smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features COC(=O)COc1c(Cl)cc(/C=N/NC(=O)CC2(C)SCCS2)cc1OC 409366526 VNEYAZCFCGRJIN-DJKKODMXSA-N 432.951 2.937 50 40 IFGB CCOC(=O)C1=C(C)N(c2nonc2NC(C)=O)C(N)=C(C#N)[C@@H]1c1ccccc1Cl 718965 BXTDJMAIGYPIIM-INIZCTEOSA-N 442.863 2.816 50 40 IFGB CCOC(=O)C1=C(CCl)NC(=O)N[C@H]1c1cn(-c2ccc(C)cc2)nc1C(=O)OCC 71195287 BLDWHCKVLUELPQ-KRWDZBQOSA-N 446.891 2.767 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc([N+](=O)[O-])c1)c1cc(Cl)cc(Cl)c1 408789458 LAJVZUVDCRWDHG-DJKKODMXSA-N 445.284 2.818 50 40 IFGB COc1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)cc1 408841972 HLHIJDBQJWWGEA-UHFFFAOYSA-N 434.408 2.931 50 40 IFGB COc1cc(/C=N/NC(N)=O)c(Br)cc1OCC(=O)Nc1ccccc1C 1002179 SSPNMTUZBSDUBV-ZVBGSRNCSA-N 435.278 2.786 50 40 IFGB Cc1ccc(SCc2c(C(=O)N/N=C/c3cccs3)nnn2-c2nonc2N)cc1 2454450 BAQNAMJNGUDSQY-AWQFTUOYSA-N 440.514 2.659 50 40 IFGB CCCC(=O)Nc1ccc(C(=O)NNC(=S)NC(=O)/C=C/c2ccc(F)cc2)cc1 2551644 YQCXEYIDZOIJAF-AWNIVKPZSA-N 428.489 2.913 50 40 IFGB CN(CC(=O)N/N=C/c1ccc(Br)cc1)S(=O)(=O)c1ccc(Cl)cc1 16186910 XCFURYMVXATJFW-VXLYETTFSA-N 444.738 2.873 50 40 IFGB C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)COC(=O)CCl 118916407 MHUNHTADZGKXNC-OSKMNGBNSA-N 438.948 2.571 50 40 IFGB Cc1ccccc1NC(=O)C(=O)N/N=C/c1cccc(OCC(=O)NCc2ccccc2)c1 409150244 APHJRNLTMZZTRY-JVWAILMASA-N 444.491 2.779 50 40 IFGB Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@H](C)NC(=O)C(C)(C)C)cc2)n1 12946851 IEAXFFFJSHXXMC-HNNXBMFYSA-N 443.573 2.698 50 40 IFGB O=C(CN1C(=O)[C@@H]2C[C@H](Br)[C@H](Br)C[C@H]2C1=O)Nc1ccccc1 408673347 RGSNOYYCDPZIFD-LPWJVIDDSA-N 444.123 2.547 50 40 IFGB Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1C 12799432 CXEVTACHMPCDGV-UHFFFAOYSA-N 431.558 2.731 50 40 IFGB O=C(CN1CCOCC1)NNc1nc(-c2ccccc2)c2cc(Br)ccc2n1 19939797 QJNOZHZYQOMYHW-UHFFFAOYSA-N 442.317 2.835 50 40 IFGB N#C/C(=C\Nc1ccc(S(=O)(=O)N=C(N)N)cc1)c1nc(-c2ccc(F)cc2)cs1 2207400 OTRHTJSEESSWTB-JLHYYAGUSA-N 442.501 2.888 50 40 IFGB CCOc1cccc(/C=N\NC(=O)CN(C)S(=O)(=O)c2ccc3ccccc3c2)c1O 16693313 TYEIBEZMBMWZLL-UCQKPKSFSA-N 441.509 2.715 50 40 IFGB C=CCOC(=O)C1=C(C)NC(SCC(=O)OC)=C(C#N)[C@H]1c1ccc(O)c(OC)c1 20102460 ADELYZAWBRMVMU-LJQANCHMSA-N 430.482 2.732 50 40 IFGB Cc1ccc(C)c(N(CC(=O)N/N=C/c2cccc(OC3CSC3)c2)S(C)(=O)=O)c1 20208345 ZLWAMKMQPCIOSX-SSDVNMTOSA-N 447.582 2.714 50 40 IFGB C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1occc1CS(=O)(=O)c1ccccc1 22021428 MWNNPCSLYYHTDY-CQSZACIVSA-N 446.456 2.621 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)CN(c2cccc(Cl)c2)S(C)(=O)=O)cc1OC 408773608 VQRHOVIQQOGZOT-FYJGNVAPSA-N 439.921 2.664 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc(Br)c1)c1ccccc1F 408780246 ABNUFBSYHPNSRQ-VXLYETTFSA-N 428.283 2.505 50 40 IFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cccc(I)c3)[C@@H]2C1 13512373 ODBHAECLMWZLON-IAGOWNOFSA-N 441.276 2.646 50 40 IFGB C=CCn1c(=S)[nH]c2cc(C(=O)NNC(=O)c3cc4c(s3)CCC4)ccc2c1=O 17445647 ASDYHMQTIODULF-UHFFFAOYSA-N 426.523 2.870 50 40 IFGB CO[Si](O[Si](OC)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1 196667145 CDHRQJOOOVAAFQ-UHFFFAOYSA-N 442.663 2.809 50 40 IFGB in-vitro Cc1ccc(NC(=O)COC(=O)CCC(=O)NNC(=O)c2ccccc2Cl)c(C)c1 408645365 LFKPFQIDWSQXJD-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB Cn1nc(C(=O)NNC(=O)c2ccccc2COc2ccccc2)c2ccccc2c1=O 12928276 UMNCXPQDBYJWHB-UHFFFAOYSA-N 428.448 2.587 50 40 IFGB C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1CSc1ccccc1)c1ccc(C)cc1 13751604 GMGWCDSLXAEYTQ-OEAKJJBVSA-N 448.512 2.987 50 40 IFGB COc1ccc([C@H]2C(C#N)=C(SCC(N)=O)NC3=C2C(=O)CC(C)(C)C3)cc1OC 16577800 ZWKOYCQYKDGFNQ-IBGZPJMESA-N 427.526 2.987 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccncc2)S(=O)(=O)c2ccc(C)cc2)cc1 408859372 SWDDCTIRBPBAKH-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB COc1cc(Br)cc2cc(C(=O)N/N=C/c3ccc(OCC(N)=O)cc3)oc12 408961185 BGTMZZNQYUWJBY-LSFURLLWSA-N 446.257 2.832 50 40 IFGB C[C@H](Oc1ccccc1Br)C(=O)NNC(=O)c1cc2ccccc2oc1=O 649803 CYWWWQJVQDRETR-NSHDSACASA-N 431.242 2.784 50 40 IFGB COc1cccc(/C=N/NC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c1O 9663406 YHQXFDBWDZRHAN-AFUMVMLFSA-N 428.448 2.923 50 40 IFGB Cc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)[C@@H](C)Oc1c(C)cc(Cl)cc1C 15385732 GUBVZULBOGMFCL-CQSZACIVSA-N 438.933 2.897 50 40 IFGB CCOc1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)ccc1OCCN1CCOCC1 19852988 NBLDUFBWOKWINZ-QFIPXVFZSA-N 439.512 2.611 50 40 IFGB COc1cccc([C@@H]2C(C#N)=C(N)OC3=C2S(=O)(=O)N(C)c2ccccc23)c1OC 20558289 HULHKFLCEQOVDJ-QGZVFWFLSA-N 425.466 2.660 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)[C@@H](C)N(c2ccc(OCC)cc2)S(C)(=O)=O)cc1 408925182 NJZFYUZSEGEVMR-BXDFRRGMSA-N 445.541 2.955 50 40 IFGB COc1cc(/C=N\NC(=O)c2ccc(Cl)cc2)cc(Br)c1OCC(N)=O 409255411 KDLSRCOQSKOAJA-WNFQYIGGSA-N 440.681 2.739 50 40 IFGB Cc1ccccc1S(=O)(=O)N1CCC2(CC1)CO[C@@H](CI)C2 2056225750 AQFYXZPRCOVXCU-CQSZACIVSA-N 435.327 2.990 50 40 IFGB Cn1nnc([C@H](Br)CC(Br)(Br)Br)n1 2344794 LMXRDIJTPNPVAQ-GSVOUGTGSA-N 441.747 2.875 50 40 IFGB O=C(NNC(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O)c1ccc(Br)cc1 9144524 OWPGHGWCAWZXJS-UHFFFAOYSA-N 432.186 2.539 50 40 IFGB CCCOc1ccc(-c2[nH]nc3c2[C@H](c2ccc(OCC(N)=O)cc2)C(C#N)=C(N)O3)cc1 9350732 GSPCKSUEMKZGMC-HXUWFJFHSA-N 445.479 2.948 50 40 IFGB CCOC(=O)c1c(C)oc2ccc(OCC(=O)NNC(=O)c3cccc(OC)c3)cc12 9597101 FPBKXLPMTBQROS-UHFFFAOYSA-N 426.425 2.767 50 40 IFGB biogenic Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)C[C@@H]3C=CCC3)cc2)cc1 12971893 GOHUTJHYDPXQSI-GOSISDBHSA-N 441.553 2.933 50 40 IFGB Cc1ccccc1CN(c1ccc(C(=O)NN=C2CCN(C)CC2)cc1)S(C)(=O)=O 409128054 DKTDOSSSCJPEGX-UHFFFAOYSA-N 428.558 2.773 50 40 IFGB CC(=O)NNc1nc(C)c(C(/C=C\c2ccc(Cl)cc2)=N/NC(=O)C[N+](C)(C)C)s1 5824122 YIANCDHJEWJQQF-FLIBITNWSA-O 449.988 2.808 50 40 IFGB CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3ccc(C)o3)cc2)cc1 9885535 DVGOGZFRKVHPQB-UHFFFAOYSA-N 443.481 2.862 50 40 IFGB CS(=O)(=O)Nc1cccc(C(=O)NNC(=O)CSc2cc(Cl)ccc2Cl)c1 12672305 UCENCWGETPHLLS-UHFFFAOYSA-N 448.353 2.918 50 40 IFGB Cc1ccc(SCc2c(C(=O)N/N=C/[C@@H]3CC=CCC3)nnn2-c2nonc2N)cc1 13143953 YTPILWYEXPDZFM-DACUGSJHSA-N 438.517 2.905 50 40 IFGB Cc1ccc(N2C(=O)[C@H](/C=N\NC(=O)c3cccc4ccccc34)C(=O)NC2=S)cc1 408753753 HUHPCXMSMZMGPL-RIMPEIONSA-N 430.489 2.928 50 40 IFGB CCc1ccc(N2C[C@H](C(=O)OCC(=O)C(C#N)=C3Nc4ccccc4N3)CC2=O)cc1 3358250 SCBXUDZMPJZBCW-MRXNPFEDSA-N 430.464 2.987 50 40 IFGB O=C(NNS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1Br 8765769 IBHLGZOFSWNWCV-UHFFFAOYSA-N 434.655 2.634 50 40 IFGB Cc1nn(-c2ccc(F)cc2F)c(C)c1C(=O)NNC(=O)c1ccc2c(c1)OCCO2 48345966 TYJQMOMLSWQYED-UHFFFAOYSA-N 428.395 2.613 50 40 IFGB COc1cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc(Br)c1OCC(N)=O 409219226 KHUVWWQWNXTAOM-WUXMJOGZSA-N 446.257 2.573 50 40 IFGB COc1ccc(Br)cc1/C=N/NC(=O)CNC(=O)Cc1ccc(Cl)cc1 2231228 PCRHEYGWKFKSJX-LSHDLFTRSA-N 438.709 2.920 50 40 IFGB COc1ccc(OCC(=O)NNC(=O)c2ccccc2OCc2c(C)noc2C)cc1 12985573 RKMUUEFOWFBGHE-UHFFFAOYSA-N 425.441 2.719 50 40 IFGB O=C(O[C@@H](CCl)C(=O)c1ccccc1)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@H]2Br 408682504 JIGDPJZFKGQLGY-LXNMOLPQSA-N 427.678 2.591 50 40 IFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(O)c(I)c2)n1 1101030 SBAMYSDQZWXVJR-REZTVBANSA-N 442.282 2.646 50 40 IFGB CCn1c(SCC(=O)N/N=C/c2cccn2C)nnc1-c1ccc(OC)c(OC)c1 1477935 KYWXPAQJGJVSPR-CIAFOILYSA-N 428.518 2.563 50 40 IFGB COc1cc(/C=N\NC(=O)c2nn(-c3ccc(Cl)cc3)c(=O)c(C#N)c2C)ccc1O 409055980 DNMKHVRFADUSQV-MYKKPKGFSA-N 437.843 2.544 50 40 IFGB CC(C)[C@H](NC(=O)c1ccccc1F)C(=O)OCC(=O)C(C#N)=C1Nc2ccccc2N1 3285347 ZWWVURVDCGZVFP-FQEVSTJZSA-N 436.443 2.965 50 40 IFGB Cc1ccc(S(=O)(=O)/C(C#N)=C/N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1C 20403645 HCRPWXZDJHTAQC-RCCKNPSSSA-N 439.537 2.989 50 40 IFGB C[C@@H](Oc1ccc(/C=N/NC(=O)c2cccc(I)c2)cc1)C(=O)O 59303293 WQUHRBALILEXAD-VURRPDKYSA-N 438.221 2.907 50 40 IFGB CC[C@@H](NC(=O)c1ccccc1NC(=O)c1ccccc1)C(=O)NNC(=O)c1ccccc1 3144130 XJKGLNCXCFSVAP-HXUWFJFHSA-N 444.491 2.909 50 40 IFGB COc1cc(/C=N/NC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)ccc1OCC(N)=O 9305874 SURDYWHMOWVXBX-LGPHULDDSA-N 440.283 2.784 50 40 IFGB COC(=O)c1ccc([C@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4cccnc4)c(=O)c32)cc1 11640058 BEHXKDRCJWQJMO-FQEVSTJZSA-N 428.448 2.605 50 40 IFGB COc1cccc(OCCCOc2ccccc2/C=N/NC(=O)Cc2nnc(N)s2)c1 13899460 MTWNRCQXVMKOGS-OEAKJJBVSA-N 441.513 2.670 50 40 IFGB C=CCNS(=O)(=O)c1cccc(C(=O)NNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 21287131 XMZJBYWSVUYLRN-UHFFFAOYSA-N 444.391 2.835 50 40 IFGB COC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)c1 28197824 JZUYKLOQGWMQHM-UHFFFAOYSA-N 434.514 2.830 50 40 IFGB C[C@H](c1ccccc1)N1C[C@H](C(=O)NNC(=O)c2ccc(Br)cc2)CC1=O 216298927 YZPCDJWYLJCLPJ-CZUORRHYSA-N 430.302 2.820 50 40 IFGB NS(=O)(=O)c1ccc(-c2ccc(/C=N/NC(=O)COc3ccc(Cl)cc3)o2)cc1 408897685 ZJBBYOCAJGTIOX-SSDVNMTOSA-N 433.873 2.777 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccncc1)c1cc(C(F)(F)F)ccc1Cl 408911307 MWIZNDHDUMJUMP-LSFURLLWSA-N 434.827 2.670 50 40 IFGB COc1ccc(NC(=O)COc2ccccc2[C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1 9715949 IUCMETWJVUPPGI-OAQYLSRUSA-N 431.452 2.962 50 40 IFGB O=C(N/N=C/c1ccc(S(=O)(=O)O)o1)/C(=C\c1cccs1)NC(=O)c1ccccc1 13471702 OGPWIOVBXWBTHJ-LOXJZLIVSA-N 445.478 2.509 50 40 IFGB O=C(COc1ccc(Br)cc1)NNC(=O)c1cnn(Cc2ccccc2)c1 14232716 NPLSJHHSYLHZMW-UHFFFAOYSA-N 429.274 2.534 50 40 IFGB COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(=O)n(Cc3ccc(Cl)cc3)c2)c1 16839345 HZMDNUJXEKQIAX-UHFFFAOYSA-N 441.871 2.642 50 40 IFGB COc1cc(/C=N/NC(=O)[C@@H](O)c2ccccc2)ccc1OC(=O)c1ccc2c(c1)OCO2 3030390 YLHMOGFTUKQICN-WGBQGACBSA-N 448.431 2.827 50 40 IFGB C[C@H]1CCc2c(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)csc2C1 5637475 PAWYKZWRZCEMCR-KRWDZBQOSA-N 426.586 2.846 50 40 IFGB Cc1nc2cc(C(=O)OCC(=O)NNC(=O)c3ccccc3)ccc2n1-c1ccccc1 8826112 WYDHHJQIVFFUBA-UHFFFAOYSA-N 428.448 2.952 50 40 IFGB O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NNC(=O)c1cccnc1 12276055 CVFLOWUXPAKUMH-GXDHUFHOSA-N 432.552 2.586 50 40 IFGB O=C(CCC(=O)Nc1ccccc1Br)N/N=C/c1cc([N+](=O)[O-])ccc1O 36020374 NCQPNQIGWMBOIF-VXLYETTFSA-N 435.234 2.932 50 40 IFGB C/C(=N\NC(=O)CN(c1cc(Cl)ccc1C)S(C)(=O)=O)c1ccc([N+](=O)[O-])cc1 408773499 RCDMGVDADSECEC-DEDYPNTBSA-N 438.893 2.863 50 40 IFGB COc1ccc(NC(=O)[C@H]2CC(=O)N=C(NNC(=O)c3ccc(Cl)cc3)S2)cc1 9330003 ZGLBWPNKQIHGGK-OAHLLOKOSA-N 432.889 2.610 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)ccc1O 15347348 XAQIIKBWARGYKJ-ZVHZXABRSA-N 428.452 2.867 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc(Br)cc1)c1cccc(F)c1 409142434 LKCKLKVNCGARJT-VXLYETTFSA-N 428.283 2.505 50 40 IFGB COc1cccc(C(=O)Nc2cccc(C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c2)c1 409223927 HQWBJRHUWYMURB-UHFFFAOYSA-N 434.408 2.931 50 40 IFGB O=C(CNC(=O)c1ccncc1)N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21 2289417 CEHRTVIGJOZTSO-HFTWOUSFSA-N 447.882 2.532 50 40 IFGB Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CCN1C(=O)COc2ccccc21 12689678 WYWDUZODDOVEDC-UHFFFAOYSA-N 436.493 2.695 50 40 IFGB COc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3C[C@@H](C)C[C@H](C)C3)cn2)cc1 24830474 WVPUERQXBSBFOG-HOTGVXAUSA-N 447.561 2.583 50 40 IFGB COc1cc(/C=N/NC(=O)COc2ccccc2)cc(I)c1OC 408528084 RAULOXLCFAMRDK-VXLYETTFSA-N 440.237 2.838 50 40 IFGB COc1cccc(/C=N\NC(=O)c2nn(-c3ccc(C)c(C)c3)c(=O)c(C#N)c2C)c1O 409062273 RCIJUTFASPZLBF-ROTLSHHCSA-N 431.452 2.508 50 40 IFGB CCOc1ccc(/C=N/NC(=O)Cn2cnc3sc(CC)cc3c2=O)cc1OCC 1784436 LYZHDPAPZDUMAZ-FOKLQQMPSA-N 428.514 2.968 50 40 IFGB O=C(Cn1nnc(-c2ccccc2)n1)N/N=C/c1cccc(OC(=O)c2cccs2)c1 4132524 PKLWQRURHGMILA-LPYMAVHISA-N 432.465 2.771 50 40 IFGB CCc1sc(C(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@@H](C)CC(C)(C)C3)C2=O)cc1C 9442935 DYZXFHUIUZRCER-QKVFXAPYSA-N 434.562 2.517 50 40 IFGB CCN(C[C@@H]1COc2ccccc2O1)C(=O)NNC(=O)c1cncn1-c1ccc(F)cc1 9467326 AHOSGIPGNVGAMT-QGZVFWFLSA-N 439.447 2.528 50 40 IFGB O=C(CSc1nc2ccccc2c(=O)n1Cc1ccccc1)NNC(=O)c1ccccc1 9588495 SLBMLNQMYSPVGN-UHFFFAOYSA-N 444.516 2.998 50 40 IFGB COc1cc(/C=N/NC(=O)CN2CCOCC2)cc(Cl)c1OCc1ccccc1C#N 15019882 LESFGGUPALVRAC-DHRITJCHSA-N 442.903 2.582 50 40 IFGB COc1cc(C(=O)N/N=C/[C@@H]2C(=O)Nc3ccccc32)ccc1I 100235652 XBGHHOKPMYUXQP-BFNDQCEFSA-N 435.221 2.751 50 40 IFGB CCOc1ccc(N(CC(=O)NN=C(C)C)S(=O)(=O)c2ccc(OC)c(OC)c2)cc1 409025028 PMCVRBPQEMPGLM-UHFFFAOYSA-N 449.529 2.810 50 40 IFGB C=CCOc1c(Br)cc(Br)cc1/C=N/NC(=O)c1nonc1N 1947709 SEVGZYPQTSKPKM-UBKPWBPPSA-N 445.071 2.506 50 40 IFGB Cc1cccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(Br)cc3)CC2=O)c1C 17330569 YBRULMROWAOOFL-HNNXBMFYSA-N 430.302 2.880 50 40 IFGB Cc1c(CBr)[n+]([O-])c2c([n+]1[O-])[C@@H](Br)CC[C@@H]2Br 17595994 SJFFCHWYKKXQSL-BQBZGAKWSA-N 430.922 2.823 50 40 IFGB O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)c1ccc2c(c1)CCO2 32421423 DVSRCYUNQWSQAJ-UHFFFAOYSA-N 443.506 2.559 50 40 IFGB CCCCOC(=O)c1cc([N+](=O)[O-])cc2c1-c1ccc([N+](=O)[O-])cc1/C2=N\NC(N)=O 4506166 DMOCFVXVUCEVFL-HEHNFIMWSA-N 427.373 2.861 50 40 IFGB N#C/C(=C\c1ccc(O)c(O)c1)C(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1 19635915 LAEHRRQVBQCFGC-UKTHLTGXSA-N 442.478 2.901 50 40 IFGB CN(c1ccc(C(=O)N/N=C/c2ccccc2C(=O)O)cc1)S(=O)(=O)c1ccccc1 20059323 OWRMCGWOSODTHW-HZHRSRAPSA-N 437.477 2.974 50 40 IFGB CCOc1cc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)ccc1OCC(=O)O 59333081 OGRWQEAQMUZMNL-RGEXLXHISA-N 435.480 2.804 50 40 IFGB O=C(COc1cccc2cccnc12)N/N=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 409009475 AHVXRYXUTYVZDD-ZVHZXABRSA-N 435.440 2.509 50 40 IFGB Cc1ccc(CN2C[C@@H](C(=O)NNC(=O)CSc3cccc4cccnc34)CC2=O)cc1 9995965 QUOLTTLLVPJNHQ-IBGZPJMESA-N 448.548 2.831 50 40 IFGB CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C/c2ccc(C(C)C)cc2)cc1 16575754 WBEUJJWXNWNXPV-LPYMAVHISA-N 430.530 2.539 50 40 IFGB Cc1cccc(NC(=O)COC(=O)CCC(=O)NNC(=O)c2ccc(Cl)cc2)c1C 408665678 VPBJGUVYHYMLKP-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2cccc(Cl)c2Cl)S(C)(=O)=O)cc1 408921058 BWWCYKLAIDKHMA-KEBDBYFISA-N 430.313 2.918 50 40 IFGB Cc1ccc(C)c(NC(=O)COc2ccccc2/C=N/NC(=O)C(=O)NCc2ccco2)c1 409268935 ZWAFXKNKUKZBFI-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB Cc1cccc(N(CC(=O)NN=C2CCN(Cc3ccccc3)CC2)S(C)(=O)=O)c1C 409330246 KISBSBKCUXUIIL-UHFFFAOYSA-N 442.585 2.838 50 40 IFGB COc1cccc(/C=N/NC(=O)CNC(=O)[C@H]2CC2(c2ccccc2)c2ccccc2)c1O 2282693 BFEBKDINUYBZKC-NDPRVOFDSA-N 443.503 2.973 50 40 IFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1cc(OC)c(OC)cc1[N+](=O)[O-])c1ccccc1 408982777 ZBMFYXIWONXVKG-QPNANDPSSA-N 444.444 2.940 50 40 IFGB O=C(CSc1nnc(-c2cccs2)n1C[C@@H]1CCCO1)NNC(=O)c1cccs1 3447221 DKMLFCVDYHOZGF-LBPRGKRZSA-N 449.583 2.800 50 40 IFGB O=C1CCC(C(=O)NNC(=O)c2ccc(COc3ccccc3-c3ccccc3)cc2)=NN1 9119387 QKIASCHHZLJIJS-UHFFFAOYSA-N 442.475 2.960 50 40 IFGB O=C(CCSc1ccc(F)cc1)NNC(=O)CCS(=O)(=O)c1ccc(Cl)cc1 9442457 NRWZSMQORLIHDR-UHFFFAOYSA-N 444.937 2.973 50 40 IFGB COc1cc(C)ccc1OCC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1 9507622 HPERUBXQFYUBGJ-CYBMUJFWSA-N 437.290 2.760 50 40 IFGB CCc1ccc(/C=c2/sc3n(c2=O)C(N)=C(C#N)[C@@H](c2ccc(CC)cc2)C=3C#N)cc1 32107552 PJNYGSUCNUGLHR-CXSSSTRGSA-N 438.556 2.986 50 40 IFGB Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)NNC(=O)[C@@H](C)Oc1ccc(F)cc1 40144501 CGUIUGYJUULYEZ-OAHLLOKOSA-N 428.439 2.925 50 40 IFGB CC(C)CNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccc(Cl)cc2)c1 409157331 VEUOXDXKMLXDMS-WYMPLXKRSA-N 430.892 2.580 50 40 IFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)ccc1OCC(=O)Nc1ccccc1 9715942 FRPGCZDJDOIBCI-OAQYLSRUSA-N 431.452 2.962 50 40 IFGB COc1ccc(S(=O)(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)cc1OC 12872169 HVCIRTNOTVZFNE-UHFFFAOYSA-N 433.511 2.759 50 40 IFGB COc1ccc(OCC(=O)N/N=C/c2ccc(OCC(=O)NCc3ccccc3)cc2)cc1 28215182 SPKGOTJSFFCSDD-JVWAILMASA-N 447.491 2.920 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(F)cc2)cc1)Nc1ccccc1 58880992 XCBUIYVAKGVPKU-AFUMVMLFSA-N 434.427 2.932 50 40 IFGB C/C(N)=C(\C#N)C(=O)CSc1nnc2n(-c3cccc(C)c3)c(=O)c3ccccc3n12 103874128 GYHQHRBKVOADJY-VKAVYKQESA-N 430.493 2.759 50 40 IFGB Cc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccccc3Br)CC2=O)cc1C 408616182 WYPDBVLROSDFQD-AWEZNQCLSA-N 430.302 2.880 50 40 IFGB COc1cc(C(=O)Nc2cccc(C(=O)NNC(=O)c3ccccc3)c2)ccc1OC(C)=O 10039336 XFZPJEJMZUOCLV-UHFFFAOYSA-N 447.447 2.948 50 40 IFGB COc1cccc(NC(=O)[C@H](NNC(=O)[C@H]2COc3ccccc3O2)c2ccccc2)c1 15472259 DEEDHBNQJPPHGZ-FGZHOGPDSA-N 433.464 2.836 50 40 IFGB CC(=O)[C@H]1CC(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)=NN1c1ccccc1 58249765 YIIUDZFRLVRZKM-OAQYLSRUSA-N 446.463 2.844 50 40 IFGB CCOc1cc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)ccc1OCC(N)=O 108929385 LZENXIBWSLUKOP-LSHDLFTRSA-N 442.453 2.836 50 40 IFGB COc1ccc(Cl)cc1-c1nc(SCC(=O)NNC(=O)Cc2ccccc2)n[nH]1 408638830 TUUKUQPKVMFADS-UHFFFAOYSA-N 431.905 2.616 50 40 IFGB COc1cc(OC)cc(C(=O)N/N=C/c2ccc(CNS(=O)(=O)c3ccccc3)o2)c1 408768604 YWNIWCORUSDOJT-LPYMAVHISA-N 443.481 2.539 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccccn2)Cc2ccc(F)cc2)cc1 409055811 BGKNGJKGPSANRC-AFUMVMLFSA-N 440.500 2.870 50 40 IFGB CCOC(=O)[C@@H](NC(C)=O)[C@H](OC(C)=O)c1cccc(N(CCCl)CCCl)c1 6089432 KAEOBVIVPGBJCY-ZWKOTPCHSA-N 433.332 2.643 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2ccc(C)c(C)c2)S(C)(=O)=O)cc1OC 20208711 FHUFEDBECSJIKG-OEAKJJBVSA-N 445.541 2.793 50 40 IFGB O=C1O[C@H]2[C@@H]3C[C@H]([C@@H](C(=O)O[C@@H](CCl)C(=O)c4ccccc4)[C@@H]13)[C@H]2Br 408682506 JIGDPJZFKGQLGY-UFGPXHDYSA-N 427.678 2.591 50 40 IFGB Cc1n[nH]c(C)c1CC(=O)N/N=C/c1cc(Br)cc(Br)c1O 3056784 WLHLZLPAKJLPTP-UBKPWBPPSA-N 430.100 2.950 50 40 IFGB CC(=O)NNc1nc(C)c(C(/C=C\c2ccccc2O)=N\NC(=O)c2ccncc2)s1 5832244 HVRQPULLOZMIFZ-FXZQEFSOSA-N 436.497 2.863 50 40 IFGB COc1ccc(C(=O)NCC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cc1OC 12698406 MMHYQVWGYYMWGT-UHFFFAOYSA-N 445.541 2.615 50 40 IFGB C/C(=N\NC(=O)CN(c1ccc(Br)cc1)S(C)(=O)=O)c1ccc(F)cc1 20209935 BHVRKPQADBGFGN-UDWIEESQSA-N 442.310 2.895 50 40 IFGB COc1cc(Br)ccc1NC(=O)[C@H]1[C@H]2C(=O)O[C@H]3[C@@H]2C[C@H]1[C@H]3Br 102538964 AESNCYHFSFMKKD-SJSAEFMNSA-N 445.107 2.967 50 40 IFGB CCOc1cc(/C=N/NC(=O)[C@H](C#N)c2ccccc2)ccc1OCC(=O)N1CCCC1 409196617 WVKFSGSSBGFTLL-RHKYMZEHSA-N 434.496 2.844 50 40 IFGB Cc1noc(C)c1COc1ccc(CC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1 9909045 VPPWJZPGKVLZJO-UHFFFAOYSA-N 447.495 2.690 50 40 IFGB COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccsc3)c2)cc1 12605786 HFMGFTPYFJWSSV-UHFFFAOYSA-N 445.522 2.561 50 40 IFGB CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(OCC(F)(F)F)nc2)cc1 12786801 RPCJYBYHHUNGON-LBPRGKRZSA-N 427.379 2.650 50 40 IFGB COc1ccc(NC(=S)NNC(=O)c2cc(Br)ccc2O)c(OC)c1 17094726 LKPKWFIOQHXZGH-UHFFFAOYSA-N 426.292 2.803 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)NN=C2CCN(C)CC2)c2cccc(C)c2)cc1 408833136 VUBXMPMZCTUKDL-UHFFFAOYSA-N 428.558 2.697 50 40 IFGB COc1ccc(S(=O)(=O)N(CCc2ccccc2)CC(=O)N/N=C/c2ccco2)cc1 408976708 BWUSCGSZYQCMGM-XQNSMLJCSA-N 441.509 2.672 50 40 IFGB COc1cc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)ccc1O[C@H](C)C(=O)O 409020302 NRTLRDHGJNDTOF-OHBSIKEHSA-N 427.369 2.965 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2cccc(Cl)c2C)cc1 409172632 DVWMCHREBPCTRS-WYMPLXKRSA-N 430.892 2.642 50 40 IFGB C[C@H](NC(=O)Nc1ccccc1)C(=O)NNC(=O)Cc1csc(-c2ccc(F)cc2)n1 39996913 PCDSHGMFEYZJLB-ZDUSSCGKSA-N 441.488 2.849 50 40 IFGB [BH3-][P+](c1ccccc1)(c1ccccc1)c1ccc(I)c(OC)c1 219785877 ZVAKLTFTLVQJOI-UHFFFAOYSA-N 432.050 2.874 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1cccc(OC)c1OCc1ccc(Br)cc1 408609172 JNHSUYRJMSDZGE-SSDVNMTOSA-N 434.290 2.623 50 40 IFGB CCOc1ccccc1C(=O)NNC(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1 10735950 VQESWBBWZYAIQH-UHFFFAOYSA-N 428.466 2.727 50 40 IFGB Cc1ccccc1NC(=O)[C@@H]1[C@@H](c2cccs2)C(C#N)=C(SCC(N)=O)N[C@@]1(C)O 19830706 XRUZMSXODHJDKY-LQWHRVPQSA-N 442.566 2.660 50 40 IFGB Cc1cccn2c(=O)c(/C=C(\C#N)C(N)=O)c(N3CCC(Cc4ccccc4)CC3)nc12 2201791 HQXRIRMYPKZXOW-HMMYKYKNSA-N 427.508 2.854 50 40 IFGB Cc1ccc2c(c1Br)/C(=N/NC(=O)CCC(=O)Nc1ccccc1)C(=O)N2 18068446 WTHJLCMTLPMIIS-UHFFFAOYSA-N 429.274 2.949 50 40 IFGB CCOc1ccccc1OCC(=O)N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O 20100896 OTYSOBOPFABCHO-DJKKODMXSA-N 438.234 2.991 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@@H]3[C@@H]4C[C@H]([C@H](Br)[C@@H]4Br)[C@@H]3C2=O)c1 100159273 AQAXYDDYNVXYEF-LVTVNPDKSA-N 443.091 2.667 50 40 IFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2cc(Br)cc([N+](=O)[O-])c2O)n1 409105530 KUSKWTZMGKZAOR-UBKPWBPPSA-N 440.279 2.712 50 40 IFGB CCOc1cc([C@@H]2C(C#N)=C(N)OC(C)=C2C(=O)OC)c(Cl)cc1OCC(=O)OC 814144 XFIJMPBBXKPLEB-GOSISDBHSA-N 436.848 2.545 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@H]3C[C@@H](Br)[C@H](Br)C[C@@H]3C2=O)c1 4156999 IBSRDFPISRPXAX-NNYUYHANSA-N 431.080 2.811 50 40 IFGB Cc1ccc(N(CCC(=O)NNC(=O)c2ccco2)S(=O)(=O)c2ccc(C)cc2)cc1 31416761 LSVQHVFOOQIMCA-UHFFFAOYSA-N 441.509 2.943 50 40 IFGB COc1ccc(S(=O)(=O)N(CC(=O)NN=C2CCCC2)Cc2ccccc2)c(OC)c1 