 385.445 2.849 50 40 GFGB COC(=O)c1ccc(NC(=O)C(=O)N/N=C\c2cccc3ccccc23)cc1 223159768 YENYJGZGJSJXDV-XKZIYDEJSA-N 375.384 2.715 50 40 GFGB Cc1cc(Cl)ccc1O[C@H](C)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1 1479727 GRZPBECALZWLLK-LLVKDONJSA-N 377.784 2.785 50 40 GFGB COc1cccc([C@@H]2CC(=O)N3C(=C2C#N)SC[C@]3(O)c2ccco2)c1OC 12275690 QDJDZSCVFWBMRU-RBZFPXEDSA-N 398.440 2.940 50 40 GFGB O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)c2ccco2)cc1 881400 FCAYZETZQICRMW-UHFFFAOYSA-N 394.343 2.515 50 40 GFGB C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)NNC(=O)c1ccco1 12868988 QFLJUXGMBKBWDC-MRVPVSSYSA-N 387.617 2.924 50 40 GFGB Cc1ccc(C(=O)N/N=C2/C(=O)N(CN3CCCCC3)c3ccccc32)cc1 3169806 KMDSVQKZWCZVBC-BSYVCWPDSA-N 376.460 2.919 50 40 GFGB O=C(CCCCl)NC(=S)Nc1ccc(Br)cc1C(=O)O 6615049 FFGDVCJPYSXTPX-UHFFFAOYSA-N 379.663 2.979 50 40 GFGB COc1ccccc1CC(=O)NNC(=O)COc1cc(C)c(Cl)c(C)c1 669865 LJQSLTAPSOIWPF-UHFFFAOYSA-N 376.840 2.734 50 40 GFGB CO[C@@H]1CC[C@H](OC(=O)c2ccccc2)[C@H](CI)O1 1714673 CLMYZZZCONXZSG-AVGNSLFASA-N 376.190 2.799 50 40 GFGB CCCN1C(=O)/C(=N\NC(=O)c2cncc(Br)c2)c2ccccc21 5739163 CTSSKPXXJBUXAL-HKWRFOASSA-N 387.237 2.735 50 40 GFGB Cc1nnc(NC(=O)CCCC(=O)O[C@H](CCl)C(=O)c2ccccc2)s1 8474321 AOLOETOJZXXKJA-CYBMUJFWSA-N 395.868 2.989 50 40 GFGB Cc1cccc(C)c1N(CC(=O)N/N=C/c1ccc(Cl)cc1)S(C)(=O)=O 19955352 OLMNIHRVWJNFEO-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB N#CC1=C(N)N=C(SCC(=O)c2ccccc2)[C@H](C(N)=O)C12CCCCC2 102413870 NDXFUXRUXPCGLW-INIZCTEOSA-N 382.489 2.760 50 40 GFGB CCOc1ccc2nnc(CNC(=O)CCCC[C@@H]3CCSS3)n2n1 238971955 ZMLFTGQPZLSHHS-GFCCVEGCSA-N 381.527 2.853 50 40 GFGB Cc1ccc(C)c(N(CC(=O)N/N=C/c2sccc2C)S(C)(=O)=O)c1 408866070 DHPJUYWJXNFUOD-VCHYOVAHSA-N 379.507 2.590 50 40 GFGB CCOc1cc(/C=N/NC(=O)CC#N)ccc1OCC(=O)Nc1ccccc1C 409012215 JTNMCNBEEIZAKQ-YDZHTSKRSA-N 394.431 2.775 50 40 GFGB Cc1ccc(S(=O)(=O)Oc2ccc(/C=N/NC(=O)c3cccnc3)cc2)cc1 4595201 VZVYHAVBSDKTTR-LPYMAVHISA-N 395.440 2.922 50 40 GFGB Cc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccoc2C)c(Br)c1 40140396 DMGPTSURXNSUFV-NSHDSACASA-N 381.226 2.887 50 40 GFGB CC1(CC(=O)N/N=C/c2ccc(OCc3ccccc3C#N)cc2)OCCO1 1093308 UWUWTVHCZUEHCP-OEAKJJBVSA-N 379.416 2.740 50 40 GFGB CCn1c(SCC(=O)N/N=C/c2cccnc2)nnc1-c1cccc(C)c1 2764502 FQGOGNSNIFPYMI-CIAFOILYSA-N 380.477 2.911 50 40 GFGB COC(=O)Oc1ccc(/C=N/NC(=O)c2ccc(OC)c(OC)c2)cc1OC 4502772 SGZWIEODLIIGSK-RGVLZGJSSA-N 388.376 2.622 50 40 GFGB COc1ccc(/C(C)=N/NC(=O)CCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 5516921 ATDIEQYAAQUCLK-FYJGNVAPSA-N 384.392 2.863 50 40 GFGB CC(C)(C)NC(=O)CO/C(=C(\C#N)c1nnc2n1CCCCC2)C(F)(F)F 6051716 QOQLCSRQIIEXKS-SDNWHVSQSA-N 385.390 2.733 50 40 GFGB CSc1cc(Cl)c(C)cc1S(=O)(=O)NC(=O)NNc1ccccn1 6244599 IAJWVBHMZPFTIF-UHFFFAOYSA-N 386.886 2.780 50 40 GFGB C/C(=N\NC(=O)CN(c1ccccc1Cl)S(C)(=O)=O)c1ccc(C)cc1 20493204 UQFGXMQQKMIAPG-XSFVSMFZSA-N 393.896 2.955 50 40 GFGB O=C(/C=C/c1ccc(Cl)cc1Cl)NC(=S)NNC(=O)c1ccncc1 32119200 BSMUIUXCQDOUET-DUXPYHPUSA-N 395.271 2.737 50 40 GFGB CCOC(=O)C1=C(CCl)NC(C)=C(C(=O)OC)[C@@H]1c1cccc([N+](=O)[O-])c1 34241690 JYPZKAWYVKYCOE-HNNXBMFYSA-N 394.811 2.785 50 40 GFGB biogenic O=C(COc1ccc(Br)cc1)N/N=C/c1ccc(O)c([N+](=O)[O-])c1 40902962 FNFCCTYVLAWSLZ-CAOOACKPSA-N 394.181 2.592 50 40 GFGB C[C@H](Oc1ccc(/C=N/NC(=O)Cc2nnc(N)s2)cc1)c1ccccc1 1253291 HTIXXAIZTRPPAK-XMOVILSBSA-N 381.461 2.953 50 40 GFGB CC(=O)NNC(=O)CSc1nc(C2CC2)nc2sc3c(c12)CC[C@@H](C)C3 1377311 JUFFEJOSUOLQSN-SECBINFHSA-N 390.534 2.953 50 40 GFGB COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(C)n(C[C@@H]4CCCO4)c(=O)c32)cc1 2252883 UQKCQZAOQHPMPQ-LPHOPBHVSA-N 393.443 2.563 50 40 GFGB COc1cccc(/C=N/NC(=O)C(=O)Nc2cc(Cl)cc(Cl)c2)c1O 8210682 QUFIZQQAAKRDAY-UFWORHAWSA-N 382.203 2.796 50 40 GFGB COC(=O)c1cc(N/C=C(\C#N)C(=O)Nc2ccccc2)cc(C(=O)OC)c1 57413991 FAWGQWYAWGRGKH-NTCAYCPXSA-N 379.372 2.718 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)C2CCN(C(=O)c3ccccc3)CC2)c1 409005681 JMTKAMQLOIDLMH-HZHRSRAPSA-N 395.459 2.706 50 40 GFGB O=C(N/N=C/c1ccc(I)o1)c1ccc([N+](=O)[O-])cc1 1496578 WMSNJNBFRBVQNN-VGOFMYFVSA-N 385.117 2.556 50 40 GFGB Cc1c(/C=N/NC(=O)CN2CCOCC2)c2ccccc2n1Cc1ccccc1 15018776 PUAYXHAHPSDMTP-BUVRLJJBSA-N 390.487 2.780 50 40 GFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 35937994 JGZZABLJRHXUOW-WBVHZDCISA-N 394.822 2.603 50 40 GFGB O=C(N/N=C/c1ccccc1)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 408846889 LKBSAQREFLWEKG-UOBPLZBXSA-N 391.880 2.643 50 40 GFGB C#CCn1cc(/C=N/NC(=O)c2cc([N+](=O)[O-])ccc2OC)c2ccccc21 409181495 BXAGTNRAAVXZNQ-CIAFOILYSA-N 376.372 2.955 50 40 GFGB O=C(Cc1nnc(NC(=O)Nc2ccccc2)s1)N/N=C/c1ccccc1O 1885951 VANKADOLAIVVIN-YBFXNURJSA-N 396.432 2.581 50 40 GFGB COc1cc(OC)cc(C(=O)NNC(=O)COc2ccc(C(C)C)c(C)c2)c1 6454446 MICZZHPGVSXLKI-UHFFFAOYSA-N 386.448 2.976 50 40 GFGB O=C(N/N=C/c1ccc(N2CCOCC2)s1)c1cc(-c2ccccc2)n[nH]1 7007951 DCGAEMGIMVESLO-DEDYPNTBSA-N 381.461 2.739 50 40 GFGB O=C(N/N=C/c1ccc(OC(=O)c2ccc3c(c2)OCO3)cc1)c1cccnc1 975655 AUZZOBNGCDIHLR-FOKLQQMPSA-N 389.367 2.793 50 40 GFGB C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CSCc1ccc(F)cc1 24977334 YSAOZJVZNDAGFF-GFCCVEGCSA-N 380.416 2.813 50 40 GFGB CCc1ccc(N2C[C@H](C(=O)N/N=C\c3ccc(OC)c(OC)c3)CC2=O)cc1 409262439 DQGGFURTBXMGSV-SUVVMJBMSA-N 395.459 2.769 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cccc(F)c3)[C@H]2C1 803611 ORLOEAOYVWVBMJ-ZWKOTPCHSA-N 391.406 2.708 50 40 GFGB COc1ccccc1C(=O)NNC(=O)COc1ccc(Br)c(C)c1 831996 IRNINVKCXUKYBK-UHFFFAOYSA-N 393.237 2.606 50 40 GFGB COc1ccc(C(=O)NNC(=O)COc2cc(C)c(Cl)c(C)c2)cc1OC 869518 HJOORZUGMYEFSQ-UHFFFAOYSA-N 392.839 2.814 50 40 GFGB CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\c1c(C)nn(-c2ccc(C)c(C)c2)c1O 19145069 NWRKVNPIFILSAE-SXGWCWSVSA-N 376.416 2.725 50 40 GFGB COc1cc(NC(=O)C/C(C)=N/NC(=O)c2cccnc2)c(OC)cc1Cl 100522711 XUYADVSAVJPWJR-SSDVNMTOSA-N 390.827 2.887 50 40 GFGB Cc1ccccc1OCC(=O)N[C@H](CC(C)C)C(=O)N/N=C/c1ccc(O)cc1 408974086 WZEGHFJBPCJNQH-QNDYCBLQSA-N 397.475 2.761 50 40 GFGB C[C@@H]1C[C@@H]1c1ccc(CCC(=O)NNC(=O)c2cc(Br)c[nH]2)o1 53175966 HTJJRYBKADKIED-SKDRFNHKSA-N 380.242 2.887 50 40 GFGB CC(=O)N1CCN(c2c(Cl)cccc2[C@H]2C[C@H](C(=O)Cl)CC2=O)CC1 57328052 PQKMQDKBWGWISS-GXTWGEPZSA-N 383.275 2.837 50 40 GFGB CCOc1cc(C(=O)NNC(=O)c2ccoc2C)cc(Br)c1OC 13137571 DBHHJBRWDOXASB-UHFFFAOYSA-N 397.225 2.833 50 40 GFGB Cc1ccc2c(c1)[C@]1(C(=O)N2)C(C#N)=C(N)N(c2cccnc2)C2=C1C(=O)CCC2 4417976 KPQHSZAVMGOPAU-QHCPKHFHSA-N 397.438 2.801 50 40 GFGB CC(C)CCNC(=O)/C(C#N)=C1\N=C(NC(=O)c2cccnc2)c2ccccc21 8560469 ZZUYDPWZWQLUEY-HNENSFHCSA-N 387.443 2.669 50 40 GFGB COc1cc(C(NC(=O)CCl)NC(=O)CCl)ccc1OCCC(C)C 2696683 JHOGQCNODWCUKD-UHFFFAOYSA-N 391.295 2.829 50 40 GFGB CCN1C(=O)[C@]2(C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)c2ccccc21 4302082 LHYCJLHQBCUQPC-QHCPKHFHSA-N 397.438 2.920 50 40 GFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(N(C)C)cc1 4414054 JWMYFTRLTFAPSP-INIZCTEOSA-N 383.477 2.701 50 40 GFGB CC[C@@H](C)Oc1cccc(C(=O)NC(=S)NNC(=O)c2cccs2)c1 6596390 REOFNWFFLQOPMS-LLVKDONJSA-N 377.491 2.875 50 40 GFGB Cc1cc(C)c(S(=O)(=O)NCC(=O)N/N=C/c2cccc(Cl)c2)c(C)c1 6607345 UCFIYUMRNXZJRA-KEBDBYFISA-N 393.896 2.694 50 40 GFGB COc1ccc(C(=O)Nc2ccccc2C(=O)NNC(=O)c2ccco2)cc1 27328983 DKIBCRYWDQPWAR-UHFFFAOYSA-N 379.372 2.615 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2ccc(F)cc2)cc(Cl)c1O 409262552 HVLJGFFBJOMSDL-AWQFTUOYSA-N 379.775 2.672 50 40 GFGB COc1cc(/C=N\NC(=O)Nc2ccc(F)cc2)ccc1O[C@H](C)C(=O)O 409017685 VOVKABJVTPSECR-BPXUPMHTSA-N 375.356 2.842 50 40 GFGB CC(=O)c1c(C)[nH]c(C(=O)NNC(=O)COc2ccc(Cl)cc2C)c1C 12864654 NWZUFIFJTUUSQG-UHFFFAOYSA-N 377.828 2.636 50 40 GFGB C/C(=N\NC(=O)CN1CCN(Cc2ccc(C)cc2)CC1)c1ccc(F)cc1 19861312 LUJSRMMQOCFNHQ-HKOYGPOVSA-N 382.483 2.792 50 40 GFGB CCOc1ccc([C@H]2CC(=O)NC(SCC(=O)NCC(C)C)=C2C#N)cc1 6963709 WXFKMOUCADEWEX-MRXNPFEDSA-N 387.505 2.929 50 40 GFGB O=C(CCc1nc2ccccc2s1)NNC(=O)CN1CCCc2ccccc21 8029864 VNUKNTIAQYURTP-UHFFFAOYSA-N 394.500 2.829 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccccc1OCC 408906679 DAQGQNPOHUZANV-GNFOSXPUSA-N 383.448 2.893 50 40 GFGB COc1ccc(C(=O)N/N=C/c2cccc(I)c2)c(O)c1 409392985 UOBDEUWMLVNJKQ-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB CCNc1sc2c3c(c(=O)[nH]c2c1C#N)[C@H](c1ccncc1)C(C#N)=C(N)O3 15085095 ANTBZXXONOTVPZ-GFCCVEGCSA-N 390.428 2.506 50 40 GFGB COC(=O)C1=C(C)NC(SC)=C(C#N)[C@H]1c1cc(OC)c(OC)c(OC)c1 20528841 DWFMEDUBYNSFRF-MRXNPFEDSA-N 390.461 2.944 50 40 GFGB biogenic,in-vitro CCC(=O)N1CCc2cc(C(=O)NNC(=O)c3ccc(OC(C)C)cc3)ccc21 40142934 LTXSXYMHFYQIQP-UHFFFAOYSA-N 395.459 2.848 50 40 GFGB COc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)N3CCCCCC3)c2C)cc1 58912556 YJNJJDNBPQEAHZ-HZHRSRAPSA-N 396.491 2.955 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1cccc(Cl)c1 59437030 YCGNFUNJMQAILA-UDWIEESQSA-N 388.811 2.849 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccccc1OCC 408906680 DAQGQNPOHUZANV-LUJYGJGBSA-N 383.448 2.893 50 40 GFGB COCCN1C(N)=C(C#N)[C@H](c2ccc3c(c2)OCO3)C2=C1CC(C)(C)CC2=O 409128720 KSQQGVGKFNDMIV-IBGZPJMESA-N 395.459 2.798 50 40 GFGB C#CCOc1c(Cl)cc(/C=N/NC(=O)[C@H](O)c2ccccc2)cc1OCC 409256192 KDHWKRDACOPCJG-MNOULKQQSA-N 386.835 2.934 50 40 GFGB COc1cc(/C=N/NC(=O)COc2ccc(Cl)cc2)ccc1OC(C)=O 3071806 QHBPTCFCZGKZTL-KEBDBYFISA-N 376.796 2.803 50 40 GFGB O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(SC(F)(F)F)cc1 24986882 IEUKCYUPXDVCJH-CQSZACIVSA-N 398.362 2.900 50 40 GFGB Cc1cccc(/C=C/C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1 13006276 XEKFVRYQNGLCFD-VAWYXSNFSA-N 390.443 2.760 50 40 GFGB COc1ccc(OCCC(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)cc1 6016653 ZDKNTBZRUFLFDW-UHFFFAOYSA-N 393.399 2.849 50 40 GFGB O=C(NNC(=O)c1nccnc1-c1nc2ccccc2s1)c1ccccc1 6670252 ZUHKPGSEPSHZMX-UHFFFAOYSA-N 375.413 2.828 50 40 GFGB CCOC(=O)COc1ccc(/C=N/NC(=O)COc2c(C)cccc2C)cc1 408908000 CZRHWRKUVFTNBB-WSDLNYQXSA-N 384.432 2.774 50 40 GFGB O=C(NNC(=O)c1cc(-c2cccc(Cl)c2)on1)c1cccc([N+](=O)[O-])c1 40087360 MMEHPPJPVDOWFB-UHFFFAOYSA-N 386.751 2.978 50 40 GFGB CC1(CC(=O)N/N=C/c2cn(CCC(N)=O)c3ccccc23)SCCS1 6348182 YAMIYCOJODAYLV-RGVLZGJSSA-N 390.534 2.553 50 40 GFGB CCOc1nccn2c(CNC(=O)CCCC[C@@H]3CCSS3)nnc12 238811764 AMCUTPFIEGAXMB-GFCCVEGCSA-N 381.527 2.853 50 40 GFGB O=C(COc1cccc(Br)c1)N/N=C/c1ccc2c(c1)OCCO2 3035445 ZCZHJHMZXGMCQP-VXLYETTFSA-N 391.221 2.749 50 40 GFGB CCOc1ccc(C(=O)N/N=C/c2cn(CC(=O)OC)c3ccccc23)cc1 20765006 CDGQMKGBJWQICF-WSDLNYQXSA-N 379.416 2.977 50 40 GFGB COC(=O)[C@H](Cc1ccccc1)NC(=O)/C(C#N)=C\c1ccc(N(C)C)cc1 96993360 UXKZQDAPYGERJI-LVSKKATPSA-N 377.444 2.560 50 40 GFGB C/C(CC(=O)Nc1cccc(Br)c1)=N\NC(=O)c1ccncc1 100527509 KYEJTYTZAJZIMO-RGVLZGJSSA-N 375.226 2.979 50 40 GFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2ccccc2)C1)c1ccc(Cl)cc1Cl 408616101 VUINJRJJCFQIGL-NSHDSACASA-N 392.242 2.808 50 40 GFGB COc1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1[N+](=O)[O-] 106858191 AWDJMNHRLZSHDV-LGMDPLHJSA-N 392.415 2.859 50 40 GFGB Cn1cc(C(=O)NNC(=O)c2ccc(NC(=O)C3CC3)cc2)c2ccccc21 10736489 NGSUMMVMULNOTG-UHFFFAOYSA-N 376.416 2.602 50 40 GFGB CC(=O)Nc1ccc(OCC(=O)N/N=C/c2ccc(Br)o2)cc1 4545270 AJKFESFTOZYYFO-CAOOACKPSA-N 380.198 2.530 50 40 GFGB CCOc1ccccc1NC(=O)[C@H]1[C@H]2C(=O)O[C@@H]3[C@@H](Br)[C@@H]1C[C@@H]32 408689142 XRTBCIFPTLVWJL-GFIYSBKGSA-N 380.238 2.595 50 40 GFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 3102402 HEPUVQITLNENBR-CAOOACKPSA-N 378.728 2.686 50 40 GFGB COc1cc(OC)cc(C(=O)N/N=C/c2ccc(O)c(Br)c2)c1 6145525 YLAAFJILZBPBQV-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB CCOC(=O)C1=C(CCl)OC(N)=C(C#N)[C@H]1c1ccc(OC)c(OC)c1 1247667 UJALIOAOXTUTJU-OAHLLOKOSA-N 378.812 2.567 50 40 GFGB Cc1cc(C)c(S(=O)(=O)N(C)CC(=O)N/N=C/c2ccccc2F)c(C)c1 6607047 MSYHARGCUFENID-SRZZPIQSSA-N 391.468 2.522 50 40 GFGB COc1cc(C(=O)NNC(=O)CCSc2ccccc2)cc(OC)c1OC 8271365 WBWMXMKARVBRSK-UHFFFAOYSA-N 390.461 2.656 50 40 GFGB Cc1cc2c(c(=O)n1C)[C@H](c1ccc(F)c(Br)c1)C(C#N)=C(N)O2 20086750 XFDPZUTYJAPRNG-CQSZACIVSA-N 390.212 2.814 50 40 GFGB Cc1sc2nc(CN3CCOCC3)nc(NNC(=O)c3ccccc3)c2c1C 23408411 VLOUKEHCPHXHMO-UHFFFAOYSA-N 397.504 2.897 50 40 GFGB COc1ccc(C(=O)N/N=C\c2cc(Br)cc([N+](=O)[O-])c2O)cc1 36151933 TXAOUIJZINPUGN-IUXPMGMMSA-N 394.181 2.835 50 40 GFGB CC(C)(C)C(=O)Nc1nnc(CC(=O)N/N=C/c2ccc(Cl)cc2)s1 59498834 ROKHEXRNYACOKV-GIJQJNRQSA-N 379.873 2.869 50 40 GFGB N#CC1=C(SCC(N)=O)N=C2CCCC(O)=C2[C@H]1c1ccc2c(c1)OCO2 100088281 XLQCEPLXQUIMFT-KRWDZBQOSA-N 383.429 2.903 50 40 GFGB C/C(=N\NC(=O)CN(c1cccnc1)S(=O)(=O)c1ccccc1)C(C)(C)C 408777168 WDHRMOBDEWUFFC-RCCKNPSSSA-N 388.493 2.815 50 40 GFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1ccc(OCC#N)cc1)c1ccccc1 408977085 CULZDHZXORYDIP-SYVPYPDPSA-N 394.431 2.917 50 40 GFGB COc1cc(OC)c(/C=N/NC(=O)[C@@H](O)c2ccccc2)cc1Br 409264679 PBVPNPBPLSDWRS-JJLFXSABSA-N 393.237 2.650 50 40 GFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1)c1ccc(Cl)cc1 7882224 IDVFHCVMSARBJH-LBPRGKRZSA-N 392.242 2.808 50 40 GFGB Cc1cc(=O)oc2cc(OCC(=O)N/N=C/c3ccc([N+](=O)[O-])cc3)ccc12 1299898 GUQPBXIXRYCSEN-KEBDBYFISA-N 381.344 2.539 50 40 GFGB CS(=O)(=O)N(CC(=O)NN=C1CCCC1)c1cc(Cl)ccc1Cl 409027946 GZYSJIXIWPOTGF-UHFFFAOYSA-N 378.281 2.806 50 40 GFGB O=C(Cn1nnc(-c2ccccc2)n1)N/N=C/c1c(Cl)cccc1Cl 4702505 MNBHRUROFTWUQR-DJKKODMXSA-N 375.219 2.797 50 40 GFGB CN(C)c1cccc(OCC(=O)N/N=C\c2ccc(Cl)c([N+](=O)[O-])c2)c1 409104878 KPBMSOFAWQWSFJ-GRSHGNNSSA-N 376.800 2.843 50 40 GFGB CS(=O)(=O)N(C[C@@H](O)C[C@H]1C=C(C=O)c2ccccc21)c1ccc(F)cc1 257173491 OWRMCIUZBKJUAB-KDOFPFPSSA-N 389.448 2.722 50 40 GFGB C/C(CC(=O)Nc1ccccc1[N+](=O)[O-])=N\NC(=O)COc1ccccc1C 4405414 QXKKCZWFMHHRLB-KGENOOAVSA-N 384.392 2.803 50 40 GFGB CC1=C(C#N)[C@@](NC(=O)c2cncc(Br)c2)(C(F)(F)F)C(O)=N1 40288379 QEYYHKXBUJZFRN-LBPRGKRZSA-N 389.131 2.643 50 40 GFGB CC1=NN(c2ccc(C)cc2C)C(=O)/C1=C/NNC(=O)c1cccc([N+](=O)[O-])c1 809143 DPDGTRURRXVZJP-GZTJUZNOSA-N 393.403 2.753 50 40 GFGB O=C(N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccccc1Br 4815494 ATRMCUNNARYLCX-REZTVBANSA-N 392.165 2.850 50 40 GFGB I[C@H]1CC[C@H]2O[C@@H]1CC[C@H]2I 5542156 JGRCXIKSKJDSQB-ULAWRXDQSA-N 377.991 2.935 50 40 GFGB C/C(=N\NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O)c1ccccc1 19954263 CSXWWULEDXGRNB-CPNJWEJPSA-N 379.869 2.646 50 40 GFGB COc1cc(/C=N/NC(=O)C(=O)Nc2ccc(C(C)C)cc2)cc(OC)c1OC 59506614 IBUULTRJKTVEBL-WSDLNYQXSA-N 399.447 2.925 50 40 GFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(Cl)cc3[N+](=O)[O-])[C@H]2C1 4786337 JGZZABLJRHXUOW-DOTOQJQBSA-N 394.822 2.603 50 40 GFGB C=CCN1C(=O)/C(=N\NC(=O)c2cncc(Br)c2)c2ccccc21 5668300 PNAYAFFESABPGK-HKWRFOASSA-N 385.221 2.511 50 40 GFGB O=C(COc1cccc(Br)c1)NNC(=O)C[C@@H]1C[C@H]2CC[C@H]1C2 104742533 UDRRHEBWWFFPQD-AVGNSLFASA-N 381.270 2.802 50 40 GFGB COc1cccc(CC(=O)N/N=C\c2ccccc2I)c1 109040050 XDNHYZRXXJFVPG-WQRHYEAKSA-N 394.212 2.993 50 40 GFGB CC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(I)o2)cc1 107977261 HCYYGIKMQHSDFP-LZYBPNLTSA-N 397.172 2.607 50 40 GFGB COc1cc(/C=N\NC(=O)c2c(C)nc3cc(C)ccn23)cc(OC)c1OC 100376932 RDMHGSKAPATDIR-NHDPSOOVSA-N 382.420 2.741 50 40 GFGB Cc1ccc2c(c1)[C@@]1(C(=O)N2C)C(C#N)=C(N)Oc2c1c(C)nn2-c1ccccc1 5269439 VSGXYONTDBKGKF-HSZRJFAPSA-N 397.438 2.838 50 40 GFGB CCCC[C@H](C[C@H](O)COCCC)C(=O)NNC(=S)Nc1ccccc1 4793995 UDLQODXYXADENG-WBVHZDCISA-N 381.542 2.988 50 40 GFGB CS(=O)(=O)Cc1ccc(C(=O)NNc2c(F)c(F)c(F)c(F)c2F)cc1 6981251 BXYNIIDQUGJQLA-UHFFFAOYSA-N 394.321 2.684 50 40 GFGB COc1ccc(Br)cc1C(=O)N/N=C/c1ccccc1C(=O)O 408923193 JQAFNWRJTVPAQI-GIJQJNRQSA-N 377.194 2.920 50 40 GFGB COc1ccc(N2C[C@H](C(=O)N/N=C\c3ccc(SC)cc3)CC2=O)cc1 409175649 UEOOVSLYCPJRTP-OFNOZLENSA-N 383.473 2.920 50 40 GFGB COc1ccccc1C(=O)N/N=C/c1ccc(O)c(I)c1 5515004 UMNPGOFJXUKXEK-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB CO[C@@H](C(=O)N/N=C1\C(=O)Nc2ccc(Br)cc21)c1ccccc1 5483071 AKZCSGRIWZFQFO-OAHLLOKOSA-N 388.221 2.609 50 40 GFGB COc1cccc(/C=N/NC(=O)COc2ccc(OC)cc2Br)c1 1435032 RUFBECZTFVROTK-VXLYETTFSA-N 393.237 2.995 50 40 GFGB Cc1ccc(Cn2cc(C(=O)NNC(=O)Nc3cccs3)ccc2=O)cc1 23136206 BIJJVUQVMSACQG-UHFFFAOYSA-N 382.445 2.733 50 40 GFGB CCCn1nc(C(=O)NNC(=O)/C=C/c2cccc(C)c2)c2ccccc2c1=O 6929846 RWAODSKOSKCLQE-VAWYXSNFSA-N 390.443 2.589 50 40 GFGB CCn1ncc2c(C(=O)NNC(=O)c3cccnc3)cc(-c3ccccc3)nc21 14221217 QFGXRTQUCJUTDJ-UHFFFAOYSA-N 386.415 2.588 50 40 GFGB C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)COc1cccc2ccccc12 15384825 SNRBPBUZXSTJEW-AWEZNQCLSA-N 382.391 2.973 50 40 GFGB C[C@H]1Cc2cc(S(=O)(=O)NC(=O)/C(C#N)=C\c3ccco3)cc(Cl)c2O1 584906932 DJTDLVYCWPDPPQ-OGGBREFQSA-N 392.820 2.668 50 40 GFGB Cc1ccc(NCC(=O)NNC(=O)c2ccc(CN3CCCCC3)cc2)cc1 12534519 MRLORJJEQAHPIG-UHFFFAOYSA-N 380.492 2.854 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](Cc3ccccc3)[C@@H]2C1 804115 MBUHITNHCISTPZ-MOPGFXCFSA-N 387.443 2.644 50 40 GFGB CCOc1cc(Br)cc(/C=N/NC(=O)c2ccccc2N)c1O 849660 QWGFXDTXAZFXPN-DJKKODMXSA-N 378.226 2.900 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)COc2cc(C)c(Cl)c(C)c2)cc1 1750118 LJNWCCZMFZZBRN-UHFFFAOYSA-N 376.840 2.870 50 40 GFGB Cc1cc(C)n(CCC(=O)N/N=C/c2ccc(Br)c([N+](=O)[O-])c2)n1 2277359 BGIWSPMOGYSMGW-RQZCQDPDSA-N 394.229 2.711 50 40 GFGB C[C@H]1C(C#N)=C(N)Oc2n[nH]c(-c3cccc(I)c3)c21 4730590 XWCIXYYXPQPYFF-ZETCQYMHSA-N 378.173 2.871 50 40 GFGB O=C(CC12CC3CC(CC(C3)C1)C2)NNS(=O)(=O)c1cc(F)ccc1F 8107037 SORJFXKCYQPYFZ-UHFFFAOYSA-N 384.448 2.881 50 40 GFGB COc1ccc(S(=O)(=O)/C(C#N)=C\N2CCN(Cc3ccccc3)CC2)cc1 102820945 LHDHDYOOBQGWKY-FXBPSFAMSA-N 397.500 2.652 50 40 GFGB NNC(=O)CCc1cc(Cl)c(OCc2cccnc2)c(Br)c1 226342003 UBORQROETXZCNK-UHFFFAOYSA-N 384.661 2.999 50 40 GFGB CNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1OCc1c(F)cccc1Cl 408606784 AZHLPYGHVOQMRQ-GZIVZEMBSA-N 398.221 2.908 50 40 GFGB Cc1onc(-c2ccccc2)c1C(=O)NNC(=S)NC(=O)c1cccs1 2251311 SKBKMAZFVIFUOJ-UHFFFAOYSA-N 386.458 2.661 50 40 GFGB COC(=O)COc1ccccc1/C=N/NC(=O)c1ccc(N2CCCC2)cc1 7385680 DMFKLRBXQLBIJO-HYARGMPZSA-N 381.432 2.603 50 40 GFGB Cc1nc2ccc(C(=O)NNC(=O)c3cc(-c4ccccc4)n[nH]3)cc2nc1C 8284009 SDTILEXSDZVHJO-UHFFFAOYSA-N 386.415 2.712 50 40 GFGB CCOC(=O)COc1ccc(/C=N/NC(=O)CNc2ccc(Cl)cc2)cc1 409364182 NIJLUUXEUXXJCL-SSDVNMTOSA-N 389.839 2.844 50 40 GFGB COC(=O)[C@H](CCBr)CCOS(=O)(=O)c1ccc(C)cc1 642882546 KQTRAYGVQAKYOJ-GFCCVEGCSA-N 379.272 2.665 50 40 GFGB O=C(COc1ccc(Cl)cc1Cl)NCC(=O)N/N=C/c1cccs1 2451474 MSZDQZYLOIVFKL-FBCYGCLPSA-N 386.260 2.700 50 40 GFGB C[C@H]1CCc2sc(C(=O)NNS(=O)(=O)c3ccc(F)cc3F)cc2C1 7403161 YSGPDGOUOGJGEX-VIFPVBQESA-N 386.445 2.774 50 40 GFGB CCN(CC)c1ccc(C(=O)NNS(=O)(=O)c2cccc(Cl)c2)cc1 7409207 OETLDKQAUYSTOM-UHFFFAOYSA-N 381.885 2.810 50 40 GFGB CCC[C@H](Br)C(=O)NCCC(=O)Nc1ccc(C(=O)OCC)cc1 8733077 MYHDLRTYZAQORX-AWEZNQCLSA-N 399.285 2.872 50 40 GFGB Cc1ccccc1C(=O)NNC(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1 12765067 JJQYGMOATGKASU-UHFFFAOYSA-N 398.440 2.637 50 40 GFGB O[C@]12[C@@H]3[C@@H]4[C@H]([C@H]5C[C@H]4[C@H]([C@@H]51)C3(Br)Br)[C@H]2Br 100938853 WZBOKYFPZUQGLI-HTFGPFAMSA-N 398.920 2.739 50 40 GFGB Cc1ccc(-c2noc(C(=O)N/N=C/c3ccn(CC(F)(F)F)n3)n2)cc1 252508408 XMYAUXWXFAVJSR-DNTJNYDQSA-N 378.314 2.568 50 40 GFGB COc1ccc(C(=O)N/N=C/c2cc(Cl)c(OCC(=O)O)c(OC)c2)cc1 409264072 KNOTXCZEQMEMIA-AWQFTUOYSA-N 392.795 2.585 50 40 GFGB Cc1cccc(C(=O)NNC(=O)[C@H](C)Nc2nc3ccccc3s2)c1[N+](=O)[O-] 14075651 MUPUKYPKUACNEZ-NSHDSACASA-N 399.432 2.775 50 40 GFGB C/C(=N\NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O)c1ccc(F)cc1 20209717 CDZWBLPARYNIEQ-UDWIEESQSA-N 397.859 2.786 50 40 GFGB CCCn1c(C)cc(/C=C(/C#N)C(=O)NCCNC(=O)Cc2ccccc2)c1C 62587253 WUIZWCQVDSZBNC-QNGOZBTKSA-N 392.503 2.897 50 40 GFGB O[C@]12[C@@H]3[C@H]4[C@H]5C[C@@H]([C@H]4[C@H]1Br)[C@@H]2[C@H]5C3(Br)Br 195528765 WZBOKYFPZUQGLI-JJKDMYDHSA-N 398.920 2.739 50 40 GFGB O=C1[C@@H]2C[C@H](Br)[C@H](Br)C[C@H]2C(=O)N1c1nccs1 408672937 PKGSWLQSPQMASE-XUTVFYLZSA-N 394.088 2.570 50 40 GFGB C/C(CCc1ccccc1)=N\NC(=O)[C@H](C)N(c1ccccc1)S(C)(=O)=O 408921534 INFCQNYSWXDKCM-QFGIDJEJSA-N 387.505 2.966 50 40 GFGB CCOC(=O)COc1ccc2ccccc2c1/C=N\NC(=O)c1ccncc1 408924877 RPWBOLZWURJEKG-QRVIBDJDSA-N 377.400 2.941 50 40 GFGB CCc1ccc(N2C[C@@H](C(=O)N/N=C\c3cc(OC)ccc3OC)CC2=O)cc1 409159112 UXJIBGRFIYHPKK-ICODJCHTSA-N 395.459 2.769 50 40 GFGB Cc1c(C(=O)NC(=S)NNC(=O)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] 6825175 VENZJJIICIIPQD-UHFFFAOYSA-N 392.824 2.506 50 40 GFGB N#C/C(=C\c1ccccc1OCC(=O)O)c1nc(N)nc(Nc2ccccc2)n1 11296481 LYHMNTOKUDTULR-GXDHUFHOSA-N 388.387 2.725 50 40 GFGB O=C(COc1ccc(F)cc1)NNC(=O)COc1cc(Cl)ccc1Cl 12992962 PDMAVUSZLPGALZ-UHFFFAOYSA-N 387.194 2.738 50 40 GFGB C=C(C)C(=O)OCCOC(=O)C1=C(N)OC(C)=C(C#N)[C@H]1c1ccccc1F 5791549 CDBSCMDLFVGZME-MRXNPFEDSA-N 386.379 2.570 50 40 GFGB COc1ccc(C[C@H](N)C(=O)OC(C)C)cc1N(CCCl)CCCl 5835302 UJNIZMPXDXHTKJ-AWEZNQCLSA-N 377.312 2.801 50 40 GFGB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\NNC(=O)c1ccc([N+](=O)[O-])cc1 101357777 MFYZEXLJPKPEMJ-WQRHYEAKSA-N 393.403 2.753 50 40 GFGB Cc1ccc(NC(=O)CCC(=O)N/N=C/c2coc3ccccc3c2=O)cc1 1881795 YUWHFRCTVADPSY-WSDLNYQXSA-N 377.400 2.970 50 40 GFGB CCOC(=O)N1CC=C2[C@@H](C1)[C@H](c1cccc(F)c1)C(C#N)=C(N)C2(C#N)C#N 664263 VAIFQJDSWFLXHA-SJLPKXTDSA-N 391.406 2.708 50 40 GFGB C[C@@H](Nc1nc2ccccc2s1)C(=O)NNC(=O)c1cc(F)cc(F)c1 8984345 IERHMTXSEHPXLZ-SECBINFHSA-N 376.388 2.836 50 40 GFGB CC(C)c1ccc(N2/C(=N\C(=O)CCl)S[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 101302554 MRSOXHPOSUCGAW-GGNAOWBESA-N 386.926 2.650 50 40 GFGB CCc1ccc(-c2nc(C(=O)NNC(=O)N3C[C@@H](C)O[C@H](C)C3)cs2)cc1 9578181 MFCBSHRKJPGWLN-CHWSQXEVSA-N 388.493 2.836 50 40 GFGB Cc1cc(NC(=O)NNc2cc(Cl)nc(N)n2)ccc1OC1CCOCC1 97164714 HDBAFWPVISZEQS-UHFFFAOYSA-N 392.847 2.727 50 40 GFGB Cc1cccc(C)c1N1C[C@@H](C(=O)NNC(=O)c2ccc(Cl)cc2)CC1=O 408649262 ZVUNMZJMGKKDMA-HNNXBMFYSA-N 385.851 2.771 50 40 GFGB Cc1ccc(/C=N/NC(=O)CN(c2ccccc2F)S(C)(=O)=O)c(C)c1C 8371274 LFMDGEGOGDEHRE-SRZZPIQSSA-N 391.468 2.667 50 40 GFGB COc1cc(C(=O)NNC(=O)c2[nH]c(C)c(C(C)=O)c2C)ccc1OC(C)C 14229563 QEQJDNHQUFDWRG-UHFFFAOYSA-N 387.436 2.705 50 40 GFGB Cc1ccsc1/C=N\NC(=O)CN1CCN(Cc2ccccc2Cl)CC1 19849423 OGZWEFAXHSSRNG-MTJSOVHGSA-N 390.940 2.978 50 40 GFGB O=C(CN1CCN(Cc2ccccc2Cl)CC1)N/N=C\c1cccs1 19849486 NBLWXTWMIFLPCA-NDENLUEZSA-N 376.913 2.669 50 40 GFGB Cc1ccccc1C(=O)N/N=C1/SCC(=O)N1Cc1ccc2c(c1)OCO2 33323925 ZXGKSXHDTBPGIW-XUTLUUPISA-N 383.429 2.500 50 40 GFGB O=C1[C@H]2C[C@H](Br)[C@@H](Br)C[C@H]2C(=O)N1c1nccs1 408672938 PKGSWLQSPQMASE-YWIQKCBGSA-N 394.088 2.570 50 40 GFGB Cc1cc(C)cc(N(CC(=O)N/N=C/c2cccc(Cl)c2)S(C)(=O)=O)c1 408781369 CPAFOLSAOYYKSA-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB C=CCN1C(=O)/C(=N/NC(=O)c2ccc(C)nc2)c2cc(Br)ccc21 6199600 QDAYKWHDHVEFFB-LTGZKZEYSA-N 399.248 2.819 50 40 GFGB O=C(NNC(=S)Nc1ccc2c(c1)OCCO2)c1ccc2ncccc2c1 1386601 QVZBVFMEVIQTQX-UHFFFAOYSA-N 380.429 2.637 50 40 GFGB COCCNC(=O)/C(C#N)=C\c1ccc(OC(=O)c2cccs2)c(OC)c1 6372308 PRPHVFXLAHOFHO-UVTDQMKNSA-N 386.429 2.645 50 40 GFGB C/C(=C\C(=O)c1ccc(Cl)cc1)NNC(=O)Cn1ccc(C(F)(F)F)n1 6550619 OPHHYEPGAKIBIG-CSKARUKUSA-N 386.761 2.963 50 40 GFGB O=C(NNC(=S)NCc1ccccc1)c1cc(Cl)c2c(c1)OCCCO2 14840793 LGWZAOCYTAQNHN-UHFFFAOYSA-N 391.880 2.810 50 40 GFGB Cc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(Cl)cc3)CC2=O)cc1C 408637890 ARAXXKQTTDXDQV-HNNXBMFYSA-N 385.851 2.771 50 40 GFGB CCNC(=O)COc1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)cc1OC 7158370 BCUDEAFCMUNDHR-KFSXAOBBSA-N 399.491 2.812 50 40 GFGB N#C/C(=C\c1ccc(SCC(=O)Nc2ccccc2)c([N+](=O)[O-])c1)C(N)=O 408991744 PDTNWRWQILFTJQ-MDWZMJQESA-N 382.401 2.718 50 40 GFGB N#CC(C(=O)COC(=O)/C=C/c1ccccc1[N+](=O)[O-])=C1Nc2ccccc2N1 6188253 VZRUAETWIRSHNM-MDZDMXLPSA-N 390.355 2.993 50 40 GFGB CC1CCN(CN2C(=O)/C(=N\NC(=O)c3ccccc3)c3ccccc32)CC1 22118027 DIPPWINNCXDMMT-ATJXCDBQSA-N 376.460 2.857 50 40 GFGB CCN(CC)S(=O)(=O)c1ccc(Cl)c(NNC(=O)c2cccnc2)c1 5234960 DKLOETNGDQDKGH-UHFFFAOYSA-N 382.873 2.522 50 40 GFGB Cc1n[nH]c2c1[C@@H](c1cccc(I)c1)C(C#N)=C(N)O2 704430 CNDATPKHSNFUQD-LBPRGKRZSA-N 378.173 2.541 50 40 GFGB COc1ccc(C(=O)N/N=C2\C(=O)N(CN3CCCCC3)c3ccccc32)cc1 1508835 MLLDGFWQDWTURE-ATJXCDBQSA-N 392.459 2.619 50 40 GFGB COc1ccccc1CNC(=O)C/C(C)=N/NC(=O)COc1cccc(C)c1 4480467 HFYOFCLQGMLVMT-XQNSMLJCSA-N 383.448 2.581 50 40 GFGB C#CCOc1ccc(/C=N/NC(=O)c2ccc(NC(C)=O)cc2)cc1OCC 6439547 RAECIVBOJLCRMI-HYARGMPZSA-N 379.416 2.820 50 40 GFGB O=C(/C=C/c1ccc(Cl)c(Cl)c1)NNC(=O)[C@H]1COc2ccccc2O1 12771587 UVMLNJAWIDSEIB-IQIBNGDESA-N 393.226 2.994 50 40 GFGB CC(C)(C)OC(=O)N1CCOC[C@]2(CC[C@@H](CI)O2)C1 95698564 GXDDETCOIZTESK-FZMZJTMJSA-N 397.253 2.607 50 40 GFGB in-vitro CCOc1ccc(S(=O)(=O)N(CC(=O)NN=C(C)C)c2ccccc2)cc1 408922581 CKBDIJVDPLBQJO-UHFFFAOYSA-N 389.477 2.793 50 40 GFGB C#CCOc1c(Cl)cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc1OCC 4616911 WCWAFWRVBNQPQM-HTRKUNOGSA-N 388.851 2.953 50 40 GFGB Cc1ccc(NCC(=O)N/N=C2\C(=O)N(CCCC#N)c3ccccc32)cc1 5696107 ZYJNPVCZFWIKGX-QQTULTPQSA-N 375.432 2.578 50 40 GFGB CCc1nc2ccccc2n1CC(=O)NNC(=O)CCc1c[nH]c2ccccc12 9885462 CDSFBXJAAXRTGD-UHFFFAOYSA-N 389.459 2.860 50 40 GFGB CC1=NN(c2ccccc2)C(=O)[C@@H]1/C(=N/NC(=O)c1cccnc1)C(F)(F)F 100922190 IDFLOCDOHWKNJH-ZOKHCUHISA-N 389.337 2.769 50 40 GFGB Cc1ccccc1N1C(=O)C[C@@H](NNC(=O)c2oc3ccccc3c2C)C1=O 102228997 ZXLZTHVGCLHUEO-OAHLLOKOSA-N 377.400 2.616 50 40 GFGB CC(C)=NNC(=O)CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(C)cc1 408787171 SWUNFOWIJUOURJ-UHFFFAOYSA-N 377.441 2.841 50 40 GFGB Cc1nc(Sc2ccc(/C=N/NC(=O)c3ccccc3N)cc2[N+](=O)[O-])n[nH]1 409192496 DIZQEDPKZHUCQZ-DJKKODMXSA-N 397.420 2.519 50 40 GFGB Cc1cccc(C(=O)Nc2nnc(CC(=O)N/N=C/c3ccccc3)s2)c1 726382 RJAJVWNOLUWJPY-UDWIEESQSA-N 379.445 2.792 50 40 GFGB O=C(COc1ccc(/C=N\NC(=O)c2ccco2)cc1)NCCc1ccccc1 35254612 RFQLBFPKNDHKTO-IWIPYMOSSA-N 391.427 2.781 50 40 GFGB CN1c2ccccc2C2=C([C@@H](c3ccc(F)cc3)C(C#N)=C(N)O2)S1(=O)=O 20558312 XECMCCSFJFNILJ-INIZCTEOSA-N 383.404 2.782 50 40 GFGB Cc1cccc(N(CC(=O)N/N=C/c2c(F)cccc2Cl)S(C)(=O)=O)c1 58924393 FDPYUDOOAFVUGG-KEBDBYFISA-N 397.859 2.704 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)COc2nc(C)cc(COC)c2C#N)cc1 59427724 AAYFWZGPPQURBJ-FSJBWODESA-N 394.431 2.502 50 40 GFGB COC(=O)c1c(NC(=S)NNC(=O)c2ccoc2C)sc2c1CCCC2 6825209 ORYKYOGOMSSVLJ-UHFFFAOYSA-N 393.490 2.946 50 40 GFGB Cc1ccc(C(=O)NNC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cc1 17447236 LFWSPYBXDOWFRN-UHFFFAOYSA-N 380.448 2.700 50 40 GFGB COCCCNC(=O)/C(C#N)=C/c1cc(Br)c(OC)cc1OC 408806206 AVMKUPARRUCDNW-KPKJPENVSA-N 383.242 2.526 50 40 GFGB COc1cccc(/C=N/NC(=O)CSc2nnc(-c3ccccc3)n2C)c1 2315119 VSJVXUJWCYFRSC-UDWIEESQSA-N 381.461 2.733 50 40 GFGB CCNc1sc2c3c(c(=O)[nH]c2c1C#N)[C@H](c1cccnc1)C(C#N)=C(N)O3 15085091 JQAGEXVQBDSAAD-GFCCVEGCSA-N 390.428 2.506 50 40 GFGB COc1cc(N2CCOCC2)ccc1/C=N/NC(=O)c1ccc(C)cc1OC 409236602 SFIDXKUFOLANAB-HYARGMPZSA-N 383.448 2.613 50 40 GFGB Cc1n[nH]c2c1[C@@H](c1cc3cc4c(cc3nc1Cl)OCCO4)C(C#N)=C(N)O2 891988 JAJTXRUTNWOWAZ-INIZCTEOSA-N 395.806 2.909 50 40 GFGB N#C/C(=C\c1cc([N+](=O)[O-])ccc1N1CCOCC1)C(=O)NCc1ccccc1 5572112 GSTVEOVIRXGWNW-LDADJPATSA-N 392.415 2.655 50 40 GFGB COC(=O)c1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N3CCOCC3)c2C)cc1 871902 SWHOLTDWINMDRR-CPNJWEJPSA-N 393.443 2.647 50 40 GFGB COc1ccccc1NCC(=O)NNC(=O)COc1cc(Cl)ccc1Cl 12543671 ILYVPZBPTVBSRN-UHFFFAOYSA-N 398.246 2.640 50 40 GFGB Cc1ccc(-c2cc(C(=O)NNC(=O)c3nccnc3N)c3ccccc3n2)cc1 14044674 AQDMCMOWECFUDA-UHFFFAOYSA-N 398.426 2.657 50 40 GFGB COc1cc(/C=N/NC(=O)CCc2ccccc2)cc(Cl)c1OCC(=O)O 408952955 LCDHUSHZMBCJLD-SRZZPIQSSA-N 390.823 2.895 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OC)c(OC)c1 408905644 BVLKRCUZKQPYJS-FEMWLQECSA-N 399.447 2.511 50 40 GFGB C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@H](C)Oc1ccccc1Cl 32795740 NQBUZZUVBHONCY-RYUDHWBXSA-N 380.803 2.861 50 40 GFGB CC(C)(C)c1ccc(OCC(=O)NC(=S)NNC(=O)c2cccs2)cc1 32119086 CWGZFYLVBQODNV-UHFFFAOYSA-N 391.518 2.760 50 40 GFGB Cc1ccccc1N(CC(=O)N/N=C/c1ccc(Cl)cc1)S(C)(=O)=O 19954675 BTQUMTBTYYNREU-YBFXNURJSA-N 379.869 2.565 50 40 GFGB COc1cc(C(=O)N/N=C/c2cccc(O)c2)ccc1I 5512545 KALLCBTVWQUKST-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB O=C(N/N=C\c1cccn1-c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2 5338176 CFRRLIDCVLPALO-BKUYFWCQSA-N 392.371 2.921 50 40 GFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3cc(O)ccc32)c(OC)c(OC)c1OC 85409576 BZROCIVXYIFJLS-MRXNPFEDSA-N 384.388 2.645 50 40 GFGB COc1cc2c(cc1/C=N\NC(=O)COc1cccc3cccnc13)OCO2 409094722 FTOWUQXBKLNKOR-YVNNLAQVSA-N 379.372 2.501 50 40 GFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1cccc(Br)c1 3149943 QEILQQJVJKQGMY-RQZCQDPDSA-N 378.182 2.886 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)CCC(=O)Nc2ccc(C)cc2C)cc1 1895044 LRYAMQGEFAPGET-UHFFFAOYSA-N 383.448 2.557 50 40 GFGB O=C(COc1ccccc1)N/N=C\c1cc2c(cc1Br)OCO2 34835174 WSPFEPDLMJMAKM-LSCVHKIXSA-N 377.194 2.707 50 40 GFGB Cc1cccc(C(=O)NN[C@H]2CC(=O)N(c3cc(Cl)cc(Cl)c3)C2=O)c1 100128037 LGRDEYLOXFWVJU-HNNXBMFYSA-N 392.242 2.868 50 40 GFGB Cc1nnc(Sc2ccc(/C=N/NC(=O)c3ccccc3)cc2[N+](=O)[O-])[nH]1 6588356 FEQSERAUIPWMGP-VCHYOVAHSA-N 382.405 2.936 50 40 GFGB Cc1ccccc1C(=O)N1CCC(C(=O)N/N=C/c2ccccc2C(=O)O)CC1 1095064 KGXLTVDYWAHSBW-OEAKJJBVSA-N 393.443 2.696 50 40 GFGB Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1ccc2c(c1)OCO2 6790281 PFGAGNJMUIQZLF-LBPRGKRZSA-N 390.823 2.914 50 40 GFGB N#C/C(=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)C(=O)Nc1ccc(O)cc1 409369665 DQDBGSMOZDDLGI-PTNGSMBKSA-N 394.387 2.683 50 40 GFGB O=C(NNS(=O)(=O)c1cc(Cl)ccc1Cl)c1ccc([N+](=O)[O-])cc1 5569513 JNRUQMORUAZCFU-UHFFFAOYSA-N 390.204 2.525 50 40 GFGB O=C(CCc1ccccc1)NNC(=O)c1ccc(I)cc1 829421 WTALQIXYKKIBCP-UHFFFAOYSA-N 394.212 2.685 50 40 GFGB COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(-n3nc(C)cc3C)cc2)c1 2629688 DDYGWVMXKWFFCX-UHFFFAOYSA-N 394.431 2.581 50 40 GFGB CC(=O)N1CCC(CCC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 72302680 CLYBYWDPXCTORG-UHFFFAOYSA-N 389.540 2.779 50 40 GFGB COc1cc(/C=N/NC(=O)CSc2nc3ccccc3[nH]2)cc(OC)c1O 5236132 HZDRDJVYBFTLKQ-DJKKODMXSA-N 386.433 2.528 50 40 GFGB CCOC(=O)Cn1cc(/C=N/NC(=O)Cc2ccc(OC)cc2)c2ccccc21 6318975 JWCSABZGVVBKLV-YDZHTSKRSA-N 393.443 2.906 50 40 GFGB C=CCNc1nc2[nH]c(=O)c3c(c2s1)OC(N)=C(C#N)[C@@H]3c1cccs1 15085071 MQDIOKXNSSLQGZ-SNVBAGLBSA-N 383.458 2.862 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccc2Br)c(O)c([N+](=O)[O-])c1 26123320 KGVZFXSKGYAMBK-CAOOACKPSA-N 394.181 2.835 50 40 GFGB Nc1nc2ncnc(N)c2nc1-c1ccc(N(CCCl)CCCl)cc1 1704186 CTAAFVYASIPODD-UHFFFAOYSA-N 378.267 2.535 50 40 GFGB NC(=O)[C@H]1C(=O)c2cccc3c2[C@]1(Br)[C@H](Br)CCC3 4991207 RGHFSKXWVJLVKI-GLXFQSAKSA-N 387.071 2.674 50 40 GFGB N#CC1=C(SCC(=O)NCc2ccco2)NC(=O)C[C@H]1c1ccc(F)cc1 6495516 VJEQCIJXPTVTCF-HNNXBMFYSA-N 385.420 2.807 50 40 GFGB C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)/C(C#N)=C\c1ccc2c(c1)OCO2 6382775 RZYVNDKCQYFMLH-KDVQLTRESA-N 390.395 2.843 50 40 GFGB COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1 408880404 HQPSHDZLICQABV-NTEUORMPSA-N 381.344 2.936 50 40 GFGB COc1cccc(NC(=O)CSC2=C(C#N)[C@@H](c3ccco3)CC(=O)N2)c1 409131162 MELUAIZUTGCZEI-AWEZNQCLSA-N 383.429 2.999 50 40 GFGB CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(CN3CCOCC3)cc2)o1 408995336 MKPASLLLWGCJJA-PXLXIMEGSA-N 384.480 2.722 50 40 GFGB N#Cc1ccccc1OCC(=O)NNC(=O)CSCc1ccc(Cl)cc1 15978059 CTGDDGQFUMLOBC-UHFFFAOYSA-N 389.864 2.671 50 40 GFGB Cc1cc(C(=O)NNC(=O)Cc2cccnc2)cc(C)c1OCc1cccnc1 103424062 AHEPGKUFUVFXBQ-UHFFFAOYSA-N 390.443 2.676 50 40 GFGB CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cc(OC)ccc3F)[C@@H]2C1 16037985 VLMDZHBTHOFQAH-UYAOXDASSA-N 391.450 2.970 50 40 GFGB COc1ccc([C@H](C)c2cc3c(cc2OC/C(C)=N\NC(N)=O)OCO3)cc1 17175873 JDFMUFLXSNRXNM-QGNWGPJTSA-N 385.420 2.999 50 40 GFGB Cc1ccc(Cn2cc(C(=O)NNC(=O)Nc3ccccc3)ccc2=O)cc1 23136169 BWNYUCJOFDYKDC-UHFFFAOYSA-N 376.416 2.672 50 40 GFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)cc(OC)c1O 3014080 QBNQKFKLKRVKAE-MRXNPFEDSA-N 392.367 2.734 50 40 GFGB O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(-n2ccnc2)nc1 12535884 DHQZEPFJXZQTNT-UHFFFAOYSA-N 392.297 2.951 50 40 GFGB O=C(NNC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(-n2cc[nH]c2=S)cc1 40119740 IIKLCSZQQWLXJA-UHFFFAOYSA-N 383.389 2.518 50 40 GFGB CN(C)c1ccc(/C=N/NC(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)cc1 1099948 VUJHQVPBPLLOTL-BUVRLJJBSA-N 396.466 2.894 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2ccc(Cl)cc2)S(C)(=O)=O)cc1 19954448 FIHRVFVLTWZRTP-YBFXNURJSA-N 379.869 2.565 50 40 GFGB CCOc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1 2098222 JGEIRTHMECCTLZ-DEDYPNTBSA-N 384.392 2.863 50 40 GFGB Cn1ccnc1Sc1ccc(/C=N/NC(=O)c2cccnc2)cc1[N+](=O)[O-] 12546560 GOULVFWCMNOKLW-KEBDBYFISA-N 382.405 2.638 50 40 GFGB COC(=O)N/N=C/c1ccc(OS(=O)(=O)c2ccc(Cl)cc2)c(OC)c1 17086132 CKTXKRQJSRQNKS-VCHYOVAHSA-N 398.824 2.806 50 40 GFGB CCNC(=O)C(=O)N/N=C/c1cccc(OC)c1OCc1ccccc1Cl 408611248 QKZIWTCLTPEZEW-SSDVNMTOSA-N 389.839 2.514 50 40 GFGB CC(=O)NNc1nc2sc3c(c2c(=O)n1-c1ccccc1)CC(C)(C)OC3 998204 NZNNYEWQJXNMEB-UHFFFAOYSA-N 384.461 2.762 50 40 GFGB O=C(CNc1ccc(Br)cc1)N/N=C/c1ccc2c(c1)OCO2 1501009 FJRCIEWPSNBCMT-UFWORHAWSA-N 376.210 2.740 50 40 GFGB O=C(N/N=C/c1ccc(OC(=O)c2cccnc2)cc1)c1cccc([N+](=O)[O-])c1 3203661 UKVIDVPJTUNFDY-WSDLNYQXSA-N 390.355 2.973 50 40 GFGB C[C@H]1CCC[C@H](C)N1C(=O)Cn1c(NNC(=O)n2ccnc2)nc2ccccc21 4912739 CQYBRQAKGRHJAD-GJZGRUSLSA-N 395.467 2.607 50 40 GFGB COc1ccc2c(c1)[C@]1(C(=O)N2)C(C#N)=C(N)Oc2c1c(C)nn2-c1ccccc1 5245676 UQGQCKPMYKBKCC-QFIPXVFZSA-N 399.410 2.514 50 40 GFGB CCCn1nc(C(=O)NNC(=O)/C=C/c2ccccc2C)c2ccccc2c1=O 6929839 CJWVQKMQCJHEKR-OUKQBFOZSA-N 390.443 2.589 50 40 GFGB Cc1ccc(-n2nc(C(=O)N/N=C\c3ccc(F)cc3)c(C)c(C#N)c2=O)cc1 409062672 YUCOKGINDICOSP-MSXFZWOLSA-N 389.390 2.624 50 40 GFGB O=C(CNc1ccc(F)cc1)N/N=C/c1cc2c(cc1Br)OCO2 409361873 ROHAEWZXYLVHIU-IFRROFPPSA-N 394.200 2.879 50 40 GFGB O=C(CNc1ccc(F)cc1)N/N=C/c1ccc(I)cc1 409363953 VVGHWZDHGHNMGI-DJKKODMXSA-N 397.191 2.993 50 40 GFGB CCn1c(C)nc2cc(C(=O)NNS(=O)(=O)c3ccc(C)c(C)c3)ccc21 3581233 UXMJMNCLFIIKFT-UHFFFAOYSA-N 386.477 2.605 50 40 GFGB CC1(C)[C@]2(C)CC[C@@]1(C(=O)NCCN1CCCCC1)[C@H](Br)C2=O 4185864 PLSNWPRDSCYRJM-XWIAVFTESA-N 385.346 2.747 50 40 GFGB CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C\NNC(=O)c1ccc([N+](=O)[O-])cc1 95471562 SRGBAFHWCMIFTO-YBEGLDIGSA-N 399.794 2.789 50 40 GFGB CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@@]12C(=O)Nc1ccccc12 2489684 FISINVDFAFZXNV-JOCHJYFZSA-N 387.395 2.575 50 40 GFGB COC(=O)c1cc(C(=O)NNc2c(F)c(F)cc(F)c2F)cc([N+](=O)[O-])c1 6145343 QNAULPZPQYLFDQ-UHFFFAOYSA-N 387.245 2.695 50 40 GFGB O=C(N/N=C/c1cc2cc3c(cc2[nH]c1=O)OCCO3)[C@H]1C[C@@H]1c1ccccc1 8769196 BLSQYRCXVHCDSQ-UVWPKEFOSA-N 389.411 2.553 50 40 GFGB Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2cncn2-c2ccc(F)cc2)c1C 12752455 YRGKJXMPASXWTE-OAHLLOKOSA-N 396.422 2.857 50 40 GFGB COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)cc1OC 18222759 VXNHGVFHOFYSQD-KRWDZBQOSA-N 375.384 2.763 50 40 GFGB O=C(NNC(=O)c1cccnc1OCC(F)(F)F)c1ccc2ccccc2n1 24642909 CFEOOMZHJBTRTJ-UHFFFAOYSA-N 390.321 2.646 50 40 GFGB O=C(NNC(=O)c1cncn1-c1ccc(F)cc1)c1cc2cc(F)ccc2[nH]1 32759894 SMPYTPLUGAIHAH-UHFFFAOYSA-N 381.342 2.707 50 40 GFGB CCOC(=O)[C@@]1(C)C/C(=N\NC(=O)c2ccccc2)C(=O)N1c1ccccc1 100207704 KMXFPBOEFUXVNU-KXZIGNATSA-N 379.416 2.531 50 40 GFGB COc1ccc(C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2Br)c(O)c1 409393447 XJGWEAIBXRTJJX-CAOOACKPSA-N 394.181 2.835 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)NCCCOC)cc(Br)c1O 6613308 QEDKBXIEZAAFTP-KPKJPENVSA-N 383.242 2.613 50 40 GFGB CCOC(=O)COc1ccc(/C=N/NC(=O)c2ccc(F)cc2)cc1OCC 8812393 LTADUHVQLWCLFA-WSDLNYQXSA-N 388.395 2.930 50 40 GFGB Cc1cc2c(c(=O)n1CCN(C)C)[C@@H](c1cccc(Cl)c1)C(C#N)=C(N)O2 2247065 XWXMYWUXQGBTIJ-KRWDZBQOSA-N 384.867 2.590 50 40 GFGB O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)N/N=C/c1ccccc1F 19682671 DXVYYZQEJUDRFS-YDZHTSKRSA-N 388.874 2.747 50 40 GFGB COc1ccccc1NC(=O)C1=C(C)N=C2C(C#N)=CNN2[C@H]1c1cccnc1 9423090 OAZMCVWCXOZGSZ-IBGZPJMESA-N 386.415 2.684 50 40 GFGB O=C(N/N=C/c1ccccc1C(F)(F)F)C(=O)Nc1ccc2c(c1)OCCO2 408972421 BOXAZLVWOIOTEX-LSHDLFTRSA-N 393.321 2.565 50 40 GFGB C[C@H]1Cc2cc(C(=O)Oc3ccc([N+](=O)[O-])cc3)ccc2N1S(C)(=O)=O 97971388 HPZMGPSNDUCIIA-NSHDSACASA-N 376.390 2.525 50 40 GFGB CCOC(=O)C1=C(CCl)OC(N)=C(C#N)[C@@H]1c1cccc(OC)c1OC 1302291 BGZBNYUBMHCSAR-AWEZNQCLSA-N 378.812 2.567 50 40 GFGB Cc1cc(=O)oc2cc(OCC(=O)N/N=C/c3ccc(N(C)C)cc3)ccc12 2268721 NJJRBIYDQQQSLW-WSDLNYQXSA-N 379.416 2.697 50 40 GFGB CCn1c(NNC(=O)CCn2ccc3ccccc32)nc2ccccc2c1=O 10323688 JXNIJXVNVZRRLV-UHFFFAOYSA-N 375.432 2.905 50 40 GFGB O=C1Nc2ccc(Cl)cc2/C1=N\NC(=O)c1cc(Br)ccc1O 15922192 WAOSPHRCFBQHLA-UHFFFAOYSA-N 394.612 2.894 50 40 GFGB CCOc1cc(/C=N/NC(=O)COc2ccc(C)c(C)c2)cc([N+](=O)[O-])c1O 36245428 WCELXQKAKQQUPK-KEBDBYFISA-N 387.392 2.845 50 40 GFGB CCOC(=O)COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc1OC 408797668 SYDQPWIONBVSFZ-XNTDXEJSSA-N 396.399 2.888 50 40 GFGB C/C(Cc1ccccc1)=N\NC(=O)CNC(=O)c1ccc(Br)cc1 4824275 NQIWEFWEJAQVMA-FYJGNVAPSA-N 388.265 2.914 50 40 GFGB Cc1ccc([C@@H]2CC(=O)NC(SCC(=O)NCc3ccco3)=C2C#N)cc1 6477607 ICRWQKGJJSTYIZ-INIZCTEOSA-N 381.457 2.976 50 40 GFGB C/C(=N\NC(=O)CSCC(=O)N/N=C(\C)c1ccccc1)c1ccccc1 16982888 PEFXBZPWWBKCKP-YHARCJFQSA-N 382.489 2.800 50 40 GFGB O=C(NNC(=O)c1nc(-c2ccccc2)n2c1CCCCC2)c1ccccn1 32633797 CZRCJZRFRWXNDF-UHFFFAOYSA-N 375.432 2.746 50 40 GFGB Cc1cc(/C=N/NC(=O)c2ccc(I)c(O)c2)c(C)n1C 408770960 CSMFPTOSPPROEX-CAOOACKPSA-N 397.216 2.716 50 40 GFGB CC1(CC(=O)N/N=C/c2ccc(-c3ccc(F)cc3[N+](=O)[O-])o2)OCCO1 409042984 OWLCVMBFESJACJ-VXLYETTFSA-N 377.328 2.597 50 40 GFGB CC(C)(C)N1C(=O)NC(=O)/C(=C/c2ccc3c(c2)CCN3CCCCl)C1=O 5669209 GKDYSUKVEUYVEI-QINSGFPZSA-N 389.883 2.938 50 40 GFGB CS(=O)(=O)[C@H](I)[C@@H](O)c1ccc(Cl)cc1Cl 96519206 LDWMBHUCMDRACG-IUCAKERBSA-N 395.045 2.833 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C\c2cn(CC(=O)O)c3ccccc23)cc1 203604735 OZICINQAQNKOOF-YBEGLDIGSA-N 389.411 2.958 50 40 GFGB CS(=O)(=O)N(C[C@H](O)C[C@H]1C=C(C=O)c2ccccc21)c1ccc(F)cc1 257173492 OWRMCIUZBKJUAB-RDTXWAMCSA-N 389.448 2.722 50 40 GFGB COc1cc(/C=N\NC(=O)Nc2ccc(F)cc2)ccc1O[C@@H](C)C(=O)O 409017678 VOVKABJVTPSECR-ASKIBSTCSA-N 375.356 2.842 50 40 GFGB Cc1cccc(OCC(=O)NNC(=O)Cc2csc(-c3ccccc3)n2)c1 6647806 WITRKOCXBXNIMI-UHFFFAOYSA-N 381.457 2.887 50 40 GFGB CCN(CC)S(=O)(=O)c1ccc(NNC(=O)Nc2cccc(Cl)c2)nc1 14095674 NQWRIIFLLRJFPR-UHFFFAOYSA-N 397.888 2.914 50 40 GFGB Cc1cccc(/C=N/NC(=O)CN(C)S(=O)(=O)c2c(C)cc(C)cc2C)c1 16348930 DQLNNGXMDPYQCL-CIAFOILYSA-N 387.505 2.691 50 40 GFGB COc1cc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc(Cl)c1OC 33772727 LBMBDHNNDSMZBB-GRSHGNNSSA-N 377.784 2.958 50 40 GFGB COCCCNC(=O)C(=O)N/N=C\c1ccc(-c2ccc(Cl)c(Cl)c2)o1 58914367 ZCHWVOZBLDWUOB-FBHDLOMBSA-N 398.246 2.856 50 40 GFGB COc1ccc(/C=N/NC(=O)[C@@H](C)Sc2nc(C)cc(C)n2)cc1[N+](=O)[O-] 59503041 HFWRTHAFBJUIQX-KBSHCFNASA-N 389.437 2.641 50 40 GFGB Cc1cc(C(=O)NNC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)c(C)o1 65479129 IDZMTMFFBGRWGY-UHFFFAOYSA-N 379.457 2.695 50 40 GFGB COC(=O)C1=C(N)SS/C1=C(/N=N\c1ccc([N+](=O)[O-])cc1)[N+](=O)[O-] 104231912 GSHWXXRIRNDXEU-BXPCSNPTSA-N 383.367 2.863 50 40 GFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(Br)s1 136880913 AWYBSERXJZYNDY-CHHVJCJISA-N 384.211 2.948 50 40 GFGB COc1ccc(/C=C(\C#N)C(=O)NCc2ccc(OC)cc2OC)c(OC)c1 408884706 YYUVKKYWYKKMDE-CXUHLZMHSA-N 382.416 2.944 50 40 GFGB COc1ccc(OC)c(/C=N\NC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3)C2)c1 