408725660 NHNHCWGSDUUMGF-UHFFFAOYSA-N 445.541 2.941 50 40 IFGB Cc1c(C(=O)N/N=C/c2ccccn2)nn(-c2cccc(C(F)(F)F)c2)c(=O)c1C#N 409057173 JIBMKDJMIHFRBX-KBKYJPHKSA-N 426.358 2.590 50 40 IFGB CCOC(=O)COc1ccc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)cc1OCC 409249719 LDJYUUSKNMECMA-SSDVNMTOSA-N 446.529 2.676 50 40 IFGB N#C/C(=C\c1cn(CC(=O)N2CCOCC2)c2ccccc12)C(=O)NCc1ccccc1 885588 PIRRHWMGYJFHAU-XSFVSMFZSA-N 428.492 2.723 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccc(CSc3nncn3C)cc2)cc(OC)c1OC 3234627 HYIKJDOVPIJVDN-SSDVNMTOSA-N 441.513 2.897 50 40 IFGB COc1ccc(CCNC(=O)C/C(C)=N/NC(=O)C(=O)Nc2cccc(Cl)c2C)cc1 9425449 ZKUSIZVDWLOAEB-VULFUBBASA-N 444.919 2.837 50 40 IFGB CCOc1ccccc1C(=O)N[C@@H](C(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1)C(C)C 9910598 FEXPCWLQCFSRET-OAQYLSRUSA-N 449.511 2.691 50 40 IFGB O=C(NNC(=O)c1cccs1)C1=NO[C@@H](CNc2ncc(C(F)(F)F)cc2Cl)C1 20365889 RNGUKPHMDBMUHH-SECBINFHSA-N 447.826 2.833 50 40 IFGB CC1(C)OC(=O)C2=C1NC(N)=C(C#N)[C@]21C(=O)N(CCCc2ccccc2)c2ccccc21 79484150 QVUQMDCYRWRQEV-SANMLTNESA-N 440.503 2.790 50 40 IFGB O=C1Nc2cc3c(cc2/C1=N\NC(=O)c1ccc(F)cc1Br)OCCCO3 84343977 DSCIYWXVKLRZIK-UHFFFAOYSA-N 434.221 2.836 50 40 IFGB CC1=C(C#N)C(=O)N([C@H]2CCS(=O)(=O)C2)C(=O)/C1=C/Nc1cc(Cl)cc(Cl)c1 102675956 SCMDLKMFBYXFDI-BRSWLGOBSA-N 440.308 2.685 50 40 IFGB Cc1ccc(N2C(=O)[C@@H](/C=N\NC(=O)c3ccc4ccccc4c3)C(=O)NC2=S)cc1 408755996 SSQPQKACZMEMLR-HTAGGTJDSA-N 430.489 2.928 50 40 IFGB COc1cc(/C=C(/C#N)C(=O)N2CCOCC2)ccc1OCC(=O)Nc1ccccc1C 409008102 TWSDJEKCVIDAKX-UYRXBGFRSA-N 435.480 2.787 50 40 IFGB N#C/C(=C\c1c(F)c(F)c(N2CCCCC2)c(F)c1F)c1nn(CCO)c(N)c1C#N 4045964 FWGOSKYRNJBHQK-DHZHZOJOSA-N 434.397 2.940 50 40 IFGB Cc1cccc(OCC(=O)NNC(=O)c2nn(-c3ccccc3)c(=O)c3ccccc23)c1 9256490 AWYFRFPRKSSPFG-UHFFFAOYSA-N 428.448 2.534 50 40 IFGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)CN(c2ccc(Cl)cc2)S(C)(=O)=O)c1 20209707 FYGQZXMHNCWHIP-LPYMAVHISA-N 436.921 2.605 50 40 IFGB COc1cccc(/C=N/NC(=O)C(=O)NC2CC2)c1OCc1ccc(Br)cc1 408612243 URPHQAAWZQPVLA-SSDVNMTOSA-N 446.301 2.765 50 40 IFGB O=C1NC[C@H](c2ccccc2)[C@H]1C(=O)N/N=C\c1cc(Br)cc(Cl)c1O 15938658 ZRBLVZDXBNJEEB-PTIKLQEPSA-N 436.693 2.788 50 40 IFGB O=C(NNC(=O)c1ccccc1O)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1 17397452 YTBDMBPAEYOENC-UHFFFAOYSA-N 445.884 2.921 50 40 IFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(OC)cc1OC 408608850 WWPQCJXJNITDMM-SFHVURJKSA-N 427.530 2.957 50 40 IFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 408883624 VFQMBTVITKLDQA-RONKMWSCSA-N 436.877 2.552 50 40 IFGB Cc1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)c(C)o1 3621571 KESKMGXWGJINOW-UHFFFAOYSA-N 439.921 2.799 50 40 IFGB CCOc1ccc(/C=C2\SC(=S)N(CC(=O)NNC(=O)c3ccccc3)C2=O)cc1 8819124 WXNPHCWNDMKICD-ATVHPVEESA-N 441.534 2.748 50 40 IFGB N#C/C(=C/c1ccc(OCC(N)=O)cc1)C(=O)Nc1ccc(I)cc1 408760077 RCOMIWCIMZMHDL-LCYFTJDESA-N 447.232 2.701 50 40 IFGB COc1cc(/C=N/NC(=O)[C@@H](C)n2cnc3sc4c(c3c2=O)CCCC4)ccc1O 958177 JHFBEXQXOQWOJB-BCFXSHNWSA-N 426.498 2.762 50 40 IFGB COc1ccccc1-c1nnc(SCC(=O)NNC(=O)c2ccc(Cl)cc2)n1C 12496587 PTNYQBIDSAHOIT-UHFFFAOYSA-N 431.905 2.697 50 40 IFGB O=C1C(NNC(=O)c2ccccc2)=C/C(=N/S(=O)(=O)c2ccccc2)C2=C1CC=CC2 101181438 WWCMPVJWDZUVQC-QOMWVZHYSA-N 433.489 2.864 50 40 IFGB CCCOc1ccc(C(=O)NNC(=O)CCNC(=O)c2ccccc2Cl)cc1OC 10324523 GDDULXDDCUSTNC-UHFFFAOYSA-N 433.892 2.719 50 40 IFGB CCc1ccccc1N(CC(=O)N/N=C/c1ccc(Br)cc1)S(C)(=O)=O 408778012 OGASQUIOLFDMRW-UDWIEESQSA-N 438.347 2.928 50 40 IFGB CCOc1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)ccc1OCC(=O)N(CC)CC 409204173 CQBPKIKPBSALQD-TVNWYLLRSA-N 429.517 2.535 50 40 IFGB COc1ccc(C(=O)NNC(=S)NC(=O)c2ccc(F)cc2)cc1Br 2135487 KKUBKVHUIPAENP-UHFFFAOYSA-N 426.267 2.546 50 40 IFGB CCN(CC)S(=O)(=O)c1cccc(C(=O)N/N=C/c2cc(OC)c(OC)cc2OC)c1 3204374 AFSHIEVSUQFVOZ-HYARGMPZSA-N 449.529 2.507 50 40 IFGB CCNC(=O)C/C(C)=N/NC(=O)COc1cc(C)c(Br)cc1Br 8663680 IOHVXZXANJNIKZ-VXLYETTFSA-N 449.143 2.917 50 40 IFGB CCn1c(SCC(=O)NNC(=O)c2cc(-c3ccccc3)n[nH]2)nnc1-c1ccco1 9507978 COEBIBFGVDEREN-UHFFFAOYSA-N 437.485 2.501 50 40 IFGB C[C@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1N)C(=O)NNC(=O)c1ccccc1 14240693 LCOBZEGHSGVKRU-AWEZNQCLSA-N 438.557 2.898 50 40 IFGB COc1ccc([C@@H]2CC(=O)NC(SCC(=O)NC[C@@H]3CCCO3)=C2C#N)cc1Cl 409313614 CXOYXAVAPRVJCE-KBPBESRZSA-N 435.933 2.716 50 40 IFGB Cc1cc2c(c(=O)n1CCCN1CCOCC1)[C@@H](c1ccccc1Cl)C(C#N)=C(N)O2 19890679 GCWBTQGMIJDBTE-FQEVSTJZSA-N 440.931 2.751 50 40 IFGB O=C(N/N=C1\C(=O)N(CN2CCCCC2)c2ccc(Br)cc21)c1ccccn1 101032566 QEGSJPXIZVJYHL-NKFKGCMQSA-N 442.317 2.768 50 40 IFGB COc1ccc(C(=O)Nc2cccc(C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c2)cc1 409224662 LDRDFOUTGSMNHG-UHFFFAOYSA-N 434.408 2.931 50 40 IFGB O=C(CCC(=O)Nc1ccc(Cl)cc1Cl)NNC(=O)[C@H]1CCCC[C@H]1C(=O)O 2135281 AELDTLRCHIVTJW-NWDGAFQWSA-N 430.288 2.751 50 40 IFGB CN1C(=O)/C(=N\NC(=O)c2cncc(Br)c2)c2cc(Br)ccc21 2354089 PXAAFXOAPXOEOY-UYRXBGFRSA-N 438.079 2.717 50 40 IFGB Cc1cccc2c1NC(=O)/C2=N\NC(=O)[C@@H](C)n1cnc2sc3c(c2c1=O)CC[C@H](C)C3 6166503 MKLAYLHVVBEPPC-WCQYABFASA-N 449.536 2.925 50 40 IFGB C/C(=N\NC(=O)CCC(=O)N/N=C(\C)c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1 20158079 GBPWNUGDGSMULY-JFMUQQRKSA-N 440.416 2.664 50 40 IFGB COc1cccc(OCC(=O)N/N=C(\C)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c1 100929978 OVPMEJDNXCMPOZ-LPYMAVHISA-N 430.417 2.512 50 40 IFGB CCOc1cc(/C=N/NC(=O)CNc2ccc(I)cc2)ccc1O 409084850 XRKJYDVRHRXPBD-KEBDBYFISA-N 439.253 2.958 50 40 IFGB COc1ccc(/C=N/NC(=O)c2ccc(Br)o2)cc1Cn1cc([N+](=O)[O-])cn1 676193 YDOGBVNWCOHUKM-FBCYGCLPSA-N 448.233 2.968 50 40 IFGB CCn1c(SCC(=O)NNC(=O)COc2ccc(F)cc2)nnc1-c1cccc(C)c1 13022380 SVQZDVPQMYCEMZ-UHFFFAOYSA-N 443.504 2.731 50 40 IFGB Nc1nonc1-n1nnc(C(=O)N/N=C/c2ccc(C(F)(F)F)cc2)c1-c1cccs1 13805398 XZWFNJREUIAWPK-GZIVZEMBSA-N 448.390 2.744 50 40 IFGB COc1cc(/C=N/NC(=O)c2nc3ccccc3c(=O)n2Cc2ccccc2)ccc1O 28218133 RTQOVHSERCOBPT-AFUMVMLFSA-N 428.448 2.923 50 40 IFGB Cc1cc(C)c(NC(=O)COc2cccc(/C=N/NC(=O)C(=O)NCC(C)C)c2)c(C)c1 409152068 AEEUBNDWHNIFJH-LGJNPRDNSA-N 438.528 2.852 50 40 IFGB COc1ccc(C(=O)NNC(=O)CSc2nnc(C)n2-c2cccc(Cl)c2)cc1 924702 IOGLQSDMNDSJOT-UHFFFAOYSA-N 431.905 2.791 50 40 IFGB C[C@H](C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)n1cnc2sc3c(c2c1=O)CCCC3 1783688 YYIBAMOEOYBUHH-OWGFIJSYSA-N 425.470 2.956 50 40 IFGB O=C(NNc1c(F)c(F)cc(F)c1F)C1CCN(S(=O)(=O)c2ccccc2F)CC1 3376832 UNUFKDVCUXCMAJ-UHFFFAOYSA-N 449.401 2.926 50 40 IFGB O=C1c2ccccc2C(=O)c2cc(S(=O)(=O)NNC(=O)[C@@H]3C[C@@H]3c3ccccc3)ccc21 8856726 HMROIRBPSHSLDJ-TZIWHRDSSA-N 446.484 2.575 50 40 IFGB CCNC(=O)COc1ccc(C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)cc1 13009420 KWTGLKOIHBYEFH-UHFFFAOYSA-N 429.542 2.997 50 40 IFGB COC(=O)c1cc(NC(=O)COc2ccc(SC#N)cc2OC)cc(C(=O)OC)c1 95452293 ZDPXBGGRSXKRFO-UHFFFAOYSA-N 430.438 2.859 50 40 IFGB COc1cc(/C=N/NC(=O)C(=O)NC[C@@H]2CCCO2)ccc1OCc1ccc(Cl)cc1 408606739 APBIIDLTGNNYBT-SAMQYFKISA-N 445.903 2.673 50 40 IFGB CCc1ccc(NC(=O)COC(=O)CCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1 408665656 VIMUMVQATIJEAJ-UHFFFAOYSA-N 431.876 2.626 50 40 IFGB O=C(CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccccc1)N/N=C/c1ccccn1 409012824 LEOUPXZTQJOCAA-ZVHZXABRSA-N 426.473 2.562 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1c(Cl)cccc1Cl)c1cccc([N+](=O)[O-])c1 409026468 QGMIZHVMJPRGJL-DJKKODMXSA-N 445.284 2.818 50 40 IFGB CC1(C)CC(=O)C2=C(C1)NC(SCC(=O)N1CCOCC1)=C(C#N)[C@@H]2c1ccco1 1273127 FKPRHNOPAKDXFY-LJQANCHMSA-N 427.526 2.937 50 40 IFGB CCOC(=O)C1=C(CCl)NC(=O)N[C@@H]1c1cn(-c2ccc(C)cc2)nc1C(=O)OCC 71195286 BLDWHCKVLUELPQ-QGZVFWFLSA-N 446.891 2.767 50 40 IFGB COc1cc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(C)cc2)ccc1OCC(N)=O 803597 JYUPHXWIBYQJDW-QFIPXVFZSA-N 445.479 2.580 50 40 IFGB COc1ccc(/C=N/NC(=O)COc2ccc(OC)cc2I)cc1 910198 TWDYEMYHKBQONE-VXLYETTFSA-N 440.237 2.838 50 40 IFGB Cc1ccc(C(=O)Nc2ccccc2C(=O)NCCC(=O)NNC(=O)c2ccccc2)cc1 3144141 GZPYTFNGXCZGOK-UHFFFAOYSA-N 444.491 2.828 50 40 IFGB COc1cccc(C(=O)N/N=C(/CNNC(=O)c2cccc(OC)c2)c2ccccc2)c1 9289528 OPZOUERZEPGLOW-ROMGYVFFSA-N 432.480 2.773 50 40 IFGB CCOc1cc(/C=N/NC(=O)CSc2nnnn2-c2ccccc2)cc(Cl)c1O 408974812 HCDKJTFHOKASKC-KEBDBYFISA-N 432.893 2.662 50 40 IFGB CCc1ccccc1NC(=O)CNC(=O)NNC(=O)[C@H](C)Nc1nc2ccccc2s1 10608643 ABZZJUPRWZMIPL-ZDUSSCGKSA-N 440.529 2.628 50 40 IFGB COc1cc(/C=N/NC(=O)CN(c2ccccc2)S(=O)(=O)c2ccccc2)ccc1O 19947674 RFGLHKHIJNLXTO-HZHRSRAPSA-N 439.493 2.746 50 40 IFGB Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCCC[C@H]1CCSS1 22698468 SCGXYIDOXLMFDK-ZDUSSCGKSA-N 430.621 2.763 50 40 IFGB CN1CCN([C@@H](CNS(=O)(=O)c2ccc(CCCl)cc2)c2cccs2)CC1 48314029 YKBRJJVPUYWUOE-SFHVURJKSA-N 428.023 2.796 50 40 IFGB CCOC(=O)c1ccc(-c2ccc(/C=N/NC(=O)Cn3nnc(-c4ccccc4)n3)o2)cc1 9283551 QXKZXEBLPFRTCL-ZVHZXABRSA-N 444.451 2.927 50 40 IFGB C[C@H]1CCc2sc(C(=O)NNC(=O)CCN3C(=O)[C@@H](C)Oc4ccccc43)cc2C1 12568120 YMRGHLFNQMFQEU-UONOGXRCSA-N 427.526 2.838 50 40 IFGB N#CCOc1ccccc1/C=N/NC(=O)CNc1ccc(I)cc1 409273259 WRNPPSXCFCAHSC-SRZZPIQSSA-N 434.237 2.756 50 40 IFGB COc1cc(/C=N/NC(=O)[C@H](O)c2ccccc2)ccc1OC(=O)c1ccc2c(c1)OCO2 3030385 YLHMOGFTUKQICN-WUKOTQDVSA-N 448.431 2.827 50 40 IFGB O=C(NNC(=S)NC(=O)c1cccc2c(Br)cccc12)c1ccncc1 32118799 YNLITAVOPOOFES-UHFFFAOYSA-N 429.299 2.947 50 40 IFGB O=C(N[C@H](Cc1ccccc1)C(=O)NNC(=O)c1ccccc1O)OCc1ccccc1 39984882 KEVIHMAGFBLGKK-HXUWFJFHSA-N 433.464 2.691 50 40 IFGB Cc1c(C(=O)N/N=C\c2ccccc2[N+](=O)[O-])nn(-c2ccc(Cl)cc2)c(=O)c1C#N 409066993 OLKJLXWPMHKFJN-KSEXSDGBSA-N 436.815 2.738 50 40 IFGB COc1cc(C(=O)OCC(=O)NNC(=O)c2ccccc2F)ccc1OCCC(C)C 9178267 YRIUIXHMGBYRBG-UHFFFAOYSA-N 432.448 2.877 50 40 IFGB COc1cc(C(=O)Nc2cccc(C(=O)NNC(=O)c3ccco3)c2)ccc1OC(C)=O 10038319 LYVCJCLJIIADBG-UHFFFAOYSA-N 437.408 2.541 50 40 IFGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)CN(c2ccc(Cl)cc2)S(C)(=O)=O)cc1 20209664 OQOMXRXIIBNUPA-LPYMAVHISA-N 436.921 2.605 50 40 IFGB CC[C@@H]1CCc2sc(C(=O)NNC(=O)CCNC(=O)NCc3ccccc3)cc2C1 32865864 FHOMPBJLUIGEOV-OAHLLOKOSA-N 428.558 2.914 50 40 IFGB CCOc1cc(/C=N/NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)ccc1O 408764117 RRLKYAGAHXHCTD-WQZUMXOESA-N 447.557 2.943 50 40 IFGB COc1cc([C@@H]2[C@H](Cl)C(=O)N2NC(=O)Cc2ccccc2)cc(Br)c1O 1632079 KYUYQEKFSYROPZ-JKSUJKDBSA-N 439.693 2.928 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@H]2C[C@H]3[C@@H](Br)[C@H]2Br)cc1 4157163 KXHQMAGGCJSUCQ-BCFCROPCSA-N 443.091 2.667 50 40 IFGB Cc1cc(C(=O)NNC(=O)c2ccc(CS(C)(=O)=O)cc2)c(C)n1-c1ccc(F)cc1 12510302 AEXNNFNKEZFZPR-UHFFFAOYSA-N 443.500 2.853 50 40 IFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cccc(I)c3)[C@@H]2C1 8926324 ODBHAECLMWZLON-SJORKVTESA-N 441.276 2.646 50 40 IFGB O=C(CCCSCCCC(=O)N/N=C/c1ccccc1O)N/N=C/c1ccccc1O 16982898 MWGPMYRFUXZJAS-DFEHQXHXSA-N 442.541 2.992 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccnc1)c1ccc(Cl)c(C(F)(F)F)c1 20213353 ZVNSJQAVOOOFCT-LSFURLLWSA-N 434.827 2.670 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)CCSc2ccccc2)cc1)NC[C@@H]1CCCO1 28214868 DFBGEVKMDWZUHE-RASHHNMQSA-N 441.553 2.993 50 40 IFGB Cc1c(C(=O)N/N=C\c2cccc(O)c2)nn(-c2cccc(C(F)(F)F)c2)c(=O)c1C#N 409056447 GSCHWXPMDGOFQO-RAWMCFOBSA-N 441.369 2.901 50 40 IFGB CCn1c(C)nc2cc(C(=O)NNS(=O)(=O)c3cccc(Br)c3)ccc21 9314409 PIBVGKLWZCYXOO-UHFFFAOYSA-N 437.319 2.750 50 40 IFGB COc1cccc2sc(NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)nc12 9381734 BKHXKPCCFIEUCU-UHFFFAOYSA-N 432.527 2.846 50 40 IFGB CN(CC(=O)N/N=C/c1ccccc1Br)S(=O)(=O)c1ccc(Cl)cc1 16187141 FGAARPUWEZKFEH-VXLYETTFSA-N 444.738 2.873 50 40 IFGB CCN(CC)c1ccc(/C=N/NC(=O)CN2CCN(Cc3ccc(C)cc3)CC2)c(O)c1 19861306 ONJGRVIHADLCTD-YZSQISJMSA-N 437.588 2.815 50 40 IFGB COc1ccc(CSCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1 58915580 XTVGHQNBVUZGMJ-LPYMAVHISA-N 444.513 2.824 50 40 IFGB O=C(O)c1ccccc1N1C(=O)[C@H]2[C@@H]3C[C@H]([C@@H](Br)[C@H]3Br)[C@@H]2C1=O 100537378 RVSOKZITIXHEOI-BEQXCEGASA-N 443.091 2.667 50 40 IFGB COc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)NC[C@@H]3CCCO3)cc2)cc1 408796478 PDPNMOKHJDUJDX-CAVPUYEOSA-N 435.480 2.915 50 40 IFGB COc1ccccc1N1CCN(C(=O)C(=O)N/N=C/c2ccccc2C(F)(F)F)CC1 408975119 HSBBFEUNRKQHFY-AFUMVMLFSA-N 434.418 2.513 50 40 IFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)[C@@H]1CC(=O)N(c2ccc(Br)cc2)C1 8691536 VSZZBHCIDZHCAX-RNDVCUHJSA-N 431.246 2.861 50 40 IFGB COc1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc(I)c1OC 15223462 VMKJKASSVYYBLH-XEVNVYFWSA-N 442.253 2.511 50 40 IFGB O=C(CSc1ccc(Cl)cc1)NNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1 72297059 JXGDAQMAOAYGKS-IBGZPJMESA-N 437.924 2.792 50 40 IFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)CNc1ccc(Br)cc1 409352494 ZHIPLQYUXXHJDA-SRZZPIQSSA-N 431.246 2.932 50 40 IFGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 13145287 SREAZBJIMNQLOX-HZHRSRAPSA-N 428.514 2.584 50 40 IFGB CCNC(=O)COc1ccc(C(=O)NNC(=O)COc2ccccc2-c2ccccc2)cc1 25056073 CJTCTJYTRUQEMI-UHFFFAOYSA-N 447.491 2.709 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccccc1Cl 409257228 RMZQFANYACDHGP-XMTZNVEYSA-N 430.892 2.722 50 40 IFGB COc1ccc(C(=O)N/N=C\c2cc(Cl)c(OCC(N)=O)c(Cl)c2)cc1OC 409325074 WYQQYYVUWFNHLI-UYOCIXKTSA-N 426.256 2.639 50 40 IFGB CCOC(=O)COc1c(Br)cc(/C=N/NC(=O)CC#N)cc1Br 8861824 NIOCDCRCWCGUKY-CNHKJKLMSA-N 447.083 2.517 50 40 IFGB CCOC(=O)[C@H](NC(=O)C(Cl)Cl)[C@@H](OC(=O)C(Cl)Cl)c1ccccc1 95705819 GPGUHASJQNXDSM-ZJUUUORDSA-N 431.099 2.926 50 40 IFGB Cc1cccc(NC(=O)COC(=O)CCC(=O)NNC(=O)c2ccccc2Cl)c1C 408648568 ZGURSMZPLUXFLR-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB O=C(COC(=O)CCCC(=O)Nc1cccc2ccccc12)NNC(=O)c1ccccc1 408648677 YBJGXCCLXNSBBV-UHFFFAOYSA-N 433.464 2.953 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2cccc(Cl)c2Cl)S(C)(=O)=O)c1O 408921063 CJGKTQZDLMXEBJ-AWQFTUOYSA-N 446.312 2.624 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2c(C)cc(C)cc2C)c1 409266011 JBLRAJHZRQIEMI-YBNTXHARSA-N 438.528 2.994 50 40 IFGB CCn1c(SCC(=O)NNC(=O)c2ccc(OC)cc2)nnc1-c1ccccc1OC 651119 MDSSPQXDBFUTGD-UHFFFAOYSA-N 441.513 2.536 50 40 IFGB COc1cccc(/C=N/NC(=O)CNC(=O)[C@@H]2CC2(c2ccccc2)c2ccccc2)c1O 2282695 BFEBKDINUYBZKC-KQBIVOJMSA-N 443.503 2.973 50 40 IFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1cc(OC)ccc1OC 6511083 CCXANVUOJNLXPG-SFHVURJKSA-N 427.530 2.957 50 40 IFGB CCCCCCC(=O)NN/C=C1/C(=O)N=C(O)N(c2ccc(Br)cc2)C1=O 9359743 JBPAZBYUIYXFIZ-KAMYIIQDSA-N 437.294 2.711 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@@H]3[C@@H]4C[C@H]([C@@H]3C2=O)[C@@H](Br)[C@@H]4Br)c1 100749338 AQAXYDDYNVXYEF-KISRQWFGSA-N 443.091 2.667 50 40 IFGB CCOc1ccc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1 408972696 QRTIAYBLPHTSCN-HZHRSRAPSA-N 433.505 2.775 50 40 IFGB CCc1ccc(N(CC(=O)N/N=C/c2cccc(Br)c2)S(C)(=O)=O)cc1 409028040 IUCBNYGXBMFFKQ-UDWIEESQSA-N 438.347 2.928 50 40 IFGB O=C(COc1ccccc1/C=N/NC(=O)C(=O)Nc1ccc(F)cc1)NCc1ccccc1 409257649 RPCVAWJRGCKXCJ-JFLMPSFJSA-N 448.454 2.610 50 40 IFGB Cn1cnnc1Sc1ccc(C(=O)N/N=c2/sc3ccccc3n2C)cc1[N+](=O)[O-] 2645877 YRPMIGBHOLVTFL-RELWKKBWSA-N 441.498 2.673 50 40 IFGB O=C(Cn1nnc(-c2ccccc2)n1)N/N=C/c1cc(Br)cc(Cl)c1O 4132522 OXNQCSWSZVZOKY-UFWORHAWSA-N 435.669 2.612 50 40 IFGB Cc1ccc(-c2nnc(SCC(=O)NNC(=O)COc3ccc(Cl)cc3)n2C)cc1 10263891 FBHQBOAYHTYTAZ-UHFFFAOYSA-N 445.932 2.762 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)CN(c2ccccn2)S(=O)(=O)c2ccccc2)cc1 19951257 BFOWBQYHSGFSSA-JJIBRWJFSA-N 438.509 2.826 50 40 IFGB C/C(=N\NC(=O)c1ccco1)c1cc2c(cc1NC(=O)[C@H]1CC=CC[C@H]1C(=O)O)OCO2 20159410 MJYYRKOJVJQPCY-QYMMWASNSA-N 439.424 2.768 50 40 IFGB Cn1c(SCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2O)nnc1-c1ccc(Cl)cc1 38168936 JTUGJJBGSCIDLW-AWQFTUOYSA-N 446.876 2.992 50 40 IFGB O=C(COc1ccc(/C=N\NC(=O)COc2ccccc2)cc1)NCCc1ccccc1 58883264 QUFLGHKAJHXNGB-PKAZHMFMSA-N 431.492 2.953 50 40 IFGB O=C(N/N=C\c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1cc2cc([N+](=O)[O-])ccc2o1 408904742 NWGRSBFDJGLTBV-MTJSOVHGSA-N 439.384 2.850 50 40 IFGB N#C/C(=C/c1ccc(OCc2cccc(C(=O)O)c2)c(Br)c1)C(=O)NC(N)=O 409236217 SAHMSJUBRCKSFM-NSIKDUERSA-N 444.241 2.828 50 40 IFGB O=C(NNC(=S)NC(=O)c1cc2ccccc2oc1=O)c1ccc(Br)cc1 3669184 VOIKNZJXJCOVTE-UHFFFAOYSA-N 446.282 2.505 50 40 IFGB COc1ccc(NC(=O)C(=O)N/N=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)c(OC)c1 58914737 MJMLKYHFBFIJAG-UUYOSTAYSA-N 438.396 2.961 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@H]3C[C@@H](Br)[C@@H](Br)C[C@H]3C2=O)cc1 100553152 PESPVOFYLHXLOG-IWDIQUIJSA-N 431.080 2.811 50 40 IFGB CCN1C(=O)/C(=N\NC(=O)CNC(=O)C(c2ccccc2)c2ccccc2)c2ccccc21 1243176 KSHQQKQMCRDPEE-OLFWJLLRSA-N 440.503 2.822 50 40 IFGB CN(c1ccc(C(=O)N/N=C/c2ccc(C(=O)O)cc2)cc1)S(=O)(=O)c1ccccc1 20059322 UTTMVOANVRTQAU-HZHRSRAPSA-N 437.477 2.974 50 40 IFGB C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1-c1cccs1)c1ccc(Cl)cc1 9233353 FIFIOGFOOXNBEB-AWQFTUOYSA-N 428.865 2.768 50 40 IFGB COc1ccc2c(c1OC)C(=O)O[C@H]2N1C(=O)/C(=N/NC(=O)c2ccco2)c2ccccc21 9266303 FZKXCRJWMRCIHE-DNQXDJSBSA-N 447.403 2.647 50 40 IFGB CCN(CC)c1ccc(/C=N/NC(=O)COc2nc(C)cc(COC)c2C#N)c(OC)c1 16678449 OXDNUJVBHIVOAY-DHRITJCHSA-N 439.516 2.792 50 40 IFGB O=C(CSc1nc2ccccc2s1)NNC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1 35351556 ZOALHYOVNYOCRE-HNNXBMFYSA-N 440.550 2.585 50 40 IFGB COc1ccc(Cl)cc1-c1nnc(SCC(=O)NNC(=O)Cc2ccccc2)o1 408637351 IWTDOTVRYLDGCF-UHFFFAOYSA-N 432.889 2.881 50 40 IFGB O=C(CCC(=O)OCC(=O)Nc1cccc(Cl)c1)NNC(=O)c1ccccc1Cl 408643712 CGHIEUOLECTLRB-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cc2ccccc2oc1=O 15386908 KFKGRWNJVFOCAN-LLVKDONJSA-N 431.242 2.784 50 40 IFGB Cc1c(/C=N/NC(=O)CN(c2ccccc2)S(C)(=O)=O)c(Cl)nn1-c1ccccc1 15945298 FNTYDWQDCXKLSH-LPYMAVHISA-N 445.932 2.750 50 40 IFGB Cc1cc(Cl)cc2c1NC(=O)[C@@]2(O)C/C(=N\NC(=O)CC#N)c1cccc([N+](=O)[O-])c1 17176536 SRNIKBHYSWLXRZ-HSJQUHBMSA-N 441.831 2.521 50 40 IFGB COc1ccc(Br)cc1C(=O)N/N=C/c1cn(CC(N)=O)c2ccccc12 33768137 QNLDNNASIJLMPN-LSFURLLWSA-N 429.274 2.662 50 40 IFGB O=C(CSc1ccc(Cl)cc1)N/N=C/c1ccc(OCC(=O)N2CCOCC2)cc1 408867997 LZDSUPIOEVXMEP-YDZHTSKRSA-N 447.944 2.820 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cc(OC)ccc3OC)[C@H]2C1 6195027 MZHIUBKIYFQJRU-AZUAARDMSA-N 433.468 2.586 50 40 IFGB Cc1cccc(C(=O)NNC(=O)[C@H](C)N(C)CC(=O)Nc2ccccc2C(F)(F)F)c1 12734898 ZYPKOPXUJVMXIP-AWEZNQCLSA-N 436.434 2.734 50 40 IFGB O=C(O)c1cccc(Cn2c(Cl)c(/C=N/NC(=O)c3ccccc3O)sc2=O)c1 13142122 JNJKUGIHHNPJRB-ZVBGSRNCSA-N 431.857 2.779 50 40 IFGB O=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C/c1ccc(O)c([N+](=O)[O-])c1 36081793 PRJQSCYMVFMXNE-AFUMVMLFSA-N 432.436 2.699 50 40 IFGB N#CC1=C(N)C(C#N)(C#N)[C@]2(C(=O)Nc3ccccc32)[C@@H]2CN(Cc3ccccc3)CC[C@H]12 103140514 VCIDMTWIRSOUQT-OFUUFJSKSA-N 434.503 2.798 50 40 IFGB CCOc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccccn2)c2ccccc2)cc1 408926705 WGMARIXUQLMTDO-LFVJCYFKSA-N 438.509 2.826 50 40 IFGB COc1ccc(OCCCOc2ccc(/C=N/NC(=O)Cc3nnc(N)s3)cc2)cc1 9553361 ZSGQMUOXIUGBOP-OEAKJJBVSA-N 441.513 2.670 50 40 IFGB Cc1ccc(N2C(=O)[C@H](/C=N\NC(=O)Cc3cccc4ccccc34)C(=O)NC2=S)cc1 408765103 ZHRBPBICLRKUHC-PUDRWSQFSA-N 444.516 2.857 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1OCC(=O)Nc1ccc(C)cc1C 409164423 IHBCEBRGTJMHJK-BHGWPJFGSA-N 430.892 2.561 50 40 IFGB N#C/C(=C\c1c(Oc2ccccc2F)nc2ccccn2c1=O)C(=O)NC[C@H]1CCCO1 2411894 ZXTIAHYEMDEVSK-ASNKMWSDSA-N 434.427 2.828 50 40 IFGB O=C(CN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)NNC(=O)c1ccc(O)cc1 8820389 RTEOOKJLLUYWTB-GUSDSWBTSA-N 439.518 2.611 50 40 IFGB CCCOc1ccc(-c2[nH]nc3c2[C@@H](c2ccc(OCC(N)=O)cc2)C(C#N)=C(N)O3)cc1 9350731 GSPCKSUEMKZGMC-FQEVSTJZSA-N 445.479 2.948 50 40 IFGB CCn1c(=O)c(C)nc2cc(C(=O)NNC(=O)c3ccccc3Br)ccc21 21005978 SDYJOCBHPBHTPC-UHFFFAOYSA-N 429.274 2.562 50 40 IFGB CCn1c(C)nc2cc(C(=O)NNS(=O)(=O)c3cccc(OC(F)(F)F)c3)ccc21 22957216 UJSHIZKABOXTOZ-UHFFFAOYSA-N 442.419 2.887 50 40 IFGB O=NN(CC(=O)N/N=C\c1ccc(Cl)cc1)CC(=O)N/N=C/c1ccc(Cl)cc1 31623549 WHUAAKATOFVDKO-CHQRTDLRSA-N 435.271 2.577 50 40 IFGB Cc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(Br)cc3)CC2=O)cc1C 408616699 ZWZHIOKGWQEVDO-HNNXBMFYSA-N 430.302 2.880 50 40 IFGB O=C(CSCC(=O)Nc1ccccc1F)NNC(=O)c1ccccc1Br 17358646 AEQGXYBYJUZQSP-UHFFFAOYSA-N 440.294 2.721 50 40 IFGB COc1cccc(N(CC(=O)N/N=C/c2ccc(OCC(C)C)cc2)S(C)(=O)=O)c1 20209968 HKSNOYWAXHHGAW-LPYMAVHISA-N 433.530 2.646 50 40 IFGB COC(=O)c1ccc([C@@H]2CC(=O)NC(SCC(=O)NCc3ccccc3)=C2C#N)cc1 409309702 LJJNDKDLYGYZBH-SFHVURJKSA-N 435.505 2.861 50 40 IFGB CCOc1cc([C@@H]2C(C#N)=C(N)OC(CC(=O)OC)=C2C(=O)OC)ccc1OC(C)C 2270138 OXDORFDATKFLCN-LJQANCHMSA-N 430.457 2.670 50 40 IFGB COC(=O)c1ccc([C@@H]2CC(=O)NC(SCC(=O)N3CCCCCC3)=C2C#N)cc1 409320819 RHSUUSNEBQYQGY-KRWDZBQOSA-N 427.526 2.948 50 40 IFGB CCCOc1ccc(-c2c(C(=O)N/N=C/c3ccsc3)nnn2-c2nonc2N)cc1 2334343 OILYBYLURYHYGD-UFFVCSGVSA-N 438.473 2.514 50 40 IFGB O=C1N=C([n+]2ccc(C(=O)c3ccccc3)cc2)/C(=C\NNC(=O)c2ccccc2O)S1 59797655 OWIBGEIWOHZWNU-XMHGGMMESA-O 445.480 2.800 50 40 IFGB O=C(CCBr)N1CCC(=O)N(C(=O)CCBr)c2ccccc21 2144227 PZAIEASPFMYMIQ-UHFFFAOYSA-N 432.112 2.853 50 40 IFGB COC(=O)c1cccc(Cn2c(Cl)c(/C=N/NC(=O)c3ccc(O)cc3)sc2=O)c1 2231777 SLUOBZZCQUVBFB-LSHDLFTRSA-N 445.884 2.868 50 40 IFGB O=C(CCNC(=O)c1ccccc1Br)N/N=C1/C(=O)Nc2ccc(Cl)cc21 2675872 QAIQHLAAHJTZIS-UHFFFAOYSA-N 449.692 2.695 50 40 IFGB NC(=O)Cn1cc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)c2ccccc21 33958857 IGLYYBNUPOVVTL-JFLMPSFJSA-N 426.476 2.513 50 40 IFGB O=C(CCN1CCN(Cc2ccccc2)CC1)N/N=C/c1cc(Br)ccc1O 95532776 IJXLLNJSRPHFDH-HZHRSRAPSA-N 445.361 2.813 50 40 IFGB O=C(O)c1ccccc1N1C(=O)[C@H]2[C@H](C1=O)[C@H]1C[C@H]2[C@H](Br)[C@H]1Br 102066062 RVSOKZITIXHEOI-DZRDUMEESA-N 443.091 2.667 50 40 IFGB COC(=O)[C@@H]1C(=O)NC(SCC(=O)N2[C@@H](C)CCC[C@H]2C)=C(C#N)[C@@H]1c1ccccc1 409131880 PGYRQKOPKAYIFC-VZJWBNGJSA-N 441.553 2.947 50 40 IFGB CCOc1ccc(C(=O)N/N=C\c2ccc(OCC(N)=O)c(OCC)c2)cc1OCC 409310550 AUOYFRDFCGQIIO-CFRMEGHHSA-N 429.473 2.511 50 40 IFGB Cc1ccc(SCc2c(C(=O)N/N=C/c3ccccc3)nnn2-c2nonc2N)cc1 9308140 QERPLXGPAAXKLD-SSDVNMTOSA-N 434.485 2.597 50 40 IFGB CCOc1ccc(Nc2ncccc2C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 40007619 JXVZPXGTMTWLSB-FQEVSTJZSA-N 434.452 2.825 50 40 IFGB Cc1cc(C)n(Cc2cccc(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)c2)n1 58011203 NXTHRBVRCQJUAR-UHFFFAOYSA-N 430.468 2.514 50 40 IFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1OC(F)(F)C(F)F 3083840 LAVJGERJRRWRKW-LSFURLLWSA-N 428.298 2.920 50 40 IFGB COc1ccc(-n2nc(C(=O)N/N=C/c3ccccc3OC)c3csc(N)c3c2=O)cc1 16217543 IPIJWTKPJAWKHX-BHGWPJFGSA-N 449.492 2.811 50 40 IFGB CCOC(=O)c1ccc2c(c1)N(CCCS(=O)(=O)O)/C(=C\C=C(C#N)C#N)N2CC 39440299 ADGPDZAJSZPYJY-OCKHKDLRSA-N 430.486 2.602 50 40 IFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1ccc(I)cc1 409226882 WISIAMOVBPOXTJ-RQZCQDPDSA-N 425.182 2.972 50 40 IFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1cc([N+](=O)[O-])cc(Br)c1O 409256735 PICRDDCMYMGWOO-REZTVBANSA-N 439.178 2.744 50 40 IFGB O=C(CCN1C(=O)/C(=C\c2ccco2)SC1=S)NNC(=O)c1ccccc1Cl 8820285 RDTBJQPFCWHOIS-GXDHUFHOSA-N 435.914 2.986 50 40 IFGB O=C(Oc1ccccc1/C=N\NC(=O)[C@H]1COc2ccccc2O1)c1ccc2c(c1)OCO2 16102541 DTKCYMYLBHGGTK-BIJBVDCDSA-N 446.415 2.925 50 40 IFGB CC(=O)NNc1nc(C)c(C(/C=C/c2ccc(Cl)cc2)=N\NC(=O)C[N+](C)(C)C)s1 17214936 YIANCDHJEWJQQF-DHZHZOJOSA-O 449.988 2.808 50 40 IFGB COc1c(Br)cc(Br)cc1C(=O)NNC(=O)c1ccncc1 32119058 CFRBTZWXQAZUNK-UHFFFAOYSA-N 429.068 2.690 50 40 IFGB O=C(COC(=O)CCC(=O)Nc1cccc(Cl)c1)NNC(=O)c1ccc(Cl)cc1 408666350 YWFHKDIMXYZUFK-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2cccc(Cl)c2C)S(C)(=O)=O)c1OC 408781492 SXXOYXGDCCWFOA-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB COc1ccc(C(=O)NNC(=O)c2cccc(NC(=O)c3ccc4c(c3)OCO4)c2)cc1 10040004 WYZCSEQMHJWCRQ-UHFFFAOYSA-N 433.420 2.751 50 40 IFGB COc1ccccc1OCC(=O)N/N=C\c1ccc(O)c(I)c1 96609920 ZHWFFXPTIMTEQT-NVMNQCDNSA-N 426.210 2.535 50 40 IFGB CC(=O)Oc1ccc(/C=N/NC(=O)[C@@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)cc1 408760121 RZCMIARPHGTPDY-KURUZVKSSA-N 445.541 2.764 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2cccnc2)Cc2ccc(F)cc2)cc1 409057342 KSADJGVWICYMCJ-AFUMVMLFSA-N 440.500 2.870 50 40 IFGB COc1ccc(CC(=O)N/N=C\c2cc(Cl)c(OCC(=O)O)c(OC)c2)cc1OC 409360004 CWFZKGHKZWRYIH-YVNNLAQVSA-N 436.848 2.522 50 40 IFGB O=C(COc1ccc(OCC(=O)N/N=C/c2ccccc2)cc1)N/N=C/c1ccccc1 16450992 XXEPKRNTAPDLJF-RYQLWAFASA-N 430.464 2.745 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccc(Cl)cc2Cl)c1 409158974 YQIRLNZIDGSQGG-BHGWPJFGSA-N 449.294 2.763 50 40 IFGB COc1cc(C(=O)N/N=C/c2ccc(OCC#N)cc2)ccc1I 2121811 LSQXWQSNPTUTOU-RGVLZGJSSA-N 435.221 2.966 50 40 IFGB O=C(CCCn1c(=O)oc2ccccc21)NNC(=O)CSc1cccc2cccnc12 13141442 OCVBMLXPXAYNSC-UHFFFAOYSA-N 436.493 2.863 50 40 IFGB CCc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(C)c(C)c3)CC2)cc1 14819727 AFYTVJINUREFBE-UHFFFAOYSA-N 443.569 2.728 50 40 IFGB C#CCOc1ccc(Br)cc1/C=N\NC(=O)Cc1ccc2c(c1)OCCO2 15230795 LBKBJOBVSSGBRY-XKZIYDEJSA-N 429.270 2.925 50 40 IFGB C/C(=N/NC(=O)c1ccco1)c1cc2c(cc1NC(=O)[C@H]1CC=CC[C@H]1C(=O)O)OCO2 17103271 MJYYRKOJVJQPCY-GEHQGGQLSA-N 439.424 2.768 50 40 IFGB CCOc1ccc(/C(C)=N/NC(=O)CN(c2ccc(OCC)cc2)S(C)(=O)=O)cc1 19954962 VHMRTDQKQYUSLB-CJLVFECKSA-N 433.530 2.790 50 40 IFGB CCc1ccccc1N(CC(=O)N/N=C(\C)c1ccc(NC(C)=O)cc1)S(C)(=O)=O 20208909 RYBGOUALLVXYPK-HZHRSRAPSA-N 430.530 2.514 50 40 IFGB COc1ccccc1NC(=O)COc1ccc(/C=N\NC(=O)c2cccnc2)cc1OC 28617606 KBUNOZFAKBXSAM-MXAYSNPKSA-N 434.452 2.880 50 40 IFGB Cc1ccccc1N1C(=O)NC(=O)[C@@H](/C=N/NC(=O)c2ccc(Cl)cc2Cl)C1=O 408528757 BWCOMLHSLCRBFT-IAAMAZNWSA-N 433.251 2.917 50 40 IFGB O=C(N/N=C/[C@@H]1C(=O)NC(=S)N(c2ccc(Cl)cc2)C1=O)c1ccc(Cl)cc1 408741536 MPGSJQNGKJFHLZ-SCDDIDHTSA-N 435.292 2.773 50 40 IFGB COc1ccc(NC(=O)C(=O)N/N=C/c2ccccc2OCC(=O)Nc2ccccc2)cc1 409259321 YTHRPAWNRKDPAV-MFKUBSTISA-N 446.463 2.802 50 40 IFGB CC(=O)Oc1ccc(/C=N/NC(=O)COc2cccc(Br)c2)c(OC(C)=O)c1 1434089 JPQDYYOJNHVLQB-UFFVCSGVSA-N 449.257 2.829 50 40 IFGB CN1C(=O)/C(=N\NC(=O)c2ccc(NS(=O)(=O)c3cccs3)cc2)c2ccccc21 6141806 JLGFSBXAGXMCMF-UZYVYHOESA-N 440.506 2.659 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc(F)cc1)c1cccc(Br)c1 20060497 IDTGYOJOKDIPBW-VXLYETTFSA-N 428.283 2.505 50 40 IFGB COc1cc(OC)c(OC)cc1/C=C(/C#N)C(=O)NCCc1ccc(OC)c(OC)c1 33581639 ZQORQBQNUOVOGY-BOPFTXTBSA-N 426.469 2.995 50 40 IFGB Cc1ccccc1NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)NCc2ccccc2)cc1 58882117 RAFNDHYNRZHEKW-JVWAILMASA-N 444.491 2.779 50 40 IFGB CCOc1ccc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1 58895651 TYFRKUWBDFIRHI-XQNSMLJCSA-N 429.542 2.945 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1C(=O)O)c1ccc(Cl)c(Cl)c1 408915320 ZNLLYTJXDVLVNP-AWQFTUOYSA-N 444.296 2.608 50 40 IFGB CCc1ccccc1NC(=O)COc1ccccc1/C=N/NC(=O)C(=O)NCc1ccco1 409250388 KTSHKNJTLUOJAT-VULFUBBASA-N 448.479 2.626 50 40 IFGB COc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1 1800572 QOOYHJLOLPKPKP-SNVBAGLBSA-N 426.256 2.555 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(OC)c(OC)c3)[C@@H]2C1 6194998 IIJLFGCSSSNMSQ-YLJYHZDGSA-N 433.468 2.586 50 40 IFGB COc1ccc(CCNC(=O)c2ccccc2NCC(=O)NNC(=O)c2ccccc2)cc1 9220346 MEEIJHZXGUMIPH-UHFFFAOYSA-N 446.507 2.541 50 40 IFGB CCOC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cc(Cl)ccc2OC)c1 15590618 JMFHACWWUHEMTF-UHFFFAOYSA-N 427.866 2.540 50 40 IFGB COc1cc(C(=O)NNC(=O)c2occc2CN2CCOCC2)ccc1OCCC(C)C 40153055 NBJYYBRNVMTWGH-UHFFFAOYSA-N 445.516 2.620 50 40 IFGB O=C(CCC(=O)OCC(=O)Nc1ccccc1Cl)NNC(=O)c1ccccc1Cl 408648058 WZZXAGLDKJXPDZ-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc2c(c1)OCO2)c1cc(Cl)cc(Cl)c1 408783987 OZSKNNSRIRXLMH-DNTJNYDQSA-N 444.296 2.638 50 40 IFGB Cc1noc(C)c1COc1cccc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)c1 2618788 QRABRNIPVYWTRA-UHFFFAOYSA-N 433.468 2.761 50 40 IFGB Cc1c(C(=O)NNC(=O)[C@H](NS(=O)(=O)c2cccs2)C(C)C)oc2ccccc12 17448367 NCXNNAJNJNIJNL-MRXNPFEDSA-N 435.527 2.567 50 40 IFGB CC(=O)Nc1ccc(C(=O)N/N=C/c2cc(Br)c(N3CCOCC3)o2)cc1 33738535 ZZADQPNXUILESQ-RGVLZGJSSA-N 435.278 2.601 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)cc1O 408761741 BDLIXDFONBVNFA-MNOULKQQSA-N 433.530 2.553 50 40 IFGB COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@@H]1c1ccc2c(c1)OCCO2 25044140 ZMQZLDWGKGKEOT-QGZVFWFLSA-N 445.903 2.718 50 40 IFGB CCNC(=O)N(C)NC(=O)c1ccccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1 95457358 GVRZXWSCLPSMPT-UHFFFAOYSA-N 444.435 2.812 50 40 IFGB CCCCC(=O)Nc1nnc(CC(=O)N/N=C/c2cc(Br)ccc2O)s1 408729863 DSIRECAXDWMALN-GIJQJNRQSA-N 440.323 2.828 50 40 IFGB CCOc1cc(/C=N/NC(=O)c2ccco2)cc(I)c1OC(C)=O 408766049 YXJCGMCOGITDHH-GIJQJNRQSA-N 442.209 2.972 50 40 IFGB CCn1c(NNC(=O)[C@@H](NC(=O)c2c(F)cccc2F)C(C)C)nc2ccccc2c1=O 11156716 LNGFCEPBIFKLJX-SFHVURJKSA-N 443.454 2.592 50 40 IFGB O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)CNC(=O)c1ccc(F)cc1 12912672 CZCKNLZPAJQXIC-UHFFFAOYSA-N 442.274 2.869 50 40 IFGB C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1CSc1ccccc1)c1cccs1 13513011 PYQOTVOMDGGEAR-RGVLZGJSSA-N 440.514 2.740 50 40 IFGB Cc1ccc([C@@H]2CC(=O)C3=C(C2)OC(N)=C(C#N)[C@]32C(=O)N(CO)c3ccccc32)cc1 17095367 ZRVDCLMXVAPTES-CPJLOUKISA-N 427.460 2.654 50 40 IFGB Cc1ccc(NC(=O)COC(=O)[C@@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)cc1Cl 101879488 LHNFQEOINWNGMO-GUATVOGLSA-N 442.693 2.701 50 40 IFGB CCn1c(SCC(=O)NNC(=O)COc2ccccc2)nnc1-c1ccc(Cl)cc1 408639478 XRNGEVKXDNANBF-UHFFFAOYSA-N 445.932 2.937 50 40 IFGB O=C(COc1ccc(Br)cc1)N/N=C/c1ccc(N2CCOCC2)c(F)c1 409129449 JRJLNWPQZJJLRL-WSDLNYQXSA-N 436.281 2.954 50 40 IFGB COc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4cccc([N+](=O)[O-])c4)c32)cc(OC)c1O 8926581 SYWOWJQSAUPRNJ-INIZCTEOSA-N 435.396 2.926 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2ccc(C)c(Cl)c2)S(C)(=O)=O)c(OC)c1 408771888 JWMXCVQFEPRSKX-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB O=C(CNC(=O)c1ccccc1F)N/N=C1\C(=O)N(Cc2ccccc2)c2ccccc21 1496748 JUVXBRMQIXEXPQ-SLMZUGIISA-N 430.439 2.623 50 40 IFGB Cc1nnc(SCC(=O)NNC(=O)COc2ccc(Cl)cc2)n1Cc1ccccc1 13452424 VEGZGJUPKKCPAQ-UHFFFAOYSA-N 445.932 2.607 50 40 IFGB CNC(=O)c1ccc(S(=O)(=O)NNC(=O)c2sccc2-c2ccc(C)cc2)cc1 15756861 VYRKARUJRXSOMO-UHFFFAOYSA-N 429.523 2.706 50 40 IFGB COc1ccccc1N1CCN(C(=O)C(=O)N/N=C/c2cccc(Cl)c2Cl)CC1 59444352 FFDYRLOFNHVVSP-YDZHTSKRSA-N 435.311 2.801 50 40 IFGB Cc1c(C(=O)N/N=C\c2cccc([N+](=O)[O-])c2)nn(-c2ccc(Cl)cc2)c(=O)c1C#N 409071323 NRMVSCZZEYSFGI-KSEXSDGBSA-N 436.815 2.738 50 40 IFGB CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)CCN2C(=O)c3ccccc3C2=O)c(OC)c1 945197 PNNNGZOTYLCHKG-FOWTUZBSSA-N 448.431 2.757 50 40 IFGB CCN(CC)CCCn1c(C)cc2c(c1=O)[C@H](c1ccc3c(c1)OCO3)C(C#N)=C(N)O2 2246522 AAJZLVZHGSFGPB-OAQYLSRUSA-N 436.512 2.836 50 40 IFGB COc1ccccc1/C=N/NC(=O)CN(C1=NS(=O)(=O)c2ccccc21)c1ccccc1 8690666 YQRPMQOKAUFGAE-BUVRLJJBSA-N 448.504 2.801 50 40 IFGB O=C(COC(=O)c1ncc(Cl)c(Cl)c1Cl)NNC(=O)c1ccc([N+](=O)[O-])cc1 9643087 TZRXLFAINWHKBF-UHFFFAOYSA-N 447.618 2.568 50 40 IFGB O=C(CN(CCc1ccccc1)S(=O)(=O)c1ccccc1)N/N=C\c1ccc(O)cc1 39986582 RIJUIDGOUBBVMV-ULJHMMPZSA-N 437.521 2.776 50 40 IFGB Cc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1NS(C)(=O)=O 40058527 KOOJMBFTVXWFPZ-OAHLLOKOSA-N 441.509 2.748 50 40 IFGB CNC(=O)c1cc(Oc2ccc(NC(=O)NNc3ncc(Cl)cn3)cc2F)ccn1 1649407287 KKQSCHOPQOADAJ-UHFFFAOYSA-N 431.815 2.965 50 40 IFGB CCc1ccccc1N(CC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1Cl)S(C)(=O)=O 20208939 KGVKIGDWGURXEU-RGVLZGJSSA-N 438.893 2.727 50 40 IFGB Cc1cc(NCC(=O)N/N=C/c2ccc3c(c2)OCO3)ccc1I 1081918 FIIBJJKZXHDXKK-DNTJNYDQSA-N 437.237 2.891 50 40 IFGB Cc1cc2c(c(=O)n1Cc1ccc3c(c1)OCO3)[C@H](c1ccc(O)cc1)C(C#N)=C(N)O2 2424300 DGQWFYIVDRQNSB-OAQYLSRUSA-N 429.432 2.858 50 40 IFGB COc1cc(/C=N/NC(=O)C(=O)NCc2ccc(Cl)cc2Cl)cc(OC)c1OC 8426860 AKOJSVLVOKLWCM-NUGSKGIGSA-N 440.283 2.786 50 40 IFGB COc1cc(CCC(=O)NNC(=O)[C@H](C)Nc2nc3ccccc3s2)cc(OC)c1 10676811 OWFJUJOSOLCWBA-ZDUSSCGKSA-N 428.514 2.894 50 40 IFGB COc1cc(/C=C(/C#N)C(=O)NCc2ccc(C)cc2)ccc1OCCN1CCOCC1 17099610 WQNKAPHDUZVERS-JCMHNJIXSA-N 435.524 2.938 50 40 IFGB COC(=O)COc1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1OC 59333014 WOBHCXRGEHOEDF-RGEXLXHISA-N 435.480 2.503 50 40 IFGB COc1cc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)c([N+](=O)[O-])cc1OC 408748053 XSFVNNPIMVPUAZ-BUVRLJJBSA-N 435.436 2.998 50 40 IFGB CCOc1cc(/C=N/NC(=O)[C@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)ccc1OC 408762318 OBLNNRMUXWQGDE-KURUZVKSSA-N 447.557 2.856 50 40 IFGB COc1cc(/C=C(\C#N)C(=O)NCc2cccs2)ccc1OCC(=O)N1CCCC1 409199208 HPASBHARVKMGHB-GZTJUZNOSA-N 425.510 2.981 50 40 IFGB O=C(CCCCCCC(=O)N/N=C/c1ccc([N+](=O)[O-])o1)N/N=C/c1ccc([N+](=O)[O-])o1 8895324 WNXMVSGYQSXPCQ-AYKLPDECSA-N 448.392 2.630 50 40 IFGB N#CC1=C(N)Oc2n[nH]c(-c3ccc([N+](=O)[O-])cc3)c2[C@]12C(=O)Nc1ccc(Cl)cc12 9160254 BXHZAUHIXZGGKE-HXUWFJFHSA-N 434.799 2.963 50 40 IFGB C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1-c1ccc(Cl)c(Cl)c1)c1ccco1 9316475 ZPWZAYBTXYIUDF-ODCIPOBUSA-N 447.242 2.953 50 40 IFGB CC1=C(C#N)C(=O)N([C@H]2CCS(=O)(=O)C2)C(=O)/C1=C\Nc1ccc(C(C)(C)C)cc1 9423839 ZKTWFUJQSGGFAU-LSPINASFSA-N 427.526 2.676 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2cccc(Cl)c2C)S(C)(=O)=O)cc1OC 408777826 JTQJKHYOBOPWPT-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NC3CCCCC3)c2)cc1 3237266 BNXQLMJKHMXQKV-UHFFFAOYSA-N 446.529 2.773 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CNC(=O)COc2ccccc2Cl)cc1OC 8452586 ZJSDFURGQGMUHX-WYMPLXKRSA-N 431.876 2.559 50 40 IFGB O=C(CN1CCOCC1)N/N=C/c1ccc(OCc2ccc(Br)cc2)cc1 15018702 RBIFVDAPKKGVGR-LPYMAVHISA-N 432.318 2.810 50 40 IFGB CCN(CC)c1ccc(C(=O)NNC(=O)CN(C)CC(=O)Nc2ccccc2Cl)cc1 15448845 VSVWHRMHYRAAAN-UHFFFAOYSA-N 445.951 2.518 50 40 IFGB CCOc1ccc(/C=N\NC(=O)CN(C)S(=O)(=O)c2ccc(OC)c(Cl)c2)cc1 39986656 OXBJFWJCUHLBFR-MTJSOVHGSA-N 439.921 2.518 50 40 IFGB O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NNC(=O)c1ccccc1O 2375489 UWWKOPGYGCGNMT-PTNGSMBKSA-N 447.563 2.896 50 40 IFGB C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cc2ccccc2oc1=O 15386909 KFKGRWNJVFOCAN-NSHDSACASA-N 431.242 2.784 50 40 IFGB Cc1cccc(-n2c(C)c(Br)c(/C=N/NC(=O)CN3CCOCC3)c2C)c1 20243788 LPTUVCVCWJUXIG-WSDLNYQXSA-N 433.350 2.947 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2F)cc1)NC1CCCCC1 58884323 AMBDHNSXMHJBQW-AFUMVMLFSA-N 440.475 2.742 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1F)c1ccc(Br)cc1 408780793 KSHWSOFACOXGNF-VXLYETTFSA-N 428.283 2.505 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1cccc(Cl)c1 409250371 KNDMTOVKSJDMGF-CHOFVFFHSA-N 430.892 2.722 50 40 IFGB C=CCn1c(SCC(=O)NNC(=O)c2ccc(F)cc2)nc2sc(CC)cc2c1=O 2619014 ZDJWHWXZAOYGLD-UHFFFAOYSA-N 446.529 2.899 50 40 IFGB CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)c2ccccc2O)[C@H]1c1ccc(OC)cc1 40049161 VCIQFWFLYLEDPY-DENIHFKCSA-N 439.512 2.942 50 40 IFGB Cc1cc(C)cc(N2C[C@H](C(=O)NNC(=O)c3ccc(Br)cc3)CC2=O)c1 408645298 UPIATMLOTSEANG-OAHLLOKOSA-N 430.302 2.880 50 40 IFGB Cc1cccc(C)c1NC(=O)COC(=O)CCC(=O)NNC(=O)c1ccc(Cl)cc1 408663824 OMWYDCOKLURQQY-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1cccc(Cl)c1 409250372 KNDMTOVKSJDMGF-XMTZNVEYSA-N 430.892 2.722 50 40 IFGB COc1cc(OC)c(OC)cc1/C=C(\C#N)C(=O)NCCc1ccc(OC)c(OC)c1 3534331 ZQORQBQNUOVOGY-GZTJUZNOSA-N 426.469 2.995 50 40 IFGB O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NNC(=O)COc1ccccc1Cl 9052194 WLCHNKPUWODBLL-UHFFFAOYSA-N 437.883 2.963 50 40 IFGB CC(C)C[C@H](C(=O)NNC(=O)c1cn(C)c2ccccc12)N1C(=O)c2ccccc2C1=O 10736652 BEMKINRYTYDQQY-HXUWFJFHSA-N 432.480 2.650 50 40 IFGB CN(CC(=O)N/N=C/c1cccc(Cl)c1)S(=O)(=O)c1ccc(Br)cc1 16187041 GBTKTGUTUBUOMN-VXLYETTFSA-N 444.738 2.873 50 40 IFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)c1cc(=O)[nH]c2ccc(Br)cc12 28629034 JKUYDXHIQXUHCE-UFWORHAWSA-N 431.202 2.668 50 40 IFGB CC(C)CNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1 58873357 NLDNKPIZTAUKML-WYMPLXKRSA-N 430.892 2.580 50 40 IFGB O=C(NNC1=C/C(=N/S(=O)(=O)c2ccccc2)c2ccccc2C1=O)c1ccccc1O 95908388 MLSQIKILEVRCOL-XHPQRKPJSA-N 447.472 2.585 50 40 IFGB Cn1ncc(Cl)c1C(=O)N/N=C/c1ccccc1OC(=O)c1ccc([N+](=O)[O-])cc1 695787 NWODRFLMMSEKCU-UFFVCSGVSA-N 427.804 2.965 50 40 IFGB O=C1c2ccccc2S(=O)(=O)N1C[C@H](Br)[C@@H](Br)CCl 4107648 WCNUPMQBUXFKQT-IUCAKERBSA-N 431.533 2.597 50 40 IFGB CC[C@@H](C)N1C(=O)C(C#N)=C(C)/C(=C/Nc2cc(OC)c(OC)cc2C(=O)OC)C1=O 9420495 UVZYLESTTQNDIB-COOUDCDJSA-N 427.457 2.794 50 40 IFGB Cc1ccc(NC(=O)COC(=O)[C@H]2[C@@H]3C[C@H]4[C@H](OC(=O)[C@@H]42)[C@@H]3Br)cc1Cl 9581305 LHNFQEOINWNGMO-FULYMMCDSA-N 442.693 2.701 50 40 IFGB C/C(=N/NC(=O)[C@H](C)n1cnc2sc3c(c2c1=O)CCC3)c1ccc2c(c1)OCCO2 13959930 CHYHSTNFKMCWEI-RTNLCPHNSA-N 438.509 2.819 50 40 IFGB C=CCNc1nc2[nH]c(=O)c3c(c2s1)OC(N)=C(C#N)[C@H]3c1ccc(C(=O)OC)cc1 15084417 CTLUZSYDCHVRMA-CYBMUJFWSA-N 435.465 2.587 50 40 IFGB CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)NNC(=O)COc1ccc(Cl)cc1C 16739956 PBEIORVWBNTFNQ-QGZVFWFLSA-N 433.892 2.532 50 40 IFGB O=C(CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccccc1)N/N=C/c1cccc(O)c1 409009828 IMHLIFFEWZEBJX-ZVHZXABRSA-N 441.484 2.873 50 40 IFGB CCOc1ccc(/C=N\NC(=O)c2nn(-c3ccc(OC)cc3)c(=O)c(C#N)c2C)cc1 409061855 JEHAIBFADGZJSG-QFEZKATASA-N 431.452 2.584 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccc(F)c(Cl)c1 409257406 QRJLIWOVIXTCIT-DKZNWEEVSA-N 448.882 2.861 50 40 IFGB N#CCOc1ccc(/C=N/NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)cc1 2174602 JWSGFEDNZLBREN-IXOWOOARSA-N 446.916 2.546 50 40 IFGB COc1cccc(-c2nn(-c3ccccc3)cc2C(=O)NNC(=O)Cn2nc(C)cc2C)c1 12971880 XNXBFFMSLLTKNL-UHFFFAOYSA-N 444.495 2.822 50 40 IFGB COc1cccc(N2C(=O)NC(=O)[C@@H](/C=N/NC(=O)c3ccc(Cl)cc3Cl)C2=O)c1 408538079 YVDGBONAZFHIAX-BMZJSHLCSA-N 449.250 2.617 50 40 IFGB CCOC(=O)[C@H]1C(=O)NC(SC)=C(C#N)[C@@H]1c1ccccc1I 726119 CRBJIUSMKAIHOA-QWHCGFSZSA-N 442.278 2.782 50 40 IFGB CCOc1cc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)ccc1OCC(N)=O 814142 VBXYXKCNBVBTCR-QFIPXVFZSA-N 445.479 2.662 50 40 IFGB N#C/C(=C\c1c(N2CCCCC2)nc2ccccn2c1=O)C(=O)NCCc1ccccc1 2198094 YUJMNXTVGNCJKJ-LVZFUZTISA-N 427.508 2.951 50 40 IFGB Cc1ccc(Cl)cc1NC(=O)COC(=O)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@@H]2Br 408687571 UQKUTDHLMYBEDZ-CPWZOYSTSA-N 442.693 2.701 50 40 IFGB Cc1c(Cl)cccc1NC(=O)COC(=O)[C@H]1[C@H]2C(=O)O[C@H]3[C@@H]2C[C@H]1[C@H]3Br 408688145 VVBSDHXAHGJLEU-JMUWXNPOSA-N 442.693 2.701 50 40 IFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4cccnc4)c(=O)c32)cc2c1OCO2 9089774 DVYOPSSURZLMDI-HXUWFJFHSA-N 444.447 2.556 50 40 IFGB CC(C)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NNC(=O)c1ccc2c(c1)OCO2 14244364 GAHWBQFXQKKVAV-KBTRNUBCSA-N 441.528 2.534 50 40 IFGB CCOC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N/N=C/c1ccccc1OCC#N 409004075 WKOUBIGXIQVQDI-XYCMHOAJSA-N 433.468 2.878 50 40 IFGB O=C(N/N=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1ccccc1Br 409016539 DHCBJJKYCYCJBY-UDWIEESQSA-N 433.262 2.958 50 40 IFGB O=C(COc1ccc(F)cc1)NN=C1CCC(=NNC(=O)COc2ccc(F)cc2)CC1 409364537 YJYPMYQMEKYIOH-UHFFFAOYSA-N 444.438 2.941 50 40 IFGB COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccsc2)c1 12734386 RUUPTXKLTNBJBO-UHFFFAOYSA-N 445.522 2.561 50 40 IFGB O=C(CN(CCc1ccccc1)S(=O)(=O)c1ccccc1)N/N=C/c1cccc(O)c1 16479007 POPMBAWCOMIBTF-JJIBRWJFSA-N 437.521 2.776 50 40 IFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(Br)cc2)C1)c1ccccc1Cl 115132076 BYPNOOLFQLWLHA-NSHDSACASA-N 436.693 2.917 50 40 IFGB C[C@H](C(=O)NN=C1CCN(C)CC1)N(c1ccc(Oc2ccccc2)cc1)S(C)(=O)=O 409029253 XOQHQUXIMOXWIB-QGZVFWFLSA-N 444.557 2.831 50 40 IFGB N#CC(C(=O)COC(=O)c1ccc(S(=O)(=O)C(F)F)cc1)=C1Nc2ccccc2N1 3442934 RIVLFJZLHFWBFV-UHFFFAOYSA-N 433.392 2.682 50 40 IFGB COc1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1OC 9665598 KUXLXIHYPGHKJX-AWEZNQCLSA-N 430.482 2.634 50 40 IFGB COc1ccc(CC(=O)NNC(=O)COCC(=O)N(c2ccccc2)c2ccccc2)cc1 9934480 MBASTSYERYTBMB-UHFFFAOYSA-N 447.491 2.767 50 40 IFGB N#CC1=C(N)Nc2nc(SCc3ccc(F)cc3)[nH]c(=O)c2[C@]12C(=O)Nc1ccccc12 12377349 DAMPWJGWLUOYGR-JOCHJYFZSA-N 446.467 2.559 50 40 IFGB Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)c2ccccc2O)ccc1F 24839424 GQZBCBHUZPTOKL-UHFFFAOYSA-N 443.456 2.715 50 40 IFGB COc1ccc(NC(=O)C(=O)N/N=C/c2cc(Br)ccc2OC)c(OC)c1 59515654 QDTODDPCOOPTHH-KEBDBYFISA-N 436.262 2.564 50 40 IFGB CCc1ccccc1N(CC(=O)N/N=C(\C)c1ccc(OC)c(OC)c1)S(C)(=O)=O 408774992 DZNTTXOOCKQJTM-PXLXIMEGSA-N 433.530 2.573 50 40 IFGB COc1ccc(NC(=O)N/N=C\c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cc1 408966496 MXTCRCCIZIFSMZ-QRVIBDJDSA-N 441.513 2.906 50 40 IFGB CCc1ccccc1N(CC(=O)NN=C1CCN(Cc2ccccc2)CC1)S(C)(=O)=O 409352065 VXISYJOVVUXVTP-UHFFFAOYSA-N 442.585 2.783 50 40 IFGB CCOC(=O)CN1C(=O)/C(=N\NC(=O)COc2cc(C)ccc2C(C)C)c2ccccc21 2353676 ISSRCLZVNRPBLG-RWEWTDSWSA-N 437.496 2.927 50 40 IFGB COc1cc(/C=N/NC(=O)CN(c2cc(Cl)cc(Cl)c2)S(C)(=O)=O)ccc1O 408773764 JAXKYOCLLKPKDK-AWQFTUOYSA-N 446.312 2.624 50 40 IFGB Cc1ccc(S(=O)(=O)N2C(=O)/C(=N\NC(=O)c3cccs3)c3ccccc32)cc1 12285207 VNIDHQOUGVPLLI-UZYVYHOESA-N 425.491 2.926 50 40 IFGB Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=S)NNC(=O)c1ccc(Cl)cc1 15875766 XQROPVIPRRGXAU-UHFFFAOYSA-N 426.951 2.530 50 40 IFGB COc1ccccc1/C=N/NC(=O)CN(C)S(=O)(=O)c1cc(Cl)ccc1Cl 16187183 DMDNBWCNPGMFJY-KEBDBYFISA-N 430.313 2.773 50 40 IFGB C[C@@H]1CCc2c(sc3ncn([C@H](C)C(=O)N/N=C4\C(=O)Nc5ccccc54)c(=O)c23)C1 6166358 MZZYTMBCRSLKNM-VXGBXAGGSA-N 435.509 2.616 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)CN(c2c(C)cccc2C)S(C)(=O)=O)cc1OC 19955423 ZYOLMDRSILQWOA-CJLVFECKSA-N 433.530 2.627 50 40 IFGB COc1cc(N2N=C(C)/C(=C/NNC(=O)c3cccc([N+](=O)[O-])c3)C2=O)ccc1Cl 408532297 MHNJLTLULGHFAI-GDNBJRDFSA-N 429.820 2.798 50 40 IFGB COc1ccc(C(=O)c2ccccc2C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1 408643471 BDPZLLQHBUVAAQ-UHFFFAOYSA-N 432.432 2.544 50 40 IFGB C/C(=N\NC(=O)CN(c1ccc(F)cc1)S(C)(=O)=O)c1cccc(Br)c1 408784594 VNBPNUXGRAFHHD-UDWIEESQSA-N 442.310 2.895 50 40 IFGB N#C/C(=C/c1ccc(OCC(=O)O)c(I)c1)C(=O)NC1CCCC1 409195962 XLIZOGGDZKTSJV-GHXNOFRVSA-N 440.237 2.720 50 40 IFGB COCCCNC(=O)/C(C#N)=C/c1c(Oc2ccc(OC)cc2)nc2ccccn2c1=O 2436637 MSPGUMIQGQGRTQ-JQIJEIRASA-N 434.452 2.555 50 40 IFGB N#CC1=C(N)OC2=C(C(=O)CCC2)[C@@]12C(=O)N(CC(=O)Nc1ccccc1)c1ccccc12 8914486 OFFQQEFNLRJWKB-VWLOTQADSA-N 440.459 2.641 50 40 IFGB C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc3c(s1)CCCC3)C2=O 9584750 UGMCYQCFUCNQOE-WHEQGISXSA-N 