409166382 DNPMSDYCOXJJQI-YSUUHWHMSA-N 381.432 2.515 50 40 GFGB N#Cc1ccccc1OCC(=O)N/N=C/c1ccc(OC(=O)c2ccco2)cc1 3085547 ALBRJBDQSKVSLB-YDZHTSKRSA-N 389.367 2.900 50 40 GFGB Cc1cc2c(c(=O)n1C[C@@H]1CCCO1)[C@H](c1ccc(F)cc1)C(C#N)=C(N)O2 4247921 GBURLUKJKGSRCD-MAUKXSAKSA-N 381.407 2.693 50 40 GFGB CC[C@H](C)NC(=O)C/C(C)=N/NC(=O)COc1ccc(C)cc1Br 4381048 QYYVRADCSLJJOF-JBBFIGJUSA-N 398.301 2.933 50 40 GFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccc(Cl)cc1 15632232 LBWYDOJMDRGBFL-LBPRGKRZSA-N 392.242 2.808 50 40 GFGB CCSc1ncc(Br)c(C(=O)NNC(=O)c2ccc(C)cc2)n1 27991271 XYQWFPYEJZXVCE-UHFFFAOYSA-N 395.282 2.734 50 40 GFGB C#CCOc1ccc(Br)cc1/C=N/NC(=O)CNC1CCCCC1 409379069 VBCFGCNDEVMJCO-CIAFOILYSA-N 392.297 2.834 50 40 GFGB Cn1/c(=N\NC(=O)CCNC(=O)c2ccccc2Cl)sc2ccccc21 104923876 KOPNEFSMJQUKGZ-RELWKKBWSA-N 388.880 2.645 50 40 GFGB CCCOc1ccc(C(=O)NNC(=O)[C@H](C(C)C)N2CCCCC2)cc1OC 48289571 XVIKGIRYTAIGLP-IBGZPJMESA-N 391.512 2.756 50 40 GFGB CCCCCC(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2OC)s1 408732712 XTCITXVLVOSJNQ-XDHOZWIPSA-N 389.481 2.758 50 40 GFGB O=C(NCc1ccco1)C(=O)N/N=C/c1cccc(OCc2ccccc2)c1 8219948 DBDVTFQLSBJWIK-YDZHTSKRSA-N 377.400 2.625 50 40 GFGB COc1cccc(/C=N/NC(=O)[C@@H](O)c2ccc(Br)cc2)c1OC 3167410 IVERBLJCASRXLK-RPJLVFAOSA-N 393.237 2.650 50 40 GFGB COc1ccc(CCNC(=O)C(=O)N/N=C/c2ccc(C(C)C)cc2)cc1OC 4499484 DOMOVKWHXNNLSW-ZVHZXABRSA-N 397.475 2.636 50 40 GFGB Cc1cccc(C)c1OCC(=O)NNC(=O)Cc1c(C)nn(CC(C)C)c1C 7960736 XZPLIBIEZIVGMC-UHFFFAOYSA-N 386.496 2.542 50 40 GFGB Cc1ccc(-c2nc(CC(=O)NNC(=O)c3n[nH]c4c3CCCC4)cs2)cc1 13294498 XAZXPBJSNBRWTE-UHFFFAOYSA-N 395.488 2.724 50 40 GFGB CN1C(=O)N(CC(=O)NNc2ccccc2C(F)(F)F)C(=O)C12CCCCC2 57289614 GKRQJRFDHYMQSX-UHFFFAOYSA-N 398.385 2.745 50 40 GFGB O=C(COc1ccccc1)N/N=C/c1ccc(I)cc1 59502290 PCSCXCJJAXCETL-LICLKQGHSA-N 380.185 2.820 50 40 GFGB C[C@H]1CCc2c(C(=O)NNC(=O)[C@@H]3[C@@H]4C=C[C@@H](CC4)[C@@H]3C(=O)O)csc2C1 225659204 IUKBUXKYOYNLOF-ABXZDOEHSA-N 388.489 2.547 50 40 GFGB COc1cccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)c1O 409153382 HWDGMJGQDQTWHF-RSFOSLOZSA-N 381.432 2.521 50 40 GFGB N#CC1=C(N)OC2=C(C(=O)CCC2)[C@@H]1c1cc2c(cc1Br)OCO2 873838 CPLNBMUYDFUCTH-OAHLLOKOSA-N 389.205 2.993 50 40 GFGB COc1cc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc(OC)c1OC 875008 PHOJSBQQUSIPJO-KEBDBYFISA-N 378.812 2.895 50 40 GFGB COc1ccc(CCNC(=O)[C@H]2CCCO[C@@H]2C(Cl)Cl)cc1OC 1578199 OCMXCMKHBVNKJT-WFASDCNBSA-N 376.280 2.961 50 40 GFGB O=C(N/N=C/c1ccc(OC(=O)c2ccc([N+](=O)[O-])cc2)cc1)c1ccncc1 3024176 MUXAIAZVFNTXHY-LPYMAVHISA-N 390.355 2.973 50 40 GFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)COc2cccc(C)c2)cc1 4697776 IZQQALWSINEACZ-XQNSMLJCSA-N 383.448 2.581 50 40 GFGB O=C(Cc1ccccc1)N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O 4702545 ILAAETBIZUGOIY-RQZCQDPDSA-N 378.182 2.756 50 40 GFGB CCCC1=NN(c2ccc(F)cc2)C(=O)/C1=C(/C)NNC(=O)c1cccnc1 103918441 LORREHRSQJBZPZ-AQTBWJFISA-N 381.411 2.932 50 40 GFGB CNC(=O)C(=O)N/N=C/c1cc(Br)ccc1Nc1ccccc1C 408708026 NJVAPYQAXBMLDZ-KEBDBYFISA-N 389.253 2.697 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccncc2)ccc1OCc1ccc(C(=O)O)o1 6627939 NWNXVXCIMOENNJ-SSDVNMTOSA-N 395.371 2.724 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])s1)C(=O)Nc1cccc(C(F)(F)F)c1 2100087 MLVOVXOTFAAGBH-CNHKJKLMSA-N 386.311 2.764 50 40 GFGB O=C(CCNC(=O)c1ccc(Cl)cc1)NNC(=O)c1ccc(Cl)cc1 8513664 NFIJDQCCZACNOK-UHFFFAOYSA-N 380.231 2.575 50 40 GFGB O=C(N/N=C/c1ccc(I)o1)c1ccccc1[N+](=O)[O-] 408599687 YNOBNDYIBBMTBG-VGOFMYFVSA-N 385.117 2.556 50 40 GFGB O=C(NNC(=O)c1ccco1)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 409224962 MVISJJNVZKBVCR-UHFFFAOYSA-N 394.343 2.515 50 40 GFGB Cc1ccc(/C=N\NC(=O)Cn2cnc3sc4c(c3c2=O)CCCC4)cc1 31783436 IKTDQJKZNFGBIJ-YVNNLAQVSA-N 380.473 2.796 50 40 GFGB CC1(CC(=O)N/N=C/c2ccc(OCc3ccc([N+](=O)[O-])cc3)cc2)OCCO1 4502709 RSYHLCZFGCTBFM-FYJGNVAPSA-N 399.403 2.777 50 40 GFGB C#CCn1c(C)c(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)c2ccccc21 6959710 LFEBLJCEFWUBBI-WYMPLXKRSA-N 388.427 2.874 50 40 GFGB CCNc1ccc(C(=O)N/N=C/c2ccc(-n3ccnc3)cc2)cc1[N+](=O)[O-] 19631046 XUGVANHAQAIZBH-WSDLNYQXSA-N 378.392 2.976 50 40 GFGB COC(=O)c1ccc(C(=O)OC)c(N/C=C(\C#N)C(=O)Nc2ccccc2)c1 57413989 GLAJNPPWSBSZCZ-WYMLVPIESA-N 379.372 2.718 50 40 GFGB CN(CC(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1)[C@H]1CCSC1 95448447 BIPHIVRZVSIQFD-AWEZNQCLSA-N 393.509 2.753 50 40 GFGB O=C(N/N=C1/C2CN3CCN(C2)CC1(c1ccccc1)C3)c1ccccc1Cl 103896846 YESUZPZCNQSHQT-GFMRDNFCSA-N 394.906 2.625 50 40 GFGB O=C(NNc1nc(=Nc2ccccc2)nc(N2CCCC2)[nH]1)Nc1ccccc1 408724302 AFICOAZWAUXOGU-UHFFFAOYSA-N 390.451 2.786 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1c[nH]c2ccccc12 408914833 XYNFKGPWLLVFCB-WQZUMXOESA-N 378.432 2.975 50 40 GFGB COc1ccc(N([C@@H](C)C(=O)NN=C2CCCCCC2)S(C)(=O)=O)cc1 20214752 AOPRGHPXHWEYAF-AWEZNQCLSA-N 381.498 2.676 50 40 GFGB COc1ccc(OC)c([C@@H]2NC(=O)NC(C)=C2C(=O)OCCCCCl)c1 4064533 PZUFAZSMHNKLJJ-INIZCTEOSA-N 382.844 2.894 50 40 GFGB COC(=O)c1cccc(NC(=O)CCNC(=O)[C@H](Br)C(C)(C)C)c1 8733069 KKOAIBVBWCIVLH-AWEZNQCLSA-N 399.285 2.728 50 40 GFGB CCCCC(=O)NN/C=C1\C(=O)N(c2cccc(C(F)(F)F)c2)C(=O)N=C1O 2307111 OQWJVPOFZHWBMP-XFXZXTDPSA-N 398.341 2.823 50 40 GFGB N#C/C(=C/c1ccccc1)C(=O)NNC(=O)COc1cccc(C(F)(F)F)c1 3311084 FOFNPOUJGNZPLW-ZROIWOOFSA-N 389.333 2.839 50 40 GFGB CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc4c(c3)OCO4)[C@H]2C1 4631547 KUMGFLSDFACHKS-FXAWDEMLSA-N 387.443 2.551 50 40 GFGB CCc1ccccc1N(CC(=O)N/N=C/c1ccccc1Cl)S(C)(=O)=O 408779140 AHZUUENQOLXWIF-UDWIEESQSA-N 393.896 2.819 50 40 GFGB CCOc1ccc(CC(=O)N/N=C\c2cc(OCC)c(O)c([N+](=O)[O-])c2)cc1 408711803 LIFDTJUZYKCOTM-NDENLUEZSA-N 387.392 2.791 50 40 GFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2ccccc2)C1)c1ccc(Cl)c(Cl)c1 408614764 HLJNWEYKNZYTAX-LBPRGKRZSA-N 392.242 2.808 50 40 GFGB COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2\C(=O)NC(=O)C(C#N)=C2C)o1 96193209 UADSRPBPKIFCIT-ZSOIEALJSA-N 379.328 2.743 50 40 GFGB CCOC(=O)[C@@H](CC)/C(C)=N\NC(=O)CCC(=O)Nc1ccc(OCC)cc1 5875095 HHRXRTVCQJQMFY-CPEHUTGBSA-N 391.468 2.885 50 40 GFGB N#CC1=C(N)[C@H](C#N)C(c2cccc(Br)c2)=N[C@H]1Br 100252817 YMZFTOISGRWCPC-TVQRCGJNSA-N 380.043 2.849 50 40 GFGB Cc1ccc2c(c1)[C@]1(C(=O)N2)C(C#N)=C(N)Oc2c1c(C)nn2-c1ccccc1 3223903 NCWJWOVDQVNJBD-QFIPXVFZSA-N 383.411 2.814 50 40 GFGB Cc1ccccc1C(=O)NNC(=O)CCCCCN1C(=O)c2ccccc2C1=O 1750032 JFBHVXHNVDRKKK-UHFFFAOYSA-N 393.443 2.613 50 40 GFGB O=C(COc1ccccc1)NNC(=S)NC(=O)c1ccc(Cl)cc1Cl 2135512 VGHRUSFPIZAOSY-UHFFFAOYSA-N 398.271 2.708 50 40 GFGB Cc1cccc(C(=O)N[C@@H](C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)C(C)C)c1 6924210 SHRFYRWFCYVNNZ-AGKWGAAGSA-N 382.420 2.808 50 40 GFGB O=C(COc1ccc2c(c1)CCC2)NNC(=O)c1ccc(Br)s1 7652850 WFTHAGZARZHCTA-UHFFFAOYSA-N 395.278 2.839 50 40 GFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)CC1(C)SCCS1 409254603 IFMLHUIUDTVFCY-GZTJUZNOSA-N 379.463 2.643 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1cc2c(cc1C)OCO2 408907937 QLCVNRWIJSXHSM-ORWNMUSCSA-N 397.431 2.531 50 40 GFGB O=C(N/N=C/c1ccc(Br)cc1)[C@H]1CC(=O)N(c2ccccc2)C1 9235152 LWTIFBHJAVNUHK-HXJASHHUSA-N 386.249 2.952 50 40 GFGB Cc1ccc(CCC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1 12733733 ULLPKZCTFFALRD-UHFFFAOYSA-N 392.459 2.680 50 40 GFGB CC(=O)Nc1ccc(C(=O)N/N=C\c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 109038372 HOTNVHBPDPKOAD-BKUYFWCQSA-N 395.419 2.917 50 40 GFGB O=C(O)COc1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 4699081 FUPCVQIKOYPPNX-DJKKODMXSA-N 383.316 2.568 50 40 GFGB CCOC(=O)COc1ccc(Br)cc1/C=C(/C#N)C(=O)NC(C)C 408783148 LJFLZBQDOAESNU-QPEQYQDCSA-N 395.253 2.823 50 40 GFGB CCOC(=O)COc1c(Br)cc(/C=C(/C#N)C(N)=S)cc1OC 408543535 PSQSYBZJWNSCSE-WMZJFQQLSA-N 399.266 2.593 50 40 GFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2cccc(OC3CSC3)c2)n1 408864477 WBUNLQSJUZQMJT-UFWORHAWSA-N 388.518 2.830 50 40 GFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=C(/C#N)C(=O)Nc1cccc(C(=O)O)c1 33644414 ZXLBDLKURRLXIM-MLPAPPSSSA-N 397.343 2.856 50 40 GFGB Cc1ccc(CNC(=O)NNC(=O)COc2cccc(Br)c2)cc1 24754207 WVPCFBHRFPXEQN-UHFFFAOYSA-N 392.253 2.667 50 40 GFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccccc1OC 4502839 SODRECSLPXUAQV-KRWDZBQOSA-N 397.504 2.948 50 40 GFGB COc1ccc(-c2cc(C(F)(F)F)nn2-c2nc(C(=O)NN)cs2)cc1 1415696 XACMDIKDNQBWFG-UHFFFAOYSA-N 383.355 2.627 50 40 GFGB COc1ccc(/C=N/NC(=O)c2cc3c(OC)cc(OC)c(OC)c3[nH]2)cc1 2334721 KPWQQRXKIPZSJO-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB COc1ccccc1OCC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCC1 4180151 AFNZZMXJEAJHAI-FYJGNVAPSA-N 398.419 2.733 50 40 GFGB CCOC(=O)N1CCC2(CC1)C(C#N)=C(N)Oc1c2c(C)nn1-c1ccccc1 17143829 DLWCCWOLKKTAOL-UHFFFAOYSA-N 393.447 2.757 50 40 GFGB CCCN1C(=O)/C(=N/NC(=O)c2ccncc2)c2cc(Br)ccc21 18116585 BQTHMHKLNYVXTI-HMMYKYKNSA-N 387.237 2.735 50 40 GFGB O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1cc([N+](=O)[O-])ccc1O 35595380 JUBTYYMNVVVJOR-ODCIPOBUSA-N 382.298 2.881 50 40 GFGB Cc1cc(/C=N\NC(=O)CC(=O)NCc2cccnc2)c(C)n1-c1ccccc1 58914247 QPVBEJFVMQCHNR-MYYYXRDXSA-N 389.459 2.646 50 40 GFGB Cc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCc3cccnc3)c2C)cc1 59566511 TUPUPQKUDLHUJH-AFUMVMLFSA-N 389.459 2.564 50 40 GFGB COc1ccc(C(=O)N/N=C/c2cc(Br)ccc2O)c(OC)c1 60512602 DDNRHEQIKORCEN-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB O[C@]12[C@H]3[C@@H]4C[C@@H]5[C@H]([C@@H]1C(Br)(Br)[C@H]35)[C@@H]4[C@@H]2Br 169795852 WZBOKYFPZUQGLI-AXIRNNPJSA-N 398.920 2.739 50 40 GFGB CCCn1nc(C(=O)OC)cc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253405358 SDYLSZHHQKIYMB-INIZCTEOSA-N 384.436 2.531 50 40 GFGB CCCn1nc(C(=O)OC)cc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253405362 SDYLSZHHQKIYMB-MRXNPFEDSA-N 384.436 2.531 50 40 GFGB CN(c1ccc(C(=O)N/N=C/c2ccccc2C(F)(F)F)cc1)S(C)(=O)=O 409135917 RCUASLDQAQAPGG-SRZZPIQSSA-N 399.394 2.865 50 40 GFGB COc1cccc(/C=N/NC(=O)COc2cccc(Br)c2)c1OC 1444758 QCMHDSAXMUILPB-VXLYETTFSA-N 393.237 2.995 50 40 GFGB CN(c1ccc(C(=O)N/N=C/c2cccc3ccccc23)cc1)S(C)(=O)=O 409137450 VGKQWQRFMHTRBH-KGENOOAVSA-N 381.457 3.000 50 40 GFGB CN(C)c1ccc(/C=N/NC(=O)c2cccc(I)c2)o1 408988521 DSAQIHONFNBANX-CXUHLZMHSA-N 383.189 2.714 50 40 GFGB CCOC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@]21C(=O)N(C)c2ccccc21 4742199 IHTOBSIWBJQHML-FQEVSTJZSA-N 395.440 2.582 50 40 GFGB C[C@H]1Oc2ccccc2N(CC(=O)NNc2ccccc2C(F)(F)F)C1=O 14199539 MZFNUPONIGAPCP-LLVKDONJSA-N 379.338 2.963 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)ccc1OCC(=O)O 408791984 GDGKIWFHLRULOP-NTEUORMPSA-N 382.372 2.800 50 40 GFGB COc1ccc(C(=O)N/N=C\c2cc(Br)ccc2O)cc1OC 83314639 JNJBWBVLOVGJNN-NVMNQCDNSA-N 379.210 2.936 50 40 GFGB C=CCc1cc(C(=O)NNC(=O)c2cc(Cl)ccc2O)cc(OC)c1OC 10627125 AGFVQQXQLIECEK-UHFFFAOYSA-N 390.823 2.866 50 40 GFGB Cc1ccc(S(=O)(=O)Oc2ccc(/C=N/NC(=O)c3ccncc3)cc2)cc1 2179809 ZELJLCHLNJPIFI-HYARGMPZSA-N 395.440 2.922 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)c2cc3cc(OC)c(OC)cc3[nH]2)c1 2329851 FBMMMAHEEJDOKF-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB CCN(CC)c1ccc(/C=N/NC(=O)Cc2ccc(OC)c(OC)c2)c(O)c1 4082405 WLVLSSHDSLNRBM-HYARGMPZSA-N 385.464 2.948 50 40 GFGB Cc1cc2c(c(=O)n1Cc1cccs1)[C@H](c1cccnc1)C(C#N)=C(N)O2 4179057 QPJLLVXGTKVOKI-QGZVFWFLSA-N 376.441 2.880 50 40 GFGB COc1ccc(C[C@@H]2S/C(=C(/C#N)C(N)=O)N(c3ccccc3)C2=O)cc1 4539970 GFTRNTQGMMQFIF-IMGOXIFKSA-N 379.441 2.607 50 40 GFGB COc1cc(/C=C(/C#N)C(N)=O)ccc1OCCOCCOc1ccc(C)cc1 4599389 YZNLMECTEJCCGE-AQTBWJFISA-N 396.443 2.870 50 40 GFGB CCOc1ccc(N2C[C@H](C(=O)N/N=C/c3cccc(OC)c3)CC2=O)cc1 6962933 QMDSNMLLYDFJEV-QLPFJNHISA-N 381.432 2.597 50 40 GFGB O=C(NNC(=O)c1ccc(COc2ccc(F)cc2)o1)c1ccc2c(c1)OCO2 14232549 PEMBWLLGGTXDDE-UHFFFAOYSA-N 398.346 2.801 50 40 GFGB CCC/C(=N\NC(=O)CNC(=O)c1ccc(OC)c(OC)c1)c1ccccc1 14922074 IWMSJXLXEZETQN-HAVVHWLPSA-N 383.448 2.754 50 40 GFGB CC(C)(C)C(=O)Nc1nnc(CC(=O)N/N=C/c2ccccc2Cl)s1 33957636 QGLOINJPFPMZTP-GIJQJNRQSA-N 379.873 2.869 50 40 GFGB Cc1occc1C(=O)NNC(=O)Cn1c(=O)n(C2=CCCCC2)c2ccccc21 40128914 YDEDKODYLAWSGI-UHFFFAOYSA-N 394.431 2.581 50 40 GFGB CS(=O)(=O)[C@@H](I)[C@@H](O)c1ccc(Cl)cc1Cl 96519207 LDWMBHUCMDRACG-DTWKUNHWSA-N 395.045 2.833 50 40 GFGB COc1cc(/C=C(/C#N)C(=O)Nc2ccc(N(C)C)cc2)cc([N+](=O)[O-])c1O 408781566 ULOBYTMBCKOLBV-JYRVWZFOSA-N 382.376 2.921 50 40 GFGB O=C(N/N=C/c1ccc2c(c1)OCO2)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1 409167625 JKQGMLDMWHGOHB-FCQRQVBFSA-N 385.807 2.572 50 40 GFGB CCCOc1ccc(NC(=O)C(=O)N/N=C/c2ccc(O)c(Cl)c2)cc1 409260069 KFPJXSFJPJDJPG-RGVLZGJSSA-N 375.812 2.923 50 40 GFGB Cc1ccccc1OCC(=O)NNC(=O)COc1ccc(Cl)cc1Cl 1801249 UPDVUPRUAKBZAI-UHFFFAOYSA-N 383.231 2.907 50 40 GFGB CC[C@@H](C)Oc1ccc(C(=O)NC(=S)NNC(=O)c2cccs2)cc1 6596376 PASAJGIOZMADGD-LLVKDONJSA-N 377.491 2.875 50 40 GFGB CCCCCCC(=O)NN/C=C1\C(=O)N(c2ccc(OC)cc2)C(=O)N=C1O 8969702 FDBWHELCDHEPJY-QINSGFPZSA-N 388.424 2.593 50 40 GFGB Cc1cccc(N(CC(=O)N/N=C/c2cccc(Cl)c2)S(C)(=O)=O)c1 20060256 RFBJHLVARCVOTB-YBFXNURJSA-N 379.869 2.565 50 40 GFGB N#CC1=C(N)C(C#N)(C#N)[C@H](c2ccc(C(=O)O)cc2[N+](=O)[O-])[C@H]2CCCC=C12 33706703 WPKLQXQKRAKGAO-GUYCJALGSA-N 389.371 2.887 50 40 GFGB O=C(O)COc1ccc(/C=N\NC(=O)Cc2ccc(Br)cc2)cc1 100062741 JTBJPVMAFAYGPI-GRSHGNNSSA-N 391.221 2.605 50 40 GFGB O=C(N/N=C\c1ccc(I)cc1)c1ccc([N+](=O)[O-])cc1 108078962 HQNZJAUWQLNBDQ-SXGWCWSVSA-N 395.156 2.963 50 40 GFGB N#C/C(=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1)C(=O)Nc1ccccc1 409001681 QHEQEBMKYWGZDC-VBKFSLOCSA-N 378.388 2.977 50 40 GFGB Cc1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)c(C)n1-c1ccc(C(=O)O)cc1 409207432 WTCDPHFSTRMBKT-BUDOKORBSA-N 393.443 2.995 50 40 GFGB CCOC(=O)COc1c(Cl)cc(/C=C(\C#N)C(=O)N2CCCC2)cc1OC 409368110 RRKKKPUALILFAK-RIYZIHGNSA-N 392.839 2.820 50 40 GFGB O=C(N/N=C/c1cc2c(cc1Br)OCO2)c1ccccc1[N+](=O)[O-] 1099786 PWEPSSGTOWAXCG-REZTVBANSA-N 392.165 2.850 50 40 GFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(C[C@@H]4CCCO4)c(=O)c32)cc1 2252884 UQKCQZAOQHPMPQ-QFBILLFUSA-N 393.443 2.563 50 40 GFGB Cc1cc(C(=O)NN[C@@H]2CC(=O)N(c3ccc4ccccc4c3)C2=O)c(C)o1 3375066 RCIKLJLCEILQRK-GOSISDBHSA-N 377.400 2.616 50 40 GFGB COc1ccc2ccccc2c1/C=N\NC(=O)[C@H]1C(=O)NC[C@@H]1c1ccccc1 4871432 PADFYJZDWRBMDP-GPAGEQDKSA-N 387.439 2.828 50 40 GFGB Cc1ccc([C@H]2CC(=O)NC(SCC(=O)NCc3ccco3)=C2C#N)cc1 6477695 ICRWQKGJJSTYIZ-MRXNPFEDSA-N 381.457 2.976 50 40 GFGB Cc1c(/C=N/NC(=O)CNC(=O)OCc2ccccc2)c2ccccc2n1C 408808820 FRDWXUVRTZCPMN-FSJBWODESA-N 378.432 2.863 50 40 GFGB COc1cc(/C=N/NC(=O)CNc2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC 409366418 UYLLYVHLIAIGQZ-AWQFTUOYSA-N 392.799 2.828 50 40 GFGB CCOC(=O)CSC1=C(C#N)[C@H](c2ccc(C)cc2)[C@@H](C(=O)OC)C(O)=N1 2310478 MRGOIXJTSQMIPQ-JKSUJKDBSA-N 388.445 2.869 50 40 GFGB N#Cc1ccc(OCC(=O)NNC(=O)/C=C/c2cccc(C(F)(F)F)c2)cc1 3266536 ALOBHGDHWSEJES-RMKNXTFCSA-N 389.333 2.817 50 40 GFGB Cc1ccc(S(=O)(=O)Nc2ccccc2/C=N\NC(=O)c2ccncc2)cc1 4809440 DNPRVWWMZPNVNJ-HMAPJEAMSA-N 394.456 2.955 50 40 GFGB C[C@@]1(C(=O)N/N=C2\C(=O)Nc3ccc(Br)cc32)CC1(Cl)Cl 6795847 WNNDOGCLUOQJHI-LBPRGKRZSA-N 391.052 2.805 50 40 GFGB Cc1cc2c(c(=O)n1CCN(C)C)[C@H](c1cccc(Cl)c1)C(C#N)=C(N)O2 2247066 XWXMYWUXQGBTIJ-QGZVFWFLSA-N 384.867 2.590 50 40 GFGB CCn1c(C)nc2cc(C(=O)N/N=C/c3c(C)nn(CCC#N)c3C)ccc21 3211379 NNCYRMYMYMJUJL-WSDLNYQXSA-N 377.452 2.856 50 40 GFGB Cc1ccc2cc(C)c3nnc(SCC(=O)NNC(=O)C(C)C)n3c2c1C 4161046 SMZPIUAFLSBMJU-UHFFFAOYSA-N 385.493 2.703 50 40 GFGB O=C(NNS(=O)(=O)c1ccc(F)c(F)c1)c1cc2c(s1)CCCCC2 7404811 WUXSIKSYNOAICP-UHFFFAOYSA-N 386.445 2.919 50 40 GFGB O=C(NNC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2)c1sc2ccccc2c1Cl 102634443 UVYBJWBVCIOOHJ-NGERZBJRSA-N 390.848 2.839 50 40 GFGB Cc1ccn2cc(C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)nc2c1 12627970 JDHCRDBBICKLBY-UHFFFAOYSA-N 390.399 2.890 50 40 GFGB C#CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)cc1OC 2128707 QIJATEBVPPVURA-FQEVSTJZSA-N 376.368 2.654 50 40 GFGB Cn1cnnc1SCc1ccc(C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1 3307993 JBUZGKDEQNHJQV-VXLYETTFSA-N 396.432 2.780 50 40 GFGB Cc1cc(C(=O)NNC(=O)CNC(=O)C2CCCCC2)c(C)n1-c1ccccc1 3322496 FAOBZYRSVXIAQY-UHFFFAOYSA-N 396.491 2.552 50 40 GFGB Cn1cnnc1SCc1ccc(C(=O)N/N=C/c2ccc(C#N)cc2)cc1 5164286 YXCBAKNFJZYYCU-SRZZPIQSSA-N 376.445 2.743 50 40 GFGB CCn1c(C)nc2cc(C(=O)NNC(=O)CCOc3ccc(C)cc3)ccc21 5687628 OJCZRPPKLQWVAL-UHFFFAOYSA-N 380.448 2.903 50 40 GFGB CC/C(=N/NC(N)=O)c1ccc(OCc2ccc(C(=O)OC)cc2)c(OC)c1 4898520 CKRZPFDCQOIQIU-JWGURIENSA-N 385.420 2.843 50 40 GFGB O=C(Cc1cc(Cl)c2c(c1)OCCO2)NNC(=O)c1ccc2ccccc2n1 27688568 ULFUQZRNBNRVEL-UHFFFAOYSA-N 397.818 2.663 50 40 GFGB COc1ccc(CCNC(=O)C/C(C)=N/NC(=O)C2CCCCC2)cc1OC 100523091 SMXPULXNZTXYRQ-HZHRSRAPSA-N 389.496 2.825 50 40 GFGB O=C(NNc1c(F)c(F)c(F)c(F)c1F)[C@H]1CC(=O)N(Cc2ccccc2)C1 8705953 WLVDNLFPNNZUHV-JTQLQIEISA-N 399.319 2.874 50 40 GFGB O=C(CNC1CCCCC1)N/N=C/c1ccccc1I 409386556 MTRMPSUHJBOZBS-VCHYOVAHSA-N 385.249 2.664 50 40 GFGB COC(=O)c1ccc(NC(=O)C(=O)N/N=C\c2ccccc2C(F)(F)F)cc1 223159586 ZURVMIDDRHMECV-YVNNLAQVSA-N 393.321 2.581 50 40 GFGB COc1cccc(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)c1OC 6511581 RPVOEPXMAOXYBH-UHFFFAOYSA-N 379.372 2.702 50 40 GFGB CCc1cc2cc3c(cc2nc1SCC(=O)NNC(=O)c1ccco1)OCO3 4849551 QIVJGMAYYDYXRM-UHFFFAOYSA-N 399.428 2.672 50 40 GFGB C/C=C/c1ccc(OCC(=O)NNC(=O)c2ccc(OCC)cc2)c(OC)c1 6510410 QQEASGHSFHBUEQ-GQCTYLIASA-N 384.432 2.967 50 40 GFGB O=C(N/N=C/c1ccccn1)c1ccccc1NS(=O)(=O)c1cccs1 5928521 DLCOHPNKDBOQNM-XDHOZWIPSA-N 386.458 2.708 50 40 GFGB COc1cc(CCC(=O)NNC(=O)CSc2ccccc2F)cc(OC)c1 7964390 RJZZMIPTZMANLJ-UHFFFAOYSA-N 392.452 2.715 50 40 GFGB Cc1nn(C)c(C)c1C[C@H](C)C(=O)NNC(=O)CSc1ccc(Cl)cc1 72297062 CAHRHHUJBNRHCX-NSHDSACASA-N 394.928 2.809 50 40 GFGB CN1c2ccccc2C2=C([C@H](c3cccc(F)c3)C(C#N)=C(N)O2)S1(=O)=O 20558306 PDLRMILIMGGOJT-MRXNPFEDSA-N 383.404 2.782 50 40 GFGB O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNc1cccc(C(F)(F)F)c1 14907612 BUOXYPPZCCOKAJ-OKILXGFUSA-N 383.370 2.714 50 40 GFGB COc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)c(O)c1 18050610 RNFISHVIWYFBCK-CYBMUJFWSA-N 380.400 2.783 50 40 GFGB N#C/C(=C/c1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(C(=O)O)cc1 96663322 FWAGZDAQNDPKKX-LGMDPLHJSA-N 377.400 2.767 50 40 GFGB C/C(CC(=O)Nc1ccc(Cl)c(Cl)c1)=N\NC(=O)C(=O)N1CCCCC1 100571708 BUIDOPFNGAFQSF-SRZZPIQSSA-N 399.278 2.827 50 40 GFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)C1CCN(C(=O)c2ccccc2)CC1 409006139 MNHGOBMXXFXZKY-KGENOOAVSA-N 380.404 2.597 50 40 GFGB C/C(CC(=O)Nc1ccc(N(C)C)cc1)=N\NC(=O)COc1ccccc1C 4180650 OYFXAOZZMGYVKP-XQNSMLJCSA-N 382.464 2.961 50 40 GFGB O=C(CCc1ccccc1)NNC(=O)c1cccc(I)c1 4195961 SIAVGTSTTPYZGO-UHFFFAOYSA-N 394.212 2.685 50 40 GFGB Cc1nc(COc2ccccc2/C=C/C(=O)NNC(=O)c2cccnc2)cs1 14221380 DPVXBXDYTGRMPI-CMDGGOBGSA-N 394.456 2.900 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2ccccc2Cl)S(C)(=O)=O)cc1 19954440 QZPVTCPZCYEESJ-YBFXNURJSA-N 379.869 2.565 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)C(=O)Nc2cc(Cl)ccc2C)c1 59515545 JWAMSUOLKYSRGT-KEBDBYFISA-N 375.812 2.754 50 40 GFGB NC(=O)CCn1cc(/C=N/NC(=O)CNc2ccc(Cl)cc2)c2ccccc21 409360867 FZUMZOPOZZXFOC-BHGWPJFGSA-N 397.866 2.732 50 40 GFGB CCNC(=O)/C(C#N)=C/c1c(Oc2ccc(F)cc2)nc2c(C)cccn2c1=O 2407381 RLJXRDPZSUDLIS-SDNWHVSQSA-N 392.390 2.977 50 40 GFGB Cc1cc(C)c(S(=O)(=O)NCC(=O)N/N=C/c2ccccc2Cl)c(C)c1 6607398 XVDZWNSMRCCRSI-KEBDBYFISA-N 393.896 2.694 50 40 GFGB CCOc1ccc(N([C@H](C)C(=O)N/N=C(\C)C(C)(C)C)S(C)(=O)=O)cc1 7036925 JQDFVGDDTBOKRY-DVDIPCOMSA-N 383.514 2.778 50 40 GFGB Cc1ccc(-n2nc(C)c(CC(=O)NNC(=O)c3ccccn3)c2C)cc1Cl 40142841 SORGFOYMEDAICR-UHFFFAOYSA-N 397.866 2.850 50 40 GFGB CC1=NN(c2ccc(C)cc2C)C(=O)/C1=C\NNC(=O)c1ccc([N+](=O)[O-])cc1 100507604 LZEFPFQTMDXJDD-BOPFTXTBSA-N 393.403 2.753 50 40 GFGB C[C@H]1CC[C@H]2[C@@H](C)[C@@H](OC(=O)CCC(=O)O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 145985167 FIHJKUPKCHIPAT-DYVQAXGSSA-N 384.425 2.602 50 40 GFGB O=C(NCc1ccc(Cl)cc1Cl)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 408718551 XKUBWJCKUNIFMT-DNTJNYDQSA-N 395.202 2.668 50 40 GFGB N#Cc1c(/C=C/c2ccccc2)c(C(=O)NN)nn(-c2ccc(Cl)cc2)c1=O 5600284 UCJRQQIFONNOTL-IZZDOVSWSA-N 391.818 2.531 50 40 GFGB CC1(CC(=O)N/N=C/c2ccc(-c3ccc(Cl)c(C(=O)O)c3)o2)OCCO1 5727795 MLTSMCNTOTZPRJ-KEBDBYFISA-N 392.795 2.901 50 40 GFGB COc1cccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)c1O 8168720 KZCUCYFUQOBAKM-WVISFHDSSA-N 387.823 2.557 50 40 GFGB CCCOc1ccc(C(=O)NNC(=O)c2cccc(NC(C)=O)c2)cc1OC 12766431 NDVXSQVUJXNOEW-UHFFFAOYSA-N 385.420 2.517 50 40 GFGB COCCCNC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccncc1 33808720 LLFQHGNMBZZRDG-JXAWBTAJSA-N 387.443 2.994 50 40 GFGB CCC(=O)N1CCN(c2ccc(N3C[C@@H](C(=O)Cl)CC3=O)cc2Cl)CC1 57332475 KFRSFNZZZABDNE-LBPRGKRZSA-N 398.290 2.517 50 40 GFGB O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C/c1cc([N+](=O)[O-])ccc1O 20249002 RXXWVIWDYGYQBE-CAOOACKPSA-N 390.377 2.592 50 40 GFGB O=C(N/N=C/c1ccc(OS(=O)(=O)c2ccccc2)cc1)c1cccnc1 96592340 MUGRWJBNIYDSTL-FYJGNVAPSA-N 381.413 2.613 50 40 GFGB COc1cc(CN2CC=C(C#N)CC2)cc(I)c1OC 96003712 KVCPWPKDOOUQRM-UHFFFAOYSA-N 384.217 2.964 50 40 GFGB Cc1ccc(/C=N/NC(=O)COc2ccc(I)cc2)o1 704671 JVPDEPFYMHZNDG-LZYBPNLTSA-N 384.173 2.722 50 40 GFGB COCCCNC(=O)/C(C#N)=C/c1cc(OC)c(OC)cc1Br 5070188 VUUXDXCIEUZYET-KPKJPENVSA-N 383.242 2.526 50 40 GFGB O=C(CNc1ccc2c(c1)OCO2)N/N=C/c1cccc(Br)c1 59463262 GCJLOXILVNYABL-UFWORHAWSA-N 376.210 2.740 50 40 GFGB N#C/C(=C/c1ccc(OCC(=O)O)cc1)C(=O)NCCc1c[nH]c2ccccc12 408950350 JIGSFLNRTPDCCB-BOPFTXTBSA-N 389.411 2.897 50 40 GFGB CC(C)COc1ccccc1C(=O)NC(=S)NNC(=O)c1cccs1 8101729 GLGGORCBRXMSKE-UHFFFAOYSA-N 377.491 2.732 50 40 GFGB Cc1cc(C(F)(F)F)nn1CC(=O)NNC(=S)Nc1cccc(Cl)c1 8680989 MQTJXUOOBRWGQV-UHFFFAOYSA-N 391.806 2.882 50 40 GFGB O=C(Cn1c(=O)oc2ccccc21)NNC(=O)c1cc2c(s1)CCCCCC2 12697692 BQTLJDODESNAGI-UHFFFAOYSA-N 399.472 2.776 50 40 GFGB CC(C)(C)CC(=O)NNC(=O)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1 16839329 OBLWQOSTWMQQSP-UHFFFAOYSA-N 375.856 2.747 50 40 GFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)c2ccc(OC)c(OC)c2)cc1 17201574 QCRWNVAZBRTTSU-LPYMAVHISA-N 385.420 2.847 50 40 GFGB CCOC(=O)Cn1c(C)c(/C=C(\C#N)C(=O)NCCCOC)c2ccccc21 105492573 BGCULUGAILVNRV-FOWTUZBSSA-N 383.448 2.573 50 40 GFGB O=C(c1ccc(F)cc1)[C@H](CCCl)OC(=O)[C@@H]1[C@H]2C[C@@H]3OC(=O)[C@@H]1[C@H]3C2 408673059 WHFGZZJBKWIVEV-MDRZNBNDSA-N 380.799 2.747 50 40 GFGB COc1c(O)ccc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)c1[N+](=O)[O-] 855664 WKAQVMBMTNHOIW-AWQFTUOYSA-N 387.392 2.763 50 40 GFGB O=C(O)COc1ccccc1/C=N/NC(=O)Cc1ccc(Br)cc1 1084717 IQKOTPUJHLCIJE-VXLYETTFSA-N 391.221 2.605 50 40 GFGB COc1cc(/C=N/NC(=O)CC(=O)NCC(C)C)ccc1OCc1ccccc1 3168326 ZTOZGXDNMQKWJQ-ZVHZXABRSA-N 397.475 2.887 50 40 GFGB N#CC1=C(N)Oc2cnccc2[C@H]1c1cccc(I)c1 5338053 XJNHDDYYEFDXHL-CQSZACIVSA-N 375.169 2.904 50 40 GFGB Cc1ccc(C(=O)NC(=S)NNC(=O)c2cccc(Br)c2)cc1 5928345 RYACLNSXPUBHJA-UHFFFAOYSA-N 392.278 2.707 50 40 GFGB CC(C)=NNC(=O)CN(c1ccccc1F)S(=O)(=O)c1ccc(C)cc1 19816719 HXBGAJFICWOFCU-UHFFFAOYSA-N 377.441 2.841 50 40 GFGB CC(C)CCN1C(=O)/C(=N/NC(=O)COc2ccc(C#N)cc2)c2ccccc21 102976813 FQJKXNZCULGTJS-NJNXFGOHSA-N 390.443 2.850 50 40 GFGB CC(C)C(=O)N/N=C/c1ccc(CNS(=O)(=O)c2ccc(Cl)cc2)o1 408782915 LDMNSMNVIMFXJV-GIJQJNRQSA-N 383.857 2.518 50 40 GFGB CCOC(=O)Cn1cc(/C=N/NC(=O)CNc2ccc(F)cc2)c2ccccc21 409351092 WFRUBNKQFRTCDL-BHGWPJFGSA-N 396.422 2.906 50 40 GFGB CCN(CC)S(=O)(=O)c1ccc(NNC(=O)Nc2cccc(C)c2)nc1 12543475 NRKNLNKYQQXSAN-UHFFFAOYSA-N 377.470 2.569 50 40 GFGB CCn1c(/C=N/NC(=O)c2cc(OC)c(OC)c(OC)c2)nc2ccccc21 1479736 RDCJMRUBNVYNGL-CIAFOILYSA-N 382.420 2.846 50 40 GFGB COc1cc(OC)cc([C@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)c1 18283775 VOCLVKNUZSKAKF-KRWDZBQOSA-N 375.384 2.763 50 40 GFGB N#Cc1ccccc1-c1nnn(CC(=O)N/N=C/c2cccc3ccccc23)n1 808956 XDVJJQSKKWOSCJ-YDZHTSKRSA-N 381.399 2.515 50 40 GFGB C/C(CC(=O)Nc1ccc(Br)cc1F)=N\NC(=O)c1cnccn1 101503865 HONTYXLEIMSZFZ-ZVBGSRNCSA-N 394.204 2.513 50 40 GFGB COC(=O)c1ccccc1NC(=O)NNC(=O)c1ccccc1-n1cccc1 2853031 LUUOASPEYDKXQG-UHFFFAOYSA-N 378.388 2.730 50 40 GFGB CCC[C@@H](Br)C(=O)NCCC(=O)Nc1ccc(C(=O)OCC)cc1 8733078 MYHDLRTYZAQORX-CQSZACIVSA-N 399.285 2.872 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)ccc1OC(=O)c1ccco1 2628085 BWZRMBQWTKWAFH-AAGJOFLKSA-N 396.399 2.710 50 40 GFGB ICC12C3C4C1C1C2C3C41CI 329780345 GBUXTGMLNXCLCQ-UHFFFAOYSA-N 383.998 2.594 50 40 GFGB COc1cccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)c1O 8168725 KZCUCYFUQOBAKM-IMRMQAIZSA-N 387.823 2.557 50 40 GFGB COc1cc([C@@H]2ON=C(C(=O)N/N=C/c3cccc(F)c3)[C@@H]2C)cc2c1OCO2 15085840 FKAOOHCPBVJUHX-YITRBVBMSA-N 399.378 2.777 50 40 GFGB CCOC(=O)Cn1c(C)c(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)c2ccccc21 876131 QHTOLWMMKIAFOX-YTBHAWNYSA-N 395.459 2.715 50 40 GFGB COc1c(O)ccc(/C=N/NC(=O)COc2ccc(Cl)c(C)c2)c1[N+](=O)[O-] 5540419 JKJMERWZBWUCDY-UFWORHAWSA-N 393.783 2.800 50 40 GFGB COC(=O)COc1c(Cl)cc(/C=N/NC(=O)c2ccccc2C)cc1OC 9200780 VAQQDMXIKZDQNR-UFFVCSGVSA-N 390.823 2.973 50 40 GFGB C/C(=N/NC(=O)c1cc2ccccc2cc1O)c1sc(N)c(C(N)=O)c1C 12372274 NGYQDTDMCBDGHD-YVNNLAQVSA-N 382.445 2.750 50 40 GFGB CC(C)COC(=O)[C@@H]1/C(=N/NC(=O)CC#N)C[C@](C)(O)C[C@H]1c1ccccc1 100249095 CIPFSKNBWXNURT-WTZTXAIYSA-N 385.464 2.516 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1Br)[C@@H](O)c1ccccc1 408591197 RXFYBFBXAFQXMV-VEJKBTLKSA-N 378.182 2.541 50 40 GFGB COc1ccc(CC(=O)N/N=C\c2cccn2-c2cccc(C(=O)O)c2)cc1 409101193 AINAJRCBWAQVFY-HMAPJEAMSA-N 377.400 2.877 50 40 GFGB COC(=O)COc1ccc(/C=N\NC(=O)c2cc3ccccc3o2)cc1OC 408853858 YNAPHOAGBILNEB-NHDPSOOVSA-N 382.372 2.757 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1cccc(OC)c1OC 408908847 SLUPNELARFGJNR-NIZGNDASSA-N 399.447 2.511 50 40 GFGB COC(=O)c1ccc(C(=O)OC)c(NC(=O)/C(C#N)=C/c2ccc(OC)cc2)c1 3169224 MLDDBPAPHPAYOU-XNTDXEJSSA-N 394.383 2.814 50 40 GFGB CCCOc1ccc(/C=N/NC(=O)C(=O)Nc2cccc(OC)c2)cc1OCC 3088286 YGTVONVJLARJNV-HYARGMPZSA-N 399.447 2.972 50 40 GFGB COc1cc([C@H](C)NC(=O)NCCNC(=O)[C@H](C)Cl)ccc1OC(C)C 65607592 ULKWWAMIUFZXET-STQMWFEESA-N 385.892 2.586 50 40 GFGB Cc1ccccc1C(=O)Nc1nnc(CC(=O)N/N=C/c2ccc(F)cc2)s1 16946724 ITCVTYUOSSCJPM-SRZZPIQSSA-N 397.435 2.931 50 40 GFGB CC1=NN(c2ccccc2)C(=O)/C1=C\NNC(=O)c1cccc(Br)c1 44965570 MCVPMAGUFYPFMV-WJDWOHSUSA-N 399.248 2.990 50 40 GFGB C/C(=N/NC(=O)CSCC(=O)N/N=C(/C)c1ccccc1)c1ccccc1 17287356 PEFXBZPWWBKCKP-BMJUYKDLSA-N 382.489 2.800 50 40 GFGB CC(=O)Nc1ccc(C(=O)NNC(=O)COc2cccc3ccccc23)cc1 1088052 KYBLDJVKZXPQAX-UHFFFAOYSA-N 377.400 2.638 50 40 GFGB Cc1cc(/C=N/NC(N)=O)c(C)n1-c1ccccc1I 6235920 QIUNHQVDCMLYJT-CAOOACKPSA-N 382.205 2.701 50 40 GFGB Cc1nn(CC(C)C)c(C)c1CC(=O)NNC(=O)Cc1ccc(Cl)cc1 24975891 WLNLICALVLQIOB-UHFFFAOYSA-N 376.888 2.742 50 40 GFGB Cn1cnnc1SCc1ccc(C(=O)NNC(=O)C[C@@H]2C[C@H]3CC[C@H]2C3)cc1 103941830 RMKSKUWJHIEUFY-XIRDDKMYSA-N 399.520 2.695 50 40 GFGB O=C(N/N=C/c1ccc(N2CCOCC2)o1)c1cc2cc([N+](=O)[O-])ccc2o1 408960603 HEJPIMDSHYULCJ-YBFXNURJSA-N 384.348 2.535 50 40 GFGB COc1cc(/C=N/NC(=O)c2cc(C)n[nH]2)ccc1OC(=O)c1cccc(F)c1 881131 NABDKIBMBCTKAY-SSDVNMTOSA-N 396.378 2.849 50 40 GFGB O=C(COc1ccccc1-c1ccccc1)NNC(=O)c1cccnc1S 14045156 HZRMCHQSISUTOG-UHFFFAOYSA-N 379.441 2.877 50 40 GFGB Cc1cc(C)cc(OCCC(=O)NNC(=O)c2cncn2-c2ccccc2)c1 29855973 HEYUEILSYYQXJH-UHFFFAOYSA-N 378.432 2.719 50 40 GFGB O=C(CBr)Nc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1 35604944 FRSCCJDUCSPOEF-UHFFFAOYSA-N 395.278 2.771 50 40 GFGB Cc1ccc2c(c1)c1c3n2CCN(CC(=O)NNC(=O)C(C)(C)C)[C@@H]3CCC1 57058973 QXSCUYLGPDXBKM-GOSISDBHSA-N 382.508 2.836 50 40 GFGB C=CCc1cc(/C=N/NC(=O)c2ccc(C)cc2)cc(OC)c1OCC(=O)O 59678679 VPIRUDBEBSBNSJ-WSDLNYQXSA-N 382.416 2.959 50 40 GFGB C=CCc1cc(/C=N/NC(=O)c2cccc(OC)c2)cc(OC)c1OCC(=O)O 59679252 GPANGQCQQIBRGP-WSDLNYQXSA-N 398.415 2.660 50 40 GFGB O=C(N/N=C/c1ccco1)[C@H]1CC(=O)N(c2ccc(Br)cc2)C1 409169642 QOFCBGBWVNGNDB-KECVIQKOSA-N 376.210 2.545 50 40 GFGB C/C(=N\NC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1ccc(Cl)s1 7779986 NKNOSPACQDKYFY-REZTVBANSA-N 392.289 2.856 50 40 GFGB NC(=O)COc1ccc(/C=N/NC(=O)CSCc2ccc(Cl)cc2)cc1 28213760 DLLFANXTVTZPAK-ZVBGSRNCSA-N 391.880 2.588 50 40 GFGB COc1ccc(-c2n[nH]cc2/C=N\NC(=O)c2ccc3c(c2)OCO3)cc1OC 17080530 FUBFXIHTXVGHJU-YVNNLAQVSA-N 394.387 2.587 50 40 GFGB Cc1cc(C)cc(N2C[C@H](C(=O)NNC(=O)c3ccccc3Cl)CC2=O)c1 408642077 NRMOYXHMGHTZGE-CQSZACIVSA-N 385.851 2.771 50 40 GFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccccc1Cl 47080831 PAZPPFQIKQIQKN-LLVKDONJSA-N 392.242 2.808 50 40 GFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(Br)cc3)[C@H]2C1 19943131 USLDAJCEQPIJJC-DLBZAZTESA-N 394.276 2.804 50 40 GFGB CCOc1ccc(C(=O)NC(=S)NNC(=O)c2ccc(Cl)cc2)cc1 6439602 HGWZXHGRMRMNHL-UHFFFAOYSA-N 377.853 2.688 50 40 GFGB CCc1ccc(OCC(=O)NNC(=O)c2ccc(-n3nc(C)cc3C)cc2)cc1 3331485 JYHRCFKDLZXYPI-UHFFFAOYSA-N 392.459 2.892 50 40 GFGB O=C(NNC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2)c1cccs1 44282549 ITPJDYQJODZUEL-UHFFFAOYSA-N 388.399 2.776 50 40 GFGB COCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cccc(Br)c1 12402634 QFCIJNHKPZCINV-HNNXBMFYSA-N 393.237 2.720 50 40 GFGB Cc1c(C(=O)NNC(=O)c2cn(C)c3ccccc23)cnn1-c1ccc(F)cc1 32418219 PGFLNWQWILSMST-UHFFFAOYSA-N 391.406 2.886 50 40 GFGB CCCC[C@H](C[C@@H](O)COCCC)C(=O)NNC(=S)Nc1ccccc1 4794002 UDLQODXYXADENG-NVXWUHKLSA-N 381.542 2.988 50 40 GFGB CCCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(OC)cc2)cc1OCC 7869488 PMCZSOPFFLPRDT-HYARGMPZSA-N 399.447 2.972 50 40 GFGB COc1cc(/C=N/NC(=O)CC#N)ccc1OCc1nc2ccccc2nc1C 16265371 RKFGGVLDQCLMRI-FSJBWODESA-N 389.415 2.890 50 40 GFGB CNC(=O)/C(C#N)=C/c1ccc(OCC(=O)Nc2cccc(C)c2)c(OC)c1 409007922 RUYRBTIRGAKKKB-MHWRWJLKSA-N 379.416 2.674 50 40 GFGB Cc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c2ccccc2n1 3408975 LFJNTFGZDAHOBS-UHFFFAOYSA-N 397.818 2.815 50 40 GFGB C[C@H](C(=O)N/N=C/c1c(F)cccc1Cl)N(c1ccccc1)S(C)(=O)=O 4543733 QNFGKARWVBYJHQ-ZICWZVMQSA-N 397.859 2.784 50 40 GFGB CC1CCN(C(=O)/C(C#N)=C\c2ccc(-c3ccc(S(N)(=O)=O)cc3)o2)CC1 5855157 VABUUUZYEVKSBF-VBKFSLOCSA-N 399.472 2.759 50 40 GFGB Cc1cccc(NC(=O)CSCC(=O)NNC(=O)c2ccc(C)cc2C)c1 8143342 OMGXYZNVJMWUKJ-UHFFFAOYSA-N 385.489 2.745 50 40 GFGB C/C(Cn1nc(C)c(Cl)c1C)=N\NC(=O)c1cc(C)nc2c1c(C)nn2C 8782482 BDVZCAUZPBOUOQ-UFFVCSGVSA-N 387.875 2.858 50 40 GFGB Cc1cccc(C(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)c1 12816271 AUNBHGPSQIYVSN-GFCCVEGCSA-N 377.238 2.986 50 40 GFGB Cc1cc(Cl)ccc1N(CC(=O)N/N=C/c1sccc1C)S(C)(=O)=O 20212590 KWJSXQPZUYQUQP-GIJQJNRQSA-N 399.925 2.935 50 40 GFGB COc1ccc(Cl)cc1C(=O)NNS(=O)(=O)c1cc(Cl)ccc1C 31666261 NKYURGKYDUEQFB-UHFFFAOYSA-N 389.260 2.934 50 40 GFGB C/C(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)=N\NC(=O)c1ccccn1 100090010 JSUXPPMLVIJLLX-KEBDBYFISA-N 375.772 2.778 50 40 GFGB COc1ccc(C(=O)N/N=C/c2ccccc2I)c(O)c1 409392018 MXRYMTQARQUYJR-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)COc2ccc(C)cc2)cc1 4697777 DGEBLPDCCZNGMO-XQNSMLJCSA-N 383.448 2.581 50 40 GFGB NC(=O)N[C@@H](CC(=O)NNC(=O)c1cc(Cl)ccc1Cl)c1ccccc1 11507478 XVWHQGUYDZDMQT-AWEZNQCLSA-N 395.246 2.554 50 40 GFGB CNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccc(Cl)c(Cl)c2)c1 40049289 DTUAIRAYUQZXJG-UHFFFAOYSA-N 388.276 2.967 50 40 GFGB O=C(N/N=C/c1ccc2c(c1)OCCO2)C(=O)Nc1cccc(C(F)(F)F)c1 107741716 PEMXDROWASUAQV-LSHDLFTRSA-N 393.321 2.565 50 40 GFGB CCOc1ccc(C(=O)N/N=C\c2ccc(OCC(=O)O)cc2)cc1OCC 409332286 GPESLLULDTWIAO-MTJSOVHGSA-N 386.404 2.711 50 40 GFGB COc1cc(/C=N/NC(=O)CSCC(=O)Nc2ccc(C)cc2)ccc1O 1806521 ADNGLDSOQRDWHB-KEBDBYFISA-N 387.461 2.531 50 40 GFGB O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)N/N=C/c1ccc(F)cc1 19682688 UPVZEXDNSTWEOO-YDZHTSKRSA-N 388.874 2.747 50 40 GFGB C/C(CCc1ccccc1)=N\NC(=O)CN(c1cccc(C)c1)S(C)(=O)=O 4502951 SCLFAMIYTPFKHS-HEHNFIMWSA-N 387.505 2.886 50 40 GFGB COc1ccc(/C=N\NC(=O)c2cc([N+](=O)[O-])ccc2O)cc1Br 408919618 ZDSSVOGAZVAUNA-IUXPMGMMSA-N 394.181 2.835 50 40 GFGB CCc1c(C)sc(NC(=O)/C(C#N)=C/c2ccc(OCC(N)=O)cc2)c1C#N 17080583 GRSREIBTYQEQPN-RIYZIHGNSA-N 394.456 2.900 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2ccccc2F)S(C)(=O)=O)cc1Cl 408772431 PDBQAMONHVZEBC-KEBDBYFISA-N 397.859 2.704 50 40 GFGB O=P(C(=S)NCCCN1CCOCC1)(c1ccccc1)c1ccccc1 95676975 RCVQXMZDYFFIIZ-UHFFFAOYSA-N 388.473 2.597 50 40 GFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)c1ccc(N2CCCC2)cc1 408675962 CUHXLMCNTLZVTE-FYJGNVAPSA-N 398.419 2.976 50 40 GFGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc2cc(C)c(C)cc2[nH]c1=O 876538 CMYQDXDVBZRRRI-SFHVURJKSA-N 379.416 2.790 50 40 GFGB O=C(N/N=C/c1cccc(OC(=O)c2ccc3c(c2)OCO3)c1)c1cccnc1 3150237 CKUZHAQBPNMSHQ-FOKLQQMPSA-N 389.367 2.793 50 40 GFGB O=C(CC(=O)N/N=C/c1ccccc1C(F)(F)F)NCCc1ccccc1 4893333 SLXRLSUMOJBSGE-ZMOGYAJESA-N 377.366 2.905 50 40 GFGB Cc1nn(-c2ccccc2)c(C)c1/C=N/NC(=O)[C@@H]1COc2ccccc2O1 6279797 DGBBSJSDWQOYAV-CNSRZQHFSA-N 376.416 2.779 50 40 GFGB CC(=O)Nc1cccc(C(=O)N/N=C/c2cc(Br)c(N(C)C)o2)c1 6614644 SZURWRNLWUXZKC-GIJQJNRQSA-N 393.241 2.830 50 40 GFGB COc1ccccc1NCC(=O)NNC(=O)Cc1ccc(Cl)cc1Cl 12533540 BGNXNPPIQKOKSE-UHFFFAOYSA-N 382.247 2.804 50 40 GFGB COc1cc(/C=N/NC(=O)Cc2nc3ccccc3n2C)ccc1OC(F)F 12643738 JPBTVHLMHZQCDM-SSDVNMTOSA-N 388.374 2.876 50 40 GFGB Cn1c(=O)n(C)c2cc(/C=C(/C#N)C(=O)NCCc3c[nH]c4ccccc34)ccc21 15227081 ODRDSMHMQDQTRS-BOPFTXTBSA-N 399.454 2.624 50 40 GFGB CCOc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)N(CC)CC)c2C)cc1 58912417 DEBTUDMBZJJCAM-HYARGMPZSA-N 384.480 2.811 50 40 GFGB O[C@@]12[C@@H](Br)[C@H]3[C@@H]4C[C@H]5[C@H]3[C@H]1C(Br)(Br)[C@H]5[C@@H]42 253476500 WZBOKYFPZUQGLI-MWFHOJDDSA-N 398.920 2.739 50 40 GFGB CC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cccc(I)c1 3087707 ISSVQLSTMBHMOP-AWEZNQCLSA-N 380.185 2.962 50 40 GFGB O=C(NNC(=O)c1c[nH]nc1-c1ccccc1)c1ccc(Br)cc1 14094855 MZHABSWMWFZJIL-UHFFFAOYSA-N 385.221 2.914 50 40 GFGB CN(C)c1ccc(/C=C(\C#N)C(=O)Nc2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] 14361382 BTUCTDNLMOGRTB-NTEUORMPSA-N 394.387 2.978 50 40 GFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)CNc1ccc(Cl)cc1 409364005 MUYKBWDYFHLRKU-SRZZPIQSSA-N 386.795 2.822 50 40 GFGB O=C1S[C@@H](Nc2ccc(I)cc2)C(=O)N1CCCl 36626567 LYBOYNQAODWMEA-SECBINFHSA-N 396.637 2.963 50 40 GFGB C[C@H](Oc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc2ccccc2oc1=O 1064056 NDBXUBGKUVJZCU-NSHDSACASA-N 386.791 2.675 50 40 GFGB CCOC(=O)[C@H]1C[C@@H](Cl)[C@@H]([S@@](=O)c2ccccc2)C[C@H]1C(=O)OCC 12413112 CMYFIVFGISYXSM-WBUBGSNBSA-N 386.897 2.923 50 40 GFGB CCN1C(=O)/C(=N\NC(=O)c2cc(Br)ccc2O)c2ccccc21 16805048 DMFKYVQLUXGTFM-CYVLTUHYSA-N 388.221 2.655 50 40 GFGB Cc1ccc(NC(=O)C(=O)N/N=C/c2cc(Br)ccc2O)cc1C 3072735 YBFFRIFHYXKEDD-DJKKODMXSA-N 390.237 2.860 50 40 GFGB COc1cc(/C=N/NC(=O)C(=O)N2CCCCC2)ccc1OCc1ccccc1 5512854 GAIWHVZQSYIUFQ-HZHRSRAPSA-N 395.459 2.737 50 40 GFGB COc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3)C2)cc1OC 5544441 JTQNRHYTHPZVHB-LTNVFZTJSA-N 381.432 2.515 50 40 GFGB Cc1cc(C)n(Cc2ccc(C(=O)N/N=C/c3cc([N+](=O)[O-])ccc3O)cc2)n1 38188175 WNPOFFADKXGCTM-SRZZPIQSSA-N 393.403 2.926 50 40 GFGB O[C@]12[C@@H](Br)[C@H]3[C@H]4[C@@H]1C(Br)(Br)[C@H]1[C@@H]4C[C@@H]3[C@H]12 195528764 WZBOKYFPZUQGLI-FQLICSPYSA-N 398.920 2.739 50 40 GFGB O=C(NNC(=O)c1ccccc1F)c1ccc(CSc2ncccn2)cc1 879597 KJGYQGGSUATGDK-UHFFFAOYSA-N 382.420 2.983 50 40 GFGB O=C(COc1ccc(Cl)cc1)NNC(=O)CSc1nc2ccccc2o1 6060847 TUCWGLYZGSSPGN-UHFFFAOYSA-N 391.836 2.800 50 40 GFGB CCOc1cccc(C(=O)NC(=S)NNC(=O)c2ccc(Cl)cc2)c1 6439820 GOGJHUCYTPUJFQ-UHFFFAOYSA-N 377.853 2.688 50 40 GFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)n1 57415995 BNCLZLKSOZIYLY-REZTVBANSA-N 379.829 2.897 50 40 GFGB COC(=O)c1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)n(CC(C)C)n1 253401161 MNXVUJGKBWVHOA-QGZVFWFLSA-N 398.463 2.777 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C\c2cc([N+](=O)[O-])cc(OC)c2O)cc1 408818808 QRDJCORTZUHGLX-AUWJEWJLSA-N 383.360 2.541 50 40 GFGB Cc1ccc(C)n1-c1ccc(C(=O)N/N=C/c2ccc(OCC(N)=O)cc2)cc1 15145271 UXKOPFXOSLOZFB-ZMOGYAJESA-N 390.443 2.722 50 40 GFGB C#CCN1C(=O)/C(=N/NC(=O)c2ccc(Br)cc2)c2ccccc21 18192957 NEIXRJPOHVUDCG-CAPFRKAQSA-N 382.217 2.563 50 40 GFGB COc1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)c(OC)c1 408784851 UKYIMUAGQAJQSP-JXAWBTAJSA-N 377.444 2.960 50 40 GFGB Cc1ccccc1[C@H]1C(C#N)=C(N)N(N2CCOCC2)C2=C1C(=O)CC(C)(C)C2 691001 KJIIIRNHHBUEPE-FQEVSTJZSA-N 392.503 2.979 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2cccc3ccccc23)cc1[N+](=O)[O-] 4499512 OVGRQZOVSJEOGL-CIAFOILYSA-N 392.371 2.845 50 40 GFGB CCc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccccc3Cl)CC2=O)cc1 8203733 CDMHVHXQDXWWSH-CQSZACIVSA-N 385.851 2.717 50 40 GFGB CC(C)(C)c1cc[n+](C2=NC(=O)S/C2=C\NNC(=O)c2ccccc2O)cc1 15952915 SEPPMLHXMHBHEB-UHFFFAOYSA-O 397.480 2.867 50 40 GFGB O=C(CCSCCC(=O)N/N=C\c1ccccc1)N/N=C\c1ccccc1 31623561 FMVOKYHMOJAAIR-BMJUYKDLSA-N 382.489 2.800 50 40 GFGB I[C@H]1[C@H]2[C@@H]3[C@@H]4C[C@@H]2[C@@H]2[C@H]4[C@@H](I)[C@H]3[C@H]12 261361228 NMQHCEGZBHEZIR-QHYCBPNOSA-N 398.025 2.981 50 40 GFGB COc1cc(/C=N/NC(=O)C(=O)NC(C)(C)C)ccc1OCc1ccccc1 5379619 WDHKUZUOMSURJO-LPYMAVHISA-N 383.448 2.639 50 40 GFGB CC(C)(C)NNC(=O)/C(=C\c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1 16957814 NYXYILHCWMNLJS-GHRIWEEISA-N 382.420 2.785 50 40 GFGB C/C(=N\NC(=O)CN(c1ccc(C)cc1C)S(C)(=O)=O)c1cccs1 20208095 XJKFYWILTTUDNU-NBVRZTHBSA-N 379.507 2.671 50 40 GFGB Cc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(Cl)cc3)CC2=O)c(C)c1 408639081 FCVHJKZHGBAANL-HNNXBMFYSA-N 385.851 2.771 50 40 GFGB Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccco2)c2ccccc2)cc1 408776096 LQYOZLCBSCRZJT-KGENOOAVSA-N 397.456 2.934 50 40 GFGB COc1cccc(/C=N/NC(=O)C(=O)Nc2cccc(Cl)c2C)c1OC 59483759 KEJZLGXBBNHEIM-KEBDBYFISA-N 375.812 2.754 50 40 GFGB O=C(CP(=O)(c1ccccc1)c1ccccc1)N/N=C/c1ccc([N+](=O)[O-])o1 1101618 MGCQRMRMKHUZBN-DEDYPNTBSA-N 397.327 2.652 50 40 GFGB Cc1cccc(C(=O)N[C@H](C(=O)NNC(=O)c2cccc(Cl)c2)C(C)C)c1 2651417 JKSRBMAFUBLFOD-KRWDZBQOSA-N 387.867 2.864 50 40 GFGB O=C(Oc1ccc(/C=N/NC(=O)[C@@H]2COc3ccccc3O2)cc1)c1ccco1 1092635 MHLGFPXTIIQACD-OZNZCJATSA-N 392.367 2.789 50 40 GFGB Cc1ccc(S(=O)(=O)NC(=O)C2=CN(Cc3ccccc3)C=C(C#N)C2)cc1 3186029 OXRKLOPKOSZWOO-UHFFFAOYSA-N 393.468 2.997 50 40 GFGB COc1cccc(/C=N\NC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3)C2)c1OC 409151955 IIHKHRRDNQJSMQ-YSUUHWHMSA-N 381.432 2.515 50 40 GFGB O=C(Nc1cccc(S(=O)(=O)N2CCOCC2)c1)[C@H](Cl)c1ccccc1 3885965 MOHCKELCHPJLFH-QGZVFWFLSA-N 394.880 2.626 50 40 GFGB COc1cc(/C=N/NC(=O)C(=O)Nc2c(C)cccc2C)cc(Cl)c1O 409257332 ODBOSOGMBABXRU-AWQFTUOYSA-N 375.812 2.760 50 40 GFGB CC1=NN(c2ccccc2)C(=O)[C@@H]1/C=N/NC(=O)COc1ccc(Cl)cc1 408741760 RXTYEHBIWJIFFD-LASGFXPTSA-N 384.823 2.860 50 40 GFGB COc1cc(Br)cc(/C=N/NC(=O)c2ccc(C#N)cc2F)c1O 408968841 ZQIPRTRPPXGKNN-DNTJNYDQSA-N 392.184 2.938 50 40 GFGB CN1/C(=C(\C#N)C(=O)CN2CCN(Cc3ccccc3)CC2)Nc2ccccc21 104030095 VUBXBJBYEQKFJM-FCDQGJHFSA-N 387.487 2.670 50 40 GFGB CC(C)N1CCC2(CC1)[C@H]1CN(C(C)C)CC=C1C(C#N)=C(N)C2(C#N)C#N 2258919 GSBXUCSUBRRWMB-IBGZPJMESA-N 378.524 2.527 50 40 GFGB CCOc1ccc(N2C[C@H](C(=O)N/N=C/c3ccc(OC)cc3)CC2=O)cc1 4113489 JGLYBNFSFVSHRS-QLPFJNHISA-N 381.432 2.597 50 40 GFGB O=C(COc1cccc2cccnc12)NNC(=S)NCCCc1ccccc1 408586629 PJEPZEMYUAZEBR-UHFFFAOYSA-N 394.500 2.742 50 40 GFGB O=C(Cc1ccc2c(c1)OCO2)N/N=C/c1cc(Br)ccc1O 409149599 KVPWAVKFKGWVRI-QGMBQPNBSA-N 377.194 2.576 50 40 GFGB CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1cccc(F)c1)C(C#N)=C(N)C2(C#N)C#N 664262 VAIFQJDSWFLXHA-WMZOPIPTSA-N 391.406 2.708 50 40 GFGB CCOC(=O)C1=C(CCl)OC(N)=C(C#N)[C@H]1c1cc(OC)ccc1OC 1480502 AOWYPPRUOCIDKY-OAHLLOKOSA-N 378.812 2.567 50 40 GFGB COC(=O)COc1c(Cl)cc(/C=N/NC(=O)c2ccc(F)cc2)cc1OC 8812107 VNUCRPYSKZPYMJ-ZVBGSRNCSA-N 394.786 2.803 50 40 GFGB CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(Cl)nc1SC 79054552 IZRQMZUCNYJLNG-UHFFFAOYSA-N 395.868 2.696 50 40 GFGB O=C(COc1ccccc1-c1ccccc1)NNC(=O)c1cnn(CCCl)c1 84562866 LZJOPESDHRQRDQ-UHFFFAOYSA-N 398.850 2.629 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(C)c(OC)c1 408906692 DGAPCDCDLULAAL-OVBDPADQSA-N 383.448 2.811 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccs1)c1cccc2ccccc12 20214955 QSLGAJBPVQKJEU-XDHOZWIPSA-N 387.486 2.818 50 40 GFGB COc1ccc(SCC(=O)N/N=C\c2ccc(N3CCOCC3)cc2)cc1 409086265 GQJZAJFLYRICKT-STZFKDTASA-N 385.489 2.774 50 40 GFGB Cc1cccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCc3ccncc3)c2C)c1 408969530 PJPWGYCGEFDRNF-AFUMVMLFSA-N 389.459 2.564 50 40 GFGB CCCn1nc(C(=O)N/N=C/c2ccc(N(C)C)cc2)c2ccccc2c1=O 6407751 XIPQDZZJHGEQQZ-HYARGMPZSA-N 377.448 2.636 50 40 GFGB COc1ccccc1C(=O)N/N=C/c1cc(Br)c(O)c(OC)c1 1009466 YXFCBQVTCCPCSD-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB Cc1cccc(N2C[C@H](C(=O)NNC(=O)c3ccc(Cl)cc3)CC2=O)c1C 7882395 CRSWLECZZBCILI-OAHLLOKOSA-N 385.851 2.771 50 40 GFGB CCOC(=O)/C(C#N)=C\c1ccc(-c2cc(C(=O)OC)cc(C(=O)OC)c2)o1 252479689 BKAYIUOTCOEDQC-GDNBJRDFSA-N 383.356 2.990 50 40 GFGB N#C/C(=C/c1ccc(OCc2cccc(C(=O)O)c2)c(Cl)c1)C(=O)NC(N)=O 409238993 YDJJSRXEEKYNLU-NSIKDUERSA-N 399.790 2.719 50 40 GFGB Cc1cccc2cc(C#N)c(SCC(=O)NNC(=O)Cc3ccccc3)nc12 976432 LIEUHXWDMHTRTE-UHFFFAOYSA-N 390.468 2.897 50 40 GFGB COc1cccc(C(=O)N/N=C(\C)CC(=O)Nc2ccc3c(c2)OCCO3)c1 4697803 KYSFDZSJTTUQOD-LPYMAVHISA-N 383.404 2.601 50 40 GFGB O=C(CCc1ncc(-c2ccc(F)cc2F)o1)NNC(=O)c1ccccc1O 10125744 HPCPZNMGNQINDR-UHFFFAOYSA-N 387.342 2.719 50 40 GFGB Cc1ccc(CN(C)C(=O)CSC2=C(C#N)C(C)(C)[C@H](C#N)C(=O)N2)cc1 5297666 QGSVXBMPQCDETF-OAHLLOKOSA-N 382.489 2.718 50 40 GFGB Cc1ccc(NC(=O)/C(C#N)=C/c2ccc3c(c2)n(C)c(=O)n3C)c([N+](=O)[O-])c1 408890868 HQUJDHHPLBQTED-NTEUORMPSA-N 391.387 2.639 50 40 GFGB C=CCn1c(SCC(=O)NNC(=O)c2ccccc2F)nc2ccccc21 11650848 SBDBIMIELOLKTC-UHFFFAOYSA-N 384.436 2.915 50 40 GFGB CC(=O)Oc1ccc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)cc1 1052157 RYDBBCOVVRYCRX-VXLYETTFSA-N 387.417 2.904 50 40 GFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)c2ccc(O)cc2O)cc1Cl 100809357 QOIPGEMLWKMVRU-UFFVCSGVSA-N 391.811 2.894 50 40 GFGB CN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(C=C(C#N)C#N)cc2)cc1 3270780 BNRSPWVOGROSPB-UHFFFAOYSA-N 380.429 2.620 50 40 GFGB CCc1cc2ccc(OC)cc2nc1SCC(=O)NNC(=O)c1ccco1 4849395 WHCXODUYXLVMBF-UHFFFAOYSA-N 385.445 2.952 50 40 GFGB C/C(=N\NC(=O)CC1(C)OCCO1)c1cccc(NC(=O)c2ccccc2)c1 6295496 KVENGZQUTWAMAE-HZHRSRAPSA-N 381.432 2.932 50 40 GFGB COc1ccccc1NCC(=O)NNC(=O)CCc1ncc(-c2ccccc2)o1 12736324 KUJSNAGIIXOMOL-UHFFFAOYSA-N 394.431 2.542 50 40 GFGB COc1cc(/C=N/NC(=O)c2cccc(Br)c2)cc([N+](=O)[O-])c1O 36245306 VYLHWZFVLBQQGH-CAOOACKPSA-N 394.181 2.835 50 40 GFGB CC(C)(C)c1ccc(OCCN2C(=O)/C(=N\NC(N)=O)c3ccccc32)cc1 46084830 GLJIPHRQTVGAMQ-NKFKGCMQSA-N 380.448 2.782 50 40 GFGB COc1ccccc1C(=O)N/N=C/c1cc2c(cc1Br)OCCO2 79047008 OYFJUCSRCCKPBJ-VXLYETTFSA-N 391.221 2.993 50 40 GFGB COc1ccc(CC(=O)N/N=C(\C)CC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 100923059 OYSNKUYRQBUJNK-FYJGNVAPSA-N 384.392 2.667 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C\[C@@H]2C(=O)N(c3ccccc3)N=C2C)cc1 408812984 CMQNXYXIEZBVSB-PGNDWZGLSA-N 388.427 2.800 50 40 GFGB C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cc1ccccc1F 8242882 DWIAAUJLPYBUEC-LLVKDONJSA-N 395.228 2.746 50 40 GFGB CCc1ccc2c(CC(=O)NNC(=O)[C@H]3COc4ccccc4O3)coc2c1 12814366 MJDNVMLZDNRKIV-LJQANCHMSA-N 380.400 2.525 50 40 GFGB Cc1ccc(OCC(=O)N/N=C\c2cc3c(cc2Cl)OCO3)c([N+](=O)[O-])c1 30738243 PSVDHLVHJYFEEQ-GXHLCREISA-N 391.767 2.814 50 40 GFGB COCCNC(=O)/C(C#N)=C\c1cn(Cc2ccccc2)nc1-c1cccnc1 96663173 IBUTWUWWQBHJSN-UNOMPAQXSA-N 387.443 2.663 50 40 GFGB CCOC(=O)COc1c(Cl)cc(/C=C(/C#N)C(=O)NC(C)C)cc1OC 408772878 SEPZHQYWDIUJST-MLPAPPSSSA-N 380.828 2.722 50 40 GFGB COc1ccc(NC(=O)N/N=C\c2ccc(OCC(=O)O)c(Cl)c2)cc1 408852728 VUFHFBCLHKDYFJ-OCKHKDLRSA-N 377.784 2.968 50 40 GFGB CCOC(=O)/C(C#N)=C/c1c(C)nn(-c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1C 408995441 AAHKXLQUOUPVKA-KPKJPENVSA-N 385.336 2.776 50 40 GFGB CCOc1ccc(C(=O)N/N=C\c2cccc(OCC(=O)O)c2)cc1OCC 409312212 KEVBNFPMIAXTQQ-MTJSOVHGSA-N 386.404 2.711 50 40 GFGB COc1cc(OC)c(OC)cc1/C=C(\C#N)C(=O)Nc1ccc([N+](=O)[O-])cc1O 5020852 INVSUUGQNRHFIX-WUXMJOGZSA-N 399.359 2.872 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2cc3c(cc2Cl)OCO3)cc1OC 5745532 XMORNWDDLVGUBE-AWQFTUOYSA-N 376.796 2.779 50 40 GFGB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C/NNC(=O)c1ccccc1[N+](=O)[O-] 16672021 KSSLVNHMQVGJME-GZTJUZNOSA-N 393.403 2.753 50 40 GFGB C/C(NNC(=O)C1CC1)=C1/C(=O)N(c2ccc(F)cc2)N=C1c1ccccc1 112120319 PQIWTMQXWGOPOU-AQTBWJFISA-N 378.407 2.881 50 40 GFGB CC(=O)NNC(=O)CSc1ncnc2scc(-c3ccc(F)cc3)c12 882443 XZFXJVHCEQTTKA-UHFFFAOYSA-N 376.438 2.757 50 40 GFGB O=C1NC[C@@H](c2ccccc2)[C@H]1C(=O)N/N=C/c1c(Cl)cccc1Cl 4322483 UDIGMDRWTCTARS-WCVVFRIDSA-N 376.243 2.973 50 40 GFGB O=C(COc1ccc2c(c1)CCCC2)NCC(=O)N/N=C/C=C/c1ccccc1 4700079 BRRJXYCZZMKKTG-HQUXDSKKSA-N 391.471 2.876 50 40 GFGB COc1ccc(NC(=O)C(=O)N/N=C/c2c(O)ccc3ccccc23)c(OC)c1 4702997 SNUHHYQYAODLFF-WSDLNYQXSA-N 393.399 2.651 50 40 GFGB COC(=O)c1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)n(CC(C)C)n1 253401159 MNXVUJGKBWVHOA-KRWDZBQOSA-N 398.463 2.777 50 40 GFGB O=C(CSc1nnc(NC2CCCCC2)s1)NNC(=O)c1cccs1 6602972 ZDBZKJCEHIBBFM-UHFFFAOYSA-N 397.551 2.898 50 40 GFGB COc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)c(OC)c1 409156136 SBQVHKPQIIRWHM-UXHMZNKVSA-N 395.459 2.824 50 40 GFGB Cc1cc(/C=N\NC(=O)c2ccccc2O)c(C)n1NC(=O)c1ccccc1 409212516 QHAYOMIRWAONSV-XKZIYDEJSA-N 376.416 2.958 50 40 GFGB O=C(Oc1ccc(/C=N\NC(=O)[C@H]2COc3ccccc3O2)cc1)c1ccco1 32110864 MHLGFPXTIIQACD-JJUBJSHISA-N 392.367 2.789 50 40 GFGB COc1ccc(C(=O)NNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1OC 32967454 MVBLTSCNONUMBW-UHFFFAOYSA-N 392.839 2.976 50 40 GFGB COc1cc([C@H]2ON=C(C(=O)N/N=C/c3ccc(F)cc3)[C@H]2C)cc2c1OCO2 15085854 NOLSIEJLPQXROM-ZFKZHXNTSA-N 399.378 2.777 50 40 GFGB C[C@@H](c1ccccc1)N1C[C@@H](C(=O)NNC(=O)c2ccccc2Cl)CC1=O 7882209 SRGBESVPXQQIAY-ZFWWWQNUSA-N 385.851 2.711 50 40 GFGB Cc1cc(Br)ccc1OCC(=O)NNC(=O)c1ccc(F)cc1 675504 IDMNICNKHOUKGS-UHFFFAOYSA-N 381.201 2.737 50 40 GFGB COc1cc(OC)c2cc(C(=O)N/N=C/c3cccc(OC)c3OC)[nH]c2c1 2212912 CMIXTASPNYHTBH-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB O=C(CSc1nnc(NC2CCCCC2)s1)NNC(=O)c1ccccc1 3373918 VTMMZHBKKIPJGU-UHFFFAOYSA-N 391.522 2.836 50 40 GFGB CCn1c(C(=O)NNC(=O)c2cc(Br)cn2C)cc2ccccc21 65521503 VSJCBPMQNLOEPD-UHFFFAOYSA-N 389.253 2.837 50 40 GFGB CC(=O)N1CCC(CCC(=O)NNC(=O)CSc2ccc(Cl)cc2)CC1 72302671 JFRIPHKJQIZXEM-UHFFFAOYSA-N 397.928 2.618 50 40 GFGB Cc1nn(-c2ccccc2)c(C)c1/C=N/NC(=O)Cn1ccc(C(F)(F)F)n1 9642607 MNIXFOLCZOZHCY-LSHDLFTRSA-N 390.369 2.855 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)Nc2cc(C)cc(C)c2)ccc1OCC(N)=O 863554 CNEWDYYOWLXFIA-CXUHLZMHSA-N 379.416 2.722 50 40 GFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C(C)(C)C)c32)ccc1OC(C)=O 5408081 NJMYTCRSGNBMCG-OAHLLOKOSA-N 382.420 2.859 50 40 GFGB CCc1cc2c(=O)n(CC(=O)N/N=C/c3c(F)cccc3Cl)cnc2s1 1784420 LXMIDXPMUDDCGN-QPSGOUHRSA-N 392.843 2.963 50 40 GFGB COc1cccc([C@H]2C(C#N)=C(N)Oc3cc(C)n(C[C@H]4CCCO4)c(=O)c32)c1 1476101 FTIQCCNOWCXKQZ-APWZRJJASA-N 393.443 2.563 50 40 GFGB C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CC1(C(=O)O)CCCCCC1 13255488 XPYAHEWALSXXTD-ZDUSSCGKSA-N 380.416 2.556 50 40 GFGB O=C(COc1cccc(Br)c1)N/N=C\c1cc([N+](=O)[O-])ccc1O 38193970 PBCPQUIGNUOUHG-IUXPMGMMSA-N 394.181 2.592 50 40 GFGB Cc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C\c2ccc(C(C)C)cc2)cc1 39986591 BMDCMFHXWUBRMW-BKUYFWCQSA-N 387.505 2.889 50 40 GFGB C/C(=N\NC(=O)CN(c1cccc(C)c1C)S(C)(=O)=O)c1cccs1 408926451 TZYSDOABNPOJCM-NBVRZTHBSA-N 379.507 2.671 50 40 GFGB Nc1nnc(CC(=O)N/N=C/c2cccc(OCc3ccc(F)cc3)c2)s1 1242996 SFQOVDKIDFXNOS-UFFVCSGVSA-N 385.424 2.531 50 40 GFGB CC(C)(C)c1ccc2c(c1)O[C@@H](C(=O)N/N=C1/C(=O)Nc3ccccc31)CO2 5669467 FPXYCULZQIESCM-QGZVFWFLSA-N 379.416 2.597 50 40 GFGB Cn1c(CC(=O)NNC(=O)CCCc2c[nH]c3ccccc23)nc2ccccc21 6423712 UBUPFUSTJPFFRQ-UHFFFAOYSA-N 389.459 2.767 50 40 GFGB Cc1ccc(C(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)o1 9689737 YTOFYXMOAGAQTI-UHFFFAOYSA-N 387.399 2.911 50 40 GFGB NNC(=O)c1ccc(CN(Cc2ccccc2)S(=O)(=O)c2ccccc2)cc1 12505417 NNDATWSEMTYALA-UHFFFAOYSA-N 395.484 2.681 50 40 GFGB Cc1cccc([C@@H]2C(C#N)=C(N)OC3=C2S(=O)(=O)N(C)c2ccccc23)c1 20558351 NBNSAFGSFSRWOF-QGZVFWFLSA-N 379.441 2.951 50 40 GFGB COc1ccc(C(=O)NNc2nc(C)cc(C)n2)cc1OCc1ccncc1 31896434 OGRAOANLGGFSOL-UHFFFAOYSA-N 379.420 2.833 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C/c2ccc(OC)c(OC)c2)c(OC)c1 408870777 WWOSPWDPWULSLJ-CXUHLZMHSA-N 382.416 2.944 50 40 GFGB C[C@@H]1CCc2c(sc3ncn(CC(=O)N/N=C/c4cccs4)c(=O)c23)C1 1783504 NAJHPBISLHDWPY-VNQCRBAESA-N 386.502 2.795 50 40 GFGB C[C@H]1CCc2c(C(=O)NNC(=O)[C@@H]3[C@@H](C(=O)O)[C@H]4C=C[C@H]3CC4)csc2C1 102220624 IUKBUXKYOYNLOF-BKDCYOLVSA-N 388.489 2.547 50 40 GFGB Cc1ccccc1C(=O)NNC(=O)C1CCN(C(=O)Nc2ccccc2)CC1 12853049 MBJGRZUGBPOJOQ-UHFFFAOYSA-N 380.448 2.700 50 40 GFGB CCOC(=O)COc1ccc(/C=N/NC(=O)COc2ccccc2Cl)cc1 408916731 YWUNATRJCINQCL-SRZZPIQSSA-N 390.823 2.811 50 40 GFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1Br)[C@H](O)c1ccccc1 408591195 RXFYBFBXAFQXMV-IREQLNLFSA-N 378.182 2.541 50 40 GFGB CN1C(=O)/C(=C(/C#N)C(=O)Nc2cccnc2)c2cc(Br)ccc21 409121648 XPRMLFLPEHDDBM-SQFISAMPSA-N 383.205 2.736 50 40 GFGB COc1ccccc1[C@@H]1C(C#N)=C(N)OC2=C1S(=O)(=O)N(C)c1ccccc12 20558297 KXNBJQHMKCLDLA-QGZVFWFLSA-N 395.440 2.651 50 40 GFGB CCOc1cc(/C=N\NC(=O)N/N=C/c2ccc(O)c(OCC)c2)ccc1O 103293499 RPHOHFJYJKFTJR-WELBJSHPSA-N 386.408 2.562 50 40 GFGB COc1ccc(/C=N/NC(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)cc1 409007166 ULFJNIYXXQOVNA-OEAKJJBVSA-N 383.423 2.837 50 40 GFGB CCOc1ccc(NC(=O)CCC(=O)NNC(=O)c2ccccc2Cl)cc1 4550989 CKGZPXFIWHSNGU-UHFFFAOYSA-N 389.839 2.919 50 40 GFGB C#CCN1C(=O)/C(=N\NC(=O)COc2cc(C)c(Cl)c(C)c2)c2ccccc21 18192945 DTCSGZDNMCCTKD-GFMRDNFCSA-N 395.846 2.836 50 40 GFGB COc1ccc(Br)cc1/C=N/NC(=O)[C@H]1COc2ccccc2O1 835616 FQUWLVOYGLDXAP-LEKRSAHOSA-N 391.221 2.748 50 40 GFGB O=C(CC(=O)N/N=C/c1ccc(Br)cc1)NCCc1ccccc1 59516032 LNPMHLNDCVMBPY-FYJGNVAPSA-N 388.265 2.648 50 40 GFGB C/C(=N\NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccc(-n2ccnc2)cc1 9097158 RXTCIEIMSZEPCT-UDWIEESQSA-N 394.347 2.843 50 40 GFGB COc1cc2c(cc1/C=N\NC(=O)c1cccc(Br)c1)OCO2 409071103 NHSCWZFCDLUPTP-LSCVHKIXSA-N 377.194 2.950 50 40 GFGB Cc1cc2c(c(=O)n1Cc1cccnc1)[C@@H](c1cccs1)C(C#N)=C(N)O2 17359847 QPTAUHWRVUFYIB-QGZVFWFLSA-N 376.441 2.880 50 40 GFGB Cc1cccc(/C=N/NC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1 19682761 VOCMQDLLOKJBOV-OEAKJJBVSA-N 384.911 2.916 50 40 GFGB Cc1ccc(NCC(=O)NNC(=O)c2ccc(Br)cc2F)cc1 12641067 WPEAHYVCCWXMNR-UHFFFAOYSA-N 380.217 2.770 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)N[C@@H](C)COC)cc(Br)c1OC 6510269 CNQDGLYTJLUNFO-HOVAHTAHSA-N 397.269 2.914 50 40 GFGB O=C(N/N=C/c1ccco1)c1ccc(S(=O)(=O)N2CCCCCC2)cc1 1470002 IPRZEGKJODFWIH-XMHGGMMESA-N 375.450 2.608 50 40 GFGB CN(CCCC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)OC(C)(C)C 58112550 AOPQIKNTRXYZAA-UHFFFAOYSA-N 393.528 2.997 50 40 GFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1cccc([N+](=O)[O-])c1)c1ccccc1 408979244 LRSWUXZJUSUFQI-NNIWKIFQSA-N 384.392 2.922 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)N[C@H](C)c2ccccc2)ccc1OCC(=O)O 9434912 RHHMJYXLNQUGGX-NGWPFTMJSA-N 380.400 2.943 50 40 GFGB Cc1ccc(/C=N/NC(=O)CN(c2cccc(Cl)c2C)S(C)(=O)=O)cc1 408788825 ICRKKHGDUGDJCI-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB CC(C)[C@@H](NC(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1c[nH]c2ccccc12 32720221 HPCAPJCQUIZKIK-GOSISDBHSA-N 396.422 2.523 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccncc2)ccc1Oc1ccc([N+](=O)[O-])cn1 845849 VUBVBFKIRGRGAP-SSDVNMTOSA-N 393.359 2.950 50 40 GFGB COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(C)n(C[C@H]3CCCO3)c(=O)c21 2246980 QVSCHRZXAANOFC-AUUYWEPGSA-N 393.443 2.563 50 40 GFGB COc1ccc(S(=O)(=O)/C(C#N)=C/N2CCN(c3ccccc3)CC2)cc1 6672709 IVXINXRMJNDERR-CAPFRKAQSA-N 383.473 2.656 50 40 GFGB Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)NNC(=O)c3ccccn3)c12 40142855 QBJYKXRRLKFJOZ-UHFFFAOYSA-N 392.463 2.842 50 40 GFGB CC(C)Oc1ccc(C(=O)NNC(=O)c2ccccc2N(C)C(=O)C2CC2)cc1 40143915 PKKJWVKXASDKKX-UHFFFAOYSA-N 395.459 2.921 50 40 GFGB N#CCCCN1C(=O)/C(=N\NC(=O)c2cc(Cl)ccc2O)c2ccccc21 100455415 TUCPKVIKPOCZJS-XLNRJJMWSA-N 382.807 2.830 50 40 GFGB N#CC1=C(SCC(=O)Nc2ccc(C(=O)O)cc2)NC(=O)C[C@H]1c1ccco1 3336186 RDLJOOFXRMOICK-CYBMUJFWSA-N 397.412 2.688 50 40 GFGB C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)COc1ccc(C#N)cc1 6787431 MZQOIRPURNKRDP-OAHLLOKOSA-N 389.411 2.705 50 40 GFGB Cc1ccccc1Nc1ccc(C(=O)O)cc1/C=N/NC(=O)C(=O)NCC(C)C 408709311 ZHUYXXAKJKIDGK-FSJBWODESA-N 396.447 2.659 50 40 GFGB COc1cccc(/C=N/NC(=O)C(=O)Nc2ccccc2Br)c1 59435813 HIWHUERHRCWRTI-VCHYOVAHSA-N 376.210 2.547 50 40 GFGB CCOc1ccc(C(=O)NNC(=O)c2ccc(OC[C@@H]3CCCO3)cc2)cc1 28701259 NKHKPSJYFGKISS-IBGZPJMESA-N 384.432 2.718 50 40 GFGB Cc1cc(C(=O)N/N=C/c2cc(Br)c(Br)o2)[nH]n1 4059951 YLPQJKXIRFJQKJ-YIXHJXPBSA-N 376.008 2.600 50 40 GFGB Cc1cccc(NC(=O)NN(C)C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1 95946371 VGHCPCDSPPYZFC-UHFFFAOYSA-N 391.472 2.636 50 40 GFGB Cc1cccc(/C=N/NC(=O)CN(c2cc(Cl)ccc2C)S(C)(=O)=O)c1 408772873 SDDKZZDGPLXQNU-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB N#C/C(=C\c1ccc(OCC(=O)N2CCCC2)cc1)C(=O)NCc1ccccc1 409168648 NORCYHOEFXPVAC-XSFVSMFZSA-N 389.455 2.911 50 40 GFGB C[C@H](C(=O)N/N=C/c1ccc(Cl)cc1)N(c1ccccc1)S(C)(=O)=O 408906546 HAFYQWBYKXPFAB-KZKLBEMASA-N 379.869 2.645 50 40 GFGB O=C1N=C(S)N(C2CC2)C(=O)/C1=C\c1ccc2c(c1)CCN2CCCCl 2591393 OZVJFSDUSSGCSJ-PTNGSMBKSA-N 389.908 2.878 50 40 GFGB C/C(CC(C)(C)N=C=S)=N/N1C(=O)[C@H](C)N2C(=S)NC(C)(C)C[C@]12C 5533054 KQSJLFGAGPZNPJ-RBFXFXTBSA-N 381.571 2.940 50 40 GFGB CC(C)(C)c1ccc2c(c1)O[C@@H](C(=O)N/N=C\c1ccc(O)c([N+](=O)[O-])c1)CO2 30702434 YWCZBTOYUSTUHS-BYSCUOHCSA-N 399.403 2.888 50 40 GFGB CCOC(=O)[C@]1(C)C/C(=N\NC(=O)c2ccccc2)C(=O)N1c1ccccc1 100207709 KMXFPBOEFUXVNU-LXDMNWQESA-N 379.416 2.531 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C(=O)OCC)cc2)cc1 59434148 OHCXEEUKLZZTTI-HYARGMPZSA-N 395.415 2.517 50 40 GFGB O=C(Cc1ccc(Cl)cc1)N/N=C/c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O 57476923 GFWQIVRZHYNKJM-CAOOACKPSA-N 378.728 2.555 50 40 GFGB O=C(COc1ccc(/C=N\NC(=O)c2ccco2)cc1)NCc1ccccc1 58883161 UCXXBZSHLXPBNM-UCQKPKSFSA-N 377.400 2.739 50 40 GFGB C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=S)NC(=O)c1ccco1 2751869 QKKQANBQYRPLBU-GFCCVEGCSA-N 383.429 2.536 50 40 GFGB CNC(=O)C(=O)N/N=C/c1cc(Br)ccc1Nc1ccccc1F 408708326 PEXFKZFLLKVKPW-AWQFTUOYSA-N 393.216 2.528 50 40 GFGB CS(=O)(=O)[C@@H](I)[C@H](O)c1ccc(Cl)cc1Cl 96519205 LDWMBHUCMDRACG-RKDXNWHRSA-N 395.045 2.833 50 40 GFGB O=C(CN(CCc1ccccc1)S(=O)(=O)c1ccccc1)NN=C1CCCC1 16479142 LKHYKWHKLAVFGE-UHFFFAOYSA-N 399.516 2.966 50 40 GFGB Cc1ccccc1C(=O)N1CCC(C(=O)NNc2ccccc2[N+](=O)[O-])CC1 33026390 HICAGCMLPRGEDN-UHFFFAOYSA-N 382.420 2.899 50 40 GFGB O=C1CCC/C(=N/NC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1 103460176 BFARDUOHLLOLJW-PYCFMQQDSA-N 388.431 2.617 50 40 GFGB CCNC(=O)/C(C#N)=C/c1c(Oc2ccccc2F)nc2c(C)cccn2c1=O 3644224 FEDUOHVQWPYFDC-SDNWHVSQSA-N 392.390 2.977 50 40 GFGB NS(=O)(=O)c1ccc(N/C=C(/C=O)c2nc3cc(Cl)ccc3o2)cc1 5589140 GOZCIWHZHRXFJN-NTMALXAHSA-N 377.809 2.781 50 40 GFGB COc1ccccc1NCC(=O)NNC(=O)C(C)(C)Oc1ccc(Cl)cc1 12534342 HHDBAHWLHPGOSE-UHFFFAOYSA-N 391.855 2.766 50 40 GFGB N#C/C(=C\c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1)C(=O)N1CCOCC1 12955557 CHODXLNIJWFDOT-RVDMUPIBSA-N 380.360 2.548 50 40 GFGB CN(CCCNC(=O)NNC(=O)c1cn(C)c2ccccc12)c1ccccc1 32795488 RGHMXBPEDIXPNP-UHFFFAOYSA-N 379.464 2.649 50 40 GFGB COc1cc(OC)cc(C(=O)N/N=C\c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 33735688 NKNCMNZKKSAOIO-BKUYFWCQSA-N 398.419 2.976 50 40 GFGB CCOC(=O)[C@H](C(C)=O)[C@@H](c1cccc(Cl)c1)[C@@H](C#N)C(N)=C(C#N)C#N 78547487 SJRRGLZPTOMYCZ-ZACQAIPSSA-N 384.823 2.592 50 40 GFGB I[C@H]1CC[C@H]2O[C@H]1CC[C@@H]2I 104262699 JGRCXIKSKJDSQB-DKXJUACHSA-N 377.991 2.935 50 40 GFGB N#CC1=C(N)SC(N)=C(C#N)C1c1cccc(I)c1 857430 HHORIXLYBARJKW-UHFFFAOYSA-N 380.214 2.509 50 40 GFGB O=C(CCCNC(=O)c1ccc(Cl)cc1)NNC(=O)c1ccc(Cl)cc1 8768698 TZWCTYJLSREDTN-UHFFFAOYSA-N 394.258 2.965 50 40 GFGB CCc1sc(C(=O)NNC(=O)C2CCN(C(=O)c3ccco3)CC2)cc1C 12676272 HCRMRTWDMCFUEP-UHFFFAOYSA-N 389.477 2.525 50 40 GFGB C/C(=N\NC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1cccnc1 6581707 YATCQLLAFWPDIT-PCLIKHOPSA-N 397.438 2.994 50 40 GFGB O=C(O)CN1C(=O)/C(=N/NC(=O)c2ccc(Cl)cc2Cl)c2ccccc21 19831057 JERGMFCXRZTYKY-HMMYKYKNSA-N 392.198 2.559 50 40 GFGB CC[C@@H](C)NC(=S)NNC(=O)c1cc(C2CC2)nc2c1c(C1CC1)nn2C 17078979 GFKODDKRVTYXDB-SNVBAGLBSA-N 386.525 2.631 50 40 GFGB COc1cc2c(cc1/C=N/NC(=O)c1cc3cc([N+](=O)[O-])ccc3o1)OCO2 408965935 XSZSJVFUQIGWKM-UFWORHAWSA-N 383.316 2.842 50 40 GFGB CS(=O)(=O)Nc1cc(C(=O)NNc2ccc(F)c(F)c2)ccc1Cl 1648232306 PGIVGWRABGBFGV-UHFFFAOYSA-N 375.784 2.747 50 40 GFGB C/C(N)=C(\C#N)C(=O)CSc1nnc(-c2cccs2)n1C[C@@H]1CCCO1 104714820 HIYFMIRAQGVHEO-KLDSGFLGSA-N 389.506 2.603 50 40 GFGB Cc1ccc(/C=N/NC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)s1 19861414 OQGHVBXOWVQTKG-CIAFOILYSA-N 390.940 2.978 50 40 GFGB COc1ccc(CC(=O)N/N=C(\C)CC(=O)Nc2ccc3c(c2)OCCO3)cc1 100522805 HILAANMCGYQMLW-OEAKJJBVSA-N 397.431 2.530 50 40 GFGB N#CC1=C(N)SC(N)=C(C#N)C12C(=O)N(CCc1ccccc1)c1ccccc12 664189 XOZSJWTYRBIEGD-UHFFFAOYSA-N 399.479 2.648 50 40 GFGB CCn1ncc(C(=O)NNC(=O)c2cccc(OC(F)(F)C(F)F)c2)c1C 2761375 BPSUGYXGIAFGFK-UHFFFAOYSA-N 388.321 2.523 50 40 GFGB CCc1ccc(/C=N/NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 3470333 YFXFREAHOUCSEH-RCCKNPSSSA-N 385.489 2.797 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2cc(Cl)cc([N+](=O)[O-])c2O)cc1OC 4735411 WWFQKDZPXFUIAA-DJKKODMXSA-N 393.783 2.664 50 40 GFGB COc1cc(Cl)c(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)cc1OC 408587460 GBQMKEBBMJSYQY-ODCIPOBUSA-N 391.811 2.648 50 40 GFGB Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1ccc(Cl)c(Cl)c1 8710089 AAHBJWNIXADYIT-UHFFFAOYSA-N 399.259 2.573 50 40 GFGB O=C(COc1cccc(Cl)c1)NNC(=S)NCCCc1ccccc1 408586234 MSCJUWGKWOQKSI-UHFFFAOYSA-N 377.897 2.847 50 40 GFGB C#CCOc1c(Cl)cc(/C=C(\C#N)C(=O)NCCCOC)cc1OCC 408808393 GDRJCSGIZVBHCM-XNTDXEJSSA-N 376.840 2.810 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2cccc(Cl)c2)S(C)(=O)=O)cc1 19954444 MGWVFKRIMCFHAG-YBFXNURJSA-N 379.869 2.565 50 40 GFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(O)c(Br)c1 110133821 HHODULOGHPURHV-MFOYZWKCSA-N 378.182 2.756 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccsc3)[C@@H]2C1 4452858 KUQNRDWGSIFKAO-HZPDHXFCSA-N 379.445 2.630 50 40 GFGB Cc1ccc(C(=O)NNC(=S)NC(=O)C2CCCCC2)cc1Br 2551608 CLEYHGGEMVOQJV-UHFFFAOYSA-N 398.326 2.973 50 40 GFGB C=CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2ccc(C)c(C)c2[nH]c1=O 4131448 GDSBKCAFXPVDEM-GOSISDBHSA-N 391.427 2.956 50 40 GFGB C/C(=N\NC(=O)CN(c1c(C)cccc1C)S(C)(=O)=O)c1ccc(C)cc1 19955410 UOPZIBMYIOJYPM-HEHNFIMWSA-N 387.505 2.918 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccco1)c1ccc(Cl)c(Cl)c1 408922985 DFBDLLNDGMCDEK-CAOOACKPSA-N 390.248 2.503 50 40 GFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)C1CCN(C(=O)c2ccc(F)cc2)CC1 409007867 ZZWMJNANBOFOPG-LPYMAVHISA-N 398.394 2.736 50 40 GFGB O=c1n(-c2ccccc2)c(=O)n2n1[C@H]1C=C[C@@H]2C2=CC=CC=C1C2Br 105027331 ZMFZXYQHIADPFO-SJPCQFCGSA-N 396.244 2.652 50 40 GFGB COc1ccc(C(=O)NNC(=O)c2cc(OC)ccc2Br)cc1 3375769 FHWOMJNBNUMYQY-UHFFFAOYSA-N 379.210 2.541 50 40 GFGB COc1cc(OC)cc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)c1 18283771 VOCLVKNUZSKAKF-QGZVFWFLSA-N 375.384 2.763 50 40 GFGB CCOc1cc(/C=N/NC(=O)OC)ccc1OS(=O)(=O)c1ccccc1 408951451 IVQIWAIIXNQBGT-LDADJPATSA-N 378.406 2.543 50 40 GFGB O=C(CCCC[C@H]1CCSS1)NCCn1c(=O)c(=O)[nH]c2ccccc21 80336956 LJSIRYBWAMTTSH-ZDUSSCGKSA-N 393.534 2.520 50 40 GFGB O=C(NN[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1=O)c1ccc(Cl)cc1 857209 DMAGIWGHCDMFQH-CQSZACIVSA-N 378.215 2.560 50 40 GFGB Cc1cc(C)c(S(=O)(=O)N(C)CC(=O)N/N=C/c2ccc(F)cc2)c(C)c1 6606934 SYEQHGQLRKKXLL-SRZZPIQSSA-N 391.468 2.522 50 40 GFGB CCn1c(C)nc2cc(C(=O)N/N=C/c3ccc(N(C)CCO)cc3)ccc21 7894590 CCACEGLELHENCL-HYARGMPZSA-N 379.464 2.557 50 40 GFGB CCCOc1ccc(C(=O)NNC(=O)c2cnn(-c3ccccc3)c2)cc1OC 8022042 VRLXIUYSEVORJV-UHFFFAOYSA-N 394.431 2.745 50 40 GFGB C/C(=N\NC(=O)CN(c1cccc(C)c1)S(C)(=O)=O)c1ccc(Cl)cc1 20060339 SXXUIAWNXQHHNZ-XSFVSMFZSA-N 393.896 2.955 50 40 GFGB COc1ccccc1OCC(=O)N/N=C(\C)CC(=O)Nc1ccc(N(C)C)cc1 100310687 GDNOOPJQVQJKEJ-HZHRSRAPSA-N 398.463 2.661 50 40 GFGB COc1ccc(SCC(=O)N/N=C\c2ccc(O[C@H](C)C(=O)O)cc2)cc1 408853314 NIKPPCVYUNHXSX-RBFBNPFJSA-N 388.445 2.790 50 40 GFGB O=C(NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)O)C(c1ccccc1)c1ccccc1 6779941 GXJAMTYDNUGGRX-MSOLQXFVSA-N 380.444 2.857 50 40 GFGB COc1cc([C@@H]2ON=C(C(=O)N/N=C/c3ccccc3F)[C@@H]2C)cc2c1OCO2 15084049 FLWIMCMZBSHWSC-YITRBVBMSA-N 399.378 2.777 50 40 GFGB CC[C@@H]1CCc2sc(C(=O)NNS(=O)(=O)c3cccc(C#N)c3)cc2C1 7403058 HCQBLWFNQDRDEQ-GFCCVEGCSA-N 389.502 2.758 50 40 GFGB O=C(N/N=C\c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccc(Cl)cc1 28640873 QFQHFCJAZZPGDU-NDENLUEZSA-N 388.811 2.849 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C\c1c(F)cccc1Cl)C1CCCCC1 33737493 LSMXBWNAGBJUCK-GRSHGNNSSA-N 389.880 2.524 50 40 GFGB CCN(CC)c1ccc(/C=N/NC(=O)c2nn(C)cc2Br)cc1 1089144 SCXOIMFMZPFFKT-VCHYOVAHSA-N 378.274 2.793 50 40 GFGB CCOc1ncccc1C(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C 14304558 WABYDLWOXHGTBX-UHFFFAOYSA-N 378.432 2.963 50 40 GFGB Cc1ccc(-n2nc(C(=O)N/N=C\c3ccco3)c(C)c(C#N)c2=O)cc1Cl 409052126 GNEZMETWKSLJDW-YVNNLAQVSA-N 395.806 2.731 50 40 GFGB CCOC(=O)/C(C#N)=C/c1ccc(OS(=O)(=O)c2ccccc2)c(OC)c1 4550129 KLIGNXJGOLUXLH-RVDMUPIBSA-N 387.413 2.933 50 40 GFGB CCCCCCOc1ccc(C(=O)NNC(=O)CC[C@]2(C)CCC(=O)N2)cc1 95456798 UKIYQXYJYORXAI-NRFANRHFSA-N 389.496 2.856 50 40 GFGB COCCCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2ccc(C)c(C)c2)c1C 408997510 MTTHEWAJEPJDIE-OYKKKHCWSA-N 398.507 2.704 50 40 GFGB CC1=NN(c2ccccc2)C(=O)[C@@]12[C@@H](c1ccccc1)[C@@]2(C#N)C(N)=C(C#N)C#N 66089392 NQSUOEFTMHMRMG-VJBMBRPKSA-N 392.422 2.963 50 40 GFGB Cc1ccc(C(C)C)c(OCC(=O)NC(=S)NNC(=O)c2cccs2)c1 32118867 GKTMXAFWDSLHPX-UHFFFAOYSA-N 391.518 2.894 50 40 GFGB Cc1ccc(S(=O)(=O)Oc2ccccc2/C=N/NC(=O)c2cccnc2)cc1 3075215 HBQVXDWZMMDMKR-HYARGMPZSA-N 395.440 2.922 50 40 GFGB CCN(CC)C(=O)[C@@H](N)Cc1ccc(OC)c(N(CCCl)CCCl)c1 5839379 KTMGOKIBEXZNAD-HNNXBMFYSA-N 390.355 2.717 50 40 GFGB Cc1ccc(C(=O)NNC(=O)CCNC(=O)c2ccc(C(C)(C)C)cc2)cc1 6451291 NADISMQXNVHMNK-UHFFFAOYSA-N 381.476 2.874 50 40 GFGB C/C(NNC(=O)c1ccccc1)=C1/C(=O)N(c2ccccc2C)C(=O)N=C1O 9088673 ZCSVHRWSKDPFRP-SSZFMOIBSA-N 378.388 2.627 50 40 GFGB O=C(N/N=C\c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 34257906 POGDBLQDUHVBDT-NDENLUEZSA-N 388.811 2.849 50 40 GFGB O=C(Cn1nnc(-c2ccccc2Cl)n1)N/N=C/c1ccc(Cl)cc1 408731283 JKOMDRSKJSMARY-DJKKODMXSA-N 375.219 2.797 50 40 GFGB CCOC(=O)Cn1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 6630325 VFSZBYVSPBPMMU-SRZZPIQSSA-N 394.387 2.877 50 40 GFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1ccc(Br)cc1 1429071 HDWJBPLRZSQYTB-RQZCQDPDSA-N 378.182 2.886 50 40 GFGB COc1ccc(CCC(=O)NNC(=O)c2cc(Cl)ccc2OC)cc1OC 2629114 AUFSDXJAHWTGHF-UHFFFAOYSA-N 392.839 2.760 50 40 GFGB COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCCCCC2)c1C 5674629 JAOVATSEUAAXKQ-CPNJWEJPSA-N 387.480 2.604 50 40 GFGB Cc1nc(-c2ccccc2)sc1C(=O)NNS(=O)(=O)c1ccc(F)cc1 7387370 AYXRPLPGKUKSIC-UHFFFAOYSA-N 391.449 2.881 50 40 GFGB O=C(Cc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc(O)c(Br)c1 408869212 RGLTVOAYLZBQPD-RQZCQDPDSA-N 378.182 2.756 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(Br)cc2)cc([N+](=O)[O-])c1O 35406283 VTWTWZHSFRFDDI-CAOOACKPSA-N 394.181 2.835 50 40 GFGB COC(=O)c1ccc(/C=N\NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1 34367163 IOPLBLQSRMPXIP-JLPGSUDCSA-N 388.423 2.859 50 40 GFGB CCO[Si](O/C=C\O[Si](OCC)(OCC)OCC)(OCC)OCC 299888303 DNRORNCIGSNDFB-YPKPFQOOSA-N 384.574 2.581 50 40 GFGB COc1cccc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)c1O 1083323 NPIRIPMHZPSWIC-HZHRSRAPSA-N 376.412 2.787 50 40 GFGB COc1cc(OC)c(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)c(OC)c1 6735452 DLZJRVGHDDCOIG-JYRVWZFOSA-N 382.372 2.956 50 40 GFGB COc1cc(SC)ccc1C(=O)NNC(=O)COc1ccccc1Cl 2629181 ULHPPURKWUMYDH-UHFFFAOYSA-N 380.853 2.911 50 40 GFGB O=C(CN1CCCc2ccccc21)NNC(=O)c1cccn1Cc1ccccc1 70039014 PKLLRUWILOVWQL-UHFFFAOYSA-N 388.471 2.750 50 40 GFGB C/C(=C\C(=O)C(F)(F)C(F)(F)F)NNC(=O)COc1ccc(C)c(C)c1 408953467 LUTGQLNFLMGBFN-YRNVUSSQSA-N 380.313 2.974 50 40 GFGB COc1ccccc1NC(=O)N/N=C\c1ccc(OCC(=O)O)c(Cl)c1 408854543 HXJPYKQUSNUTNC-OCKHKDLRSA-N 377.784 2.968 50 40 GFGB COc1ccc(CCNC(=O)/C(C#N)=C\c2ccc(C(=O)O)cc2)cc1OC 33579017 FKCHXMYBBLFSKI-BOPFTXTBSA-N 380.400 2.668 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)cc(Br)c1O 1091254 BOFGOTRJDBIFGJ-CNHKJKLMSA-N 393.193 2.656 50 40 GFGB CCOC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@@]21C(=O)Nc2ccccc21 4728084 MNJAPSDADMKGSG-LJQANCHMSA-N 381.413 2.558 50 40 GFGB O=C(COC(=O)CCCc1c[nH]c2ccccc12)NNC(=O)c1cccs1 7779215 YEOKSVMHXQCDFF-UHFFFAOYSA-N 385.445 2.557 50 40 GFGB COc1ccc(S(=O)(=O)/C(C#N)=C/N2CCN(Cc3ccccc3)CC2)cc1 20403655 LHDHDYOOBQGWKY-HEHNFIMWSA-N 397.500 2.652 50 40 GFGB CCN(NC(=O)CN(c1ccccc1C)S(C)(=O)=O)c1ccc(C)cc1 65620747 HETDFSZTIJAMNJ-UHFFFAOYSA-N 375.494 2.627 50 40 GFGB CC(C)(C)OC(=O)N1CCOC[C@@]2(CC[C@H](CI)O2)C1 95698563 GXDDETCOIZTESK-BXUZGUMPSA-N 397.253 2.607 50 40 GFGB in-vitro COc1ccc(OC)c(/C=C(\C#N)C(=O)NCc2ccc(OC)cc2OC)c1 408865984 FBKPUGCPRXNCFH-CXUHLZMHSA-N 382.416 2.944 50 40 GFGB O=C(CN1Cc2ccccc2C1)N/N=C\c1cccn1-c1ccc([N+](=O)[O-])cc1 409197900 ROLLCKHMQCDKDW-UUYOSTAYSA-N 389.415 2.851 50 40 GFGB Cc1ccc(N2C[C@@H](C(=O)N/N=C/c3ccc4c(c3)OCO4)CC2=O)cc1C 409156278 NPUDKARHQKAXIS-CPHRPENTSA-N 379.416 2.535 50 40 GFGB Cc1ccc(CN2CCN(CC(=O)N/N=C/c3cccc(Cl)c3)CC2)cc1 19861298 ZWBLDEXPDYFEOG-OEAKJJBVSA-N 384.911 2.916 50 40 GFGB C[C@H](Cl)CN(C[C@@H](C)Cl)C(=O)Oc1ccc(C[C@H](N)C(=O)O)cc1 1763335 JCZBYODVXLGJTG-WDMOLILDSA-N 377.268 2.696 50 40 GFGB Nc1nnc(CC(=O)N/N=C/c2ccc(OCc3ccc(F)cc3)cc2)s1 4837056 CWMQDZIIVIYJEP-UFFVCSGVSA-N 385.424 2.531 50 40 GFGB O=C(CCc1ncc(-c2c(F)cccc2F)o1)NNC(=O)c1cccc(O)c1 11675993 ZDUZGTXIUAZROV-UHFFFAOYSA-N 387.342 2.719 50 40 GFGB O=C(NNC(=O)c1ccc(=O)n(Cc2ccccc2)c1)c1ccc(Cl)cc1 16839273 QLZOSIKQAAMVJU-UHFFFAOYSA-N 381.819 2.625 50 40 GFGB O=C(NN/C=C1\C(=O)N(CCC2=CCCCC2)C(=S)N=C1O)c1ccccc1 17247772 KVFBUGRAAWCNBR-SSZFMOIBSA-N 398.488 2.779 50 40 GFGB N#C/C(=C\c1ccc(-c2cccc(Cl)c2)o1)C(=O)NCCN1CCOCC1 21540250 WZKCETBOSYQCEN-DTQAZKPQSA-N 385.851 2.955 50 40 GFGB Cc1noc(C)c1CSc1ncccc1C(=O)NNC(=O)c1ccoc1C 39976075 MBJWCFYEJRAHGZ-UHFFFAOYSA-N 386.433 2.955 50 40 GFGB CCCOc1ccc(C(=O)N/N=C\c2cccc(OCC(=O)O)c2)cc1OC 409320266 CMJATGOQQQPZJR-MTJSOVHGSA-N 386.404 2.711 50 40 GFGB CN(C)c1cccc(OCC(=O)N/N=C\c2cn(CC#N)c3ccccc23)c1 409377977 LDIVICPYIWYCKG-QRVIBDJDSA-N 375.432 2.760 50 40 GFGB O=C(N/N=C/c1ccncc1)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 3308530 QCCWLLKCYYSUGZ-OEAKJJBVSA-N 383.415 2.547 50 40 GFGB CCn1c(C)nc2cc(C(=O)NNC(=O)CCOc3ccccc3C)ccc21 2628389 MTWBHHPCMLODKQ-UHFFFAOYSA-N 380.448 2.903 50 40 GFGB Cc1ccccc1OCC(=O)NNC(=O)COc1cc(C)c(Cl)c(C)c1 4689359 QCTLWZQYOCYALF-UHFFFAOYSA-N 376.840 2.870 50 40 GFGB O=C(CSc1ncccn1)N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 408864632 YQTHOMCLMLYLNJ-KEBDBYFISA-N 383.389 2.887 50 40 GFGB CCc1ccc(N2C[C@@H](C(=O)N/N=C\c3cccc(OC)c3OC)CC2=O)cc1 409152348 FASLWFNJZIDCFH-ICODJCHTSA-N 395.459 2.769 50 40 GFGB Cc1cc(OCC(=O)NNC(=O)CCOc2ccccc2C)ccc1Cl 15889143 CPJPCYIIFDVITO-UHFFFAOYSA-N 376.840 2.952 50 40 GFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)c2cc(OC)cc(OC)c2)cc1 100522610 FEBSDJLKFQYQGE-OEAKJJBVSA-N 399.447 2.525 50 40 GFGB C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1c[nH]nc1-c1ccc(F)cc1 10099047 WZCUJTPUUSPUTQ-NSHDSACASA-N 386.358 2.583 50 40 GFGB CCCCc1[nH]nc2c1[C@]1(C(=O)N(CCC)c3ccccc31)C(C#N)=C(N)O2 12858431 GSKXLKQRHXECSY-OAQYLSRUSA-N 377.448 2.881 50 40 GFGB CCn1c(NNC(=O)CCOc2ccc(C)cc2C)nc2ccccc2c1=O 29860937 YCPVUBAWJFCHON-UHFFFAOYSA-N 380.448 2.945 50 40 GFGB NNC(=O)c1ccc(OCc2ccccc2F)c(I)c1 216820674 GUPWERKZSNVGQZ-UHFFFAOYSA-N 386.164 2.613 50 40 GFGB O=C(N/N=C/c1cc(Br)c(O)cc1O)c1ccc([N+](=O)[O-])cc1 408718994 DQRWTLBNKPNNBP-FRKPEAEDSA-N 380.154 2.532 50 40 GFGB COc1ccc(C(=O)N/N=C\c2ccc(OCC(=O)O)c(Cl)c2)cc1OC 409302388 IMQUQVQJOIZPGJ-UKWGHVSLSA-N 392.795 2.585 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)Nc2cccc(C)c2C)ccc1OCC(N)=O 59201473 IUFDZOVBLAHFCI-CXUHLZMHSA-N 379.416 2.722 50 40 GFGB O[C@]12[C@@H]3[C@H]4[C@H]([C@H]5C[C@H]4[C@H]([C@@H]51)C3(Br)Br)[C@H]2Br 100938849 WZBOKYFPZUQGLI-BLWRLFHZSA-N 398.920 2.739 50 40 GFGB COc1cc(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)cc(OC)c1OC 2661858 IGEWZHRTTHTHRF-UHFFFAOYSA-N 398.337 2.806 50 40 GFGB O=C(ON=C1C=CC(=NNC(=O)c2ccccc2O)C=C1)c1ccc(F)cc1 6473594 ADSCDXVKMLHZHH-UHFFFAOYSA-N 379.347 2.956 50 40 GFGB C[C@@H](NNC(=O)c1ccccc1Br)C(=O)Nc1sccc1C#N 8777371 XBCASYSYVORGFL-SECBINFHSA-N 393.266 2.644 50 40 GFGB O=C(NNc1ccccc1)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 70716493 QQBYQSDLDOEXNA-UHFFFAOYSA-N 393.896 2.884 50 40 GFGB Cc1c(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)oc2c1C(=O)CC(C)(C)C2 40140080 SQMSKAKDWZAERI-UHFFFAOYSA-N 385.376 2.726 50 40 GFGB COc1cc(OC)c(OC)cc1/C=C(\C#N)C(=O)Nc1ccccc1C(=O)O 13060152 CPHDTQYYGMDQGE-MDWZMJQESA-N 382.372 2.956 50 40 GFGB O=C(NNC(=O)c1ccccc1-n1cccc1)c1cncc(Br)c1 5701456 NZMUKFSLBXSIJR-UHFFFAOYSA-N 385.221 2.710 50 40 GFGB C=CCNC(=O)/C(C#N)=C/c1c(Oc2ccccc2F)nc2ccccn2c1=O 2427496 NFLNRSJZWDMGKM-WYMLVPIESA-N 390.374 2.835 50 40 GFGB COc1cc(C(=O)N/N=C/c2coc3ccc(C)cc3c2=O)cc(OC)c1OC 2754646 IZEHTPAXMQENFC-LSHDLFTRSA-N 396.399 2.891 50 40 GFGB Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCl)[C@@H]2c2ccccc2)cc1 4778633 BRZPAJKUGAZGJE-SFHVURJKSA-N 378.881 2.766 50 40 GFGB Cc1noc(C)c1CSCC(=O)OCC(=O)C(C#N)=C1Nc2ccccc2N1 6639726 QCFCODCGQWBEPX-UHFFFAOYSA-N 398.444 2.910 50 40 GFGB CCCCc1[nH]nc2c1[C@@]1(C(=O)N(CCC)c3ccccc31)C(C#N)=C(N)O2 12858419 GSKXLKQRHXECSY-NRFANRHFSA-N 377.448 2.881 50 40 GFGB CC(C)(C)CC(=O)NNC(=O)c1nn(-c2ccccc2)c(=O)c2ccccc12 12947460 GOEFZDYBGNDPBE-UHFFFAOYSA-N 378.432 2.583 50 40 GFGB O=C(N/N=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ncccc1[N+](=O)[O-] 15231073 UQFYCLUNJHIQPW-VXLYETTFSA-N 381.304 2.922 50 40 GFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccc(Cl)cc1 15632233 LBWYDOJMDRGBFL-GFCCVEGCSA-N 392.242 2.808 50 40 GFGB C/C(=N/NC(=O)CN1CCN(Cc2ccccc2)CC1)c1ccc(Cl)cc1 20191040 BMWYYDRXLYNYSD-QJOMJCCJSA-N 384.911 2.998 50 40 GFGB CCOC(=O)[C@@H](C(C)=O)[C@@H](c1cccc(Cl)c1)[C@@H](C#N)C(N)=C(C#N)C#N 78547493 SJRRGLZPTOMYCZ-IKGGRYGDSA-N 384.823 2.592 50 40 GFGB Cc1ccc(/C=N/NC(=O)CN(c2cc(Cl)ccc2C)S(C)(=O)=O)cc1 408766719 FLYUJCUWMQNRQP-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB COc1ccc(/C=C(\C#N)C(=O)OCC(=O)N2CCc3ccccc3C2)cc1 3224154 NDYRRRHHYCDGRV-XDHOZWIPSA-N 376.412 2.730 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2c(F)cccc2Cl)S(C)(=O)=O)cc1 20208024 IJJALMWEHNXVQD-KEBDBYFISA-N 397.859 2.704 50 40 GFGB C/C(CC(=O)N1CCCC1)=N\NC(=O)COc1ccc(C)cc1Br 4416323 QYEWKIMJUOFOJZ-CPNJWEJPSA-N 396.285 2.641 50 40 GFGB Cc1onc(-c2ccccc2)c1C(=O)NNC(=O)Cc1nc2ccccc2[nH]1 6967927 QGKXIOLLEOHZHF-UHFFFAOYSA-N 375.388 2.530 50 40 GFGB O=C(Cn1cc(C(F)(F)F)ccc1=O)N/N=C/c1ccc(OC(F)F)cc1 3188687 CHCMJJHWCDZCAF-QPJQQBGISA-N 389.280 2.619 50 40 GFGB Cc1sc2nc3n(c(=O)c2c1C)C[C@@H](CI)S3 4176631 KAGYRJXMTNCWIE-SSDOTTSWSA-N 378.260 2.984 50 40 GFGB Cc1cccc(OCCC(=O)NNC(=O)COc2ccc(Cl)c(C)c2)c1 15889141 OMRHSYFXXWUYNM-UHFFFAOYSA-N 376.840 2.952 50 40 GFGB O=C(CN1CCCCC1)N/N=C/c1cc2cc([N+](=O)[O-])ccc2nc1Cl 408728446 MNYRQJNGLQGGIH-VXLYETTFSA-N 375.816 2.732 50 40 GFGB COC(=O)COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)OC)cc2)cc1 408795162 LJJGESFUYZVEOM-LFIBNONCSA-N 394.383 2.571 50 40 GFGB CC(C)(C)c1ccc(C(=O)NNC(=O)N2CCN(Cc3ccncc3)CC2)cc1 24527788 KKAZRRIJJHNOSZ-UHFFFAOYSA-N 395.507 2.551 50 40 GFGB CC(C)c1ccc(/C=N\NC(=O)CN(C2CCCCC2)S(C)(=O)=O)cc1 106372454 IQWSIEYJGRLEIY-MOSHPQCFSA-N 379.526 2.854 50 40 GFGB Cc1ccc(CC(=O)N/N=C/c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c(C)c1 20194865 KYDKFXFQLFNTCN-HYARGMPZSA-N 396.447 2.741 50 40 GFGB O=C(COc1cccc(Br)c1)NNC(=O)C[C@H]1C[C@H]2CC[C@H]1C2 104742536 UDRRHEBWWFFPQD-RWMBFGLXSA-N 381.270 2.802 50 40 GFGB COc1cccc(C(=O)NNC(=O)COc2ccc(Br)cc2C)c1 4838929 KJKFSINKNHWZSR-UHFFFAOYSA-N 393.237 2.606 50 40 GFGB Cc1ccc(N2C[C@H](C(=O)Oc3ccc([N+](=O)[O-])cc3)CC2=O)cc1[N+](=O)[O-] 7929519 YUNDIEIIYNCFIC-GFCCVEGCSA-N 385.332 2.770 50 40 GFGB CCOC(=O)C1=C(CCl)OC(N)=C(C#N)[C@@H]1c1ccc(OC)c(OC)c1 1247668 UJALIOAOXTUTJU-HNNXBMFYSA-N 378.812 2.567 50 40 GFGB CCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cc(OC)ccc3F)[C@H]2C1 4631496 UNCFBNNHWPSDLI-PKOBYXMFSA-N 377.423 2.580 50 40 GFGB COC(=O)Oc1ccc(/C=N/NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1OC 408829892 QZQGMWYGDMBMII-VXLYETTFSA-N 387.348 2.821 50 40 GFGB CCCCc1nc(C)c(C(=O)NNC(=O)CNc2ccc(OC)cc2)s1 69924419 BXVXADQCLUVIBJ-UHFFFAOYSA-N 376.482 2.676 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)c1cc(Br)ccc1O 3122915 FFCXQXKZAYXANP-FRKPEAEDSA-N 380.154 2.532 50 40 GFGB O=C(CNc1ccc(I)cc1)N/N=C/c1ccccc1O 1051233 WEHTZWMGQVKQCN-GIJQJNRQSA-N 395.200 2.559 50 40 GFGB O=c1[nH]c(=O)c2[nH]c(/N=N/c3ccc(N(CCCl)CCCl)cc3)nc2[nH]1 4706990 DFDRCUVILPNOLL-GHVJWSGMSA-N 396.238 2.639 50 40 GFGB COc1cc(C(=O)NNS(=O)(=O)c2cc(C)ccc2C)ccc1OC(C)C 7387866 BBXKDJNOUOZBRY-UHFFFAOYSA-N 392.477 2.723 50 40 GFGB COc1cccc(NC(=O)C(=O)N/N=C/c2ccc(Br)cc2)c1 7782205 AKCRYYDTYOUWES-VCHYOVAHSA-N 376.210 2.547 50 40 GFGB CCCOc1ccc(/C=N/NC(=O)C(=O)NCCc2ccccc2)cc1OCC 7869459 UTHPESUBDYPFET-LFVJCYFKSA-N 397.475 2.683 50 40 GFGB O[C@@]12[C@@H](Br)[C@H]3[C@H]4[C@@H]1C(Br)(Br)[C@H]1[C@@H]4C[C@H]3[C@H]12 169795850 WZBOKYFPZUQGLI-VMZHCPTASA-N 398.920 2.739 50 40 GFGB O=C(NNC(=O)c1ccccc1I)c1ccccc1F 6222328 YASLEKSRXNKMSY-UHFFFAOYSA-N 384.148 2.505 50 40 GFGB COc1ccc(NC(=O)C(=O)N/N=C\c2ccccc2Br)cc1 105062299 WVURLCODLZQRAB-ZDLGFXPLSA-N 376.210 2.547 50 40 GFGB COC(=O)/C(C#N)=C/c1c(Oc2ccccc2OC)nc2c(C)cccn2c1=O 2448644 VANCJDLIXNNNNZ-SDNWHVSQSA-N 391.383 2.884 50 40 GFGB Cc1[nH]c(=O)c(C#N)c(C)c1CCC(=O)NNc1ccccc1C(F)(F)F 60944025 AYZXPGZMIFOHII-UHFFFAOYSA-N 378.354 2.958 50 40 GFGB CC1=C(C(=O)OC(C)C)[C@@H](c2ccc3c(c2)OCO3)N2C(=N1)SC(C#N)=C2N 408603697 GUQULTLIMXEAEQ-MRXNPFEDSA-N 398.444 2.752 50 40 GFGB COC(=O)COc1ccccc1/C=C(\C#N)C(=O)Nc1cccc([N+](=O)[O-])c1 408797646 SWZJGZGSONMNSM-NTEUORMPSA-N 381.344 2.692 50 40 GFGB COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCl)cc2)c1 408925852 RAQRILHPRNUPAD-UHFFFAOYSA-N 384.841 2.682 50 40 GFGB COc1cc(/C=N/NC(=O)Cc2ccc(Br)cc2)cc(OC)c1O 894920 DQJRUYIGMRKVOU-VXLYETTFSA-N 393.237 2.865 50 40 GFGB COCCNC(=O)/C(C#N)=C\c1ccc(OCc2ccccc2C#N)c(OC)c1 4515075 IVSVMNWWWZICTK-ODLFYWEKSA-N 391.427 2.815 50 40 GFGB CN(C)c1cccc(C(=O)N/N=C/c2ccc(OCC(=O)O)c(Cl)c2)c1 4780048 RFGQLQQUMSPKQP-KEBDBYFISA-N 375.812 2.633 50 40 GFGB COc1ccc(C(=O)N/N=C/c2cc(Br)cc(OC)c2O)cc1 5513554 HRRJOVLRNNYBFS-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB Cc1cc(OCC(=O)NNC(=O)Cc2cnn(-c3ccccc3)c2)ccc1Cl 29567704 GGRIFIPQPYLZJW-UHFFFAOYSA-N 398.850 2.603 50 40 GFGB Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccc(Br)cc2)c1 727762 AQUZTTKWCCZYHK-UHFFFAOYSA-N 377.238 2.906 50 40 GFGB COc1cc(Cl)cc(/C=N/NC(=O)COc2ccc(C)cc2[N+](=O)[O-])c1O 13847774 OBVCGUOYUCWVEI-UFWORHAWSA-N 393.783 2.800 50 40 GFGB Cn1c(SCC(=O)N/N=C/c2ccccn2)nnc1-c1cccc(Cl)c1 2343458 WJOQAVWJVBLKKK-KEBDBYFISA-N 386.868 2.773 50 40 GFGB C#CCOc1c(I)cc(/C=C(\C#N)C(N)=S)cc1OC 408542663 KQSZTVMVGXXNIA-BJMVGYQFSA-N 398.225 2.505 50 40 GFGB Cc1ccc(S(=O)(=O)NNC(=O)c2oc3ccccc3c2C)cc1[N+](=O)[O-] 7380452 OPUHAPQALASRMA-UHFFFAOYSA-N 389.389 2.581 50 40 GFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccc(Cl)cc1 69516230 YVDAJDASTLOIAG-GFCCVEGCSA-N 392.242 2.808 50 40 GFGB Cc1ccc(/C=N\NC(=O)c2nn(-c3cccc(C)c3)c(=O)c(C#N)c2C)cc1 409051165 BCAMOKCKOROWHY-CFRMEGHHSA-N 385.427 2.793 50 40 GFGB N#CCOc1ccc(/C=N\NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1 33894670 LMEUZTUZRLDMCL-UQQQWYQISA-N 385.423 2.975 50 40 GFGB O=C(O)COc1ccc(/C=N\NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 33560706 FUPCVQIKOYPPNX-OCKHKDLRSA-N 383.316 2.568 50 40 GFGB CCNc1nc2[nH]c(=O)c3c(c2s1)OC(N)=C(C#N)[C@@H]3c1ccc(OC)cc1 15082504 HWXYWALLTRGMGC-LBPRGKRZSA-N 395.444 2.643 50 40 GFGB COc1ccc(C(=O)NNC(=O)c2ccc(CSc3ncccn3)cc2)cc1 2346272 MUHUSDDHTBNHIS-UHFFFAOYSA-N 394.456 2.852 50 40 GFGB CCOc1ccc([C@@H]2CC(=O)NC(SCC(=O)N3CCCC3)=C2C#N)cc1 6355254 BFLOTYIOCQOBPM-INIZCTEOSA-N 385.489 2.780 50 40 GFGB CCOc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(OCC)cc3)C2)cc1 6962072 OIJFNFWUFLQHSH-QIWJOQEQSA-N 395.459 2.987 50 40 GFGB Cc1ccccc1C(=O)NNS(=O)(=O)c1cc(Br)ccc1C 7423218 QOUAOSNLUUADEB-UHFFFAOYSA-N 383.267 2.689 50 40 GFGB C[C@H](c1ccccc1)N1C[C@@H](C(=O)NNC(=O)c2ccc(Cl)cc2)CC1=O 7882074 HTHOYYIZTMZUGO-CJNGLKHVSA-N 385.851 2.711 50 40 GFGB Cn1cc(C(=O)NNS(=O)(=O)c2ccccc2C(F)(F)F)c2ccccc21 7907340 BYLUUQDYHZDWTM-UHFFFAOYSA-N 397.378 2.820 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])c2cccnc2c1O)c1ccc([N+](=O)[O-])cc1 59459109 AZWGUEKRGLAEGB-DJKKODMXSA-N 381.304 2.521 50 40 GFGB CC(C)(C)c1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)cc1 408614810 IITIPAVTNAFXJB-INIZCTEOSA-N 379.460 2.798 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccc2Cl)ccc1O[C@H](C)C(=O)O 409009308 DBUYHSXMJTVDAB-JZOCJUILSA-N 376.796 2.964 50 40 GFGB O=C(CSc1nc(-c2ccc(Cl)cc2)n[nH]1)NNC(=O)c1ccccc1 7604837 UTORZMPPXGIIAE-UHFFFAOYSA-N 387.852 2.678 50 40 GFGB O=C(CNc1ccc(F)cc1)N/N=C/c1ccccc1I 409341132 CSPHVRJPUWSGEY-DJKKODMXSA-N 397.191 2.993 50 40 GFGB CC(=O)Nc1ccc(C(=O)NN2C(=O)[C@@H](Cl)[C@H]2/C=C\c2ccccc2)cc1 34073045 VJBMUESHSPZPMA-OUODJMRJSA-N 383.835 2.821 50 40 GFGB O=C(CN1CCOCC1)N/N=C/c1ccc(OCc2cccc(Cl)c2)cc1 19797829 RQPNREVLGPMGJK-LPYMAVHISA-N 387.867 2.701 50 40 GFGB Cc1cc2c(c(=O)n1C[C@@H]1CCCO1)[C@H](c1ccccc1F)C(C#N)=C(N)O2 1256011 SPHCTPLOWQTOKR-SCLBCKFNSA-N 381.407 2.693 50 40 GFGB COc1cc(C(=O)N/N=C/c2ccc(Br)o2)cc(OC)c1OC 2675581 KZKFQCQABAUIFE-CAOOACKPSA-N 383.198 2.832 50 40 GFGB O=C(COc1cccc(Br)c1)N/N=C/c1cc([N+](=O)[O-])ccc1O 704535 PBCPQUIGNUOUHG-CAOOACKPSA-N 394.181 2.592 50 40 GFGB O=C(CNc1ccc(Br)cc1)N/N=C/c1cccc([N+](=O)[O-])c1 1500991 DZIMSFYMDBHCNL-GIJQJNRQSA-N 377.198 2.920 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)c2cc3c(OC)ccc(OC)c3[nH]2)c1 2229851 ZLLVPIWEOVGPNA-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB C/C(=N\NC(=O)C(=O)Nc1ccc(Br)cc1C)c1ccncc1 5191615 ZCMWUERZICKNGN-RGVLZGJSSA-N 375.226 2.631 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(F)cc2)ccc1OCC(N)=O 5953487 XDFNJCSRSLPIGU-NTEUORMPSA-N 383.379 2.634 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)COc2ccc(Cl)cc2C)c(C)c1 6844018 MAMKGXOKJJZEKC-UHFFFAOYSA-N 376.840 2.870 50 40 GFGB COc1ccccc1NC(=O)[C@@H](C)SC1=C(C#N)C(C)(C)[C@H](C#N)C(=O)N1 7252361 VDEAEJBZEGNKAM-VXGBXAGGSA-N 384.461 2.786 50 40 GFGB Cc1nc2ccccn2c1C(=O)NNS(=O)(=O)c1cc(Cl)cc(Cl)c1 9113890 CUEXYTHDEBVXRR-UHFFFAOYSA-N 399.259 2.573 50 40 GFGB COC[C@H](C)NC(=O)COC(=O)/C(C#N)=C/c1cc(C)n(CCC(C)C)c1C 32944999 ZMEWTCKMBBUTGO-RPJLVFAOSA-N 389.496 2.752 50 40 GFGB Cc1ccccc1-n1c(C)cc(/C=N/NC(=O)C(=O)NCc2cccnc2)c1C 408968976 DYTVPSJNNNXQMJ-AFUMVMLFSA-N 389.459 2.564 50 40 GFGB CCN1C(=O)[C@]2(C(C#N)=C(N)Oc3[nH]nc(-c4ccccc4)c32)c2ccccc21 1272258 RKOJRVCFUMVKBJ-QFIPXVFZSA-N 383.411 2.816 50 40 GFGB C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1Cl 12984043 XVQYHRDFNRFMPG-VXGBXAGGSA-N 380.803 2.861 50 40 GFGB CC(=O)Nc1cccc(C(=O)N/N=C\c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 34795171 KZJNGCRUOGRMMX-BKUYFWCQSA-N 395.419 2.917 50 40 GFGB COC(=O)[C@@H]1/C(=N/NC(=O)c2ccccc2O)C[C@](C)(O)C[C@@H]1c1ccccc1 101406504 JPQOGYMVEBZUHB-QIDKHDHUSA-N 396.443 2.596 50 40 GFGB O=C(Cn1cnc(Cl)c1Cl)NNC(=S)Nc1ccccc1Cl 2150184 YYGANAFOOCBHIU-UHFFFAOYSA-N 378.672 2.861 50 40 GFGB COc1ccc(-c2n[nH]cc2/C=N\NC(=O)c2cc(OC)cc(OC)c2)cc1 5634351 GGKZIPAJAPQTHX-UUYOSTAYSA-N 380.404 2.866 50 40 GFGB CCc1ccc2c(CC(=O)NNC(=O)COc3ccccc3C#N)coc2c1 6981785 MQSLJCVYSQHFEG-UHFFFAOYSA-N 377.400 2.636 50 40 GFGB O=C(N/N=C/c1ccc2c(c1)OCO2)c1ccc(I)cc1 10118504 BSTDTVJCZSWHMJ-CAOOACKPSA-N 394.168 2.784 50 40 GFGB C/C(=N\NC(=O)c1cc(Br)c[nH]1)[C@@H]1Cc2ccccc2C(=O)O1 54293563 DIDQDZOHGMCPAX-FRSZACSASA-N 376.210 2.665 50 40 GFGB O=C(CCc1ccccc1O)N/N=C1/C(=O)Nc2ccc(Br)cc21 59472632 JAUFKNYQCGUOBD-UHFFFAOYSA-N 388.221 2.560 50 40 GFGB COC(=O)c1ccccc1NC(=O)C/C(C)=N/NC(=O)Cc1ccc(OC)cc1 100277935 VIOKZTWAEPPHGE-OEAKJJBVSA-N 397.431 2.545 50 40 GFGB Cc1ccc(/C=N/NC(=O)[C@H](CC(C)C)NC(=O)COc2ccccc2C)o1 408972580 PDYMZKXGQWGKMR-YPKZHZFPSA-N 385.464 2.956 50 40 GFGB CC(C)CN(CC(C)C)C(=O)[C@@H](Br)[C@@H](Br)C(=O)O 1685978 MHDIVHHUHBOMDP-VHSXEESVSA-N 387.112 2.739 50 40 GFGB COc1ccc(CC(=O)NNC(=O)c2cnn(-c3ccc(C)cc3)c2C)cc1 13019175 YCXRLRCVCOOTNV-UHFFFAOYSA-N 378.432 2.501 50 40 GFGB N#CC(C#N)=C(N1CCOCC1)[C@@]1(C#N)[C@@H](c2ccccc2Cl)C1(C#N)C#N 66089427 PGOALIYKPGHXRO-FXAWDEMLSA-N 388.818 2.614 50 40 GFGB N#C/C(=C\c1ccc(OCC(=O)N2CCCC2)cc1)C(=O)Nc1cccnc1 409162786 HTFJNULFTZSTFP-SFQUDFHCSA-N 376.416 2.628 50 40 GFGB CSc1ccc(/C=N/NC(=O)[C@H](C)N(c2ccccc2)S(C)(=O)=O)cc1 408911891 OWEVSFYDGGTSHG-ITRAFESCSA-N 391.518 2.713 50 40 GFGB C/C(CC(C)(C)N=C=S)=N/N1C(=O)[C@@H](C)N2C(=S)NC(C)(C)C[C@@]12C 5515722 KQSJLFGAGPZNPJ-JUUCDUNVSA-N 381.571 2.940 50 40 GFGB O=C(Cn1nnc(-c2ccccc2)n1)N/N=C/c1ccc(Cl)cc1Cl 797367 IOSBCSLJCFLETG-DJKKODMXSA-N 375.219 2.797 50 40 GFGB Cc1ccc(C)n1-c1ccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1 4541419 BTDWFEDIQNZLPF-UHFFFAOYSA-N 391.427 2.712 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccccc3F)[C@@H]2C1 5564641 WRFYMFOHZTWKMN-SJLPKXTDSA-N 391.406 2.708 50 40 GFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(C(F)(F)F)c1 5569027 ZILWKXIPLCLVJJ-AWQFTUOYSA-N 380.282 2.702 50 40 GFGB Cc1ccccc1OCC(=O)N[C@H](CC(C)C)C(=O)N/N=C/c1cccc(O)c1 408971687 JLMTXEMIOATKLE-QNDYCBLQSA-N 397.475 2.761 50 40 GFGB Cc1cc(/C=N\NC(=O)c2cccc(O)c2)c(C)n1NC(=O)c1ccccc1 409218395 IPSBPIHCNBRZRZ-XKZIYDEJSA-N 376.416 2.958 50 40 GFGB CCOc1cc(/C=N/NC(=O)CNc2ccc(Cl)cc2)cc([N+](=O)[O-])c1O 409360288 DOJVUDVBXWZLNM-AWQFTUOYSA-N 392.799 2.915 50 40 GFGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc2ccc(C)c(C)c2[nH]c1=O 876502 XCQAKZOLYRRGHQ-KRWDZBQOSA-N 379.416 2.790 50 40 GFGB O=C(CC(=O)N/N=C/c1c[nH]c2ccccc12)N/N=C/c1c[nH]c2ccccc12 1921216 AGDFORZBDVFCDP-DWGHPKEWSA-N 386.415 2.640 50 40 GFGB C/C(CC(=O)Nc1ccccn1)=N\NC(=O)C(=O)Nc1cccc(Cl)c1C 4561527 KPUYNVYGIPXASJ-FOKLQQMPSA-N 387.827 2.503 50 40 GFGB O=C(NN[C@H]1CC(=O)N(c2ccccc2)C1=O)c1ccc(Cl)cc1Cl 18222673 BTSWTVVDNLSYKP-AWEZNQCLSA-N 378.215 2.560 50 40 GFGB Cc1nc(Sc2ccc(/C=N/NC(=O)c3ccccc3O)cc2[N+](=O)[O-])n[nH]1 409192977 GVLUFNOFMZQZGJ-GIJQJNRQSA-N 398.404 2.642 50 40 GFGB COc1cc(Br)cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)c1OC 409207683 XJANXEWYXLHSTM-CYIWUNGXSA-N 395.253 2.668 50 40 GFGB CN(C)c1ccc(/C=N/NC(=O)c2ccn(Cc3ccc([N+](=O)[O-])cc3)n2)cc1 1086999 BNMXDNKJMMIBKM-FYJGNVAPSA-N 392.419 2.670 50 40 GFGB CN(C)c1ccc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc1Br 1100167 WOTCQSVLEJYWPO-CZAWJFPGSA-N 378.270 2.717 50 40 GFGB C/C(CCc1ccccc1)=N\NC(=O)CN(c1ccccc1C)S(C)(=O)=O 19954811 VPXXFLRATWJNQG-HEHNFIMWSA-N 387.505 2.886 50 40 GFGB Cn1cc(C(=O)NNS(=O)(=O)C2=Cc3ccccc3CC2)c2ccccc21 57806837 DVMUTCXSXBDVGT-UHFFFAOYSA-N 381.457 2.730 50 40 GFGB COC(=O)[C@@]12C(=O)Oc3ccc([N+](=O)[O-])cc3[C@H]1[C@@]2(C)C(=O)c1ccccc1 101740533 UKNKZORBGHIYAD-RYGJVYDSSA-N 381.340 2.660 50 40 GFGB CCCOc1ccc(C(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1OC 15476947 BBZRDGRLFZJJFX-UHFFFAOYSA-N 388.420 2.576 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(C#N)cc2F)c(Br)cc1O 408964617 CXVCDBSOFXMOKK-DNTJNYDQSA-N 392.184 2.938 50 40 GFGB COc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)c(Br)cc1O 409228418 YTADONKLTGKGHF-OCKHKDLRSA-N 381.201 2.995 50 40 GFGB CCOc1cc([N+](=O)[O-])cc(/C=N/NC(=O)COc2c(C)cccc2C)c1O 36245424 OWSMOKOMJPEKRJ-KEBDBYFISA-N 387.392 2.845 50 40 GFGB CCOC(=O)COc1ccc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)cc1 7385052 MJJLHZNVFNOQHH-HZHRSRAPSA-N 395.459 2.993 50 40 GFGB COc1ccc(C(=O)NNC(=O)c2ccc(Br)cc2)cc1OC 2645814 NIFZYYHWIDLUEC-UHFFFAOYSA-N 379.210 2.541 50 40 GFGB N#Cc1ccc(C(=O)N/N=C/c2cccn2-c2ccc(C(=O)O)cc2)c(F)c1 5555665 OZAGDMHADYDHAL-FSJBWODESA-N 376.347 2.950 50 40 GFGB O=C(NCc1cccnc1)C(=O)N/N=C\c1ccc(-c2cccc(Cl)c2)o1 17150220 HKTQMXBZZRMSGE-FMCGGJTJSA-N 382.807 2.762 50 40 GFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccccc1Cl 28772400 FCJACGVCPFEFLF-LLVKDONJSA-N 392.242 2.808 50 40 GFGB NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Oc2ccccc2)c1 225502349 NWZVQEOBJFATHC-UHFFFAOYSA-N 383.429 2.883 50 40 GFGB CC1(CC(=O)N/N=C/c2ccc(-c3ccc(C(=O)O)c(Cl)c3)o2)OCCO1 4526121 ZICZCCOMUFDSEM-KEBDBYFISA-N 392.795 2.901 50 40 GFGB CC(=O)Nc1ccc(C(=O)N/N=C\c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1 33625185 XBWOBONZFTXSTF-BKUYFWCQSA-N 395.419 2.917 50 40 GFGB O=C(Oc1c(/C=N\NC(=O)c2ccccc2O)cccc1[N+](=O)[O-])c1ccco1 409224968 MVTFYDDXNLUWER-JAIQZWGSSA-N 395.327 2.877 50 40 GFGB C[C@@H](Oc1ccc(Cl)cc1)C(=O)NNC(=O)c1cc2ccccc2oc1=O 1064058 NDBXUBGKUVJZCU-LLVKDONJSA-N 386.791 2.675 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)N[C@H](C)c2ccccc2)ccc1OCC(N)=O 4616252 PVXXPFWSPSTDTD-CLXYIWAZSA-N 393.443 2.734 50 40 GFGB Cc1cc(C(=O)NNC(=O)/C(O)=C/C(=O)c2ccccc2)c2ccccc2n1 100930522 OWOSCCIDPAWIHK-UNOMPAQXSA-N 375.384 2.629 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(Cl)cc2)ccc1O[C@H](C)C(=O)O 409010093 JMAMYQFRVGQIHR-JZOCJUILSA-N 376.796 2.964 50 40 GFGB N#C/C(C(=O)NCc1ccccc1)=C1\S[C@@H](CCO)C(=O)N1c1ccccc1 2235003 VOYIKNKCDBBBND-KOXKPCSVSA-N 393.468 2.569 50 40 GFGB CC(C)COc1ccc(C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)NN)cc1 2244829 XCADQIRCXQIMHU-HXUWFJFHSA-N 394.475 2.534 50 40 GFGB O=C(Oc1ccc([N+](=O)[O-])cc1)[C@H]1CCC(=O)N1C(=O)OCc1ccccc1 2555072 ZRQOXQJWPSHSDJ-MRXNPFEDSA-N 384.344 2.828 50 40 GFGB C[C@H]1CCC[C@H](C)N1C(=O)CSc1nnc(NC(=O)CCCl)s1 4904154 VKDMZGXSHLLOPY-UWVGGRQHSA-N 376.935 2.987 50 40 GFGB COc1ccc([C@H]2C(C#N)=C(N)OC3=C2S(=O)(=O)N(C)c2ccccc23)cc1 20558321 DPWUMOLEJWCVIE-KRWDZBQOSA-N 395.440 2.651 50 40 GFGB Cc1occc1C(=O)NNC(=O)c1ccc(-n2cc(Br)cn2)cc1 31602055 TYGAOSFFGBRQIO-UHFFFAOYSA-N 389.209 2.611 50 40 GFGB CCOC(=O)Cn1cc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c2ccccc21 408599258 QZTPXHLXRGPHAW-SRZZPIQSSA-N 394.387 2.877 50 40 GFGB O=C(Cc1ccc([N+](=O)[O-])cc1)N/N=C/c1cc(Br)ccc1O 1479691 USOWMYFBONXEAX-RQZCQDPDSA-N 378.182 2.756 50 40 GFGB CC(C)C[C@H](NS(=O)(=O)Cc1ccccc1)C(=O)NNc1ccccc1 1677528 UNOSCORMYUKXTK-SFHVURJKSA-N 375.494 2.664 50 40 GFGB CCOc1ccccc1NC(=O)C(=O)N/N=C/c1ccc(Br)cc1 3127105 SMTMOUUORKILJE-YBFXNURJSA-N 390.237 2.937 50 40 GFGB CCN1C(=O)[C@@]2(C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)c2ccccc21 4753744 DZHDSRQEWQPJSE-JOCHJYFZSA-N 385.379 2.532 50 40 GFGB CC(=O)Nc1ccc(NC(=O)C(=O)N/N=C(\C)c2ccc(Cl)s2)cc1 5148494 GWSAGNNEBADWLB-AWQFTUOYSA-N 378.841 2.839 50 40 GFGB O=C(COCC(=O)N/N=C/C=C/c1ccccc1)N/N=C\C=C/c1ccccc1 6514289 WABIMDOQELJJMK-TZPNNYFWSA-N 390.443 2.634 50 40 GFGB O=C(CCNC(=O)c1ccccc1)NNC(=O)c1cc2c(s1)CCCCC2 14244762 ZVQAFLNMPJCKNG-UHFFFAOYSA-N 385.489 2.598 50 40 GFGB O=C(NNC(=O)c1cccc2c3c([nH]c12)CCCC3)c1ccc2c(c1)OCCO2 32795812 SDPCAMGUPMYTAT-UHFFFAOYSA-N 391.427 2.893 50 40 GFGB Cc1ccc(C)c(N2C[C@@H](C(=O)N/N=C/c3ccc([N+](=O)[O-])cc3)CC2=O)c1 59417684 OTONJWBDRRXPOJ-XYHOIZSOSA-N 380.404 2.715 50 40 GFGB Cc1ccc(C)c(CC(=O)N/N=C/c2cn(CCC(N)=O)c3ccccc23)c1 409360357 DYKAUTJHYWJDRO-ZMOGYAJESA-N 376.460 2.826 50 40 GFGB COc1cccc(NCC(=O)NNC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)c1 12534565 YLPHTBUMHQEWLQ-UHFFFAOYSA-N 392.459 2.928 50 40 GFGB O=C(/C=C/c1cccc(-c2ccccc2)c1)NCCCNS(=O)(=O)CCl 78976559 BSTJZCYMXGPQTB-ZHACJKMWSA-N 392.908 2.989 50 40 GFGB O=C(CN(C1CCCCC1)S(=O)(=O)c1ccccc1)N/N=C\c1ccco1 16491178 XBXMKGWERMWYMK-ZHZULCJRSA-N 389.477 2.753 50 40 GFGB O=C(CC12C[C@@H]3C[C@H](CC(Br)(C3)C1)C2)NNC(=O)c1ccncc1 103116902 PWEXPTJFQJENNS-AGCBMJJTSA-N 392.297 2.967 50 40 GFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(OC3CSC3)cc2)n1 685653 ANLNEPMMGYSWFS-UFWORHAWSA-N 388.518 2.830 50 40 GFGB COc1cc(/C=N/NC(=O)CSc2nc3ccccc3o2)cc(OC)c1O 1478048 RIAUVMGEOBYCQH-DJKKODMXSA-N 387.417 2.793 50 40 GFGB COc1ccc(-c2cc(C(=O)NNC(=O)CCl)c3ccccc3n2)cc1OC 2650111 SXXXTWLCJLGFFL-UHFFFAOYSA-N 399.834 2.919 50 40 GFGB Cc1cc2c(c(=O)n1CCO)[C@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 4851029 ZJGBIECVWSGTFB-OAHLLOKOSA-N 392.242 2.674 50 40 GFGB CCOc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC(N)=O)c(OC)c2)cc1 6963032 KRUIVEARSPTGNL-XNTDXEJSSA-N 395.415 2.504 50 40 GFGB CC(C)CCN1C(=O)/C(=N/NC(=O)c2ccc3c(c2)OCO3)c2ccccc21 8103700 YMUXYRVFQXPTQM-ZBJSNUHESA-N 379.416 2.942 50 40 GFGB N#Cc1ccc(OCC(=O)NNC(=O)CCCc2nc3ccccc3s2)cc1 8315354 ILICTBMFJGCYFH-UHFFFAOYSA-N 394.456 2.717 50 40 GFGB O=C(NNC(=O)[C@H]1CC=CC[C@@H]1C(=O)O)c1sc2ccccc2c1Cl 12809855 CGLPZOPWUVDQGV-UWVGGRQHSA-N 378.837 2.983 50 40 GFGB CN(c1ccc(C(=O)N/N=C/c2cccnc2)cc1)S(=O)(=O)c1ccccc1 20232844 BXHRBZSUESNMKL-PXLXIMEGSA-N 394.456 2.671 50 40 GFGB N#C/C(=C\c1ccc(-c2cccc(Cl)c2)o1)C(=O)N[C@@H]1CCS(=O)(=O)C1 26966551 LMOLFTVPLBIKDT-BMQCOBNYSA-N 390.848 2.810 50 40 GFGB COc1ccc(C(=O)N[C@]2(C(Cl)Cl)N=C(c3ccccc3)NC2=N)cc1 98049009 TWABGXNXRHVOML-SFHVURJKSA-N 391.258 2.952 50 40 GFGB CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)cc1OC(=O)C1CC1 4040723 GYGQYYUWPUQNBB-QGZVFWFLSA-N 380.404 2.650 50 40 GFGB aggregator Cc1cc(Br)ccc1OCC(=O)NNC(=O)CCc1ccccc1 4550623 FAKKUQRKQFVIFI-UHFFFAOYSA-N 391.265 2.917 50 40 GFGB CCOc1cc([C@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)ccc1O 8017765 NDDJONWVQBFBBG-KRWDZBQOSA-N 375.384 2.851 50 40 GFGB Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)COc3ccc(C)c(C)c3)cc2)n1 9376525 MUSLZZFORPOBLM-UHFFFAOYSA-N 392.459 2.946 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2cccc(Cl)c2C)c(OC)c1 59483760 VJQNMXZCGTXMIS-KEBDBYFISA-N 375.812 2.754 50 40 GFGB O=C1[C@H]2[C@H](C(=O)N1c1ccccc1)[C@H]1C[C@H]2[C@H](Br)[C@@H]1Br 216009369 JNUMSHAQCAUPTM-GRRRKWKPSA-N 399.082 2.969 50 40 GFGB C[C@H](Br)C(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1 616588011 BHXSJGQNXOTMIL-LBPRGKRZSA-N 389.315 2.973 50 40 GFGB C/C(=N\NC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)c1cc2ccccc2o1 6686787 VRFUFPDCARHDNS-KEBDBYFISA-N 391.836 2.888 50 40 GFGB COc1cc(N)c(Cl)cc1C(=O)OCC(=O)C(C#N)=C1Nc2ccccc2N1 6016611 ARSHQFRUVGKDJS-UHFFFAOYSA-N 398.806 2.929 50 40 GFGB CCCNC(=O)/C(C#N)=C1\N=C(NC(=O)c2ccc(OC)cc2)c2ccccc21 5203893 OERMAODBFGPVKD-HNENSFHCSA-N 388.427 2.646 50 40 GFGB CCCCN(CCCC)C(=O)[C@H]1[C@@H](C(=O)O)[C@H]2C[C@H]1[C@H](Br)[C@H]2O 252444358 KCBNELBBVDYUQJ-JNWWKETESA-N 390.318 2.506 50 40 GFGB C[C@H]1CCC[C@@H](C)N1C(=O)CSc1nnc(NC(=O)CCCl)s1 4904140 VKDMZGXSHLLOPY-AOOOYVTPSA-N 376.935 2.987 50 40 GFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3cc(N(C)C)ccc32)c(OC)c2c1OCO2 36559103 PCKCXOUJKPGAJK-QGZVFWFLSA-N 395.415 2.717 50 40 GFGB COc1ccc(CCNC(=S)NNC(=O)c2ccc(Cl)cc2)cc1OC 5274160 IJMPGZARRHOZGJ-UHFFFAOYSA-N 393.896 2.709 50 40 GFGB O=C(CNc1cccc2ccccc12)N/N=C1\C(=O)Nc2ccc([N+](=O)[O-])cc21 4938121 YCQVFVXXPVBJPL-UHFFFAOYSA-N 389.371 2.633 50 40 GFGB C[C@H](OC(=O)/C(C#N)=C\c1ccc(N(C)C)cc1)C(=O)NC1(C#N)CCCCC1 96798017 SJZOKFFNIMSMMU-CQUHBBLWSA-N 394.475 2.934 50 40 GFGB Cc1cc(C(=O)N/N=C/c2ccc(OC(=O)c3ccc([N+](=O)[O-])cc3)cc2)[nH]n1 880498 MOBOEMCDEODMAW-RGVLZGJSSA-N 393.359 2.609 50 40 GFGB C/C(=N\NC(=O)CC(=O)Nc1ccc(C)cc1)c1cc2ccccc2oc1=O 5810565 CIROXRXBTBDTEN-OEAKJJBVSA-N 377.400 2.970 50 40 GFGB Cc1nn(-c2ccccc2)c(C)c1/C=C(\C#N)C(=O)OCC(=O)NC(C)(C)C 6084841 MBCIXYGSHCEQHL-LFIBNONCSA-N 380.448 2.854 50 40 GFGB CC(C)c1ccc(/C=N/NC(=O)CN(C)S(=O)(=O)c2ccc(F)cc2)cc1 6377361 MPYBMGPXVAYTMX-CIAFOILYSA-N 391.468 2.720 50 40 GFGB COc1cc(OC)cc(C(=O)NNC(=O)CCC(=O)c2ccc(Cl)s2)c1 14244764 KERFYNYUXHSSNQ-UHFFFAOYSA-N 396.852 2.843 50 40 GFGB Cc1ccsc1/C=N/NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 17079999 VHUPIKJRCYIACZ-IYSPOMMRSA-N 391.518 2.608 50 40 GFGB C[C@H](Sc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc(OCC(N)=O)cc1 28214157 DIEUVNSUCFTTAE-SQWLXVSWSA-N 391.880 2.835 50 40 GFGB C[C@@H](Oc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc1)C(=O)O 39557410 YCKWJKRDWNBAIY-HMASQMOLSA-N 376.796 2.721 50 40 GFGB O=C(CC(=O)N/N=C\c1c(O)ccc2ccccc12)NCCc1ccccc1 59444513 KKHGNUIXAZXJMX-IWIPYMOSSA-N 375.428 2.745 50 40 GFGB O=C(COc1ccc(OC(F)(F)F)cc1)NNC(=S)Nc1ccccc1 2532720 KANZTUKFAMTASH-UHFFFAOYSA-N 385.367 2.982 50 40 GFGB Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)[C@H]1Cc2ccccc2O1 7964977 ZBOWGOUIUWSYDE-MRXNPFEDSA-N 379.441 2.883 50 40 GFGB O=P(O)(O)COc1ccccc1P(=O)(c1ccccc1)c1ccccc1 8017058 JHYJODXVCAYNJS-UHFFFAOYSA-N 388.296 2.840 50 40 GFGB biogenic Cc1ccc(CSCCNC(=O)NNC(=O)Cc2csc(C)n2)cc1 32809150 QGEWIWQBVYIVGJ-UHFFFAOYSA-N 378.523 2.566 50 40 GFGB CCN(CC)Cc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1 36833839 KHCQQPJQWOISQC-OAHLLOKOSA-N 387.455 2.896 50 40 GFGB COc1ccccc1/C=N/NC(=O)C(=O)Nc1cccc(Br)c1 59515427 FSVLYXGZHHRMRY-VCHYOVAHSA-N 376.210 2.547 50 40 GFGB CNc1snc(C)c1C(=O)OCC(=O)N/N=C1/C[C@H]2CC[C@@]1(C)C2(C)C 102595752 FSXZPYSQBSJCDK-CNWLJIKSSA-N 378.498 2.968 50 40 GFGB Cn1cnnc1SCC(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 2409417 LUYNQPWFIJJCTA-RGVLZGJSSA-N 381.461 2.637 50 40 GFGB Cc1[nH]nc2c1[C@]1(C(=O)N(CCc3ccccc3)c3ccccc31)C(C#N)=C(N)O2 4123529 ZMBQAQJWNKUYSC-HSZRJFAPSA-N 397.438 2.680 50 40 GFGB CCC(=O)N1CCc2cc(C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)ccc21 40143045 CLBCRSQDYKRHKB-UHFFFAOYSA-N 395.503 2.963 50 40 GFGB Cc1ccc2c(c1)c1c3n2CCN(CC(=O)NNC(=O)C(C)(C)C)[C@H]3CCC1 57058975 QXSCUYLGPDXBKM-SFHVURJKSA-N 382.508 2.836 50 40 GFGB COc1cc(OC)cc(C(=O)N/N=C/c2cc(Br)c(N(C)C)o2)c1 108002480 MATQTSYEKFYDEF-GIJQJNRQSA-N 396.241 2.889 50 40 GFGB O=C(CCc1ccccc1)NNC(=O)COc1ccc(Br)cc1 4996272 SHHHJMSBSKEXAR-UHFFFAOYSA-N 377.238 2.608 50 40 GFGB CCc1ccc(-n2nc(C(=O)N/N=C\c3ccccc3)c(C)c(C#N)c2=O)cc1 409056945 FMJXQSGVRQTBEU-OYKKKHCWSA-N 385.427 2.739 50 40 GFGB O=C(CN1CCCCCC1=O)NNC(=O)c1cc2c(s1)CCCCCC2 14187604 UAOPZXBNBPVKMC-UHFFFAOYSA-N 377.510 2.571 50 40 GFGB Cc1ccccc1OCC(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c1ccc(O)cc1 408974085 WZEGHFJBPCJNQH-QMFLXTPQSA-N 397.475 2.761 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)ccc1OCC(N)=O 408819998 ZSMWKVOLGGNAKS-JXEBCEQSSA-N 385.464 2.551 50 40 GFGB CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)CBr)cc1 35604929 GAUNBRXAYXVGIB-UHFFFAOYSA-N 397.294 2.841 50 40 GFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1cccn1-c1cccc(C(=O)O)c1 35132599 NFQJMQSJGHQVHM-BKUYFWCQSA-N 392.371 2.777 50 40 GFGB CCCCn1c(SCC(=O)NNC(=O)c2ccccc2)nnc1-c1ccco1 4882055 KFAKYNKJAPZIDL-UHFFFAOYSA-N 399.476 2.892 50 40 GFGB CCOc1nccn2c(CNC(=O)CCCC[C@H]3CCSS3)nnc12 238811765 AMCUTPFIEGAXMB-LBPRGKRZSA-N 381.527 2.853 50 40 GFGB C=CCN1C(=O)[C@]2(c3ccccc31)[C@@H]1CCCC=C1C(C#N)=C(N)C2(C#N)C#N 2218713 ZNGKIVGFDJUHRB-UZUQRXQVSA-N 381.439 2.967 50 40 GFGB CCOC(=O)/C(C#N)=C/c1c(Oc2ccccc2OC)nc2ccccn2c1=O 2436721 INFHNASZOQWDRI-WYMLVPIESA-N 391.383 2.965 50 40 GFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(Cl)cc3[N+](=O)[O-])[C@H]2C1 5690667 JGZZABLJRHXUOW-RDJZCZTQSA-N 394.822 2.603 50 40 GFGB Cc1cc(OCC(=O)NNC(=O)COc2ccc(Cl)cc2)ccc1Cl 6477543 MPECBSQTELXZJH-UHFFFAOYSA-N 383.231 2.907 50 40 GFGB Cc1cc(/C=N/NC(=O)[C@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(Cl)cc1 7324520 JPNOFEDQRHSLJS-ANKPHQHTSA-N 393.896 2.632 50 40 GFGB CCc1ccccc1N1C[C@@H](C(=O)NNC(=O)c2ccc(Cl)cc2)CC1=O 7881922 VAHVJHXCRHHZOO-HNNXBMFYSA-N 385.851 2.717 50 40 GFGB Cc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C/c2c(F)cccc2Cl)cc1 7994726 VASUCKGJAXOBAQ-KEBDBYFISA-N 397.859 2.558 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OC)c(C)c1 408906177 ASMLJDDQTVMMPO-SDLXJUDFSA-N 383.448 2.811 50 40 GFGB N#Cc1ccc(C(=O)N/N=C\c2cc3c(cc2Br)OCO3)c(F)c1 408964787 DYGHELXVGLYJQC-SCDVKCJHSA-N 390.168 2.952 50 40 GFGB CCOc1ccc(/C=N/NC(=O)c2sc3ncnc(N)c3c2C)cc1OC 408972357 AWJUPGWLJCYWEH-GZIVZEMBSA-N 385.449 2.753 50 40 GFGB O=C(COc1cccc(Br)c1)N/N=C\c1cccc([N+](=O)[O-])c1O 409097882 OGXDCGBNRQBWMN-IUXPMGMMSA-N 394.181 2.592 50 40 GFGB N#C/C(=C/c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)C(=O)NCCCc1ccccc1 409246699 AMLIGFBAVRVJEU-DHDCSXOGSA-N 396.359 2.865 50 40 GFGB C/C(N)=C(\C#N)C(=O)CSc1nnc2c(Cl)cc(C(F)(F)F)cn12 104866615 QVNMJFHBMLHWCQ-VURMDHGXSA-N 375.763 2.819 50 40 GFGB Cc1cc(/C=C(\C#N)C(=O)NC(N)=O)c(C)n1-c1ccc(Br)cc1 6961519 PTUOJWBRUNGTLP-MDWZMJQESA-N 387.237 2.959 50 40 GFGB Cc1ccc(S(=O)(=O)N[C@@H](C(=O)N/N=C/c2cccc(C)c2)C(C)C)cc1 408754009 IFQOZDNPUBLLPE-DBRLUCFCSA-N 387.505 2.757 50 40 GFGB N#C/C(=C/c1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(C(=O)O)c1 408544068 UNNRQIHBWRAQAA-ATVHPVEESA-N 377.400 2.767 50 40 GFGB COc1cc(/C=C/C(=O)NN)cc(Cl)c1OCc1ccc([N+](=O)[O-])cc1 226337296 YBIWUVUIIPSURO-QPJJXVBHSA-N 377.784 2.839 50 40 GFGB CCCOc1ccc(/C=N/NC(=O)C(=O)NC2CCCCC2)cc1OCC 4402105 SOUPPZWRWLHXFC-KGENOOAVSA-N 375.469 2.773 50 40 GFGB Cc1ccc(C2=N[C@@](NC(=O)c3ccccc3)(C(Cl)Cl)C(=O)N2)cc1 101426552 PEWRANPDVUEPOW-GOSISDBHSA-N 376.243 2.801 50 40 GFGB O=C(NNC(=O)c1cncn1-c1ccccc1)c1ccccc1Br 12506320 ZPOADWFETQZKMH-UHFFFAOYSA-N 385.221 2.710 50 40 GFGB CNC(=O)/C(C#N)=C1\S[C@H](Cc2ccccc2)C(=O)N1c1ccc(F)cc1 1888589 USKCGTSBINHQOG-XUMLYMLNSA-N 381.432 2.998 50 40 GFGB C[C@@H]1CCC[C@H](NC(=O)CCC(=O)NNC(=O)Cn2ccc3ccccc32)[C@@H]1C 4676728 ZILMRPFOIUHSHP-NUJGCVRESA-N 398.507 2.510 50 40 GFGB CN(c1ccc(C(=O)N/N=C/c2c(O)ccc3ccccc23)cc1)S(C)(=O)=O 409115183 KVDYCKGWFHCTOR-FYJGNVAPSA-N 397.456 2.705 50 40 GFGB O=C(N/N=C/c1ccccc1I)c1cccc([N+](=O)[O-])c1 5678727 RLECORBXRBKJCK-CXUHLZMHSA-N 395.156 2.963 50 40 GFGB CC1(C)[C@]2(C)CC[C@]1(C(=O)NCCN1CCCCC1)[C@H](Br)C2=O 100868375 PLSNWPRDSCYRJM-FSPWUOQZSA-N 385.346 2.747 50 40 GFGB CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cccc([N+](=O)[O-])c3)[C@H]2C1 23379244 SNPIHSCJNGCICY-RBUKOAKNSA-N 388.431 2.730 50 40 GFGB CCc1ccc(/C=N/NC(=O)CNS(=O)(=O)c2c(C)cc(C)cc2C)cc1 6542850 FBMKINWUSNLZQB-CIAFOILYSA-N 387.505 2.603 50 40 GFGB CCc1ccccc1N1C[C@H](C(=O)NNC(=O)c2ccc(Cl)cc2)CC1=O 7881921 VAHVJHXCRHHZOO-OAHLLOKOSA-N 385.851 2.717 50 40 GFGB O=C(NNC(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12)c1cnccn1 12974273 UXEBHXGBPRLFFT-UHFFFAOYSA-N 387.374 2.906 50 40 GFGB COc1ccccc1OCC(=O)N/N=C/c1cccn1-c1ccc(C(=O)O)cc1 4092123 IXNRSEYMOOGVOL-LPYMAVHISA-N 393.399 2.713 50 40 GFGB CCCc1nn(C)c2c(=O)[nH]c(-c3cc([C@H](O)CCl)ccc3OCC)nc12 77293463 QFQLUTUWAYYGSV-CQSZACIVSA-N 390.871 2.947 50 40 GFGB in-vitro COc1ccc(-c2n[nH]cc2/C=N\NC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC 32565545 IJKMPHXJNDKURY-NHDPSOOVSA-N 395.375 2.766 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)cc1OC 3059268 SPGUIRKSIGCGDN-LSHDLFTRSA-N 395.337 2.811 50 40 GFGB COC(=O)/C(C#N)=C/c1c(Oc2ccc(OC)cc2)nc2ccccn2c1=O 4205376 IPEZCGUEAKHPPD-ACCUITESSA-N 377.356 2.575 50 40 GFGB C[C@@H]1CCC[C@@H](C)N1C(=O)Cn1c(NNC(=O)n2ccnc2)nc2ccccc21 4912743 CQYBRQAKGRHJAD-HUUCEWRRSA-N 395.467 2.607 50 40 GFGB O=C(NNS(=O)(=O)c1cccc(C(F)(F)F)c1)c1ccc2ccccc2n1 12770982 FFAAGORSDGPTSR-UHFFFAOYSA-N 395.362 2.877 50 40 GFGB O=C(NNC(=O)c1cccnc1)C1=NN(c2ccccc2)[C@@H](c2ccccc2)C1 40068108 IEGYOFFSWBYQEP-HXUWFJFHSA-N 385.427 2.850 50 40 GFGB O=C(COc1ccc(/C=N\NC(=O)c2ccccc2)cc1)NCc1ccco1 58882857 SOXYMQYGAQXOAQ-QRVIBDJDSA-N 377.400 2.739 50 40 GFGB CCOc1cc(/C=N/NC(=O)[C@@H](C#N)c2ccccc2)ccc1OCCOC 6961163 JNOIWCMZWCOMKU-FSTGKYBXSA-N 381.432 2.868 50 40 GFGB N#C/C(=C\c1c(N2CCCCC2)nc2ccccn2c1=O)C(=O)N1CCCCC1 1464682 VVUKLQRMXRUPCE-BMRADRMJSA-N 391.475 2.604 50 40 GFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(Br)cc3)[C@@H]2C1 4149613 USLDAJCEQPIJJC-SJORKVTESA-N 394.276 2.804 50 40 GFGB COc1ccc([C@H](C)c2cc3c(cc2OC/C(C)=N/NC(N)=O)OCO3)cc1 5766580 JDFMUFLXSNRXNM-AEOXGOBCSA-N 385.420 2.999 50 40 GFGB Cc1ccc(/C=N/NC(=O)CN(C)S(=O)(=O)c2c(C)cc(C)cc2C)cc1 6840327 IEYKANJMJDSMDJ-CIAFOILYSA-N 387.505 2.691 50 40 GFGB COc1ccccc1NC(=O)[C@H](C)SC1=C(C#N)C(C)(C)[C@@H](C#N)C(=O)N1 7252366 VDEAEJBZEGNKAM-RYUDHWBXSA-N 384.461 2.786 50 40 GFGB Cc1ccsc1/C=N/NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 17080000 VHUPIKJRCYIACZ-UZUMKDMXSA-N 391.518 2.608 50 40 GFGB CCOC(=O)/C(C#N)=C\c1cn(CCC(=O)O)nc1-c1ccc(OC)c(OC)c1 6179662 MXUACKCJWHJOEM-ZROIWOOFSA-N 399.403 2.512 50 40 GFGB O=C(N/N=C1/CCc2ccccc21)c1cccc(S(=O)(=O)N2CCCC2)c1 6238246 YBPKOQVJXOCUSF-VZCXRCSSSA-N 383.473 2.551 50 40 GFGB O=C(Cc1ccc(Cl)cc1)NC(=S)NNC(=O)c1ccc(Cl)cc1 6506082 STSIALVNSHHBIV-UHFFFAOYSA-N 382.272 2.872 50 40 GFGB COC(=O)c1cccc(NC(=O)CCNC(=O)[C@@H](Br)C(C)(C)C)c1 8733068 KKOAIBVBWCIVLH-CQSZACIVSA-N 399.285 2.728 50 40 GFGB CNc1nc2[nH]c(=O)c3c(c2s1)OC(N)=C(C#N)[C@H]3c1ccccc1Cl 15082509 YIESDKNHGKBVIB-SNVBAGLBSA-N 385.836 2.898 50 40 GFGB Cc1ccc(/C=N\NC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1 32576980 JBEOLGVPRQQFRL-UCQKPKSFSA-N 384.911 2.916 50 40 GFGB COc1ccc(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)cc1OC 105992711 VPSMKQMSSQNIOA-FSJBWODESA-N 389.411 2.968 50 40 GFGB COC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cccc(I)c1 2344790 QNRSSLSHYJBEFP-ZDUSSCGKSA-N 396.184 2.546 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc(Br)c1O 3102778 BJMZZUHBTGUPOK-CAOOACKPSA-N 394.181 2.835 50 40 GFGB C/C(=N\NC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1cccnc1 6296067 MBLQIRYPXFAWFS-LFVJCYFKSA-N 397.442 2.937 50 40 GFGB COc1cc(C(=O)NNC(=O)c2ccccc2)ccc1OCc1c(C)noc1C 2662472 CPSYLXBMYXYXSC-UHFFFAOYSA-N 395.415 2.954 50 40 GFGB C[C@@H]1CCC[C@@H](C)N1C(=O)CSc1nnc(NC(=O)CCCl)s1 4904168 VKDMZGXSHLLOPY-NXEZZACHSA-N 376.935 2.987 50 40 GFGB CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(Br)cc1 6337269 USXWOYSFEQUMAI-UHFFFAOYSA-N 393.237 2.688 50 40 GFGB Cc1ccc(C(=O)N/N=C/c2ccc(CNS(=O)(=O)c3ccccc3)o2)cc1 408771727 BQDOKPSPUIDGRZ-FYJGNVAPSA-N 397.456 2.830 50 40 GFGB O=C(N/N=C/c1ccc(OC(=O)c2ccco2)c([N+](=O)[O-])c1)c1cccnc1 4458523 ZKEZQZISYCYZPO-KEBDBYFISA-N 380.316 2.566 50 40 GFGB Cc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccc(Cl)cc3)CC2=O)cc1C 408637892 ARAXXKQTTDXDQV-OAHLLOKOSA-N 385.851 2.771 50 40 GFGB O=C(CN1CCC(c2c[nH]c3ccccc23)CC1)NNC(=O)c1ccccc1 8748296 SCXSWOHYNMWPBW-UHFFFAOYSA-N 376.460 2.809 50 40 GFGB O=C(COc1ccccc1I)N/N=C\c1ccsc1 409002411 ZRCQYUAGFFTCCM-CHHVJCJISA-N 386.214 2.882 50 40 GFGB Cc1ccccc1COc1ccc(C(=O)NN)cc1I 216820616 RBAOKYJQGRDREH-UHFFFAOYSA-N 382.201 2.782 50 40 GFGB COc1ccc(-c2n[nH]cc2/C=N\NC(=O)CCc2ccc(O)c(O)c2)cc1 44790609 KIKOSSNUBPWLGT-NHDPSOOVSA-N 380.404 2.579 50 40 GFGB O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@H]1COc2ccccc2O1 41780495 YCCAELGQXOXZJB-CQSZACIVSA-N 383.282 2.897 50 40 GFGB CC(=O)c1ccc(NC(=O)CSC2=C(C#N)C(C)(C)[C@H](C#N)C(=O)N2)cc1 1438361 LYDRIJSGZPKEPE-CQSZACIVSA-N 382.445 2.592 50 40 GFGB COc1ccc(Cl)cc1C(=O)NNS(=O)(=O)c1ccc(Cl)s1 2642922 FTDRTXCHMDPIFC-UHFFFAOYSA-N 381.262 2.687 50 40 GFGB COC(=O)CSC1=C(C#N)C2(CCCC2)C(c2nc(C)cs2)=C(N)N1 10322689 HDFINDUCDVRMAI-UHFFFAOYSA-N 376.507 2.884 50 40 GFGB O=C(CN1CCCc2ccccc21)NNC(=O)c1csc(Br)c1 12545742 FVYGXJSMDSPXLA-UHFFFAOYSA-N 394.294 2.724 50 40 GFGB CCn1c2ccccc2c2cc(/C=N/NC(=O)CCN3CCN(C)CC3)ccc21 22036332 JVYSYLZOQROXEC-JJIBRWJFSA-N 391.519 2.902 50 40 GFGB NC(=O)COc1ccc(/C=N\NC(=O)C(c2ccccc2)c2ccccc2)cc1 58884482 HJYMORZYWLNYQQ-MYYYXRDXSA-N 387.439 2.833 50 40 GFGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1cc2c(cc1[N+](=O)[O-])OCO2 856156 OCNARWYXAMJHCJ-INIZCTEOSA-N 383.360 2.774 50 40 GFGB O=C(CC[C@@H](O)c1ccccc1)N/N=C/c1ccc(I)o1 58886409 UGIAYHGUJXMIGO-VGSSETLESA-N 398.200 2.848 50 40 GFGB O=C(CSc1nnc(Nc2ccccc2)s1)NNC(=O)c1ccccc1 2726520 ANRMUVCFYIKTQS-UHFFFAOYSA-N 385.474 2.835 50 40 GFGB CCOc1ccccc1NC(=O)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@@H]2Br 408689139 XRTBCIFPTLVWJL-BMTCLBQJSA-N 380.238 2.595 50 40 GFGB CCOc1cc(C(=O)NNC(=O)c2cccnc2)ccc1OCc1cccnc1 32035755 NGTMLEBBNJRBKT-UHFFFAOYSA-N 392.415 2.529 50 40 GFGB CC1=C(C#N)C(=O)N(Cc2ccccc2)C(=O)/C1=C\Nc1ccc2[nH]c(=O)[nH]c2c1 16693940 RXIASIHDOBSHRS-BOPFTXTBSA-N 399.410 2.561 50 40 GFGB C/C(=N\NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O)c1ccc(C)cc1 19954268 CENGQWNZYJITFW-XSFVSMFZSA-N 393.896 2.955 50 40 GFGB C#CCOc1ccc(Br)cc1/C=N/NC(=O)[C@H](O)c1ccccc1 59471524 VJWSSEGMXCWLNN-XNHPLOEXSA-N 387.233 2.645 50 40 GFGB COc1ccc(NC(=O)CSC2=C(C#N)[C@@H](c3ccco3)CC(=O)N2)cc1 409133356 SPIHONIOLNVOQV-AWEZNQCLSA-N 383.429 2.999 50 40 GFGB COc1ccc(/C=N/NC(=O)c2cc3c(OC)c(OC)c(OC)cc3[nH]2)cc1 2363466 JFNLSTYCPFSWSW-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB Cn1cnnc1SCC(=O)N/N=C/c1ccc(OCc2ccccc2F)cc1 2395187 AKTTWJRXHOKNMZ-UFFVCSGVSA-N 399.451 2.776 50 40 GFGB Cc1ccc(-n2ncc(N(C)NC(=O)C(C)(C)CCl)c(Cl)c2=O)cc1 4276890 UPKQEFUAYWOTCK-UHFFFAOYSA-N 383.279 2.927 50 40 GFGB Cc1ccc(/C=N/NC(=O)[C@@H](C)N(c2ccccc2)S(C)(=O)=O)c(C)c1C 4363630 AQGUQTWJDPIQFR-VYVDHXHBSA-N 387.505 2.917 50 40 GFGB COc1cc(/C=N/NC(=O)c2cc(C)n[nH]2)ccc1OC(=O)c1ccccc1 18240582 RFMOOKCVJWKKIY-CIAFOILYSA-N 378.388 2.710 50 40 GFGB O=C(COc1ccc(/C=N/NC(=O)c2ccccc2O)cc1)NC1CCCCC1 28214792 DHPMKDLJPHIMRX-OEAKJJBVSA-N 395.459 2.984 50 40 GFGB COc1cc([C@@H](C)NC(=O)NCCNC(=O)[C@H](C)Cl)ccc1OC(C)C 65607589 ULKWWAMIUFZXET-QWHCGFSZSA-N 385.892 2.586 50 40 GFGB O=C(O)COc1ccc(/C=N\NC(=O)COc2cccc(Cl)c2)cc1Cl 408847770 ROIRLOYOJLUOPD-ZBKNUEDVSA-N 397.214 2.986 50 40 GFGB CS(=O)(=O)c1ncc(Cl)c(C(=O)/C(C#N)=C2\Nc3ccccc3S2)n1 104832261 TUYDZLLZUDPHMZ-RIYZIHGNSA-N 392.849 2.669 50 40 GFGB O=C(COc1ccc(Cl)cc1)NNC(=O)CSc1nc2ccccc2[nH]1 5204471 ZMDJWTDLVQHEDX-UHFFFAOYSA-N 390.852 2.535 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc(C(F)(F)F)c1)c1ccccc1 408879507 GPRUGYHKKJKUES-SRZZPIQSSA-N 399.394 2.622 50 40 GFGB Cc1cc(/C=N/NC(=O)[C@@H]2CCS(=O)(=O)C2)c(C)n1-c1ccc(Cl)cc1 7324519 JPNOFEDQRHSLJS-DGURAOSJSA-N 393.896 2.632 50 40 GFGB COc1cc(/C=C/C(=O)NNC(=O)COc2c(C)cccc2C)cc(OC)c1 7960725 ABIFVUVFHXRNFA-CMDGGOBGSA-N 384.432 2.560 50 40 GFGB CCc1ccc(OCC(=O)NNC(=O)COc2ccc(Cl)cc2C)cc1 5877815 UDVPVZSSSSQFOC-UHFFFAOYSA-N 376.840 2.816 50 40 GFGB O=C(N/N=C/c1cc(Cl)cc([N+](=O)[O-])c1O)c1cncc(Br)c1 2272872 GRWUUQNQTSKYHT-YAXRCOADSA-N 399.588 2.875 50 40 GFGB O=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C/c1cccc(O)c1 2357337 BMDNUNGSIXGMNR-MFKUBSTISA-N 387.439 2.791 50 40 GFGB CCCCN1C(=O)/C(=N\NC(=O)Cc2nc3ccccc3[nH]2)c2ccccc21 3233870 XTESMQQBBBKJEM-QQTULTPQSA-N 375.432 2.773 50 40 GFGB Cn1cc([C@H]2C(C#N)=C(N)N(c3ccc([N+](=O)[O-])cc3)C3=C2C(=O)CCC3)cn1 5590394 OJORGHOKUAXFEG-SFHVURJKSA-N 390.403 2.633 50 40 GFGB COc1ccc(/C(C[C@H]2OC(=O)c3ccccc32)=N/NC(=O)C[N+](C)(C)C)cc1 17215496 UFHWSDAVPJUQDQ-PAYQVUOSSA-O 396.467 2.524 50 40 GFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)Cc1ccc(Cl)cc1 408727491 ZVFHMJBXYJGRHU-VXLYETTFSA-N 377.784 2.958 50 40 GFGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc2cc(OCC)ccc2[nH]c1=O 876622 REPBOZNFHNUZHB-SFHVURJKSA-N 395.415 2.572 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2cccc(OC)c2)cc(Cl)c1O 6958767 PLAOWNGEFXKSIM-KEBDBYFISA-N 391.811 2.542 50 40 GFGB Cc1cc(/C=N/NC(=O)C(=O)NCCc2ccccc2)c(C)n1-c1ccccc1 58884254 FXDIDGOSBBSEQX-PCLIKHOPSA-N 388.471 2.903 50 40 GFGB CCCC1=NN(c2ccc(F)cc2)C(=O)/C1=C(/C)NNC(=O)c1ccncc1 103918433 YNIODMHNOLJSKF-AQTBWJFISA-N 381.411 2.932 50 40 GFGB CCOc1ccc(OCc2ccc(C(=O)NNC(=O)[C@H]3CCCO3)cc2)cc1 6635233 ZNPVQVOOQXUMOC-LJQANCHMSA-N 384.432 2.604 50 40 GFGB COc1cc(N2CCOCC2)ccc1/C=N\NC(=O)Nc1ccccc1OC 409229674 STEVOARHJNPJPU-STZFKDTASA-N 384.436 2.696 50 40 GFGB Cc1noc(C(C)C)c1C(=O)NNC(=O)[C@H](C)Nc1nc2ccccc2s1 32904527 HYHUSXQUISCVAG-NSHDSACASA-N 387.465 2.978 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C\N2CCN(c3ccc(F)cc3)CC2)cc1 102820797 GUWKNZFWANWZDP-VLGSPTGOSA-N 394.450 2.680 50 40 GFGB CN1[C@H]2CC[C@@H]1C=C1C(C#N)=C(N)C(C#N)(C#N)[C@H](c3c(F)cccc3F)[C@H]12 102566584 JBPGDEKLKIFDTA-CITCOMRZSA-N 377.398 2.851 50 40 GFGB N#Cc1ccc(OCC(=O)NNC(=O)Cc2coc3cc4c(cc23)CCC4)cc1 12755926 RUIDAEZPOWCRSN-UHFFFAOYSA-N 389.411 2.562 50 40 GFGB CCCCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc3c(c2)OCO3)cc1 408998297 AZGOSEAFBQMNJZ-CIAFOILYSA-N 383.404 2.683 50 40 GFGB COc1ccc(NC(=O)/C(C#N)=C\c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O)cc1 408744614 GFKUNPRHCBIXMI-WDZFZDKYSA-N 384.304 2.763 50 40 GFGB O=C(Cn1ccc(C(F)(F)F)n1)N/N=C/c1ccccc1Br 3370576 HAPUAVZNJGTZRX-CNHKJKLMSA-N 375.148 2.815 50 40 GFGB COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(C)n(C4CC4)c(=O)c32)cc1OC 2430927 GAHBLNQYOVVQRL-SFHVURJKSA-N 379.416 2.727 50 40 GFGB COc1cccc(C(=O)N/N=C/c2cc(Br)c(O)c(OC)c2)c1 2771705 MSAUNUKWHAICSN-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB COc1ccc(SCC(=O)NNC(=S)NCCCc2ccccc2)cc1 408588795 YZJPFDJUBJPDDI-UHFFFAOYSA-N 389.546 2.915 50 40 GFGB COc1cc(C)ccc1C(=O)N/N=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 409012166 JCEWXNMQIJEKLE-FYJGNVAPSA-N 398.419 2.512 50 40 GFGB COc1ccc(CC(=O)NNC(=O)COc2cc(C)c(Cl)c(C)c2)cc1 669836 FJGYREOSMOOWME-UHFFFAOYSA-N 376.840 2.734 50 40 GFGB Cc1cccc(OCC(=O)N/N=C/c2ccc(I)o2)c1 1508599 LXTLEWKWZIPIDU-LZYBPNLTSA-N 384.173 2.722 50 40 GFGB COc1cc2c(cc1/C=N\NC(=O)CSc1ccc([N+](=O)[O-])cc1)OCO2 409099091 QCRGUQIDSZRENL-LSCVHKIXSA-N 389.389 2.575 50 40 GFGB COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCCC[C@@H]2C)c1C 4494280 CXXBTBYZLROBJA-UZUMKDMXSA-N 387.480 2.603 50 40 GFGB Cc1ccc(C)c(N(CC(=O)N/N=C/c2cccc(Cl)c2)S(C)(=O)=O)c1 408767242 KNOBXPSGNGDGDM-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@@]12C(=O)Nc1ccc(Cl)cc12 9305218 PPVTWZVPSWKGRQ-FQEVSTJZSA-N 391.770 2.771 50 40 GFGB N#C/C(=C/c1ccc(-c2cccc(Cl)c2)o1)C(=O)N[C@@H]1CCS(=O)(=O)C1 5944284 LMOLFTVPLBIKDT-UZGISAJGSA-N 390.848 2.810 50 40 GFGB C=CCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(F)cc2)c(OCC)c1 408602412 DLHLAEANEDPYMD-ZMOGYAJESA-N 399.422 2.556 50 40 GFGB O=C(COc1ccc(Cl)cc1Cl)NNC(=O)c1cccc([N+](=O)[O-])c1 1479732 RNXKRRNSVWVPJH-UHFFFAOYSA-N 384.175 2.742 50 40 GFGB O=C(N/N=C/c1ccc2c(c1)OCO2)c1cccc(I)c1 59502268 BRHXDJMMBQHDEZ-CAOOACKPSA-N 394.168 2.784 50 40 GFGB CCOc1ccc(CC(=O)N/N=C/c2cn(CCC(N)=O)c3ccccc23)cc1 10315686 GJUOXHSYTPBTNB-ZVHZXABRSA-N 392.459 2.608 50 40 GFGB CC(C)c1ccc(OCC(=O)N/N=C2/C(=O)Nc3ccc([N+](=O)[O-])cc32)cc1 6201438 POYXMCZUHOUFTB-UHFFFAOYSA-N 382.376 2.570 50 40 GFGB N#CC1=C(N)C(C#N)(C#N)[C@@H](c2ccc(C(=O)O)cc2[N+](=O)[O-])[C@H]2CCCC=C12 33706704 WPKLQXQKRAKGAO-SUMWQHHRSA-N 389.371 2.887 50 40 GFGB CC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(/C)NNC(=O)c1cccnc1 101152991 ZNQGPTSBFUDLEL-WJDWOHSUSA-N 392.444 2.622 50 40 GFGB C[C@H]1[C@H](C)CCC[C@H]1NC(=O)CCC(=O)NNC(=O)Cn1ccc2ccccc21 103142637 ZILMRPFOIUHSHP-SOLBZPMBSA-N 398.507 2.510 50 40 GFGB C=CCc1cc(/C=N/NC(=O)c2ccccc2F)cc(OC)c1OCC(=O)O 59250093 PATLMFQERWMVGL-SSDVNMTOSA-N 386.379 2.790 50 40 GFGB CC(=O)Nc1cccc(C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c1 12815559 XVUJRVDGYWYJCF-UHFFFAOYSA-N 383.448 2.917 50 40 GFGB COc1cc(C(=O)N/N=C(/Cc2ncc[nH]2)c2ccccc2)cc(OC)c1OC 13133604 UTCCOJHKHVSQRA-JLPGSUDCSA-N 394.431 2.812 50 40 GFGB O=C(CN(Cc1ccco1)S(=O)(=O)c1ccccc1)NN=C1CCCC1 408976582 RQSGMKIBKGRAMP-UHFFFAOYSA-N 375.450 2.517 50 40 GFGB COc1cc(C=NNC(=O)CC#N)ccc1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 408738073 ISGIHKOUVXMGDA-UHFFFAOYSA-N 399.319 2.668 50 40 GFGB O=C(CN1CCN(Cc2ccccc2Cl)CC1)N/N=C\c1ccccc1F 31906044 RBGBMPYIGBXLLS-QRVIBDJDSA-N 388.874 2.747 50 40 GFGB O=C(O)c1ccccc1/C=N/NC(=O)C1CCN(C(=O)c2ccc(F)cc2)CC1 1095094 XKWHICVSNBEDSG-YDZHTSKRSA-N 397.406 2.526 50 40 GFGB Cc1ccccc1OCC(=O)N/N=C/c1ccc(I)o1 2674625 MDUASGHUGBPESI-LZYBPNLTSA-N 384.173 2.722 50 40 GFGB CCC(=O)NNC(=O)CSc1nnc(-c2ccccc2)c(-c2ccccc2)n1 4187357 QBIBHZSZZUKZPU-UHFFFAOYSA-N 393.472 2.855 50 40 GFGB C/C(N)=C(/C#N)C(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(F)cc1 8725361 ROPMQKFLKZWCIV-FOWTUZBSSA-N 394.431 2.942 50 40 GFGB CCOc1ccc2ccccc2c1/C=N/NC(=O)CNC(=O)c1ccncc1 2269772 OYAMHLLEFGUWOQ-ZMOGYAJESA-N 376.416 2.514 50 40 GFGB Cc1cc(O)cc(O)c1/C=N\NC(=O)[C@H]1COc2ccc(C(C)(C)C)cc2O1 13810613 XVPZDBDBYCZZLE-RCECTWRXSA-N 384.432 2.994 50 40 GFGB COC(=O)COc1cccc(/C=N/NC(=O)c2cc3ccccc3cc2O)c1 4502832 SYSSIRFKCSGBKC-WSDLNYQXSA-N 378.384 2.861 50 40 GFGB COC(=O)c1ccc(/C=N/NC(=O)Cc2ccc(Br)cc2)cc1 4735310 DDCOTVIQSYKERS-YBFXNURJSA-N 375.222 2.929 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(O)c(OCC)c1 408907568 NSFKETSCPZUYEF-NIZGNDASSA-N 399.447 2.598 50 40 GFGB COc1cccc(/C=N/NC(=O)c2ccccc2Cl)c1O[C@H](C)C(=O)O 409233400 VVUPVMXCPWLRAR-JZOCJUILSA-N 376.796 2.964 50 40 GFGB COC(=O)c1ccc(NC(=O)C(=O)N/N=C\c2ccc(Cl)cc2Cl)cc1 223157579 KKWFWTIQSGLXNH-UKWGHVSLSA-N 394.214 2.869 50 40 GFGB CC(C)(C)c1ccc(C(=O)NNC(=O)c2ccc(Cn3cncn3)cc2)cc1 10891537 WMTMQHOJTMIIMD-UHFFFAOYSA-N 377.448 2.699 50 40 GFGB CCOc1cc(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])cc(Cl)c1O 1434060 VQKRPAQDIRXLKV-DJKKODMXSA-N 393.783 2.882 50 40 GFGB Cc1ccc(NCC(=O)NNC(=O)c2cccnc2SC(F)F)c(C)c1 12534520 WBBXROGZWVWBMT-UHFFFAOYSA-N 380.420 2.886 50 40 GFGB N#CC1=C(SCC(=O)Nc2ccc(C(=O)O)cc2)NC(=O)C[C@@H]1c1ccco1 3336184 RDLJOOFXRMOICK-ZDUSSCGKSA-N 397.412 2.688 50 40 GFGB N#Cc1ccc(-c2ccc(OCC(=O)N/N=C3\N=C(N)c4ccccc43)cc2)cc1 5517472 GRMQNZVKJQNBQC-UHFFFAOYSA-N 395.422 2.801 50 40 GFGB CN(C)c1cccc(OCC(=O)N/N=C\c2cc([N+](=O)[O-])ccc2Cl)c1 409097202 FZZYHATYGIEBIK-GRSHGNNSSA-N 376.800 2.843 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccco2)cc(Br)c1OC(C)=O 408762945 LZYMBJXFNXVKDZ-CAOOACKPSA-N 381.182 2.740 50 40 GFGB COc1ccccc1C(=O)N/N=C(\C)CC(=O)Nc1ccc2c(c1)OCCO2 100522764 HPJAGGWHSUBGQU-LPYMAVHISA-N 383.404 2.601 50 40 GFGB CN(C)c1ccc([C@@H]2C(C#N)=C(N)N(N(C)C)C3=C2C(=O)CC(C)(C)C3)cc1 1080471 OOMZDLYTSVOLSC-LJQANCHMSA-N 379.508 2.965 50 40 GFGB COc1cc(/C=N/NC(=O)[C@@H](O)c2ccccc2)ccc1OC(=O)c1ccco1 1083356 JILPQLRYTVPBQC-MEGCXXLRSA-N 394.383 2.691 50 40 GFGB CCc1cccc2c(/C=C(\C#N)C(=O)NCc3cccs3)cn(CC(N)=O)c12 6568126 KDODSVRVCFYEFO-OQLLNIDSSA-N 392.484 2.974 50 40 GFGB O=C(NNC(=O)[C@H]1COc2ccccc2O1)C(c1ccccc1)c1ccccc1 3453805 QTHZFODQRAGSAV-HXUWFJFHSA-N 388.423 2.806 50 40 GFGB COc1cc(OC)cc(C(=O)NNC(=O)CCC(=O)c2cc(C)sc2C)c1 5066111 CQOLQCDVUXZELN-UHFFFAOYSA-N 390.461 2.806 50 40 GFGB C/C(=N\NC(=O)CN(c1ccccc1Cl)S(C)(=O)=O)c1cccs1 20209297 RPLDLWCOCVJGKC-GZTJUZNOSA-N 385.898 2.708 50 40 GFGB O=C(N/N=C/c1ccc(Br)o1)c1ccc(CN2CCOCC2)cc1 408992325 ABWYFTFDDSRQOA-YBFXNURJSA-N 392.253 2.638 50 40 GFGB CCN(CC)c1ccc2cc(C(=N)NNC(=O)c3ccccc3)c(=O)oc2c1 1500762 ITOXBCRUOYYGLQ-UHFFFAOYSA-N 378.432 2.899 50 40 GFGB biogenic Cc1ccc(CN2CCN(CC(=O)N/N=C/c3ccc(Cl)cc3)CC2)cc1 19682617 ZPJKTAMITPDASS-OEAKJJBVSA-N 384.911 2.916 50 40 GFGB COC(=O)COc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2F)cc1OC 408812422 NAJSKUICNVWALP-ZROIWOOFSA-N 384.363 2.932 50 40 GFGB C[C@H](Sc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1 6552287 GFHNTQUWOYWRSM-MEDUHNTESA-N 392.864 2.808 50 40 GFGB CCCn1nc(C(=O)N/N=C/c2ccc(OCC)cc2)c2ccccc2c1=O 6652249 QCJPOFKVNSFGHT-HYARGMPZSA-N 378.432 2.969 50 40 GFGB C[C@@H](SCc1ccc(Br)cc1)C(=O)NNC(=O)c1ccccn1 7475537 WWPVVXUOXHEMRJ-LLVKDONJSA-N 394.294 2.927 50 40 GFGB CNC(=O)/C(C#N)=C1\S[C@@H](Cc2ccccc2)C(=O)N1c1ccc(F)cc1 16758894 USKCGTSBINHQOG-IMGOXIFKSA-N 381.432 2.998 50 40 GFGB O=C(NNC(=S)NCc1ccccc1)C(O)(c1ccccc1)c1ccccc1 17079961 JOAMMYWESFOVQH-UHFFFAOYSA-N 391.496 2.618 50 40 GFGB COc1ccc(OC)c(NC(=O)C(=O)N/N=C\c2c(F)cccc2Cl)c1 408895247 UMRHFJBCTFVIKI-UKWGHVSLSA-N 379.775 2.585 50 40 GFGB Cc1ccc(/C=N/NC(=O)CN(c2ccc(Cl)cc2C)S(C)(=O)=O)cc1 408776100 UEYGUOWMNVVUIS-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB COc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)cc(Cl)c1OCC(=O)O 409243889 YPARDCAQZXYEAV-NKVSQWTQSA-N 394.786 2.644 50 40 GFGB COc1cc2c(cc1OC)[C@@H](C1C(=O)CC(C)CC1=O)N(C(=O)CCl)CC2 4730355 FIUXBGOBUVXMRB-DZDLRIQZSA-N 393.867 2.553 50 40 GFGB O=C(COc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc(Br)s1 673672 IJRPJCRCOWXWES-VIZOYTHASA-N 384.211 2.948 50 40 GFGB CCCCC(=O)NN/C=C1\C(=O)N(c2cccc(Cl)c2)C(=S)N=C1O 2303143 RVDRQVCVOCAWCA-XFXZXTDPSA-N 380.857 2.623 50 40 GFGB COc1ccc(C[C@H]2S/C(=C(\C#N)C(N)=O)N(c3cccc(C)c3)C2=O)cc1 11690291 LBQZFEZKZDONDK-DTBMRADHSA-N 393.468 2.915 50 40 GFGB CC(NNC(=O)c1cc(Br)ccc1O)=C1C(=O)CC(C)(C)CC1=O 1410300 VENKLUNAZSHWME-UHFFFAOYSA-N 395.253 2.621 50 40 GFGB Cc1cc(C(=O)NNC(=O)COc2ccc(C(=O)c3ccccc3)cc2)c(C)o1 3411283 RIDKICTVKXIXHM-UHFFFAOYSA-N 392.411 2.967 50 40 GFGB N#CC(C(=O)COC(=O)COc1ccc2c(c1)CCC2)=C1Nc2ccccc2N1 4444587 ULIHLGDVNRQTJQ-UHFFFAOYSA-N 389.411 2.939 50 40 GFGB COc1cc(/C=N/NC(=O)c2cccc(I)c2)ccc1O 5357581 UWGQZMZNWWZLPY-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB CCn1c(SCC(=O)NNC(=O)c2ccccc2)nnc1-c1ccccc1 6634620 BKJQSJKOIFXIBM-UHFFFAOYSA-N 381.461 2.518 50 40 GFGB O=C(COc1cccc(Br)c1)NNC(=S)NCc1ccccc1 16217923 COKRMVWFCBRHEC-UHFFFAOYSA-N 394.294 2.523 50 40 GFGB Cc1ccc(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)cc1O 22988841 UUHNNGRRNVFDRQ-UHFFFAOYSA-N 377.400 2.748 50 40 GFGB N#C/C(=C/c1ccc(-c2cccc(Cl)c2)o1)C(=O)NCCN1CCOCC1 26687123 WZKCETBOSYQCEN-SSZFMOIBSA-N 385.851 2.955 50 40 GFGB COc1ccc(C)cc1NC(=O)C(=O)N/N=C/c1c(O)ccc2ccccc12 59433995 HPRLDIJAVLJDBL-WSDLNYQXSA-N 377.400 2.951 50 40 GFGB COc1ccc(C(=O)N/N=C\c2ccc(O)c(Br)c2)cc1OC 409318741 XUKNXJNTRFVETM-NVMNQCDNSA-N 379.210 2.936 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccco1)c1cc(Cl)cc(Cl)c1 408789879 OHBWZLOAGLLNRB-CAOOACKPSA-N 390.248 2.503 50 40 GFGB CCOc1ccc2oc(C(=O)N/N=C\c3ccc4c(c3)n(C)c(=O)n4C)cc2c1 409186326 AKQZRSUOGVUQTA-UUYOSTAYSA-N 392.415 2.786 50 40 GFGB CCCCC(=O)NN/C=C1/C(=O)N(c2ccccc2Cl)C(=S)N=C1O 4365527 YUTNOMISVJTUPL-MDZDMXLPSA-N 380.857 2.623 50 40 GFGB Cc1nc(Cl)c(C[C@H](Br)CBr)c(NCCO)n1 2254732 CSTQNFUDUSOIRH-ZETCQYMHSA-N 387.503 2.544 50 40 GFGB