446.573 2.525 50 40 IFGB CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1 12516619 KHKKJXWFDIMFPM-UHFFFAOYSA-N 446.488 2.775 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@H]3C[C@@H](Br)[C@H](Br)C[C@H]3C2=O)cc1 98048832 PESPVOFYLHXLOG-WRWGMCAJSA-N 431.080 2.811 50 40 IFGB CC[C@H](C)[C@H](NC(N)=O)C(=O)NNC(=O)c1ccc(COc2cccc3cccnc23)cc1 9284533 WWMROVFYMUBHBO-YWZLYKJASA-N 449.511 2.658 50 40 IFGB Cc1ccc2c(c1Br)/C(=N/NC(=O)CCC(=O)NCc1ccccc1)C(=O)N2 12462634 QPWJVBFNXHMNBY-UHFFFAOYSA-N 443.301 2.627 50 40 IFGB CC(C)[C@@H](NC(=O)Cc1cccs1)C(=O)N/N=C\c1ccc(N(C)C)c([N+](=O)[O-])c1 34703798 YMAYZKVAAZODFJ-GFIJVFARSA-N 431.518 2.556 50 40 IFGB Cn1c(SCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2O)nnc1-c1cccc(Cl)c1 38163234 GHGGTJBPVQCHOW-AWQFTUOYSA-N 446.876 2.992 50 40 IFGB O=C(NNS(=O)(=O)c1ccc(I)cc1)c1ccc(Cl)cc1 226855117 JNPIJPWSEXPNQB-UHFFFAOYSA-N 436.658 2.568 50 40 IFGB N#C/C(=C\c1cn(CC(=O)NCc2ccco2)c2ccccc12)C(=O)NC[C@H]1CCCO1 883594 XDEYXGQJIQUITF-FVECTHPASA-N 432.480 2.753 50 40 IFGB CCc1ccc(N(CC(=O)N/N=C/c2ccccc2Br)S(C)(=O)=O)cc1 409025067 LDDAWORVOLNSQM-UDWIEESQSA-N 438.347 2.928 50 40 IFGB Cc1ccc(NC(=O)COc2ccccc2/C=N/NC(=O)C(=O)NCc2ccccc2)cc1 409160557 RHKPINRAPUKOKF-JVWAILMASA-N 444.491 2.779 50 40 IFGB CCOc1cc(/C=C(\C#N)C(=O)N2CCCC2)cc(Br)c1OCC(=O)OC 409369195 HGNWSJDOVZIENK-RIYZIHGNSA-N 437.290 2.929 50 40 IFGB O=C(COc1ccc(Br)cc1[N+](=O)[O-])N/N=C/c1ccc([N+](=O)[O-])s1 3030166 ZIGSTJYRWGBZGZ-GIDUJCDVSA-N 429.208 2.856 50 40 IFGB Cc1ccc([C@H]2CC(=O)C3=C(C2)OC(N)=C(C#N)[C@]32C(=O)N(CO)c3ccccc32)cc1 17095368 ZRVDCLMXVAPTES-LMKMVOKYSA-N 427.460 2.654 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)cc1C 408986766 DNCNVARXNAPSRB-HTHFWCIQSA-N 435.484 2.715 50 40 IFGB CCOc1cc(/C=N\NC(=O)c2ccc(C)cc2)cc(Br)c1OCC(N)=O 409251024 NWYNFFIKMXBBPN-YVNNLAQVSA-N 434.290 2.784 50 40 IFGB COc1ccc(C(=O)N/N=C\c2cc(Br)ccc2OCC(=O)O)cc1OC 409314682 GTZCDLIAEVSPLG-UKWGHVSLSA-N 437.246 2.694 50 40 IFGB COc1ccc2c(c1OC)C(=O)O[C@H]2NNC(=O)c1nc(Cl)c(Cl)c(N)c1Cl 19939818 GCYXRZPYLFHMHT-OAHLLOKOSA-N 447.662 2.745 50 40 IFGB COc1cccc(/C=N\NC(=O)c2nn(-c3ccc(C)cc3)c(=O)c(C#N)c2C)c1OC 409075323 YTDDZJJGUGCAJH-MXAYSNPKSA-N 431.452 2.502 50 40 IFGB O=C(NN1C[C@H](C(=O)O[C@H](CCCl)C(=O)c2ccc(F)cc2)CC1=O)c1ccccc1 8927387 AWYNZACHXHJBOU-SJLPKXTDSA-N 446.862 2.743 50 40 IFGB CCCOc1ccc(C(=O)NC(=S)NNC(=O)c2ccc(NC(=O)CC)cc2)cc1 12137284 HGBAOWCUMURZGC-UHFFFAOYSA-N 428.514 2.773 50 40 IFGB N#C/C(=C\c1c[nH]nc1-c1ccc(Cl)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1 17095634 WJOQZOZGJRYFRB-UKTHLTGXSA-N 427.873 2.923 50 40 IFGB O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NNC(=O)c1ccncc1 1764179 MWIWYPYHDXADGK-SDNWHVSQSA-N 432.552 2.586 50 40 IFGB COc1cccc(Nc2nnc(SCC(=O)NNC(=O)/C=C/c3ccco3)s2)c1 2621559 FZQGDVBVKDLSEA-BQYQJAHWSA-N 431.499 2.836 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)CN(c2cc(Cl)ccc2OC)S(C)(=O)=O)cc1 408784683 RTQAYLPAVUZXEK-FYJGNVAPSA-N 439.921 2.664 50 40 IFGB Cc1cc(C)cc(N(CC(=O)NN=C2CCN(C)CC2)S(=O)(=O)c2ccccc2)c1 408827702 GDVQEMDXZISLLA-UHFFFAOYSA-N 428.558 2.697 50 40 IFGB COc1cc(/C=N/NC(=O)[C@H](CC(C)C)NC(=O)COc2ccccc2C)ccc1O 408969024 FXPZLDYZLHIXFL-VQXFCIMOSA-N 427.501 2.769 50 40 IFGB CCOc1cc(/C=N/NC(=O)c2ccccc2Cl)ccc1OCC(=O)N1CCOCC1 409008854 MZLFVQMVSYKTRD-ZVHZXABRSA-N 445.903 2.740 50 40 IFGB O=C(COc1ccc(Cl)cc1Cl)NNC(=S)NC(=O)c1ccc([N+](=O)[O-])cc1 2122546 ATSQLHKQKMTOAB-UHFFFAOYSA-N 443.268 2.616 50 40 IFGB O=C(COC(=O)c1ccccc1Cc1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1 3536311 PXZDYNQTMYIUTM-UHFFFAOYSA-N 433.420 2.804 50 40 IFGB COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccc(F)c3)c2)cc1 12605824 MMQUWIOTSLBNGK-UHFFFAOYSA-N 443.456 2.710 50 40 IFGB CCOc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)c2ccc(Cl)cc2)cc1 27638737 FZVLIJGLWMQJLT-UHFFFAOYSA-N 431.905 2.747 50 40 IFGB O=C(CCCCC(=O)N/N=C/c1cccc([N+](=O)[O-])c1)N/N=C\c1cccc([N+](=O)[O-])c1 31729806 OIGXARFYWZPPQG-VOKWCDJLSA-N 440.416 2.664 50 40 IFGB Cn1cc(/C=N/NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)c2ccccc21 408998645 NANVTMYJHQCIRU-DQMKJMRDSA-N 444.495 2.889 50 40 IFGB O=C(NNC(=O)c1ccc(Cl)s1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 945102 IUOSBJHKWOLPLH-UHFFFAOYSA-N 427.935 2.651 50 40 IFGB CCn1c(SCC(=O)NNC(=O)Cc2c[nH]c3ccccc23)nnc1-c1cccs1 9218767 YWFYICBBSYRMLF-UHFFFAOYSA-N 440.554 2.990 50 40 IFGB COc1ccc(Cl)cc1C(=O)NNC(=O)C[C@@H](NC(N)=O)c1ccccc1Cl 9507925 VFQGCCZICBRKQA-CQSZACIVSA-N 425.272 2.563 50 40 IFGB COc1ccc(CN2C(=O)/C(=C\NNC(=O)c3cccnc3)c3ccccc3C2=O)cc1 13125396 LVMPOFYMBAYDCM-STZFKDTASA-N 428.448 2.548 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccco2)S(=O)(=O)c2ccccc2)c(OC)c1 19950635 REELAMLNESECTL-HYARGMPZSA-N 443.481 2.642 50 40 IFGB Cc1cc(C(=O)NNS(=O)(=O)c2ccc3oc(=O)ccc3c2)c(C)n1-c1ccccc1 22903036 OAUQZCPUZCQFEG-UHFFFAOYSA-N 437.477 2.824 50 40 IFGB O=C(N/N=C1/CCCCc2ccccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1 103383845 ZFAQFDKSPAHHKL-LNVKXUELSA-N 427.526 2.568 50 40 IFGB O=C(COC(=O)CSc1ccc(F)cc1)NNC(=O)c1ccc(Br)cc1 9961534 WHEKMWPIVOSERX-UHFFFAOYSA-N 441.278 2.685 50 40 IFGB CCc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccccc3Br)CC2=O)cc1 17358568 VJRWTYUZQCARBX-AWEZNQCLSA-N 430.302 2.826 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2ccncc2)S(=O)(=O)c2ccc(F)cc2)cc1 20231967 WLPNLCWROHOLHN-ZVHZXABRSA-N 426.473 2.875 50 40 IFGB COc1cc([N+](=O)[O-])cc2cc(C(=O)N/N=C/c3cn(CC(N)=O)c4ccccc34)oc12 107960802 UQETZGRGESUNRS-NUGSKGIGSA-N 435.396 2.554 50 40 IFGB O=C(N/N=C/c1ccc(OCC(=O)N2CCOCC2)cc1)c1ccc(Cl)c(Cl)c1 409012401 JUEBYMCHKVANFW-FSJBWODESA-N 436.295 2.995 50 40 IFGB CCCCOc1ccc(/C=N/NC(=O)CN(c2cccc(OC)c2)S(C)(=O)=O)cc1 20209958 OFNKKXMEXOSIKX-PXLXIMEGSA-N 433.530 2.790 50 40 IFGB CCOc1ccc(N2C[C@@H](C(=O)N/N=C/c3cc(OC)c(OC)c(OC)c3)CC2=O)cc1 409158941 UKVVVZMMWJUTIA-CBFMJHRQSA-N 441.484 2.614 50 40 IFGB N#C/C(=C\c1cn(CC(=O)N2CCOCC2)c2ccccc12)C(=O)NCc1cccs1 409199545 OSXWBHWQSQYTDC-SFQUDFHCSA-N 434.521 2.785 50 40 IFGB O=C(NN=C1c2ccccc2-c2ccccc21)c1cccc(S(=O)(=O)N2CCOCC2)c1 3233645 KTKJZXSEWCYMPW-UHFFFAOYSA-N 447.516 2.870 50 40 IFGB O=C(COc1ccccc1)N/N=C/c1ccc(CNS(=O)(=O)c2ccc(Cl)cc2)o1 408769575 VUGHUOGEQQXLGM-WSDLNYQXSA-N 447.900 2.941 50 40 IFGB Cc1cccc(N(CC(=O)N/N=C/c2cc(Br)c(C)o2)S(C)(=O)=O)c1C 408905960 BMIUBLZGRQFSTE-DJKKODMXSA-N 442.335 2.884 50 40 IFGB CCOC(=O)c1c(NC(=O)/C(C#N)=C/c2ccc3c(c2)OCO3)sc(C(N)=O)c1C 9283038 ZNLFPGYXLJPTOL-WUXMJOGZSA-N 427.438 2.607 50 40 IFGB CS(=O)(=O)c1ccc(C(=O)NNC(=O)CSc2cc(Cl)ccc2Cl)cc1 9507549 MVIJDZJMJHAHQB-UHFFFAOYSA-N 433.338 2.950 50 40 IFGB Cc1cc2c(c(=O)n1CCCN1CCOCC1)[C@@H](c1ccc(Cl)cc1)C(C#N)=C(N)O2 20519074 FMHUONXLVCCBDV-FQEVSTJZSA-N 440.931 2.751 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc(C(=O)O)cc1)c1cc(Cl)cc(Cl)c1 408782464 HDZBGDMSUSPWOT-AWQFTUOYSA-N 444.296 2.608 50 40 IFGB COc1ccc(/C=N/NC(=O)C2CCN(C(=O)c3ccc(OC)c(OC)c3)CC2)cc1 409006657 QQHCSHPLXWXDNZ-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB Cc1ccc(OCC(=O)N/N=C/c2cc3c(cc2Br)OCO3)c([N+](=O)[O-])c1 9355229 BUJRZUPSRWSKSA-FBCYGCLPSA-N 436.218 2.924 50 40 IFGB CCn1nc(C(=O)NNC(=O)c2ccccc2C(=O)c2ccccc2)c2ccccc2c1=O 15856745 SEGXKISEZLREMT-UHFFFAOYSA-N 440.459 2.722 50 40 IFGB COc1cc(/C=C/C(=O)NNC(N)=S)ccc1OCc1ccc(Br)cc1 62715770 NSAMBZZEWAPVPS-WEVVVXLNSA-N 436.331 2.914 50 40 IFGB CCN(CC)c1ccc(N2/C(=N\C(=O)CCl)S[C@@H]3CS(=O)(=O)C[C@@H]32)c(C)c1 101319374 JZBXTGOQOMVTPL-XSAFGROZSA-N 429.995 2.681 50 40 IFGB CCOC(=O)c1c(NC(=O)NNC(=O)c2ccccc2O)sc2c1CC(C)(C)OC2 9435448 XBTQURVUOQIQEF-UHFFFAOYSA-N 433.486 2.948 50 40 IFGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)CN(c2cccc(Cl)c2)S(C)(=O)=O)c1 20209564 DOYZFNLTVGDYFX-LPYMAVHISA-N 436.921 2.605 50 40 IFGB Cc1ccc(C(=O)N/N=C/[C@H]2C(=O)NC(=O)N(c3cccc(C(F)(F)F)c3)C2=O)cc1 108214015 HMWISUDGULBPEP-CJEGQJQSSA-N 432.358 2.629 50 40 IFGB COc1cc(N2CCCC2)c(OC)cc1/C=N\NC(=O)COc1ccccc1[N+](=O)[O-] 409111835 COQUVBSSQZACML-XKZIYDEJSA-N 428.445 2.741 50 40 IFGB COc1ccc(C(=O)NNC(=O)c2ccc(=O)n(Cc3ccc(Cl)cc3)c2)cc1OC 16839343 ZUQWTTAJTSADER-UHFFFAOYSA-N 441.871 2.642 50 40 IFGB COc1cccc(/C=N/NC(=O)c2nc3ccccc3c(=O)n2Cc2ccccc2)c1O 28218237 VFTVFRUNFYLFEE-AFUMVMLFSA-N 428.448 2.923 50 40 IFGB CC(=O)NC12C[C@@H]3C[C@@H](C1)CC(C(=O)NNC(=O)CCSc1ccc(F)cc1)(C3)C2 105855685 NMBIOKDMDPTIGA-KILAXVPQSA-N 433.549 2.930 50 40 IFGB COc1cc(/C=N/NC(=O)[C@H](COCc2ccccc2)NC(=O)OC(C)(C)C)ccc1O 108981502 AKRNRCVGEWAQMQ-VQXFCIMOSA-N 443.500 2.961 50 40 IFGB Cc1ccc(S(=O)(=O)NCc2ccc(/C=N/NC(=O)COc3ccccc3)o2)cc1 408778491 VKRZVWNAMXSSGY-LPYMAVHISA-N 427.482 2.596 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(Br)cc3)C2)c(OC)c1 409154035 FOZFJTIKSTYGDY-HYLGSWLWSA-N 446.301 2.970 50 40 IFGB CC(C)(C)c1ccc(C(=O)NNC(=O)CN2C(=O)N[C@]3(CCCc4ccccc43)C2=O)cc1 12973648 SWYVYXYMKXHCRY-VWLOTQADSA-N 448.523 2.529 50 40 IFGB O=C1c2ccccc2C(=O)c2cc(S(=O)(=O)NNC(=O)[C@@H]3C[C@H]3c3ccccc3)ccc21 13616830 HMROIRBPSHSLDJ-PZJWPPBQSA-N 446.484 2.575 50 40 IFGB C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)N/N=C2/C(=O)Nc3ccccc32)cc1 14361277 IYFJFMJPZZAJFI-HZPDHXFCSA-N 434.496 2.941 50 40 IFGB C/C(=N\NC(=O)CN(c1cccc(C(F)(F)F)c1)S(C)(=O)=O)c1ccccc1O 408776425 OQCOUZCAHRQNFY-WSDLNYQXSA-N 429.420 2.717 50 40 IFGB COc1ccc(C(=O)NNC(=O)c2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3)c2)cc1 409222547 DUEMNZNEFAYGEU-UHFFFAOYSA-N 434.408 2.931 50 40 IFGB C[C@H](C(=O)N/N=C/c1cccc([N+](=O)[O-])c1)n1cnc2sc3c(c2c1=O)CCCC3 958173 RSBNSCLCUMOCQI-OWGFIJSYSA-N 425.470 2.956 50 40 IFGB O=C(CCC(=O)Nc1ccc(I)cc1)N/N=C/c1ccccc1O 1949346 VNAQDINBUTVBIF-YBFXNURJSA-N 437.237 2.866 50 40 IFGB CCc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccc(Br)cc3)CC2=O)cc1 17330551 NMICYCPMIINZAC-OAHLLOKOSA-N 430.302 2.826 50 40 IFGB O=C(NNc1ccc(F)cc1)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccccc1F 32904801 ZMINENWBWGLDCD-IBGZPJMESA-N 431.464 2.998 50 40 IFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2ccc(OC)cc2)cc(Br)c1O 59483280 AOLQGDISPSNTQI-KEBDBYFISA-N 436.262 2.651 50 40 IFGB O=C(CNC(=O)c1ccc2c(c1)OCO2)N/N=C(Br)/C=C/c1ccccc1 2052916 GERVYRXINMJNEI-LZDZMTAZSA-N 430.258 2.683 50 40 IFGB C#CCN1C(=O)/C(=N/NC(=O)COc2cccc(Cl)c2)c2cc(Br)ccc21 9019546 YTVSUCZKYUMHPD-PTGBLXJZSA-N 446.688 2.982 50 40 IFGB O=C(NNC(=O)c1cccs1)c1ccc(Cl)c(S(=O)(=O)NCc2ccccc2)c1 9883010 QCTAKZNOAHEXJQ-UHFFFAOYSA-N 449.941 2.955 50 40 IFGB Cc1ccc(N(CC(=O)NN=C2CCN(C)CC2)S(=O)(=O)c2ccc(C)cc2)cc1 13144997 UVZPDYOMYYBJDU-UHFFFAOYSA-N 428.558 2.697 50 40 IFGB CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3[nH]c(C)c(C)c3c2)c1 13593005 AQNFWJFBQZVJFW-UHFFFAOYSA-N 442.541 2.890 50 40 IFGB Cc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2cccc(N(C)C)c2)cc1Cl 36391698 VYKZIKPKSPEKIN-UHFFFAOYSA-N 444.948 2.848 50 40 IFGB C/C(=N\NC(=O)CN(c1cccc(Br)c1)S(C)(=O)=O)c1ccc(F)cc1 58924416 ITJQWZCKNMCKLE-UDWIEESQSA-N 442.310 2.895 50 40 IFGB COc1cccc(C(=O)N/N=C/c2cc(I)c(O)c(OC)c2)c1 408727237 QSSVFZPJYYXRCJ-GIJQJNRQSA-N 426.210 2.778 50 40 IFGB O=C(N/N=C/c1ccc(N2CCOCC2)cc1)c1cccc(I)c1 409096335 JSPJVYHMTCPUOG-DEDYPNTBSA-N 435.265 2.892 50 40 IFGB COc1cc(/C=C(/C#N)C(=O)NC(N)=O)cc(Cl)c1OCc1ccc(C(=O)O)cc1 409222889 YBQVKZOWSZPGHN-NSIKDUERSA-N 429.816 2.728 50 40 IFGB C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccccc3F)cc2)C1 16044599 NGMCWSUEWWGMGM-GJZGRUSLSA-N 433.505 2.567 50 40 IFGB COc1ccc(CCNC(=O)/C(C#N)=C\c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1OC 96663259 UXEJHFIVOFSANF-YBEGLDIGSA-N 441.440 2.895 50 40 IFGB COc1cccc(N(CC(=O)N/N=C/c2ccccn2)S(=O)(=O)c2ccc(C)cc2)c1 408833378 USYALOOYNLKAIX-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB COc1cccc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)c1O[C@@H](C)C(=O)O 409251409 QDBQQTJHNYCSQC-GNYKCMPYSA-N 448.475 2.933 50 40 IFGB CCOC(=O)Cn1cc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)c2ccccc21 409255080 XTBOHQGWGXBRDX-LSHDLFTRSA-N 425.514 2.854 50 40 IFGB Cc1ccc(-c2c(C(=O)N/N=C/c3c(F)cccc3Cl)nnn2-c2nonc2N)cc1 2350719 KUXKWYDARQQWFU-NUGSKGIGSA-N 440.826 2.764 50 40 IFGB Cc1sc2ncn(CC(=O)N/N=C\c3cc(Br)ccc3O)c(=O)c2c1C 6166573 LEJZVHIDCKDFGG-IOXNKQMXSA-N 435.303 2.693 50 40 IFGB COc1ccc(S(=O)(=O)N(CC(=O)NN=C2CCCC2)Cc2ccccc2)cc1OC 9805564 KBORXCIJSYMWLY-UHFFFAOYSA-N 445.541 2.941 50 40 IFGB Cc1cccc(C(=O)NCC(=O)NNC(=O)CSc2cc(Cl)ccc2Cl)c1 12671616 IKGMQPSUYGFKDE-UHFFFAOYSA-N 426.325 2.971 50 40 IFGB NC(=O)CCn1cc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)c2ccccc21 107884590 SMQXJFHKMSMKSO-OGLMXYFKSA-N 440.503 2.903 50 40 IFGB COCCNC(=O)Cn1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c2ccccc21 6077087 MZSBSLZVQSEQLD-QFIPXVFZSA-N 448.523 2.855 50 40 IFGB COc1ccccc1C(=O)NNC(=O)CCCN1C(=O)/C(=C\c2ccco2)SC1=S 8820326 UHTQZNJKWLWKNA-FOWTUZBSSA-N 445.522 2.731 50 40 IFGB Cn1c(C(=O)NNC(=O)CCC(=O)N2CCc3ccccc3C2)cc2cc(Cl)ccc21 9850681 YFDUSEKBVZJWKI-UHFFFAOYSA-N 438.915 2.958 50 40 IFGB C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc3c(s1)CCCC3)C2=O 9584735 UGMCYQCFUCNQOE-DMZKTXOQSA-N 446.573 2.525 50 40 IFGB COc1ccc(C(=O)NNc2cccc(C(F)(F)F)c2)cc1S(=O)(=O)NC1CC1 58314962 DKQIAIZKCXDIQP-UHFFFAOYSA-N 429.420 2.912 50 40 IFGB Cc1cccc(NC(=O)C(=O)N/N=C/c2ccccc2OCC(=O)NCc2ccccc2)c1 409165692 ASRVBCCOCSIGOJ-JVWAILMASA-N 444.491 2.779 50 40 IFGB C[C@@H]1CCCC[C@@H]1NC(=S)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3 13058675 MAVOJNTUTDYYIY-PBHICJAKSA-N 427.574 2.811 50 40 IFGB CCN(CC)c1ccc(/C=N/NC(=O)Cc2nc3sc(C)c(C)c3c(=O)[nH]2)c(O)c1 20934200 YCXVWRCSKYFJDS-SSDVNMTOSA-N 427.530 2.846 50 40 IFGB CC(C)[C@H](NC(=O)Cc1cccs1)C(=O)N/N=C/c1ccc(N(C)C)c([N+](=O)[O-])c1 33958514 YMAYZKVAAZODFJ-CIPMJJFUSA-N 431.518 2.556 50 40 IFGB O=C(CSc1nc2ccccc2s1)NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 35351553 ZOALHYOVNYOCRE-OAHLLOKOSA-N 440.550 2.585 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])cc(I)c1O 408766125 ZQGQIYQGZSYELW-CAOOACKPSA-N 441.181 2.678 50 40 IFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4ccccn4)c(=O)c32)cc1OC 1471750 YUBGFWXCUDRZJD-OAQYLSRUSA-N 430.464 2.835 50 40 IFGB COc1ccc(CNC(=O)CCC(=O)NNC(=O)Cc2c(C)[nH]c3ccc(C)cc23)cc1 12463670 WVDFOWQSMFXPBC-UHFFFAOYSA-N 436.512 2.580 50 40 IFGB N#C/C(=C\c1ccc(NS(=O)(=O)c2ccc(O)c([N+](=O)[O-])c2)cc1)C(=O)N1CCCC1 32915864 ZCYUNWJQPVNLEC-RVDMUPIBSA-N 442.453 2.631 50 40 IFGB O=C(N/N=C/[C@@H]1C(=O)NC(=O)N([C@H]2C[C@H]3CC[C@H]2C3)C1=O)c1ccc(Cl)cc1Cl 408536893 TUOUUHNFVIUNFM-VSWKWIOWSA-N 437.283 2.592 50 40 IFGB O=C(N/N=C/c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)C(O)(c1ccccc1)c1ccccc1 3113331 BREDZPSZVHGXCM-LPYMAVHISA-N 436.380 2.595 50 40 IFGB CC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)NNC(=O)CCSc1ccc(F)cc1)(C3)C2 18059692 NMBIOKDMDPTIGA-MBWAJUJLSA-N 433.549 2.930 50 40 IFGB COc1ccc([C@H]2C(C#N)=C(N)OC3=C2S(=O)(=O)N(C)c2ccccc23)c(OC)c1 20558303 MJHCCYONHFBOPI-SFHVURJKSA-N 425.466 2.660 50 40 IFGB CN(C)c1ccc(/C=N\NC(=O)CCCCC(=O)N/N=C\c2ccc(N(C)C)cc2)cc1 31629056 LZDPNPOQTNNHAC-MFYXSQMNSA-N 436.560 2.979 50 40 IFGB O=C(CCNC(=O)c1ccccc1NC(=O)c1ccccc1)NNC(=O)c1ccccc1 3146514 MKECNPHEKAUFBT-UHFFFAOYSA-N 430.464 2.520 50 40 IFGB Cc1ccc(S(=O)(=O)CCC(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)cc1 3294431 JZSYOBJMCZRKQI-UHFFFAOYSA-N 425.466 2.544 50 40 IFGB COc1ccc(CC(=O)N/N=C(\C)CC(=O)Nc2ccc3c(c2)OCCO3)cc1OC 13562679 CRJLJRMGVLMGMG-ZVHZXABRSA-N 427.457 2.538 50 40 IFGB O=C(N/N=C/c1ccco1)C1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1 59921795 WFUQWOWKHQYYOK-XDHOZWIPSA-N 440.319 2.593 50 40 IFGB CCc1ccccc1N(CC(=O)N/N=C/c1cccc(Br)c1)S(C)(=O)=O 408774113 AUKCGAVDORSUBQ-UDWIEESQSA-N 438.347 2.928 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(CC)cc2)c(Cl)c1 409163643 VKZSITOKTFOVOY-DHRITJCHSA-N 444.919 2.896 50 40 IFGB CCOc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)ccc1OCC(N)=O 814141 VBXYXKCNBVBTCR-JOCHJYFZSA-N 445.479 2.662 50 40 IFGB O=C(NNC(=O)c1cc(F)ccc1F)c1cccc(S(=O)(=O)NCc2ccccc2)c1 12985303 QGBRRHDRFJKWTB-UHFFFAOYSA-N 445.447 2.518 50 40 IFGB COc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)cn2)cc1 24830471 WVPUERQXBSBFOG-HZPDHXFCSA-N 447.561 2.583 50 40 IFGB CCOc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2cccnc2)c2ccccc2)cc1 408906826 IPXUYNYBJMRDFK-LFVJCYFKSA-N 438.509 2.826 50 40 IFGB Cc1cc2c(c(=O)n1CCN(C)C)[C@H](c1ccccc1Br)C(C#N)=C(N)O2 2247294 RHHMFDKECRMWKN-QGZVFWFLSA-N 429.318 2.699 50 40 IFGB CN(C)N(C(=O)c1cc(-c2cccs2)nn1-c1ccccc1)[C@@H]1CCS(=O)(=O)C1 9584089 XEEYWYPWKAKQSI-MRXNPFEDSA-N 430.555 2.707 50 40 IFGB CCOc1ccccc1/C=N\NC(=O)CN(C)S(=O)(=O)c1ccc(OC)c(Cl)c1 35177671 XDOANCMIWNNPOG-MTJSOVHGSA-N 439.921 2.518 50 40 IFGB COC(=O)N/N=C(/c1nc2ccc(Cl)cc2nc1O)[C@H](O)c1ccc([N+](=O)[O-])cc1 104291294 VBCPPHSSHJQCQP-LRSOKBAUSA-N 431.792 2.691 50 40 IFGB CC(=O)OCC(=O)[C@]1(O)CC[C@H]2[C@@H]3CC[C@H]4[C@@H](Cl)C(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C 118932340 ACYCMKPAVQZVIQ-VWZAPPJTSA-N 438.948 2.858 50 40 IFGB COc1cc(OC)cc(C(=O)NNC(=O)CSc2nc(-c3ccc(Cl)cc3)n[nH]2)c1 408637317 IJAJKXJNFKVJAG-UHFFFAOYSA-N 447.904 2.696 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2cccc(C(F)(F)F)c2)S(C)(=O)=O)cc1 408872339 DIRUPVGXQUWOCO-SSDVNMTOSA-N 429.420 2.630 50 40 IFGB O=C(Cc1cccc(C(F)(F)F)c1)N/N=C\c1ccc(OCC(=O)N2CCOCC2)cc1 409009392 FETXWWCTQJWOFQ-WGARJPEWSA-N 449.429 2.636 50 40 IFGB O=C(CNC(=O)c1ccc2ccccc2c1)NNC(=O)c1ccc(Br)s1 10030855 GMFSUKFQCIEPTB-UHFFFAOYSA-N 432.299 2.855 50 40 IFGB Cc1cc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccco2)c(C)n1-c1ccc(F)cc1 40051364 GAJKUAHEDDLKSO-IBGZPJMESA-N 438.459 2.892 50 40 IFGB Cc1ccccc1OCC(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c1ccc(C(=O)O)cc1 408972945 XEUFKOVGALTYLA-BBMHEYIBSA-N 425.485 2.753 50 40 IFGB O=C(NNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1 409003045 QWBGYVWHHYIIRP-UHFFFAOYSA-N 449.379 2.830 50 40 IFGB COCCn1c(C)cc2c(c1=O)[C@@H](c1ccc(OC)c(Br)c1)C(C#N)=C(N)O2 2326684 NGLUZVOVFXJQBG-KRWDZBQOSA-N 446.301 2.792 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)CSCc2ccccc2)cc1)NC[C@@H]1CCCO1 8452164 LXYDFKWQCCEAKS-LHXREVONSA-N 441.553 2.744 50 40 IFGB COC(=O)c1ccccc1-n1c(C)cc(/C=N\NC(=O)C(=O)NCCc2ccccc2)c1C 223164198 FGFYFAHNGIKFQP-YUMHPJSZSA-N 446.507 2.690 50 40 IFGB COc1cc(/C=C(/C#N)C(=O)NC(N)=O)cc(Cl)c1OCc1cccc(C(=O)O)c1 409221397 PSXKPFPKMJJKMA-NSIKDUERSA-N 429.816 2.728 50 40 IFGB CCN(CC)C(=O)CSC1=C(C#N)[C@H](c2ccccc2Cl)[C@H](C(=O)OC)C(=O)N1 13027159 LWVFGLUSDBYASD-IRXDYDNUSA-N 435.933 2.679 50 40 IFGB COc1ccc(OCC(=O)N/N=C/c2ccc(OCC(=O)N3CCCCC3)cc2)cc1 408864372 UUYPJFNIMCAFAN-BUVRLJJBSA-N 425.485 2.616 50 40 IFGB Cc1ccc([C@H]2CC(=O)C3=C(C2)OC(N)=C(C#N)[C@@]32C(=O)N(CO)c3ccccc32)cc1 17095366 ZRVDCLMXVAPTES-IVCQMTBJSA-N 427.460 2.654 50 40 IFGB O=C(Cn1nnc(-c2ccccc2)n1)N/N=C/c1cc(Cl)cc(Br)c1O 59421150 XXWUXUMEQABULU-UFWORHAWSA-N 435.669 2.612 50 40 IFGB CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CC[C@@H]4[C@@H](Cl)C(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C 118932343 ACYCMKPAVQZVIQ-OKHGOZGVSA-N 438.948 2.858 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C\c2c(O)ccc3ccccc23)cc1C 16282827 BHBNGFKILZPECI-QRVIBDJDSA-N 441.509 2.633 50 40 IFGB O=C(CN1CCCCCC1=O)NNC(=O)C1=NN(c2ccccc2)[C@@H](c2ccccc2)C1 12807871 MLVHIFBGNXGILE-OAQYLSRUSA-N 433.512 2.544 50 40 IFGB C/C(=N/NC(=O)c1ccccc1O)c1cccc(/C(C)=N/NC(=O)c2ccccc2O)n1 17751793 LZZXYEOYZNOUPB-ACZYEWCVSA-N 431.452 2.801 50 40 IFGB COc1ccc(NC(=O)[C@H](NNC(=O)[C@H]2COc3ccccc3O2)c2ccccc2)cc1 32853673 TZGPPUNDTZCKQK-FGZHOGPDSA-N 433.464 2.836 50 40 IFGB O=C1CC=C2[C@@H]3C[C@H]4N(CC[C@]45c4cc(O)c(O)cc4N1[C@H]25)C/C3=C/CBr 61953320 VFOJBHJJEXIGII-XXAFXBFYSA-N 429.314 2.810 50 40 IFGB Cc1c(NC(=O)/C(C#N)=C\c2ccc(N3CCOCC3)cc2)c(=O)n(-c2ccccc2)n1C 96669558 PSYWBZIUIZOUOB-SILNSSARSA-N 443.507 2.867 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)NN=C2CCN(C)CC2)c2ccccc2C)cc1 408859696 PJVLKDPWRWUWDT-UHFFFAOYSA-N 428.558 2.697 50 40 IFGB COc1cc2c3c(c1)[C@@]1(C(=O)N3C(C)(C)C[C@H]2C)C(C#N)=C(N)Oc2cc(C)oc(=O)c21 1460195 ODUCSGYKDKLULQ-YDGUKXNOSA-N 433.464 2.962 50 40 IFGB Cc1ccccc1Oc1nc2ccccn2c(=O)c1/C=C(\C#N)C(=O)NC[C@H]1CCCO1 2405902 NVDXSDHTURNASC-VJSYINPZSA-N 430.464 2.997 50 40 IFGB Cc1ccc(S[C@@H](C)C(=O)N/N=C/c2ccc(OCC(=O)N3CCOCC3)cc2)cc1 409116212 LFDKHVGNEPGEOQ-WORIPGKHSA-N 441.553 2.864 50 40 IFGB O=C(COc1ccccc1/C=N/NC(=O)C(=O)NC1CC1)Nc1cc(Cl)cc(Cl)c1 409261578 DUDUUOJQOZJKMK-AUEPDCJTSA-N 449.294 2.740 50 40 IFGB O=C1[C@H]2[C@@H]3C[C@H]([C@@H](Br)[C@H]3Br)[C@@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1 100537447 ZCDMNVVYMXYOLY-RHIYVLOFSA-N 444.079 2.877 50 40 IFGB O=C(CN1C[C@H](c2ccccc2)CC1=O)N/N=C/c1ccc(Br)c([N+](=O)[O-])c1 408974424 ZOOOFTKIVYOZLU-SBUZPKSBSA-N 445.273 2.824 50 40 IFGB COc1ccc(CCNC(=S)N/C=C(/C#N)S(=O)(=O)c2ccc(C)cc2)cc1OC 5855146 SNCNDCADSVQUBV-JXAWBTAJSA-N 445.566 2.858 50 40 IFGB Cc1csc(=O)n1CC(=O)NNC(=O)c1ccc(COc2cccc3cccnc23)cc1 8880791 QCVPDWMATFITKR-UHFFFAOYSA-N 448.504 2.807 50 40 IFGB CCc1sc(C(=O)NCC(=O)NNC(=O)[C@H](C)Nc2nc3ccccc3s2)cc1C 12983165 NSVQULJEKBKBDP-LBPRGKRZSA-N 445.570 2.606 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2)cc1)NCCc1ccccc1 58880733 BDCGZBIJGPRKOJ-WPWMEQJKSA-N 444.491 2.513 50 40 IFGB O=C(NCCCN(Cc1ccccc1)C(=O)C(Cl)Cl)c1nc2ccccc2c(=O)[nH]1 