CC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cccc(I)c1 3087708 ISSVQLSTMBHMOP-CQSZACIVSA-N 380.185 2.962 50 40 GFGB NC(=O)[C@H]1C(=O)c2cccc3c2[C@@]1(Br)[C@H](Br)CCC3 4991205 RGHFSKXWVJLVKI-UDZFHETQSA-N 387.071 2.674 50 40 GFGB C[C@H](Sc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1 6552285 GFHNTQUWOYWRSM-ZBEGNZNMSA-N 392.864 2.808 50 40 GFGB NNC(=O)CSc1nnc(CNc2ccc(Cl)cc2)n1-c1ccccc1 66324376 ULHIEAKNSGNAPI-UHFFFAOYSA-N 388.884 2.615 50 40 GFGB O=C(N/N=C/c1cc2cc3c(cc2[nH]c1=O)OCCO3)[C@@H]1C[C@H]1c1ccccc1 8769198 BLSQYRCXVHCDSQ-CKGAZFRFSA-N 389.411 2.553 50 40 GFGB COC(=O)COc1ccc(/C=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 408862039 HRQCGEQKRYCJEA-DJKKODMXSA-N 391.767 2.564 50 40 GFGB O=C(c1ccc(F)cc1)[C@H](CCCl)OC(=O)[C@H]1[C@H]2C(=O)O[C@@H]3C[C@H]1C[C@H]23 408673063 WHFGZZJBKWIVEV-NMWGWCOWSA-N 380.799 2.747 50 40 GFGB COc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)cc(Br)c1O 83315126 QPZDATGIPOEMMZ-OCKHKDLRSA-N 381.201 2.995 50 40 GFGB C/C(=N\NC(=O)c1cncc(Br)c1)c1ccc2c(c1)OCCO2 13943813 GSTOYLRPNJRGBP-VXLYETTFSA-N 376.210 2.769 50 40 GFGB Cc1occc1C(=O)NNC(=O)COc1ccc(C(=O)c2ccccc2)cc1 6342755 FFDBVPPQAOGZJR-UHFFFAOYSA-N 378.384 2.659 50 40 GFGB N#C/C(=C/c1ccc2c(c1)OCO2)C(=O)OCC(=O)NCc1ccc(Cl)cc1 6415137 DKPUAVBNDUKPRS-CHHVJCJISA-N 398.802 2.835 50 40 GFGB COc1ccc(C)cc1N(CC(=O)NN=C1CCCCCC1)S(C)(=O)=O 20212235 QDVBNTXRQGUINJ-UHFFFAOYSA-N 381.498 2.596 50 40 GFGB CCOc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)N[C@H](C)CC)c2C)cc1 408940042 NVDZAYZKYFYPMV-CYGNYLSHSA-N 384.480 2.858 50 40 GFGB COc1ccc(Br)cc1/C=N/NC(=O)C(=O)NC1CCCCCC1 15227570 YCKPKJIAMHRMQK-YBFXNURJSA-N 396.285 2.747 50 40 GFGB O=C(N/N=C/c1ccc(N2CCOCC2)cc1)c1ccc(N2CCCC2)cc1 7385892 RRJAURQUTKEPFN-HAVVHWLPSA-N 378.476 2.887 50 40 GFGB COc1ccc(C(=O)N/N=C(\C)CC(=O)Nc2ccc(Cl)cn2)cc1OC 100789162 HVHLGLFRQUCVBC-SSDVNMTOSA-N 390.827 2.887 50 40 GFGB CCC(=O)N1CCc2cc(C(=O)N/N=c3/sc4ccccc4n3C)ccc21 103319731 FITCMXROOOMBMP-LSDHQDQOSA-N 380.473 2.785 50 40 GFGB CCOc1ccc(N2C[C@@H](C(=O)N/N=C/c3ccccc3OC)CC2=O)cc1 6962998 HNTQKCTUTLWZRW-QPNANDPSSA-N 381.432 2.597 50 40 GFGB O=C(COC(=O)c1ccccc1Cc1ccccc1)NNC(=O)c1ccccc1 3290519 DVTXCZCLQFLTKF-UHFFFAOYSA-N 388.423 2.895 50 40 GFGB COc1ccccc1[C@H]1C(C#N)=C(N)N(c2nc[nH]n2)C2=C1C(=O)CC(C)(C)C2 5408222 ZVHGTYKKRFDVEP-KRWDZBQOSA-N 390.447 2.754 50 40 GFGB Cc1noc(C)c1COc1ccc(C(=O)NNC(=O)c2ccccc2O)cc1 5172051 WUWMDQIBACUYHQ-UHFFFAOYSA-N 381.388 2.651 50 40 GFGB Cc1cc2c(c(=O)n1CCO)[C@@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 4851024 RJKZNENNOAYLDL-HNNXBMFYSA-N 392.242 2.674 50 40 GFGB CC(C)[C@H](NC(=O)c1ccc(F)cc1)C(=O)NNC(=O)c1c[nH]c2ccccc12 21901059 HPCAPJCQUIZKIK-SFHVURJKSA-N 396.422 2.523 50 40 GFGB O=C(N/N=C1/CCS(=O)(=O)c2ccc(F)cc21)c1cc2ccccc2cc1O 34106543 VSKZQCXMALOLCR-XLNRJJMWSA-N 398.415 2.996 50 40 GFGB Cn1c(NNC(=O)c2cc3ccccc3o2)nc2sc3c(c2c1=O)CCC3 2230000 WGTSSQQFRSLAJI-UHFFFAOYSA-N 380.429 2.987 50 40 GFGB NNC(=O)/C(=C\C=C\c1ccccc1)NC(=O)c1ccccc1Br 4507425 YHTBCTZSYVTNBO-LVEAOLTQSA-N 386.249 2.766 50 40 GFGB Nc1ccccc1C(=O)N/N=C/c1ccc(-c2cc(C(=O)O)cc(C(=O)O)c2)o1 409007363 OCCRWBMYUGGPAZ-LSHDLFTRSA-N 393.355 2.689 50 40 GFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2cc(Cl)ccc2Cl)C1)c1ccccc1 408645983 SURQMPLPYYQPJS-GFCCVEGCSA-N 392.242 2.808 50 40 GFGB O=C(O)COc1ccccc1/C=N/NC(=O)COc1cc(Cl)ccc1Cl 1103496 CMIXKTIXTWANEG-DNTJNYDQSA-N 397.214 2.986 50 40 GFGB CCOC(=O)[C@H]1C[C@H]([S@@](=O)c2ccccc2)[C@H](Cl)C[C@@H]1C(=O)OCC 12413114 CMYFIVFGISYXSM-BOYGYQERSA-N 386.897 2.923 50 40 GFGB COc1cc(/C=N\NC(=O)COc2cccc3cccnc23)ccc1OCC#N 409016008 AGHDRDHTJWSDNU-CFRMEGHHSA-N 390.399 2.675 50 40 GFGB COc1ccc2cc([C@H](C)C(=O)NNC(=O)CN3CCCCCC3=O)ccc2c1 8054564 NLUBYVBDQKAXMR-HNNXBMFYSA-N 397.475 2.502 50 40 GFGB C/C(=N\NC(=O)[C@H](C)Oc1cccc(C)c1C)c1ccc2c(c1)NC(=O)CO2 8105562 HJGYMENYTUFRFY-FVQJWRHTSA-N 381.432 2.942 50 40 GFGB Cc1cc2c(c(=O)n1Cc1ccccn1)[C@@H](c1cccs1)C(C#N)=C(N)O2 37866397 YSCXJFNLMBPUHQ-QGZVFWFLSA-N 376.441 2.880 50 40 GFGB CCOc1ccc(NC(=O)CCC(=O)NNC(=O)c2cccc(OCC)c2)cc1 14042057 MMKOHKVNHCJJRW-UHFFFAOYSA-N 399.447 2.664 50 40 GFGB Cc1cccc[n+]1[C@@H]1[C@H](c2ccccc2)C(C#N)=C([C-](C#N)C#N)N[C@]1(O)C1CC1 100023575 BHQKVVGNCAIGEQ-JRFVFWCSSA-N 395.466 2.709 50 40 GFGB Cn1cc(Br)cc1C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2 10465220 CJPFMWMBPMFXDP-UHFFFAOYSA-N 380.286 2.765 50 40 GFGB COc1cc(OC)c(/C=N/NC(=O)Cc2ccc3c(c2)OCO3)cc1Cl 408592570 ZKLJHKSITAYURT-AWQFTUOYSA-N 376.796 2.779 50 40 GFGB O=C(NNC(=O)c1ccccc1C(=O)c1ccc(F)cc1)c1ccccc1O 13009422 ZGIRYCHIAWBMGU-UHFFFAOYSA-N 378.359 2.837 50 40 GFGB CC(C)=NNC(=O)CN(c1ccc(C)cc1)S(=O)(=O)c1ccc(F)cc1 19956272 BDHPDPQCGXZJDR-UHFFFAOYSA-N 377.441 2.841 50 40 GFGB COc1ccc(C(=O)NNC(=O)COc2ccc(Br)cc2C)cc1 722438 ICKYLLPVWUEDDX-UHFFFAOYSA-N 393.237 2.606 50 40 GFGB O=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C/c1ccc(O)cc1 3080409 QSWFDKUSCJWDIJ-MFKUBSTISA-N 387.439 2.791 50 40 GFGB CN(c1ccc(C(=O)N/N=C/c2ccco2)cc1)S(=O)(=O)c1ccccc1 4502930 FXXPSSLSLUAQID-XSFVSMFZSA-N 383.429 2.869 50 40 GFGB CCCn1c(O)c(C(=O)NNC(=O)c2cccc(C)c2)c(=O)c2ccccc21 5509317 MHMXKSUHFAZRGC-UHFFFAOYSA-N 379.416 2.500 50 40 GFGB COc1cc(OC)cc(C(=O)NNS(=O)(=O)/C=C/c2ccc(Cl)cc2)c1 7379503 JVEJRVSNDAMMRJ-BQYQJAHWSA-N 396.852 2.592 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)ccc1OCC(N)=O 408819999 ZSMWKVOLGGNAKS-ZBIYFRDHSA-N 385.464 2.551 50 40 GFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2)c(OC)c1 408970165 BUQGSKICUJOYRS-NSMHLIOHSA-N 383.448 2.639 50 40 GFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1 788110 FCUZLDCZSLTVBE-RNDVCUHJSA-N 386.795 2.751 50 40 GFGB C/C(=N\NC(=O)c1nc[nH]c1C(=O)N/N=C(\C)c1ccccc1)c1ccccc1 4631292 NGMFZEKQCYKHSN-KOJZRSEWSA-N 388.431 2.718 50 40 GFGB C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)COc1ccc(C#N)cc1 6787430 MZQOIRPURNKRDP-HNNXBMFYSA-N 389.411 2.705 50 40 GFGB O=C(NNc1nc(-c2ccncc2)no1)c1cnn(-c2ccc(Cl)cc2)c1 58264015 PJHVRTRFFNVUCO-UHFFFAOYSA-N 381.783 2.728 50 40 GFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 409180831 SHRJAJRVSCWPPR-CAOOACKPSA-N 378.728 2.929 50 40 GFGB C=C(C)C(=O)OCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cccc(F)c1 2275818 IRFPIUAYLLUTQC-KRWDZBQOSA-N 386.379 2.570 50 40 GFGB O=C(CCNC(=O)c1ccccc1)N/N=C/c1c(F)c(F)c(F)c(F)c1F 2305936 BSPIWVGMKINCEA-KTZMUZOWSA-N 385.292 2.652 50 40 GFGB O=C(N/N=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 5740798 POGDBLQDUHVBDT-UDWIEESQSA-N 388.811 2.849 50 40 GFGB Cc1noc(C(C)C)c1C(=O)NNC(=O)[C@@H](C)Nc1nc2ccccc2s1 32904526 HYHUSXQUISCVAG-LLVKDONJSA-N 387.465 2.978 50 40 GFGB O=C(N/N=C/c1cccc(I)c1)c1ccccc1[N+](=O)[O-] 408598648 HATXOMUIRSOKDD-CXUHLZMHSA-N 395.156 2.963 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2ccc(Cl)cc2)S(C)(=O)=O)c(C)c1 408786858 OQUMDMAXUSRQRU-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB COC(=O)N/N=C/c1cc(OC)c(O)c(Br)c1Br 2968915 NOTPJVULLUVXIS-YIXHJXPBSA-N 382.008 2.616 50 40 GFGB COCCCNC(=O)CSC1=C(C#N)[C@@H](c2ccc(Cl)cc2)CC(=O)N1 6441095 JOIYHIUMAIUNQX-CQSZACIVSA-N 393.896 2.565 50 40 GFGB CCOC(=O)C1=C(CCl)NC(=O)N[C@H]1c1ccc(F)c(Br)c1 57509021 HDEYYMPMKLQVFY-LBPRGKRZSA-N 391.624 2.998 50 40 GFGB O=C(N/N=C\c1cc(Br)ccc1O)[C@@H]1OCCc2ccccc21 26503709 ZXICQBDIXKIGTH-DZGUVLCISA-N 375.222 2.919 50 40 GFGB O=C(COc1ccc2ccccc2c1)NNS(=O)(=O)c1ccc(F)cc1F 12781457 DOEOSEMNKLXFDY-UHFFFAOYSA-N 392.383 2.507 50 40 GFGB CC(C)c1ccc(N(CC(=O)N/N=C/c2cccs2)S(C)(=O)=O)cc1 20209051 QXOQDKMHBYZTNF-WOJGMQOQSA-N 379.507 2.788 50 40 GFGB COc1cccc(/C=N/NC(=O)C2CCN(C(=O)c3ccccc3)CC2)c1OC 409006859 RGSBRRCAYBLXRO-HZHRSRAPSA-N 395.459 2.706 50 40 GFGB COc1cccc(/C=N\NC(=O)COc2ccccc2[N+](=O)[O-])c1OC(C)C 136881241 VSXJOABDPQACJH-JAIQZWGSSA-N 387.392 2.920 50 40 GFGB O=C(NNC(=O)c1ccccc1F)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1 5848179 QZZSDYFLSWZJQF-UHFFFAOYSA-N 386.383 2.799 50 40 GFGB CCNC(=O)COc1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)cc1OC 7158372 BCUDEAFCMUNDHR-YIXFDOPESA-N 399.491 2.812 50 40 GFGB CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCc2nc3ccccc3[nH]2)cc1 16496416 PAUAXVHCKGXGBG-AWEZNQCLSA-N 396.447 2.509 50 40 GFGB N#C/C(=C/c1ccc(OCC(=O)O)c(Br)c1)C(=O)NC1CCCC1 409189368 KFMLZMXERZGOIT-GHXNOFRVSA-N 393.237 2.878 50 40 GFGB Cc1cccc(N(CC(=O)N/N=C/c2cccc(Cl)c2)S(C)(=O)=O)c1C 408906100 CJCBNNKRGLNJQE-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB CCOC(=O)/C(C#N)=C1\C(=O)N(CN2CCc3ccccc3C2)c2ccccc21 39380627 AGXSCJOJYFYQPS-VZCXRCSSSA-N 387.439 2.889 50 40 GFGB C/C(Cc1ccccc1)=N\NC(=O)CNC(=O)c1ccccc1Br 13118348 OKNSWOQWXKFWTI-FYJGNVAPSA-N 388.265 2.914 50 40 GFGB Cc1ccc(C(=O)NNC(=O)c2ccc(=O)n(Cc3ccccc3)c2)cc1C 16839261 BVIGLBFARQEDQA-UHFFFAOYSA-N 375.428 2.588 50 40 GFGB CCn1c(SCC(=O)N/N=C\c2cccnc2)nnc1-c1ccc(C)cc1 30742867 SSSXXJVWWQADFK-MTJSOVHGSA-N 380.477 2.911 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)N[C@H](C)c2ccccc2)cc1OC 7869813 ZCLMSSDOAPVADT-QQHUYRGFSA-N 381.432 2.588 50 40 GFGB O=C(CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2)NNC(=O)c1ccncc1 103116904 PWEXPTJFQJENNS-LGBHXNNWSA-N 392.297 2.967 50 40 GFGB COc1cc(/C=N/NC(=O)c2sc3ccccc3c2O)c(O)c([N+](=O)[O-])c1 2277797 XITQXHLANSOWGJ-QGMBQPNBSA-N 387.373 2.993 50 40 GFGB CC(C)c1ccc(N2/C(=N\C(=O)CCl)S[C@H]3CS(=O)(=O)C[C@@H]32)cc1 101302548 MRSOXHPOSUCGAW-HJUNTIBCSA-N 386.926 2.650 50 40 GFGB Cc1ccc(C(=O)N/N=C\c2cc(Cl)c(OCC(N)=O)c(Cl)c2)cc1 409252270 CYOAUGSQUHFWHC-WNFQYIGGSA-N 380.231 2.930 50 40 GFGB CCOc1cccc(/C=N\NC(=O)c2cccc(Cl)c2)c1OCC(=O)O 409210953 LYKIHRDUCBMRJO-JMIUGGIZSA-N 376.796 2.966 50 40 GFGB CCOc1ccc(/C=N/NC(=O)c2cc(OC)c(OC)c(OC)c2)cc1OC 2096330 GHQPMWHTJDXPGU-CIAFOILYSA-N 388.420 2.884 50 40 GFGB CC(=O)N/C(=C/c1ccccc1)C(=O)NNC(=O)c1ccc(Cl)cc1Cl 32748022 AWMMDCDFSARXBN-CXUHLZMHSA-N 392.242 2.932 50 40 GFGB CCOc1cc(/C=N/NC(=O)CCCC(=O)NC2CCCCC2)ccc1O 4565152 IROGOCUNJQAYDQ-KGENOOAVSA-N 375.469 2.860 50 40 GFGB CCN(CC)c1ccc(C(=O)NN[C@@H](C(=O)NC2CC2)c2ccccc2)cc1 12636370 GHYUUMREGRCOFP-HXUWFJFHSA-N 380.492 2.787 50 40 GFGB CC(C)COC(=O)[C@H]1/C(=N/NC(=O)CC#N)C[C@](C)(O)C[C@H]1c1ccccc1 100249091 CIPFSKNBWXNURT-WINKHJFASA-N 385.464 2.516 50 40 GFGB CCOc1cc(/C=N/NC(=O)C2CCN(C(=O)c3ccccc3)CC2)ccc1O 409004842 FHOPZEQHYWLUPE-HZHRSRAPSA-N 395.459 2.793 50 40 GFGB Cc1ccc2c(c1)[C@]1(C(=O)N2C)C(C#N)=C(N)Oc2c1c(C)nn2-c1ccccc1 5269442 VSGXYONTDBKGKF-QHCPKHFHSA-N 397.438 2.838 50 40 GFGB O=C(CNC(=O)c1ccc(Oc2ccccc2)cc1)NNC(=O)c1cccs1 7653680 AHZQBULRTUJEMD-UHFFFAOYSA-N 395.440 2.731 50 40 GFGB COCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cccc(Br)c1 12402633 QFCIJNHKPZCINV-OAHLLOKOSA-N 393.237 2.720 50 40 GFGB CCC(=N\NC(=O)c1ccccc1O)/C(CC)=N/NC(=O)c1ccccc1O 96837087 JTSJSAKSGVQGTC-YHARCJFQSA-N 382.420 2.790 50 40 GFGB COc1cccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)c1OC 100201245 KABZAGLGNIBUQK-INIZCTEOSA-N 388.379 2.845 50 40 GFGB CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)C(=O)N/N=C/c1ccncc1 107548195 PYNMRCMXLUZNQJ-XNQWGTPPSA-N 398.463 2.642 50 40 GFGB COc1ccccc1/C=N/NC(=O)c1cc2c(OC)cc(OC)c(OC)c2[nH]1 2342267 VYNODNZIXAYEJO-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB C[C@@H](OC(=O)/C(C#N)=C\c1ccc(N(C)C)cc1)C(=O)NC1(C#N)CCCCC1 96798018 SJZOKFFNIMSMMU-OKSBFYSISA-N 394.475 2.934 50 40 GFGB Cc1cccc(/C=N/NC(=O)CN(c2cccc(Cl)c2)S(C)(=O)=O)c1 408768838 KCCOCOWYRZEEBY-YBFXNURJSA-N 379.869 2.565 50 40 GFGB COc1ccc(C(=O)NCC(=O)N/N=C/C(C)=C/c2ccccc2)cc1OC 4526470 GVAIIVJDWNMTKY-RESQAUMJSA-N 381.432 2.639 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccsc3)[C@H]2C1 1803230 KUQNRDWGSIFKAO-HOTGVXAUSA-N 379.445 2.630 50 40 GFGB Cn1c(SCC(=O)N/N=C/c2ccncc2)nnc1-c1cccc(Cl)c1 2384379 WFHNEWYISOJXJU-KEBDBYFISA-N 386.868 2.773 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1C(F)(F)F)c1ccccc1 3663405 NNPKOHSZIUXFBX-SRZZPIQSSA-N 399.394 2.622 50 40 GFGB Cc1nn(-c2ccccc2)c(O)c1/C(=N/NC(=O)c1ccncc1)C(F)(F)F 5433585 SJOCAGRNSBIIRD-HAHDFKILSA-N 389.337 2.978 50 40 GFGB CCOc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(COC)c32)ccc1OC(C)C 6196128 UOFYNIXGMRYYGW-KRWDZBQOSA-N 384.436 2.960 50 40 GFGB Cc1cccn2cc(COc3ccccc3C(=O)NNC(=O)c3ccco3)nc12 12822797 JLHLIDDNJNXSGA-UHFFFAOYSA-N 390.399 2.890 50 40 GFGB O=C(N/N=C/c1ccccc1[N+](=O)[O-])C1CCN(C(=O)c2ccccc2)CC1 409004276 BRRPDUDXBOMNBL-KGENOOAVSA-N 380.404 2.597 50 40 GFGB O=C(NNC(=O)[C@H]1CCCC[C@H]1C(=O)O)C(c1ccccc1)c1ccccc1 1280982 GXJAMTYDNUGGRX-ZWKOTPCHSA-N 380.444 2.857 50 40 GFGB CSc1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2ccccc2)c1 3292795 KKOSHRLLEHQHJQ-UHFFFAOYSA-N 378.837 2.680 50 40 GFGB Cc1cc(C)nc(NNC(=O)COc2ccc(C(=O)c3ccccc3)cc2)n1 14512099 XYOIESHYRZWMLK-UHFFFAOYSA-N 376.416 2.847 50 40 GFGB COc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)c(OC)c1 18201228 XPMKVRCFMACIMG-QGZVFWFLSA-N 388.379 2.845 50 40 GFGB CC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(=O)NCCN3CCOCC3)o2)cc1 27018712 RRITZGFYJUNFEG-XMHGGMMESA-N 393.443 2.505 50 40 GFGB CCOC(=O)COc1ccccc1/C=C(/C#N)C(=O)NCc1ccc(OC)cc1 408815051 RJPRZLVKPALCAG-PDGQHHTCSA-N 394.427 2.860 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2cc(C)cc(C)c2)cc1OC 408969101 HJEQJAOWBAWHJF-LPYMAVHISA-N 381.432 2.966 50 40 GFGB O=C(O)c1cc(C(=O)O)cc(-c2ccc(/C=N\NC(=O)c3ccccc3O)o2)c1 409065365 ROLAENWJSAOLCY-FBHDLOMBSA-N 394.339 2.813 50 40 GFGB COc1cc(OC)c([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1Br 818660 RYFDKBWJROAUIJ-CQSZACIVSA-N 391.225 2.716 50 40 GFGB CC1=C/C(=N/C(=O)CBr)C=C/C1=N/S(=O)(=O)c1ccccc1 104214334 KBZGGWYMBUCHAU-XFDFJKANSA-N 381.251 2.695 50 40 GFGB COc1ccc2[nH]c(C(=O)N/N=C/c3cc(OC)c(OC)c(OC)c3)cc2c1 2225986 IPDMICMXMCUIAB-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)N2CCCC2)ccc1OCC(=O)N1CCCC1 409368096 REZSWPOLBQFDRC-QGOAFFKASA-N 397.475 2.616 50 40 GFGB CC1=C(C(=O)OC(C)C)[C@H](c2ccc3c(c2)OCO3)N2C(=N1)SC(C#N)=C2N 408603693 GUQULTLIMXEAEQ-INIZCTEOSA-N 398.444 2.752 50 40 GFGB C/C(CC(=O)Nc1ccc(Br)cc1)=N/NC(=O)c1ccccn1 16136642 YFJUDEFJAGMJGL-JAIQZWGSSA-N 375.226 2.979 50 40 GFGB COc1ccccc1C(=O)N/N=C/c1cc2c(cc1Br)OCO2 5515003 DYRKKGVPIWTTTG-QGMBQPNBSA-N 377.194 2.950 50 40 GFGB C/C(CC(C)(C)N=C=S)=N/N1C(=O)[C@@H](C)N2C(=S)NC(C)(C)C[C@]12C 5515721 KQSJLFGAGPZNPJ-DDNFGVELSA-N 381.571 2.940 50 40 GFGB CCN(CC)c1ccc2cc(C(N)=O)/c(=N\NC(=O)c3cccs3)oc2c1 12338899 DUMBXYNDUQFRNR-ZBJSNUHESA-N 384.461 2.685 50 40 GFGB C[C@@H]1[C@@H](NC(=O)CCC(=O)NNC(=O)Cn2ccc3ccccc32)CCC[C@H]1C 103142639 ZILMRPFOIUHSHP-RYRKJORJSA-N 398.507 2.510 50 40 GFGB CN(CCO)c1ccc(/C=N/NC(=O)CNc2cccc(C(F)(F)F)c2)cc1 7985128 POWUUUZMXXCUTB-WYMPLXKRSA-N 394.397 2.696 50 40 GFGB O=C(N/N=c1/c(=O)c2cccc3cccc1c32)c1cncn1-c1ccc(F)cc1 6507637 HIUPFSUMMHXNSV-LKUDQCMESA-N 384.370 2.799 50 40 GFGB COC(=O)[C@H]1CCC(=O)N1/C(C)=N\NC(=O)Nc1ccc(Cl)c(Cl)c1 1624534 MZAIMLDRPPQLPG-ZUWLAJTLSA-N 387.223 2.612 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(F)cc3)[C@@H]2C1 803616 IKNJFPNMQLFUEI-MSOLQXFVSA-N 391.406 2.708 50 40 GFGB N#CC1=C(N)N(c2ccc(F)cc2)C2=C([C@H]1c1ccc(O)cc1)S(=O)(=O)CC2 1429884 XEKBBHLTGFJQJJ-SFHVURJKSA-N 397.431 2.859 50 40 GFGB C/C(=N\NC(=O)c1cc(O)c(O)c(O)c1)c1ccc(NC(=O)c2ccco2)cc1 5893435 QBDVKXNISYYNGU-SSDVNMTOSA-N 395.371 2.803 50 40 GFGB O=C(N/N=C\c1ccc([N+](=O)[O-])cc1)C(O)(c1ccccc1)c1ccccc1 33301373 BBJFMVRTJNZOPL-JCMHNJIXSA-N 375.384 2.981 50 40 GFGB COc1ccc(/C=N\NC(=O)c2ccco2)cc1COc1ccccc1C(N)=O 33334409 BKJMYFBGANSILB-FMCGGJTJSA-N 393.399 2.730 50 40 GFGB C/C(=N\NC(=O)CN(c1cc(C)ccc1C)S(C)(=O)=O)c1ccc(F)cc1 408865384 CHIHRBIHUIBATR-RCCKNPSSSA-N 391.468 2.749 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OCC)cc1 408906444 JKUDFYAIFFYABZ-OMNSNBSWSA-N 383.448 2.893 50 40 GFGB COc1ccccc1CCC(=O)NNC(=O)c1ccc(Br)cc1 2629041 WPNXDEANBYRPIB-UHFFFAOYSA-N 377.238 2.852 50 40 GFGB CCCNC(=O)/C(C#N)=C1\N=C(NC(=O)c2ccc(F)cc2)c2ccccc21 5322662 ODYKOLCOGBGZQN-ZCXUNETKSA-N 376.391 2.777 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2cc(Br)c(O)cc2O)cc1 408719239 KIUBKNVXZAROES-GIJQJNRQSA-N 379.210 2.562 50 40 GFGB C/C(CCc1ccccc1)=N\NC(=O)CN(c1ccccc1F)S(C)(=O)=O 408782414 IFSZDTBSXYZLOJ-RCCKNPSSSA-N 391.468 2.717 50 40 GFGB COc1cc(/C=C(/C#N)C(=O)NC(C)C)c(Br)cc1OC(C)=O 408786269 NSPVDDCGDZPDHX-XGICHPGQSA-N 381.226 2.815 50 40 GFGB CCOc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(COC)c32)ccc1OC(C)C 6196129 UOFYNIXGMRYYGW-QGZVFWFLSA-N 384.436 2.960 50 40 GFGB O=C(NNC(=O)[C@H]1[C@H]2CC[C@H](C2)[C@H]1C(=O)O)c1ccc(OC2CCCC2)cc1 17078830 OZLPYWOSLSDFOH-IHETXDGRSA-N 386.448 2.516 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(C)c(OC)c1 408906693 DGAPCDCDLULAAL-SDLXJUDFSA-N 383.448 2.811 50 40 GFGB CCn1c(SCC(=O)N/N=C/c2ccc(O)cc2)nnc1-c1ccccc1 863956 JVXFIUHZGPUYFE-UDWIEESQSA-N 381.461 2.913 50 40 GFGB Cc1ccc(S(=O)(=O)NCCSS(=O)(=O)c2ccc(C)cc2)cc1 1632244 FQWORAHSQAIMEB-UHFFFAOYSA-N 385.532 2.704 50 40 GFGB CSCC[C@@H](NC(=O)c1ccccc1)C(=O)N/N=C/c1ccc(N(C)C)cc1 2072535 KOVGICHQKPKXKM-QTCOBDOFSA-N 398.532 2.754 50 40 GFGB CCCCOC(=O)CN1C(=O)C(=C(C#N)C#N)c2cc(Br)ccc21 4556537 GQZQGCBAJWBHAJ-UHFFFAOYSA-N 388.221 2.940 50 40 GFGB Cc1cc(C(=O)NC(=S)NNC(=O)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] 6826111 PHDJXEYIDXIKAX-UHFFFAOYSA-N 392.824 2.506 50 40 GFGB O=C(N/N=C1\CCc2ccccc21)c1cccc(S(=O)(=O)N2CCCC2)c1 13071078 YBPKOQVJXOCUSF-XUTLUUPISA-N 383.473 2.551 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)c1cccc(C(F)(F)F)c1 408964333 QUWLJIDTVATKJG-FBCYGCLPSA-N 398.253 2.991 50 40 GFGB CC(C)(C)c1ccc(/C=C/C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 24765945 MDCWORJHDOGFGG-QHSLDKKCSA-N 380.444 2.985 50 40 GFGB COc1cccc(C(=O)Nc2cccc(C(=O)NNC(=O)c3ccco3)c2)c1 8167156 PXBIFLRMZHKBST-UHFFFAOYSA-N 379.372 2.615 50 40 GFGB CC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(\C)NNC(=O)c1ccncc1 4438593 JIYIZWKMSIZHRK-LFIBNONCSA-N 392.444 2.622 50 40 GFGB CNC(=S)NNC(=O)c1cc(-c2cc(OC)ccc2OC)nc2ccccc12 6734717 KZKVIOALPZSUTH-UHFFFAOYSA-N 396.472 2.658 50 40 GFGB CCN(Cc1cccs1)C(=O)NNC(=O)c1cncn1-c1ccc(F)cc1 9467558 MGOGCRHXXKBSTA-UHFFFAOYSA-N 387.440 2.949 50 40 GFGB C/C(=N\NC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cccs1 4964558 PLBVPNQFPMJYSL-QGOAFFKASA-N 377.491 2.687 50 40 GFGB CCOC(=O)Cn1cc(/C=N/NC(=O)c2ccc(OC)cc2)c2ccccc21 409261421 BNBSNXPXZPNXRS-WSDLNYQXSA-N 379.416 2.977 50 40 GFGB COc1cccc(C(=O)N/N=C/c2ccc(O)c(I)c2)c1 408962021 FPGKYADMMWAFHW-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB COc1cc(/C=N/NC(=O)CN2Cc3cc(C)c(C)cc3C2)cc(OC)c1OC 409206473 JYBPGKUXIKHTHM-AUEPDCJTSA-N 397.475 2.795 50 40 GFGB CCOCCCNC(=O)/C(C#N)=C\c1cc(Br)c(O)c(OC)c1 6489187 XXWPTOOXYWHVAL-GHXNOFRVSA-N 383.242 2.613 50 40 GFGB Cc1onc(-c2ccccc2Cl)c1C(=O)NNC(=O)c1nn(C)cc1Cl 707629 PAWYSBBUZKLOAS-UHFFFAOYSA-N 394.218 2.765 50 40 GFGB COC(=O)Cn1cc(/C=N/NC(=O)c2ccc(C#N)cc2F)c2ccccc21 977455 ZWAMMXJTFVMUQE-AUEPDCJTSA-N 378.363 2.589 50 40 GFGB c1ccc(-c2nnc(SSc3nnc(-c4ccccc4)nn3)nn2)cc1 6229428 CVUQZSUKAIJYHP-UHFFFAOYSA-N 378.446 2.980 50 40 GFGB N#C/C(=C/c1ccc(-c2ccc(S(N)(=O)=O)cc2)o1)C(=O)N1CCCCC1 6242583 OAHBYNAMXLYLQD-QINSGFPZSA-N 385.445 2.513 50 40 GFGB O=C(NNC(=O)c1cccnc1O)c1ccccc1OCc1ccc(F)cc1 12979509 VKOBQAXMCLAHTC-UHFFFAOYSA-N 381.363 2.580 50 40 GFGB CCOc1ccc(/C=N/NC(=O)c2ccc(CN3CCOCC3)cc2)cc1OC 24539320 QMTCLUARUFFBCA-HZHRSRAPSA-N 397.475 2.690 50 40 GFGB COC(=O)c1ccccc1-c1ccc(/C=C2/C(=O)N(C)C(=O)C(C#N)=C2C)o1 101139816 RBDCCMGQKBBQIF-MHWRWJLKSA-N 376.368 2.955 50 40 GFGB CNC(=O)/C(C#N)=C/c1c(Oc2ccc(Cl)cc2)nc2ccccn2c1=O 2426457 RJAGZHGFPXJCFN-ZRDIBKRKSA-N 380.791 2.793 50 40 GFGB CCOC(=O)c1ccc(NC(=O)C/C(C)=N/NC(=O)c2cccc(O)c2)cc1 4676097 CHLJLZDIMJGIFA-LPYMAVHISA-N 383.404 2.703 50 40 GFGB Cc1ccc(NC(=O)/C(C#N)=C/c2cccc(OCC(=O)O)c2)c([N+](=O)[O-])c1 408923870 KSHDMODAUHGKDH-RIYZIHGNSA-N 381.344 2.912 50 40 GFGB Cc1cc([N+](=O)[O-])c(-c2ccc(/C=N/NC(=O)c3nonc3N)o2)cc1Cl 3205523 IUVWGSZCNPXIOJ-NGYBGAFCSA-N 390.743 2.546 50 40 GFGB COc1cc(Cl)cc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)c1O 8336653 AQXOQTSPFCVSFC-CNHKJKLMSA-N 380.857 2.703 50 40 GFGB O=C(Cn1ccc2ccccc21)NNC(=O)c1ccc(OC[C@@H]2CCCO2)cc1 13619774 URJWNUKDXIAYCH-IBGZPJMESA-N 393.443 2.660 50 40 GFGB CCNC(=O)C(=O)N/N=C/c1cc(Br)ccc1Nc1ccccc1 408708006 NEFDBAZLKMRXIW-RGVLZGJSSA-N 389.253 2.779 50 40 GFGB O=C(N/N=C\c1cc(Br)ccc1OCCO)Nc1ccccc1 408719061 IGDQIOYLVUEMCC-WQRHYEAKSA-N 378.226 2.976 50 40 GFGB CCOc1ccc(/C(C)=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] 409056171 KYBJOCIMJWAGCJ-XDHOZWIPSA-N 386.364 2.985 50 40 GFGB C=CCc1cccc(/C=N/NC(=O)CNc2cccc(N3CCCC3=O)c2)c1O 1095813 JEQLCJGKALNYCL-ZVHZXABRSA-N 392.459 2.810 50 40 GFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)c1ccn(Cc2ccc([N+](=O)[O-])cc2)n1 8780716 OYYWKMXXRRTNJN-YBFXNURJSA-N 394.347 2.512 50 40 GFGB C#CCN1C(=O)/C(=N\NC(=O)c2c(-c3ccccc3)noc2C)c2ccccc21 18192982 MWPFXKCYKFZPRK-ATJXCDBQSA-N 384.395 2.764 50 40 GFGB COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(C)[nH]c(=O)c32)cc1Br 18266079 WYXILXVSCBHPMS-AWEZNQCLSA-N 388.221 2.673 50 40 GFGB C/C(=N\NC(=O)c1ccc(CN2CCOCC2)cc1)c1cccc([N+](=O)[O-])c1 20064282 XKWZCMALBHHVOP-RCCKNPSSSA-N 382.420 2.581 50 40 GFGB CC/C(=N\NC(N)=O)c1ccc(OCc2ccc(C(=O)OC)cc2)c(OC)c1 33656896 CKRZPFDCQOIQIU-CJLVFECKSA-N 385.420 2.843 50 40 GFGB CC1=NN(c2ccccc2)C(=O)[C@]12[C@H](c1ccccc1)[C@@]2(C#N)C(N)=C(C#N)C#N 66089390 NQSUOEFTMHMRMG-WTIAFYNJSA-N 392.422 2.963 50 40 GFGB C=CCOc1c(Br)cc(/C=N/NC(N)=O)cc1Br 408897354 RQWDWYHNTJLKGW-GIDUJCDVSA-N 377.036 2.779 50 40 GFGB COc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(C)cc3)o2)cc1 873883 DRSXINQTGPNENP-UHFFFAOYSA-N 398.444 2.607 50 40 GFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1ccccc1NC(=O)c1cccc(C)c1 104850965 ZJNRHINKXFCJJW-VKAVYKQESA-N 377.400 2.730 50 40 GFGB Cc1cc(/C=N\NC(=O)c2ccco2)c(C)n1-c1cc(C(=O)O)cc(C(=O)O)c1 408843915 HNNGLFPNNOPSMY-FBHDLOMBSA-N 395.371 2.847 50 40 GFGB CC(C)[C@H](NC(=O)c1ccco1)C(=O)NNc1cc(C(=O)O)ccc1Cl 32731724 IUKQMQXTJXUGBQ-AWEZNQCLSA-N 379.800 2.529 50 40 GFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)c2cccs2)c([N+](=O)[O-])c1 100510101 OKXGRFWXATZKHB-VCHYOVAHSA-N 376.394 2.799 50 40 GFGB CCOc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)ccc1OCC(=O)OC 408748071 XXJYJQYXFVSIKL-WQRHYEAKSA-N 394.427 2.860 50 40 GFGB COCCCNC(=O)/C(C#N)=C/c1ccc(OCC(=O)Nc2ccccc2)cc1 408813790 VDAFRMYTMNFOIJ-NBVRZTHBSA-N 393.443 2.764 50 40 GFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3cccc(OC)c3)CC2)cc1 409004424 CTVXEOLKPXWBGE-HZHRSRAPSA-N 395.459 2.706 50 40 GFGB COc1cc(/C=N/NC(=O)C2CCN(C(=O)c3ccccc3C)CC2)ccc1O 409006459 NZFWWRDRSTUJRM-OEAKJJBVSA-N 395.459 2.712 50 40 GFGB CNC(=O)C(=O)N/N=C/c1cc(Br)ccc1Nc1ccc(C)cc1 408707895 MLNWFSZUBAACSN-KEBDBYFISA-N 389.253 2.697 50 40 GFGB O=C(CCc1ccccc1O)N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCC1 4456030 BBTNJGUMPFCUJY-KGENOOAVSA-N 382.420 2.984 50 40 GFGB COc1cc(C(=O)NNC(=O)c2ccc(NC(C)=O)s2)ccc1OC(C)C 10326860 DLYMKAARKDOUOW-UHFFFAOYSA-N 391.449 2.577 50 40 GFGB CNC(=O)/C(C#N)=C/c1c(Oc2ccc(F)cc2)nc2c(C)cccn2c1=O 2424381 TVLUKHUMKWNORF-JLHYYAGUSA-N 378.363 2.587 50 40 GFGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1Cl 2651389 WHBUJVCYZORRMO-UHFFFAOYSA-N 384.175 2.985 50 40 GFGB CC(C)[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)c1ccco1 6509348 LOWCTGYOFNZCPJ-AWEZNQCLSA-N 398.246 2.802 50 40 GFGB Cc1cc(Br)ccc1OCC(=O)NNC(=O)c1ccccc1C 722433 NJOYRPBZTBUORT-UHFFFAOYSA-N 377.238 2.906 50 40 GFGB Cc1cc2c(c(=O)n1C[C@H]1CCCO1)[C@@H](c1ccccc1F)C(C#N)=C(N)O2 1268756 SPHCTPLOWQTOKR-ACJLOTCBSA-N 381.407 2.693 50 40 GFGB COc1ccccc1/C=N/NC(=O)CSc1nnc(-c2ccccc2)n1C 2314666 DAOXYELLODNGKQ-UDWIEESQSA-N 381.461 2.733 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)C(O)(c1ccccc1)c1ccccc1 3027367 IOHFIRRZCKLFOM-HYARGMPZSA-N 391.383 2.687 50 40 GFGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@@H]2CCCC[C@H]2C(=O)O)c1 4000807 YLWGTLSJKNJWCJ-HZPDHXFCSA-N 376.453 2.536 50 40 GFGB CCNc1sc2c3c(c(=O)[nH]c2c1C#N)[C@@H](c1cccnc1)C(C#N)=C(N)O3 15085093 JQAGEXVQBDSAAD-LBPRGKRZSA-N 390.428 2.506 50 40 GFGB COc1ccc(N/C=C(\C#N)C(=O)N/C=N\OCc2ccc([N+](=O)[O-])cc2)cc1 100363506 RMNDDVHITQMLPU-RVDMUPIBSA-N 395.375 2.699 50 40 GFGB CCN(CC)S(=O)(=O)c1cccc(C(=O)N/N=C2/CC(=O)CC(C)(C)C2)c1 101475386 SWFMZGJYGOOXLG-HKWRFOASSA-N 393.509 2.582 50 40 GFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1cccn1-c1ccc([N+](=O)[O-])cc1 108997007 NKHIQTADMIAZCT-MOSHPQCFSA-N 393.359 2.987 50 40 GFGB COc1ccc([C@H]2CC(=O)NC(SCC(=O)NCc3ccco3)=C2C#N)cc1 6441569 IMOYUBZCUVMNJN-MRXNPFEDSA-N 397.456 2.676 50 40 GFGB COc1cc(Br)ccc1OCC(=O)N/N=C/c1cccc(O)c1 1434437 NYGGOTKGVFPTOO-GIJQJNRQSA-N 379.210 2.692 50 40 GFGB O=C(N/N=C/c1ccc(I)o1)c1cccc([N+](=O)[O-])c1 59503454 BBBLOXMKUHSFPG-VGOFMYFVSA-N 385.117 2.556 50 40 GFGB CC(C)C/C(=N\NC(=O)CNC(=O)c1ccc2c(c1)OCO2)c1ccccc1 13476413 XDGQKIOKAQWSPX-HAVVHWLPSA-N 381.432 2.712 50 40 GFGB COc1ccccc1NCC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCC1 4357728 YEBZEXUUGOBPDF-LPYMAVHISA-N 397.435 2.766 50 40 GFGB O=C(NNC(=O)c1ccc2c(c1)OCO2)c1ccc(C2SCCS2)cc1 8271965 KXVUFJGUTVBKBW-UHFFFAOYSA-N 388.470 2.969 50 40 GFGB CCOC(=O)c1c(C)[nH]c(C(=O)N/N=C/c2ccc(OCC)c(OC)c2)c1C 8231204 HRWDISXVWXNXTL-SRZZPIQSSA-N 387.436 2.979 50 40 GFGB O=C(NNc1c([N+](=O)[O-])cc([N+](=O)[O-])c2cccnc12)c1ccc([N+](=O)[O-])cc1 101490992 WKAQAPWKQSGYAN-UHFFFAOYSA-N 398.291 2.716 50 40 GFGB COC(=O)c1ccc(OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)cc1 12538573 ZDYDOAMCZHSESL-UHFFFAOYSA-N 377.400 2.742 50 40 GFGB C/C(=N\NC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(C)cc1 6631887 HWMZSXDUTAZYRS-LTGZKZEYSA-N 385.489 2.934 50 40 GFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)n1 27570628 VRKBDLQGQBFUSO-REZTVBANSA-N 379.829 2.897 50 40 GFGB Cc1ccc(C(=O)N/N=C/c2cc(Br)c(N3CCOCC3)o2)cc1 59250520 WWUOOQSNAUZNQX-YBFXNURJSA-N 392.253 2.951 50 40 GFGB Cc1cc2c(c(=O)n1Cc1ccccn1)[C@H](c1ccc(F)cc1)C(C#N)=C(N)O2 5066510 MQIOUIRAFXLKPG-LJQANCHMSA-N 388.402 2.957 50 40 GFGB Cc1cc2c(c(=O)n1C[C@H]1CCCO1)[C@@H](c1ccc(F)cc1)C(C#N)=C(N)O2 4247924 GBURLUKJKGSRCD-QAPCUYQASA-N 381.407 2.693 50 40 GFGB CCOC(=O)Cn1cc(/C=N/NC(=O)COc2ccccc2)c2ccccc21 408527936 GTMMPRQMYJELBF-WSDLNYQXSA-N 379.416 2.734 50 40 GFGB CCc1[nH]c(C(=O)NNC(=O)c2ccccc2-n2cccc2)c(C)c1C(=O)OC 15627251 ORKRQDRTDJNEQB-UHFFFAOYSA-N 394.431 2.538 50 40 GFGB Cc1ccccc1S(=O)(=O)N1CCC[C@@H](C(=O)N/N=C/c2ccccc2)C1 18192673 RHRVVLOBAXABSY-ALDSOSFCSA-N 385.489 2.546 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)C1(O)c2ccccc2-c2ccccc21 861671 KQOVGWHHZQBVKK-WSDLNYQXSA-N 389.367 2.667 50 40 GFGB O=C(Cn1cnc2sc3c(c2c1=O)CCCC3)N/N=C/c1ccc(F)cc1 1987101 KAAZWFAQRNLTDD-LSFURLLWSA-N 384.436 2.626 50 40 GFGB CC(C)(C)C(=O)Nc1nnc(CC(=O)N/N=C/c2c[nH]c3ccccc23)s1 59498831 RLYXUCUUQUUBGQ-KEBDBYFISA-N 384.465 2.697 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)N[C@H](C)COC)cc(Br)c1OC 6510270 CNQDGLYTJLUNFO-XXLSNGBASA-N 397.269 2.914 50 40 GFGB N#C/C(=C\c1cccc(OS(=O)(=O)c2ccc3ccccc3c2)c1)C(N)=O 408757051 WERQFHOVUWWASD-LICLKQGHSA-N 378.409 3.000 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2cccc(Cl)c2)S(C)(=O)=O)c(C)c1 408775259 FSRRFCXFJCBGIZ-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB C/C(=C\C(=O)C(F)(F)C(F)(F)F)NNC(=O)COc1cc(C)cc(C)c1 408948724 DJYJTLZHXMREBF-YRNVUSSQSA-N 380.313 2.974 50 40 GFGB Cc1cc(C)c2c(N)c(C(=O)NNC(=O)[C@H]3COc4ccccc4C3)sc2n1 24987502 NJSRZMUXNJRZIK-CYBMUJFWSA-N 396.472 2.508 50 40 GFGB CCCOc1ccc(C(=O)NNC(=O)c2cccnc2SC)cc1OC 12696640 HGMYCWWKGZDKAP-UHFFFAOYSA-N 375.450 2.676 50 40 GFGB Cc1cc(C)cc(-n2ccnc2SCC(=O)NNC(=O)c2cccc(O)c2)c1 11916020 WZZHSDKAGRUZRO-UHFFFAOYSA-N 396.472 2.748 50 40 GFGB C/C(=C/C(=O)C(F)(F)F)NNC(=O)C(=O)Nc1ccc(Cl)c(Cl)c1 4725127 QDUDTPIWTNEWHZ-XQRVVYSFSA-N 384.141 2.588 50 40 GFGB COc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C(C)(C)C)c32)ccc1OC(C)=O 5408080 NJMYTCRSGNBMCG-HNNXBMFYSA-N 382.420 2.859 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)[C@H](O)c2ccc(Br)cc2)c1 704548 TWANPAGFQVOSID-MWJIIQFGSA-N 393.237 2.650 50 40 GFGB O=C(CCN1C(=O)c2ccccc2C1=O)NNc1ccccc1C(F)(F)F 14907308 PLYKCOQQELNIJB-UHFFFAOYSA-N 377.322 2.835 50 40 GFGB COC(=O)c1cccc(/C=C(\C#N)C(=O)NCCc2ccc(OC)c(OC)c2)c1 408969934 XDYWYEITSRSJLF-LDADJPATSA-N 394.427 2.756 50 40 GFGB COC(=O)c1c(NC(=O)/C(C#N)=C/c2ccsc2)sc(C(N)=O)c1C 8299848 NFVXQWBKGXYTJJ-BJMVGYQFSA-N 375.431 2.549 50 40 GFGB C/C(=N\NC(=O)CN(c1ccc(Cl)cc1C)S(C)(=O)=O)c1ccccc1 408791194 WIIKDPXVYYGYEV-XSFVSMFZSA-N 393.896 2.955 50 40 GFGB O=C(O)COc1cccc(/C=N/NC(=O)c2ccccc2Br)c1 5636644 AABYDKRJNBALBZ-GIJQJNRQSA-N 377.194 2.676 50 40 GFGB COc1ccccc1NC(=O)C/C(C)=N/NC(=O)c1ccc(NC(C)=O)cc1 16137086 VHZYDRLEWDXQCO-YDZHTSKRSA-N 382.420 2.788 50 40 GFGB CC[C@@H](C)NC(=O)C/C(C)=N/NC(=O)COc1ccc(C)cc1Br 12418647 QYYVRADCSLJJOF-UNDKWDADSA-N 398.301 2.933 50 40 GFGB O=C(N/N=C/c1ccccc1[N+](=O)[O-])C(O)(c1ccccc1)c1ccccc1 1083252 PIJHXQYMACFIFH-PXLXIMEGSA-N 375.384 2.981 50 40 GFGB CC(C)(C)C(=O)Nc1cccc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1 12734630 YEMIRCPWPQJLDU-UHFFFAOYSA-N 397.431 2.517 50 40 GFGB O=C(NNC(=O)[C@@H]1CCCO1)c1cc(-c2ccc(F)cc2)nc2ccccc12 39975600 LEECMYDAEXQXGC-IBGZPJMESA-N 379.391 2.981 50 40 GFGB O=C(N/N=C/c1ccc(OC(=O)c2cccc([N+](=O)[O-])c2)cc1)c1cccnc1 3097468 JLPHVHWQKKDGDB-WSDLNYQXSA-N 390.355 2.973 50 40 GFGB N#CC1=C(S)N[C@](O)(c2ccccc2)[C@@H]([n+]2ccccc2)[C@@H]1c1ccncc1 3176675 ZNEQCVUXICTZHQ-URVUXULASA-O 387.488 2.807 50 40 GFGB CC(C)c1ccc(OCC(=O)NC(=S)NNC(=O)c2cccs2)cc1 6359044 VFIFQCUQGSKZHM-UHFFFAOYSA-N 377.491 2.586 50 40 GFGB C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(-c3ccccc3)cc2)C[C@@H](C)O1 12849694 WQKRWPSGFZRFKA-CALCHBBNSA-N 381.476 2.614 50 40 GFGB C[C@H](C(=O)NNC(=O)c1ccccc1)N(C)CCOc1ccc(Cl)cc1 12984984 ULVQHBIIMFFLMO-CQSZACIVSA-N 375.856 2.500 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccccc2)cc(I)c1O 58626036 MUYVXRBZOVBAHL-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccccc2)C1)c1ccc(Cl)cc1Cl 408616100 VUINJRJJCFQIGL-LLVKDONJSA-N 392.242 2.808 50 40 GFGB Cc1cc(C)cc(N(CC(=O)N/N=C/c2ccc(Cl)cc2)S(C)(=O)=O)c1 408773750 LYBIZMQJCCSVRH-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OC)cc1C 408912656 QSYMHSCGOZTPLD-VZMFNRANSA-N 383.448 2.811 50 40 GFGB CCc1ccc(N(CC(=O)N/N=C(\C)c2cccs2)S(C)(=O)=O)cc1 409026172 HYRYUDRRGLOFTM-QGOAFFKASA-N 379.507 2.617 50 40 GFGB O=S(=O)(c1ccccc1)C(Br)S(=O)(=O)c1ccccc1 1717867 JQZULCGDVVRTEA-UHFFFAOYSA-N 375.265 2.613 50 40 GFGB O=C(N/N=C/c1ccc(I)cc1)c1ccc2c(c1)OCO2 59471538 PDKHEPYGLGEKKY-CAOOACKPSA-N 394.168 2.784 50 40 GFGB CC1=C/C(=N\C(=O)CBr)C=C/C1=N/S(=O)(=O)c1ccccc1 104214327 KBZGGWYMBUCHAU-DNCSNFMJSA-N 381.251 2.695 50 40 GFGB CCOc1ccccc1OCC(=O)N/N=C/c1cc(OC)c(OC)cc1OC 3324631 WNJJEHIDJORTQV-CIAFOILYSA-N 388.420 2.640 50 40 GFGB O=C(NNC(=O)c1ccccc1C(=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 5515703 BZGWVDBRBJKNCQ-UHFFFAOYSA-N 389.367 2.901 50 40 GFGB Cc1ccc(N2C(=O)N=C(O)/C(=C/NNC(=O)c3ccccc3)C2=O)cc1C 9328005 MRRZBQNYMFUGMY-WJDWOHSUSA-N 378.388 2.545 50 40 GFGB O=C(CN1CCOCC1)N/N=C/c1ccccc1OCc1ccc(Cl)cc1 19851654 UGZQJCHSPYTZKC-LPYMAVHISA-N 387.867 2.701 50 40 GFGB CCNc1ccc(C(=O)NNC(=O)COc2ccc(Cl)cc2)cc1[N+](=O)[O-] 7738044 VFZIBGTWSJBKSD-UHFFFAOYSA-N 392.799 2.520 50 40 GFGB COc1ccc(/C=N\NC(=O)c2cc(Br)ccc2O)cc1[N+](=O)[O-] 33690811 NNCYCYPHHKCBBI-IUXPMGMMSA-N 394.181 2.835 50 40 GFGB COc1cc([C@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)cc2c1OCO2 3191459 FAUSBUVVPQMSNS-INIZCTEOSA-N 390.351 2.748 50 40 GFGB Cc1cc(Br)cc(/C=N/NC(=O)[C@@H]2COc3ccccc3O2)c1O 2348025 TYTXGDTZSORILQ-UZSVJVCZSA-N 391.221 2.753 50 40 GFGB CC(C)(C)c1n[nH]c2c1[C@@H](c1cc3c(cc1[N+](=O)[O-])OCO3)C(C#N)=C(N)O2 5095140 NONGFUJVVQYFIB-ZDUSSCGKSA-N 383.364 2.562 50 40 GFGB O=C(CCNC(=O)c1ccccc1)NNC(=O)c1cc(Cl)ccc1Cl 15986326 AAYPOUBCTDXGOM-UHFFFAOYSA-N 380.231 2.575 50 40 GFGB CC1=NN(c2ccccc2)C(=O)[C@]12[C@@H](c1ccccc1)[C@@]2(C#N)C(N)=C(C#N)C#N 66089393 NQSUOEFTMHMRMG-AJSBUHFISA-N 392.422 2.963 50 40 GFGB O[C@@]12[C@H]3[C@@H]4C[C@@H]5[C@H]([C@@H]1C(Br)(Br)[C@H]35)[C@@H]4[C@@H]2Br 169795853 WZBOKYFPZUQGLI-INWIXKQOSA-N 398.920 2.739 50 40 GFGB CCOC(=O)c1ccc(NC(=S)NNC(=O)c2c[nH]c3ccccc23)cc1 5689448 IPLVFNUPXODJGE-UHFFFAOYSA-N 382.445 2.976 50 40 GFGB C#CCn1cc(/C=N/NC(=O)Cc2ccc(OC)c(OC)c2)c2ccccc21 10004080 MPBKTGZMXQVZCO-OEAKJJBVSA-N 375.428 2.985 50 40 GFGB O=C(N/N=C\c1ccc(O)c(I)c1)c1ccc(F)cc1 32109910 CQLZJTGJZLELOE-IUXPMGMMSA-N 384.148 2.900 50 40 GFGB C=CCc1cc(/C=N/NC(=O)c2cccc(F)c2)cc(OC)c1OCC(=O)O 59303485 BHUUFBGZZAZVLL-SSDVNMTOSA-N 386.379 2.790 50 40 GFGB COc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])cc(Br)c2O)cc1 59502251 OBKXRQNUXSLUJV-CAOOACKPSA-N 394.181 2.835 50 40 GFGB C=CCOc1ccc(/C=N\NC(=O)Cc2ccc(OC)c(OC)c2)cc1OC 59515930 YHBOKOBTGKIIES-HMAPJEAMSA-N 384.432 2.970 50 40 GFGB CCc1cc(C(=O)NNC(=O)[C@H]2[C@@H]3CC[C@@H](C3=C(C)C)[C@@H]2C(=O)O)cs1 225590511 JOQGNRGLWIHDEO-VRKREXBASA-N 376.478 2.765 50 40 GFGB O=C(N/N=C/c1ccc(N2CCOCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2o1 408960987 KUCADEYGTCIRSE-FYJGNVAPSA-N 394.387 2.942 50 40 GFGB N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)C(=O)NCCCc1ccccc1 409251756 VZRIJRPGIJYRCW-CXUHLZMHSA-N 379.372 2.979 50 40 GFGB Cc1ccc(/C=N/NC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1 19682720 QZXJZJVTAUCDDX-OEAKJJBVSA-N 384.911 2.916 50 40 GFGB Cc1n[nH]c2c1[C@@]1(C(=O)N(Cc3ccccc3)c3ccccc31)C(C#N)=C(N)O2 4741510 BAAFUFAXHQSCRP-QFIPXVFZSA-N 383.411 2.637 50 40 GFGB Cc1cc(S(=O)(=O)NNC(=O)c2ccc(F)cc2)ccc1Br 7386513 WITMTSMAOUPGSD-UHFFFAOYSA-N 387.230 2.520 50 40 GFGB COc1cccc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)c1O 20247979 ZGJJTEPQEJOMDY-GIJQJNRQSA-N 375.406 2.693 50 40 GFGB C[C@@H]1[C@H](OC(=O)CCC(=O)O)O[C@@H]2O[C@@]3(C)CC[C@@H]4[C@H](C)CC[C@H]1[C@@]24OO3 136002434 FIHJKUPKCHIPAT-FIONOGTBSA-N 384.425 2.602 50 40 GFGB C[C@H]1CCC[C@@H](C)N1C(=O)Cn1c(NNC(=O)n2ccnc2)nc2ccccc21 13566595 CQYBRQAKGRHJAD-GASCZTMLSA-N 395.467 2.607 50 40 GFGB N#C/C(=C\c1ccc(Cl)cc1Cl)C(=O)NC(=O)n1ccc([N+](=O)[O-])n1 2744316 JLNQMZHJMYKNCU-WEVVVXLNSA-N 380.147 2.790 50 40 GFGB Cn1ccnc1Sc1ccc(/C=N/NC(=O)c2ccccc2O)cc1[N+](=O)[O-] 1436467 PLHDFTJRGZEFCG-RGVLZGJSSA-N 397.416 2.949 50 40 GFGB O=C(NNC(=O)c1cc2cc(Br)ccc2oc1=O)c1ccccc1 1064044 XKXCFILCUMVRRO-UHFFFAOYSA-N 387.189 2.630 50 40 GFGB COC(=O)c1ccccc1-c1ccc(/C=N/NC(=O)[C@@H](O)c2ccccc2)o1 1102824 PMRJPZYGPQLUKZ-MEGCXXLRSA-N 378.384 2.917 50 40 GFGB Cc1ccc(SCCC(=O)NNC(=O)COc2ccccc2C#N)cc1C 7541833 ADCGPRPKLMTRTO-UHFFFAOYSA-N 383.473 2.884 50 40 GFGB CO[C@H]1C[C@H](O)[C@@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)O1 195984040 AEDSCEUXZVLWFU-PWRODBHTSA-N 386.564 2.685 50 40 GFGB NNC(=O)/C=C/c1ccc(OCc2ccccc2)c(I)c1 226332319 JZQDXHREEXXAKH-VQHVLOKHSA-N 394.212 2.873 50 40 GFGB Cc1ccc(C(=O)NNC(=O)c2cccc(I)c2)cc1 866235 MRPYLCHXCAYKQG-UHFFFAOYSA-N 380.185 2.674 50 40 GFGB COc1ccc2[nH]c(=O)c([C@@H]3C(C#N)=C(N)OC4=C3C(=O)CC(C)(C)C4)cc2c1 876546 RSABNHYLSVMTJT-GOSISDBHSA-N 391.427 2.988 50 40 GFGB C/C(N)=C(\C#N)C(=O)CSc1nc2ccccc2c(=O)n1-c1ccccc1 104699392 WYPUQJKFJVRYAO-SSZFMOIBSA-N 376.441 2.803 50 40 GFGB COc1cccc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)c1OC 1421515 WAZMLIFHIULNFL-VXLYETTFSA-N 389.433 2.996 50 40 GFGB O=C(NNC(=O)c1ccco1)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O 12744556 BOORUVNFCKULFX-SFHVURJKSA-N 376.368 2.809 50 40 GFGB CC(C)c1ccccc1N1/C(=N\C(=O)CCl)S[C@@H]2CS(=O)(=O)C[C@H]21 101316736 YDWLWZPHMIKNSQ-QJGXAYKQSA-N 386.926 2.650 50 40 GFGB COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1cc(Cl)ccc1OC 408605127 KQZQIVKMOXXGSZ-AWEZNQCLSA-N 390.852 2.906 50 40 GFGB O=C(NN=C1CCC(=NNC(=O)c2ccccc2O)CC1)c1ccccc1O 5344642 IXJKBLNPKGYSLS-UHFFFAOYSA-N 380.404 2.544 50 40 GFGB CCOc1cc(/C=N/NC(=O)c2cccc(N(C)C)c2)ccc1O[C@@H](C)C(=O)O 4677914 WMTQEYVYDSWEPE-KOUDTOEKSA-N 399.447 2.767 50 40 GFGB COc1cccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)c1OC 4742454 KABZAGLGNIBUQK-MRXNPFEDSA-N 388.379 2.845 50 40 GFGB Cc1ccsc1/C=N/NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O 6218740 PUJGGPMHLUZLQP-RQZCQDPDSA-N 385.898 2.626 50 40 GFGB O=C(CN(c1cccnc1)S(=O)(=O)c1ccccc1)NN=C1CCCCC1 6257988 UHCFATNMCSYCIJ-UHFFFAOYSA-N 386.477 2.713 50 40 GFGB Cc1ccc(SCC(=O)NNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)cc1 95447686 LDKPMXBLUVZFPO-UHFFFAOYSA-N 384.417 2.938 50 40 GFGB O=C(CNC1CCCCC1)N/N=C/c1ccc(I)cc1 409375100 FOSDLHVMYKGACK-VCHYOVAHSA-N 385.249 2.664 50 40 GFGB CN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)CBr)cc1 1748265 OWRLSZLRESMVMO-UHFFFAOYSA-N 383.267 2.845 50 40 GFGB COC(=O)COc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1 4510831 QCLQLZOIQSHBPW-SFHVURJKSA-N 382.416 2.689 50 40 GFGB Cc1cc2c(c(=O)n1Cc1ccccn1)[C@@H](c1ccc(F)cc1)C(C#N)=C(N)O2 5066514 MQIOUIRAFXLKPG-IBGZPJMESA-N 388.402 2.957 50 40 GFGB CC(C)(C)OC(=O)N1C(N)=C(C#N)C2(CCOCC2)c2[nH]c(C(F)(F)F)nc21 5632434 MLINUFUNYBCQGC-UHFFFAOYSA-N 399.373 2.926 50 40 GFGB C[C@H](c1ccccc1)N1C[C@H](C(=O)NNC(=O)c2ccccc2Cl)CC1=O 7882208 SRGBESVPXQQIAY-UKRRQHHQSA-N 385.851 2.711 50 40 GFGB C/C(=N\NC(=O)CN(c1ccc(C)cc1C)S(C)(=O)=O)c1ccc(F)cc1 20208180 SHPCIGPVODXLGD-RCCKNPSSSA-N 391.468 2.749 50 40 GFGB Cc1nn(C)c2ncc(C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)cc12 23743533 OPKCHEAWFNWKKA-UHFFFAOYSA-N 381.480 2.644 50 40 GFGB C#CCOc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc1OC 408544890 YIHVBEIXMMHHDC-YBEGLDIGSA-N 376.368 2.951 50 40 GFGB CC(=O)NNC(=O)CSc1nc(C2CC2)nc2sc3c(c12)CC[C@H](C)C3 1377310 JUFFEJOSUOLQSN-VIFPVBQESA-N 390.534 2.953 50 40 GFGB COc1cc(/C=N/NC(=O)COc2ccccc2)cc(Br)c1OC 6735619 VYFVYUNYLLJEIJ-VXLYETTFSA-N 393.237 2.995 50 40 GFGB Cc1ccc(C(=O)N/N=C\c2cc([N+](=O)[O-])cc(Br)c2O)cn1 4724752 HWMHMHWJXBHJAA-IDUWFGFVSA-N 379.170 2.530 50 40 GFGB C/C(=N\NC(=O)CN(c1c(C)cccc1C)S(C)(=O)=O)c1cccs1 20213846 KVFSDYIZSIOGTA-NBVRZTHBSA-N 379.507 2.671 50 40 GFGB CCc1ccc(N2C[C@@H](C(=O)N/N=C\c3ccc(OC)c(OC)c3)CC2=O)cc1 409262438 DQGGFURTBXMGSV-ICODJCHTSA-N 395.459 2.769 50 40 GFGB O=C(N/N=C\c1ccc(O)c([N+](=O)[O-])c1)C(O)(c1ccccc1)c1ccccc1 36008815 FALGCSABVTVDDN-HMAPJEAMSA-N 391.383 2.687 50 40 GFGB CCOc1ccc(NC(=O)C(=O)N/N=C\c2cc([N+](=O)[O-])ccc2Cl)cc1 223152417 HMEUTRFIMQACSM-GRSHGNNSSA-N 390.783 2.736 50 40 GFGB CCC[C@H](Br)C(=O)NCCC(=O)Nc1cccc(C(=O)OCC)c1 8733220 ORNFFCSQRLEXRP-AWEZNQCLSA-N 399.285 2.872 50 40 GFGB Cc1ccc(N(CC(=O)N/N=C/c2cccs2)S(C)(=O)=O)cc1Cl 2176045 QREJKRXMNKIDDY-RQZCQDPDSA-N 385.898 2.626 50 40 GFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2cc(Cl)ccc2Cl)C1)c1ccccc1 408645985 SURQMPLPYYQPJS-LBPRGKRZSA-N 392.242 2.808 50 40 GFGB Cn1c(CC(=O)NNC(=O)c2ccc(Cl)cc2Cl)nc2ccccc21 9913447 KOEKKLOUGUUQBW-UHFFFAOYSA-N 377.231 2.884 50 40 GFGB O=C(Nc1ccccc1C(=O)NNC(=O)c1ccco1)c1ccc([N+](=O)[O-])cc1 408997852 OJBLHDMKZDHGTD-UHFFFAOYSA-N 394.343 2.515 50 40 GFGB Cc1c(C(=O)N/N=C\c2cccc(Cl)c2)nn(-c2ccccc2)c(=O)c1C#N 409060619 VLNNWEVHRJHWSI-FMCGGJTJSA-N 391.818 2.830 50 40 GFGB CCn1c(SCC(=O)NNC(=O)c2ccc(C)cc2)nnc1-c1ccccc1 925436 GPHCYRRHXSKUTR-UHFFFAOYSA-N 395.488 2.827 50 40 GFGB COc1ccc2c(c1)/C(=N\NC(=O)COc1ccc(Cl)cc1Cl)C(=O)N2 59472620 SJAABEGFHOFTIT-UHFFFAOYSA-N 394.214 2.853 50 40 GFGB COc1cc([C@H]2ON=C(C(=O)N/N=C/c3ccccc3F)[C@@H]2C)cc2c1OCO2 15084051 FLWIMCMZBSHWSC-NMIDASLBSA-N 399.378 2.777 50 40 GFGB Cc1n[nH]c2c1[C@@H](c1c(C)c([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C)C(C#N)=C(N)O2 8439202 OYZABICRNNHEKX-CYBMUJFWSA-N 384.352 2.678 50 40 GFGB Cc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCc3ccccn3)c2C)cc1 58884287 XFZFVUDCFDRNLP-DHRITJCHSA-N 389.459 2.564 50 40 GFGB C/C(=N\NC(=O)c1c(C)nc2ccccn12)c1ccc(N2CCOCC2)cc1 5071013 CTQOJGLOHNFMGE-HZHRSRAPSA-N 377.448 2.633 50 40 GFGB CCC(CC)=NNC(=O)CN(Cc1ccco1)S(=O)(=O)c1ccccc1 4698943 ZGHWLTIJAVKFCE-UHFFFAOYSA-N 377.466 2.763 50 40 GFGB O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)N/N=C/c1cccc(F)c1 19861428 RGERTWFWICBEPW-YDZHTSKRSA-N 388.874 2.747 50 40 GFGB Cn1c(CC(=O)NNC(=O)Cc2cccc(C(F)(F)F)c2)nc2ccccc21 6651815 APIMJAOGQWVQQU-UHFFFAOYSA-N 390.365 2.525 50 40 GFGB Cc1ccc(NCc2nnc(S[C@@H](C)C(=O)NN)n2-c2ccccc2)cc1 66324378 LUZIOMUXFKMISY-AWEZNQCLSA-N 382.493 2.658 50 40 GFGB O=C(NNS(=O)(=O)c1ccc(Br)s1)Nc1ccccc1 8944861 IUDNJPCCTSZXAW-UHFFFAOYSA-N 376.257 2.526 50 40 GFGB Cn1c(=O)c(NNC(=O)c2cccnc2)c2c3c(cccc31)C(=O)c1ccccc1-2 11691643 SOAPGJMSQUKOQI-UHFFFAOYSA-N 396.406 2.902 50 40 GFGB COc1ccc(C(=O)NNC(=O)CCC(=O)Nc2cccc(Cl)c2C)cc1 2132116 SNIZDYTYZDNQSK-UHFFFAOYSA-N 389.839 2.837 50 40 GFGB CCOC(=O)/C(C#N)=C/Nc1ccccc1NS(=O)(=O)c1cccs1 5533874 LTOBDLGKYRNZOL-VAWYXSNFSA-N 377.447 2.931 50 40 GFGB CCc1n[nH]c2c1C1(CCN(C(=O)OCc3ccccc3)CC1)C(C#N)=C(N)O2 6529184 QJUCTFVEAOUASV-UHFFFAOYSA-N 393.447 2.729 50 40 GFGB COc1cc(/C=N/NC(=O)COc2ccc(Cl)c(C)c2)cc(OC)c1O 8183382 DXJVUVUTEVHVKK-AWQFTUOYSA-N 378.812 2.900 50 40 GFGB COc1ccc(/C=N\NC(=O)CC(=O)Nc2cccc(Cl)c2)cc1OC 32119734 UDDPKQFAPTYFKL-JAIQZWGSSA-N 375.812 2.836 50 40 GFGB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NNc1cc(C(=O)O)ccc1Cl 32731721 IUKQMQXTJXUGBQ-CQSZACIVSA-N 379.800 2.529 50 40 GFGB Cc1nc(C(C)(C)C)sc1C(=O)NNC(=O)c1cc(Br)cn1C 65552048 PFQITUCDDMJIDM-UHFFFAOYSA-N 399.314 2.925 50 40 GFGB CC(C)NC(=O)COc1ccc(/C=N/NC(=O)CSc2ccccc2)cc1 408786674 UPFMOOTWFWJLMM-CIAFOILYSA-N 385.489 2.832 50 40 GFGB CCOc1cc(/C=N/NC(=O)CC#N)ccc1OCC(=O)Nc1ccc(C)cc1 409019411 ZAOSOGLLERDTJW-YDZHTSKRSA-N 394.431 2.775 50 40 GFGB COc1ccc(C(=O)N/N=C/c2ccc(N(C)C)c(Br)c2)c(O)c1 409389788 AHBRVJWUHQUUCA-VXLYETTFSA-N 392.253 2.993 50 40 GFGB O=C(OC(=O)[C@@H](Br)C(F)(F)F)[C@@H](Br)C(F)(F)F 885164260 ZVCBCAPTWMUSNK-JCYAYHJZSA-N 395.875 2.708 50 40 GFGB COc1cccc(/C=N/NC(=O)c2ccc(CSc3nncn3C)cc2)c1O 3234582 NIIHBENOLVSYEV-KEBDBYFISA-N 397.460 2.586 50 40 GFGB Cc1ccc(NC(=O)[C@@H]2CC(=O)N=C(NNC(=O)c3ccc(C)cc3)S2)cc1 2409472 MIPHGLQKCXJILF-INIZCTEOSA-N 396.472 2.565 50 40 GFGB N#C/C(=C/c1ccc2c(c1)OCO2)C(=O)OCC(=O)NCCCc1ccccc1 6450916 QNFVCUOTAAZMRG-WQRHYEAKSA-N 392.411 2.614 50 40 GFGB C/C(=N\NC(=O)NCCc1cccs1)c1ccc(N2CCOCC2)c(F)c1 98055384 JZNGYKREJHJSPB-HYARGMPZSA-N 390.484 2.990 50 40 GFGB COc1cccc(/C=N/NC(=O)C(=O)NCC(C)C)c1Nc1ccccc1C 408706946 FNPCZQLFOUVGMI-YDZHTSKRSA-N 382.464 2.970 50 40 GFGB COCCN1C(N)=C(C#N)[C@H](c2cccc([N+](=O)[O-])c2)C2=C1CC(C)(C)CC2=O 409135939 REPOGXTZPLYJGX-SFHVURJKSA-N 396.447 2.977 50 40 GFGB COc1ccc(C(=O)N/N=C\c2cc([N+](=O)[O-])cc(Br)c2O)cc1 408873173 OBKXRQNUXSLUJV-IUXPMGMMSA-N 394.181 2.835 50 40 GFGB Cn1cc(Br)cc1C(=O)NNC(=O)c1cc(Cl)c(Cl)n1C 32825621 OILKMWFYZRYPJF-UHFFFAOYSA-N 394.056 2.508 50 40 GFGB N#C/C(=C\c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1)C(=O)NC[C@H]1CCCO1 2800818 UWBRMAXVXNACRF-SPQRHKFCSA-N 394.387 2.984 50 40 GFGB COC(=O)N/N=C/c1ccc(OS(=O)(=O)c2cc(C)ccc2C)c(OC)c1 3328989 RVKPUQQALDYSJW-YBFXNURJSA-N 392.433 2.770 50 40 GFGB Cc1cc(Cl)ccc1OCC(=O)NNC(=O)[C@H](C)Oc1ccccc1F 7652760 XORNRDZSRSJCHZ-LBPRGKRZSA-N 380.803 2.781 50 40 GFGB O=C(CSc1ccc([N+](=O)[O-])cc1)NNC(=S)Nc1ccccc1F 15847314 TUBGETLNDPAGQI-UHFFFAOYSA-N 380.426 2.844 50 40 GFGB Cn1ncc(Br)c1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253407125 VPMVTLNIRVVCOP-LBPRGKRZSA-N 377.242 2.633 50 40 GFGB CSc1ccc(/C=N/NC(=O)CN(c2ccc(C)cc2)S(C)(=O)=O)cc1 2176160 RACWDOHGOIQTAD-XDHOZWIPSA-N 391.518 2.633 50 40 GFGB COC(=O)C1=C(C(=O)OC)[C@]2(Cl)C(Cl)=C(Cl)[C@]1(Cl)C2Cl 101046083 PTHAIDJVSTZQHP-QWRGUYRKSA-N 380.438 2.908 50 40 GFGB COc1cccc(OCc2cc(/C=N/NC(=O)c3cc[nH]n3)ccc2OC)c1 13108476 UUOOWDUXIYPMLW-WSDLNYQXSA-N 380.404 2.770 50 40 GFGB COc1ccc(S(=O)(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)cc1 6328685 WAIPPTRUWRHQIX-UHFFFAOYSA-N 399.472 2.726 50 40 GFGB CCOc1cc(/C=N\NC(=O)Cc2ccc3c(c2)OCCO3)cc(Cl)c1O 409366759 XZQABTNBWGNNIC-NHDPSOOVSA-N 390.823 2.908 50 40 GFGB COC(=O)c1ccc(NC(=O)C(=O)N/N=C\c2cccc(Cl)c2Cl)cc1 223160470 GSADJDBWXPVOEJ-UKWGHVSLSA-N 394.214 2.869 50 40 GFGB O=C(CSc1nnc(Nc2ccccc2)s1)NNC(=O)c1cccs1 3446720 MKXUCJLIBFKRBE-UHFFFAOYSA-N 391.503 2.897 50 40 GFGB CCCCN1C(=O)/C(=N\NC(=O)COc2ccccc2[N+](=O)[O-])c2ccccc21 5890824 AJLYLMCPVFHOPE-QOCHGBHMSA-N 396.403 2.641 50 40 GFGB CC(C)=C1[C@H]2CC[C@H]1[C@H](C(=O)NNC(=O)c1csc(C)c1C)[C@H]2C(=O)O 102198222 WCKKBTDCLNSGBU-MPTQWLOMSA-N 376.478 2.819 50 40 GFGB COc1cccc(/C=N/NC(=O)CC(=O)Nc2cccc(Cl)c2)c1OC 1051895 JYHIBYIYKZVGMP-RGVLZGJSSA-N 375.812 2.836 50 40 GFGB Cc1occc1C(=O)NNC(=O)[C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1 54884138 FVFOUPMQBGIHCO-AWEZNQCLSA-N 382.203 2.849 50 40 GFGB O=C(N/N=C/c1ccccc1C(=O)O)C(=O)Nc1ccc(Cl)c(Cl)c1 59444395 ASQJQJIESJPEDY-UFWORHAWSA-N 380.187 2.780 50 40 GFGB COc1cc(/C=C(/C#N)C(=O)NCCCc2ccccc2)ccc1OCC(=O)O 4724077 UZNMBTIUYFJRRG-PDGQHHTCSA-N 394.427 2.815 50 40 GFGB Cc1cc(C)n(CCCNC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)n1 9532407 ISMWWEXRYBBJGY-GFCCVEGCSA-N 389.525 2.721 50 40 GFGB CC(C)(C)c1ccc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccoc3)C2)cc1 28409306 RISXNBJQUWOYPA-MRXNPFEDSA-N 397.475 2.891 50 40 GFGB O=C(COc1cccc(Br)c1)NNC(=O)c1cc(F)cc(F)c1 15506775 CQKVBAKJGWNTLT-UHFFFAOYSA-N 385.164 2.567 50 40 GFGB C#CCOC(=O)c1cccc(-c2ccc(/C=C3\C(=O)NC(=O)C(C#N)=C3C)o2)c1 16694023 PVJYTEMGPSHJRB-BOPFTXTBSA-N 386.363 2.616 50 40 GFGB CCCC1=C(C(=O)OCC)[C@]2(C(=O)Nc3ccc(Cl)cc32)C(C#N)=C(N)O1 850918 RDYOXLJHMBIHPQ-LJQANCHMSA-N 387.823 2.871 50 40 GFGB COc1cc(OC)cc(C(=O)NNC(=O)COc2cc(C)c(Cl)c(C)c2)c1 669835 YQHFCMVTUKARRI-UHFFFAOYSA-N 392.839 2.814 50 40 GFGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc2cc(CC)ccc2[nH]c1=O 876487 YIYOTGDFTIBXTN-SFHVURJKSA-N 379.416 2.735 50 40 GFGB COc1cc(/C=N/NC(=O)c2cncc(Br)c2)ccc1OC(C)=O 1444650 YTQZFQSDYSMWJK-FBCYGCLPSA-N 392.209 2.542 50 40 GFGB COc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OCCCBr)cc1 4065371 JMUQEOLNEBQREN-AWEZNQCLSA-N 383.242 2.651 50 40 GFGB O=C(NNC(=O)c1ccc[nH]c1=O)c1ccccc1OCc1ccccc1Cl 12979513 PNFUCDQYDZYZKO-UHFFFAOYSA-N 397.818 2.682 50 40 GFGB O=C(NNC(=O)c1ccccc1Br)c1ccc(Cn2cccn2)cc1 14122416 IKZLIRBBIVENLY-UHFFFAOYSA-N 399.248 2.769 50 40 GFGB O=C(CCN1CCN(Cc2ccccc2)CC1)N/N=C/c1ccc(Cl)cc1 22867131 JFXUEXCGLHRXOU-XQNSMLJCSA-N 384.911 2.998 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccccc1Cl 408827347 JGDVUOORVMIUSY-UDWIEESQSA-N 388.811 2.849 50 40 GFGB CCC(=O)Nc1nnc(CC(=O)N/N=C/c2ccc(Cl)cc2Cl)s1 1958367 NGRGFCSUQWIDPN-REZTVBANSA-N 386.264 2.886 50 40 GFGB N[P@@](=O)(OCCC(=O)OCc1ccccc1)N(CCCl)CCCl 2033506 URRQYEVJTAKGKS-HSZRJFAPSA-N 383.212 2.983 50 40 GFGB in-vitro O=C(NC(=S)NNC(=O)c1cccc2ccccc12)c1ccc([N+](=O)[O-])cc1 4977064 JMSBWQFWXQGTCV-UHFFFAOYSA-N 394.412 2.697 50 40 GFGB Cc1cccc(N(CC(=O)N/N=C/c2ccc(Cl)cc2)S(C)(=O)=O)c1 20060258 KXVJAAOTRHDQOI-YBFXNURJSA-N 379.869 2.565 50 40 GFGB N#C/C(=C\c1cn(CC(=O)NCc2ccco2)c2ccccc12)C(=O)NC1CC1 883685 FHFRZKUGTNHKBL-XNTDXEJSSA-N 388.427 2.736 50 40 GFGB CN1CCN(c2ncc(/C=N/NC(=O)c3ccc(C(F)(F)F)cc3)s2)CC1 1406071 RGQPDCCFBBVJAW-SSDVNMTOSA-N 397.426 2.678 50 40 GFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)c1ccccc1 408979802 OOZDOOBSEFAQMZ-NNIWKIFQSA-N 384.392 2.922 50 40 GFGB COc1cccc(/C=N/NC(=O)C(=O)NCc2ccc(C(C)C)cc2)c1OC 409001081 GOTBDTGFOKIXSH-YDZHTSKRSA-N 383.448 2.594 50 40 GFGB Cc1sc2ncnc(SCC(=O)NNC(=O)Cc3ccccc3)c2c1C 886428 AQPYAIHGGRJREZ-UHFFFAOYSA-N 386.502 2.790 50 40 GFGB CCOc1ccc(C(=O)NNC(=O)c2cc(F)c(F)c(F)c2F)cc1OC 32845599 KGQZOQNODCLGOA-UHFFFAOYSA-N 386.301 2.725 50 40 GFGB COc1ccc(CCCC(=O)N/N=C/c2ccc(OCC(=O)O)cc2)c(C)c1 408910301 JREYKSGQJKWYBZ-LPYMAVHISA-N 384.432 2.940 50 40 GFGB CCOC(=O)/C(C#N)=C/c1cc(I)c(O)c(OCC)c1 2772849 PJWMNFBXCFBHKI-BJMVGYQFSA-N 387.173 2.866 50 40 GFGB O=C(NNC(=O)c1cccn(Cc2cccc(F)c2)c1=O)Nc1ccc(F)cc1 23136129 FWGNDJYDZSDGRE-UHFFFAOYSA-N 398.369 2.641 50 40 GFGB CC1=C(C)C[C@@H](C(=O)NNC(=O)[C@@H](C)Oc2ccc(C)c(C)c2)[C@@H](C(=O)O)C1 6033411 YDGQPLKUDJGWBS-NXHRZFHOSA-N 388.464 2.665 50 40 GFGB COc1ccc(/C=N/NC(=O)c2cccc(I)c2)cc1O 59519015 YICNHZISPJZUSU-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cccc(F)c1 12816265 QYNGSALUUINWPU-JTQLQIEISA-N 381.201 2.817 50 40 GFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)COc1cccc(C)c1 4690657 PETLZOFGCWDPSR-HZHRSRAPSA-N 397.431 2.666 50 40 GFGB COC(=O)COc1c(Cl)cc(/C=N/NC(=O)c2ccc(C)cc2)cc1OC 409364656 OHHYSONPUIBQLF-UFFVCSGVSA-N 390.823 2.973 50 40 GFGB CCc1sc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3ccoc3)C2)cc1C 28419352 MSROVOLAERJHAE-ZDUSSCGKSA-N 389.477 2.525 50 40 GFGB N#Cc1cccnc1NCCNC(=O)NNc1ccc(OC(F)(F)F)cc1 47114392 RKRLMDPBEJQZMK-UHFFFAOYSA-N 380.330 2.590 50 40 GFGB Cc1ccc(Cl)cc1N(CC(=O)N/N=C/c1ccc(F)cc1)S(C)(=O)=O 408787204 UPJXQPNBBORSBE-KEBDBYFISA-N 397.859 2.704 50 40 GFGB O=C(NN[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1=O)c1cccc(F)c1 1073462 HZFBSJXCDPXKLT-CQSZACIVSA-N 396.205 2.699 50 40 GFGB COc1ccc(OC)c(NC(=O)C(=O)N/N=C/c2cccc3ccccc23)c1 59515463 IFUQUXNAOZWPRH-LPYMAVHISA-N 377.400 2.946 50 40 GFGB COC(=O)[C@@H]1CCC[C@H](C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)C1 106921582 AQSMJEVAVKJJIH-FRRDWIJNSA-N 378.494 2.613 50 40 GFGB CCOCc1c(C(=O)NNC(=O)Cc2ccc(OC)cc2)oc2ccccc12 12820329 IRDBLNYZEGJAOF-UHFFFAOYSA-N 382.416 2.982 50 40 GFGB Cc1ccc(/C=N/NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(C)c1 3470377 KXGXWWBUPBNOHH-KGENOOAVSA-N 385.489 2.852 50 40 GFGB O=C(CNc1ccc2ccccc2c1)N/N=C1/C(=O)Nc2ccc([N+](=O)[O-])cc21 6258216 OFYZJIJSKAPTTA-UHFFFAOYSA-N 389.371 2.633 50 40 GFGB COc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)O)c(OC)c2)cc1 4722757 BHUSBKLCFDFRDX-NTEUORMPSA-N 382.372 2.713 50 40 GFGB COc1cc(/C=N/NC(=O)COc2cc(C)cc(C)c2)c([N+](=O)[O-])cc1OC 4703524 SHELTFUFBCLFMU-KEBDBYFISA-N 387.392 2.758 50 40 GFGB CCOc1cc(/C=N/NC(=O)c2cc([N+](=O)[O-])ccc2O)cc(Cl)c1O 409054485 GNGYYBDXMRICEE-QGMBQPNBSA-N 379.756 2.822 50 40 GFGB Cc1ccc(NCC(=O)N/N=C/c2ccc(I)o2)cc1 1092663 XFXHTKWNQBWBJN-CAOOACKPSA-N 383.189 2.755 50 40 GFGB Cc1occc1C(=O)NNS(=O)(=O)C1=Cc2ccc(OC(F)F)cc2CC1 50530826 PHSUOAJTBSPPPR-UHFFFAOYSA-N 398.387 2.741 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)N(CC)CC)ccc1OCc1ccccc1 5452770 RQMUDSWKLCAAPM-HZHRSRAPSA-N 397.475 2.983 50 40 GFGB O=C(NNS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccc(-c2ccccc2)cc1 834004 YHAVHBCLGVUVJM-UHFFFAOYSA-N 397.412 2.885 50 40 GFGB CCCC[C@H](CCC(=O)NNC(=O)c1ccccc1Br)C(=O)O 2340079 NRTYFPNEWCDGAT-LLVKDONJSA-N 385.258 2.881 50 40 GFGB CSc1ccc(/C=N/NC(=O)CN(c2ccccc2C)S(C)(=O)=O)cc1 20207619 SASIVVGDHUANMI-XDHOZWIPSA-N 391.518 2.633 50 40 GFGB CC(C)CN(CC(C)C)C(=O)CSC1=C(C#N)C(C)(C)[C@H](C#N)C(=O)N1 7250965 PVDJWPATGBTUOX-CQSZACIVSA-N 376.526 2.891 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)C(=O)Nc2ccc3ccccc3c2)c1 3089857 MLSPBKFXGHQZRZ-LPYMAVHISA-N 377.400 2.946 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccsc3)[C@@H]2C1 1803229 KUQNRDWGSIFKAO-CVEARBPZSA-N 379.445 2.630 50 40 GFGB Cc1cc(C)cc(N2C[C@@H](C(=O)NNC(=O)c3ccc(Cl)cc3)CC2=O)c1 7882552 KRXPTCKMJSSGFX-HNNXBMFYSA-N 385.851 2.771 50 40 GFGB O=C(CN1C(=O)c2cccc3cccc1c23)N/N=C/c1cccc2c1OCCO2 108904737 WQLIZEUCKBXSSG-FSJBWODESA-N 387.395 2.722 50 40 GFGB O=C(COc1ccc(/C=N\NC(=O)Cc2ccccc2)cc1)NCc1ccco1 58882763 GCIZNHOSMBQNBP-OYKKKHCWSA-N 391.427 2.668 50 40 GFGB CCCN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cc(OC)ccc3F)[C@H]2C1 4311112 VLMDZHBTHOFQAH-ICSRJNTNSA-N 391.450 2.970 50 40 GFGB COc1ccc(SCC(=O)N/N=C\c2ccc(O[C@@H](C)C(=O)O)cc2)cc1 408853311 NIKPPCVYUNHXSX-GHOUAXAESA-N 388.445 2.790 50 40 GFGB Cc1ccccc1[C@@H]1C(C#N)=C(N)OC2=C1S(=O)(=O)N(C)c1ccccc12 20558348 MPTOIIXFHZCHNT-QGZVFWFLSA-N 379.441 2.951 50 40 GFGB Cc1ccc(/C=N/NC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)cc1 20493177 KSDFZNBWKCEXER-YBFXNURJSA-N 379.869 2.565 50 40 GFGB O=C(COc1ccc(/C=N/NC(=O)c2cccnc2)cc1)NC1CCCCC1 28214912 KCMUBSIVBIPLEO-YDZHTSKRSA-N 380.448 2.673 50 40 GFGB Cc1ccc(CN(C)C(=O)CSC2=C(C#N)C(C)(C)[C@@H](C#N)C(=O)N2)cc1 5297669 QGSVXBMPQCDETF-HNNXBMFYSA-N 382.489 2.718 50 40 GFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)COc2ccc(C)cc2)c(OC)c1 4409419 FDFOSMGRWKXPJC-HZHRSRAPSA-N 399.447 2.912 50 40 GFGB C[C@@H](c1ccccc1)N1C[C@H](C(=O)NNC(=O)c2ccccc2Cl)CC1=O 7882207 SRGBESVPXQQIAY-DZGCQCFKSA-N 385.851 2.711 50 40 GFGB CCCC1=C(C(=O)OCC)[C@@H](c2cc(OC)c3c(c2)OCO3)C(C#N)=C(N)O1 2247689 PFNNZORRJCQLGC-INIZCTEOSA-N 386.404 2.849 50 40 GFGB Cc1cc([N+](=O)[O-])nn1Cc1ccc(C(=O)N/N=C/c2ccccc2O)cc1 2272947 DVDOBNUJTCVHSQ-RGVLZGJSSA-N 379.376 2.618 50 40 GFGB CCOc1ccc(NC(=O)CCC(=O)NNC(=O)CCc2ccccc2)cc1 4426570 QMRYXEUVLIHXCK-UHFFFAOYSA-N 383.448 2.584 50 40 GFGB Cc1cccc(OCC(=O)N/N=C2\C(=O)N(CCCC#N)c3ccccc32)c1 4889330 WOTJONFCBSYBHK-GFMRDNFCSA-N 376.416 2.545 50 40 GFGB CCc1ccc(/C=N/NC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)cc1 19682556 FKCTVRDMOJRMFJ-LFVJCYFKSA-N 378.520 2.825 50 40 GFGB O=C(Cc1ccccc1)N/N=C/c1cc(Br)c(N2CCOCC2)o1 59248363 WFBFNACIWRVYGC-XDHOZWIPSA-N 392.253 2.572 50 40 GFGB O=C(N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2)c1cccc(Br)c1 652034 MNHDFJYPGHSOOX-REZTVBANSA-N 392.165 2.850 50 40 GFGB O=C(N/N=C/c1ccc2c(c1)OCO2)c1ccccc1I 1091040 NGGFLAAOCGUYQN-CAOOACKPSA-N 394.168 2.784 50 40 GFGB COc1cccc(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)c1OC 3059264 CJBGJRHQFAIDOO-LSHDLFTRSA-N 395.337 2.811 50 40 GFGB O=C(Cn1nnc(-c2ccccc2Cl)n1)N/N=C/c1cc(Cl)ccc1O 8380584 ZGQTZRGATYCNBY-UFWORHAWSA-N 391.218 2.503 50 40 GFGB COC(=O)C1=C(C)NC(SCC(=O)NC2CC2)=C(C#N)[C@@H]1c1cccs1 19597348 AWORQOGIZFENRB-MRXNPFEDSA-N 389.502 2.629 50 40 GFGB C/C(=N\NC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O)c1cccs1 20209470 JWKQNCRRGHVFCC-GZTJUZNOSA-N 385.898 2.708 50 40 GFGB O=C(N/N=C/c1c(Cl)cccc1Cl)C(=O)Nc1ccc2c(c1)OCCO2 59516221 KEWSHTNBDCFIIF-AWQFTUOYSA-N 394.214 2.853 50 40 GFGB COc1cc(C(=O)N/N=C/c2ccc(C)o2)ccc1I 408748049 XPXVXHYRLMMVOL-LZYBPNLTSA-N 384.173 2.965 50 40 GFGB Cc1cccc(-c2n[nH]c(=S)n2CCC(=O)NNC(=O)Cc2ccccc2)c1 12869658 JQSVTCLLWPWLQO-UHFFFAOYSA-N 395.488 2.696 50 40 GFGB COc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)O)cc2)c([N+](=O)[O-])c1 4660254 ZANBINIXJAPVOM-MDWZMJQESA-N 397.343 2.612 50 40 GFGB CNC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2Cl)c(Cl)c1 408609086 JILSUKDVFJLGCT-ZVBGSRNCSA-N 380.231 2.769 50 40 GFGB NC1=C(c2nc3ccccc3[nH]2)C(=O)[C@@H](Br)N1c1cccc(O)c1 94992571 ZILATKLRLDTELQ-HNNXBMFYSA-N 385.221 2.706 50 40 GFGB Cc1ccc(C)c(OCC(=O)NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2)c1 12764817 QBHGQVVZNUDWOG-CQSZACIVSA-N 376.840 2.951 50 40 GFGB CC(C)c1ccc(/C=N/NC(=O)CN(Cc2ccccc2)S(C)(=O)=O)cc1 6377366 ACFMXDQUXZQBHW-FYJGNVAPSA-N 387.505 2.722 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2cc(Br)c(O)c(OC)c2)cc1 5513655 MRIUZGBCBFTFSV-VXLYETTFSA-N 393.237 2.865 50 40 GFGB Cc1cccc(C)c1OCC(=O)NNC(=O)c1ccc(N2CCCCCC2)nc1 32809292 ZCDIFQLBMALXBG-UHFFFAOYSA-N 396.491 2.919 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(NC(=O)C3CC3)cc2)ccc1OC(C)=O 674450 APIFWOSBTSUGAR-WSDLNYQXSA-N 395.415 2.733 50 40 GFGB Cc1ccc(C(=O)NNC(=O)c2ccc(Br)cc2)cc1[N+](=O)[O-] 3612107 CPCAQGQUEKLHHY-UHFFFAOYSA-N 378.182 2.741 50 40 GFGB COc1ccc(NC(=O)C(=O)N/N=C/c2cccc3ccccc23)c(OC)c1 5513321 RDILOGDSEPPRTO-LPYMAVHISA-N 377.400 2.946 50 40 GFGB CN(CC(=O)NNC(=O)c1ccc(-c2ccc(F)cc2)s1)[C@@H]1CCSC1 95448446 BIPHIVRZVSIQFD-CQSZACIVSA-N 393.509 2.753 50 40 GFGB COc1cc([C@@H]2C(C#N)=C(SCC(N)=O)N=C3CCCC(O)=C32)ccc1O 100086751 FIKZSZMYIVSHIN-QGZVFWFLSA-N 385.445 2.889 50 40 GFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)CCc1ccccc1 100522814 WZZSRKQJGIEPSP-HZHRSRAPSA-N 381.432 2.911 50 40 GFGB COC(=O)[C@@H]1/C(=N/NC(=O)c2ccccc2O)C[C@@](C)(O)C[C@@H]1c1ccccc1 101406501 JPQOGYMVEBZUHB-ZTOALKBRSA-N 396.443 2.596 50 40 GFGB Cc1ccc2c(c1Br)/C(=N/NC(=O)[C@@H]1[C@H]3CCCC[C@H]31)C(=O)N2 252394531 PALHEPDOGAHVEN-IAZYJMLFSA-N 376.254 2.966 50 40 GFGB COC(=O)COc1cccc(/C=N/NC(=O)CSCc2ccc(C)cc2)c1 408858890 QQJRSWQDLLYCED-SRZZPIQSSA-N 386.473 2.930 50 40 GFGB CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C/NNC(=O)c1cccc([N+](=O)[O-])c1 4714456 GKDXQORFXXONGT-WOJGMQOQSA-N 393.403 2.753 50 40 GFGB Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNS(=O)(=O)c1cccs1 12801855 VOXPEHSABBIFCU-NSHDSACASA-N 388.898 2.795 50 40 GFGB CCOC(=O)[C@H](C(C)=O)[C@@H](c1cccc(Cl)c1)[C@H](C#N)C(N)=C(C#N)C#N 257345181 SJRRGLZPTOMYCZ-BBWFWOEESA-N 384.823 2.592 50 40 GFGB COc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1 3396574 RMWHEVHDCJTWIB-LLVKDONJSA-N 380.491 2.505 50 40 GFGB COc1cc(/C=N/NC(=O)c2cc(C)n[nH]2)ccc1OC(=O)c1cccs1 4663963 UNQQMTVBQUUOTC-VXLYETTFSA-N 384.417 2.771 50 40 GFGB CCCCc1[nH]nc2c1[C@@H](c1cc(OC)c(OC)cc1OC)C(C#N)=C(N)O2 5045032 NXPYQZNVLLNCNW-KRWDZBQOSA-N 384.436 2.996 50 40 GFGB C[C@@H](Cl)CN(C[C@@H](C)Cl)C(=O)Oc1ccc(C[C@H](N)C(=O)O)cc1 5353400 JCZBYODVXLGJTG-GYSYKLTISA-N 377.268 2.696 50 40 GFGB CCOC(=O)c1c(N/C=C2\C(=O)N(C)C(=O)C(C#N)=C2C)sc2c1CCCC2 5510724 OUKBMAVFEXUUAS-UVTDQMKNSA-N 399.472 2.938 50 40 GFGB CC(C)c1ccc2c(c1)/C(=N\NC(=O)c1nc(O)c3ccccc3n1)C(=O)N2 6016181 ORKRSYCBYQCALV-UHFFFAOYSA-N 375.388 2.545 50 40 GFGB CCOC(=O)CSC1=C(C#N)[C@@H](c2ccccc2Cl)[C@@H](C#N)C(=O)N1 9332270 UNUYGJHEVDOABG-ABAIWWIYSA-N 375.837 2.725 50 40 GFGB COc1cccc(NCC(=O)NNC(=O)c2cc3ccccc3cc2OC)c1 12515200 CSBGPSMOHPVRPI-UHFFFAOYSA-N 379.416 2.730 50 40 GFGB O[C@@]12[C@@H](Br)[C@@H]3[C@@H]4[C@@H]5C[C@@H]3[C@H]1[C@H]5C(Br)(Br)[C@@H]42 100019695 WZBOKYFPZUQGLI-PGLDHXKXSA-N 398.920 2.739 50 40 GFGB O=C(N/N=C/c1ccc(Sc2ncccn2)c([N+](=O)[O-])c1)c1ccncc1 409098480 INVOZDMSBOCYBP-SRZZPIQSSA-N 380.389 2.695 50 40 GFGB O=C(Cn1c(-c2ccccn2)nc2ccccc21)N/N=C/c1ccc(O)cc1O 4980757 SDAUYNRCYRBXJW-FSJBWODESA-N 387.399 2.660 50 40 GFGB O=C(CSc1nc2ccccc2o1)NNC(=O)Cc1ccc(Cl)cc1 8350009 GVKMAJKDTBNHAU-UHFFFAOYSA-N 375.837 2.963 50 40 GFGB CN(NC(=O)CN(C)S(=O)(=O)c1ccc2ccccc2c1)c1ccccc1 8358615 TXIGEXWREWXDGO-UHFFFAOYSA-N 383.473 2.628 50 40 GFGB Cc1cc(Br)cc2c1N(C)C(=O)/C2=N\NC(=O)c1cccc(O)c1 12445804 DAGOBAXHLXFFMW-RGEXLXHISA-N 388.221 2.574 50 40 GFGB C/C(CCc1ccccc1)=N\NC(=O)[C@@H](C)N(c1ccccc1)S(C)(=O)=O 408921532 INFCQNYSWXDKCM-GFXBCDTMSA-N 387.505 2.966 50 40 GFGB CCOC(=O)Cn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c2ccccc21 409344195 JHKYQMOQSBEYKY-LSHDLFTRSA-N 393.399 2.697 50 40 GFGB CC(C)CN(CC(C)C)C(=O)[C@H](Br)[C@@H](Br)C(=O)O 1685977 MHDIVHHUHBOMDP-NXEZZACHSA-N 387.112 2.739 50 40 GFGB Cc1ccc(C(=O)NNC(=O)COc2ccc(C)cc2Br)cc1 3247001 QAPPPIDGZMFBKG-UHFFFAOYSA-N 377.238 2.906 50 40 GFGB COc1ccc(C(=O)NNC(=O)COc2ccc(Cl)cc2C)cc1OC 12877234 JFVVYXXBGYINOF-UHFFFAOYSA-N 378.812 2.506 50 40 GFGB COc1ccc(/C=N/NC(=O)c2c(C)nc3ccc(Cl)cn23)cc1[N+](=O)[O-] 408976092 PKCUYDUKJBZHRS-UFWORHAWSA-N 387.783 2.977 50 40 GFGB CCc1cc(C(=O)NNC(=O)[C@H]2[C@@H](C(=O)O)[C@@H]3CC[C@H]2C3=C(C)C)cs1 17076978 JOQGNRGLWIHDEO-XNISGKROSA-N 376.478 2.765 50 40 GFGB COc1ccc(C(=O)NCC(=O)N/N=C(C)\C=C\c2ccccc2)cc1OC 4411945 SKTGFKCJCVQSQY-QWGTYQKISA-N 381.432 2.639 50 40 GFGB biogenic CC1(C)[C@H]2CC[C@]1(C)/C(=N/NC(=O)COn1nnc3ccc(Cl)cc31)C2 102446631 QBCLMMKGDYVMHD-USKDLNBVSA-N 375.860 2.832 50 40 GFGB CC(=O)N[C@@H](C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2)C(C)C 8420768 BETSLDGOPTXLQT-WMLDXEAASA-N 393.553 2.821 50 40 GFGB CCn1c(C)nc2cc(C(=O)NNC(=O)COc3ccc4c(c3)CCC4)ccc21 9885253 NTDPWKKUAZCMPV-UHFFFAOYSA-N 392.459 2.693 50 40 GFGB O=Cc1s/c(=N/S(=O)(=O)c2ccccc2)n(CCCCl)c1Cl 12504681 LLKYUKDABCWPOE-DTQAZKPQSA-N 379.290 2.934 50 40 GFGB C=CCc1cc(/C=C(/C#N)C(=O)N(C)C)cc(OCC)c1OCC(=O)OCC 59334902 ZCYGBLVWNHBPRV-BOPFTXTBSA-N 386.448 2.751 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])c(O)c2ncccc12)c1ccc([N+](=O)[O-])cc1 59459148 KWMPPYHZYAAFOC-DJKKODMXSA-N 381.304 2.521 50 40 GFGB C/C(CCc1ccccc1)=N\NC(=O)CN(c1ccc(F)cc1)S(C)(=O)=O 408775891 KQYHTARLEODHLB-RCCKNPSSSA-N 391.468 2.717 50 40 GFGB Cc1cc(/C=N\NC(=O)CN2CCOCC2)c(C)n1-c1ccc(C(C)C)cc1 408994548 GPWSNWOWKJSCIN-UCQKPKSFSA-N 382.508 3.000 50 40 GFGB O=C(CNc1ccc(Cl)cc1)N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2 409360025 CYYMSNMOGLZARJ-FBCYGCLPSA-N 376.756 2.539 50 40 GFGB O=C(N/N=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)NC1CCCCC1 58914350 YNDQQQBAONJWOE-NDENLUEZSA-N 384.392 2.754 50 40 GFGB COC(=O)C1=C(N)SS/C1=C(\N=N\c1ccc([N+](=O)[O-])cc1)[N+](=O)[O-] 104231918 GSHWXXRIRNDXEU-KYUUQUQASA-N 383.367 2.863 50 40 GFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccccc3Br)[C@H]2C1 4730480 JYWYZPCDJFDJOE-RDJZCZTQSA-N 394.276 2.804 50 40 GFGB CN(C)c1ccc(/C=C(\C#N)C(=O)OCC(=O)NC2(C#N)CCCCC2)cc1 4961452 STJFLYPDDODQQP-SFQUDFHCSA-N 380.448 2.545 50 40 GFGB CSc1ccc(/C=N/NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1 409110792 YSNONHZCUZRHAM-LDADJPATSA-N 377.491 2.568 50 40 GFGB O=C(NNS(=O)(=O)c1cc(Cl)c(Cl)cc1Cl)c1ccc(O)cc1 226855712 WQJOGBKDNWRJJN-UHFFFAOYSA-N 395.651 2.976 50 40 GFGB O=C(O)c1ccc(/C=N/NC(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)cc1 1095084 YYJNEKRFJKLQGD-YDZHTSKRSA-N 397.406 2.526 50 40 GFGB COC(=O)COc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2)cc1OC 8113332 DBTFSLQJQUGYLO-KEBDBYFISA-N 376.796 2.664 50 40 GFGB O=C(N/N=C/c1ccccc1O)C1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 5636519 OTRLMQXJOJMNQA-FYJGNVAPSA-N 382.420 2.663 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])c(O)cc1O)c1ccc(Br)cc1 5569434 NJMPFFGPZZQXLG-FRKPEAEDSA-N 380.154 2.532 50 40 GFGB O=C(COC(=O)Cc1ccc(-c2ccccc2)cc1)NNC(=O)c1ccccc1 3314308 JTCHSYLIIWVVKH-UHFFFAOYSA-N 388.423 2.901 50 40 GFGB Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)COc3ccccc3C)cc2)n1 3319156 GYBFONHRFZCXHV-UHFFFAOYSA-N 378.432 2.638 50 40 GFGB COc1ccc(/C=C/C(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1 3456390 MZXOLCCSGVUMHR-JXMROGBWSA-N 394.349 2.954 50 40 GFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)COc2cccc(C)c2)c(OC)c1 4697865 USIIYEALFTVZQR-HZHRSRAPSA-N 399.447 2.912 50 40 GFGB COc1ccc2c(CC(=O)NNC(=O)c3cc(-c4ccccc4)n[nH]3)coc2c1 6506028 CWCCPWWIKVNGRL-UHFFFAOYSA-N 390.399 2.835 50 40 GFGB COc1cccc(NCC(=O)NNC(=O)CCc2ncc(-c3ccccc3)o2)c1 12522256 QMSRBYBLHGASAE-UHFFFAOYSA-N 394.431 2.542 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)c2ccc(Br)cc2)c(C)c1 12735874 YBPMRMGYLDQWCP-UHFFFAOYSA-N 377.238 2.906 50 40 GFGB O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1Cc1ccccc1 13001407 SYBYKAJKZAILCR-OAQYLSRUSA-N 388.423 2.878 50 40 GFGB COc1ccc(Br)cc1[C@H]1C(C#N)=C(N)Oc2cc(C)[nH]c(=O)c21 18266089 SLSTXKTVCUHHIK-AWEZNQCLSA-N 388.221 2.673 50 40 GFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1cccn1-c1ccc(C(=O)O)cc1 35191295 KOUDUVAITHQSDN-BKUYFWCQSA-N 392.371 2.777 50 40 GFGB COc1cc(/C=C(/C#N)C(=O)NC(C)C)cc(Br)c1OCC#N 408770697 ASYOIDGPDGTFJN-SDQBBNPISA-N 378.226 2.792 50 40 GFGB CS(=O)(=O)N(CC(=O)NN=C1CCCC1)c1cc(Cl)cc(Cl)c1 408770743 BTGSCDOQAZZXAM-UHFFFAOYSA-N 378.281 2.806 50 40 GFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1cccc([N+](=O)[O-])c1)c1ccccc1 408979245 LRSWUXZJUSUFQI-UOBPLZBXSA-N 384.392 2.922 50 40 GFGB Cc1cc(C(=O)NNC(=O)c2ccco2)c(C)n1-c1ccc2c(c1)OCCO2 28404970 XCFAURJZUIVWHB-UHFFFAOYSA-N 381.388 2.533 50 40 GFGB COc1ccc2c(c1)[C@@]1(C(=O)N2)C(C#N)=C(N)Oc2c1c(C)nn2-c1ccccc1 5245679 UQGQCKPMYKBKCC-JOCHJYFZSA-N 399.410 2.514 50 40 GFGB O=C(N[C@H](CCl)Cc1ccccc1)C(=O)N[C@H](CCl)Cc1ccccc1 7036764 FGQRXPPUTDNSJL-ROUUACIJSA-N 393.314 2.919 50 40 GFGB O=C(NNS(=O)(=O)c1ccc(C(F)(F)F)cc1)c1cc2c(s1)CCC2 7379818 JWVSSXZXROBNCC-UHFFFAOYSA-N 390.408 2.879 50 40 GFGB Nc1sc(-c2ccccc2)cc1C(=O)NNC(=O)COc1ccccc1O 7986437 MGUWNPYOZLVHQC-UHFFFAOYSA-N 383.429 2.543 50 40 GFGB Cn1cc(C(=O)NNC(=O)Cc2ccc(Br)cc2)c2ccccc21 8144717 PFBMQFKFMDGBGK-UHFFFAOYSA-N 386.249 2.945 50 40 GFGB Cc1cccc(OCC(=O)NNC(=O)c2c[nH]nc2-c2ccc(Cl)cc2)c1 8710109 GHZOQWJYQOMLFN-UHFFFAOYSA-N 384.823 2.879 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2ccccc2F)cc(Cl)c1O 409273232 WIOQQIIODDFDAW-AWQFTUOYSA-N 379.775 2.672 50 40 GFGB CS(=O)(=O)N(CC(=O)NN=C1CCCC1)c1cccc(Cl)c1Cl 408925776 PRTNRXUPMFUOHK-UHFFFAOYSA-N 378.281 2.806 50 40 GFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)c1cccc(I)c1 919185 AXIREXMUUDDXHN-CXUHLZMHSA-N 395.156 2.963 50 40 GFGB Cc1cc(=O)oc2cc(OCC(=O)N/N=C/c3nc4ccccc4[nH]3)ccc12 4870521 UWJNAUMXAHXACC-UFFVCSGVSA-N 376.372 2.507 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2cc(Cl)ccc2OC)ccc1O 5463779 GXHRVHHHWANYGM-KEBDBYFISA-N 391.811 2.542 50 40 GFGB O=C(CSCc1ccc(Cl)s1)NNC(=O)c1n[nH]c2c1CCCC2 12531470 SFYGCGJBGFTRFV-UHFFFAOYSA-N 384.914 2.698 50 40 GFGB CN(C)S(=O)(=O)c1cccc(C(=O)NNc2cccc(C(F)(F)F)c2)c1 14907524 QVUDCZNRYDGSSZ-UHFFFAOYSA-N 387.383 2.713 50 40 GFGB Cn1c(CC(=O)NNC(=O)CCc2nc3ccccc3s2)nc2ccccc21 5268632 XRQAFZZRWRCTIV-UHFFFAOYSA-N 393.472 2.506 50 40 GFGB O=C(NNC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2)c1ccccc1 40140157 UGQWFESDTUFTQO-UHFFFAOYSA-N 382.370 2.714 50 40 GFGB CC(=O)Nc1cccc(C(=O)N/N=C\c2cc([N+](=O)[O-])ccc2N2CCCC2)c1 108918670 OYZWINKKMMIAQR-BKUYFWCQSA-N 395.419 2.917 50 40 GFGB COc1cc(/C=N\NC(=O)Cc2ccccc2)ccc1OCC(=O)OC(C)C 408600272 AYJSCYDKYNAUMT-XKZIYDEJSA-N 384.432 2.718 50 40 GFGB O=C1[C@@H]2C[C@H](Br)[C@@H](Br)C[C@H]2C(=O)N1c1nccs1 408672935 PKGSWLQSPQMASE-NGJRWZKOSA-N 394.088 2.570 50 40 GFGB Cc1cc2c(c(=O)n1CCCn1ccnc1)[C@H](c1ccccc1)C(C#N)=C(N)O2 1471844 OTKVAQBLNGTETR-LJQANCHMSA-N 387.443 2.662 50 40 GFGB Cn1c(SCC(=O)N/N=C/c2ccncc2)nnc1-c1ccc(Cl)cc1 2320475 KMVDQZXMYDHJBP-KEBDBYFISA-N 386.868 2.773 50 40 GFGB COc1cccc(/C=N/NC(=O)C(=O)NCc2ccc(Cl)cc2Cl)c1 3088307 JDGPLGKBTRVLJZ-ZVBGSRNCSA-N 380.231 2.769 50 40 GFGB Cc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)O)cc2)c([N+](=O)[O-])c1 5698325 MRMCFGHOEINEDU-NTEUORMPSA-N 381.344 2.912 50 40 GFGB CCOC(=O)CSC1=C(C#N)[C@H](c2ccc(OC)c(Cl)c2)CC(=O)N1 6955141 JMYCWTRUESPHKI-NSHDSACASA-N 380.853 2.984 50 40 GFGB COc1ccc(C(=O)N/N=C/c2ccc(O)c(Br)c2)c(OC)c1 60512599 QKAUCPSSEZTBPQ-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB N#CC1=C(SCC(=O)NCc2ccco2)NC(=O)C[C@@H]1c1ccc(F)cc1 6495518 VJEQCIJXPTVTCF-OAHLLOKOSA-N 385.420 2.807 50 40 GFGB CCCOc1ccc(/C=N/NC(=O)C(=O)NCc2ccccc2)cc1OCC 7869468 GSWXRSGKSAVUJX-HZHRSRAPSA-N 383.448 2.641 50 40 GFGB COc1ccccc1OCC(=O)NNC(=O)COc1cc(C)ccc1C(C)C 2134913 UFWROKPKHVLXRX-UHFFFAOYSA-N 386.448 2.732 50 40 GFGB COC(=O)N/N=C/c1c(O)c(OC)cc(Br)c1Br 8206439 OVLJYXGADAJNDX-YIXHJXPBSA-N 382.008 2.616 50 40 GFGB O=C(COc1cccc(Cl)c1)N/N=C\c1ccc(N2CCOCC2)c(F)c1 409125697 JXIGPTJQTSQZFU-UUYOSTAYSA-N 391.830 2.845 50 40 GFGB CC(C)=C1[C@@H]2CC[C@@H]1[C@@H](C(=O)NNC(=O)c1csc(C)c1C)[C@@H]2C(=O)O 225583626 WCKKBTDCLNSGBU-YXAMBPQSSA-N 376.478 2.819 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)NCCOc2ccccc2)c([N+](=O)[O-])cc1OC 20228055 NBELMTSFYGYHFI-XNTDXEJSSA-N 397.387 2.714 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2ccc(OC)c(Cl)c2)ccc1O 59516253 ASUYWQUFZIPBBZ-KEBDBYFISA-N 391.811 2.542 50 40 GFGB O=C(NNS(=O)(=O)c1ccc(Cl)s1)c1ccc(Br)cc1 2658493 YXTUARZITJMKOF-UHFFFAOYSA-N 395.687 2.787 50 40 GFGB C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)COc1cccc2ccccc12 15384824 SNRBPBUZXSTJEW-CQSZACIVSA-N 382.391 2.973 50 40 GFGB COc1cc(/C=N/NC(=O)c2cccc(C)c2)cc(Cl)c1OCC(=O)O 409260705 UYXOHDCXDIUPDV-AWQFTUOYSA-N 376.796 2.884 50 40 GFGB CCCN(CCC)CN1C(=O)/C(=N\NC(=O)c2ccncc2)c2ccccc21 13756052 KOHMXGBDFMWAMM-NMWGTECJSA-N 379.464 2.642 50 40 GFGB COc1ccc(N(CC(=O)NN=C2CCCCC2)S(C)(=O)=O)cc1Cl 786414 FSMWGJLSSLVWTR-UHFFFAOYSA-N 387.889 2.551 50 40 GFGB CCOc1cc(/C=C(\C#N)C(N)=S)cc(I)c1OC 108170018 MQLMCGGVIYBKHY-RUDMXATFSA-N 388.230 2.892 50 40 GFGB Cc1ccc(-c2ccc(/C=N/NC(=O)c3nonc3N)o2)c(Br)c1 2239671 KLEAXGCNVBLUGL-CNHKJKLMSA-N 390.197 2.747 50 40 GFGB COc1cccc(/C=N/NC(=O)c2cc3cc(OC)c(OC)c(OC)c3[nH]2)c1 2334458 HIKXMMWOGGHXQQ-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB O=C(CNc1ccc(I)cc1)N/N=C/c1cccs1 59720768 RAVIWQXVXJTGQP-LZYBPNLTSA-N 385.230 2.915 50 40 GFGB O=C(COC(=O)C1(c2cccc(F)c2)CCCC1)NNC(=O)c1cccs1 2634578 BRCAKDZKKAOOOQ-UHFFFAOYSA-N 390.436 2.703 50 40 GFGB COC(=O)COc1ccc(/C=N/NC(=O)CNc2cccc3ccccc23)cc1 409392542 QHRMCGFKOOEZKM-ZMOGYAJESA-N 391.427 2.954 50 40 GFGB CCOC(=O)COc1ccccc1/C=N/NC(=O)c1ccc(N2CCCC2)cc1 408676938 NTHQBJNKSZCTCN-HZHRSRAPSA-N 395.459 2.993 50 40 GFGB CCN(CC)S(=O)(=O)c1ccc(NNC(=O)Nc2ccc(Cl)cc2)nc1 8710638 KSOYCUYPPJLMJB-UHFFFAOYSA-N 397.888 2.914 50 40 GFGB COc1ccc(C(=O)N/N=C/c2cc(OC)cc(Br)c2O)c(O)c1 409392223 OEJIPJTWYFNYMS-QGMBQPNBSA-N 395.209 2.641 50 40 GFGB O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1ccc(O)c([N+](=O)[O-])c1 408534663 WIEQJGQEMNJMGI-ODCIPOBUSA-N 382.298 2.881 50 40 GFGB COc1cccc(/C=N/NC(=O)c2ccc(Cl)cc2)c1O[C@@H](C)C(=O)O 409236841 GEQHLMPLZGIQLK-KKBVUKDESA-N 376.796 2.964 50 40 GFGB COC(=O)c1ccc(-c2ccc(/C=N/NC(=O)[C@H](O)c3ccccc3)o2)cc1 409267931 YBEQSNGZDOYIFG-PPRFWAEMSA-N 378.384 2.917 50 40 GFGB COc1ccc(CC(=O)N/N=C(\C)c2ccc(-n3ccnc3)cc2)cc1OC 20158282 KKAPHYCNOCEXLP-HZHRSRAPSA-N 378.432 2.972 50 40 GFGB COc1ccc(F)c([C@@H]2[C@H]3CN(C(C)C)CC=C3C(C#N)=C(N)C2(C#N)C#N)c1 1250778 OSPJDKSVHFHVON-AZUAARDMSA-N 391.450 2.968 50 40 GFGB O=C(COc1ccccc1)N/N=C/c1ccccc1I 5684217 OIBKWCWTOYIAIO-LICLKQGHSA-N 380.185 2.820 50 40 GFGB Cc1nn(CCC(=O)NNC(=S)Nc2ccccc2)c(C)c1Br 8684996 VJCNJYJCDMEUPI-UHFFFAOYSA-N 396.314 2.670 50 40 GFGB C/C(=N/NC(=O)Cc1ccc(O)cc1)c1ccc(NC(=O)C(F)(F)F)cc1 17077525 NWNJOWIQFUPJML-KSEXSDGBSA-N 379.338 2.976 50 40 GFGB CCCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccccc2)c(OCC)c1 408608203 GTRALMYSJYLIMF-OEAKJJBVSA-N 383.448 2.641 50 40 GFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C(\C)c1ccc(OC)c([N+](=O)[O-])c1 409273070 VDGWBMBWIGAWAE-VCHYOVAHSA-N 388.336 2.674 50 40 GFGB O=C(Cc1cccc([N+](=O)[O-])c1)N/N=C/c1cccn1-c1ccc(C(=O)O)cc1 4738605 RZPJBVAKOBJZGS-FYJGNVAPSA-N 392.371 2.777 50 40 GFGB O=C(COC(=O)/C=C/c1ccc(C(F)(F)F)cc1)NNC(=O)c1cccs1 6946228 JDJSOJQLZHJUIA-VMPITWQZSA-N 398.362 2.785 50 40 GFGB CCCCN1C(=O)c2ccc(C(=O)NNc3ccccc3[N+](=O)[O-])cc2C1=O 7007536 OSRIRRJEMRWTBY-UHFFFAOYSA-N 382.376 2.748 50 40 GFGB COc1ccccc1NCC(=O)NNC(=O)c1cc2cc(C)ccc2nc1C 12533174 WUACHIGNUABPLD-UHFFFAOYSA-N 378.432 2.733 50 40 GFGB Cc1nn(-c2ccccc2)c(C)c1/C=N\NC(=O)CCn1nnc2ccccc21 33340686 WYCHWXCOONZRBJ-HMAPJEAMSA-N 387.447 2.774 50 40 GFGB CC(C)(C)OC(=O)N1CCOC[C@]2(CC[C@H](CI)O2)C1 95698562 GXDDETCOIZTESK-RISCZKNCSA-N 397.253 2.607 50 40 GFGB in-vitro O=C(N/N=C/c1sc(N2CCOCC2)nc1-c1ccccc1)c1cccnc1 5163235 FTJUIHNBMABDGY-HYARGMPZSA-N 393.472 2.806 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)[C@@H]2COc3ccccc3O2)cc1OCC 5464407 UOPCCGZUPNXNNP-BOURKTIISA-N 382.416 2.940 50 40 GFGB COc1cc(/C=N/NC(=O)COc2ccccc2Cl)c([N+](=O)[O-])cc1OC 8112241 XRTGGXSZVPYKAA-DJKKODMXSA-N 393.783 2.795 50 40 GFGB C[C@H](Sc1nnc(C2CC2)n1C1CC1)C(=O)NNC(=O)c1ccc(F)cc1 9614244 INCSAITVMACHSD-JTQLQIEISA-N 389.456 2.571 50 40 GFGB COc1ccc(OC)c([C@@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)c1 18201232 VCLPZCRLCHHVBD-QGZVFWFLSA-N 388.379 2.845 50 40 GFGB COc1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)c3ccco3)cc2)cc1 59421968 BMRUJBPNAYFQMB-UHFFFAOYSA-N 379.372 2.615 50 40 GFGB COc1ccc(C(=O)N[C@@]2(C(Cl)Cl)N=C(c3ccccc3)NC2=N)cc1 98049008 TWABGXNXRHVOML-GOSISDBHSA-N 391.258 2.952 50 40 GFGB Nc1nnc(CC(=O)N/N=C/c2ccccc2OCc2ccccc2F)s1 666163 PBMQTGVBSHLVPP-UFFVCSGVSA-N 385.424 2.531 50 40 GFGB COc1ccc(Br)cc1/C=N/NC(=O)COc1ccccc1OC 1429043 APEHPELGECKIHC-VXLYETTFSA-N 393.237 2.995 50 40 GFGB COc1cccc(/C=C(/C#N)C(=O)NCc2ccccc2)c1O[C@@H](C)C(=O)O 409231150 HYLLAUCGHRQJPG-FMNVXAMXSA-N 380.400 2.770 50 40 GFGB COC(=O)c1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)cc1 409265149 NYRKZNKPFUBAIE-KCDOPAPYSA-N 393.443 2.593 50 40 GFGB COc1ccc(/C(C)=N/NC(=O)c2cc(OC)c(OC)c(OC)c2)c(OC)c1 5829431 LDWXVXWXDWINAQ-CIAFOILYSA-N 388.420 2.884 50 40 GFGB C#CCOc1c(Br)cc(/C=C(\C#N)C(=O)N2CCCC2)cc1OC 409370600 BPHGPJGRYCFTDT-NTEUORMPSA-N 389.249 2.999 50 40 GFGB O=C(CNc1ccccc1)N/N=C/c1cccc(I)c1 409379772 ZITPTUGVDXCPLZ-VCHYOVAHSA-N 379.201 2.853 50 40 GFGB COc1ccc(/C=C(\C#N)C(=O)N2CCCC2)cc1I 409367881 IXYPSJPIRMUORH-XYOKQWHBSA-N 382.201 2.829 50 40 GFGB CC(C)(C)NC[C@@H](O)Cn1cc(/C=N/NC(=O)c2ccncc2)c2ccccc21 95117207 AHWJNNWMRCVLHH-LLXCYVELSA-N 393.491 2.549 50 40 GFGB O=C(CSc1ccccc1F)NNC(=O)c1cncc(Br)c1 7652922 MADIUKULIHBJIX-UHFFFAOYSA-N 384.230 2.537 50 40 GFGB Cc1cc(C)c2cc(C(=O)NNC(=O)c3ccc4c(c3)OCCO4)[nH]c2c1C 32753456 ZBTMDCFGMLGYJI-UHFFFAOYSA-N 379.416 2.939 50 40 GFGB COc1cc(/C=N/NC(=O)c2cccnc2)c(Br)cc1OC(C)=O 408980340 VONXCQQINPXVEC-DJKKODMXSA-N 392.209 2.542 50 40 GFGB COc1cc(/C=C(/C#N)C(=O)NCCCc2ccccc2)cc([N+](=O)[O-])c1O 409237078 VVKCVALBHUNDJB-YBEGLDIGSA-N 381.388 2.965 50 40 GFGB COc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)cc1OC 2399223 TYPXYVAUIIVAPY-UXHMZNKVSA-N 395.459 2.824 50 40 GFGB C/C(=N\NC(=O)Cc1cccs1)c1ccc(S(=O)(=O)N2CCCC2)cc1 6507485 BGAQNRGYKZXEKA-XMHGGMMESA-N 391.518 2.616 50 40 GFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3ccc(F)cc3)CC2)cc1 409005434 IPAPFZLFHXHWDV-OEAKJJBVSA-N 383.423 2.837 50 40 GFGB Cc1ccc(NCC(=O)N/N=C/c2ccc(N3CCOCC3)c(F)c2)cc1C 409138292 ZQAKMURMWFVRBB-ZMOGYAJESA-N 384.455 2.841 50 40 GFGB CCOc1ccc2ccccc2c1/C=N/NC(=O)CNC(=O)c1ccccc1O 2269531 LPVFEYFDEWYJEI-ZMOGYAJESA-N 391.427 2.824 50 40 GFGB Cc1cc(C(=O)CCl)c(C)n1-c1cccc(S(=O)(=O)N2CCOCC2)c1 3249521 AQGQGXJINFPOMP-UHFFFAOYSA-N 396.896 2.537 50 40 GFGB CCCCc1[nH]nc2c1[C@H](c1cc(OC)c(OC)cc1OC)C(C#N)=C(N)O2 5045033 NXPYQZNVLLNCNW-QGZVFWFLSA-N 384.436 2.996 50 40 GFGB O=C(O)COc1ccc(/C=N/NC(=O)c2ccc(Br)cc2)cc1 6672568 OWNKSWUNDPVQMK-GIJQJNRQSA-N 377.194 2.676 50 40 GFGB Cc1cc(C)n2nc(SCC(=O)C(C#N)=C3Nc4ccccc4N3)nc2n1 7006870 MUIVEVVIRHJSTG-UHFFFAOYSA-N 377.433 2.675 50 40 GFGB O=C(NNS(=O)(=O)c1ccc2ccccc2c1)c1cc(Br)c[nH]1 7709587 YOSSZMVMAIWION-UHFFFAOYSA-N 394.250 2.554 50 40 GFGB COc1ccc(Br)cc1/C=N/NC(=O)C(=O)Nc1ccc(F)cc1 7784929 TYKKPNDPTATVMR-DJKKODMXSA-N 394.200 2.686 50 40 GFGB COC(=O)NNC(=O)c1nc(SCc2ccccc2)ncc1Br 11916286 ZQZFZTWJIIUGTF-UHFFFAOYSA-N 397.254 2.532 50 40 GFGB Cn1cc(C(=O)NNC(=O)NCCCN2CCc3ccccc32)c2ccccc21 12539293 XDWZMOZYRVHROB-UHFFFAOYSA-N 391.475 2.575 50 40 GFGB N#C/C(=C\c1ccc(-c2ccccc2Cl)o1)C(=O)NCCN1CCOCC1 26967787 XYFLSTKXCYEUBS-FYWRMAATSA-N 385.851 2.955 50 40 GFGB O=C(CSc1nnnn1-c1ccc(Cl)cc1)N/N=C\c1cccc(F)c1 33349016 WTIMDLGIPSCMDS-OCKHKDLRSA-N 390.831 2.697 50 40 GFGB Cc1nn(-c2ccccc2)c(O)c1/C(=N\NC(=O)c1ccncc1)C(F)(F)F 97601862 SJOCAGRNSBIIRD-HZHRSRAPSA-N 389.337 2.978 50 40 GFGB O=C(Cc1ccc(F)cc1)N/N=C\c1cc(Br)c(O)c([N+](=O)[O-])c1 409221182 MCXARHAKPUYKNI-LSCVHKIXSA-N 396.172 2.895 50 40 GFGB CCn1c(C)nc2cc(C(=O)NNC(=O)CCc3ccccc3OC)ccc21 2626943 QVMREGKZDWYPOT-UHFFFAOYSA-N 380.448 2.767 50 40 GFGB Cc1ccc(NC(=O)NNc2nc(N3CCCC3)nc(N3CCCC3)n2)cc1 39705509 XYUKSZOSLTXDLS-UHFFFAOYSA-N 382.472 2.529 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)O)cc2)cc(OC)c1OC 13338262 GWNQIWYUDPOLGM-RIYZIHGNSA-N 382.372 2.956 50 40 GFGB Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@H]1CC=CC[C@@H]1C(=O)O 13255502 IJOFUJDKSGANEQ-SNPRPXQTSA-N 394.855 2.539 50 40 GFGB C=CCN1C(=O)/C(=N/NC(=O)c2ccncc2)c2cc(Br)ccc21 13564112 KCHSYLMBZVTRBZ-HMMYKYKNSA-N 385.221 2.511 50 40 GFGB O=C(N/N=C/c1cc2c(cc1Br)OCO2)c1ccc([N+](=O)[O-])cc1 829895 IYRHPNJVRKJWCW-REZTVBANSA-N 392.165 2.850 50 40 GFGB Cc1c(C(=O)NNS(=O)(=O)c2ccc3ccccc3c2)cccc1[N+](=O)[O-] 5921573 UBDQVIHFJOSREN-UHFFFAOYSA-N 385.401 2.680 50 40 GFGB Cc1cc(OCC(=O)NNC(=O)[C@@H](C)Oc2ccccc2)cc(C)c1Cl 4957271 NSYGMRZGVPLRJW-CQSZACIVSA-N 376.840 2.951 50 40 GFGB CCOc1ccc([C@H]2CC(=O)NC(SCC(=O)N3CCCC3)=C2C#N)cc1 6355274 BFLOTYIOCQOBPM-MRXNPFEDSA-N 385.489 2.780 50 40 GFGB N#C/C(=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)C(=O)NC1CCCCC1 6815570 IXWSWWSTNUXEIR-VBKFSLOCSA-N 384.436 2.787 50 40 GFGB CC(C)CCOc1ccc(C(=O)NNS(=O)(=O)c2cccc(F)c2)cc1 7520291 LIZBETRAFZMEGG-UHFFFAOYSA-N 380.441 2.874 50 40 GFGB Cc1ccc(C(=O)NNC(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)c(C)c1 8706514 SVMOCNOLPQPUBT-UHFFFAOYSA-N 392.415 2.540 50 40 GFGB Cc1ccc(OCc2nnc(SCC(=O)NNC(=O)c3ccccc3)o2)cc1 10475590 LRGSEINCJGXJQP-UHFFFAOYSA-N 398.444 2.510 50 40 GFGB Cc1cc(C(F)F)nn1[C@@H](C)C(=O)N/N=C\c1ccn(CC(F)(F)F)n1 253406571 UTAKZABWYGVPKQ-IYBFXNGJSA-N 378.305 2.599 50 40 GFGB O=C(O)COc1ccc(/C=N/NC(=O)c2cccs2)cc1Br 1105898 RARNCGANNRAFLE-FRKPEAEDSA-N 383.223 2.738 50 40 GFGB CCCc1ccc(N2C[C@H](C(=O)NNC(=O)c3cc(C)oc3C)CC2=O)cc1 40068940 PFMRQUYMWCTWQM-MRXNPFEDSA-N 383.448 2.663 50 40 GFGB COc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cc2c(c([N+](=O)[O-])c1)OCCO2 85412797 QVYRQKKGHDPAFT-QGZVFWFLSA-N 381.344 2.593 50 40 GFGB Cc1nn(C)c(C)c1C#C/C(C(C#N)=C(C#N)C#N)=C(/C#N)c1c(C)nn(C)c1C 100567911 HNBYHRGERMIDCG-XUTLUUPISA-N 394.442 2.584 50 40 GFGB CCc1c(C(=O)NNc2nc(-c3ccncc3)no2)cnn1Cc1ccccc1 102787366 YDQPXGKQRLOZKR-UHFFFAOYSA-N 389.419 2.696 50 40 GFGB C[C@@H](c1ccccc1)N1C[C@@H](C(=O)NNC(=O)c2ccc(Cl)cc2)CC1=O 7882073 HTHOYYIZTMZUGO-BBRMVZONSA-N 385.851 2.711 50 40 GFGB CCN(CC)c1ccc(/C=N/NC(=O)c2sc3ncnc(N)c3c2C)c(O)c1 107756508 JXQHQRNPSCQAER-NUGSKGIGSA-N 398.492 2.898 50 40 GFGB CCOC(=O)[C@@H](CC)/C(C)=N/NC(=O)CCC(=O)Nc1ccc(OCC)cc1 13146029 HHRXRTVCQJQMFY-NIZGNDASSA-N 391.468 2.885 50 40 GFGB COC(=O)COc1ccccc1/C=C(/C#N)C(=O)NCCCc1ccccc1 409243268 RJTDEPXKPJUIMP-RGEXLXHISA-N 378.428 2.894 50 40 GFGB C[C@@H]1[C@H](OC(=O)CCC(=O)O)O[C@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@H]1[C@@]24OO3 254142619 FIHJKUPKCHIPAT-VQFGIQJOSA-N 384.425 2.602 50 40 GFGB CC(C)(C)OC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccoc3)[C@H]2C1 4149684 XKGMYZMREOPCPI-DLBZAZTESA-N 391.431 2.940 50 40 GFGB O=C1[C@H]2[C@@H]3C[C@@H]([C@@H](Br)[C@H]3Br)[C@@H]2C(=O)N1c1ccccc1 6096756 JNUMSHAQCAUPTM-XALSLBCYSA-N 399.082 2.969 50 40 GFGB O=C(CNc1ccc(Br)cc1)N/N=C/c1ccccc1[N+](=O)[O-] 103219430 IULNLQDYZOHSFU-GIJQJNRQSA-N 377.198 2.920 50 40 GFGB CN(C)c1ccc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc1Br 1100165 WOTCQSVLEJYWPO-MAUPQMMJSA-N 378.270 2.717 50 40 GFGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccc2c(c1[N+](=O)[O-])OCO2 1437164 VRAIGTCMFMCCRX-AWEZNQCLSA-N 383.360 2.774 50 40 GFGB C[C@@H]1C(C#N)=C(N)Oc2n[nH]c(-c3cccc(I)c3)c21 4730591 XWCIXYYXPQPYFF-SSDOTTSWSA-N 378.173 2.871 50 40 GFGB Cc1csc(CC(=O)NNC(=O)c2c[nH]c3ccc(Br)cc23)n1 8707592 UNDXZZOGIZTHCX-UHFFFAOYSA-N 393.266 2.699 50 40 GFGB COc1ccc(CCNC(=O)CC(=O)NN=C2CCCCCCC2)cc1OC 408972810 FXIBPOJGBJYLIE-UHFFFAOYSA-N 389.496 2.969 50 40 GFGB O=C(Cc1ccc2c(c1)OCCO2)N/N=C\c1cc(Br)ccc1O 409359281 BEFZVCAUWOIPGC-GRSHGNNSSA-N 391.221 2.619 50 40 GFGB CCOC(=O)c1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)n(CC)n1 253400267 KXZIEVRMUUQBJD-MRXNPFEDSA-N 384.436 2.531 50 40 GFGB COc1cc(C)ccc1C(=O)N/N=C/c1cccc(OC)c1O[C@H](C)C(=O)O 409225208 JVSPRGXXGZVRIA-SRRANQMSSA-N 386.404 2.628 50 40 GFGB COc1cc(/C=N/NC(=O)CNC2CCCCC2)cc(Br)c1OC 409375108 FRUWJXWJZFZGBC-KEBDBYFISA-N 398.301 2.839 50 40 GFGB Cc1cc2c(c(=O)n1CCN(C)C)[C@@H](c1ccccc1Cl)C(C#N)=C(N)O2 2253726 KUDRFKLMVUZVHN-KRWDZBQOSA-N 384.867 2.590 50 40 GFGB O=C(N/N=C/c1cc2c(cc1Br)OCO2)c1cccc([N+](=O)[O-])c1 5569058 UCQGFUPOPWKPNG-REZTVBANSA-N 392.165 2.850 50 40 GFGB N#C/C(C(N)=O)=C1\S[C@H](Cc2cccc([N+](=O)[O-])c2)C(=O)N1c1ccccc1 13647430 NHXJZDNNJZFJMI-ORMOWBNMSA-N 394.412 2.506 50 40 GFGB C/C(=N\NC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccc1F 24764155 RJYRMQJGUMXQBO-KGENOOAVSA-N 389.452 2.764 50 40 GFGB CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCC(=O)Nc1ccccc1C 