60017100 RLGNOFMDPJCFFV-UHFFFAOYSA-N 447.322 2.876 50 40 IFGB CC1=C(C#N)C(=O)N([C@@H]2CCS(=O)(=O)C2)C(=O)/C1=C/Nc1cc(Cl)cc(Cl)c1 102675955 SCMDLKMFBYXFDI-UVYNJXETSA-N 440.308 2.685 50 40 IFGB COc1ccc(C)cc1N(CC(=O)N/N=C/c1c(F)cccc1Cl)S(C)(=O)=O 20212350 OROSGAHHIRQPRU-UFFVCSGVSA-N 427.885 2.712 50 40 IFGB Cc1oc(/C=N/NC(=O)[C@H](C)N(c2ccccc2)S(C)(=O)=O)cc1Br 408905869 AFZGVMHMBOCXFO-HPAYWCODSA-N 428.308 2.655 50 40 IFGB CC(C)NC(=O)COc1ccc(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)cc1 101910820 GGVJBBVDNXQFJU-LGJNPRDNSA-N 444.491 2.854 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2Cl)cc1 409257376 QMSMUJVIWOOEQD-XMTZNVEYSA-N 430.892 2.722 50 40 IFGB COc1cc(/C=N/NC(=O)CNc2ccc(F)cc2)cc(I)c1O 409355791 DXQLGZJCJFBRBK-DNTJNYDQSA-N 443.216 2.707 50 40 IFGB CCOC(=O)COc1c(Br)cc(/C=C(\C#N)C(=O)N2CCCC2)cc1OC 409372356 KUTGOFRKDINYNA-RIYZIHGNSA-N 437.290 2.929 50 40 IFGB O=C(Cc1ccccc1Cl)NNC(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1 12917429 LKBLQFZLNZWWBG-UHFFFAOYSA-N 432.885 2.911 50 40 IFGB CCc1cccc(N2C[C@H](C(=O)NNC(=O)c3ccc(OC(C)C)c(OC)c3)CC2=O)c1 12933061 KGFNTPXRYRFVHV-GOSISDBHSA-N 439.512 2.859 50 40 IFGB COc1cccc(-c2nc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)cs2)c1OC 13021439 RIYHRTSACUWSJJ-UHFFFAOYSA-N 427.438 2.631 50 40 IFGB C/C(=N\NC(=O)c1cc(O)cc(O)c1)c1cccc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)c1 17101297 SBBYBMHDGVUBOQ-AHOAIBTLSA-N 437.452 2.857 50 40 IFGB O=C(Cn1c2ccccc2c(=O)c2ccccc21)N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2 6475074 IZNUPZKCDBXPLE-BHGWPJFGSA-N 444.403 2.942 50 40 IFGB C/C(=N/NC(=O)c1ccccc1O)c1cccc(/C(C)=N\NC(=O)c2ccccc2O)n1 8655184 LZZXYEOYZNOUPB-CPZPTNFUSA-N 431.452 2.801 50 40 IFGB COc1ccc(NC(C)=O)cc1S(=O)(=O)NNC(=O)c1cc2c(s1)CCCCC2 12924658 YPXCYZAHQTXASD-UHFFFAOYSA-N 437.543 2.607 50 40 IFGB CCc1ccccc1N1C[C@H](C(=O)NNC(=O)c2ccc(Br)cc2)CC1=O 17330630 XHWOKTZVFGPNJQ-OAHLLOKOSA-N 430.302 2.826 50 40 IFGB CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)C(=O)N/N=C/c1ccc2c(c1)OCO2 33374822 HPQDCMSXSWHNFF-AMAFCZHPSA-N 441.484 2.976 50 40 IFGB COC(=O)CC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(/C)NNC(=O)c1ccccc1 101623774 DIDHHVINOBGYJZ-UYRXBGFRSA-N 449.492 2.771 50 40 IFGB Cc1ccc(N2C(=O)[C@H](/C=N\NC(=O)c3ccc4ccccc4c3)C(=O)NC2=S)cc1 408756000 SSQPQKACZMEMLR-RIMPEIONSA-N 430.489 2.928 50 40 IFGB Cc1cccc2c1NC(=O)/C2=N\NC(=O)[C@H](C)n1cnc2sc3c(c2c1=O)CC[C@@H](C)C3 6166502 MKLAYLHVVBEPPC-YPMHNXCESA-N 449.536 2.925 50 40 IFGB O=C(CSc1ccccc1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 17632480 IPQXHDGFQMBCQD-UHFFFAOYSA-N 444.520 2.942 50 40 IFGB C=CCc1cc(/C=N\NC(=O)CN2CCOCC2)cc(OC)c1OCc1ccccc1F 59247132 JLFIDKFWTRORHN-YSMPRRRNSA-N 441.503 2.924 50 40 IFGB COc1ccc(N2C[C@H](C(=O)N/N=C\c3cc(Br)ccc3O)CC2=O)cc1 409164621 LDDAWZMOESHKIG-CROSZVBWSA-N 432.274 2.667 50 40 IFGB CC(C)CNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2cccc(Cl)c2)c1 409165850 ATZCXZMWRBYOEA-WYMPLXKRSA-N 430.892 2.580 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccn(Cc3ccc([N+](=O)[O-])cc3)n2)cc(OC)c1OC 1091875 AHKJRBVOWOIXJN-WSDLNYQXSA-N 439.428 2.629 50 40 IFGB CC1=C(C#N)C(=O)N(CCN2CCOCC2)C(=O)/C1=C\Nc1cccc(C(F)(F)F)c1 9420944 BZZKQVDWYZCUID-AQTBWJFISA-N 434.418 2.542 50 40 IFGB CCn1c(C)nc2cc(C(=O)NNC(=O)CSc3ccc4c(c3)OCCO4)ccc21 9506842 KYFAEHBRLZAXEL-UHFFFAOYSA-N 426.498 2.689 50 40 IFGB CCn1c(NNC(=O)[C@H](NC(=O)c2c(F)cccc2F)C(C)C)nc2ccccc2c1=O 11156709 LNGFCEPBIFKLJX-GOSISDBHSA-N 443.454 2.592 50 40 IFGB CCOc1ccc(/C(C)=N/NC(=O)[C@H](C)N(c2ccc(OC)cc2)S(C)(=O)=O)cc1 19953715 KBVVCWAIRBFLRV-PZBNQXIHSA-N 433.530 2.789 50 40 IFGB Cc1ccc(S(=O)(=O)/C(C#N)=C/N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1 20403651 QLQOWOFPUUILIU-HMMYKYKNSA-N 425.510 2.680 50 40 IFGB CC(C)[C@@H](NC(=O)Cc1cccs1)C(=O)N/N=C/c1ccc(N(C)C)c([N+](=O)[O-])c1 33958515 YMAYZKVAAZODFJ-MRUVXERFSA-N 431.518 2.556 50 40 IFGB CN(CC(=O)N/N=C\c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccc2ccccc2c1 39986652 FQTNGUYRJACGQQ-BKUYFWCQSA-N 426.454 2.519 50 40 IFGB Cc1ccc(C)c(N(CC(=O)N/N=C/c2cccc(Br)c2)S(C)(=O)=O)c1 408771016 DEZRBTANTFOYLV-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2cc(Cl)ccc2Cl)S(C)(=O)=O)cc1 409027794 HMVBARMAXJPUCM-KEBDBYFISA-N 430.313 2.918 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1Cl 2085267 IAXBFTDEEZRVEU-DJKKODMXSA-N 445.284 2.818 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2ccc(C(C)C)cc2)S(C)(=O)=O)c1OC 408776367 NXMKSNCBHPHQQA-LPYMAVHISA-N 433.530 2.744 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccc(C(C)C)cc2)S(C)(=O)=O)c(OC)c1 408785385 WWLSJMDZZWXSOE-LPYMAVHISA-N 433.530 2.744 50 40 IFGB Cc1oc(/C=N/NC(=O)CN(c2ccc(Cl)cc2)S(C)(=O)=O)cc1Br 58926461 NJBDOOBVRLCURS-QGMBQPNBSA-N 448.726 2.920 50 40 IFGB CCOC(=O)C1=C(CBr)NC(C)=C(C(=O)OC)[C@@H]1c1cccc([N+](=O)[O-])c1 68605194 WQTLFARIUNGLPK-HNNXBMFYSA-N 439.262 2.941 50 40 IFGB biogenic CCOc1ccccc1/C=N/NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1 408988670 IUGFZGJVVXNHLN-SCRDLHCBSA-N 435.484 2.796 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccc(Cl)cc1 409167038 HAAKSPXGYOFZPG-ZMOGYAJESA-N 430.892 2.724 50 40 IFGB Cn1c(=O)[nH]c(=O)c2c1nc(SCCCBr)n2CCCc1ccccc1 5295224 JEDJEGOYJSMDIO-UHFFFAOYSA-N 437.363 2.933 50 40 IFGB C/C(=N\NC(=O)CN1CCN(Cc2ccccc2Cl)CC1)c1ccc([N+](=O)[O-])cc1 13597492 XGXZUBLKNWBDHW-XQNSMLJCSA-N 429.908 2.906 50 40 IFGB O=C(COc1ccccc1-c1ccccc1)NNC(=O)[C@H]1CCCN(c2ncccn2)C1 27605100 PXRZVIGVFUDMMH-IBGZPJMESA-N 431.496 2.586 50 40 IFGB COc1ccc(-n2nc(C(=O)N/N=C\c3cc#cc4ccccc34)c(C)c(C#N)c2=O)cc1 409058239 JRZSZQLMRQDIQI-DICXZTSXSA-N 435.443 2.939 50 40 IFGB C/C(=N\NC(=O)c1[nH]nc(Br)c1Br)c1ccc2c(c1)OCCO2 8782605 LCYKDAAAQKHAMP-REZTVBANSA-N 444.083 2.860 50 40 IFGB CCCCOc1ccc(C(=O)NNC(=O)CNC(=O)c2cc(C)c(CC)s2)cc1OC 12872546 NMPSJYYXFYDSPV-UHFFFAOYSA-N 447.557 2.997 50 40 IFGB Cc1cc(C(=O)NNC(=O)[C@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c(C)o1 27666765 BYNPMOFYGNNHBN-HXUWFJFHSA-N 443.525 2.814 50 40 IFGB CC[C@@H](Oc1cc(Cl)ccc1Cl)C(=O)NNC(=O)[C@@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O 225641957 APTZUNALKUCBEW-FFBJCKDISA-N 427.284 2.821 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccc(Cl)cc1 409257646 TVOMPFUQLGXCDA-XMTZNVEYSA-N 430.892 2.722 50 40 IFGB COc1ccccc1C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1 15940947 WKKGKNYGYRQOAO-UHFFFAOYSA-N 431.495 2.632 50 40 IFGB COc1ccc(NC(=S)NNC(=O)c2cccc(I)c2)cc1 408587245 SNLAGMONLWIKIU-UHFFFAOYSA-N 427.267 2.931 50 40 IFGB C=CCc1cc(/C=N/NC(=O)COc2cccc3cccnc23)cc(OC)c1OCC(=O)O 408849162 VLHZQOJGHQILQA-LGJNPRDNSA-N 449.463 2.964 50 40 IFGB COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)Nc2nnc(-c3ccccc3)o2)c1C 8825942 ZNPSMBOHFHKSEN-XDHOZWIPSA-N 449.467 2.890 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(Cc2ccco2)S(=O)(=O)c2ccccc2)cc1 9845933 JSXGHLLTWNFEKH-HYARGMPZSA-N 427.482 2.629 50 40 IFGB CCOc1ccc2oc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c(C)c2c1 12801100 ATOOMRWACHAUQF-UHFFFAOYSA-N 430.486 2.508 50 40 IFGB CN1/C(=C(/C#N)C(=O)COC(=O)c2ccccc2NS(C)(=O)=O)Sc2ccccc21 105856496 KCJTWZWBJUSMJR-XMHGGMMESA-N 443.506 2.761 50 40 IFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(OC)c(OC)c1 408607693 UIOMERWZAHIHLZ-SFHVURJKSA-N 427.530 2.957 50 40 IFGB CCOc1ccc(/C=N/NC(=O)[C@H](C)N(c2ccccc2)S(C)(=O)=O)cc1OCC 408906274 FCRSZASGXYMHBI-PZBNQXIHSA-N 433.530 2.789 50 40 IFGB C=CCOc1c(/C=N/NC(=O)CNC(=O)COc2ccc(Cl)cc2)cccc1OC 8452589 SPDWSGPUNQFXPK-WYMPLXKRSA-N 431.876 2.559 50 40 IFGB N#CCC(=O)Nc1ccc(C(=O)NNC(=O)CSc2nc3ccccc3s2)cc1 9442638 FNXGMCNNOFFKTH-UHFFFAOYSA-N 425.495 2.702 50 40 IFGB Cc1ccc(C(C)C)c(OCC(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2Cl)c1 13042159 YHUYMZVRSFFPQS-UHFFFAOYSA-N 440.905 2.859 50 40 IFGB CC(C)CNC(=O)CC(=O)N/N=C\c1ccc(OCC(=O)N[C@@H](C)c2ccccc2)cc1 59960434 LAUCXEXYNTUYHV-OMTSMLQXSA-N 438.528 2.555 50 40 IFGB CC1(C)[C@@H]2C[C@@H]1CC=C2/C=N/NC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 102375142 PCCXRCZRXNECAZ-YUPBQZPNSA-N 445.585 2.735 50 40 IFGB O=C(NNc1nc(N2CCCCC2)nc(N2CCOCC2)n1)Nc1ccc(Cl)cc1 408725200 JZGSCMHTPUZYRC-UHFFFAOYSA-N 432.916 2.501 50 40 IFGB N#C/C(=C\c1ccc(OCC(=O)Nc2ccc(I)cc2)cc1)C(N)=O 408756847 XTDFAZZSPQIGMB-UKTHLTGXSA-N 447.232 2.701 50 40 IFGB COc1cc(C)ccc1C(=O)N/N=C/c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 408968373 YFHZICVEPRUVMH-ZMOGYAJESA-N 440.525 2.822 50 40 IFGB O=C(Oc1cccc(/C=N/NC(=O)[C@@H]2COc3ccccc3O2)c1)c1ccc2c(c1)OCO2 3143908 KWYGDBSTTBORAG-RVRSLOCESA-N 446.415 2.925 50 40 IFGB Cc1cccc(O[C@H](C)C(=O)NNC(=O)CCn2c(S)nnc2-c2cccs2)c1C 18103567 GZQXXKDTEGMYLI-CQSZACIVSA-N 445.570 2.917 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2ccc(F)cc2)S(C)(=O)=O)cc1OCC 20211834 LWJALMBNDHAPID-OEAKJJBVSA-N 449.504 2.706 50 40 IFGB O=C(NNc1nc2cc3c(cc2s1)OCO3)c1ccc(S(=O)(=O)N2CCCC2)cc1 9381946 UTGJCIZTABKFDM-UHFFFAOYSA-N 446.510 2.566 50 40 IFGB COc1ccc(NC(=O)COc2ccc([C@@H]3C(C#N)=C(N)Oc4[nH]nc(C)c43)cc2)cc1 9715937 VCZLRZOXTVMNRL-OAQYLSRUSA-N 431.452 2.962 50 40 IFGB O=C(NNC(=O)c1ccccn1)c1ccc(NC(=O)c2ccc(Br)o2)cc1 48345856 WOXKMGVZRSRRSI-UHFFFAOYSA-N 429.230 2.764 50 40 IFGB COc1ccc(C(=O)NNC(=O)CSc2ncc(-c3ccccc3)n2C)cc1OC 905530 CAHCXGPINIHPLV-UHFFFAOYSA-N 426.498 2.658 50 40 IFGB CCCOc1ccc([C@@H]2[C@H]3CN(C(C)=O)CC=C3C(C#N)=C(N)C2(C#N)C#N)cc1OC 1789981 DVGAKCRXQWQNPA-SIKLNZKXSA-N 431.496 2.756 50 40 IFGB C/C(=N/NC(=O)[C@H](C)S[C@@H](C)C(=O)N/N=C(\C)c1ccccc1O)c1ccccc1O 4742244 LCPLTURMCNZSNV-WXFDVJJJSA-N 442.541 2.989 50 40 IFGB COc1cccc(NC(=O)COc2ccc([C@@H]3C(C#N)=C(N)Oc4[nH]nc(C)c43)cc2)c1 9715940 GCQJZCSASSDMLX-OAQYLSRUSA-N 431.452 2.962 50 40 IFGB Cc1ccc(C)c(N(CC(=O)N/N=C/c2cc(Br)c(C)o2)S(C)(=O)=O)c1 14185900 KGELMINXPIVQFI-DJKKODMXSA-N 442.335 2.884 50 40 IFGB O=C(CCCCl)NC(=S)Nc1ccc(I)cc1C(=O)O 16385313 COEGQWGVMFDCGJ-UHFFFAOYSA-N 426.663 2.821 50 40 IFGB COc1ccc(Cl)cc1C(=O)NNC(=O)CN(Cc1cccs1)C[C@@H]1CCCO1 29112695 MLXVOLGZDXNPFW-HNNXBMFYSA-N 437.949 2.852 50 40 IFGB COc1cc(OC)cc(C(=O)NNC(=O)c2ccccc2OCc2c(C)noc2C)c1 29598412 BHRCQSSYYYMJRQ-UHFFFAOYSA-N 425.441 2.962 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)NC2CCCC2)cc1)Nc1cccc(Cl)c1 58873435 YWZFRUHBSKYZSI-ZMOGYAJESA-N 442.903 2.866 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2cccc(Cl)c2Cl)S(C)(=O)=O)c1 408923161 FUUPPEUSSHXRKT-KEBDBYFISA-N 430.313 2.918 50 40 IFGB CCc1ccc(N(CC(=O)N/N=C(\C)c2cccc(NC(C)=O)c2)S(C)(=O)=O)cc1 409024414 KYIRUPQHWMWRNQ-HZHRSRAPSA-N 430.530 2.514 50 40 IFGB COc1ccc(C(=O)Nc2cccc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)c2)cc1 10040104 YYCBZINEJMQFLP-UHFFFAOYSA-N 433.420 2.751 50 40 IFGB CCOc1cc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc(OCC)c1OCC 8826113 QNGALMYPISPPIF-UHFFFAOYSA-N 440.500 2.773 50 40 IFGB O=C(COc1ccc(Cl)cc1)NNC(=O)CN(Cc1cccs1)C[C@H]1CCCO1 17307935 MDWOOKVAURLLSM-QGZVFWFLSA-N 437.949 2.609 50 40 IFGB CCCCOc1ccc(/C=N/NC(=O)CN(c2ccc(OC)cc2)S(C)(=O)=O)cc1 20210167 OGOCENWYADRQCT-PXLXIMEGSA-N 433.530 2.790 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NCc3ccccc3)cc2)cc1 58873547 SJKLQMSMBPOODP-JVWAILMASA-N 444.491 2.779 50 40 IFGB Cc1ccc(NC(=O)COC(=O)CCCC(=O)NNC(=O)c2ccccc2Cl)cc1 408646047 OEKKANCPLGYRKV-UHFFFAOYSA-N 431.876 2.762 50 40 IFGB Cc1ccccc1OCC(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 408970006 YMWQVYNAJMZBQI-QMFLXTPQSA-N 426.473 2.963 50 40 IFGB COc1ccccc1/C=N/NC(=O)CN(c1cc(Cl)ccc1Cl)S(C)(=O)=O 409027522 DYSWXEWPVGOSTK-KEBDBYFISA-N 430.313 2.918 50 40 IFGB CCOc1cc(/C=N\NC(=O)c2nn(-c3cccc(C)c3)c(=O)c(C#N)c2C)ccc1O 409073922 UPESUUZCOHTJCA-MXAYSNPKSA-N 431.452 2.589 50 40 IFGB O=C(COc1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc(NC(=O)C2CCCCC2)cc1 674519 QKFXAQAKCUUDNK-UHFFFAOYSA-N 440.456 2.954 50 40 IFGB O=C(N/N=C/c1ccccc1O)c1cc(C(=O)N/N=C/c2ccccc2O)cc([N+](=O)[O-])c1 1744127 YPOBNHGMTZBNAK-MPDMMBQKSA-N 447.407 2.534 50 40 IFGB COc1ccccc1N(CC(=O)N/N=C/c1c(Cl)cccc1Cl)S(C)(=O)=O 2085132 FCFSSSKNMNKVPU-KEBDBYFISA-N 430.313 2.918 50 40 IFGB COc1cccc(NC(=O)[C@@H](NNC(=O)[C@H]2COc3ccccc3O2)c2ccccc2)c1 15472257 DEEDHBNQJPPHGZ-YADHBBJMSA-N 433.464 2.836 50 40 IFGB COc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3C[C@@H](C)C[C@@H](C)C3)cn2)cc1 24830467 WVPUERQXBSBFOG-IYBDPMFKSA-N 447.561 2.583 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@@H]3C[C@H](Br)[C@@H](Br)C[C@H]3C2=O)cc1 100826480 PESPVOFYLHXLOG-WYUUTHIRSA-N 431.080 2.811 50 40 IFGB O=C1OC(=O)[C@H]2[C@H]1[C@H]1C[C@H]2[C@H]2[C@@H](c3cc(Cl)ccc3O)c3sc(=O)[nH]c3S[C@H]21 229876714 VFAWHSQATVLVIT-UDONIMFZSA-N 435.910 2.983 50 40 IFGB CN(C)c1ccc(/C=N/NC(=O)CN(c2cccc(C(F)(F)F)c2)S(C)(=O)=O)cc1 408776976 SUFZJUGPIHELCN-FSJBWODESA-N 442.463 2.688 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c(Cl)c1 408910808 LGIXJLCJZGSASG-DJKKODMXSA-N 445.284 2.818 50 40 IFGB O=C(CSc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 409021012 WWEVLEYUVDNBIY-UDWIEESQSA-N 445.457 2.582 50 40 IFGB CCCOc1ccc(N2C(=O)C[C@@H](NNC(=O)c3cccc(Br)c3)C2=O)cc1 1767953 YEONOHSCEIJUCJ-QGZVFWFLSA-N 446.301 2.804 50 40 IFGB CCOC(=O)[C@H](NC(C)=O)[C@@H](OC(C)=O)c1cccc(N(CCCl)CCCl)c1 6089424 KAEOBVIVPGBJCY-MSOLQXFVSA-N 433.332 2.643 50 40 IFGB CCOc1c(Br)cc(C(=O)NNC(=O)c2n[nH]c3ccccc23)cc1OC 15977439 PXLNJXBQEUZNMB-UHFFFAOYSA-N 433.262 2.808 50 40 IFGB O=C(NNC(=O)c1cccs1)C1=NO[C@H](CNc2ncc(C(F)(F)F)cc2Cl)C1 20365886 RNGUKPHMDBMUHH-VIFPVBQESA-N 447.826 2.833 50 40 IFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@@H]1CS[C@]2(c3ccccc3)CCC(=O)N12 22965635 CWHLGTJRJLEQIB-FXICMQEYSA-N 439.581 2.941 50 40 IFGB O=C(CN1CC=C(c2ccc(O)cc2)CC1)NNC(=O)c1ccc(Br)cc1 40018017 UFLZKQMSQLJNJA-UHFFFAOYSA-N 430.302 2.705 50 40 IFGB C[C@@]1(NNC(=O)NCc2ccc(-c3ccc(Br)cc3)o2)CCS(=O)(=O)C1 89919501 NRVFLFINYHBXCW-QGZVFWFLSA-N 442.335 2.590 50 40 IFGB CCOC(=O)c1ccc(NC(=S)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1 1410857 HYDQPAMGFWNIOA-UHFFFAOYSA-N 433.486 2.521 50 40 IFGB Cc1cccc[n+]1[C@@H]1[C@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C(C(C#N)C#N)N[C@]1(O)C1CC1 33778143 UUHQFLQUMHGTRC-JRFVFWCSSA-N 441.471 2.658 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@H]3[C@H]4C[C@@H]([C@@H](Br)[C@@H]4Br)[C@@H]3C2=O)cc1 169619900 KXHQMAGGCJSUCQ-PQCBQTOFSA-N 443.091 2.667 50 40 IFGB CCCOc1ccc2[nH]c(C(=O)NNC(=O)CCC(=O)NCc3ccc(F)cc3)cc2c1 199422969 YFFYPUMJJSLWNR-UHFFFAOYSA-N 440.475 2.953 50 40 IFGB Cc1cccc(C)c1NC(=O)COc1ccccc1/C=N/NC(=O)C(=O)NCc1ccco1 409249443 IKAASJDGJLGUNN-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc5c(c4)OCO5)c32)cc(OC)c1O 8410137 HQSVPOCGCOLKJJ-QGZVFWFLSA-N 434.408 2.746 50 40 IFGB CCOc1cc(Br)cc(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])c1O 9905808 QRQWQAIPYHUKTI-DJKKODMXSA-N 438.234 2.991 50 40 IFGB COCc1cc(C)nc(OCC(=O)N/N=C/c2ccc(-c3ccccc3C(=O)O)o2)c1C#N 59503527 PVLHVHKBHXZWCP-OPEKNORGSA-N 448.435 2.895 50 40 IFGB COc1cc(C(=O)NNC(=O)c2cccc(NC(=O)c3ccco3)c2)ccc1OC(C)=O 10038826 UPXXLOAMFIPWOR-UHFFFAOYSA-N 437.408 2.541 50 40 IFGB COc1ccc(/C=N/NC(=O)CNc2ccc(I)cc2)c(OC)c1 59720887 YVZKONGVLMHHTH-KEBDBYFISA-N 439.253 2.871 50 40 IFGB O=C(O)c1ccccc1N1C(=O)[C@H]2[C@H](C1=O)[C@H]1C[C@H]2[C@H](Br)[C@@H]1Br 102066066 RVSOKZITIXHEOI-IEOIMIPYSA-N 443.091 2.667 50 40 IFGB CC[C@@H](Oc1cc(Cl)ccc1Cl)C(=O)NNC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 102201774 APTZUNALKUCBEW-FFEYXXLKSA-N 427.284 2.821 50 40 IFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1ccc(OS(=O)(=O)c2cc(C)ccc2C)cc1 104371649 VSULFCQNLLUJRX-SDXDJHTJSA-N 428.466 2.553 50 40 IFGB Cc1cc2c(cc1/C=N/NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1)OCO2 408863064 OTTLWXTYBATMCZ-ZTBJCTOSSA-N 449.916 2.681 50 40 IFGB Cc1ccccc1OCC(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c1ccc2c(c1)OCO2 408971852 MLAKTRMNTYWKCC-AMAFCZHPSA-N 425.485 2.784 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2cc(Cl)cc(Cl)c2)cc1 409152670 BLPCBYAEYSSABS-AUEPDCJTSA-N 437.283 2.597 50 40 IFGB CC1=C(C#N)C(=O)N(CCN2CCOCC2)C(=O)/C1=C\Nc1ccccc1N1CCCCC1 9422179 QIBXAEHZDJSHFA-UZYVYHOESA-N 449.555 2.514 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)NC2CCCCC2)cc1)Nc1ccc(F)cc1 58873445 SVXAOFCSYYWSJI-AFUMVMLFSA-N 440.475 2.742 50 40 IFGB CC1=C(C#N)C(=O)N([C@@H]2CCS(=O)(=O)C2)C(=O)/C1=C\Nc1ccc(C(C)(C)C)cc1 9423838 ZKTWFUJQSGGFAU-UEXNTNOUSA-N 427.526 2.676 50 40 IFGB COc1cc(/C=N/NC(=O)c2cccc(I)c2)cc(OC)c1O 408756346 ZBOWAKVRUKKGTO-GIJQJNRQSA-N 426.210 2.778 50 40 IFGB COc1ccc(N(CC(=O)N/N=C(\C)CCc2ccccc2)S(C)(=O)=O)cc1OC 408772124 BIAUBGXMZDOOHL-CJLVFECKSA-N 433.530 2.595 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccc(Cl)cc2)c1 409155995 SJWBNMCVKWYHCB-ZMOGYAJESA-N 430.892 2.724 50 40 IFGB COc1cc(/C=N/NC(=O)CNc2ccc(I)cc2)ccc1O 1421563 UKYCXQIGICOQJT-DJKKODMXSA-N 425.226 2.568 50 40 IFGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)CN(c2cccc(Cl)c2)S(C)(=O)=O)cc1 20209504 RVMRJMKAFJSBBM-LPYMAVHISA-N 436.921 2.605 50 40 IFGB N#C/C(=C/c1ccccc1OCc1ccc(I)cc1)C(=O)NC(N)=O 409241029 WKKQQHQRSWAQPJ-ZROIWOOFSA-N 447.232 2.972 50 40 IFGB COC(=O)COc1c(Cl)cc(/C=N/NC(=O)c2cc(OC)cc(OC)c2)cc1OC 8810997 KPQORDKOTPCBET-LSHDLFTRSA-N 436.848 2.682 50 40 IFGB C=CCN1C(=O)/C(=N\NC(=O)[C@H]2COc3ccccc3O2)c2cc(Br)ccc21 13880634 BGWNJUVMMAVTDC-RTAFMGCNSA-N 442.269 2.642 50 40 IFGB COc1ccc(OC)c(/C=N\NC(=O)CN(C)S(=O)(=O)c2ccc3ccccc3c2)c1 16187265 BWEUGOTUAALPMF-UCQKPKSFSA-N 441.509 2.628 50 40 IFGB COc1cccc(/C=N\NC(=O)[C@H](C)S[C@@H](C)C(=O)N/N=C/c2cccc(OC)c2)c1 33838147 RGOGHTJKUCHEDX-WXFDVJJJSA-N 442.541 2.814 50 40 IFGB O=C(CNC(=O)c1cccc(F)c1)N/N=C1/C(=O)N(Cc2ccccc2)c2ccccc21 100502896 UYELBBUCENECKD-XAYXJRQQSA-N 430.439 2.623 50 40 IFGB CCOc1ccc(N(CC(=O)N/N=C/c2ccncc2)S(=O)(=O)c2ccccc2)cc1 408856854 FBPIUSGUHYBVJV-LFVJCYFKSA-N 438.509 2.826 50 40 IFGB COc1ccccc1NC(=O)COc1ccc(C(=O)NNC(=O)c2ccccc2)cc1OC 3333782 ROKVMGICSJQOIN-UHFFFAOYSA-N 449.463 2.796 50 40 IFGB C=C(C)C(=O)OCCOC(=O)C1=C(N)OC(C)=C(C#N)[C@H]1c1cc([N+](=O)[O-])ccc1Cl 8768369 IZJGJPPQCJCRFP-MRXNPFEDSA-N 447.831 2.992 50 40 IFGB CC(C)NC(=O)NCc1ccc(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)cc1 12686532 MYNGIFOKWIQIAL-UHFFFAOYSA-N 433.468 2.893 50 40 IFGB Cc1cccc[n+]1[C@@H]1[C@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C([C-](C#N)C#N)N[C@]1(O)C1CC1 100023555 VPFRCQCGNFASQJ-JRFVFWCSSA-N 440.463 2.617 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1C(=O)O)c1cc(Cl)cc(Cl)c1 408781498 SZWDDWSBYVECDE-AWQFTUOYSA-N 444.296 2.608 50 40 IFGB CC(C)c1c(C(=O)NNC(=O)CCNC(=O)OC(C)(C)C)cnn1-c1ccc(F)cc1 96003906 POEGNDVPZFAOTE-UHFFFAOYSA-N 433.484 2.811 50 40 IFGB Cc1ccc(C)c(NC(=O)CCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1 408665668 VLBWLGQVYBUTRX-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB CCCOc1ccc([C@H]2C(C#N)=C(N)OC(CC(=O)OC)=C2C(=O)OC)cc1OCC 2269485 GWVBYPKSBRBTSL-IBGZPJMESA-N 430.457 2.672 50 40 IFGB COc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NC[C@@H]3CCCO3)c2C)cc1Cl 15231443 HNFDBKLNAWKCJM-PKOLSWDWSA-N 432.908 2.501 50 40 IFGB O=C(Cc1cccc2ccccc12)N/N=C/[C@@H]1C(=O)NC(=S)N(c2ccccc2)C1=O 18193307 VYUQMXFZSMLRKI-ANRKENSESA-N 430.489 2.548 50 40 IFGB COc1cc(/C=N/NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)ccc1C 408868339 NZVDYIBZVHRYGW-ZFJBLLOBSA-N 435.933 2.960 50 40 IFGB CC(C)C(=O)N/N=C/c1ccc(CNS(=O)(=O)c2ccc(Br)cc2)o1 409000164 DYAHAGIWFPPWCE-GIJQJNRQSA-N 428.308 2.627 50 40 IFGB C[C@@H](C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)n1cnc2sc3c(c2c1=O)CCCC3 1783686 YYIBAMOEOYBUHH-PGCIDKTFSA-N 425.470 2.956 50 40 IFGB CCc1ccc(OCC(=O)NNC(=O)COc2ccc(F)cc2Br)cc1 14186466 VBZDEWARDDYJEU-UHFFFAOYSA-N 425.254 2.756 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@H]3C[C@@H](Br)[C@@H](Br)C[C@H]3C2=O)c1 100926990 IBSRDFPISRPXAX-IWDIQUIJSA-N 431.080 2.811 50 40 IFGB COc1cc(/C=N/NC(=O)C(=O)NC2CC2)ccc1OCc1ccc(Br)cc1 408609627 KQXSUGVJVAEYPN-SSDVNMTOSA-N 446.301 2.765 50 40 IFGB CN(C)c1ccc(/C=N/NC(=O)CN(c2cc(Cl)cc(Cl)c2)S(C)(=O)=O)cc1 408781051 QRRWLSJYKOEFBT-SRZZPIQSSA-N 443.356 2.976 50 40 IFGB Cc1ccc(NC(=O)COC(=O)c2ccc(/C=C(/C#N)C(=O)N3CCOCC3)cc2)cc1 409200175 HGZOMXXSRJVGSF-ZHZULCJRSA-N 433.464 2.556 50 40 IFGB O=C(NNC=C1C(=O)N(c2ccccc2)C(=S)N(c2ccccc2)C1=O)c1ccncc1 1305871 JERIXLQHUOHMTK-UHFFFAOYSA-N 443.488 2.565 50 40 IFGB COc1ccc(C(=O)NNC(=O)[C@@H](NC(=O)C23CC4CC(CC(C4)C2)C3)C(C)C)cc1 12991376 IYBHQWYTNUBIMJ-ZDCBYCKXSA-N 427.545 2.813 50 40 IFGB C[C@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(OCC(=O)N2CCOCC2)cc1 16322167 OJWRITLYLZCXOB-BDFKGGEMSA-N 427.526 2.555 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(C)cc2C)c(Cl)c1 409156886 UCTONDHVUFWKIU-BHGWPJFGSA-N 430.892 2.561 50 40 IFGB O=C(CN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)NNC(=O)c1cccc(O)c1 8820388 YCRIAOWUCLCFCF-BJXWFGTRSA-N 439.518 2.611 50 40 IFGB NC(=O)CCn1cc(/C=N/NC(=O)Cc2ccc(Br)cc2)c2ccccc21 9203226 KAUODYQGIHTCMW-FSJBWODESA-N 427.302 2.972 50 40 IFGB COc1ccccc1N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccs2)cc1 9509294 GNJXKMRBDIADRE-UHFFFAOYSA-N 445.522 2.657 50 40 IFGB C=CCOc1cccc(/C=N/NC(=O)CN(C)S(=O)(=O)c2c(C)cc(C)cc2C)c1 16267367 HCGLGJYRXFNFDH-OEAKJJBVSA-N 429.542 2.947 50 40 IFGB COc1ccccc1NC(=O)COc1ccc(/C=N/NC(=O)c2cccnc2)cc1OC 1093226 KBUNOZFAKBXSAM-DHRITJCHSA-N 