98086501 MMQMCEHBOPXTEA-MHWRWJLKSA-N 379.416 2.804 50 40 GFGB Cc1cc(C(F)F)nn1[C@H](C)C(=O)N/N=C/c1ccn(CC(F)(F)F)n1 252502790 UTAKZABWYGVPKQ-JXVSOWSCSA-N 378.305 2.599 50 40 GFGB Cc1ccc(N2C[C@H](C(=O)N/N=C/c3ccc4c(c3)OCO4)CC2=O)cc1C 409156282 NPUDKARHQKAXIS-YJCKXXIQSA-N 379.416 2.535 50 40 GFGB COc1cc(/C(C)=N/NC(=O)Cn2nc(C)c(Br)c2C)ccc1O 1298342 JUSOJLIXDURCTK-GIJQJNRQSA-N 395.257 2.517 50 40 GFGB Cc1c(/C=N/NC(=O)CSc2ncccn2)c(Cl)nn1-c1ccccc1 4545238 BPSRFVMFILRUOK-UFFVCSGVSA-N 386.868 2.867 50 40 GFGB CC(C)(C)N(CCI)CCI 4963232 HOCFWQIDZJXVEA-UHFFFAOYSA-N 381.039 2.957 50 40 GFGB CCOC(=O)NNC(=O)c1cc(-c2ccccc2)c(N2CCOCC2)s1 21772357 KXCOAOUZTACSIQ-UHFFFAOYSA-N 375.450 2.643 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(I)cc2)ccc1O 10476108 RDICYDKTZLFIPN-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB COc1ccc(NC(=O)[C@H](C)SC2=C(C#N)C(C)(C)[C@@H](C#N)C(=O)N2)cc1 12622496 VYKGLLQMYWSPPX-FZMZJTMJSA-N 384.461 2.786 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)N[C@H](C)c2ccc(OC)cc2)cc1 59459672 ZUFZXNKTVQWEJD-QQHUYRGFSA-N 381.432 2.588 50 40 GFGB Cc1ccc(C(=O)/C=C(\O)C(=O)NNC(=O)c2cc(C)nc3ccccc23)cc1 100244528 XCHULDPNRNTZGX-NDENLUEZSA-N 389.411 2.937 50 40 GFGB Cc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccccc3Cl)CC2=O)cc1C 408616148 WNKJNTMZIMHVAF-CQSZACIVSA-N 385.851 2.771 50 40 GFGB Cc1cc(OCC(=O)NNC(=O)[C@H](C)Oc2ccccc2)cc(C)c1Cl 4957273 NSYGMRZGVPLRJW-AWEZNQCLSA-N 376.840 2.951 50 40 GFGB CCC[C@H](C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12)c1ccccc1 6454726 ABXQOQKJVVPOSX-INIZCTEOSA-N 392.459 2.761 50 40 GFGB CC(C)(C)c1n[nH]c2c1[C@H](c1cc3c(cc1[N+](=O)[O-])OCO3)C(C#N)=C(N)O2 5095141 NONGFUJVVQYFIB-CYBMUJFWSA-N 383.364 2.562 50 40 GFGB CCOc1ccc(/C=N\NC(=O)Cc2ccc3c(c2)OCCO3)c(OCC)c1 409359765 BWFKKIBCZICENZ-HMAPJEAMSA-N 384.432 2.948 50 40 GFGB COc1ccc(/C=C(/C#N)C(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc1O 16693360 SZTMPYCLETYYKL-WQLSENKSSA-N 397.456 2.986 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1cc2c(cc1C)OCO2 408907940 QLCVNRWIJSXHSM-QQZPLFJDSA-N 397.431 2.531 50 40 GFGB Nc1nonc1C(=O)N/N=C/c1cc(C23CC4CC(CC(C4)C2)C3)ccc1O 5890815 HWKWMZQVNCGWRM-LSHDLFTRSA-N 381.436 2.589 50 40 GFGB COc1cc(C(=O)NNC(=O)CNc2ccccc2)ccc1OCCC(C)C 32879972 GTNWGBLTYRQWDR-UHFFFAOYSA-N 385.464 2.993 50 40 GFGB Cc1oc(-n2c(C)cc(/C=N/NC(=O)CC3(C)OCCO3)c2C)c(C#N)c1C 6456304 VJLQHCXLXJXNSV-SSDVNMTOSA-N 384.436 2.779 50 40 GFGB COc1ccccc1NC(=O)C/C(C)=N/NC(=O)c1ccc(OC)c(OC)c1 18143984 QEKRYHBLPSGVJF-LPYMAVHISA-N 385.420 2.847 50 40 GFGB COc1cc(OC)c(/C=N/NC(=O)c2ccc(Br)o2)c(OC)c1 655016 XTNVYACQOFUTNH-CAOOACKPSA-N 383.198 2.832 50 40 GFGB COc1ccccc1C(=O)NNC(=O)COc1ccc(Br)cc1C 832004 MMJKGIROJAHGQV-UHFFFAOYSA-N 393.237 2.606 50 40 GFGB Cc1c(Cl)ccc(OCC(=O)NNC(=O)c2ccccc2[N+](=O)[O-])c1C 8535923 OFEPPMFQKTVZRQ-UHFFFAOYSA-N 377.784 2.705 50 40 GFGB CCOc1ccc(/C=N\NC(=O)[C@@H]2CC(=O)N(c3ccc(OC)cc3)C2)cc1 409167984 KNQOYSCILMSCRY-NXUSMQHESA-N 381.432 2.597 50 40 GFGB COc1cccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)c1O 409153377 HWDGMJGQDQTWHF-CNPYVQQSSA-N 381.432 2.521 50 40 GFGB COc1cccc(C(=O)N2CCC(C(=O)N/N=C/c3ccc(F)cc3)CC2)c1 409005342 HVKUHBSUFULXMK-OEAKJJBVSA-N 383.423 2.837 50 40 GFGB C[C@H](S[C@@H](C)C(=O)N/N=C/c1ccccc1)C(=O)N/N=C\c1ccccc1 38798918 FPCODJQCYPMUTI-CKDGUWKISA-N 382.489 2.797 50 40 GFGB O[C@@]12[C@@H](Br)[C@H]3[C@H]4[C@@H]1C(Br)(Br)[C@H]1[C@@H]4C[C@@H]3[C@H]12 195528763 WZBOKYFPZUQGLI-RAWWRJLWSA-N 398.920 2.739 50 40 GFGB O=C(COC(=O)Cc1ccc(Cl)cc1)NNC(=O)c1ccc(Cl)cc1 5613171 OGFHQTCEKXKHIQ-UHFFFAOYSA-N 381.215 2.540 50 40 GFGB O=C(CNC(=O)c1ccc(Cl)cc1)N/N=C\c1ccc(Cl)c([N+](=O)[O-])c1 33591935 MGGPYZIBSFVAMA-ZBKNUEDVSA-N 395.202 2.782 50 40 GFGB COc1ccccc1NS(=O)(=O)c1cccc(NC(=O)NCCCl)c1 4865370 CZCGMVZCHZYMQN-UHFFFAOYSA-N 383.857 2.856 50 40 GFGB CNC(=O)OCc1nc(SSC(C)(C)C)n(C)c1COC(=O)NC 13215251 JYWQNPPIDJENSS-UHFFFAOYSA-N 376.504 2.671 50 40 GFGB O=C(N/N=C\c1sc(=O)[nH]c1-[n+]1ccc2ccccc2c1)c1ccccc1 15895141 ZYORMRBBKNMWHI-UHFFFAOYSA-O 375.433 2.630 50 40 GFGB O=C(CN1CCOCC1)NNc1nc(-c2ccccc2)c2cc(Cl)ccc2n1 19537060 OIUGHXCVYFFEGD-UHFFFAOYSA-N 397.866 2.726 50 40 GFGB C/C(CC(=O)Nc1ccccn1)=N\NC(=O)c1ccc([N+](=O)[O-])cc1Cl 100510139 QPTOHZMSUVPZIR-KEBDBYFISA-N 375.772 2.778 50 40 GFGB CCn1c(SCC(=O)N/N=C/c2ccccc2C(=O)O)nc2ccccc21 4951498 GTZLYWYNCIAMSX-RGVLZGJSSA-N 382.445 2.997 50 40 GFGB O=C(Cc1ccc(Cl)cc1)N/N=C\C=N\NC(=O)Cc1ccc(Cl)cc1 12362731 QGSNAMLNLXHCLV-CHQRTDLRSA-N 391.258 2.983 50 40 GFGB C/C(=N\NC(=O)[C@@H](C)N(c1ccccc1)S(C)(=O)=O)c1ccc(F)cc1 408921541 IUMCMIZUDRYECY-GNUZOCDUSA-N 377.441 2.521 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(N(C)C)cc1 408906512 CDXABWCYESNLEB-QTCOBDOFSA-N 382.464 2.560 50 40 GFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1cc(C(=O)O)ccc1Nc1ccccc1C 408709312 ZICBRVGCIOOLFC-LVCXCXRVSA-N 396.447 2.802 50 40 GFGB CCCCC(=O)Nc1nnc(CC(=O)N/N=C/c2c[nH]c3ccccc23)s1 408732566 WZUJTXIGPIPULL-RGVLZGJSSA-N 384.465 2.841 50 40 GFGB NNC(=O)c1ccc(OCc2cccc(F)c2)c(I)c1 216820563 HZGSWKHXTBPVJY-UHFFFAOYSA-N 386.164 2.613 50 40 GFGB O=C1NC[C@@H](c2ccccc2)[C@@H]1C(=O)N/N=C/c1c(Cl)cccc1Cl 676995 UDIGMDRWTCTARS-QTEQDDJKSA-N 376.243 2.973 50 40 GFGB Cc1cc2c(c(=O)n1CCO)[C@@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 4851030 ZJGBIECVWSGTFB-HNNXBMFYSA-N 392.242 2.674 50 40 GFGB COc1cccc(C(=O)NNC(=O)c2cccc(NC(=O)c3ccco3)c2)c1 8167121 WVHHAARPLJWBFJ-UHFFFAOYSA-N 379.372 2.615 50 40 GFGB O=C(COc1ccc2ccccc2c1)NNC(=O)c1cc(Br)c[nH]1 8122955 WAXGWFOCYIFUAR-UHFFFAOYSA-N 388.221 2.770 50 40 GFGB COc1cccc(/C=N/NC(=O)c2ccn(Cc3ccc([N+](=O)[O-])cc3)n2)c1 1086955 CHSANGFWXQFSRO-UDWIEESQSA-N 379.376 2.612 50 40 GFGB C[C@H](C(=O)N/N=C\c1ccc(O)cc1)n1cnc2sc3c(c2c1=O)CCCC3 31858942 XWHZHJCHRGAUQR-SKKJWADRSA-N 396.472 2.754 50 40 GFGB N#CCn1cc(/C=N\NC(=O)COc2ccccc2[N+](=O)[O-])c2ccccc21 109044910 UXTOKHJVYHXJOX-NHDPSOOVSA-N 377.360 2.602 50 40 GFGB COc1ccc(-n2c(C)cc(/C=N\NC(=O)CC(=O)NCC(C)C)c2C)cc1 58913914 XLMFOWOJCATGTF-QRVIBDJDSA-N 384.480 2.715 50 40 GFGB CC(C)NC(=O)/C(C#N)=C/c1ccc(OCC(=O)NCc2ccccc2)cc1 408804559 YJRUGLWPYVSLLH-XDHOZWIPSA-N 377.444 2.813 50 40 GFGB COC(=O)COc1c(Cl)cc(/C=N/NC(=O)c2cccs2)cc1OC 1102796 PGIBSAVLKVXDMO-QGMBQPNBSA-N 382.825 2.726 50 40 GFGB C/C(N)=C(\C#N)C(=O)CSc1n[nH]c(-c2ccccc2Br)n1 5266922 ACXYOHYVHBUFKC-NTMALXAHSA-N 378.255 2.652 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(OCC)cc2)cc1OC 3067328 AJVHKTQQGCUODK-HYARGMPZSA-N 397.431 2.748 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C\N2CCN(c3ccccc3)CC2)cc1 100676499 KIUTYPYNQRITOI-ZPHPHTNESA-N 376.460 2.541 50 40 GFGB COc1ccc(C[C@@H](N)C(=O)OC(C)C)cc1N(CCCl)CCCl 1707262 UJNIZMPXDXHTKJ-CQSZACIVSA-N 377.312 2.801 50 40 GFGB COC(=O)COc1ccc(/C=N/NC(=O)CSCc2ccc(C)cc2)cc1 59473524 GNUFDVYOTYPVTJ-SRZZPIQSSA-N 386.473 2.930 50 40 GFGB O=C(N/N=C/c1ccc(O)cc1)c1nn(Cc2ccccc2)c(=O)c2ccccc12 3247539 OGNXVTMYMXAABE-ZVHZXABRSA-N 398.422 2.914 50 40 GFGB CC(C)c1ccccc1N1/C(=N\C(=O)CCl)S[C@H]2CS(=O)(=O)C[C@@H]21 101316734 YDWLWZPHMIKNSQ-HJUNTIBCSA-N 386.926 2.650 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)NC2CCCCCC2)ccc1OCC(N)=O 2768571 XWMGKPYASYGGPE-LFIBNONCSA-N 385.464 2.695 50 40 GFGB O=C(/C=C/c1ccc(Cl)c(Cl)c1)NNC(=O)[C@@H]1COc2ccccc2O1 12771585 UVMLNJAWIDSEIB-BVBGJJFLSA-N 393.226 2.994 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)CCCC(=O)NC2CCCCC2)c1 4492048 BESQEBDGQMWFQN-KGENOOAVSA-N 375.469 2.773 50 40 GFGB COCCN1C(N)=C(C#N)[C@@H](c2ccc3c(c2)OCO3)C2=C1CC(C)(C)CC2=O 409128722 KSQQGVGKFNDMIV-LJQANCHMSA-N 395.459 2.798 50 40 GFGB O=C(CN(c1ccccc1)S(=O)(=O)c1ccccc1)N/N=C/c1ccco1 4714244 JYPCSUUBFJWTEY-XSFVSMFZSA-N 383.429 2.625 50 40 GFGB COc1cccc(/C=N/NC(=O)CCC(=O)Nc2cccc(Cl)c2)c1O 2100983 COMXCKBHYBUTJJ-RGVLZGJSSA-N 375.812 2.923 50 40 GFGB Cc1cc(C)nc(NNC(=O)C2CCN(c3ccc(C(F)(F)F)cn3)CC2)n1 29066250 XNWATOBYUPVGBM-UHFFFAOYSA-N 394.401 2.867 50 40 GFGB Cn1c(=O)n(C)c2cc(/C=C(\C#N)S(=O)(=O)c3ccc(Cl)cc3)ccc21 12390312 JDKIEZRBKWIKSL-OQLLNIDSSA-N 387.848 2.869 50 40 GFGB CCN(CC)S(=O)(=O)c1cccc(C(=O)N/N=C(\C)c2ccc(C#N)cc2)c1 5415488 IROYCDYRKQXMFT-PXLXIMEGSA-N 398.488 2.743 50 40 GFGB C/C(=N\NC(=O)CN1CCN(Cc2ccccc2)CC1)c1ccccc1Cl 22860237 DJSXLILFVKSYBP-HAVVHWLPSA-N 384.911 2.998 50 40 GFGB CCOc1ccccc1NC(=O)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@H]2Br 408689144 XRTBCIFPTLVWJL-IGYYUICOSA-N 380.238 2.595 50 40 GFGB CNS(=O)(=O)c1ccc(C(=O)NNc2c(Cl)cc(Cl)cc2Cl)o1 31548840 YLPVIXAZVINKSP-UHFFFAOYSA-N 398.655 2.905 50 40 GFGB C[C@@H]1CCC[C@@H](NC(=O)CCC(=O)NNC(=O)Cn2ccc3ccccc32)[C@@H]1C 4676731 ZILMRPFOIUHSHP-JFIYKMOQSA-N 398.507 2.510 50 40 GFGB CCOc1cc(/C=N/NC(N)=O)ccc1OCC(=O)Nc1ccc(C)c(C)c1 694314 YGNMBGYGJQQXJF-SSDVNMTOSA-N 384.436 2.722 50 40 GFGB O=C(CC(=O)N/N=C/c1ccc2c(c1)CCC2)N/N=C/c1ccc2c(c1)CCC2 1709565 JIZLYCTYDDBFHB-KOJZRSEWSA-N 388.471 2.655 50 40 GFGB COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(OC(F)(F)F)cc2)c1 2616756 SUKSOVPTWQQNLD-UHFFFAOYSA-N 384.310 2.677 50 40 GFGB O=C(CSc1ccccc1F)N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2 6945587 YZIJTEUZEKNLQT-CNHKJKLMSA-N 377.353 2.705 50 40 GFGB COC(=O)c1ccc(/C=N/NC(=O)c2cc(Br)ccc2O)cc1 59372182 SDBOFHFOFWUJQU-GIJQJNRQSA-N 377.194 2.705 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)NCCc2ccccc2)ccc1OCC(=O)O 408812051 LBBNNZSBTZFPER-LDADJPATSA-N 394.427 2.815 50 40 GFGB O=C(Cc1ccccc1)N/N=C/c1ccc(OCC(=O)N2CCCCC2)cc1 408827382 JBHBOHMPYKFQST-XQNSMLJCSA-N 379.460 2.771 50 40 GFGB Cc1cccc(Br)c1NNC(=O)Cn1ncc(=O)c2ccccc21 1165372496 NCRGWPPZHJNFAP-UHFFFAOYSA-N 387.237 2.611 50 40 GFGB Cc1ccsc1/C=N/NC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1 6868664 QDOSXGLACYZARF-CPNJWEJPSA-N 391.518 2.608 50 40 GFGB O=S(=O)(Nc1ccc(-n2cncn2)nc1)c1ccc(CCCCl)cc1 58246016 ONCJUONCVPEMSQ-UHFFFAOYSA-N 377.857 2.635 50 40 GFGB C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=S)NC(=O)c1ccco1 2751868 QKKQANBQYRPLBU-LBPRGKRZSA-N 383.429 2.536 50 40 GFGB O=C(NNC(=O)c1ccccc1O)c1ccc(NC(=O)c2cccs2)cc1 17575081 SBGWOVPTKWAAKC-UHFFFAOYSA-N 381.413 2.781 50 40 GFGB Cc1ccc(S(=O)(=O)N[C@@H](C(=O)N/N=C/c2ccccc2C)C(C)C)cc1 408758958 VNLMMXZDMNBEAC-DBRLUCFCSA-N 387.505 2.757 50 40 GFGB NNC(=O)c1ccc2oc(-c3ccc(I)cc3)nc2c1 226317482 NLLGSWFRFOWVDM-UHFFFAOYSA-N 379.157 2.703 50 40 GFGB CCCCn1nc(C(=O)N/N=C/c2ccc(C(=O)O)cc2)c2ccccc2c1=O 6790253 USTPXHCLJIKXKJ-LPYMAVHISA-N 392.415 2.659 50 40 GFGB Cc1ccccc1/C=N/NC(=O)Cc1nnc(NC(=O)c2ccccc2)s1 9008028 VEPWWIWVPQFKQI-UDWIEESQSA-N 379.445 2.792 50 40 GFGB CCOC(=O)Cn1cc(/C=N/NC(=O)c2cccc(OC)c2)c2ccccc21 14134350 CSUMTMIJJMQRCN-WSDLNYQXSA-N 379.416 2.977 50 40 GFGB N#CC(C#N)=C1C(=O)N(CN2CCN(Cc3ccccc3)CC2)c2ccccc21 19991260 NAZHWFOGGLGFIS-UHFFFAOYSA-N 383.455 2.609 50 40 GFGB N#C/C(=C\N1CCN(Cc2ccc3c(c2)OCO3)CC1)C(=O)Nc1ccccc1 20403630 HUFXYOPIFYBPLH-OBGWFSINSA-N 390.443 2.579 50 40 GFGB N#C/C(=C\c1ccc(Br)c([N+](=O)[O-])c1)C(=O)NC[C@@H]1CCCO1 32787542 RGVASSPDEDYTGG-BCMYLCSRSA-N 380.198 2.559 50 40 GFGB O=C(N/N=C/c1ccccc1)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 408846887 LKBSAQREFLWEKG-NNIWKIFQSA-N 391.880 2.643 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cccc(F)c3)[C@H]2C1 803613 ORLOEAOYVWVBMJ-ROUUACIJSA-N 391.406 2.708 50 40 GFGB COC(=O)CSC1=C(C#N)[C@@H](c2ccc(Br)cc2)CC(=O)N1 2196749 VSOFQKLZZVUXER-LLVKDONJSA-N 381.251 2.694 50 40 GFGB Nc1nc(Cl)cc(NNC(=O)Nc2cnn(Cc3ccc(Cl)cc3)c2)n1 97164730 BTLFSTVEXDBDCH-UHFFFAOYSA-N 393.238 2.759 50 40 GFGB Cc1ccc(CN2CCN(CC(=O)N/N=C/c3c[nH]c4ccccc34)CC2)cc1 19367346 HRXSJMDTKSTSCX-MFKUBSTISA-N 389.503 2.744 50 40 GFGB COC(=O)[C@@H]1N(S(=O)(=O)c2ccc(C)cc2)C(C(Cl)Cl)=NC1(C)C 68571825 CAMPTDDVOBXURK-NSHDSACASA-N 393.292 2.522 50 40 GFGB biogenic O=C(CNc1cccc([N+](=O)[O-])c1)N/N=C/c1cc([N+](=O)[O-])ccc1Cl 2143940 JFWRYQYCPZNMDT-QGMBQPNBSA-N 377.744 2.719 50 40 GFGB O[C@@]12[C@@H]3[C@@H]4[C@@H]5C[C@H]([C@@H]4[C@H]1Br)[C@@H]2[C@@H]5C3(Br)Br 100938852 WZBOKYFPZUQGLI-BBWONXNDSA-N 398.920 2.739 50 40 GFGB COc1cc(N2CCCC2)ccc1/C=N/NC(=O)CSc1nc(C)cc(C)n1 4678098 KTBXBEAENFEBDE-CIAFOILYSA-N 399.520 2.945 50 40 GFGB CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCC(=O)c2cccs2)cc1 8208683 KOQDITIDPLHXJS-ZDUSSCGKSA-N 390.461 2.725 50 40 GFGB Cc1cccc[n+]1[C@@H]1[C@H](c2ccccc2)C(C#N)=C([C-](C#N)C#N)N[C@@]1(O)C1CC1 169303339 BHQKVVGNCAIGEQ-GMKZXUHWSA-N 395.466 2.709 50 40 GFGB COc1ccc(/C=N/NC(=O)c2ccc(C)nc2)cc1I 1427499 AVYMGWQWWCSFPF-QGMBQPNBSA-N 395.200 2.767 50 40 GFGB CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(COC)c32)cc1OCC 6162520 DRIQEKAGNZPFGC-QGZVFWFLSA-N 384.436 2.962 50 40 GFGB COC(=O)[C@H]1CCC(=O)N1/C(C)=N/NC(=O)Nc1ccc(Cl)c(Cl)c1 16957369 MZAIMLDRPPQLPG-OZOTYFBYSA-N 387.223 2.612 50 40 GFGB COc1cc([C@H]2C(C#N)=C(N)N(N(C)C)C3=C2C(=O)CC(C)(C)C3)ccc1O 1440867 WNULWQDVXSBGLN-SFHVURJKSA-N 382.464 2.614 50 40 GFGB O=C(N/N=C/c1ccc(O)c([N+](=O)[O-])c1)C(O)(c1ccccc1)c1ccccc1 36136648 FALGCSABVTVDDN-HYARGMPZSA-N 391.383 2.687 50 40 GFGB CC[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1 7428732 ZURFWLPVUUPTPG-GFCCVEGCSA-N 376.434 2.552 50 40 GFGB COc1cc(/C=N/NC(=O)CNc2ccc(C)c(C)c2)ccc1O[C@H](C)C(=O)O 409012764 KLRYCCVQCFALRK-QHBIDGPYSA-N 399.447 2.726 50 40 GFGB Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2ccc3nc4n(c3c2)CCC4)c1C 40119052 ZVDLILVPESUCMM-HNNXBMFYSA-N 392.459 2.828 50 40 GFGB CN(CC(=O)N/N=C/c1ccc(C(C)(C)C)cc1)S(=O)(=O)c1ccccc1 6313507 NEOYMHAKJAXLPG-KGENOOAVSA-N 387.505 2.755 50 40 GFGB O=C(CCNC(=O)c1ccccc1Cl)NNC(=O)c1cccc(Cl)c1 3451310 SFTHMLHEKSGVKF-UHFFFAOYSA-N 380.231 2.575 50 40 GFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1)c1ccccc1Cl 47080857 WPMZYMJTHSYFKE-LLVKDONJSA-N 392.242 2.808 50 40 GFGB COCCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1Nc1ccc(C)cc1 408708786 SSFWKFPLUPXPLY-WSDLNYQXSA-N 388.855 2.605 50 40 GFGB Cc1ccc(-n2ncc(C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)c2C)cc1 12864399 GIBBEWNMIHEIOV-HNNXBMFYSA-N 396.422 2.857 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C\c2ccc(OC(C)=O)c(OC)c2)cc1 408817155 VFNGGECJMVRFBN-YVLHZVERSA-N 380.400 2.852 50 40 GFGB C[C@H](c1ccccc1)N1C[C@@H](C(=O)NNC(=O)c2ccccc2Cl)CC1=O 7882210 SRGBESVPXQQIAY-HIFRSBDPSA-N 385.851 2.711 50 40 GFGB O=C(/C=C/c1ccc2c(c1)OCO2)NNC(=O)COc1ccc2ccccc2c1 32848596 KDDMFPGFVGVEFD-UXBLZVDNSA-N 390.395 2.808 50 40 GFGB Cc1cccc(C(=O)NNC(=O)CCCCCN2C(=O)c3ccccc3C2=O)c1 1750067 PCWWWJZZNWWQJX-UHFFFAOYSA-N 393.443 2.613 50 40 GFGB C[C@H](Oc1ccccc1)C(=O)N/N=C1/C(=O)Nc2ccc(Br)cc21 13637806 MDMALPCKDMYLEP-JTQLQIEISA-N 388.221 2.689 50 40 GFGB COc1ccc(/C=C(\C#N)C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCO3)cc1O 7007113 CWWMESKLPXJRDM-WUXMJOGZSA-N 397.343 2.626 50 40 GFGB CCOC(=O)COc1ccc(/C=N/NC(=O)CC2(C)SCCS2)cc1 409265148 SLALDYJGBPGYHH-WOJGMQOQSA-N 382.507 2.665 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(O)cc2)ccc1OC(=O)c1ccco1 3526257 OZLPYMGZOHNQLI-CIAFOILYSA-N 380.356 2.977 50 40 GFGB O=C(Cn1c(C(F)(F)F)nc2ccccc21)N/N=C1\C(=O)Nc2ccccc21 2632084 FGLSLUWUKSVZFP-UHFFFAOYSA-N 387.321 2.528 50 40 GFGB Cc1cc(-c2ccccc2)nc(N(C)NC(=O)C(C)(C)C)c1S(C)(=O)=O 1404884 BNWPELOTHLDVSS-UHFFFAOYSA-N 375.494 2.974 50 40 GFGB Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCl)[C@H]2c2ccccc2)cc1 4778635 BRZPAJKUGAZGJE-GOSISDBHSA-N 378.881 2.766 50 40 GFGB CCc1sc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3ccoc3)C2)cc1C 28419348 MSROVOLAERJHAE-CYBMUJFWSA-N 389.477 2.525 50 40 GFGB COc1cc2ccccc2cc1C(=O)NC(=S)NNC(=O)c1cccs1 6646167 BSGGXRXIYCXTHY-UHFFFAOYSA-N 385.470 2.859 50 40 GFGB CCNC(=O)/C(C#N)=C/c1c(Oc2ccccc2OC)nc2ccccn2c1=O 2400633 VAPKUFDBIDZRDL-WYMLVPIESA-N 390.399 2.538 50 40 GFGB C=CCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2ccc(OCC)cc2)c1C 58913950 RJJBYLCTBYKFGH-UCQKPKSFSA-N 382.464 2.635 50 40 GFGB Cc1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1 7383448 ZNQKYZLLYJQPBS-HNNXBMFYSA-N 384.457 2.925 50 40 GFGB COc1ccc(C(=O)N/N=C2/C(=O)N(CC(C)C)c3ccccc32)cc1OC 8102862 VPWWYOGHURAUOW-ZBJSNUHESA-N 381.432 2.841 50 40 GFGB Cc1noc(C)c1CSCC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2 95349020 XLFXBAZXXJNJRO-UHFFFAOYSA-N 377.510 2.888 50 40 GFGB O=C(N/N=C/c1cc(Br)c(O)cc1O)c1cccc([N+](=O)[O-])c1 5569057 GTKVSQWVJFFMEE-FRKPEAEDSA-N 380.154 2.532 50 40 GFGB COC(=O)c1ccc(C(=O)OC)c(NC(=O)/C(C#N)=C\c2ccc(OC)cc2)c1 3169225 MLDDBPAPHPAYOU-GDNBJRDFSA-N 394.383 2.814 50 40 GFGB O=C1C(CBr)=C(CBr)C(=O)c2c(O)ccc(O)c21 104170027 RTGFQJMXHYNOEX-UHFFFAOYSA-N 376.000 2.563 50 40 GFGB O=C(CCCCl)NC(=S)Nc1ccc(I)cn1 2228977 FUUAFORXDJDNTG-UHFFFAOYSA-N 383.642 2.518 50 40 GFGB Cc1ccc(OCC(=O)N/N=C\c2ccc(Br)o2)c([N+](=O)[O-])c1 6029241 HXJBVCYRAKXIHD-APSNUPSMSA-N 382.170 2.788 50 40 GFGB O=C(NNC(=O)c1nn(-c2ccc(F)cc2)c2c1CCCC2)c1ccccc1 14213138 YTUITKCDNYRLRC-UHFFFAOYSA-N 378.407 2.965 50 40 GFGB COc1ccccc1NC(=O)[C@@H](C)SC1=C(C#N)C(C)(C)[C@@H](C#N)C(=O)N1 7252371 VDEAEJBZEGNKAM-NEPJUHHUSA-N 384.461 2.786 50 40 GFGB COc1cc(/C=N/NC(=O)C(=O)NC2CCCC2)ccc1OCc1ccccc1 408972220 NSRXALFFQHUNNB-OEAKJJBVSA-N 395.459 2.783 50 40 GFGB O=C(OC(=O)[C@@H](Br)C(F)(F)F)[C@H](Br)C(F)(F)F 885164273 ZVCBCAPTWMUSNK-XIXRPRMCSA-N 395.875 2.708 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(F)cc3)[C@H]2C1 803615 IKNJFPNMQLFUEI-ZWKOTPCHSA-N 391.406 2.708 50 40 GFGB Cn1cnnc1SCc1ccc(C(=O)N/N=C/c2ccc(C(=O)O)cc2)cc1 3238468 ASIOOMCDKCVEGF-KEBDBYFISA-N 395.444 2.570 50 40 GFGB CC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2ccc(Br)cc2)c1C 3451971 XOEZKVKESGZAIE-UHFFFAOYSA-N 378.226 2.671 50 40 GFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(N(C)C)cc1 4414053 JWMYFTRLTFAPSP-MRXNPFEDSA-N 383.477 2.701 50 40 GFGB O=C(CCC(=O)N(c1ccccc1)c1ccccc1)NNC(=O)c1ccncc1 4700269 KJMUYQNVAGGVQW-UHFFFAOYSA-N 388.427 2.988 50 40 GFGB CCCc1ccc(N2C[C@@H](C(=O)NNC(=O)c3cc(C)oc3C)CC2=O)cc1 40068941 PFMRQUYMWCTWQM-INIZCTEOSA-N 383.448 2.663 50 40 GFGB COc1ccc(CNC(=O)C/C(C)=N/NC(=O)c2ccc(OC)c(OC)c2)cc1 100522602 LEINAWSBUNOKFG-OEAKJJBVSA-N 399.447 2.525 50 40 GFGB CCOc1ccc(N(CC(=O)NN=C2CCCCCC2)S(C)(=O)=O)cc1 408724736 AFVYONJAYYDCLY-UHFFFAOYSA-N 381.498 2.678 50 40 GFGB Cc1cc2c(c(=O)n1C[C@H]1CCCO1)[C@H](c1ccc(F)cc1)C(C#N)=C(N)O2 4247922 GBURLUKJKGSRCD-CRAIPNDOSA-N 381.407 2.693 50 40 GFGB Cc1ccccc1NCC(=O)N/N=C1\C(=O)N(CCCC#N)c2ccccc21 5804321 WJVSQCOTMRNIIX-QQTULTPQSA-N 375.432 2.578 50 40 GFGB O=C(CN1CCOCC1)N/N=C/c1ccc(Sc2ccc(Cl)cc2)o1 409186974 KJQBAZMENNZISW-YBFXNURJSA-N 379.869 2.867 50 40 GFGB CCN(CC)c1ccc(/C=N/NC(=O)Cn2cc(C(F)(F)F)ccc2=O)cc1 3187772 YLOQHBFYIUPGEF-FOKLQQMPSA-N 394.397 2.864 50 40 GFGB O=C1N(CN2CCc3ccccc3C2)c2ccccc2[C@]12OC[C@H](CCl)O2 19831101 XEDFTGXKVQWEPB-LAUBAEHRSA-N 384.863 2.856 50 40 GFGB COc1ccc(O)c(/C=N/NC(=O)c2ccc(I)cc2)c1 10476075 XQIHQTJFQKGOKM-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB COc1ccc(F)c([C@@H]2[C@@H]3CN(C(C)C)CC=C3C(C#N)=C(N)C2(C#N)C#N)c1 16037555 OSPJDKSVHFHVON-UYAOXDASSA-N 391.450 2.968 50 40 GFGB Cc1cccc(NCC(=O)N/N=C2/C(=O)Nc3ccc(Br)cc32)c1 18155585 ZJUWGKAVHCTVFE-UHFFFAOYSA-N 387.237 2.642 50 40 GFGB O=C(NCc1ccco1)C(=O)N/N=C/c1cccc(OCc2ccc(F)cc2)c1 408606781 AYMSDFDAVWULIZ-WYMPLXKRSA-N 395.390 2.764 50 40 GFGB C#CCOc1c(Cl)cc(/C=N/NC(=O)[C@@H](O)c2ccccc2)cc1OCC 409256194 KDHWKRDACOPCJG-ZFJBLLOBSA-N 386.835 2.934 50 40 GFGB CCn1c(C)nc2cc(C(=O)NNS(=O)(=O)c3ccc(C)cc3C)ccc21 3299696 RPJOCLPQBNTYNV-UHFFFAOYSA-N 386.477 2.605 50 40 GFGB CCCNC(=O)CSC1=C(C#N)[C@H](c2ccc(OC)c(Cl)c2)CC(=O)N1 6324045 HFUKPPHGQRIPEL-LBPRGKRZSA-N 393.896 2.947 50 40 GFGB CO/N=C(/C(=O)N/N=C/c1ccc(SC)cc1)c1csc(NC(C)=O)c1 8782797 LSDJHSRTGCPFOJ-IHIAXYNZSA-N 390.490 2.929 50 40 GFGB O=C(O)CCCC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl 12137217 BBRYHKIZUUAUDL-UHFFFAOYSA-N 377.224 2.555 50 40 GFGB O=C(NNS(=O)(=O)c1ccc(F)cc1F)c1cc2c(s1)CCCCC2 14196712 NJDDCJQWVLWMRR-UHFFFAOYSA-N 386.445 2.919 50 40 GFGB COC(=O)[C@@H]1/C(=N/NC(=O)c2ccccc2O)C[C@@](C)(O)C[C@H]1c1ccccc1 104505551 JPQOGYMVEBZUHB-GRLQUFFESA-N 396.443 2.596 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1c[nH]c2ccccc12 408914830 XYNFKGPWLLVFCB-IXOWOOARSA-N 378.432 2.975 50 40 GFGB CCNC(=O)C(=O)N/N=C/c1ccc(OCc2c(F)cccc2Cl)cc1 408998611 BMPQROXVLLHQPZ-LSHDLFTRSA-N 377.803 2.644 50 40 GFGB O=C(O)COc1ccc(/C=N/NC(=O)CNc2cccc3ccccc23)cc1 409393731 ZOKMXLAMIMUMGU-FSJBWODESA-N 377.400 2.865 50 40 GFGB COc1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1OC 108206492 XHJHQNMUDOGLHH-JXAWBTAJSA-N 377.444 2.960 50 40 GFGB COc1ccc(OCc2ccc(C(=O)NNC(=S)NCC(C)C)o2)cc1 2794336 LJIIXZCOGVMWSL-UHFFFAOYSA-N 377.466 2.632 50 40 GFGB COc1ccc(C)cc1NC(=O)C(=O)N/N=C/c1ccc(Br)cc1 59433944 VTXWQVGCEPMUJB-VXLYETTFSA-N 390.237 2.855 50 40 GFGB COc1ccc(C(=O)NNC(=O)CSc2ccc(Cl)cc2)c(OC)c1 12821396 MQQPSCDJSOSGCP-UHFFFAOYSA-N 380.853 2.911 50 40 GFGB COc1cc(/C=N/NC(=O)c2cc3cccc(OC)c3o2)ccc1OCC(=O)O 4739966 PMXXQGPINNGPRR-UFFVCSGVSA-N 398.371 2.677 50 40 GFGB Cc1cc(C)cc(N2C[C@@H](C(=O)NNC(=O)c3ccccc3Cl)CC2=O)c1 408642076 NRMOYXHMGHTZGE-AWEZNQCLSA-N 385.851 2.771 50 40 GFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1cccc(OC)c1O)c1ccccc1 408981719 WJKKVJMJCFOFCJ-REIAIGDLSA-N 385.420 2.728 50 40 GFGB COc1ccc2oc(=O)c(/C(C)=N/NC(=O)c3ccc([N+](=O)[O-])cc3)cc2c1 4738015 LQGWENFBLYUUJF-RGVLZGJSSA-N 381.344 2.864 50 40 GFGB CCc1cc2c(SCC(=O)NNC(=O)c3cccs3)ncnc2s1 8641000 WEQYLUKZCJXNCL-UHFFFAOYSA-N 378.504 2.869 50 40 GFGB O=C(NNC(=O)C1CCCC1)c1ccc(-n2cc(Br)cn2)cc1 84388099 ABLAWBXVHDCKJO-UHFFFAOYSA-N 377.242 2.586 50 40 GFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C\c2ccc(OC)c(C(=O)O)c2)cc1 409050076 ZXRVOCGYXJIRNL-ZROIWOOFSA-N 380.356 2.726 50 40 GFGB CCN(C(=O)COC(=O)/C(C#N)=C/c1ccc2c(c1)OCO2)c1ccccc1 3240741 ALAPXLUYSXGOLN-MHWRWJLKSA-N 378.384 2.919 50 40 GFGB CCc1ccc(NC(=O)C(=O)N/N=C(\C)CC(=O)Nc2ccccc2OC)cc1 4416513 ASIMFUJHCHKJCP-ZVHZXABRSA-N 396.447 2.717 50 40 GFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1cc(Cl)cc([N+](=O)[O-])c1O 109309570 QOCPTECXWMVOND-IUXPMGMMSA-N 378.728 2.555 50 40 GFGB CC1=NN(c2ccccc2)C(=O)[C@H]1/C=N/NC(=O)COc1ccc(Cl)cc1 408741765 RXTYEHBIWJIFFD-RYFGYPJOSA-N 384.823 2.860 50 40 GFGB CCc1ccccc1N(CC(=O)N/N=C/c1cccc(Cl)c1)S(C)(=O)=O 408783728 PVLDMFAJWSPNHO-UDWIEESQSA-N 393.896 2.819 50 40 GFGB O=C(N/N=C/c1ccc(O)c(Br)c1)c1cc([N+](=O)[O-])ccc1O 409046179 JBVAPNJDPVDUDH-FRKPEAEDSA-N 380.154 2.532 50 40 GFGB CC(C)(C)C(=O)NNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1 409000538 YPQDWLPHLJQKHA-UHFFFAOYSA-N 384.392 2.654 50 40 GFGB Cc1ccc(C)n1NC(=O)/C(C#N)=C\c1ccc(I)o1 409379402 WUBCFBDVFOITFA-XFFZJAGNSA-N 381.173 2.980 50 40 GFGB CC1(C)[C@]2(C(=O)NNC(=O)[C@]34CC[C@](C)(C(=O)C3)C4(C)C)CC[C@@]1(C)C(=O)C2 675010544 VDCTVVVRQFWDRF-ZDNVTZCJSA-N 388.508 2.705 50 40 GFGB C/C(=N/NC(=O)CC(=O)Nc1ccc(C)cc1)c1cc2ccccc2oc1=O 17187973 CIROXRXBTBDTEN-UCQKPKSFSA-N 377.400 2.970 50 40 GFGB CN1[C@H]2C=C3C(C#N)=C(N)C(C#N)(C#N)[C@H](c4c(F)cccc4F)[C@H]3[C@H]1CC2 101651630 JBPGDEKLKIFDTA-OLJVKKBNSA-N 377.398 2.851 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cccc(F)c3)[C@@H]2C1 4311881 ORLOEAOYVWVBMJ-MSOLQXFVSA-N 391.406 2.708 50 40 GFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OCC)cc1 408906446 JKUDFYAIFFYABZ-QTCOBDOFSA-N 383.448 2.893 50 40 GFGB C[C@H](NC(=O)/C(C#N)=C\c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)c1ccccc1 409240252 PEYORSUHJLSDGJ-ODYDIQAQSA-N 382.332 2.993 50 40 GFGB O=C(COc1ccc(Br)cc1)N/N=C/c1cc([N+](=O)[O-])ccc1O 12582563 RYFGQFVBZDQZJV-CAOOACKPSA-N 394.181 2.592 50 40 GFGB O=C(N/N=C1\C2CN3CCN(C2)CC1(c1ccccc1)C3)c1ccccc1Cl 22942390 YESUZPZCNQSHQT-HIXSDJFHSA-N 394.906 2.625 50 40 GFGB C=CCN1C(=O)[C@]2(C(C#N)=C(N)OC(C)=C2C(=O)OC(C)(C)C)c2ccccc21 1247362 ZZUDHNLUYVFYIV-QFIPXVFZSA-N 393.443 2.797 50 40 GFGB O=C(Cc1csc(-c2ccsc2)n1)NNC(=O)c1ccc2c(c1)OCO2 13001171 DJZCQQQFCOTNRT-UHFFFAOYSA-N 387.442 2.604 50 40 GFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)C(O)(c1ccccc1)c1ccccc1 1083254 MJLHTCPIOOSDQU-PXLXIMEGSA-N 375.384 2.981 50 40 GFGB CN1C(=O)[C@@]2(C(C#N)=C(N)N(c3cccnc3)C3=C2C(=O)CCC3)c2ccccc21 4417972 OCNSTZBRVJWTMA-HSZRJFAPSA-N 397.438 2.517 50 40 GFGB O=C(COc1ccccc1)N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O 36228658 WNKPFSKKKSRDGL-CAOOACKPSA-N 394.181 2.592 50 40 GFGB CCOc1ccc(C(=O)NNC(=O)c2ccc(-n3cccc3)cc2O)cc1OC 58296749 BCESXDHKFXWWSH-UHFFFAOYSA-N 395.415 2.665 50 40 GFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OC)c(OC)c1 408905645 BVLKRCUZKQPYJS-NIZGNDASSA-N 399.447 2.511 50 40 GFGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2cc(CC)ccc2[nH]c1=O 876489 YIYOTGDFTIBXTN-GOSISDBHSA-N 379.416 2.735 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)c2cccc(C)c2O)c(Br)c1 2333027 OFVIOQIDYUCBHD-UHFFFAOYSA-N 393.237 2.612 50 40 GFGB O=C(OCCCNC1=NS(=O)(=O)c2ccccc21)[C@H](Cl)c1ccccc1 2477552 ZYKGVPQTTVISKW-MRXNPFEDSA-N 392.864 2.639 50 40 GFGB COc1ccc(/C=N/NC(=O)c2ccccc2O)cc1I 4815569 PFCVGDGABPUROH-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB O=C(N/N=C1/C(=O)N(CCc2ccccc2)c2ccccc21)[C@H](O)c1ccccc1 6229231 LLYAVNCHYYXMBK-FNBPXTNNSA-N 399.450 2.830 50 40 GFGB N#CCCCN1C(=O)/C(=N/NC(=O)COc2cccc(Cl)c2)c2ccccc21 6231316 ABLCHHLZKDHWOC-LYBHJNIJSA-N 396.834 2.890 50 40 GFGB C[C@@H](Sc1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1 6552292 GFHNTQUWOYWRSM-BDJLRTHQSA-N 392.864 2.808 50 40 GFGB COc1ccc(OCCC(=O)NNC(=O)COc2ccc(Cl)c(C)c2)cc1 15889142 AWNNXIPZEKFWGA-UHFFFAOYSA-N 392.839 2.652 50 40 GFGB COc1ccc(OC)c(/C=N\NC(=O)COc2ccc(Br)cc2)c1 20010903 SDEBPSZKKKEGAN-GRSHGNNSSA-N 393.237 2.995 50 40 GFGB Cc1occc1C(=O)NNC(=O)c1cccc(CS(=O)(=O)c2ccccc2)c1 40140393 UYFIJCRJVDZWJP-UHFFFAOYSA-N 398.440 2.637 50 40 GFGB COc1cccc(/C=N/NC(=O)c2cccc(Cl)c2)c1O[C@@H](C)C(=O)O 409232295 PXBGFPNOZYIUFO-KKBVUKDESA-N 376.796 2.964 50 40 GFGB Cc1nn(-c2ccccc2)c(C)c1/C=N/NC(=O)CCn1nnc2ccccc21 1469432 WYCHWXCOONZRBJ-HYARGMPZSA-N 387.447 2.774 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2cccc(OC)c2)cc1OCC 3089168 ZVCOPGRPBVWARA-HYARGMPZSA-N 397.431 2.748 50 40 GFGB COC(=O)Cn1cc(/C=N/NC(=O)c2cc(OC)cc(OC)c2)c2ccccc21 8811212 OOSNKQHPDFZIQL-SSDVNMTOSA-N 395.415 2.595 50 40 GFGB COc1ccc(OC)c([C@H]2CC(=O)N3C(=C2C#N)SC[C@]3(O)c2ccco2)c1 12276265 GSAIAQWKFTUTHP-XCLFUZPHSA-N 398.440 2.940 50 40 GFGB O=C(NNc1nc(-c2ccncc2)no1)c1cc(Br)ccc1F 60362618 CBSDILNTLVRCHN-UHFFFAOYSA-N 378.161 2.790 50 40 GFGB CC(C)CN(CC(C)C)C(=O)[C@H](Br)[C@H](Br)C(=O)O 1685975 MHDIVHHUHBOMDP-ZJUUUORDSA-N 387.112 2.739 50 40 GFGB CCc1cccc(CC)c1NC(=O)C(=O)N/N=C/c1cc(OC)ccc1OC 3085320 FOIGJHQSRVEGDT-LPYMAVHISA-N 383.448 2.917 50 40 GFGB O=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C/c1ccccc1O 3170345 BKEHXZOUBVIAIM-MFKUBSTISA-N 387.439 2.791 50 40 GFGB O=C(NNS(=O)(=O)c1ccc(Br)cc1)c1ccccc1Cl 5770937 BATLKWDJUADFPD-UHFFFAOYSA-N 389.658 2.726 50 40 GFGB COC(=O)c1ccc(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)cc1 3059245 REYPYPJECXUVFT-LSHDLFTRSA-N 393.321 2.581 50 40 GFGB NC(=O)N/N=C/c1ccc(OCc2ccc(I)cc2)cc1 408994477 HUJOLJOXZHRYKO-GIJQJNRQSA-N 395.200 2.872 50 40 GFGB CCOC(=O)C1=C(c2ccc(OC)cc2)OC(N)=C(C#N)[C@H]1c1cccnc1 1305036 STLFPMADNKLVFJ-QGZVFWFLSA-N 377.400 2.872 50 40 GFGB CN(CCCl)C[C@@H]1O[C@H](c2ccccc2)O[C@H]2[C@@H]3OC(C)(C)O[C@H]3O[C@H]12 4801880 CZXLGGHMQXFZRL-SSDAWUQTSA-N 383.872 2.516 50 40 GFGB Cc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O)c(Cl)c1 4815530 CVKDXJNPODXQTB-REZTVBANSA-N 378.728 2.934 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)CCc2ccccc2)c(Br)c1 4996276 HIUGSAZSQLJZMT-UHFFFAOYSA-N 391.265 2.917 50 40 GFGB C=C(C)C(=O)OCCOC(=O)C1=C(N)OC(C)=C(C#N)[C@H]1c1cccc(F)c1 5791547 ICWUKYGQCLKDEY-MRXNPFEDSA-N 386.379 2.570 50 40 GFGB Cc1cc(C)cc(N2C[C@H](C(=O)NNC(=O)c3ccc(Cl)cc3)CC2=O)c1 7882551 KRXPTCKMJSSGFX-OAHLLOKOSA-N 385.851 2.771 50 40 GFGB NNC(=O)COc1ccc(-c2[nH]nc(C(F)(F)F)c2-c2ccccc2)c(O)c1 8973356 GSIZHMYGQSOZNT-UHFFFAOYSA-N 392.337 2.837 50 40 GFGB CS(=O)(=O)Nc1cccc(C2=NN(C(=O)CCl)[C@@H](c3ccccc3)C2)c1 23175898 DKNPWKKVOUSDJK-QGZVFWFLSA-N 391.880 2.975 50 40 GFGB O=C(NNC(=O)c1c[nH]c2ccccc12)c1ccc(NC(=O)c2ccccn2)cc1 32933180 YKQZLWAUHLDOCC-UHFFFAOYSA-N 399.410 2.890 50 40 GFGB O=C1[C@@H]2[C@H]3C[C@@H]([C@H](Br)[C@H]3Br)[C@@H]2C(=O)N1c1ccccc1 245377316 JNUMSHAQCAUPTM-DZDPUUJWSA-N 399.082 2.969 50 40 GFGB NNC(=O)/C(=C\c1ccc(Br)cc1)NC(=O)c1ccccc1Cl 2285098 DNVJXYDRTKTVRC-NTEUORMPSA-N 394.656 2.863 50 40 GFGB Cc1nc2ccsn2c1[C@@H]1C(C#N)=C(N)Oc2c1c(=O)n(C)c1ccccc21 20086247 BWOGUYDPYZXQPC-OAHLLOKOSA-N 389.440 2.774 50 40 GFGB CCc1ccccc1N1C[C@@H](C(=O)NNC(=O)c2ccccc2Cl)CC1=O 41779235 OIEALIIXCUEOCT-AWEZNQCLSA-N 385.851 2.717 50 40 GFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1 104602086 OQQYJYUWGSNZHH-PTNGSMBKSA-N 380.429 2.878 50 40 GFGB C/C(=N\NC(=O)CN(c1cc(C)cc(C)c1)S(C)(=O)=O)c1ccc(C)cc1 408775183 OQNZFUYEGLECII-HEHNFIMWSA-N 387.505 2.918 50 40 GFGB CCCOc1ccc(/C=N\NC(=O)[C@H]2CC(=O)N(c3ccc(OC)cc3)C2)cc1 409271526 MCCWVPLIQGJNRH-PGECNJAHSA-N 395.459 2.987 50 40 GFGB Cc1cc(C)c2c(N)c(C(=O)NNC(=O)[C@@H]3COc4ccccc4C3)sc2n1 24987499 NJSRZMUXNJRZIK-ZDUSSCGKSA-N 396.472 2.508 50 40 GFGB CSc1ccc(/C=N/NC(=O)CN(c2cccc(C)c2)S(C)(=O)=O)cc1 20207825 FJRPOOFYABUEIZ-XDHOZWIPSA-N 391.518 2.633 50 40 GFGB CNC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(Cl)cc2)c(Cl)c1 408609137 JLQHKAGVJLMDCP-ZVBGSRNCSA-N 380.231 2.769 50 40 GFGB COCCNC(=O)/C(C#N)=C/c1ccc(OCc2cc(OC)ccc2OC)cc1 408802457 YEWYKYGLTSFACH-SFQUDFHCSA-N 396.443 2.952 50 40 GFGB Cc1ccc(/C=N/NC(=O)[C@H](C)N(c2ccccc2)S(C)(=O)=O)c(C)c1C 2085188 AQGUQTWJDPIQFR-RSZPVBOMSA-N 387.505 2.917 50 40 GFGB O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H]1COc2ccccc2O1 41780496 YCCAELGQXOXZJB-AWEZNQCLSA-N 383.282 2.897 50 40 GFGB COc1ccc(NCC(=O)NNC(=O)C(C)(C)Oc2ccc(Cl)cc2)cc1 12534518 HDXXKRQQDRUJJX-UHFFFAOYSA-N 391.855 2.766 50 40 GFGB Cc1cc(C)c(NCC(=O)NNC(=O)c2ccc(Br)o2)c(C)c1 10162059 QFDOHVTWXLKVEC-UHFFFAOYSA-N 380.242 2.840 50 40 GFGB O=C(CC[C@H](O)c1ccccc1)N/N=C/c1ccc(I)o1 58886413 UGIAYHGUJXMIGO-VZWMTCDZSA-N 398.200 2.848 50 40 GFGB O=C(NNC(=O)c1cc2ccccc2cc1O)c1ccc(Br)o1 8878332 FODXFMFPHHMMBF-UHFFFAOYSA-N 375.178 2.976 50 40 GFGB Cn1c(SCC(=O)N/N=C/c2ccco2)nnc1-c1ccc(Cl)cc1 1102153 XHHXSYLFGJXYKH-GIJQJNRQSA-N 375.841 2.971 50 40 GFGB Cc1cccc(C)c1OCC(=O)NNC(=O)c1ccccc1Br 5619937 LZIUWLBRUFWTGI-UHFFFAOYSA-N 377.238 2.906 50 40 GFGB Cc1cc(Cl)ccc1OCC(=O)NN[C@H](C(=O)NC1CC1)c1ccccc1 12784060 KMFHIGVJAGEBQI-IBGZPJMESA-N 387.867 2.668 50 40 GFGB O=C(O)CC/C(=N/NC(=O)c1cncc(Br)c1)c1ccccc1 4591812 WKYGGKPZMAAUEX-RGEXLXHISA-N 376.210 2.843 50 40 GFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@H]1CC(=O)N(c2ccccc2F)C1 15480413 SUCNDVYZWWPSPI-IGMNZBQBSA-N 399.466 2.542 50 40 GFGB CC(C)c1ccc(/C=N/NC(=O)CN(c2ccccc2F)S(C)(=O)=O)cc1 408787082 QVMCYJYZZSHFFH-CIAFOILYSA-N 391.468 2.865 50 40 GFGB CN(C)c1ccc(/C=N/NC(=O)CNC2CCCCC2)cc1Br 409382770 OVIQWVRAXFTABS-RGVLZGJSSA-N 381.318 2.888 50 40 GFGB Cc1cc2c(c(=O)n1C[C@@H]1CCCO1)[C@@H](c1cccc(F)c1)C(C#N)=C(N)O2 1266460 ZYLUYHNECDPIQX-YJBOKZPZSA-N 381.407 2.693 50 40 GFGB CCc1cc(C(=O)NNC(=O)[C@@H]2[C@H]3CC[C@@H](C3=C(C)C)[C@H]2C(=O)O)cs1 102618667 JOQGNRGLWIHDEO-WMHQRMGPSA-N 376.478 2.765 50 40 GFGB Cc1ccc(CC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2N2CCOCC2)c(C)c1 20194862 PDVXUAFPWWIPQS-HYARGMPZSA-N 396.447 2.741 50 40 GFGB CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(/C)NNC(=O)c1cccs1 103916745 AWBZYRPXHMPNGY-GDNBJRDFSA-N 385.405 2.587 50 40 GFGB Cc1ccc(C)n1-c1cccc(C(=O)N/N=C/c2ccc(OCC(N)=O)cc2)c1 408963027 LOKRGJCRWNFYRL-ZMOGYAJESA-N 390.443 2.722 50 40 GFGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)CO/N=C/c2ccccc2)c1 3177972 XPTIETPYHOTDJH-WSDLNYQXSA-N 383.448 2.695 50 40 GFGB O=C(N/N=C/c1cccnc1)c1ccccc1NS(=O)(=O)c1cccs1 6146936 JXQDVGOTXFJBDD-XDHOZWIPSA-N 386.458 2.708 50 40 GFGB COc1ccc([C@@H]2C(C#N)=C(N)OC3=C2S(=O)(=O)N(C)c2ccccc23)cc1 20558319 DPWUMOLEJWCVIE-QGZVFWFLSA-N 395.440 2.651 50 40 GFGB C#CCOc1ccc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)cc1OCC 6960539 WYNSUSHCTHCERG-CIAFOILYSA-N 398.488 2.747 50 40 GFGB C[C@@H](Oc1ccccc1)C(=O)N/N=C1/C(=O)Nc2ccc(Br)cc21 13122233 MDMALPCKDMYLEP-SNVBAGLBSA-N 388.221 2.689 50 40 GFGB O=C1NC[C@H](c2ccccc2)[C@@H]1C(=O)N/N=C\c1ccc(Cl)c(Cl)c1 30885237 BYEYZZODDDCIDU-KLROMGPLSA-N 376.243 2.973 50 40 GFGB CC1=C(C#N)C(=O)N(C)C(=O)/C1=C/c1c(C)nn(-c2ccc(Cl)cc2)c1O 35183209 TWRNMBLLOBYCDQ-RIYZIHGNSA-N 382.807 2.762 50 40 GFGB O=C(Cc1ccc(Br)cc1)N/N=C\c1ccc(O)c([N+](=O)[O-])c1 36144778 KVULBEFWLHTMBR-MFOYZWKCSA-N 378.182 2.756 50 40 GFGB Cc1ccccc1OCC(=O)N/N=C/c1ccc(OCC(=O)NC(C)(C)C)cc1 409000628 UMEYBDJCWXYLCV-YDZHTSKRSA-N 397.475 2.818 50 40 GFGB O=C(N/N=C/c1ccc2c(c1)OCO2)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1 409167630 JKQGMLDMWHGOHB-UWPAOYMWSA-N 385.807 2.572 50 40 GFGB O=C(N/N=C/c1cccc(OC(=O)c2ccc([N+](=O)[O-])cc2)c1)c1cccnc1 1433874 ORAWUMUUZPQERJ-WSDLNYQXSA-N 390.355 2.973 50 40 GFGB N#C/C(=C\c1ccc(-c2ccc(Cl)cc2)o1)C(=O)N[C@H]1CCS(=O)(=O)C1 26966845 AHEWJIPNNWXSGP-GLNPCMGASA-N 390.848 2.810 50 40 GFGB COc1ccc(C)cc1N(CC(=O)NN=C1CCCCCCC1)S(C)(=O)=O 20212247 QXMBBEOLZSDWRD-UHFFFAOYSA-N 395.525 2.986 50 40 GFGB O=C(CSc1nc2ccccc2o1)NNC(=O)c1cc(-c2ccccc2)n[nH]1 6509137 OTGNLYAYYHBUNI-UHFFFAOYSA-N 393.428 2.771 50 40 GFGB COc1cc(C(=O)N/N=C2\NC(C)(C)Cc3ccccc32)cc(OC)c1OC 5523148 RMTTWWCANKQJCA-UHFFFAOYSA-N 383.448 2.728 50 40 GFGB COc1cc([C@H]2ON=C(C(=O)N/N=C/c3cccc(F)c3)[C@@H]2C)cc2c1OCO2 15085843 FKAOOHCPBVJUHX-NMIDASLBSA-N 399.378 2.777 50 40 GFGB Cc1cccc(NCC(=O)N/N=C\c2ccc(I)o2)c1 5337790 RWPUHCIOIVZAIY-IUXPMGMMSA-N 383.189 2.755 50 40 GFGB CC1(CC(=O)N/N=C/c2ccc(I)o2)SCCS1 6348150 ZHHKZWNPUFPKBH-NTUHNPAUSA-N 396.275 2.921 50 40 GFGB CCCCN1C(=O)/C(=N\NC(=O)CNc2ccc(OC)cc2)c2ccccc21 102375018 AOZCNIZFHQPOLN-GFMRDNFCSA-N 380.448 2.774 50 40 GFGB CCCCC(=O)NN/C=C1\C(=O)N(c2ccc(Cl)cc2)C(=S)N=C1O 2587079 GVWDBBDOPKOOMM-XFXZXTDPSA-N 380.857 2.623 50 40 GFGB CCOC(=O)CCC(=O)NNC(=O)CCCOc1ccc(Cl)cc1Cl 4601981 YQGWQWDYJRQFDG-UHFFFAOYSA-N 391.251 2.643 50 40 GFGB COc1ccc2cc(/C=N/NC(=O)CSc3ncccn3)c(Cl)nc2c1 6647290 AAUKQSOPROYLNV-ZVBGSRNCSA-N 387.852 2.929 50 40 GFGB O=C(N/N=C/c1cc2ccccc2nc1Cl)c1nc2ccccc2c(=O)[nH]1 9452603 PJCATYBLQQHYFV-UFFVCSGVSA-N 377.791 2.889 50 40 GFGB CCC(=O)NNC(=O)Cn1c(COc2ccc(Cl)cc2)nc2ccccc21 15474473 SDSZHPFCTRISPW-UHFFFAOYSA-N 386.839 2.826 50 40 GFGB CCCNC(=O)NNC(=O)c1cc(-c2ccc3c(c2)OCO3)nc2ccccc12 15933849 OOSYJVQYFLACJX-UHFFFAOYSA-N 392.415 2.985 50 40 GFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)c2ccc(NC(C)=O)cc2)cc1 16137082 LVGAVVYPIQLLCL-YDZHTSKRSA-N 382.420 2.788 50 40 GFGB CCCN(CCC)CN1C(=O)/C(=N\NC(=O)c2ccccn2)c2ccccc21 20292039 BQABRNKBZKZMKB-NMWGTECJSA-N 379.464 2.642 50 40 GFGB O=C(OCCCNC1=NS(=O)(=O)c2ccccc21)[C@@H](Cl)c1ccccc1 2477547 ZYKGVPQTTVISKW-INIZCTEOSA-N 392.864 2.639 50 40 GFGB CCN(CC)c1ccc2cc(C(=N)NNC(=O)c3cccs3)c(=O)oc2c1 3198250 DZCYQCLDNABDGR-UHFFFAOYSA-N 384.461 2.961 50 40 GFGB biogenic Cc1nc(C(F)(F)F)ccc1C(=O)N/N=C/c1ccc(OC[C@H]2CO2)cc1 4276653 BTGLVKQIDGZKQU-HMAUVEFUSA-N 379.338 2.950 50 40 GFGB COC(=O)/C(CC(=O)C(C)(C)C)=N\NC(=O)c1ccc(Br)cc1 5379487 PGVLELWOEGYAMV-PDGQHHTCSA-N 383.242 2.713 50 40 GFGB COc1cc(OC)c(OC)cc1/C=N/NC(=O)c1cc(-c2ccccc2)n[nH]1 9089540 YAWOICUCOBEDAK-CIAFOILYSA-N 380.404 2.866 50 40 GFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@@H]1CC(=O)N(c2ccccc2F)C1 15480415 SUCNDVYZWWPSPI-LBMSDSGBSA-N 399.466 2.542 50 40 GFGB COc1ccc(C(=O)NNC(=O)c2ccc(NC(=O)c3ccco3)cc2)cc1 16510298 UCIJUCKMGMJUKT-UHFFFAOYSA-N 379.372 2.615 50 40 GFGB Cc1c(/C=N\NC(=O)CN2CCOCC2)c2ccccc2n1Cc1ccccc1 20295230 PUAYXHAHPSDMTP-IWIPYMOSSA-N 390.487 2.780 50 40 GFGB O=C(CCCC[C@H]1CCSS1)N[C@H]1CCN(c2nccn3cnnc23)C1 575414448 HVMKVJIXAFUTKU-KBPBESRZSA-N 392.554 2.533 50 40 GFGB COCc1cc(C)n(CC(=O)NN=C2CCC(C(C)(C)C)CC2)c(=O)c1C#N 6796491 WVNCQJLBPWCEFJ-UHFFFAOYSA-N 386.496 2.883 50 40 GFGB COc1cc(Br)cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)c1OC 409207684 XJANXEWYXLHSTM-TZWLIRKLSA-N 395.253 2.668 50 40 GFGB Cc1cccc(OCC(=O)N/N=C2\C(=O)Nc3ccc(Br)cc32)c1 5519948 FQBQDTNMKQGFFZ-UHFFFAOYSA-N 388.221 2.609 50 40 GFGB O=C(NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cc2c(s1)CCCCC2 7404795 FMJOICDQYBTELQ-UHFFFAOYSA-N 395.462 2.549 50 40 GFGB C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)[C@@H](C)Oc1ccccc1Cl 32795738 NQBUZZUVBHONCY-NWDGAFQWSA-N 380.803 2.861 50 40 GFGB COc1cc(/C=N/NC(=O)CSc2nc3ccccc3o2)ccc1OCC#N 6441226 WCEYBIGPRNPJKY-SRZZPIQSSA-N 396.428 2.981 50 40 GFGB O=C(N/N=C/c1ccc(OCC(=O)N2CCCCC2)cc1)c1ccc(F)cc1 408884486 UHAIMRYFJNQRCC-OEAKJJBVSA-N 383.423 2.981 50 40 GFGB CCc1ccc(-n2nc(C(=O)N/N=C/c3cccs3)c(C)c(C#N)c2=O)cc1 409057134 UKAZBYKATYMOCR-WSDLNYQXSA-N 391.456 2.800 50 40 GFGB COc1cc(/C=N\NC(=O)c2ccco2)ccc1OCc1ccc(C(=O)O)o1 33687899 PPCLWFSLZAYTNL-JMIUGGIZSA-N 384.344 2.922 50 40 GFGB CCOC(=O)CSC1=C(C#N)[C@@H](c2ccc(OC)c(Cl)c2)CC(=O)N1 6955150 JMYCWTRUESPHKI-LLVKDONJSA-N 380.853 2.984 50 40 GFGB COCCOCCOCCOCCNC(=O)CCCC[C@H]1CCSS1 104530425 DVOKZPCLVOHRAR-INIZCTEOSA-N 395.587 2.513 50 40 GFGB Cc1ccc(-n2ncc(C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)c2C)cc1 12864392 GIBBEWNMIHEIOV-OAHLLOKOSA-N 396.422 2.857 50 40 GFGB C[C@@H](C(=O)N/N=C/c1ccc(Cl)cc1)N(c1ccccc1)S(C)(=O)=O 408906545 HAFYQWBYKXPFAB-HCZVKUGISA-N 379.869 2.645 50 40 GFGB CC[C@H](C)c1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1 7428733 ZURFWLPVUUPTPG-LBPRGKRZSA-N 376.434 2.552 50 40 GFGB O=C(NNC(=O)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1)C1CC1 72272659 ZVBIFSGLMVGISZ-CTNGQTDRSA-N 391.471 2.724 50 40 GFGB CS(=O)(=O)N(C[C@H](O)C[C@@H]1C=C(C=O)c2ccccc21)c1ccc(F)cc1 95117204 OWRMCIUZBKJUAB-KBXCAEBGSA-N 389.448 2.722 50 40 GFGB O=C(NC[C@H]1CCCO1)C(=O)N/N=C/c1c2ccccc2cc2ccccc12 5777163 FIAAAHJYKVSLOH-PTZPRWATSA-N 375.428 2.738 50 40 GFGB NC(=O)Cn1cc(/C=N/NC(=O)c2cccc(Br)c2)c2ccccc21 6045779 YWVMWBIMKVHBEA-ZVBGSRNCSA-N 399.248 2.653 50 40 GFGB O=C(CCN1CCCC[C@H]1c1cccnc1)N/N=C/c1ccc2c(c1)OCO2 6223347 LIKLIPIIWAWWLK-XNQWGTPPSA-N 380.448 2.878 50 40 GFGB CCCN(CC(=O)NNC(=O)c1ccco1)C(=O)c1oc2ccccc2c1C 32891555 FYORHQFODIEBFA-UHFFFAOYSA-N 383.404 2.648 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2O)cc1OC 100800137 KXMUHTQFZGIZBN-LPYMAVHISA-N 394.431 2.596 50 40 GFGB Cc1ccccc1NCC(=O)N/N=C1/C(=O)Nc2ccc(Br)cc21 5533752 PSOKXBIBXAWHLG-UHFFFAOYSA-N 387.237 2.642 50 40 GFGB O=C(NNC1=NCCC1)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1 6863094 JDGCLLCPTVFSDL-UHFFFAOYSA-N 392.868 2.568 50 40 GFGB CCCSc1ncc(Cl)c(C(=O)NNC(=O)c2ccccc2[N+](=O)[O-])n1 28287061 CUIYOKFEDJQLMG-UHFFFAOYSA-N 395.828 2.615 50 40 GFGB O=C(NNC(=S)NC(=O)c1sc2ccccc2c1Cl)c1ccncc1 6536128 WIDVCPSOGBUAFT-UHFFFAOYSA-N 390.877 2.899 50 40 GFGB COc1ccc(Br)cc1[C@@H]1C(C#N)=C(N)Oc2cc(C)[nH]c(=O)c21 18266086 SLSTXKTVCUHHIK-CQSZACIVSA-N 388.221 2.673 50 40 GFGB O=C1N(CN2CCc3ccccc3C2)c2ccccc2[C@@]12OC[C@H](CCl)O2 19831098 XEDFTGXKVQWEPB-UWJYYQICSA-N 384.863 2.856 50 40 GFGB Cc1cc(Br)ccc1OCC(=O)NNC(=O)/C=C/c1ccco1 9553321 PPCKASBIVYWOSA-FNORWQNLSA-N 379.210 2.590 50 40 GFGB COc1ccc(OCC(=O)N/N=C\c2cccn2-c2ccc(C(=O)O)cc2)cc1 409237103 IYYBPKZXQODSPO-XKZIYDEJSA-N 393.399 2.713 50 40 GFGB CCc1sc(C(=O)NNC(=O)c2ccc(S(=O)(=O)C(C)C)cc2)cc1C 40144592 VYXDMMXAAOVUTP-UHFFFAOYSA-N 394.518 2.876 50 40 GFGB O=C(CN1CCN(Cc2ccccc2Cl)CC1)N/N=C/c1ccccc1F 22924832 RBGBMPYIGBXLLS-YDZHTSKRSA-N 388.874 2.747 50 40 GFGB COc1cc(/C=N/NC(=O)CC(=O)Nc2cccc(C(F)(F)F)c2)ccc1O 1421649 YQVGDZOWRFCDBA-LSHDLFTRSA-N 395.337 2.899 50 40 GFGB CCN(Cc1ccc(OC)c(F)c1)[C@H](C)C(=O)NNC(=O)c1ccc(F)cc1 8324993 IZJTVOPNCMDPDI-CYBMUJFWSA-N 391.418 2.645 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])cc(Br)c1O)c1ccccc1O 9190232 MCDBNKHOELHMHB-FRKPEAEDSA-N 380.154 2.532 50 40 GFGB COc1cccc(/C=N/NC(=O)c2cc3c(OC)c(OC)ccc3[nH]2)c1OC 2350735 RKSQGNNQXZLBHE-SRZZPIQSSA-N 383.404 2.966 50 40 GFGB Cc1ccc(NC(=O)NNc2ccc(S(=O)(=O)N3CCCCC3)cn2)cc1 6346881 DICWAAGSNWCKFX-UHFFFAOYSA-N 389.481 2.713 50 40 GFGB C/C(=N\NC(=O)CC1(C)OCCO1)c1ccc(NC(=O)c2ccccc2)cc1 4502712 HAKXNMMNQGQRJY-HZHRSRAPSA-N 381.432 2.932 50 40 GFGB Cc1ccc(OCC(=O)NNC(=O)c2sc(-c3ccccn3)nc2C)cc1C 15705873 DILKLATZZXHXBC-UHFFFAOYSA-N 396.472 2.970 50 40 GFGB COc1ccc(OC)c(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)c1 409159114 QATZQKOJPHZZRE-FZJZADEZSA-N 395.459 2.824 50 40 GFGB COc1cc(/C=C2/C(=O)NC(=O)N(c3ccccc3)C2=O)cc(SC#N)c1O 409043680 SZYUXABBDWTFJC-QPEQYQDCSA-N 395.396 2.640 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2ccc(OC)cc2)cc(Cl)c1O 409268795 AOUVVHOYYCHVDM-KEBDBYFISA-N 391.811 2.542 50 40 GFGB C/C(=N\NC(=O)CN(c1ccccc1F)S(C)(=O)=O)c1ccc(Cl)cc1 408779883 MXXSOTZXEUXZIQ-UDWIEESQSA-N 397.859 2.786 50 40 GFGB COC(=O)c1ccc(NC(=O)C(=O)N/N=C\c2ccc(Cl)c(Cl)c2)cc1 223157660 JJZYZESUHLPYNP-UKWGHVSLSA-N 394.214 2.869 50 40 GFGB Cc1ccccc1-n1nnnc1SCC(=O)N/N=C/c1ccc(Cl)cc1 4966270 AXGIJGFCMXOPPY-VXLYETTFSA-N 386.868 2.867 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2cccc(Br)c2)cc1 3057525 AQYKBJOPJIAFOL-VCHYOVAHSA-N 376.210 2.547 50 40 GFGB CCCCn1nc(C(=O)NNC(=O)c2ccc(Cl)cc2)c2ccccc2c1=O 3413382 BWVDXQUHFQQZSU-UHFFFAOYSA-N 398.850 2.925 50 40 GFGB COc1ccc(OC)c2sc(NNC(=O)[C@@H]3COc4ccccc4O3)nc12 4121483 FVLYGTCKGREEMR-AWEZNQCLSA-N 387.417 2.597 50 40 GFGB Cc1ccc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1 6190044 ZTHCZCPVMQPAAM-PXLXIMEGSA-N 399.516 2.854 50 40 GFGB COC(=O)COc1cccc(/C=N/NC(=O)c2cc3cccc(OC)c3o2)c1 8169029 REXOQDQGAYEHOB-SRZZPIQSSA-N 382.372 2.757 50 40 GFGB O=C(/C=C/c1cc(Cl)cc(Cl)c1)NNC(=O)[C@H]1COc2ccccc2O1 12609651 AZKLZZZBEIEVLI-SQRWCISFSA-N 393.226 2.994 50 40 GFGB O=C(N/N=C\c1cc(Cl)cc([N+](=O)[O-])c1O)c1cncc(Br)c1 13584400 GRWUUQNQTSKYHT-ZWSORDCHSA-N 399.588 2.875 50 40 GFGB Cc1ccc(O[C@H](C)C(=O)NNC(=O)CNc2nc3ccccc3s2)cc1 14161610 JLJFXKDMEXHWBJ-CYBMUJFWSA-N 384.461 2.632 50 40 GFGB CNc1nc2[nH]c(=O)c3c(c2s1)OC(N)=C(C#N)[C@@H]3c1ccc(Cl)cc1 15084559 FCIKBMNXDJALND-JTQLQIEISA-N 385.836 2.898 50 40 GFGB CCCc1c(/C=N/NC(=O)c2ccccc2O)c(OC)c2c(c1OC)OCO2 15085460 YSWNMGCQIRAFRY-UFFVCSGVSA-N 386.404 2.855 50 40 GFGB COC(=O)C1=C(C)NC(SC)=C(C#N)[C@@H]1c1cc(OC)c(OC)c(OC)c1 20528839 DWFMEDUBYNSFRF-INIZCTEOSA-N 390.461 2.944 50 40 GFGB biogenic,in-vitro Cc1cc(C(=O)NNC(=O)CCCNc2ncccn2)c(C)n1-c1ccccc1 40143557 ZCDBZRSDZOLGHX-UHFFFAOYSA-N 392.463 2.537 50 40 GFGB CCc1cc(C(=O)NNC(=O)[C@@H]2[C@@H]3CC[C@H](C3=C(C)C)[C@@H]2C(=O)O)cs1 102210928 JOQGNRGLWIHDEO-XOUADPBQSA-N 376.478 2.765 50 40 GFGB C[C@H](Oc1ccc(/C=N\NC(=O)COc2cccc(Cl)c2)cc1)C(=O)O 208349922 WOWNWHGYBOBHAX-XGTDKWECSA-N 376.796 2.721 50 40 GFGB Cc1ccc(Oc2cc(NNC(=O)[C@H]3COc4ccccc4O3)ncn2)cc1 632575 RRQABKLRUAEWOY-QGZVFWFLSA-N 378.388 2.860 50 40 GFGB COC(=O)/C(CC(=O)C(C)(C)C)=N/NC(=O)c1cccc(Br)c1 4697229 KLPNBZPBMMTLLP-LDADJPATSA-N 383.242 2.713 50 40 GFGB CC(C)(C)NC(=O)C(=O)N/N=C/c1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1 6646033 HJPGAHRVDJEHNG-CIAFOILYSA-N 398.419 2.539 50 40 GFGB CCOc1cc(/C=N/NC(=O)Cc2ccc(C)cc2C)ccc1OCC(=O)OC 20195196 DBWZHTITOWJABX-YDZHTSKRSA-N 398.459 2.947 50 40 GFGB COc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)c(OC)c1OC 408542126 HIBGCIIMDWNAQD-ZROIWOOFSA-N 382.372 2.956 50 40 GFGB COc1cc2c(cc1/C=N\NC(=O)c1ccccc1Br)OCO2 409073465 PSQLUBUOMMBQQZ-LSCVHKIXSA-N 377.194 2.950 50 40 GFGB CCc1ccc(N2C[C@H](C(=O)N/N=C\c3cc(OC)ccc3OC)CC2=O)cc1 409159116 UXJIBGRFIYHPKK-SUVVMJBMSA-N 395.459 2.769 50 40 GFGB CCc1ccc(OCC(=O)NNC(=O)c2ccc(OC(F)(F)F)cc2)cc1 2628318 JICLZBKTJCZRHY-UHFFFAOYSA-N 382.338 2.988 50 40 GFGB CCCCCC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 12521071 RSOPPPVZCRAKJQ-UHFFFAOYSA-N 395.506 2.890 50 40 GFGB O=C(N/N=C/c1ccc(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1 58884985 ZDXSTEGWFKCQGV-QGMBQPNBSA-N 381.175 2.990 50 40 GFGB CCOc1cc(/C=C(\C#N)C(=O)N2CCCC2)cc(Cl)c1OCC(=O)OC 409367791 KYAYTNBXNWYPNR-RIYZIHGNSA-N 392.839 2.820 50 40 GFGB COc1ccc(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)c(OC)c1 105992703 BGFDBXWVFFUKTC-FSJBWODESA-N 389.411 2.968 50 40 GFGB COc1cccc(/C=N/NC(=O)c2cccc(I)c2)c1O 4547437 SFHQJFIODOUJCY-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C/c2cccc(OC)c2OC)c(OC)c1 408876831 RBPLDYUDFYUALM-MHWRWJLKSA-N 382.416 2.944 50 40 GFGB CN(c1ccccc1)c1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cn1 40128078 NYXLXFRSEORQEI-UHFFFAOYSA-N 391.387 2.833 50 40 GFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)Cc2ccc(OC)c(OC)c2)cc1 100923061 PSAUWGXCDZSWOU-OEAKJJBVSA-N 399.447 2.776 50 40 GFGB COc1ccccc1/C=N/NC(=O)c1ccn(Cc2ccc([N+](=O)[O-])cc2)n1 1089112 CJHWZSWYFKCAJB-UDWIEESQSA-N 379.376 2.612 50 40 GFGB Cc1cc(Cl)ccc1O[C@@H](C)C(=O)NNC(=O)c1cccc([N+](=O)[O-])c1 1479726 GRZPBECALZWLLK-NSHDSACASA-N 377.784 2.785 50 40 GFGB O=C(NCc1ccco1)C(=O)N/N=C/c1ccccc1OCc1ccccc1 2076784 PVRCKQBPVPUQCC-YDZHTSKRSA-N 377.400 2.625 50 40 GFGB COc1ccccc1OCc1ccc(C(=O)NNC(=S)NCC(C)C)o1 2794456 BOPNSJKJMXHZSW-UHFFFAOYSA-N 377.466 2.632 50 40 GFGB CCOc1c(Br)cc(/C=C(\C#N)C(=O)OCCOC)cc1OC 3517165 IILCKUYLITZKAQ-KPKJPENVSA-N 384.226 2.953 50 40 GFGB COC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(OC)c(Cl)c1 4771071 WWZCBDVVIHWOSZ-AWEZNQCLSA-N 390.852 2.906 50 40 GFGB C[C@H](S[C@@H](C)C(=O)N/N=C\c1ccccc1)C(=O)N/N=C\c1ccccc1 38798916 FPCODJQCYPMUTI-ROXWWLGHSA-N 382.489 2.797 50 40 GFGB O=C(CNC(=O)C12CC3CC(CC(C3)C1)C2)N/N=C\c1c[nH]c2ccccc12 17200785 RHCSDAFONYNLQS-ROTLSHHCSA-N 378.476 2.951 50 40 GFGB COc1ccc(NC(=S)NNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 408587289 SYEQKOOHOPWURG-UHFFFAOYSA-N 386.389 2.981 50 40 GFGB COc1cc(OC)c(/C=N\NC(=O)c2ccccc2N)cc1Br 408718848 ODASZJKCDSROTG-OCKHKDLRSA-N 378.226 2.812 50 40 GFGB Cc1ccc(/C=N/NC(=O)CN(c2cccc(F)c2)S(C)(=O)=O)c(C)c1C 409145650 QNDGTHRXHYAXHT-SRZZPIQSSA-N 391.468 2.667 50 40 GFGB COc1ccccc1/C=N/NC(=O)c1ccc(Cn2nc([N+](=O)[O-])cc2C)cc1 5150041 BWZUGBXADZNRJQ-CIAFOILYSA-N 393.403 2.921 50 40 GFGB COc1ccc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc1Cn1nc(C)cc1C 44790537 MSQVQITWZBPTJJ-ACEGTKJHSA-N 394.475 2.759 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)c(OC)c1 3059257 RJKHOGXJRRHYGB-LSHDLFTRSA-N 395.337 2.811 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(N)cc2)ccc1OC(=O)c1ccco1 3525542 VAGXVLIIIXFKIA-WSDLNYQXSA-N 379.372 2.854 50 40 GFGB Cc1cc2c(c(=O)n1C[C@H]1CCCO1)[C@H](c1cccc(F)c1)C(C#N)=C(N)O2 1266459 ZYLUYHNECDPIQX-CRAIPNDOSA-N 381.407 2.693 50 40 GFGB CCCNC(=O)N(NC(=O)c1ccccc1)c1nc(C(=O)OCC)cs1 3768066 DKGZPQNCUHZQTP-UHFFFAOYSA-N 376.438 2.591 50 40 GFGB COc1ccc(CCC(=O)NNc2nc(C)cc(C)n2)cc1Br 12986216 DRZBWNAVQBQXGF-UHFFFAOYSA-N 379.258 2.940 50 40 GFGB Cc1cc(C)cc(OCCN(C)CC(=O)NNC(=O)c2ccccc2Cl)c1 14242054 SUALBKUHUKPQQL-UHFFFAOYSA-N 389.883 2.729 50 40 GFGB CCOc1ccccc1N(CC(=O)NN=C(C)C)S(=O)(=O)c1ccccc1 20493165 MEBXUYVECQCWFN-UHFFFAOYSA-N 389.477 2.793 50 40 GFGB O=C(Cn1nnc2ccccc21)N/N=C\C(Br)=C\c1ccccc1 31841319 GLQSIRDOXHCRPW-UGFKSEECSA-N 384.237 2.969 50 40 GFGB CC(C)c1ccccc1N1/C(=N\C(=O)CCl)S[C@H]2CS(=O)(=O)C[C@H]21 101316732 YDWLWZPHMIKNSQ-KRGDBVFUSA-N 386.926 2.650 50 40 GFGB O[C@]12[C@@H](Br)[C@@H]3[C@@H]4[C@@H]5C[C@@H]3[C@H]1[C@@H]5C(Br)(Br)[C@H]42 253476501 WZBOKYFPZUQGLI-QPAFDRJZSA-N 398.920 2.739 50 40 GFGB COc1cccc(CC(=O)N/N=C\c2cccn2-c2cccc(C(=O)O)c2)c1 409108470 WCSOSAMWLRHOIE-HMAPJEAMSA-N 377.400 2.877 50 40 GFGB C#CCOc1cc(Br)c(/C=C(/C#N)C(=O)N(C)C)cc1OCC 59334743 DIMUUNJVPYIHDC-JYRVWZFOSA-N 377.238 2.855 50 40 GFGB O[C@@]12[C@@H]3[C@H]4[C@H]5C[C@@H]([C@H]4[C@H]1Br)[C@@H]2[C@H]5C3(Br)Br 195528766 WZBOKYFPZUQGLI-UIGYZEAASA-N 398.920 2.739 50 40 GFGB Cc1nc(C(F)(F)F)ccc1C(=O)N/N=C/c1ccc(OC[C@@H]2CO2)cc1 2243832 BTGLVKQIDGZKQU-UCBNSMMZSA-N 379.338 2.950 50 40 GFGB C[C@@H](Sc1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1 6552286 GFHNTQUWOYWRSM-BZNIZROVSA-N 392.864 2.808 50 40 GFGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1cccc(Nc2ncccn2)c1 40060176 DVRPQRVDQPBDPA-UHFFFAOYSA-N 397.822 2.957 50 40 GFGB CCOC(=O)N1CC=C2[C@@H](C1)[C@@H](c1cccc(F)c1)C(C#N)=C(N)C2(C#N)C#N 664260 VAIFQJDSWFLXHA-AEFFLSMTSA-N 391.406 2.708 50 40 GFGB Cc1ccc(N2C[C@@H](C(=O)Oc3ccc([N+](=O)[O-])cc3)CC2=O)cc1[N+](=O)[O-] 7929520 YUNDIEIIYNCFIC-LBPRGKRZSA-N 385.332 2.770 50 40 GFGB C=CCc1cc(/C=N/NC(=O)Cc2ccccc2)cc(OC)c1OCC(=O)O 59678217 XSIKDGCAOJOFRX-LPYMAVHISA-N 382.416 2.580 50 40 GFGB C#CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc4c(cc32)OCO4)cc1OC 2128710 QIJATEBVPPVURA-HXUWFJFHSA-N 376.368 2.654 50 40 GFGB CC(C)=NNC(=O)CN(c1ccc(Oc2ccccc2)cc1)S(C)(=O)=O 20059712 UKVXHJHXHQOBPY-UHFFFAOYSA-N 375.450 2.757 50 40 GFGB N#C/C(=C/c1cc(Br)c(Br)o1)C(=O)N1CCOCC1 408955669 YGNZNFJBENQQMY-YVMONPNESA-N 390.031 2.570 50 40 GFGB CCOc1ccc(N([C@@H](C)C(=O)N/N=C(\C)C(C)(C)C)S(C)(=O)=O)cc1 7036923 JQDFVGDDTBOKRY-AZDDOORDSA-N 383.514 2.778 50 40 GFGB CC(=O)N[C@H](CC(=O)NNC(=O)c1ccc(OC(C)C)cc1)c1ccc(C)cc1 22901532 CIDMESJZRAYYGR-HXUWFJFHSA-N 397.475 2.811 50 40 GFGB CCc1ccc(-c2nc(C(=O)NNC(=O)N3C[C@H](C)O[C@H](C)C3)cs2)cc1 12568372 MFCBSHRKJPGWLN-BETUJISGSA-N 388.493 2.836 50 40 GFGB COc1cccc(N2C(=O)[C@H](Cc3ccc(F)cc3)S/C2=C(/C#N)C(N)=O)c1 2372260 BEZRRNWAJDVSPU-IMGOXIFKSA-N 397.431 2.746 50 40 GFGB C=CCN1C(=O)[C@@]2(C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c2ccccc21 4592622 ANSDJHBWIXBPAV-JOCHJYFZSA-N 375.428 2.824 50 40 GFGB CC(C)N1CCC2(CC1)[C@@H]1CN(C(C)C)CC=C1C(C#N)=C(N)C2(C#N)C#N 2258917 GSBXUCSUBRRWMB-LJQANCHMSA-N 378.524 2.527 50 40 GFGB COc1ccc(C(=O)NNC(=O)COC(=O)c2c(C)c(C)c(C)c(C)c2C)cc1 9458316 POJDHHGTHDIPBU-UHFFFAOYSA-N 398.459 2.855 50 40 GFGB Cc1cc(SCC(=O)NNC(=S)NC2CC2)c(C)cc1Br 15909241 KAESAALAEAUZMN-UHFFFAOYSA-N 388.356 2.816 50 40 GFGB CCc1c(C)sc(NC(=S)NNC(=O)c2ccoc2C)c1C(=O)OC 17077985 VPPYRIYTYBDAIT-UHFFFAOYSA-N 381.479 2.938 50 40 GFGB COc1cc(Cl)c(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc1OC 35331370 IRRZNPMUKYRYRB-GRSHGNNSSA-N 377.784 2.958 50 40 GFGB C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)c1ccc(O)c(O)c1 1060850 ZKLHQJMDQBSTAO-MRVPVSSYSA-N 385.203 2.633 50 40 GFGB CC(=O)c1ccc(NC(=S)NNC(=O)c2cc(-c3cccs3)[nH]n2)cc1 4995272 VLPKNSJCORRCSQ-UHFFFAOYSA-N 385.474 2.972 50 40 GFGB N#C/C(=C/c1ccc(N2CCOCC2)o1)C(=O)NCCc1c[nH]c2ccccc12 5776849 GAEVIVZGXCUYEX-LGMDPLHJSA-N 390.443 2.863 50 40 GFGB COCCNC(=O)/C(C#N)=C/c1ccc(OCc2ccccc2C#N)c(OC)c1 6627086 IVSVMNWWWZICTK-YBFXNURJSA-N 391.427 2.815 50 40 GFGB CCO[Si](O/C=C/O[Si](OCC)(OCC)OCC)(OCC)OCC 223711853 DNRORNCIGSNDFB-BUHFOSPRSA-N 384.574 2.581 50 40 GFGB C=CCOc1ccc(C(=O)N/N=C\c2cccc(OCC(=O)O)c2)cc1OCC 409319036 ZJHZGPCDRIWMFB-XKZIYDEJSA-N 398.415 2.877 50 40 GFGB CCOC(=O)CN1C(=O)/C(=C(\C#N)C(=O)Nc2ccccc2)c2ccccc21 409385689 CEIDRCKGTJWEKR-KNTRCKAVSA-N 375.384 2.512 50 40 GFGB CCc1ccc(NC(=S)NNC(=O)Cn2nc(C(F)(F)F)cc2C)cc1 2739486 WWCAWIFKGFAPSQ-UHFFFAOYSA-N 385.415 2.791 50 40 GFGB O=C(CSCc1cccc(Br)c1)NNC(=O)c1cccc(O)c1 12902584 QDKZGQYBIPEWGF-UHFFFAOYSA-N 395.278 2.849 50 40 GFGB CCOc1cc(/C=N/NC(N)=O)cc(Cl)c1OC(=O)c1ccc(OC)cc1 408887869 UMLIVRIXQLEREG-UFFVCSGVSA-N 391.811 2.969 50 40 GFGB O=C(NNC(=O)[C@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1)C1CC1 72272660 ZVBIFSGLMVGISZ-PZJWPPBQSA-N 391.471 2.724 50 40 GFGB Cc1cccc(/C=N/NC(=O)CN(c2ccc(Cl)cc2)S(C)(=O)=O)c1 19954354 CMQQXMPORFAZSP-YBFXNURJSA-N 379.869 2.565 50 40 GFGB O=C(CSc1ncccn1)N/N=C/c1ccc(OC(=O)c2ccccc2)cc1 685636 MAMXZAJQWHLGEY-YDZHTSKRSA-N 392.440 2.938 50 40 GFGB O=C(Nc1cccc(S(=O)(=O)N2CCOCC2)c1)[C@@H](Cl)c1ccccc1 3885964 MOHCKELCHPJLFH-KRWDZBQOSA-N 394.880 2.626 50 40 GFGB COC(=O)COc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1 4502823 KJCNUWRPIGQFNY-WSDLNYQXSA-N 378.384 2.861 50 40 GFGB COc1ccc(Br)cc1C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1O 5206417 YQFXDTHHVZCRLP-CAOOACKPSA-N 394.181 2.835 50 40 GFGB CC1(C)CC(=O)C2=C(C1)N(c1nc[nH]n1)C(N)=C(C#N)[C@H]2c1ccc(F)cc1 5408203 WNXFBHXHAVLWCR-MRXNPFEDSA-N 378.411 2.885 50 40 GFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccccc3F)[C@H]2C1 5488976 WRFYMFOHZTWKMN-WMZOPIPTSA-N 391.406 2.708 50 40 GFGB CNc1nc2[nH]c(=O)c3c(c2s1)OC(N)=C(C#N)[C@H]3c1ccc(Cl)cc1 15084561 FCIKBMNXDJALND-SNVBAGLBSA-N 385.836 2.898 50 40 GFGB NNC(=O)c1ccccc1N(Cc1ccccc1)S(=O)(=O)c1ccccc1 32115652 AETLXBAXZNJAPZ-UHFFFAOYSA-N 381.457 2.686 50 40 GFGB Cc1occc1C(=O)NNC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2 40140391 ICQDAZCOKIBGAB-UHFFFAOYSA-N 386.358 2.615 50 40 GFGB COc1cc(OC)c(OC)cc1/C=N/NC(=O)COc1cccc(Cl)c1 1444150 ZRTFXRQGTITYMY-KEBDBYFISA-N 378.812 2.895 50 40 GFGB CCOC(=O)C1=C(C(=O)OCC)[C@@H](c2ccccc2Cl)C(C#N)=C(N)O1 4836940 LHSYDQAUJHTHIN-ZDUSSCGKSA-N 376.796 2.528 50 40 GFGB COc1cc(/C=N/NC(=O)CC2(C)OCCO2)ccc1OCc1ccccc1 5415342 AEJOVQGKCLSKQG-HYARGMPZSA-N 384.432 2.877 50 40 GFGB CC(C)(C)C(=O)NC(=S)NNC(=O)COc1ccccc1-c1ccccc1 6857291 LNTBPJKJVARGBK-UHFFFAOYSA-N 385.489 2.800 50 40 GFGB CC(C)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1 12972822 CXFYRTTVQFCVBW-UHFFFAOYSA-N 395.868 2.558 50 40 GFGB C/C(=N\NC(=O)CCCC(=O)N/N=C(\C)c1ccccc1O)c1ccccc1O 16184442 YJYPVNQVDQSVQN-HOFJZWJUSA-N 396.447 2.649 50 40 GFGB COc1ccc(CC(=O)N/N=C\c2ccc(Cl)c([N+](=O)[O-])c2)cc1OC 36144858 SYEVQNYOQQVJEK-GRSHGNNSSA-N 377.784 2.958 50 40 GFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(C)c(OC)c1 408608439 WIHVTNWLPPKMKN-MRXNPFEDSA-N 384.461 2.952 50 40 GFGB O=[P@](O)(CCP(c1ccccc1)c1ccccc1)CN1CCOCC1 2307949 QOUJDSBLEZJTBE-UHFFFAOYSA-N 377.361 2.679 50 40 GFGB Cn1c(SCC(=O)N/N=C/c2ccccn2)nnc1-c1ccc(Cl)cc1 2319060 XHOLULZRPFQHHN-KEBDBYFISA-N 386.868 2.773 50 40 GFGB CCc1cc(C)cc(OCC(=O)N/N=C\c2ccc(O[C@@H](C)C(=O)O)cc2)c1 408852098 IDODFLYZKWFKMD-QZDMBBGESA-N 384.432 2.938 50 40 GFGB COc1ccc(/C=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] 408867662 JLULWXKLAPCJLL-CAOOACKPSA-N 378.728 2.929 50 40 GFGB COCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 5007788 BLSOVGVAYSXDGK-LDADJPATSA-N 381.432 2.550 50 40 GFGB Cc1cc(C(=O)OCC(=O)NNC(=O)c2ccccc2)c(C)n1-c1ccccc1 3363306 ZRBJYZVTOSVCLN-UHFFFAOYSA-N 391.427 2.712 50 40 GFGB O=C(NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1)c1ccccc1 4879317 GEGQLHCQBOEPQT-UHFFFAOYSA-N 395.440 2.562 50 40 GFGB CCc1ccccc1NC(=O)C(=O)N/N=C/c1cc(Cl)c(O)c(OC)c1 409251520 QXPUDHREZYRNAW-KEBDBYFISA-N 375.812 2.705 50 40 GFGB CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccccc2OCC(=O)O)cc1 13343049 KXRZRTJOTGSCGC-LFIBNONCSA-N 394.383 2.872 50 40 GFGB C=CCc1ccc(OCC(=O)N/N=C/c2ccc(OC)c(OC)c2)c(OC)c1 1085761 LGVLVECMOPPGSF-LPYMAVHISA-N 384.432 2.970 50 40 GFGB biogenic CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccccc3F)[C@H]2C1 1244163 WRFYMFOHZTWKMN-FUHWJXTLSA-N 391.406 2.708 50 40 GFGB CC(C)C[C@@H](NS(=O)(=O)Cc1ccccc1)C(=O)NNc1ccccc1 2045291 UNOSCORMYUKXTK-GOSISDBHSA-N 375.494 2.664 50 40 GFGB O=C(COc1ccc(Br)cc1)NNC(=O)c1ccc(Cl)cc1 3483491 FOHKSZIEQPDYOY-UHFFFAOYSA-N 383.629 2.943 50 40 GFGB CCOC(=O)CSC1=C(C#N)[C@H](c2ccc(OC(F)F)cc2)CC(=O)N1 874533 NOFBBFRNGCMREE-LBPRGKRZSA-N 382.388 2.923 50 40 GFGB O=C(N/N=C/c1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Cl)c(Cl)c1 3089024 HXWUHFLDVVAQBJ-UFWORHAWSA-N 380.187 2.780 50 40 GFGB COc1cc(/C=C(\C#N)C(=O)N2CCCC2)cc(I)c1O 409369405 MPNHBFRSZXGZHE-IZZDOVSWSA-N 398.200 2.535 50 40 GFGB COc1ccc(CNC(=O)C(=O)N/N=C/c2c(Cl)cccc2Cl)cc1 7782389 JVHNOZMSHSSALA-UFFVCSGVSA-N 380.231 2.769 50 40 GFGB CCOc1ccc(N2C[C@@H](C(=O)N/N=C/c3ccc(OC)cc3)CC2=O)cc1 4113490 JGLYBNFSFVSHRS-QPNANDPSSA-N 381.432 2.597 50 40 GFGB CCOC(=O)/C(C#N)=C/Nc1ccc([N+](=O)[O-])cc1I 139285349 XAYCLMQTTOACRN-BQYQJAHWSA-N 387.133 2.582 50 40 GFGB O=C(NN(Cc1ccccc1)Cc1ccccc1)c1cnc2n(c1=O)CCS2 12740837 YIVNAAMYPWHFHH-UHFFFAOYSA-N 392.484 2.696 50 40 GFGB CC(C)[C@H](NC(=O)C1CCCCC1)C(=O)NNC(=O)c1cccc(Cl)c1 14181228 QICHRZURGSQMIP-INIZCTEOSA-N 379.888 2.822 50 40 GFGB Cc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCc3ccncc3)c2C)cc1 58884289 SXPLRJYMJMTRDB-AFUMVMLFSA-N 389.459 2.564 50 40 GFGB C/C(=N\NC(=O)COc1cccc(Br)c1)c1ccc(O)cc1O 105463117 KPYHRSQTGCMOAH-VCHYOVAHSA-N 379.210 2.780 50 40 GFGB CCOC(=O)Cn1cc(/C=N/NC(=O)c2ccccc2OC)c2ccccc21 409373540 XGHKLWPATCJXLR-WSDLNYQXSA-N 379.416 2.977 50 40 GFGB CCc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccc(Cl)cc3)CC2=O)cc1 8316884 ZKCMRZFRQCTOEU-OAHLLOKOSA-N 385.851 2.717 50 40 GFGB CCOc1ccc(OCc2ccc(C(=O)NNC(=O)[C@@H]3CCCO3)cc2)cc1 6635223 ZNPVQVOOQXUMOC-IBGZPJMESA-N 384.432 2.604 50 40 GFGB Cc1cccc(C(=O)N[C@H](C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)C(C)C)c1 6924206 SHRFYRWFCYVNNZ-IUOVYFEOSA-N 382.420 2.808 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1F)c1cccc2ccccc12 19955161 NVXBZIOSQLSKBL-LPYMAVHISA-N 399.447 2.895 50 40 GFGB Cc1ccccc1OCC(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c1ccccc1O 408970522 AUTZMTDEATXMEL-XNQWGTPPSA-N 397.475 2.761 50 40 GFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccccc1Cl 47080832 PAZPPFQIKQIQKN-NSHDSACASA-N 392.242 2.808 50 40 GFGB I[C@H]1[C@@H]2[C@@H]3C[C@@H]4[C@@H]5[C@@H](I)[C@H]([C@H]42)[C@H]1[C@@H]53 261361229 NMQHCEGZBHEZIR-XIBHNDMSSA-N 398.025 2.981 50 40 GFGB COc1ccc(CCNC(=O)[C@H]2CCCO[C@H]2C(Cl)Cl)cc1OC 1578197 OCMXCMKHBVNKJT-SWLSCSKDSA-N 376.280 2.961 50 40 GFGB O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1Cc1ccccc1 13001405 SYBYKAJKZAILCR-NRFANRHFSA-N 388.423 2.878 50 40 GFGB COc1cc(Br)c(O)c(/C=N/NC(=O)c2ccccc2OC)c1 408590190 NZTIGUOQHWHMGW-GIJQJNRQSA-N 379.210 2.936 50 40 GFGB COc1ccc(OC)c(NC(=O)NNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 5208591 VSBFSVLSTKHNSX-UHFFFAOYSA-N 377.313 2.669 50 40 GFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)N[C@@H](C)c2ccccc2)cc1OC 7869812 ZCLMSSDOAPVADT-WXUSHSQQSA-N 381.432 2.588 50 40 GFGB C=C(C)C(=O)OCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cccc(F)c1 2275819 IRFPIUAYLLUTQC-QGZVFWFLSA-N 386.379 2.570 50 40 GFGB CC1=NN(c2ccccc2)C(=O)/C1=C(\NNC(=O)c1cccnc1)C(F)(F)F 100509962 RIFXHACRVMYYIL-PFONDFGASA-N 389.337 2.555 50 40 GFGB COc1ccc(OC)c([C@@H]2CC(=O)N3C(=C2C#N)SC[C@@]3(O)c2ccco2)c1 12276259 GSAIAQWKFTUTHP-RNODOKPDSA-N 398.440 2.940 50 40 GFGB O=C(NNC(=O)c1cc(-c2cccs2)nc2ccccc12)c1ccc[nH]c1=O 12979505 BGDOADKETXRCRS-UHFFFAOYSA-N 390.424 2.726 50 40 GFGB Cc1ccc(S(=O)(=O)NCc2ccc(/C=N/NC(=O)c3ccccc3)o2)cc1 408779983 PHCGHWRSMFCFCE-FYJGNVAPSA-N 397.456 2.830 50 40 GFGB O=C(N/N=C/c1cc(Br)c(N2CCOCC2)o1)c1ccccc1 408853029 PFNZBCKEGJWXFP-WOJGMQOQSA-N 378.226 2.643 50 40 GFGB Cc1nc2ccsn2c1[C@H]1C(C#N)=C(N)Oc2c1c(=O)n(C)c1ccccc21 20086249 BWOGUYDPYZXQPC-HNNXBMFYSA-N 389.440 2.774 50 40 GFGB N=C1NC(c2ccccc2)=N[C@]1(NC(=O)Cc1ccccc1)C(Cl)Cl 101359255 LXBJFSLJFSHMJT-GOSISDBHSA-N 375.259 2.873 50 40 GFGB COc1ccccc1CNC(=O)C/C(C)=N/NC(=O)c1cc(Cl)ccc1O 100530224 FDFUJBHVRIBXRX-WSDLNYQXSA-N 389.839 2.866 50 40 GFGB COc1ccc(/C=C(\C#N)C(=O)NCCc2ccc(OC)c(OC)c2)cc1O 3320489 KDCUXSSTYDYVGO-MHWRWJLKSA-N 382.416 2.684 50 40 GFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccc([N+](=O)[O-])cc1 6615235 GEWYEWPSGYXXSI-XDHOZWIPSA-N 383.364 2.867 50 40 GFGB Cc1ccc(Cc2nnc(SCC(=O)NNC(=O)c3ccccc3)o2)cc1C 20196964 YQEDOXVGFGLSOX-UHFFFAOYSA-N 396.472 2.831 50 40 GFGB CCc1cccc(OCC(=O)NNC(=O)COc2ccc(Cl)cc2C)c1 12815353 FRNJBVAKUDBSSX-UHFFFAOYSA-N 376.840 2.816 50 40 GFGB CN(CCCNC(=O)NNC(=O)c1c[nH]c2ccccc12)Cc1ccccc1 32795513 OPXLZMIKAIOUKM-UHFFFAOYSA-N 379.464 2.634 50 40 GFGB Cc1cc2c(c(=O)n1Cc1ccccn1)[C@@H](c1ccccc1F)C(C#N)=C(N)O2 2258014 COIVLILXJVYWSS-IBGZPJMESA-N 388.402 2.957 50 40 GFGB CCOc1ccccc1/C=N/NC(=O)C(=O)Nc1cccc(Br)c1 59435527 RNSXYUOPECKIGU-YBFXNURJSA-N 390.237 2.937 50 40 GFGB N#Cc1ccccc1OCC(=O)NNC(=O)CSCc1cccc(Cl)c1 15978055 PMFHEQHIOUFQSM-UHFFFAOYSA-N 389.864 2.671 50 40 GFGB COc1cc(/C=N/NC(=O)COc2cccc(Br)c2)ccc1O 863179 IVBREBZOOUEWLK-GIJQJNRQSA-N 379.210 2.692 50 40 GFGB CCN(CC)Cc1ccc(C(=O)NNC(=O)C(C)(C)Oc2ccc(F)cc2)o1 40158814 JBOPYPFHHPKRGB-UHFFFAOYSA-N 391.443 2.879 50 40 GFGB Cc1cc(C)n2nc(C(=O)N/N=C/c3cc(Cl)cc(Cl)c3O)nc2n1 1081824 HYAHVRBSDAQZTE-NGYBGAFCSA-N 379.207 2.517 50 40 GFGB CN(NC(=O)c1ccc(Cl)cc1Cl)C1=NS(=O)(=O)c2ccccc21 1092575 PGBIHVUBAREEGJ-UHFFFAOYSA-N 384.244 2.719 50 40 GFGB COc1ccc(NS(=O)(=O)c2cccc(NC(=O)NCCCl)c2)cc1 4865405 PSBMSANLRLMWQG-UHFFFAOYSA-N 383.857 2.856 50 40 GFGB O=C(N/N=C1/C(=O)N(Cc2ccccc2)c2ccccc21)[C@H](O)c1ccccc1 5769337 FETFMZSYDFTTLB-KWLPWJRRSA-N 385.423 2.787 50 40 GFGB Cc1cc(Cl)ccc1OCC(=O)NNC(=O)/C=C/c1ccc2c(c1)OCO2 12883693 GZSUTXAUZZSEAV-XVNBXDOJSA-N 388.807 2.617 50 40 GFGB O=C(N/N=C/c1ccc(I)cc1)c1ccccc1[N+](=O)[O-] 408598986 MYFYTOFHNSAQTG-CXUHLZMHSA-N 395.156 2.963 50 40 GFGB COc1cc(/C=N/NC(=O)CNc2ccc(C)c(C)c2)ccc1O[C@@H](C)C(=O)O 409012763 KLRYCCVQCFALRK-QCXKMSLLSA-N 399.447 2.726 50 40 GFGB O=C(Oc1ccc(/C=N\NC(=O)[C@@H]2COc3ccccc3O2)cc1)c1ccco1 32110861 MHLGFPXTIIQACD-ZIHVZMLCSA-N 392.367 2.789 50 40 GFGB C/C(=N/NC(=O)CCCC(=O)N/N=C(\C)c1ccccc1O)c1ccccc1O 102139308 YJYPVNQVDQSVQN-OQRYGUKSSA-N 396.447 2.649 50 40 GFGB Cc1ccc(C)c(N(CC(=O)N/N=C/c2ccc(Cl)cc2)S(C)(=O)=O)c1 408776042 LGNQDGAVSKBWLW-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB COc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(Cl)cc2C)cc1OC 3060075 KXDKJYDTMIUDEO-KEBDBYFISA-N 375.812 2.754 50 40 GFGB N#C/C(=C\c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1 4063117 MEOZVEUWYRBPSL-FOWTUZBSSA-N 378.388 2.977 50 40 GFGB C[C@@H](OC(=O)/C(C#N)=C/c1ccc(N(C)C)cc1)C(=O)NC1(C#N)CCCCC1 6985839 SJZOKFFNIMSMMU-APVMCDBPSA-N 394.475 2.934 50 40 GFGB O=C(NNS(=O)(=O)c1ccccc1C(F)(F)F)c1ccc2ccccc2n1 12772122 GLQDPVSSOZAGPV-UHFFFAOYSA-N 395.362 2.877 50 40 GFGB COc1ccc2cc([C@@H](C)C(=O)NNC(=O)CN3CCCCCC3=O)ccc2c1 12790355 NLUBYVBDQKAXMR-OAHLLOKOSA-N 397.475 2.502 50 40 GFGB CC(C)Sc1ncc(Cl)c(C(=O)NNC(=O)c2ccccc2[N+](=O)[O-])n1 28287060 PSVLKLIGZSDZAA-UHFFFAOYSA-N 395.828 2.614 50 40 GFGB COc1ccc(C)cc1NC(=O)[C@@H](NNC(=O)c1cccn1C)c1ccccc1 32814698 CEKRIBUBRGSEAY-FQEVSTJZSA-N 392.459 2.957 50 40 GFGB CCN(CC)C(=O)Nc1ccc(OC[C@@H](O)CBr)c(C(C)=O)c1 39305649 COVQKIDNDABIDX-ZDUSSCGKSA-N 387.274 2.898 50 40 GFGB in-vitro COc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1ccc(OCC(N)=O)cc1 408810547 JAPASKRKHBIMIZ-MDWZMJQESA-N 385.807 2.758 50 40 GFGB Cc1cccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCc3ccco3)c2C)c1 408969787 UOMBBDHVXCHBOE-FSJBWODESA-N 378.432 2.762 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2ccccc2OC)cc(Cl)c1O 6958785 CKIYJTHHWZOSGX-KEBDBYFISA-N 391.811 2.542 50 40 GFGB CCn1c(C)nc2cc(C(=O)NNC(=O)Cc3c[nH]c4ccccc34)ccc21 2630488 SGKONTQWKCNANZ-UHFFFAOYSA-N 375.432 2.850 50 40 GFGB CC(C)CCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 12742261 NSXPRQKPTBYPRO-UHFFFAOYSA-N 392.463 2.586 50 40 GFGB Cc1ccccc1N(CC(=O)N/N=C/c1cccc(Cl)c1)S(C)(=O)=O 19954671 QTPKZYJZBUSXLX-YBFXNURJSA-N 379.869 2.565 50 40 GFGB COC(=O)[C@@H]1/C(=N/NC(=O)c2ccccc2)C[C@](C)(O)C[C@H]1c1ccccc1 100249744 UXDWCDGUZQAGFL-BQIKYIHRSA-N 380.444 2.890 50 40 GFGB COc1ccc(Br)cc1/C=N/NC(=O)C(=O)Nc1ccccc1F 7784911 XZDFTVATVLPGGM-DJKKODMXSA-N 394.200 2.686 50 40 GFGB CCOc1ccccc1OCC(=O)NNC(=O)c1ccc2c(c1)nc(C)n2CC 2628324 ZZOZRPUIZOLTLR-UHFFFAOYSA-N 396.447 2.603 50 40 GFGB COc1ccc(C(=O)N/N=C2\C(=O)Nc3c(Br)cc(C)cc32)cc1 6826261 DMAXGFJCBGTXTC-UHFFFAOYSA-N 388.221 2.852 50 40 GFGB CCn1c(NNC(=O)CC23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)nc2ccccc2c1=O 102666728 VDSJJZASXBNHDM-ZNAOMFPMSA-N 396.491 2.581 50 40 GFGB COC(=O)c1csc(-n2nc(-c3ccccc3)cc2NC(=O)CCl)n1 1415844 CMKWQYPHTGQEJE-UHFFFAOYSA-N 376.825 2.960 50 40 GFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc2ccccc12)c1ccccc1F 408774284 ULRWHBFTCNDZAH-LPYMAVHISA-N 399.447 2.895 50 40 GFGB Cc1cc(OCC(=O)NNC(=O)/C=C/c2ccco2)ccc1Br 1794826 JSZPQFDAQBHZQL-FNORWQNLSA-N 379.210 2.590 50 40 GFGB COC(=O)c1ccc(COc2ccc(/C=N/NC(=O)C3CC3)cc2OC)cc1 3261655 MVXDVVFULXVAAF-WSDLNYQXSA-N 382.416 2.921 50 40 GFGB CCn1c(C)nc2cc(C(=O)N/N=C/c3ccc(N4CCOCC4)cc3)ccc21 5160264 KCLNYCJMIPWOSG-HZHRSRAPSA-N 391.475 2.965 50 40 GFGB O=C(COc1ccc(Cl)cc1)NNC(=O)c1ccccc1Br 5173886 WRLNGGOSDOUEQM-UHFFFAOYSA-N 383.629 2.943 50 40 GFGB COc1ccc(/C=N/NC(=O)C2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 5558631 WSNCIEMWNXFSFD-HYARGMPZSA-N 396.447 2.966 50 40 GFGB CNC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1 9232166 AUXWKNVHRBZGFE-ZVBGSRNCSA-N 380.231 2.769 50 40 GFGB Cc1c(Cl)cccc1NC(=O)C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2 12632119 IIMAUFFSELBEDK-UHFFFAOYSA-N 389.883 2.951 50 40 GFGB COc1cc(/C=N/NC(=O)c2c(C)nc3ccc(C)cn23)cc(OC)c1OC 59444046 CYGWKFXCRHKQEF-UFFVCSGVSA-N 382.420 2.741 50 40 GFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C\c1cc([N+](=O)[O-])ccc1Cl 83311302 RMUODKJQZKPBOV-IUXPMGMMSA-N 378.728 2.686 50 40 GFGB COc1cccc(C(=O)N2CCC(C(=O)N/N=C/c3ccccc3OC)CC2)c1 409006117 MGCLKZRNSODCJQ-HZHRSRAPSA-N 395.459 2.706 50 40 GFGB COc1cc(OC)c(/C=N/NC(=O)COc2cccc3cccnc23)c(OC)c1 5047123 URWHVXNSHLIOHV-FSJBWODESA-N 395.415 2.790 50 40 GFGB O=C(CNc1ccc(F)cc1)N/N=C/c1ccc(I)o1 409363385 VTJUJDORAPCMTR-REZTVBANSA-N 387.152 2.586 50 40 GFGB N#C/C(=C\c1ccc(OCc2nc3ccccc3[nH]2)cc1)C(=O)N1CCOCC1 408764574 URMZOWIEYDIOKD-GHRIWEEISA-N 388.427 2.908 50 40 GFGB COC(=O)c1ccc(NC(=O)C(=O)N/N=C\c2ccc(C(C)(C)C)cc2)cc1 223160787 CLPBTZBVEDNTDA-XKZIYDEJSA-N 381.432 2.860 50 40 GFGB COc1ccc(/C=N/NC(=O)CC(=O)Nc2cccc(Cl)c2)c(OC)c1 1437732 BUKCNQSXDNLJLK-RGVLZGJSSA-N 375.812 2.836 50 40 GFGB Cc1ccc([C@@H]2C(C#N)=C(N)N(N3CCOCC3)C3=C2C(=O)CC(C)(C)C3)cc1 690773 BVHGOGFNGJOLRC-HXUWFJFHSA-N 392.503 2.979 50 40 GFGB CCOc1c(Br)cc(C(=O)NNC(=O)c2ccc(C)o2)cc1OC 9254535 FRZRJRPFOUJBCD-UHFFFAOYSA-N 397.225 2.833 50 40 GFGB O=C(CCCC[C@H]1CCSS1)NCCn1nnc2ccccc2c1=O 238872346 NFFXMDRKJPYVGR-ZDUSSCGKSA-N 378.523 2.622 50 40 GFGB O=C(Cc1ccc(F)cc1)N/N=C\c1ccc(O)c(I)c1 409230527 FCPQGIPZOLLGJR-NVMNQCDNSA-N 398.175 2.829 50 40 GFGB COc1ccc(OC)c2sc(NNC(=O)[C@H]3COc4ccccc4O3)nc12 4121484 FVLYGTCKGREEMR-CQSZACIVSA-N 387.417 2.597 50 40 GFGB N/C(=N\NC(=O)C/C=N/OCc1ccc(Cl)cc1Cl)c1cccnc1 6883702 MAENCYAENHQJPC-QPSGOUHRSA-N 380.235 2.718 50 40 GFGB CCc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(Cl)cc3)CC2=O)cc1 8316885 ZKCMRZFRQCTOEU-HNNXBMFYSA-N 385.851 2.717 50 40 GFGB Cc1cc(C)nc(NNC(=O)Cc2ccc(OCc3c(C)noc3C)cc2)n1 11333749 JMRONYIATGZMPL-UHFFFAOYSA-N 381.436 2.963 50 40 GFGB Cc1ccc(-c2cc(C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)n[nH]2)s1 32795742 MYCNWBATGLPSCB-NSHDSACASA-N 388.424 2.814 50 40 GFGB N#CC1=C(SCC(N)=O)N=C2CCCC(O)=C2[C@@H]1c1ccc2c(c1)OCO2 100088280 XLQCEPLXQUIMFT-QGZVFWFLSA-N 383.429 2.903 50 40 GFGB C#CCOc1ccc(/C=C(/C#N)C(=O)NCc2ccc(OC)cc2)cc1OC 408812185 CKQFLKMTEDKCGX-PDGQHHTCSA-N 376.412 2.939 50 40 GFGB C#CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)cc1Br 409140310 RFHXAFHKJGUBFD-OAHLLOKOSA-N 385.221 2.711 50 40 GFGB Cc1ccc(C(=O)N/N=C/c2cc(I)cc(C)c2O)cn1 4724836 XGLYMZLNCUOPIY-QGMBQPNBSA-N 395.200 2.773 50 40 GFGB Cc1ccc(N2C[C@@H](C(=O)N/N=C/c3cccc([N+](=O)[O-])c3)CC2=O)cc1C 409163140 MJQJXLZHGGNCBV-XYHOIZSOSA-N 380.404 2.715 50 40 GFGB CCOc1cc(/C=N/NC(N)=O)cc(Cl)c1OS(=O)(=O)c1ccccc1 408889712 GAXPFIVMCCXDJW-VXLYETTFSA-N 397.840 2.509 50 40 GFGB C=CC(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c1 1135459432 NIIURVXVOMDJHQ-NSHDSACASA-N 399.472 2.778 50 40 GFGB Cc1ccccc1N(CC(=O)N/N=C/c1ccc(C)c(C)c1C)S(C)(=O)=O 20207633 QIWCLGIEQAAVCV-CIAFOILYSA-N 387.505 2.837 50 40 GFGB O=C(N/N=C\c1ccc([N+](=O)[O-])o1)c1ccccc1I 4656817 IZAKUIFRJIITHH-AUWJEWJLSA-N 385.117 2.556 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)c([N+](=O)[O-])cc1OC 408678535 ZYQWQCCDSVSFKH-FYJGNVAPSA-N 398.419 2.976 50 40 GFGB CCOc1ccc([C@@H]2CC(=O)NC(SCC(=O)NCC(C)C)=C2C#N)cc1 6963677 WXFKMOUCADEWEX-INIZCTEOSA-N 387.505 2.929 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(Cl)cc2)ccc1O[C@@H](C)C(=O)O 409010095 JMAMYQFRVGQIHR-KKBVUKDESA-N 376.796 2.964 50 40 GFGB C[C@@H](NC(=O)Nc1ccccc1)C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 40161105 OITSVIVEPFMYAH-CQSZACIVSA-N 382.464 2.955 50 40 GFGB COc1ccc(OC)c(C(=O)NNC(=O)COc2ccc(Cl)c(C)c2)c1 12898395 DUKJKWGZFWBECM-UHFFFAOYSA-N 378.812 2.506 50 40 GFGB O=C(NNC(=O)[C@@H]1CCCC[C@H]1C(=O)O)C(c1ccccc1)c1ccccc1 17077754 GXJAMTYDNUGGRX-QZTJIDSGSA-N 380.444 2.857 50 40 GFGB COCCN1C(=O)C(C#N)=C(C)/C(=C/Nc2cccc(C(F)(F)F)c2)C1=O 8993313 WSYQUBQRGARJCI-GDNBJRDFSA-N 379.338 2.856 50 40 GFGB CCCCC(=O)NN/C=C1/C(=O)N(c2cccc(Cl)c2)C(=S)N=C1O 16995122 RVDRQVCVOCAWCA-FMIVXFBMSA-N 380.857 2.623 50 40 GFGB COc1cc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)cc([N+](=O)[O-])c1O 7383963 VNSVJUAJLARRFK-UDWIEESQSA-N 384.392 2.673 50 40 GFGB CCOC(=O)N(NC(=O)c1ccc(N(CCCl)CCCl)cc1)C(C)=O 1558674 GCNUQRIVWJMQOH-UHFFFAOYSA-N 390.267 2.620 50 40 GFGB Cc1cc(OCC(=O)NNC(=O)CCc2ccccc2)ccc1Br 4996273 WYRNAPOXYUFTFF-UHFFFAOYSA-N 391.265 2.917 50 40 GFGB CCOc1cc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc([N+](=O)[O-])c1O 36178017 OPIICDAILVOTSJ-DJKKODMXSA-N 393.783 2.882 50 40 GFGB CCOc1cc(/C=C(/C#N)C(N)=O)ccc1OCC(=O)Nc1ccc(C)cc1 98086500 IJXGGCLGTHVXCU-YBEGLDIGSA-N 379.416 2.804 50 40 GFGB O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(SC(F)(F)F)cc1 24986879 IEUKCYUPXDVCJH-AWEZNQCLSA-N 398.362 2.900 50 40 GFGB C#CCOc1ccc(Br)cc1/C=N/NC(=O)COc1ccccc1 59471523 TZPKACLGRBHCJN-UDWIEESQSA-N 387.233 2.990 50 40 GFGB CCCOc1ccc(C(=O)NNC(=O)[C@@H](C(C)C)N2CCCCC2)cc1OC 48289569 XVIKGIRYTAIGLP-LJQANCHMSA-N 391.512 2.756 50 40 GFGB Cc1ccc(OCC(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)c([N+](=O)[O-])c1 9355246 GVGQMNDQAICDQN-QGMBQPNBSA-N 392.755 2.994 50 40 GFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(O)c(Br)c2)n1 8336668 AKYVUUJPBCJGDI-REZTVBANSA-N 395.282 2.804 50 40 GFGB O=C1NC[C@@H](c2ccccc2)[C@@H]1C(=O)N/N=C\c1ccc(Cl)c(Cl)c1 30885244 BYEYZZODDDCIDU-ATZUCEEVSA-N 376.243 2.973 50 40 GFGB O=C(NNC(=O)c1cnn(-c2ccccc2F)c1C(F)(F)F)c1cccnc1 32755357 TYOJQCZHSCWENQ-UHFFFAOYSA-N 393.300 2.500 50 40 GFGB Cn1c(CC(=O)NNC(=O)c2cc(F)c(F)cc2Cl)nc2ccccc21 2621879 BHIBONQYDCDITO-UHFFFAOYSA-N 378.766 2.509 50 40 GFGB Cc1ccc(C(=O)NC(=S)NNC(=O)c2ccccc2Br)cc1 12137344 ZFTLFRPPCBLLKO-UHFFFAOYSA-N 392.278 2.707 50 40 GFGB COc1ccc(C(=O)NNc2ncnc3c2cnn3-c2ccc(F)cc2)cc1 16953392 WVUSRJMVKFTANZ-UHFFFAOYSA-N 378.367 2.720 50 40 GFGB CCOc1ccccc1/C=N/NC(=O)C(=O)Nc1ccc(OC)c(Cl)c1 58884785 KIJHNHBOILDYFQ-RGVLZGJSSA-N 375.812 2.836 50 40 GFGB C=CCc1cc(/C=C(/C#N)C(=O)N(C)C)cc(Br)c1OCC(=O)O 59334834 NIEFMYVDIBXSMP-QPEQYQDCSA-N 393.237 2.636 50 40 GFGB CN1C(=O)[C@]2(C(C#N)=C(N)N3C(=C2C#N)Sc2ccccc23)c2ccccc21 207047393 OBDVQHCXJCAJBH-NRFANRHFSA-N 383.436 2.956 50 40 GFGB Cc1nn(C)c(F)c1/C=N/NC(=O)c1cc(-c2ccco2)nc2onc(C)c12 252500646 SZRYKAOWYRKKTA-DNTJNYDQSA-N 382.355 2.736 50 40 GFGB Cc1c(C(=O)N/N=C\c2ccc(Cl)cc2)nn(-c2ccccc2)c(=O)c1C#N 409061900 JUNXZOGTTGIZRG-FMCGGJTJSA-N 391.818 2.830 50 40 GFGB COc1cc(N2CCOCC2)ccc1/C=N/NC(=O)CNc1ccc(C)c(C)c1 409222998 YJCWHDNHTXNCPU-ZVHZXABRSA-N 396.491 2.711 50 40 GFGB COc1ccc(C(=O)NNC(=O)COc2ccc(Br)c(C)c2)cc1 831998 HWCOAQOCBYONCH-UHFFFAOYSA-N 393.237 2.606 50 40 GFGB N#CCC(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2F)c(Cl)c1 6227119 YRNJBRQZAQMLFZ-LSHDLFTRSA-N 388.786 2.860 50 40 GFGB CCc1c(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cnn1-c1cccc(C)c1 32795001 QUJLEAYZCMQDPS-UHFFFAOYSA-N 393.403 2.726 50 40 GFGB O=C(CN1CCOCC1)N/N=C\c1cn(Cc2ccc(F)cc2)c2ccccc12 59246485 WEQXAFIDQPMORZ-CFRMEGHHSA-N 394.450 2.611 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C\N2CCN(Cc3ccccc3)CC2)cc1 102673244 MMDKPGRMHFWAQZ-UZYVYHOESA-N 390.487 2.537 50 40 GFGB CCCCCCCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 102819322 AWRNHNQWBBFUPM-UHFFFAOYSA-N 395.525 2.593 50 40 GFGB O=C(CCCC[C@@H]1CCSS1)NCCn1c(O)nc2ccsc2c1=O 238845429 IEXTXPNZWCPZOB-LLVKDONJSA-N 399.563 2.994 50 40 GFGB Cc1cccc(/C=N/NC(=O)CN(c2ccc(Cl)cc2C)S(C)(=O)=O)c1 408786686 MEDVRQDXUWYYST-RGVLZGJSSA-N 393.896 2.873 50 40 GFGB COc1cc(C(=O)N/N=C/c2ccccc2O)ccc1I 4739606 PFCKJIOAGPMCHE-RQZCQDPDSA-N 396.184 2.769 50 40 GFGB C=CCn1c(SCC(=O)NNC(=O)c2ccc(OC)cc2)nc2ccccc21 11650843 BHUUNOPOZCXDTF-UHFFFAOYSA-N 396.472 2.784 50 40 GFGB COc1ccc(CNC(=O)/C(C#N)=C/N2CCN(Cc3ccccc3)CC2)cc1 19897667 MMDKPGRMHFWAQZ-DYTRJAOYSA-N 390.487 2.537 50 40 GFGB C[C@@H](C(=O)N/N=C\c1ccc(O)cc1)n1cnc2sc3c(c2c1=O)CCCC3 31858940 XWHZHJCHRGAUQR-DMBOVMDOSA-N 396.472 2.754 50 40 GFGB Cc1nn(-c2ccc(F)cc2F)c(C)c1CC(=O)NNC(=O)c1ccoc1C 40128898 SNKCUCOOGBFLME-UHFFFAOYSA-N 388.374 2.672 50 40 GFGB O=C(Cl)c1nnc2sc(-c3ccc(I)cc3)nn12 57339037 QRUHTFDOFSMELO-UHFFFAOYSA-N 390.593 2.836 50 40 GFGB O=[N+]([O-])c1cnc2c(c1)CN(S(=O)(=O)c1ccc(CCCCl)cc1)CC2 95941917 IRCSTXDNBVQFMP-UHFFFAOYSA-N 395.868 2.908 50 40 GFGB CC(C)OCCCNC(=O)C(=O)N/N=C/c1ccccc1OCc1ccccc1 408616388 YLNXSFDSGYQZCT-BUVRLJJBSA-N 397.475 2.647 50 40 GFGB COc1ccccc1OCC(=O)N/N=C\c1cccn1-c1cccc(C(=O)O)c1 409109119 YALPIDMMHICRBP-XKZIYDEJSA-N 393.399 2.713 50 40 GFGB Cc1ccc(/C=N/NC(=O)c2[nH]c(C)c(C(=O)N/N=C/c3ccc(C)o3)c2C)o1 3009522 QYUOJEXINOZWPL-VGENTYGXSA-N 395.419 2.962 50 40 GFGB COc1ccc(CC(=O)N/N=C/c2cc(Cl)cc(OC)c2O)cc1OC 4735419 PEOZDMHFQGHNRW-KEBDBYFISA-N 378.812 2.764 50 40 GFGB Cc1ccc2c(c1)[C@]1(C=C3c4cc5c(cc4CCN3C(N)=C1C#N)OCO5)C(=O)N2 5427714 KUWSGSRQGQHIAI-QHCPKHFHSA-N 398.422 2.520 50 40 GFGB COc1ccc(C(=O)NNC(=O)CSc2nnc(-c3ccccc3C)o2)cc1 6548087 CTGQYEZMNAXGHB-UHFFFAOYSA-N 398.444 2.607 50 40 GFGB CCOc1ccc(C(=O)N/N=C/c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1 20764427 XLQYHRTYUDYRSM-KGENOOAVSA-N 398.419 2.594 50 40 GFGB CCCCOc1cccc(C(=O)NC(=S)NNC(=O)c2cccs2)c1 6592694 WJDFZNIWDKXEKY-UHFFFAOYSA-N 377.491 2.876 50 40 GFGB CCn1c(NNC(=O)CCOc2cccc(C)c2C)nc2ccccc2c1=O 24907391 PFUAONSHSLSUAA-UHFFFAOYSA-N 380.448 2.945 50 40 GFGB COc1ccc(C(=O)NNC(=O)CCc2ncc(-c3ccc(F)cc3)o2)cc1 14056059 BRBARWWAMCUEDQ-UHFFFAOYSA-N 383.379 2.883 50 40 GFGB COc1cc([C@H](C)NC(=O)NCCNC(=O)[C@@H](C)Cl)ccc1OC(C)C 65607585 ULKWWAMIUFZXET-OLZOCXBDSA-N 385.892 2.586 50 40 GFGB Cc1c(C(=O)NNC(=O)Cc2nc3ccccc3n2C)oc2c(C)cccc12 53089974 IPMJSIAUPJUMPY-UHFFFAOYSA-N 376.416 2.940 50 40 GFGB C/C(=N\NC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)c1ccccc1 705531 FHFBEPGSAJQVFA-OQKWZONESA-N 399.516 2.936 50 40 GFGB COc1cc(Cl)cc(/C=N/NC(=O)c2cncc(Br)c2)c1O 2330088 FBCAVJUKRPQENZ-NGYBGAFCSA-N 384.617 2.976 50 40 GFGB Cc1ccc(C)c(N2C[C@@H](C(=O)NNC(=O)c3ccc(Cl)cc3)CC2=O)c1 7882266 UZDDWOZKCYUCEI-HNNXBMFYSA-N 385.851 2.771 50 40 GFGB COc1cc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)cc(Cl)c1O 8336644 WDYIPKSVRYSASI-CNHKJKLMSA-N 380.857 2.703 50 40 GFGB CCc1ccc(-c2nc(C(=O)NNC(=O)N3C[C@H](C)O[C@@H](C)C3)cs2)cc1 9578182 MFCBSHRKJPGWLN-STQMWFEESA-N 388.493 2.836 50 40 GFGB CCOc1ccc(NC(=O)[C@@H]2[C@@H]3C[C@@H]4[C@@H]2C(=O)O[C@@H]4[C@@H]3Br)cc1 102620400 RYLVDSDJJUYXRX-MTWVNVMRSA-N 380.238 2.595 50 40 GFGB Cc1ccc(N2C[C@H](C(=O)N/N=C/c3cccc([N+](=O)[O-])c3)CC2=O)cc1C 409163139 MJQJXLZHGGNCBV-BTZNOAQDSA-N 380.404 2.715 50 40 GFGB COc1cc(/C=N/NC(=O)C(=O)Nc2cccc(C)c2C)cc(Cl)c1O 409171734 GCSMZYXOZALFST-AWQFTUOYSA-N 375.812 2.760 50 40 GFGB Cc1ccc2c(c1Br)/C(=N/NC(=O)C1[C@H]3CCCC[C@H]13)C(=O)N2 100505627 PALHEPDOGAHVEN-UWVGGRQHSA-N 376.254 2.966 50 40 GFGB Cc1ccc(S(=O)(=O)Oc2ccc(/C=C(\C#N)C(N)=O)cc2Cl)cc1 408878571 BZKAHFDREMMZJQ-MDWZMJQESA-N 376.821 2.808 50 40 GFGB Cc1cc(/C=C(/C#N)C(=O)N2CCOCC2)c(C)n1-c1cccc([N+](=O)[O-])c1 408779248 SSILSJXXIPUQFJ-BOPFTXTBSA-N 380.404 2.768 50 40 GFGB C/C(=N\NC(=O)CN(c1cc(C)ccc1C)S(C)(=O)=O)c1cccs1 408867492 LBOAIGCWKNQGCY-NBVRZTHBSA-N 379.507 2.671 50 40 GFGB CCc1n[nH]c(=O)c(CNS(=O)(=O)c2ccc(CCCCl)cc2)c1CC 83817668 ATAOFLAZZSBKMH-UHFFFAOYSA-N 397.928 2.545 50 40 GFGB O=C(CNc1cccc(Br)c1)N/N=C/c1cc([N+](=O)[O-])ccc1O 36020543 KWYNTNDIKASWFI-QGMBQPNBSA-N 393.197 2.625 50 40 GFGB C/C(=N\NC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)c1ccc[nH]1 8043251 PWSLXELMZLGHEH-BUVRLJJBSA-N 385.427 2.927 50 40 GFGB COC(=O)c1c(NC(=O)/C(C#N)=C/c2sccc2C)sc(C(N)=O)c1C 17079479 HBBYWVCUVHUJMR-UXBLZVDNSA-N 389.458 2.858 50 40 GFGB O=C(NNC(=O)N1CCN(Cc2c(F)cccc2Cl)CC1)c1ccccc1 40068953 VAFZPPFEGSZYAO-UHFFFAOYSA-N 390.846 2.651 50 40 GFGB Cc1sc(NC(=O)CCl)nc1-c1ccc2c(c1)CCN2S(C)(=O)=O 1365872 BQDPGWGQEICVQW-UHFFFAOYSA-N 385.898 2.618 50 40 GFGB CCOc1cc(C(=O)NNC(=O)c2ccoc2C)cc(OCC)c1OCC 6342732 KRMMIRKZNZGKMN-UHFFFAOYSA-N 376.409 2.859 50 40 GFGB COC(=O)C1=C2S[C@H](C)C(=O)N2C(N)=C(C#N)[C@@H]1c1c(F)cccc1Cl 5478195 SHVSKEYZHWLYLG-RDDDGLTNSA-N 393.827 2.619 50 40 GFGB O=C(N/N=C1/C(=O)N(Cc2ccccc2)c2ccccc21)[C@@H](O)c1ccccc1 5769342 FETFMZSYDFTTLB-VLBGROSNSA-N 385.423 2.787 50 40 GFGB CN1[C@@H]2C=C3C(C#N)=C(N)C(C#N)(C#N)[C@H](c4c(F)cccc4F)[C@H]3[C@H]1CC2 20057271 JBPGDEKLKIFDTA-OBPDSEFTSA-N 377.398 2.851 50 40 GFGB COc1ccc(/C=N/NC(=O)CSc2nnc(-c3ccccc3)n2C)cc1 1085716 IVGZUEBCWSILQF-UDWIEESQSA-N 381.461 2.733 50 40 GFGB N#C/C(=C\c1cc2c(cc1Br)OCO2)C(=O)NCc1ccco1 6221994 PMDCVUROUHWOEV-NYYWCZLTSA-N 375.178 2.994 50 40 GFGB O=C(CN1CCOCC1)N/N=C/c1ccc(-c2cccc(C(F)(F)F)c2)o1 59246913 OOOZTADLAPLFJC-SSDVNMTOSA-N 381.354 2.748 50 40 GFGB O=C(COc1ccc(Cl)cc1)NNC(=S)NCCCc1ccccc1 96285255 VHTYTQBZRUPCTE-UHFFFAOYSA-N 377.897 2.847 50 40 GFGB O=C(CCc1ccccc1)NNc1cc(N2CCCC2)nc(N2CCCC2)n1 1063310 PXRMXFXKZIXTEP-UHFFFAOYSA-N 380.496 2.753 50 40 GFGB COC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1ccccc1I 1515266 OFFRQPPKFGRENT-ZDUSSCGKSA-N 396.184 2.546 50 40 GFGB COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc(C)n(C[C@@H]3CCCO3)c(=O)c21 2246982 QVSCHRZXAANOFC-IFXJQAMLSA-N 393.443 2.563 50 40 GFGB COc1ccc(OC)c(S(=O)(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1 7381182 HWZSUPSYIKWXOF-UHFFFAOYSA-N 392.477 2.625 50 40 GFGB CCOc1ccc(C(=O)N/N=C/c2ccc(OCC(=O)O)c(OCC)c2)cc1 20764761 DJJZDLHPBCXFME-CIAFOILYSA-N 386.404 2.711 50 40 GFGB COc1ccc(NC(=O)C(=O)N/N=C\c2c(F)cccc2Cl)c(OC)c1 59444791 PEXJGAUECPNMGV-UKWGHVSLSA-N 379.775 2.585 50 40 GFGB CCOc1ccc(OCCCC(=O)NNC(=O)COc2ccccc2C)cc1 9721161 CGFNCVKVZBSNAH-UHFFFAOYSA-N 386.448 2.779 50 40 GFGB COc1ccc(C(=O)NNc2ncnc3c2cnn3-c2ccccc2)cc1OC 20662204 BDOMPRBPJPMIHZ-UHFFFAOYSA-N 390.403 2.590 50 40 GFGB CCOC(=O)/C(C#N)=C/c1c(Oc2ccc(OC)cc2)nc2ccccn2c1=O 2439151 YFBNYWPILBBBRF-WYMLVPIESA-N 391.383 2.965 50 40 GFGB COc1c(OC(C)=O)ccc(/C=N\NC(=O)c2ccc(Cl)cc2)c1[N+](=O)[O-] 4775409 ZFIKZCVREJXVNY-OCKHKDLRSA-N 391.767 2.946 50 40 GFGB Nc1nonc1C(=O)N/N=C/c1ccc(OCc2c(F)cccc2Cl)cc1 408735684 VFIQMVMXHDJPTO-ODCIPOBUSA-N 389.774 2.787 50 40 GFGB COc1ccccc1C(=O)N/N=C/c1cc(Cl)c(OCC(=O)O)c(OC)c1 409263211 IIDRYNRHBKDOEH-AWQFTUOYSA-N 392.795 2.585 50 40 GFGB O=C(N/N=C\c1cc([N+](=O)[O-])cc(Br)c1O)c1ccccc1O 98028268 MCDBNKHOELHMHB-APSNUPSMSA-N 380.154 2.532 50 40 GFGB Cc1[nH]nc2c1[C@@]1(C(=O)N(CCc3ccccc3)c3ccccc31)C(C#N)=C(N)O2 4123528 ZMBQAQJWNKUYSC-QHCPKHFHSA-N 397.438 2.680 50 40 GFGB COC(=O)COc1ccc(/C=N/NC(=O)c2cccs2)cc1Br 4739160 XWYMZWAIAXYNTL-CAOOACKPSA-N 397.250 2.826 50 40 GFGB O=C(N/N=C/c1ccc(O)c(I)c1)c1ccccc1F 5867063 QTEAOGWINXCCQL-CAOOACKPSA-N 384.148 2.900 50 40 GFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(Cl)cc3[N+](=O)[O-])[C@@H]2C1 16034611 JGZZABLJRHXUOW-NVXWUHKLSA-N 394.822 2.603 50 40 GFGB COc1cc(OC)cc(C(=O)N/N=C(\C)CC(=O)Nc2ccccc2OC)c1 16137022 DJBDQGXEJYNORT-LPYMAVHISA-N 385.420 2.847 50 40 GFGB O=C(COc1ccc(/C=N/NC(=O)c2cccnc2)cc1)NCc1ccccc1 28214918 OSGAEHUMANSKCL-AFUMVMLFSA-N 388.427 2.541 50 40 GFGB NC(=O)Cn1cc(/C=N\NC(=O)c2ccc(-n3cccc3)cc2)c2ccccc21 33568932 GLDGDOHWTXBQBT-CFRMEGHHSA-N 385.427 2.681 50 40 GFGB CCOc1cc(/C=N/NC(=O)C(=O)NC)cc(Cl)c1OCc1ccccc1 408611686 RPWPISAFDOFXCR-SSDVNMTOSA-N 389.839 2.514 50 40 GFGB