434.452 2.880 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@H]3C[C@H](Br)[C@H](Br)C[C@@H]3C2=O)c1 4156997 IBSRDFPISRPXAX-FIQHERPVSA-N 431.080 2.811 50 40 IFGB O=C1c2ccccc2C(=O)c2cc(S(=O)(=O)NNC(=O)[C@H]3C[C@H]3c3ccccc3)ccc21 13616832 HMROIRBPSHSLDJ-FPOVZHCZSA-N 446.484 2.575 50 40 IFGB CCOc1cc(/C=N/NC(=O)[C@@H](C#N)c2ccccc2)ccc1OCC(=O)N1CCCC1 409196616 WVKFSGSSBGFTLL-NTRYICDMSA-N 434.496 2.844 50 40 IFGB CCCOC(=O)c1ccc(Oc2c[nH]nc2-c2ccc(OCC(=O)NN)cc2O)cc1 18126011 NJVXHJIMZVRLRO-UHFFFAOYSA-N 426.429 2.510 50 40 IFGB Cc1[nH]c2ccccc2c1[C@@H]1c2ccccc2C(=O)N1CC(=O)NNC(=O)c1ccncc1 9581909 ROGNDNRMDWHUNL-QHCPKHFHSA-N 439.475 2.878 50 40 IFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@H]1CS[C@]2(c3ccccc3)CCC(=O)N12 22965641 CWHLGTJRJLEQIB-NUFMFFRISA-N 439.581 2.941 50 40 IFGB COCc1c(Br)c(C)nc(OCC(=O)N/N=C/c2cccc(OC)c2)c1C#N 27519375 OUEKSENTBOQDHS-LSFURLLWSA-N 447.289 2.708 50 40 IFGB O=C(COc1ccc(Cl)cc1Cl)NNC(=S)NC(=O)c1ccccc1[N+](=O)[O-] 2135508 YDWIGPRHLWQKBH-UHFFFAOYSA-N 443.268 2.616 50 40 IFGB Cc1cccn2c(=O)c(/C=C(\C#N)c3nc4ccccc4[nH]3)c(N3CCN(C)CC3)nc12 8996857 SKFVXMVRDXECNG-SAPNQHFASA-N 425.496 2.695 50 40 IFGB C[C@@H]1CN(c2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)NC2CCCCC2)C[C@@H](C)O1 9428133 CDQQFEOSHNQWJU-DSXONILISA-N 435.528 2.664 50 40 IFGB O=C(NNC(=S)Nc1ccccc1)c1nc2ccc(Br)cn2c1[N+](=O)[O-] 19851174 OSXNQVVBENACNB-UHFFFAOYSA-N 435.263 2.636 50 40 IFGB Cc1ccc(N2C(=O)[C@@H](/C=N\NC(=O)c3cccc4ccccc34)C(=O)NC2=S)cc1 408753751 HUHPCXMSMZMGPL-HTAGGTJDSA-N 430.489 2.928 50 40 IFGB C=CCc1cc(/C=N/NC(=O)[C@@H](Cc2ccccc2)NC(=O)OCC)cc(OC)c1O 408906081 HEYNVSZAMRMWIT-IERINAHZSA-N 425.485 2.937 50 40 IFGB COc1ccc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc1 2417750 OQQOVSOFMBPSFK-XAVZPLJISA-N 446.463 2.698 50 40 IFGB C[C@@H](C(=O)N/N=C1/C(=O)Nc2ccccc21)n1cnc2sc3c(c2c1=O)CC[C@@H](C)C3 11990282 MZZYTMBCRSLKNM-NEPJUHHUSA-N 435.509 2.616 50 40 IFGB Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CNC(=O)/C=C/c1ccccc1 12742115 HXKNKXLLAMXGTA-FMIVXFBMSA-N 429.904 2.784 50 40 IFGB COc1cccc(N(CC(=O)N/N=C/c2ccco2)S(=O)(=O)c2ccc(C)cc2)c1 408780251 WCSGEVQEBUVNOL-HYARGMPZSA-N 427.482 2.942 50 40 IFGB COc1cccc(N(CC(=O)N/N=C/c2ccc3c4c(cccc24)CC3)S(C)(=O)=O)c1 408876873 RKHXBMNUWSZYNG-ZVHZXABRSA-N 437.521 2.863 50 40 IFGB O=C(O)c1cccc(Cn2c(Cl)c(/C=N/NC(=O)c3cccc(O)c3)sc2=O)c1 2224311 UTDIUCBMMDBSPR-ZVBGSRNCSA-N 431.857 2.779 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)CN(c2cccc(C)c2C)S(C)(=O)=O)cc1OC 9144598 KXTBXMMEARYHEJ-CJLVFECKSA-N 433.530 2.627 50 40 IFGB C/C=C/C=C/C(=O)NNc1ccc(S(=O)(=O)Nc2ccccc2OC)cc1[N+](=O)[O-] 9612563 FTXHVZDTGDUDCY-COBAKMAKSA-N 432.458 2.980 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)NN=C2CCN(C)CC2)c2ccc(F)cc2)cc1 13147170 FGNIOFHSKWKWIB-UHFFFAOYSA-N 432.521 2.527 50 40 IFGB O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)c1ccccc1Cl 13148123 VVRRZTADUMRGPQ-UHFFFAOYSA-N 435.933 2.518 50 40 IFGB Cc1cccc(C)c1N(CC(=O)N/N=C/c1ccccc1Br)S(C)(=O)=O 20213961 MILSLTNTWWIYHK-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB COc1cc(OC)cc(C(=O)N/N=C/c2cc(Br)c(N3CCOCC3)o2)c1 33665405 NJLPCAPSMAONOK-RGVLZGJSSA-N 438.278 2.660 50 40 IFGB CC(=O)Nc1cccc(-c2nc(SCC(=O)NNC(=O)c3ccc(Cl)cc3)n[nH]2)c1 408637711 NOMJMMITQSQKNL-UHFFFAOYSA-N 444.904 2.637 50 40 IFGB COc1cc(C(=O)NNC(=O)c2ccc(NC(=O)c3ccco3)cc2)cc(OC)c1OC 882749 GTOVCQMZWGAUFG-UHFFFAOYSA-N 439.424 2.633 50 40 IFGB N#C/C(C(=O)NCc1ccco1)=C1/N=C(NC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21 2432392 WRVSPBPIQHESLA-VXPUYCOJSA-N 441.403 2.929 50 40 IFGB Cc1nn(Cc2ccccc2)c(Cl)c1/C=N/NC(=O)Cn1nnc(-c2ccccc2)n1 10021801 WJBDYCJPSLZYFW-FSJBWODESA-N 434.891 2.697 50 40 IFGB Cc1cc(C)c2c(c1)/C(=N/NC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)CCC2 13134047 SZBXZSRZUDTFAE-ZNTNEXAZSA-N 441.553 2.795 50 40 IFGB CN1CCC(=NNC(=O)CN(c2ccc(Cl)cc2)S(=O)(=O)c2ccccc2)CC1 20102451 CBQDULNBYJSQKJ-UHFFFAOYSA-N 434.949 2.733 50 40 IFGB CC(C)(C)[Si](C)(C)OC[C@@H]1[C@H]2[C@H](O)N3[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H]3[C@H](O)N12 299803675 OIAGEYLUDDDVCA-ZGNFWCEMSA-N 430.738 2.786 50 40 IFGB COc1cc(/C=C(/C#N)C(=O)NC(N)=O)cc(Cl)c1OCc1cccc([N+](=O)[O-])c1 409234150 MLQFIJDTGGBBEY-ACAGNQJTSA-N 430.804 2.938 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)COc2c(OC)cc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 3115941 VADCLCPZTAYRAA-RGVLZGJSSA-N 430.373 2.606 50 40 IFGB CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)c2ccccc2O)[C@@H]1c1ccc(OC)cc1 40049164 VCIQFWFLYLEDPY-UGKGYDQZSA-N 439.512 2.942 50 40 IFGB O=C(NNC1=C/C(=N/S(=O)(=O)c2ccccc2)c2ccccc2C1=O)c1cccc(O)c1 101027826 XPQTWPHBKJWGBM-QOMWVZHYSA-N 447.472 2.585 50 40 IFGB Cc1cc(C)cc(NC(=O)COC(=O)CCC(=O)NNC(=O)c2ccccc2Cl)c1 408644841 IJIOEGWDOIRHTN-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1)c1ccc(Br)cc1 408645363 SFZNQWIYCQNNIY-GFCCVEGCSA-N 436.693 2.917 50 40 IFGB Cc1c(Cl)cccc1NC(=O)CCC(=O)NNC(=O)COc1ccc([N+](=O)[O-])cc1 2134768 XWLHVDCHGZHOJK-UHFFFAOYSA-N 434.836 2.502 50 40 IFGB O=C(N/N=C\c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1ccc(Br)cc1 28617747 HYUWEASECPDOOD-NDENLUEZSA-N 433.262 2.958 50 40 IFGB COCCCNC(=O)C(=O)N/N=C/c1cc(Br)ccc1OCc1ccccc1 408609733 RUDXGSCZQBMUQK-YDZHTSKRSA-N 448.317 2.631 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccc(C)c(C)c2C)S(C)(=O)=O)c(OC)c1 408869199 PPCWFNVHYUCADN-WSDLNYQXSA-N 433.530 2.545 50 40 IFGB Cc1cccc(NC(=O)COc2ccccc2/C=N/NC(=O)C(=O)NCc2ccccc2)c1 409164358 HKTUOFPQYODKPC-JVWAILMASA-N 444.491 2.779 50 40 IFGB COc1ccc2o/c(=N\NC(=O)COc3ccc(Cl)cc3Cl)c(C(N)=O)cc2c1 868250 QVBDPLRBTXGQJT-CLCOLTQESA-N 436.251 2.858 50 40 IFGB CCCCn1nc(C(=O)NNC(=O)c2ccc(OC(F)F)cc2)c2ccccc2c1=O 9395636 SQOZEGADRVSQSO-UHFFFAOYSA-N 430.411 2.873 50 40 IFGB COc1ccc(/C=N\NC(=O)CN(C)S(=O)(=O)c2ccc3ccccc3c2)cc1OC 34888866 DYSTUCFJEAGRQG-UCQKPKSFSA-N 441.509 2.628 50 40 IFGB Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)NNC(=O)[C@H](C)Oc1ccc(F)cc1 40144503 CGUIUGYJUULYEZ-HNNXBMFYSA-N 428.439 2.925 50 40 IFGB COCCNC(=O)C(=O)N/N=C/c1cc(Br)ccc1Nc1ccc(C)cc1 408707106 GWEMCMRVZXPRLR-WSDLNYQXSA-N 433.306 2.714 50 40 IFGB COc1ccc(S(=O)(=O)N(CC(=O)NN=C2CCCC2)c2ccccc2OC)cc1 409026391 NXUDGGHDMJMDGY-UHFFFAOYSA-N 431.514 2.945 50 40 IFGB COc1ccc(/C=N\NC(=O)c2nn(-c3cccc(C)c3)c(=O)c(C#N)c2C)cc1OC 409071960 QRHWVERMTHMXTO-MXAYSNPKSA-N 431.452 2.502 50 40 IFGB O=C(COc1ccc2ccccc2c1)NNS(=O)(=O)c1cccc(Br)c1 12824970 KPSZVGLDYBCNBS-UHFFFAOYSA-N 435.299 2.991 50 40 IFGB C[C@H](Sc1ccc(Cl)cc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 12936133 RRQLYPOSFWBHMU-NSHDSACASA-N 426.951 2.575 50 40 IFGB CCn1c(C)nc2cc(C(=O)NNC(=O)[C@H](NC(=O)C3CCCCC3)C(C)C)ccc21 14205790 INAIUVFQBRQWSJ-HXUWFJFHSA-N 427.549 2.847 50 40 IFGB O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)s1)c1ccccc1Cl 25524693 PGGORLSQEHOVGW-GFCCVEGCSA-N 448.353 2.669 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(F)cc2)cc1)NC1CCCCC1 59960071 QBDJYJRILWQGCU-AFUMVMLFSA-N 440.475 2.742 50 40 IFGB O=C1O[C@H]2[C@@H]3C[C@H]([C@@H](C(=O)Nc4cccc(C(=O)N5CCCCC5)c4)[C@@H]13)[C@H]2Br 138982320 ODSFTYWODOKHGI-OBRKIGFESA-N 447.329 2.822 50 40 IFGB O=C(O)c1ccccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1C[C@H]2[C@@H](Br)[C@H]1Br 4157148 RVSOKZITIXHEOI-HGPWQKRLSA-N 443.091 2.667 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1[N+](=O)[O-])c1cccc2ccccc12 8843150 DZGUQSRGYJXWGQ-FYJGNVAPSA-N 426.454 2.664 50 40 IFGB CN1CCN(CN2C(=O)/C(=N\NC(=O)c3ccc(Cl)cc3Cl)c3ccccc32)CC1 19882743 UFIUITFOFMRACW-CLCOLTQESA-N 446.338 2.679 50 40 IFGB COc1ccc(C(=O)NNc2nc(CN3CCOCC3)nc3sc(C)c(C)c23)cc1 25784504 HPCIONFKOGJEPH-UHFFFAOYSA-N 427.530 2.906 50 40 IFGB CCOc1ccc(/C=N\NC(=O)c2cc(OC)c(OC)c(OC)c2[N+](=O)[O-])cc1OC 28632525 NRBZCDPNJCBJRQ-NHDPSOOVSA-N 433.417 2.792 50 40 IFGB O=C(COC(=O)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@H]2Br)Nc1cccc2ccccc12 408679440 FCXLZOKLUDIBRL-PSWKNJSVSA-N 444.281 2.893 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)c(C)c1 408987613 FYISOAUSMLYAGD-YGFNIOOWSA-N 435.484 2.715 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1cc(Cl)ccc1C 409155100 BPMPMETWWDLYPH-WYMPLXKRSA-N 430.892 2.642 50 40 IFGB O=C(O)c1ccccc1/C=N/NC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 58980258 MDIYPZCTFFXTPK-LPYMAVHISA-N 449.916 2.589 50 40 IFGB CCOC(=O)COc1ccc(/C=C(/C#N)C(=O)NC(C)C)cc1I 408774499 LTQQYBZXCLCSAN-QPEQYQDCSA-N 442.253 2.665 50 40 IFGB C/C(=N\NC(=O)CN(c1cc(Cl)ccc1C)S(C)(=O)=O)c1cccc([N+](=O)[O-])c1 408786019 FBNARBNBWKFEMA-DEDYPNTBSA-N 438.893 2.863 50 40 IFGB CCOc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)ccc1OCC(=O)N(CC)CC 409204172 CQBPKIKPBSALQD-GQEMFKIVSA-N 429.517 2.535 50 40 IFGB CCNC(=S)NNC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(C)cc1 1836943 WOQUFCQPJUNTSE-UHFFFAOYSA-N 426.571 2.850 50 40 IFGB Cc1cc(C)cc(N(CC(=O)N/N=C/c2cc(Br)c(C)o2)S(C)(=O)=O)c1 20208535 GYXGPPKWYLCFEJ-DJKKODMXSA-N 442.335 2.884 50 40 IFGB O=C(CC(=O)NC1CCCCC1)N/N=C\c1ccc(OCC(=O)Nc2ccccc2)cc1 58873105 DGOUOTCZVZXHBM-XYGWBWBKSA-N 436.512 2.993 50 40 IFGB Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NN=C3C(=O)Nc4ccccc43)cc2)cc1 409125946 NHTXVHLKJGHVKG-UHFFFAOYSA-N 448.504 2.906 50 40 IFGB CCOc1ccc(-c2c(C(=O)N/N=C/C=C/c3ccccc3)nnn2-c2nonc2N)cc1 2376536 FHTGSUUKLYHMSR-XWJCGCQVSA-N 444.455 2.727 50 40 IFGB Cc1cccc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)NC[C@H]2CCCO2)c1 3643987 WJQUQCHTASCPEK-XEYRCQSKSA-N 430.464 2.997 50 40 IFGB Cc1ccc(/C=N/NC(=O)[C@@H](NC(=O)c2ccccc2)c2n[nH]c(=O)c3ccccc23)cc1 9065094 MSEOQAHSWVULQK-WGLQLPMYSA-N 439.475 2.853 50 40 IFGB O=C(COC(=O)CCCC(=O)Nc1ccc(F)cc1)NNC(=O)c1ccccc1Cl 408662627 GESDOOQKTIPHNY-UHFFFAOYSA-N 435.839 2.592 50 40 IFGB C[C@@H](C(=O)N/N=C1\C(=O)N(C)c2ccccc21)n1cnc2sc3c(c2c1=O)CC[C@@H](C)C3 6166511 UULPLFRCUFSALN-PZHKKDGKSA-N 449.536 2.641 50 40 IFGB Cc1ccccc1OCC(=O)N[C@H](CC(C)C)C(=O)N/N=C/c1ccccc1OCC#N 408972619 PTTLHWCXJUXOHA-XYCMHOAJSA-N 436.512 2.957 50 40 IFGB COc1cc(C(=O)Nc2ccc(C(=O)NNC(=O)c3ccco3)cc2)cc(OC)c1OC 881389 MSDBPNVLAZLSDM-UHFFFAOYSA-N 439.424 2.633 50 40 IFGB CCn1c(CNc2ccc(C)cc2)nnc1SCC(=O)NNC(=O)Cc1ccccc1 886994 VDUSGTJEUVHDIJ-UHFFFAOYSA-N 438.557 2.701 50 40 IFGB COc1cccc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1OC 58951654 YCVYRHWLSWOQDN-HZHRSRAPSA-N 445.541 2.563 50 40 IFGB CCOc1cc(/C=N\NC(=O)c2nn(-c3ccc(C)cc3)c(=O)c(C#N)c2C)ccc1O 409057854 IHYPUHMHNZLVBP-MXAYSNPKSA-N 431.452 2.589 50 40 IFGB Cc1ccc(NC(=O)COc2cccc(/C=N/NC(=O)C(=O)NCC(C)C)c2)cc1Cl 409154761 KVFTYRUUGDAKRZ-BRJLIKDPSA-N 444.919 2.888 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2cc(Cl)cc(Cl)c2)cc1 409163129 MEUSQCVCEZDWJM-BHGWPJFGSA-N 449.294 2.763 50 40 IFGB O=C(/C=C/c1ccc(F)cc1)NC(=S)NNC(=O)c1ccc(NC(=O)C2CC2)cc1 2551656 IWAASIGNPBYXSU-KGVSQERTSA-N 426.473 2.523 50 40 IFGB CC(C)(C)C(=O)Nc1nnc(CC(=O)N/N=C/c2cc(Br)ccc2O)s1 408729142 ATLPAOSRQZDDLC-QGMBQPNBSA-N 440.323 2.684 50 40 IFGB COc1ccc(SCC(=O)N/N=C\c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1 409009318 DDJJORULBDESCM-BKUYFWCQSA-N 430.486 2.682 50 40 IFGB CCOC(=O)c1c(NC(=O)C(=O)N/N=C/c2ccccc2O)sc2c1CCCCC2 8682598 KXIQFZGBSQNPCA-WSDLNYQXSA-N 429.498 2.988 50 40 IFGB C[C@@H]1CCc2sc(C(=O)NNC(=O)CCN3C(=O)[C@@H](C)Oc4ccccc43)cc2C1 12568119 YMRGHLFNQMFQEU-ZIAGYGMSSA-N 427.526 2.838 50 40 IFGB CCn1cc(C(=O)NNC(=O)CSc2ccc(Cl)cc2)c(=O)c2ccc(C)nc21 13164150 HKWFJOUVMJPNSA-UHFFFAOYSA-N 430.917 2.932 50 40 IFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C\c1cc([N+](=O)[O-])cc(Br)c1O 96838831 SZUCNOIRFOZSQK-IDUWFGFVSA-N 439.178 2.500 50 40 IFGB COc1ccc(/C=N/NC(=O)Cn2cnc3sc4c(c3c2=O)CC[C@@H](C)C4)cc1OC 719446 CZMQMEVZOAOSHF-OKYTWDAHSA-N 440.525 2.750 50 40 IFGB CCCOc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2-c2cccs2)cc1 2446023 IDMUZELZDNPEKE-SRZZPIQSSA-N 438.473 2.514 50 40 IFGB COc1cccc(N(CC(=O)N/N=C/c2ccccc2C(F)(F)F)S(C)(=O)=O)c1 20209961 OICGDYJQYDERLP-SSDVNMTOSA-N 429.420 2.630 50 40 IFGB COc1ccccc1NC(=O)CN1C(=O)/C(=N/NC(=O)c2ccccc2O)c2ccccc21 100630538 LWVLEVXXYWRCPA-XTCLZLMSSA-N 444.447 2.520 50 40 IFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 408868989 QIUKPSAIXBGMMC-XNHPLOEXSA-N 436.877 2.552 50 40 IFGB C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1-c1ccccc1)c1cc(F)c(F)cc1C 1445376 AKZLXNRSJQZXTR-BHGWPJFGSA-N 438.398 2.640 50 40 IFGB COc1cc2c3c(c1)[C@]1(C(=O)N3C(C)(C)C[C@@H]2C)C(C#N)=C(N)Oc2cc(C)oc(=O)c21 1460196 ODUCSGYKDKLULQ-BUBHHJDNSA-N 433.464 2.962 50 40 IFGB COc1cc([C@@H]2[C@H](Cl)C(=O)N2NC(=O)c2ccc(NC(C)=O)cc2)cc(OC)c1OC 5841528 HIXFLJPXFRBGRX-ZWKOTPCHSA-N 447.875 2.507 50 40 IFGB CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(Br)cc3)CC2=O)cc1 10092057 UGWGSIYIAJNDMV-AWEZNQCLSA-N 446.301 2.662 50 40 IFGB Cc1cccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(Br)s2)c1C 12772529 JGKSYSKARBPSGX-LLVKDONJSA-N 433.349 2.904 50 40 IFGB O=C(CC(=O)NC1CCCCC1)N/N=C\c1ccc(OCC(=O)NC2CCCCC2)cc1 30738779 BVVDIEXHZLSISB-XYGWBWBKSA-N 442.560 2.803 50 40 IFGB COc1ccccc1N(CC(=O)N/N=C/c1ccncc1)S(=O)(=O)c1ccc(C)cc1 408905985 BSNJDVFNHJLQMR-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB O=C(CN1C(=O)COc2ccccc21)NNC(=O)c1ccc(-c2ccccc2Cl)o1 14240123 RDSRHBRBSWDYIX-UHFFFAOYSA-N 425.828 2.787 50 40 IFGB O=C(COc1ccc2ccccc2c1)NNC(=O)c1ccc(=O)n(Cc2ccccc2)c1 16839283 IJAIEEVJRSNZNA-UHFFFAOYSA-N 427.460 2.890 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)c(OC)c1 408762829 MLGCJEXNWKQBIT-RXULLKCLSA-N 447.557 2.856 50 40 IFGB Cc1c(C(=O)N/N=C\c2cccc(Br)c2)nn(-c2ccccc2)c(=O)c1C#N 409062544 WOFGSQZSRPBNEF-FMCGGJTJSA-N 436.269 2.939 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NC(C)C)cc2Cl)cc1 409153717 DTUVSKOKBRMCNS-FOKLQQMPSA-N 430.892 2.641 50 40 IFGB Cc1ccsc1/C=N/NC(=O)CN(c1cccc(Br)c1)S(C)(=O)=O 20209828 BAZNLWHLOOCARI-RQZCQDPDSA-N 430.349 2.735 50 40 IFGB COc1ccc(CCNC(=O)CC(=O)N/N=C/c2cccc(Br)c2)cc1OC 59516060 VPHGQRBBSDOWEE-YDZHTSKRSA-N 448.317 2.665 50 40 IFGB O=C(COC(=O)CCC(=O)Nc1ccccc1Cl)NNC(=O)c1ccc(Cl)cc1 138901881 JMWWVMUBFMCWDZ-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB Cc1cccc[n+]1[C@H]1[C@@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C([C-](C#N)C#N)N[C@@]1(O)C1CC1 169298847 VPFRCQCGNFASQJ-OEMFJLHTSA-N 440.463 2.617 50 40 IFGB OCC[C@@]12[C@H]3[C@@H]4C[C@H]5[C@@H]([C@H]4[C@H]1I)[C@H]2[C@H](I)[C@H]53 261361220 LPPSJDDLSOALBA-PUUGIKJXSA-N 442.078 2.734 50 40 IFGB COc1ccc(C(=O)Nc2ccccc2C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 408995413 CMBMFYKTOYYZAY-UHFFFAOYSA-N 434.408 2.931 50 40 IFGB C[C@H](C(=O)NN=C1CCN(Cc2ccccc2)CC1)N(c1ccccc1)S(C)(=O)=O 409334283 WPXDSMKUUJEANN-GOSISDBHSA-N 428.558 2.609 50 40 IFGB O=C(Cc1csc(N2CCOCC2)n1)NNC(=S)Nc1ccc(Cl)cc1Cl 3360746 ZOKMBLKMAJLNBM-UHFFFAOYSA-N 446.385 2.847 50 40 IFGB O=C(/C=C/c1ccco1)NCC(=O)N/N=C1/C(=O)N(CCc2ccccc2)c2ccccc21 13536676 PLWYVZQDLDAGCP-PIVBYUDSSA-N 442.475 2.519 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C\c2c(F)cccc2Cl)cc1C 16282824 QZNDHMJSBJDHTO-FBHDLOMBSA-N 427.885 2.567 50 40 IFGB Cc1ccc(N(CC(=O)NN=C2CCN(C)CC2)S(=O)(=O)c2ccccc2)cc1C 16312026 QFJVWBGBTSTIIY-UHFFFAOYSA-N 428.558 2.697 50 40 IFGB N#Cc1ccc(/C=N\NC(=O)CCSCCC(=O)N/N=C\c2ccc(C#N)cc2)cc1 31629188 BWNNAWSSCIYJBW-YXHOTNNGSA-N 432.509 2.544 50 40 IFGB Cc1ccc(N2C(=O)NC(=O)[C@H](/C=N/NC(=O)c3ccc(Cl)cc3Cl)C2=O)cc1 408531990 HTMHYXYBVGRNJU-DKNGMTOASA-N 433.251 2.917 50 40 IFGB CCOc1ccccc1/C=N\NC(=O)c1nn(-c2ccccc2OC)c(=O)c(C#N)c1C 409066172 HJVVHKFIXJJATE-QFEZKATASA-N 431.452 2.584 50 40 IFGB COc1ccc(C)cc1NC(=O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2 20357169 MNHXXNPCYOMXNE-DNTJNYDQSA-N 434.246 2.584 50 40 IFGB CCCOc1ccc(N2C(=O)C[C@@H](NNC(=O)c3ccc(Br)cc3)C2=O)cc1 100824734 NPFTUWKENDIVFD-QGZVFWFLSA-N 446.301 2.804 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NCc3ccco3)cc2)cc1C 409258519 XHKGJAFBDVWUAA-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB Cc1cc(C(=O)NNC(=O)c2ccc(Cn3cncn3)cc2)c(C)n1-c1ccc(F)cc1 10891330 ZLZDMZYQGYMOFQ-UHFFFAOYSA-N 432.459 2.948 50 40 IFGB CCOc1cc(C(=O)NNC(=O)c2ccc(NC(C)=O)cc2)cc(OCC)c1OCC 15792928 WRBSYNXOFMIOTC-UHFFFAOYSA-N 429.473 2.916 50 40 IFGB COc1cc(OC)cc(C(=O)N2CCC(C(=O)N/N=C/c3cccc([N+](=O)[O-])c3)CC2)c1 59953144 UPQLIAYMKCDYTB-OEAKJJBVSA-N 440.456 2.615 50 40 IFGB N#C/C=C(\c1ccc(F)cc1)N1CCC(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC1 79023322 IHDGHVYSJYZZKM-AWQFTUOYSA-N 428.489 2.688 50 40 IFGB O=C(COC(=O)[C@H]1[C@H]2C(=O)O[C@H]3[C@@H]2C[C@H]1[C@H]3Br)Nc1cccc2ccccc12 408679441 FCXLZOKLUDIBRL-VTAJJLHNSA-N 444.281 2.893 50 40 IFGB O=C(COc1cccc(/C=N/NC(=O)C(=O)Nc2ccc(F)cc2)c1)NCc1ccccc1 409248351 FQWBWHRGOGWZFI-JFLMPSFJSA-N 448.454 2.610 50 40 IFGB C[C@H]1CCc2c(sc3ncn([C@H](C)C(=O)N/N=C4\C(=O)Nc5ccccc54)c(=O)c23)C1 6166359 MZZYTMBCRSLKNM-NWDGAFQWSA-N 435.509 2.616 50 40 IFGB CCOC(=O)/C(C#N)=C\N1CCN(c2cnn(-c3cccc(Cl)c3)c(=O)c2Cl)CC1 8781517 NRXACBYSKAFXEV-YPKPFQOOSA-N 448.310 2.632 50 40 IFGB O=C(NNC(=O)c1ccco1)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1 12865764 NINLUJILQXMKOW-UHFFFAOYSA-N 425.894 2.573 50 40 IFGB COc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCCCC3)cc1NC(C)=O 12774375 FKCXRVKQAMSINX-UHFFFAOYSA-N 437.543 2.607 50 40 IFGB Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)c2ccc(Cl)cc2)cc1 14180757 PKZVEVKZCUAROX-GOSISDBHSA-N 435.933 2.653 50 40 IFGB C/C(=N/NC(=O)c1ccco1)c1cc2c(cc1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)O)OCO2 17103269 MJYYRKOJVJQPCY-GYJPVHJYSA-N 439.424 2.768 50 40 IFGB Cc1ccccc1NC(=O)[C@H]1[C@@H](c2cccs2)C(C#N)=C(SCC(N)=O)N[C@@]1(C)O 19830707 XRUZMSXODHJDKY-OPYAIIAOSA-N 442.566 2.660 50 40 IFGB Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)NNC(=O)[C@H](C)Oc1ccccc1F 40129494 MVNSPNAVQCUOHE-HNNXBMFYSA-N 428.439 2.925 50 40 IFGB O=C(/C=C\c1ccco1)NCC(=O)N/N=C1/C(=O)N(CCc2ccccc2)c2ccccc21 100813030 PLWYVZQDLDAGCP-XJJMBYNTSA-N 442.475 2.519 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2ccc(C(C)C)cc2)S(C)(=O)=O)c(OC)c1 408783352 OAWGZSRZBJHPTM-LPYMAVHISA-N 433.530 2.744 50 40 IFGB COc1ccc([C@H]2CC(=O)NC(SCC(=O)NC[C@H]3CCCO3)=C2C#N)cc1Cl 409313617 CXOYXAVAPRVJCE-ZIAGYGMSSA-N 435.933 2.716 50 40 IFGB COc1cccc(Nc2nnc(SCC(=O)NNC(=O)c3ccc(C#N)cc3)s2)c1 2630530 KUCCFUMCAPDLJK-UHFFFAOYSA-N 440.510 2.715 50 40 IFGB Cc1nn(Cc2ccc(C(=O)N/N=C3/C(=O)Nc4ccc([N+](=O)[O-])cc43)o2)c(C)c1Cl 8782637 RLOPCZACYOREMD-UHFFFAOYSA-N 442.819 2.789 50 40 IFGB CC(=O)NNc1nc(C)c(C(/C=C/c2ccccc2O)=N\NC(=O)c2ccncc2)s1 17215521 HVRQPULLOZMIFZ-SIOYSBSZSA-N 436.497 2.863 50 40 IFGB COc1cccc(N2C[C@@H](C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)CC2=O)c1 40058418 UJSKYSPHQWIUAM-ZFWWWQNUSA-N 427.526 2.696 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccccn2)S(=O)(=O)c2ccc(C)cc2)cc1 59472764 TZSWHSSTBWDTMX-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB Cc1cc(O)ccc1N1C(=O)[C@H]2[C@H](C1=O)[C@H]1C[C@H]2[C@H](Br)[C@@H]1Br 101215963 WHBYAKCYZUDQAB-ZZWKFIDSSA-N 429.108 2.983 50 40 IFGB CC(=O)Oc1ccc(/C=N/NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)cc1 8451704 PXJGEKUCRDQDJW-PPRFWAEMSA-N 449.916 2.569 50 40 IFGB Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3cccc(Cl)c3)c2)n1 12824059 WHMJPRDJSVCGLD-UHFFFAOYSA-N 444.900 2.919 50 40 IFGB COc1cc(OC)cc(C(=O)N2CCC(C(=O)N/N=C/c3ccc(N(C)C)cc3)CC2)c1 15228393 MKFQHNKSQWHAML-PCLIKHOPSA-N 438.528 2.772 50 40 IFGB C[C@]1([P+](c2ccccc2)(c2ccccc2)c2ccccc2)CCC(=O)N(C(N)=O)C1=O 96022393 YTKWBFHIWXCXPJ-VWLOTQADSA-O 431.452 2.967 50 40 IFGB COc1ccc(Br)cc1/C=N/NC(=O)c1ccc(N(C)S(C)(=O)=O)cc1 409119575 SFIZYHXNMJSHGM-YBFXNURJSA-N 440.319 2.617 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccc(Cl)cc1 409257645 TVOMPFUQLGXCDA-CHOFVFFHSA-N 430.892 2.722 50 40 IFGB CC[C@H](C)c1ccc(OCC(=O)NNC(=S)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 12291920 UDZLXRQFHCFVLP-ZDUSSCGKSA-N 430.486 2.823 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C/c2ccc(C(C)C)cc2)cc1OC 16575750 VYDNLBUDGNPQJD-LPYMAVHISA-N 433.530 2.598 50 40 IFGB COc1ccccc1N1C(=O)/C(=C/NNC(=O)c2ccccc2Cl)C(O)=NC1=S 17016236 NVCSHJQCEIFDAG-ZRDIBKRKSA-N 430.873 2.755 50 40 IFGB CC(C)CNC(=O)CC(=O)N/N=C\c1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1 58872998 KFMWTZKOPNBHDK-MXAYSNPKSA-N 444.919 2.970 50 40 IFGB O=C(NCc1ccc(Cl)cc1)C(=O)N/N=C/c1cc2c(cc1Br)OCO2 59515594 IQNUHNLZDVKVGI-ODCIPOBUSA-N 438.665 2.598 50 40 IFGB Cc1ccc(C(=O)/C=C(\O)C(=O)NNC(=O)C(O)(c2ccccc2)c2ccccc2)cc1 100519014 YNLIUTNBQUFIQS-JWGURIENSA-N 430.460 2.703 50 40 IFGB COc1ccc(C)cc1N(CC(=O)N/N=C/c1cccnc1)S(=O)(=O)c1ccccc1 408833824 VGCGKECYUSPMNU-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB Cc1cccc(N(CC(=O)N/N=C/c2cccc(OC3CSC3)c2)S(C)(=O)=O)c1C 408906857 JGJLVEKEBAQYTJ-SSDVNMTOSA-N 447.582 2.714 50 40 IFGB CCOc1ccc(/C=N\NC(=O)c2nn(-c3ccccc3OC)c(=O)c(C#N)c2C)cc1 409056154 GKMZDAPVUCKWDT-QFEZKATASA-N 431.452 2.584 50 40 IFGB C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NNS(=O)(=O)c1ccccc1[N+](=O)[O-] 1083975 VHKMKZDZCAOLID-SECBINFHSA-N 434.257 2.679 50 40 IFGB CCOc1cc([C@H]2C(C#N)=C(N)OC(CC(=O)OC)=C2C(=O)OC)ccc1OC(C)C 2270137 OXDORFDATKFLCN-IBGZPJMESA-N 430.457 2.670 50 40 IFGB Cc1cc(=O)oc2cc(OCC(=O)NNC(=O)CCc3nc4ccccc4s3)ccc12 13147779 SELKZAHDIXXCLQ-UHFFFAOYSA-N 437.477 2.870 50 40 IFGB Cc1ccccc1OCC(=O)NNC(=O)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1 23109491 HTPIMSZNSSAPHS-UHFFFAOYSA-N 425.872 2.698 50 40 IFGB N#C/C(=C\c1cn(-c2ccccc2)nc1-c1cccs1)C(=O)N[C@@H]1CCS(=O)(=O)C1 26966587 XBTASFPNSPMNFB-GSPCDJLXSA-N 438.534 2.811 50 40 IFGB O=C(NNC(=O)c1ccc2ccccc2n1)c1cn(-c2ccccc2C(F)(F)F)nn1 48344240 KGHBRVVIJYQFJC-UHFFFAOYSA-N 426.358 2.909 50 40 IFGB COc1ccc(OC)c(NC(=O)C(=O)N/N=C(\C)CC(=O)Nc2ccc(Cl)cc2)c1 100763083 QVSGLDSMENXUJB-WYMPLXKRSA-N 432.864 2.817 50 40 IFGB CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccccc3Br)CC2=O)cc1 10093213 VUDUZEKSUFOLTD-ZDUSSCGKSA-N 446.301 2.662 50 40 IFGB Cc1cccn2c(=O)c(/C=C(\C#N)C(=O)N3CCOCC3)c(Oc3ccc(F)cc3)nc12 13786973 JINUFYWSNCZXHK-DTQAZKPQSA-N 434.427 2.700 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccc(I)cc2)c(O)c([N+](=O)[O-])c1 10476076 LWVXHBCPOIWCDA-CAOOACKPSA-N 441.181 2.678 50 40 IFGB CCN(NC(=O)C1CCN(S(=O)(=O)c2ccc(C#N)cc2)CC1)c1ccc(C)cc1 16066503 SHBXHBKXQCYFFY-UHFFFAOYSA-N 426.542 2.825 50 40 IFGB O=C(NNS(=O)(=O)c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)n1 22996513 WIGOLOLITQVQHX-UHFFFAOYSA-N 431.289 2.882 50 40 IFGB Cc1ccc(S(=O)(=O)N2C[C@H](O)[C@@H](N(C(=O)CCl)[C@H](C)c3ccccc3)C2)cc1 95836994 KFNCGGKMCZOBBV-UXPWSPDFSA-N 436.961 2.557 50 40 IFGB CCN(CC)CCCn1c(C)cc2c(c1=O)[C@@H](c1ccc3c(c1)OCO3)C(C#N)=C(N)O2 2246521 AAJZLVZHGSFGPB-NRFANRHFSA-N 436.512 2.836 50 40 IFGB Cc1ccc(OCC(=O)NNC(=O)[C@H](C)NC(=O)Cc2cccc3ccccc23)cc1C 8767782 LQFVSIWGAFQTMN-SFHVURJKSA-N 433.508 2.730 50 40 IFGB C=CCNC(=O)/C(C#N)=C/c1ccc(OC(=O)COc2ccc([N+](=O)[O-])cc2)c(OC)c1 27563600 QZFRCEBDZJUQIL-LFIBNONCSA-N 437.408 2.797 50 40 IFGB O=C(CSc1nnnn1-c1ccc(Cl)cc1)N/N=C/c1c[nH]nc1-c1ccccc1 680563 QBIAOFZPILRSQG-UFFVCSGVSA-N 438.904 2.948 50 40 IFGB CCc1nc2ccccc2c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1C 2660124 SFKMKFZRCZOLHT-UHFFFAOYSA-N 436.424 2.632 50 40 IFGB CCOc1cc(/C=N/NC(=O)CNC(=O)c2ccco2)ccc1OC(=O)c1ccccc1 3115541 HYCSXNOVLBRVCS-AFUMVMLFSA-N 435.436 2.778 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@H]3[C@H]4C[C@@H]([C@@H](Br)[C@@H]4Br)[C@@H]3C2=O)c1 169618849 AQAXYDDYNVXYEF-PQCBQTOFSA-N 443.091 2.667 50 40 IFGB Cc1cccc(NC(=O)COc2cccc(/C=N/NC(=O)C(=O)NCc3ccccc3)c2)c1 409175827 VKKSVJSKTIYVBA-JVWAILMASA-N 444.491 2.779 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2ccc(C)cc2C)S(C)(=O)=O)cc1OC 20208121 ICHGGZJIFVMSEF-OEAKJJBVSA-N 445.541 2.793 50 40 IFGB COc1cc(I)c(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc1OC 408734959 MCAZPSMVWJRFQN-XEVNVYFWSA-N 442.253 2.511 50 40 IFGB COc1ccc(NS(=O)(=O)c2cccc(C(=O)N/N=C/c3ccccc3O)c2)cc1 3218283 HHBCWSZSDDMSBS-HYARGMPZSA-N 425.466 2.966 50 40 IFGB COC(=O)c1sccc1S(=O)(=O)NNC(=O)c1cc2c(s1)CCCCCC2 22021472 NWAKNPBEQGTNAB-UHFFFAOYSA-N 428.557 2.879 50 40 IFGB O=C(CCCC[C@H]1SC[C@H]2NC(=O)N[C@H]21)N/N=C/c1c(F)c(F)c(F)c(F)c1F 71790017 SUBCRWHUPDUERG-HXCSILILSA-N 436.406 2.558 50 40 IFGB C=CCOc1ccc(C(=O)N/N=C\c2cc(Cl)ccc2OCC(N)=O)cc1OCC 409322723 MYJADHWHRRWKGU-MSXFZWOLSA-N 431.876 2.932 50 40 IFGB N#C/C(=C\c1ccc(OCC(N)=O)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Br 9057439 NLABGIJYMPVNOC-KPKJPENVSA-N 445.229 2.767 50 40 IFGB O=C(NNS(=O)(=O)c1ccc(F)c(F)c1F)c1ccc(COc2ccccc2)o1 12753578 GARWXZILNHZYGG-UHFFFAOYSA-N 426.372 2.899 50 40 IFGB O=C(CN(c1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccccc1)N/N=C/c1ccco1 19951029 PFERPOZHJCGRPN-DEDYPNTBSA-N 428.426 2.533 50 40 IFGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)CN(c2c(C)cccc2C)S(C)(=O)=O)c1 20213918 ZQFGHMYJJOTZNM-XQNSMLJCSA-N 430.530 2.568 50 40 IFGB Cc1cccc(N(CC(=O)NN=C2CCN(C)CC2)S(=O)(=O)c2ccccc2)c1C 57200277 YSKZXTWVEUFPRK-UHFFFAOYSA-N 428.558 2.697 50 40 IFGB CCN(CC)c1ccc(/C=N/NC(=O)[C@H](C)N(c2ccc(OC)cc2)S(C)(=O)=O)cc1 19953867 JWURWRFXARCTGP-CSUZIONRSA-N 446.573 2.846 50 40 IFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1ccc(OCCC(=O)O)cc1)c1ccccc1 33606272 YMNOQJLDHYPJGW-SYVPYPDPSA-N 427.457 2.868 50 40 IFGB COC(=O)c1ccc(/C=N\NC(=O)c2nn(-c3ccc(Cl)cc3)c(=O)c(C#N)c2C)cc1 409057298 JPVOINPRFPGFMV-ROTLSHHCSA-N 449.854 2.617 50 40 IFGB Cc1cc(=O)oc2cc(OCC(=O)OCC(=O)C(C#N)=C3Nc4ccccc4N3)ccc12 9282845 OXXYNBDBDXCNTH-UHFFFAOYSA-N 431.404 2.865 50 40 IFGB O=C(NNS(=O)(=O)c1cccc(Br)c1)c1ccc(Br)cc1 14246712 YMCKBLDDDBAWDG-UHFFFAOYSA-N 434.109 2.835 50 40 IFGB CCN(CC)c1ccc(/C=N/NC(=O)C(=O)N/N=C/c2ccc(N(CC)CC)cc2)cc1 16991531 ZOTUMTITZGNJDR-RPCRKUJJSA-N 436.560 2.979 50 40 IFGB O=C(N/N=C/[C@H]1C(=O)NC(=O)N([C@@H]2C[C@H]3CC[C@H]2C3)C1=O)c1ccc(Cl)cc1Cl 408536892 TUOUUHNFVIUNFM-SHYJSAEJSA-N 437.283 2.592 50 40 IFGB Cc1c(Cl)cccc1NC(=O)COC(=O)CCCC(=O)NNC(=O)c1ccccc1 408647954 VSFJBKDXBGNIJW-UHFFFAOYSA-N 431.876 2.762 50 40 IFGB O=C(CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccccc1)N/N=C/c1ccc(O)cc1 409013287 UGHUQDNEMFEPGI-ZVHZXABRSA-N 441.484 2.873 50 40 IFGB CCC(=O)NNC(=O)CSc1nnc2c3c4c(sc3nc(CC)n12)C[C@@H](C)CC4 13499823 YDMCZXHIICHENP-JTQLQIEISA-N 432.575 2.676 50 40 IFGB Cc1ccc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc1 13777454 LFPLYKWTUXESBQ-XEYRCQSKSA-N 430.464 2.997 50 40 IFGB CCN(CC)c1ccc(C(=O)NNC(=O)[C@H](NC(=O)c2ccc(OC)cc2)C(C)C)cc1 26773725 RJNJSVGQCFYIBA-OAQYLSRUSA-N 440.544 2.757 50 40 IFGB CC(/C=N\NC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1)=C\c1ccccc1 30742982 FPCBJIVBVJNKFV-DZJHMMJTSA-N 440.569 2.507 50 40 IFGB O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1)c1cccc(Cl)c1 40020224 ZMWRXGJVRFKNML-UHFFFAOYSA-N 427.935 2.651 50 40 IFGB O=C(NNC(=O)[C@H]1CCCN(C(=O)c2cccc3ccccc23)C1)c1ccc2c(c1)OCO2 49600768 LDUAVHJPODPWAT-SFHVURJKSA-N 445.475 2.882 50 40 IFGB O=C(N/N=C/c1cc(Br)c(O)c(I)c1)c1ccncc1 408738496 ZVHUXNUFOGJZQT-REZTVBANSA-N 446.042 2.918 50 40 IFGB Cc1cccc(C(=O)Nc2ccc(C(=O)NNC(=O)COc3ccc([N+](=O)[O-])cc3)cc2)c1 955296 OJBAGUNRROYUQL-UHFFFAOYSA-N 448.435 2.996 50 40 IFGB O=C(C[C@H]1NC(Cc2ccccc2)=NNC1=O)N/N=C/c1cccc(Oc2ccccc2)c1 973013 VWRAJQKYRJVYLM-XBIXJXDHSA-N 441.491 2.963 50 40 IFGB COc1ccccc1NC(=O)C(=O)N/N=C(\C)CC(=O)Nc1ccccc1Br 16136802 UYRQAYLTJGHABY-FSJBWODESA-N 447.289 2.917 50 40 IFGB O=C(NNC(=O)c1ccccc1F)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1 26972013 IHIIWMZQRXIOQA-UHFFFAOYSA-N 431.420 2.840 50 40 IFGB COC(=S)O[C@@H]1C[C@H](n2cnc3c(=O)[nH]cnc32)O[C@@H]1CO[Si](C)(C)C(C)(C)C 195495701 AKHWATRAUQBPHS-JHJVBQTASA-N 440.598 2.745 50 40 IFGB COc1cc(/C=C(/C#N)C(=O)NC(N)=O)cc(Cl)c1OCC(=O)Nc1ccc(F)cc1 409232259 PQGLIQBOXLKBGZ-SDQBBNPISA-N 446.822 2.607 50 40 IFGB Cc1ccc(Cn2nc(C)c(C(=O)OCC(=O)NNC(=O)c3ccccc3)c2Cl)cc1 9811678 NGZAXBYUUQAZER-UHFFFAOYSA-N 440.887 2.820 50 40 IFGB COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)CC(C)C)ccc1Cl 12741387 LJGXAGJAUDZPQD-UHFFFAOYSA-N 439.921 2.957 50 40 IFGB O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1O 12809107 VBTDYTFMJHXCGK-UHFFFAOYSA-N 445.884 2.921 50 40 IFGB O=C(CSc1ccc(Cl)cc1)NNC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1 72297060 JXGDAQMAOAYGKS-LJQANCHMSA-N 437.924 2.792 50 40 IFGB COc1cc(OC)cc(C(=O)N/N=C\c2ccc(OCC(=O)O)c(Br)c2)c1 107773543 FGXJAMUQEVJHLR-UKWGHVSLSA-N 437.246 2.694 50 40 IFGB Cc1cccc(C)c1NC(=O)COC(=O)CCC(=O)NNC(=O)c1ccccc1Cl 408646478 PIUKSLKHLWVKIX-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CNS(=O)(=O)c2c(C)cc(C)cc2C)cc1OC 409149990 XLRZHGKWFXNZCV-YDZHTSKRSA-N 445.541 2.614 50 40 IFGB O=C(Cc1ccc(F)cc1)N/N=C\c1cc([N+](=O)[O-])cc(I)c1O 409232992 JKMHAARHICBXGQ-LSCVHKIXSA-N 443.172 2.737 50 40 IFGB COc1ccc(NS(=O)(=O)c2cccc(C(=O)N/N=C/c3ccc(O)cc3)c2)cc1 4528757 NPVVPHFEDPFIAM-HYARGMPZSA-N 425.466 2.966 50 40 IFGB COc1ccc(OC)c(S(=O)(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)c1 12993399 NEGMCMYGNUHJGZ-UHFFFAOYSA-N 433.511 2.759 50 40 IFGB Cc1cccc[n+]1[C@@H]1[C@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C(C(=C=N)C#N)N[C@]1(O)C1CC1 61942062 XYKRUTFELYKHCC-JRFVFWCSSA-N 441.471 2.694 50 40 IFGB CC(=O)Nc1cccc(C(=O)N/N=C\c2ccc(OCC(=O)O)c(Br)c2)c1 108983902 ZJVWCMZWIGNGEA-UKWGHVSLSA-N 434.246 2.635 50 40 IFGB C=CCOc1cccc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)c1 408969922 WZVKKWRWQCYHGH-LFVJCYFKSA-N 445.516 2.942 50 40 IFGB COc1cc([C@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4ccccn4)c(=O)c32)cc2c1OCO2 2246064 CKWIQZXYBSYSLB-FQEVSTJZSA-N 444.447 2.556 50 40 IFGB COc1cccc(-c2nc(C(=O)NNC(=O)c3cccc(N(C)C)c3)cs2)c1OC 12537285 VFYHDYWNYPNYDP-UHFFFAOYSA-N 426.498 2.968 50 40 IFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2cc(Br)c(O)c([N+](=O)[O-])c2)n1 409231506 KVRMKWRQLGAPOW-UBKPWBPPSA-N 440.279 2.712 50 40 IFGB COc1ccc(CNC(=S)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cc1 16273815 GCDSLJXXBATSHV-UHFFFAOYSA-N 434.736 2.942 50 40 IFGB COc1ccc(/C=N/NC(=O)/C(=C/c2ccc3c(c2)OCO3)NC(=O)c2ccco2)cc1 6924747 KWRJEBOUKFUEOY-CECYVXGQSA-N 433.420 2.938 50 40 IFGB CC1=C(C#N)C(=O)N([C@H]2CCS(=O)(=O)C2)C(=O)/C1=C/Nc1ccc(C(C)(C)C)cc1 102676099 ZKTWFUJQSGGFAU-DAQNXSASSA-N 427.526 2.676 50 40 IFGB O=C(CCC(=O)Nc1ccccc1I)N/N=C/c1cccc(O)c1 2753251 HSKKSDDSGDMODL-YBFXNURJSA-N 437.237 2.866 50 40 IFGB COc1cc(/C=C/C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)ccc1OCC#N 3282230 FYLZXZHHRLORFV-VQHVLOKHSA-N 430.420 2.996 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccc(N(C)S(=O)(=O)c3ccccc3)cc2)ccc1O 8843160 YQHIUZKSVPXESB-HZHRSRAPSA-N 439.493 2.990 50 40 IFGB CC[C@H]1CCc2sc(C(=O)NNC(=O)CCNC(=O)NCc3ccccc3)cc2C1 32865865 FHOMPBJLUIGEOV-HNNXBMFYSA-N 428.558 2.914 50 40 IFGB COc1ccc(S(=O)(=O)N(CCc2ccccc2)CC(=O)NN=C2CCCC2)cc1 59444003 SECBHSLPTYTETC-UHFFFAOYSA-N 429.542 2.975 50 40 IFGB Cn1c(=O)n(C)c2cc(N3CCN(c4ccccc4)CC3)c(NC(=O)CCCl)cc21 408533989 UKURUXQOUXGQFU-UHFFFAOYSA-N 427.936 2.771 50 40 IFGB O=C(COc1cccc2ccccc12)N/N=C\c1ccc(OCC(=O)N2CCOCC2)cc1 409011642 HXDYPZNXEZTQNM-QQXSKIMKSA-N 447.491 2.607 50 40 IFGB O=C(CNc1ccc(I)cc1)NNC(=S)Nc1ccccc1 951726622 FLBYSBKYCGQZPT-UHFFFAOYSA-N 426.283 2.721 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cccc(OC)c3OC)[C@@H]2C1 6195003 CLFYTHAIFVKTAI-IEBWSBKVSA-N 433.468 2.586 50 40 IFGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)CN(c2cc(C)cc(C)c2)S(C)(=O)=O)cc1 20208491 BKOQQTVDSYUBEH-XQNSMLJCSA-N 430.530 2.568 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1c(C)cc(C)cc1C 409156494 GBKKKEWGBOAAAK-VULFUBBASA-N 438.528 2.996 50 40 IFGB Cc1ccc(NC(=O)COc2ccccc2/C=N/NC(=O)C(=O)NCc2ccco2)c(C)c1 409273560 ZCGDFECRRKTTSP-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cc3c4ccccc4n(C)c3s2)cc1 1405552 BMGPSCVGHDTSAW-UHFFFAOYSA-N 442.522 2.975 50 40 IFGB aggregator N#Cc1ccc(/C=N/NC(=O)CCSCCC(=O)N/N=C/c2ccc(C#N)cc2)cc1 1681941 BWNNAWSSCIYJBW-RYQLWAFASA-N 432.509 2.544 50 40 IFGB CCCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)CN2C(=O)c3ccccc3C2=O)cc1 1791990 MJJUJKWWVPONQU-GHRIWEEISA-N 431.448 2.711 50 40 IFGB O=C(CSc1nnc2scc(-c3ccc(F)cc3)n12)NNC(=O)c1ccncc1 12878544 GQGJLNAICAFJOK-UHFFFAOYSA-N 428.474 2.545 50 40 IFGB COC(=O)c1ccc(/C=N/NC(=O)c2nc3ccccc3c(=O)n2Cc2ccccc2)cc1 28218259 YGYYAVZECJOJOO-CVKSISIWSA-N 440.459 2.995 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2F)cc1)Nc1ccccc1 58880957 NHJGOFOCFSDKIF-AFUMVMLFSA-N 434.427 2.932 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@@H]3C[C@H](Br)[C@H](Br)C[C@H]3C2=O)cc1 100826478 PESPVOFYLHXLOG-KKOKHZNYSA-N 431.080 2.811 50 40 IFGB Cc1ccc(Cl)cc1NC(=O)COc1ccc(/C=N/NC(=O)C(=O)NC(C)C)cc1 409171397 ANIMJDIKXKOJKI-FOKLQQMPSA-N 430.892 2.641 50 40 IFGB CN1C(=O)/C(=N\NC(=O)Cn2cnc3scc(-c4ccccc4)c3c2=O)c2ccccc21 1784551 HGKQBKZIHIFYQV-QOMWVZHYSA-N 443.488 2.622 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2cccc(Cl)c2Cl)cc1 409157332 IQOXGIDCOHTOHK-BHGWPJFGSA-N 449.294 2.763 50 40 IFGB CCOc1cc(C(=O)N/N=C\c2cc(Cl)c(OCC(N)=O)c(OCC)c2)ccc1OC 409309869 NKPCQVCXFGGRDX-MYKKPKGFSA-N 449.891 2.774 50 40 IFGB COC(=O)c1ccc([C@H]2CC(=O)NC(SCC(=O)N3CCCC[C@@H]3C)=C2C#N)cc1 409328181 ZVOKAQIDUWZPNS-WMLDXEAASA-N 427.526 2.946 50 40 IFGB COc1cc(C(=O)N/N=C2\C(=O)Nc3ccc(C)c(Br)c32)cc(OC)c1OC 8397320 KJWWYNSEMFKPOT-UHFFFAOYSA-N 448.273 2.870 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C\c2ccccc2C(F)(F)F)cc1C 16282960 QEWKOCBPXMXKIF-KSEXSDGBSA-N 443.447 2.793 50 40 IFGB Cc1c(C(=O)N/N=C/c2cc3c(cc2Br)OCO3)sc2ncnc(N)c12 408974145 VSFMHGONWCDEDD-IPBDZQFASA-N 434.275 2.837 50 40 IFGB Cc1ccc(OCC(=O)NNC(=S)NC(=O)c2ccccc2Br)c(C)c1 2136050 JYBOKFIIQIVZAD-UHFFFAOYSA-N 436.331 2.780 50 40 IFGB CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)c2ccco2)cc1 39969202 GTTYRLXXLJCGGS-UHFFFAOYSA-N 429.454 2.554 50 40 IFGB COc1ccccc1-n1nc(C(=O)N/N=C\c2cc#cc3ccccc23)c(C)c(C#N)c1=O 409059041 QPQSXADKIRDWRW-DICXZTSXSA-N 435.443 2.939 50 40 IFGB Cc1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)[C@@H]3[C@@H](C(=O)O)[C@H]4C=C[C@H]3C4)cc2)cc1 409370549 SVCXBMKPJUAOPR-ZULIPRJHSA-N 433.464 2.531 50 40 IFGB CCc1[nH]c(C(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)c(C)c1C(=O)OC 22988268 QQYZUHWFSFUGFK-UHFFFAOYSA-N 436.468 2.719 50 40 IFGB Cc1occc1C(=O)NNC(=O)COc1ccc(Br)cc1Br 8399668 NQTNZXXMSJTXQU-UHFFFAOYSA-N 432.068 2.953 50 40 IFGB aggregator C[N+](C)(C)CC(=O)NC(=O)N/N=C/[C@H](CC#N)CN(Cc1ccccc1)Cc1ccccc1 17214990 CHOCXJOLMFXXPK-JEWPKMHUSA-O 449.579 2.736 50 40 IFGB CCOc1ccc(/C=N/NC(=O)CN(c2ccccc2F)S(C)(=O)=O)cc1OCC 20211704 JZRDIXVSKKMQQS-LPYMAVHISA-N 437.493 2.539 50 40 IFGB Cc1cc(C)cc(N(CC(=O)N/N=C/c2ccc(Br)cc2)S(C)(=O)=O)c1 408781402 CVQBWSMQRRMNSU-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2ccc(Cl)cc2C)S(C)(=O)=O)c(OC)c1 408783744 QJUGZDNOMZVDQY-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB O=C(N[C@H](Cc1cnc[nH]1)C(=O)N/N=C/c1cc(Cl)ccc1O)OCc1ccccc1 408986772 DNNHMBYWDMBELM-ZTWLKVPMSA-N 441.875 2.757 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NC(C)C)cc2)cc1Cl 409165312 WEKFJGFRKNIKJS-FOKLQQMPSA-N 430.892 2.641 50 40 IFGB CC/C(NNC(=O)c1ccccc1Cl)=C1/C(=O)NC(=O)N(c2ccccc2C)C1=O 9424458 BKULCBUHSOWCPK-BMRADRMJSA-N 426.860 2.830 50 40 IFGB C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3ccccc3)ccc2Cl)C1 9545782 XWPRPACGAYYXMK-CQSZACIVSA-N 435.933 2.835 50 40 IFGB COc1ccc2c(c1)CCc1cc(C(=O)NNC(=O)Cn3nnc4ccccc43)sc1-2 12992957 ZJVFZBYMMPULAM-UHFFFAOYSA-N 433.493 2.728 50 40 IFGB CCN(CC)CN1C(=O)/C(=N\NC(=O)c2ccncc2)c2cc(Br)ccc21 19882720 CNVRCOCRJDLDBA-XLNRJJMWSA-N 430.306 2.624 50 40 IFGB COc1cc(/C=N\NC(=O)Cn2cnc3sc(-c4ccccc4)cc3c2=O)ccc1O 31783500 LEKZOEJWWNBJKX-MYKKPKGFSA-N 434.477 2.990 50 40 IFGB COc1ccc(/C=N\NC(=O)CN2CCN(Cc3ccccc3)CC2)cc1Br 32576948 QCLGUCXHTZJQFZ-UCQKPKSFSA-N 445.361 2.726 50 40 IFGB CNC(=O)/C(C#N)=C/c1c(Oc2ccc(Br)cc2)nc2ccccn2c1=O 3643918 OFYHCMMDCYTUNV-ZRDIBKRKSA-N 425.242 2.902 50 40 IFGB Cn1cc(Br)cc1C(=O)NNS(=O)(=O)c1cccc(Cl)c1Cl 12892913 OZNJKNCKXZBQLU-UHFFFAOYSA-N 427.107 2.718 50 40 IFGB O=C(Nc1cccnc1)OC[C@@H](NC(=O)C(Cl)Cl)[C@@H](O)c1ccc([N+](=O)[O-])cc1 53291213 HHHIIBJOVPFLLU-KGLIPLIRSA-N 443.243 2.560 50 40 IFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2cccc(OC)c2)cc(Br)c1O 59483237 XPEYTVPMNKKDRI-KEBDBYFISA-N 436.262 2.651 50 40 IFGB CCCOc1ccc(/C=N/NC(=O)CN(c2ccccc2)S(C)(=O)=O)cc1OCC 408873419 QXGBLZAUGQBZPQ-PXLXIMEGSA-N 433.530 2.790 50 40 IFGB C[C@@H](C(=O)NN=C1CCN(C)CC1)N(c1ccc(Oc2ccccc2)cc1)S(C)(=O)=O 409029252 XOQHQUXIMOXWIB-KRWDZBQOSA-N 444.557 2.831 50 40 IFGB CCOC(=O)CC(=O)CSC1=C(C#N)[C@H](c2ccc(C)cc2)[C@H](C(=O)OC)C(O)=N1 2226904 JNPAAZLQVRBIHF-ROUUACIJSA-N 430.482 2.829 50 40 IFGB Cc1ccc2c(C)c(CCC(=O)NNC(=O)c3cc(Br)cn3C)c(=O)oc2c1 16271432 JXPKWJXEJZLAJX-UHFFFAOYSA-N 446.301 2.905 50 40 IFGB O=C(CN1C[C@@H](c2ccccc2)CC1=O)N/N=C/c1cc2c(cc1Br)OCO2 16478308 BNPBPAIOXUUEOG-XYJSHWMKSA-N 444.285 2.644 50 40 IFGB COc1cc(Br)ccc1OCC(=O)N/N=C/c1cc(OC)c(O)c(OC)c1 678289 ROPCJNAVFYAKMG-AWQFTUOYSA-N 439.262 2.710 50 40 IFGB CC1(C)CC(=O)C2=C(C1)N(c1ccc(S(N)(=O)=O)cc1)C(N)=C(C#N)[C@H]2c1ccco1 2211520 HQPWYIXXBTZYQI-IBGZPJMESA-N 438.509 2.868 50 40 IFGB O=C(COC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)NNC(=O)c1ccccc1 9255008 HHALGHVCDJAKSH-UHFFFAOYSA-N 441.447 2.552 50 40 IFGB N#C/C(=C\c1ccc(OCC(=O)NC[C@@H]2CCCO2)cc1)C(=O)NCCc1ccccc1 13424148 JWQMIVAVFNVQHP-QFVBLGFASA-N 433.508 2.626 50 40 IFGB Cc1cccc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)N2CCOCC2)c1C 13811544 NVBJRROFPAOPIP-NBVRZTHBSA-N 430.464 2.869 50 40 IFGB C/C(=N\NC(=O)CN(c1ccc(Cl)cc1C)S(C)(=O)=O)c1cccc([N+](=O)[O-])c1 14166135 VGNZJEYGLANQSL-DEDYPNTBSA-N 438.893 2.863 50 40 IFGB COc1ccc(OCC(=O)N/N=C2/C(=O)N(C)c3c(C)cc(Br)cc32)cc1 100024524 KOKNURCVCNCKJZ-OQKWZONESA-N 432.274 2.642 50 40 IFGB CCOc1cc(/C=C(/C#N)C(=O)NC(C)C)cc(Br)c1OCC(=O)OC 408772014 JQVZNFLGMZJIDQ-MLPAPPSSSA-N 425.279 2.831 50 40 IFGB COCCNC(=O)/C(C#N)=C/c1ccc(OCc2cc(OC)ccc2OC)c(OC)c1 408804266 WQNJWSYIRUADEF-GZTJUZNOSA-N 426.469 2.961 50 40 IFGB O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1)c1ccc(Cl)cc1 3339274 FBRPZPZGBALXCB-UHFFFAOYSA-N 435.933 2.980 50 40 IFGB COc1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1OC 9665601 KUXLXIHYPGHKJX-CQSZACIVSA-N 430.482 2.634 50 40 IFGB COc1ccccc1OCCN1C(=O)/C(=N\NC(=O)c2ccccc2O)c2ccccc21 40137551 YRAXRPFDSFWRCJ-LVWGJNHUSA-N 431.448 2.961 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccco2)S(=O)(=O)c2ccc(C)cc2)cc1 20059825 AEKDCZOQJRSVGU-HYARGMPZSA-N 427.482 2.942 50 40 IFGB COc1ccc(NC(=O)NNC(=O)c2cccn(Cc3cccc(F)c3)c2=O)c(OC)c1 23136145 LFEDZSBRBVNCIU-UHFFFAOYSA-N 440.431 2.519 50 40 IFGB C[C@]1(C(=O)NNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1(Br)Br 2344806 LDFOZGFCHUHKHU-WXJAXGNASA-N 447.083 2.652 50 40 IFGB C/C(=N/NC(=O)Cn1cc([N+](=O)[O-])c(C)n1)c1ccc(OCc2ccc(C(=O)O)o2)cc1 8816357 RBRHDPBIKXVKCM-MTJSOVHGSA-N 441.400 2.510 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cccc(OC)c3OC)[C@@H]2C1 6194986 CLFYTHAIFVKTAI-MJGOQNOKSA-N 433.468 2.586 50 40 IFGB CC[C@@H]1CCc2sc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2C1 9718252 MXMILENMQSMQCK-GFCCVEGCSA-N 431.470 2.789 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccco2)ccc1OS(=O)(=O)c1ccc([N+](=O)[O-])cc1 408767256 YRLYGFUADUUKQQ-UDWIEESQSA-N 445.409 2.728 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc2ccccc12)c1cccc([N+](=O)[O-])c1 409024910 JCQPSVVYGWQSIC-FYJGNVAPSA-N 426.454 2.664 50 40 IFGB COc1cc(/C=N\NC(=O)c2ccc(Br)cc2)cc(Cl)c1OCC(N)=O 409265404 ICERXLZTAMYZKO-WNFQYIGGSA-N 440.681 2.739 50 40 IFGB Cc1ccccc1N(CC(=O)NN=C1CCN(Cc2ccccc2)CC1)S(C)(=O)=O 409344749 GVTNOJRTFYJGOT-UHFFFAOYSA-N 428.558 2.529 50 40 IFGB NC(=O)CSCCC(=O)NNC(=O)c1ccc(COc2ccc3ccccc3c2)cc1 30546740 DFJMFYRTFLFHLP-UHFFFAOYSA-N 437.521 2.788 50 40 IFGB C/C(=N\OCC(=O)N/N=C1/C(=O)N(CN2CCCCC2)c2ccccc21)c1cccs1 102647655 CNQZSGNHSVQCMO-UWHCKCMLSA-N 439.541 2.799 50 40 IFGB COc1cc(C)ccc1OCC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1 13134414 HPERUBXQFYUBGJ-ZDUSSCGKSA-N 437.290 2.760 50 40 IFGB CCOc1ccc(C(=O)NC(=S)NNC(=O)c2cccs2)cc1Br 14770941 WJMZNAJPOPZKPT-UHFFFAOYSA-N 428.333 2.859 50 40 IFGB C=CCN1C(=O)/C(=N/NC(=O)[C@@H]2COc3ccccc3O2)c2cc(Br)ccc21 100056983 BGWNJUVMMAVTDC-VPMFXMNOSA-N 442.269 2.642 50 40 IFGB O=C(COC(=O)CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2)NNC(=O)c1ccco1 102418833 FZUMHWHJWLSRNB-NYYJTOMGSA-N 439.306 2.708 50 40 IFGB COC(=O)c1ccc(NC(=O)C(=O)N/N=C\c2cc(C)n(-c3cccc(OC)c3)c2C)cc1 223162895 NAJZEEKLZVLYAB-QFEZKATASA-N 448.479 2.978 50 40 IFGB O=C(N/N=C/c1cc(I)ccc1O)c1cncc(Br)c1 2361022 UXVOJIIYCDOCQY-UBKPWBPPSA-N 446.042 2.918 50 40 IFGB Cc1ccccc1Oc1nc2ccccn2c(=O)c1/C=C(\C#N)C(=O)NC[C@@H]1CCCO1 2405904 NVDXSDHTURNASC-KJCUYJGMSA-N 430.464 2.997 50 40 IFGB Cc1ccccc1/C=N/NC(=O)[C@@H](NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12 9065410 OQPOFOTZBMHQAH-WGLQLPMYSA-N 439.475 2.853 50 40 IFGB Cc1c(-c2ccc(/C=N/NC(=O)CNC(=O)COc3ccccc3)o2)cccc1[N+](=O)[O-] 409159287 SDTQBPDSAZQZBN-WYMPLXKRSA-N 436.424 2.809 50 40 IFGB CCN1C(=O)/C(=N/NC(=O)COc2ccccc2[N+](=O)[O-])c2cc(Br)ccc21 9018943 MVMXOTLHSKAFSN-HEHNFIMWSA-N 447.245 2.623 50 40 IFGB COc1ccccc1N(CC(=O)N/N=C/c1ccc2c3c(cccc13)CC2)S(C)(=O)=O 408924501 JIWWDGVPWMZKJO-ZVHZXABRSA-N 437.521 2.863 50 40 IFGB O=C(COc1ccccc1)N/N=C/c1sc(=O)n(Cc2cccc(C(=O)O)c2)c1Cl 2220250 RJCKYOPHCILSDY-LSHDLFTRSA-N 445.884 2.839 50 40 IFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1cc([N+](=O)[O-])cc(Br)c1O 3039394 SZUCNOIRFOZSQK-REZTVBANSA-N 439.178 2.500 50 40 IFGB Cc1onc(-c2ccccc2)c1C(=O)NC(=S)NNC(=O)c1cc(-c2ccco2)[nH]n1 9507704 XUYFARJDJMKZRT-UHFFFAOYSA-N 436.453 2.582 50 40 IFGB CCOc1cc(C(=O)NNC(=O)[C@H](C)Oc2ccc(C#N)cc2)cc(OCC)c1OCC 12993353 PLZRKPXNAKRVKF-HNNXBMFYSA-N 441.484 2.983 50 40 IFGB CCn1c(SCC(=O)NNC(=O)c2ccc(C)cc2)nnc1-c1ccc([N+](=O)[O-])cc1 6878287 JBWCGMCFUNEFTN-UHFFFAOYSA-N 440.485 2.735 50 40 IFGB O=C(CN1CCCc2ccccc21)NNC(=O)Cn1c(C(F)(F)F)nc2ccccc21 9442866 YYMMQVFJJSJTDN-UHFFFAOYSA-N 431.418 2.655 50 40 IFGB C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)N/N=C2/C(=O)Nc3ccccc32)cc1 14361280 IYFJFMJPZZAJFI-HOTGVXAUSA-N 434.496 2.941 50 40 IFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1cccc(OC)c1OC 408602282 BIKGVCKWWTXCOP-KRWDZBQOSA-N 427.530 2.957 50 40 IFGB COc1ccc(C(=O)N/N=C/c2ccc(CNC(=O)C(=O)Nc3ccc(C)cc3)o2)cc1 408775480 HKYSZKOEKJJFCF-AFUMVMLFSA-N 434.452 2.615 50 40 IFGB C#CCOc1ccc(Br)cc1/C=N/NC(=O)CNc1ccc2c(c1)OCO2 409219936 RWVMSEDPQSRCGZ-LSHDLFTRSA-N 430.258 2.752 50 40 IFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2cc(C)n(-c3ccc(C(N)=O)cc3)c2C)n1 409238870 LUMWVTACGAXDQQ-BHGWPJFGSA-N 436.541 2.842 50 40 IFGB Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c2ccc(N(C)C)cc2)cc1 15229783 SHNBLDFYDQZNQU-VQYZLWMVSA-N 430.574 2.904 50 40 IFGB CCn1nc(C(=O)NNC(=O)c2ccc(COc3ccc(C)cc3)o2)c2ccccc2c1=O 30893352 GQNRYDWJOUGTFS-UHFFFAOYSA-N 446.463 2.972 50 40 IFGB Cc1cc(/C=N/NC(=O)c2cccc(N(C)C)c2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 408968504 ZTZMAMOOBIKASB-ZVHZXABRSA-N 439.541 2.571 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NC(C)C)cc2Cl)c(C)c1 409163753 XIRDDAWOBZUSIF-BHGWPJFGSA-N 444.919 2.949 50 40 IFGB CCc1ccc(N2C[C@H](C(=O)NNC(=O)c3cccc(Br)c3)CC2=O)cc1 408615322 OWURITCZOOSHNA-OAHLLOKOSA-N 430.302 2.826 50 40 IFGB COc1ccc(-c2csc(NC(=S)N[C@@H]3CS(=O)(=O)C[C@H]3Cl)n2)cc1OC 575421104 HTCNHGFOJCJOHT-ZYHUDNBSSA-N 447.991 2.518 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2ccc(C)cc2)S(C)(=O)=O)cc1OCC 20207894 PDNCEUIDDLRGMP-HZHRSRAPSA-N 445.541 2.875 50 40 IFGB O=C(Cn1cnc2scc(-c3ccccc3)c2c1=O)N/N=C/c1ccc(O)c([N+](=O)[O-])c1 36075005 NWEAKAYKAHKASJ-NUGSKGIGSA-N 449.448 2.889 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccc(I)c(OC)c2)ccc1O 408747590 PYZVREYAWFRNJO-GIJQJNRQSA-N 426.210 2.778 50 40 IFGB NC(=O)COc1ccc(/C=N/NC(=O)C[C@@H](NC(=O)c2ccccc2)c2ccccc2)cc1 408981170 UZPCZCYWEKRUQX-YABPMDJWSA-N 444.491 2.562 50 40 IFGB COc1cccc([C@@H]2C(C#N)=C(N)N(N3CCOCC3)C3=C2C(=O)CC(C)(C)C3)c1OC 691454 VDKJMCOBLUPFFS-HXUWFJFHSA-N 438.528 2.687 50 40 IFGB COc1ccc(/C=N/NC(=O)COc2ccccc2C#N)cc1I 1445334 IKVCXTSIKCRPFZ-KEBDBYFISA-N 435.221 2.701 50 40 IFGB Cc1ccc(S(=O)(=O)Oc2ccccc2/C=N/NC(=O)c2c(Cl)cnn2C)cc1 2100057 NHGWNYRJPXAAMC-SRZZPIQSSA-N 432.889 2.914 50 40 IFGB O=C(CN1CCCCCC1=O)NNC(=O)C1=NN(c2ccccc2)[C@H](c2ccccc2)C1 12807883 MLVHIFBGNXGILE-NRFANRHFSA-N 433.512 2.544 50 40 IFGB C[C@H](NC(=O)COc1ccc(/C=N/NC(=O)CSc2ncccn2)cc1)c1ccccc1 28215054 DVZUTSZKJFFVRT-HSOLMKNUSA-N 449.536 2.975 50 40 IFGB CCOC(=O)COc1ccc(/C=N/NC(=O)c2cccc(NC(C)=O)c2)cc1OCC 108986358 RTKNELZJNBFTOO-YDZHTSKRSA-N 427.457 2.750 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)c1cc(Cl)ccc1Cl 409024195 BHCWLUTWSBAQAA-DJKKODMXSA-N 445.284 2.818 50 40 IFGB CC/C(=N\NC(=O)[C@@H](C)N(c1ccccc1)S(C)(=O)=O)c1ccc(OC)c(OC)c1 408905957 BJNKUPJAPODEPM-JOJWKMGHSA-N 433.530 2.789 50 40 IFGB Cc1cccc(N(CC(=O)NN=C2CCN(Cc3ccccc3)CC2)S(C)(=O)=O)c1 409344657 GEMKBIUDSRRTDM-UHFFFAOYSA-N 428.558 2.529 50 40 IFGB COc1cc(/C=N/NC(=O)CN(c2cc(Cl)ccc2Cl)S(C)(=O)=O)ccc1O 9891945 MTOQHFLFVXKQAK-AWQFTUOYSA-N 446.312 2.624 50 40 IFGB COc1c(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)ccc(Cl)c1Cl 629505 XHXKXRNQZPJBNP-UHFFFAOYSA-N 429.285 2.581 50 40 IFGB Cc1ccc(/C=C2/SC(=S)N(CCC(=O)NNC(=O)c3ccc(O)cc3)C2=O)cc1 2300281 IMMOFQNXMQPZHL-SFQUDFHCSA-N 441.534 2.753 50 40 IFGB COc1cc(/C=N/NC(=O)COc2ccc(C)cc2)cc(I)c1O 14920651 ZIFOLBZYPKBIAN-DJKKODMXSA-N 440.237 2.843 50 40 IFGB CCc1ccccc1N(CC(=O)NN=C1CCN(C)CC1)S(=O)(=O)c1ccccc1 408829137 OHGHCBLZOBLNNV-UHFFFAOYSA-N 428.558 2.642 50 40 IFGB COc1ccc(C(=O)N/C(=C/c2ccccc2)C(=O)NCCC(=O)OCCCl)cc1 6924793 DKMTXQADDVFHJY-XDJHFCHBSA-N 430.888 2.754 50 40 IFGB C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NC(=S)NNC(=O)c1ccccc1O 12284885 WGEVVLNNSWMWJH-VIFPVBQESA-N 428.297 2.802 50 40 IFGB Cc1c(/N=C2/NC[C@@H](CI)S2)c(=O)n(-c2ccccc2)n1C 15228008 ZVEMEJOQVQVARJ-GFCCVEGCSA-N 428.299 2.612 50 40 IFGB CCOc1ccc(C(=O)NNC(=O)[C@H](NC(=O)c2c(F)cccc2F)C(C)C)cc1OC 13062671 DUTFZUBONCYYRE-LJQANCHMSA-N 449.454 2.588 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccccc2C(F)(F)F)S(C)(=O)=O)cc1 20210171 MTUTVJCOHICABK-SSDVNMTOSA-N 429.420 2.630 50 40 IFGB CCCOc1ccc(/C=N/NC(=O)[C@H](C)N(c2ccc(OC)cc2)S(C)(=O)=O)cc1 20214797 UEJGXAWYXYKMLR-PZBNQXIHSA-N 433.530 2.789 50 40 IFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1ccc(OCCC(=O)O)cc1)c1ccccc1 33606268 YMNOQJLDHYPJGW-CKMDTHJYSA-N 427.457 2.868 50 40 IFGB Cc1ccc(N2C(=O)[C@H](/C=C(\C#N)C(=O)Nc3ccccc3F)C(=O)NC2=S)cc1C 408811738 AJSIYLCVGHFTPY-HFQYIWAZSA-N 436.468 2.895 50 40 IFGB N#C/C(=C\c1cn(CC(=O)NCc2ccco2)c2ccccc12)C(=O)NC[C@@H]1CCCO1 883598 XDEYXGQJIQUITF-KDMTZKAISA-N 432.480 2.753 50 40 IFGB O=C(N/N=C\c1ccccc1O)c1cc(C(=O)N/N=C/c2ccccc2O)cc([N+](=O)[O-])c1 4464116 YPOBNHGMTZBNAK-QFHCXKJNSA-N 447.407 2.534 50 40 IFGB CN(C)C(=O)CSc1ccccc1C(=O)OCC(=O)C(C#N)=C1Nc2ccccc2N1 9223337 PGTIYVGRMKSERU-UHFFFAOYSA-N 436.493 2.866 50 40 IFGB Cc1ccsc1/C=N/NC(=O)CN(C)S(=O)(=O)c1ccc(Br)cc1 16363144 OMHHZKWQWSRAGE-RQZCQDPDSA-N 430.349 2.590 50 40 IFGB COc1ccc(OC)c(N(CC(=O)N/N=C/c2ccco2)S(=O)(=O)c2ccccc2)c1 19951489 FDFCITDLYMYCPC-HYARGMPZSA-N 443.481 2.642 50 40 IFGB CCNc1ccc(C(=O)N/N=C2/C(=O)Nc3ccc(Br)cc32)cc1[N+](=O)[O-] 33044007 FUOMGDFTUVUKOT-UHFFFAOYSA-N 432.234 2.875 50 40 IFGB CCOC(=O)COc1ccc(/C=N/NC(=O)c2cc(OC)cc(OC)c2)cc1OCC 34807441 GYTUGYJRQCKCQD-YDZHTSKRSA-N 430.457 2.808 50 40 IFGB COc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCc3ccccn3)c2C)cc1Cl 408963425 BUGNGMKXMFQOAM-RPPGKUMJSA-N 439.903 2.918 50 40 IFGB COc1cc(/C=N/NC(=O)c2sc3ncnc(N)c3c2C)cc(Br)c1O 408973977 SJQOLRPBVGDRPD-IGCPIRJNSA-N 436.291 2.823 50 40 IFGB CCN(CC)c1ccc(O)c(/C=N/NC(=O)Cn2nnc(-c3ccccc3Cl)n2)c1 408977694 JOTZMACGVXSJNZ-WSDLNYQXSA-N 427.896 2.696 50 40 IFGB COc1cc(CCC(=O)NNC(=O)[C@@H](C)Nc2nc3ccccc3s2)cc(OC)c1 10676814 OWFJUJOSOLCWBA-CYBMUJFWSA-N 428.514 2.894 50 40 IFGB Cc1ccccc1/C=N\NC(=O)[C@@H](NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12 33688158 OQPOFOTZBMHQAH-XPUNOZPZSA-N 439.475 2.853 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1cc(Br)ccc1Nc1ccc(OC)cc1 408708656 SDSSTYNUUHYXKQ-WSDLNYQXSA-N 431.290 2.954 50 40 IFGB O=C(NC[C@@H]1CCCO1)C(=O)N/N=C/c1cc(Br)ccc1Nc1ccccc1 408709184 YKFYKAYZTZQGPG-FZJZADEZSA-N 445.317 2.938 50 40 IFGB O=C(Cn1cnc2sc(-c3ccccc3)cc2c1=O)N/N=C1\C(=O)Nc2ccccc21 958345 NLNQNNUXVWQNKW-UHFFFAOYSA-N 429.461 2.598 50 40 IFGB O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1)c1ccc(F)cc1 3325042 ROKFVQNEIZLHPY-UHFFFAOYSA-N 439.468 2.652 50 40 IFGB C=CCN(N=O)C(=O)N(CCC)CCCC[C@@H](NC(C)=O)C(=O)NCc1ccccc1 5784921 BJOIOOQNCUHQNP-HXUWFJFHSA-N 431.537 2.979 50 40 IFGB C[C@@H]1CN(c2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)NCc2ccccc2)C[C@@H](C)O1 9075705 SVTWQVBXNAWYRC-LNSJNNGNSA-N 443.507 2.531 50 40 IFGB C/C(CC(=O)NCc1ccc(Cl)cc1)=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 14923593 PQXSSOLKIUMKOG-WSDLNYQXSA-N 447.835 2.898 50 40 IFGB COc1ccc(C)cc1S(=O)(=O)N(C)CC(=O)N/N=C\c1c(O)ccc2ccccc12 16291157 ZLWWAUHOINCILD-QRVIBDJDSA-N 441.509 2.633 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2cccc(Cl)c2)S(C)(=O)=O)cc1Cl 408780153 TZNVKTHDLUFKGU-KEBDBYFISA-N 430.313 2.918 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccc(Cl)cc2)c1 409262324 HSJGMBIXQLNEDH-XMTZNVEYSA-N 430.892 2.722 50 40 IFGB COc1ccc(Cl)cc1C(=O)OCC(=O)NNC(=O)c1ccccc1Br 9663969 PYYSESMYUIAOKJ-UHFFFAOYSA-N 441.665 2.729 50 40 IFGB CC(=O)NNc1nc(C)c(C(/C=C/c2ccccc2O)=N/NC(=O)c2ccncc2)s1 16958132 HVRQPULLOZMIFZ-CJWOJCOVSA-N 436.497 2.863 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)[C@@H](C)N(c2ccc(OC)cc2)S(C)(=O)=O)cc1 20214789 OIIPKBHUVBIODA-QFNCUCFLSA-N 431.514 2.565 50 40 IFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)C1=NN(Cc2ccc(F)cc2)C(=O)CC1 40140427 OSAZVIOCZNOKIG-UHFFFAOYSA-N 426.492 2.668 50 40 IFGB Cc1cc(/C=N\NC(=O)C(=O)NCCc2ccccc2)c(C)n1-c1ccc(C(=O)O)cc1 223164288 IHFVJNIZYYIETP-YSMPRRRNSA-N 432.480 2.601 50 40 IFGB COC(=O)[C@@H]1C(=O)NC(SCC(=O)N2[C@@H](C)CCC[C@H]2C)=C(C#N)[C@H]1c1ccccc1 409131878 PGYRQKOPKAYIFC-ITKAJJHTSA-N 441.553 2.947 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1cc(Cl)cc(Cl)c1 409169916 SXLZKOQBXXMTIZ-BHGWPJFGSA-N 449.294 2.763 50 40 IFGB O=C(CCCOc1ccc(Cl)cc1Cl)NCC(=O)N/N=C/c1ccc(O)cc1O 32114557 NSMCSNXCDTYSSC-AUEPDCJTSA-N 440.283 2.830 50 40 IFGB N#C/C(=C\c1cnn(-c2ccc(Cl)cc2)c1)C(=O)Nc1ccc(S(N)(=O)=O)cc1 40139636 JPSJSDZLQOPBKG-NTEUORMPSA-N 427.873 2.719 50 40 IFGB BrCCOCCOCCOCCOCCOCCOCc1ccccc1 888087251 UHESJGULKUNTKI-UHFFFAOYSA-N 435.355 2.681 50 40 IFGB O=C(CCc1ccccc1)NCC(=O)N/N=C1\C(=O)N(Cc2ccccc2)c2ccccc21 2287403 HWEZYNRNRIBDII-GNVQSUKOSA-N 440.503 2.803 50 40 IFGB O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)Cn1cnc2ccccc2c1=O 9119251 KQHGKVLCPLJLMG-UHFFFAOYSA-N 449.294 2.710 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@H]3[C@@H]4C[C@H]([C@@H](Br)[C@H]4Br)[C@@H]3C2=O)c1 100159277 AQAXYDDYNVXYEF-RHIYVLOFSA-N 443.091 2.667 50 40 IFGB Cc1cccc(N2C(=O)NC(=O)[C@H](/C=N/NC(=O)c3ccc(Cl)cc3Cl)C2=O)c1 408536167 QCTQJSHVQHICMR-DKNGMTOASA-N 433.251 2.917 50 40 IFGB CCOc1ccc(N([C@@H](C)C(=O)N/N=C(\C)c2ccc(OC)cc2)S(C)(=O)=O)cc1 408906233 DELGIVQBCDDILI-PZBNQXIHSA-N 433.530 2.789 50 40 IFGB CCOc1ccccc1OCC(=O)N/N=C/c1cc([N+](=O)[O-])cc(Br)c1O 2742989 YURZMVBTUQAEAT-DJKKODMXSA-N 438.234 2.991 50 40 IFGB CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)CC34CC5CC(CC(C5)C3)C4)ccc21 12985276 SGJZZCMVQQIIEU-UHFFFAOYSA-N 445.585 2.766 50 40 IFGB COc1ccc(OC)c(S(=O)(=O)N(C)CC(=O)N/N=C\c2ccc(C(C)C)cc2)c1 33519706 VUGCAPHVVBXLSO-XKZIYDEJSA-N 433.530 2.598 50 40 IFGB C#CCOc1ccc(Br)cc1/C=N/NC(=O)CNC(=O)OCc1ccccc1 408820651 XSYIDGSQAAFKMP-FSJBWODESA-N 444.285 2.838 50 40 IFGB O=C(COc1ccccc1/C=N/NC(=O)C(=O)Nc1ccc(F)cc1)Nc1ccccc1 409267293 UMOCTTQBPBILKD-AFUMVMLFSA-N 434.427 2.932 50 40 IFGB O=C(N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1)c1cccc(S(=O)(=O)N2CCCC2)c1 3210806 MBBBZXYNCAWQQD-UDWIEESQSA-N 436.877 2.797 50 40 IFGB CCN(CC)S(=O)(=O)c1cc([N+](=O)[O-])ccc1NNC(=O)Nc1ccccc1OC 8670536 ARMPGCJEAQVRJU-UHFFFAOYSA-N 437.478 2.783 50 40 IFGB C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cc1cnn(-c2ccccc2)c1 12808650 UYRNYQZIPGDMBY-AWEZNQCLSA-N 443.301 2.792 50 40 IFGB COC(=O)N/N=C(\c1nc2ccc(Cl)cc2nc1O)[C@@H](O)c1ccc([N+](=O)[O-])cc1 17949532 VBCPPHSSHJQCQP-SITPEIFSSA-N 431.792 2.691 50 40 IFGB CC/C(=N\NC(=O)CN(c1cccc(C)c1)S(C)(=O)=O)c1ccc(OC)c(OC)c1 20207706 DDBGHBAIXKHSPY-RELWKKBWSA-N 433.530 2.709 50 40 IFGB COc1cc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)cc(Br)c1O 28217919 SFXNENDOYPSAMP-CNHKJKLMSA-N 425.308 2.813 50 40 IFGB COc1cc([C@H]2[C@@H](Cl)C(=O)N2NC(=O)Cc2ccccc2)cc(Br)c1O 5838500 KYUYQEKFSYROPZ-CVEARBPZSA-N 439.693 2.928 50 40 IFGB Cc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccccc2O)cc1 12521289 SQFYFGPISBCDTC-UHFFFAOYSA-N 425.466 2.576 50 40 IFGB COc1cc(/C=N/NC(=O)C(=O)NCc2ccco2)ccc1OCc1ccc(F)cc1 17472372 PMGMOZIDCMMHKW-BRJLIKDPSA-N 425.416 2.773 50 40 IFGB O=C(CCN1CCN(Cc2ccccc2)CC1)NNC(=O)Cc1ccc(Cl)c(Cl)c1 22801866 GRWXKJSMWPOIGE-UHFFFAOYSA-N 449.382 2.891 50 40 IFGB Cc1cc(/C=N/NC(=O)C(=O)NC[C@H]2CCCO2)c(C)n1-c1ccccc1C(F)(F)F 58912236 FULLZVDVPZZZMM-OUPCILMJSA-N 436.434 2.858 50 40 IFGB CC1=NN(c2ccc(Br)cc2)C(=O)/C1=C/NNC(=O)c1ccccc1[N+](=O)[O-] 100507707 WCAGTGRSEGFKLX-XNTDXEJSSA-N 444.245 2.898 50 40 IFGB Cc1ccc2c(c1Br)/C(=N/NC(=O)COc1ccccc1[N+](=O)[O-])C(=O)N2 672424 UOCVTEFMBCTNDH-UHFFFAOYSA-N 433.218 2.517 50 40 IFGB O=C(NNC(=O)c1cccs1)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1 9467957 ZWSLXGXBORRWHL-UHFFFAOYSA-N 437.449 2.902 50 40 IFGB CCc1ccccc1N(CC(=O)N/N=C(\C)c1cccc(NC(C)=O)c1)S(C)(=O)=O 20208953 ICIFCYQDEMIWIX-HZHRSRAPSA-N 430.530 2.514 50 40 IFGB Cc1ccsc1/C=N/NC(=O)CN(c1ccccc1Br)S(C)(=O)=O 58925148 UDRMNTJHKXMWCI-RQZCQDPDSA-N 430.349 2.735 50 40 IFGB Cc1ccc(NC(=O)C(=O)N/N=C/c2ccc(OCC(=O)N3CCCC3)cc2)cc1Cl 409150609 CWXXCEYLEPUQCW-ZMOGYAJESA-N 442.903 2.738 50 40 IFGB O=C1CC=C2[C@@H]3C[C@H]4N(CC[C@]45c4cc(O)c(O)cc4N1[C@H]25)C/C3=C\CBr 5048152 VFOJBHJJEXIGII-KWSKFPHISA-N 429.314 2.810 50 40 IFGB COc1ccc(C)cc1NC(=O)C(=O)N/N=C(\C)CC(=O)NC12CC3CC(CC(C3)C1)C2 8405276 ZYOSAIQDZVFJTE-JFLMPSFJSA-N 440.544 2.909 50 40 IFGB CN(C)c1ccc([P@](=O)(CC(=O)N/N=C/c2ccc(C#N)cc2)OCCCl)cc1 9087006 GAIZIBJVBYJOQI-NDHMKERHSA-N 432.848 2.933 50 40 IFGB CC/C(NNC(=O)c1ccccc1Cl)=C1/C(=O)NC(=O)N(c2ccc(OC)cc2)C1=O 9332846 BGIASQNDJJDKKY-WUKNDPDISA-N 442.859 2.530 50 40 IFGB O=C(NNc1ccc(F)cc1)[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccccc1F 32904800 ZMINENWBWGLDCD-LJQANCHMSA-N 431.464 2.998 50 40 IFGB COC(=O)c1ccc(NC(=O)C(=O)N/N=C\c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 223162465 RDTAKDUJYWPFOR-QFEZKATASA-N 448.479 2.978 50 40 IFGB O=C(Oc1ccc([N+](=O)[O-])cc1C=NN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1ccccc1 409410372 VWASVJXIOYXSTK-HZVDNRATSA-N 431.404 2.955 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cc(OC)ccc3OC)[C@H]2C1 6195011 MZHIUBKIYFQJRU-ICSRJNTNSA-N 433.468 2.586 50 40 IFGB COc1ccccc1Oc1nc2ccccn2c(=O)c1/C=C(\C#N)C(=O)NC[C@@H]1CCCO1 13769838 CMUKXQUFMMIWQT-MAUBAPBLSA-N 446.463 2.698 50 40 IFGB CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\c1c(C)nn(-c2ccc(Br)cc2)c1O 16249318 LTJOQKKQBDIOFI-ZSOIEALJSA-N 427.258 2.871 50 40 IFGB C/C(=N\NC(=O)CN(c1cccc(Br)c1)S(C)(=O)=O)c1cccs1 20209768 WDMHDYVBEBLGAW-GZTJUZNOSA-N 430.349 2.817 50 40 IFGB O=C(N[C@@H](Cc1cnc[nH]1)C(=O)N/N=C/c1cc(Cl)ccc1O)OCc1ccccc1 408986771 DNNHMBYWDMBELM-IZHXIWSZSA-N 441.875 2.757 50 40 IFGB CCOc1cc(/C=N/NC(=O)C2CCN(C(=O)c3cccc(OC)c3)CC2)ccc1O 409007508 XAWJJZSNEJPBPT-BUVRLJJBSA-N 425.485 2.802 50 40 IFGB O=C1N[C@H](CSSC[C@@H]2NC(=O)N(c3ccccc3)C2=O)C(=O)N1c1ccccc1 17919486 LWWOTFAGDSYYIA-IYBDPMFKSA-N 442.522 2.618 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc(OCC#N)cc1)c1cccc2ccccc12 20215024 YBBUBYBFJDKFKI-BUVRLJJBSA-N 436.493 2.658 50 40 IFGB O=C(NNc1nc(=Nc2ccccc2)nc(N2CCCC2)[nH]1)Nc1ccc([N+](=O)[O-])cc1 408726669 UOZUHGXRLRCXRQ-UHFFFAOYSA-N 435.448 2.694 50 40 IFGB C=CCN(N=O)C(=O)N(CCC)CCCC[C@H](NC(C)=O)C(=O)NCc1ccccc1 5784907 BJOIOOQNCUHQNP-FQEVSTJZSA-N 431.537 2.979 50 40 IFGB Cc1cc(Br)ccc1OCC(=O)NNC(=O)c1ccc(Br)o1 8400389 PFIWPFPGKGVUKF-UHFFFAOYSA-N 432.068 2.953 50 40 IFGB COc1cccc(NC(=O)COc2ccc([C@H]3C(C#N)=C(N)Oc4[nH]nc(C)c43)cc2)c1 9715941 GCQJZCSASSDMLX-NRFANRHFSA-N 431.452 2.962 50 40 IFGB COc1ccc(OC)c(N(CC(=O)N/N=C/c2cccc3ccccc23)S(C)(=O)=O)c1 408773766 LZJSBUYNJSQCRL-OEAKJJBVSA-N 441.509 2.773 50 40 IFGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 408883629 VFQMBTVITKLDQA-XNHPLOEXSA-N 436.877 2.552 50 40 IFGB COc1ccc(N2C(=O)[C@@H]3[C@@H]4C[C@H]([C@@H]3C2=O)[C@@H](Br)[C@@H]4Br)cc1 3152388 KHYQVLDAIPZWMH-GSZZWUTPSA-N 429.108 2.978 50 40 IFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1cc(OC)ccc1OC 6511082 CCXANVUOJNLXPG-GOSISDBHSA-N 427.530 2.957 50 40 IFGB O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C\NNC(=O)C12CC3CC(CC(C3)C1)C2 8430147 CZPDNJDQKAIZIK-BOPFTXTBSA-N 442.903 2.644 50 40 IFGB O=C(NNC1=C/C(=N/S(=O)(=O)c2ccccc2)c2ccccc2C1=O)c1ccccc1 101027831 AMMXMQWPJKIPHN-QOMWVZHYSA-N 431.473 2.879 50 40 IFGB CN(C)c1ccc(/C=N/NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)cc1 408876681 PUERDHQSNRWETB-KWJZBXMYSA-N 434.949 2.709 50 40 IFGB O=C(N[C@H](C(=O)N/N=C\c1ccc(F)cc1)c1n[nH]c(=O)c2ccccc12)c1ccccc1 33745233 HCQJTQIZMJVMMK-IDEIYSCTSA-N 443.438 2.684 50 40 IFGB Cc1ccc(C)c(N2C/C(=N\NC(=O)CC#N)[C@@H](c3nc4ccccc4s3)C(=O)C2=O)c1 102915111 GAMXJKYDOOXCOF-RHKYMZEHSA-N 445.504 2.999 50 40 IFGB C/C(=N\NC(=O)[C@H](C)S[C@@H](C)C(=O)N/N=C(\C)c1ccccc1O)c1ccccc1O 104382825 LCPLTURMCNZSNV-AVJRFCSFSA-N 442.541 2.989 50 40 IFGB COc1cccc(C(=O)N2CCC(C(=O)N/N=C/c3cccc(OC)c3OC)CC2)c1 409004957 GNVXVKYVKVTKNC-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB COc1cc(CN(C)CC(=O)NNC(=O)c2ccc(Cl)cc2)ccc1OC(F)F 9466719 WZIWBVDVKHWZIQ-UHFFFAOYSA-N 427.835 2.843 50 40 IFGB C[C@H]1CCc2c(sc3ncn([C@@H](C)C(=O)N/N=C4/C(=O)Nc5ccccc54)c(=O)c23)C1 11990283 MZZYTMBCRSLKNM-RYUDHWBXSA-N 435.509 2.616 50 40 IFGB Cc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)OCCO3)c(C)n1-c1ccc(F)cc1 12636143 JTJINRHXOSZCKV-UHFFFAOYSA-N 445.472 2.628 50 40 IFGB O=C(N[C@@H](C(=O)N/N=C\c1ccccc1F)c1n[nH]c(=O)c2ccccc12)c1ccccc1 85886301 LNTNZPINWCEWQB-WZRHPCBOSA-N 443.438 2.684 50 40 IFGB C[C@@H](c1ccccc1)N1C[C@@H](C(=O)NNC(=O)c2ccc(Br)cc2)CC1=O 216298785 YZPCDJWYLJCLPJ-BBRMVZONSA-N 430.302 2.820 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1OCC(=O)Nc1ccc(CC)cc1 408612904 XJISKTQELMOMJR-DHRITJCHSA-N 444.919 2.896 50 40 IFGB COc1cccc(N(CC(=O)N/N=C/c2ccc(Cl)cc2Cl)S(C)(=O)=O)c1 408785477 ZKRHXJKMZHJNQB-KEBDBYFISA-N 430.313 2.918 50 40 IFGB O=C(COc1cccc(/C=N/NC(=O)C(=O)NCCc2ccccc2)c1)Nc1ccccc1 409156939 TUNJLKUMOALWDJ-WPWMEQJKSA-N 444.491 2.513 50 40 IFGB Cc1ccc(C(=O)NNC(=O)CSc2nnc(-c3ccncc3)n2Cc2ccco2)cc1 1224038 YPQCUJSGLQWVIY-UHFFFAOYSA-N 448.508 2.843 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C/c2ccc(C(C)(C)C)cc2)cc1OC 16323055 KUUYRXJRUZSSAL-OEAKJJBVSA-N 447.557 2.772 50 40 IFGB COc1cc(C=NNC(=O)[C@@H](C)n2cnc3sc4c(c3c2=O)CCCC4)ccc1O 11990280 JHFBEXQXOQWOJB-GFCCVEGCSA-N 426.498 2.762 50 40 IFGB O=C(CCN1C(=O)/C(=C\c2ccccc2F)SC1=S)NNC(=O)c1ccccc1O 12032350 GZCFPUVNJIWKSX-LFIBNONCSA-N 445.497 2.584 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2cccc3ccccc23)S(C)(=O)=O)c1OC 19955091 OXYMOBFBWVSXDO-OEAKJJBVSA-N 441.509 2.773 50 40 IFGB COc1cccc([C@H]2C(C#N)=C(N)OC3=C2S(=O)(=O)N(C)c2ccccc23)c1OC 20558291 HULHKFLCEQOVDJ-KRWDZBQOSA-N 425.466 2.660 50 40 IFGB CCc1ccccc1N(CC(=O)N/N=C/c1cccc(OC2CSC2)c1)S(C)(=O)=O 408876454 LJYHLDYRAYWQGO-WSDLNYQXSA-N 447.582 2.660 50 40 IFGB COc1cc(/C=N/NC(=O)CSc2ccc([N+](=O)[O-])cc2)ccc1O[C@@H](C)C(=O)O 409015788 BFKFISFEJAPRJS-QDBSGRMGSA-N 433.442 2.698 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2cccc(Cl)c2)c1 409264147 PFRWCCQREPFDAJ-CHOFVFFHSA-N 430.892 2.722 50 40 IFGB O=C(NNS(=O)(=O)c1ccc(Cl)cc1)c1cnn(-c2ccccc2)c1-n1cccc1 8672180 JBXIQZTVYOYRML-UHFFFAOYSA-N 441.900 2.940 50 40 IFGB Cc1cc2c(c(=O)n1C)[C@]1(C(=O)N(Cc3cccc(F)c3)c3ccccc31)C(C#N)=C(N)O2 9743083 RZDCPHZMHIFLMS-RUZDIDTESA-N 442.450 2.752 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2ccc(OC3CSC3)cc2)S(C)(=O)=O)cc1C 20208672 ZADBRBGHJZIUDG-SSDVNMTOSA-N 447.582 2.714 50 40 IFGB CCOc1ccc(/C=N/NC(=O)CN(c2ccccc2CC)S(C)(=O)=O)cc1OCC 20208917 AJHLSLVKGCMLOT-HZHRSRAPSA-N 447.557 2.963 50 40 IFGB O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2C(=O)O)o1)c1cc([N+](=O)[O-])ccc1O 409044286 VGNKMRDUDJFOCT-AWQFTUOYSA-N 440.324 2.931 50 40 IFGB COc1ccc(Br)cc1/C=C/C(=O)NC(=S)NNC(=O)c1cccs1 32119238 LOFHGPTYDZHJLJ-QPJJXVBHSA-N 440.344 2.868 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)CN(c2ccc(C)c(C)c2)S(C)(=O)=O)cc1OC 408779544 YEMMIGJYFZATOO-CJLVFECKSA-N 433.530 2.627 50 40 IFGB COc1ccc(C(=O)N/N=C/c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cc1 408968266 XREDALYVVKLPKU-YDZHTSKRSA-N 426.498 2.514 50 40 IFGB Cc1ccc(NC(=O)COc2ccccc2/C=N/NC(=O)C(=O)NCc2ccco2)cc1C 409257073 NVUMVLCAIRAKCO-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB O=C(CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1)N/N=C/c1ccco1 19949802 MXGAXAUKANDNJQ-DEDYPNTBSA-N 428.426 2.533 50 40 IFGB O=C(O)CC/C(=N/NC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccccc1 61887565 ZOBWWXCAAXOJSD-ATJXCDBQSA-N 443.525 2.860 50 40 IFGB COc1cccc(N2C(=O)NC(=O)[C@H](/C=N/NC(=O)c3ccc(Cl)cc3Cl)C2=O)c1 408538080 YVDGBONAZFHIAX-DKNGMTOASA-N 449.250 2.617 50 40 IFGB CN(C)c1cccc(OCC(=O)N/N=C\c2cc(Br)cc([N+](=O)[O-])c2O)c1 409105855 LMUWYCKLPBFERN-OCKHKDLRSA-N 437.250 2.658 50 40 IFGB CNC(=O)/C(C#N)=C1\S[C@@H](Cc2cccc([N+](=O)[O-])c2)C(=O)N1c1ccc(F)cc1 1888689 PAVREMFWRPWJNV-IMGOXIFKSA-N 426.429 2.906 50 40 IFGB COc1cc(OC)c(OC)cc1/C=N/NC(=O)c1ccc(CSc2nncn2C)cc1 3351780 XHWFWIPVMBLDNW-SSDVNMTOSA-N 441.513 2.897 50 40 IFGB O=C(CCN1C(=O)/C(=C/c2cccs2)SC1=S)NNC(=O)c1ccc(F)cc1 8660840 BPGRZMGVYJXVMM-UVTDQMKNSA-N 435.527 2.940 50 40 IFGB CCOc1ccc2ccccc2c1/C=N/NC(=O)CNC(=O)[C@H]1COc2ccccc2O1 13764594 MLRJGNLOSKPBPM-XFBJJFJZSA-N 433.464 2.645 50 40 IFGB O=C(N[C@H](C(=O)N/N=C\c1ccccc1)c1n[nH]c(=O)c2ccccc12)c1ccccc1 33929378 INIJLTOZUZPYLC-BABSMXRMSA-N 425.448 2.545 50 40 IFGB COc1cc(/C=N/NC(=O)Cc2nnc(NC(=O)c3ccc(Cl)cc3)s2)ccc1O 106340513 AKBUMEUTFHYEKD-UFFVCSGVSA-N 445.888 2.851 50 40 IFGB Cc1ccc(N2C(=O)NC(=O)/C(=C\NNC(=O)C34CC5CC(CC(C5)C3)C4)C2=O)c(C)c1 408532445 MRVXPZOOLXZUCS-LDADJPATSA-N 436.512 2.607 50 40 IFGB O=C(CNC(=O)OCc1ccccc1)NCC(=O)NN(c1ccccc1)c1ccccc1 409003546 SOMGTJIKSFGFSH-UHFFFAOYSA-N 432.480 2.899 50 40 IFGB Cc1cc(C)cc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NCc3ccco3)cc2)c1 409255982 NABCRUVORPGERT-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB COc1cc([C@@H]2[C@@H](Cl)C(=O)N2NC(=O)c2ccc(N)cc2)cc(Br)c1O 1633090 PKBYULAWXQAMBX-ZIAGYGMSSA-N 440.681 2.581 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cc(OC)cc(OC)c3)[C@H]2C1 6195007 GQVILTUHGBDNRJ-PMACEKPBSA-N 433.468 2.586 50 40 IFGB Cc1ccc(OCC(=O)NNC(=O)CNc2nc3ccccc3s2)c2c1[C@@H](C)CC2=O 32909683 HTMVUWRUPMNSBO-ZDUSSCGKSA-N 438.509 2.933 50 40 IFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C\c1cc(Br)cc([N+](=O)[O-])c1O 40853244 QDTZPDWHAOZHAC-IDUWFGFVSA-N 439.178 2.500 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)CN(c2cc(C)cc(C)c2)S(C)(=O)=O)cc1OC 408771950 LROITSTXIXGEGQ-CJLVFECKSA-N 433.530 2.627 50 40 IFGB CCCCOc1ccc(C(=O)NN(CCC#N)C2=NS(=O)(=O)c3ccccc32)cc1 12631394 ALDVJMARHSFKRE-UHFFFAOYSA-N 426.498 2.875 50 40 IFGB CCCOc1ccc(/C=N/NC(=O)CN(c2cc(C)ccc2OC)S(C)(=O)=O)cc1 20212268 XWOXZKQJWVLOOJ-HYARGMPZSA-N 433.530 2.709 50 40 IFGB COc1ccc(CC(=O)N/N=C/c2ccc(OCC(=O)N3CCCCC3)cc2)cc1OC 59436887 LTMILDZENPJGHU-PCLIKHOPSA-N 439.512 2.788 50 40 IFGB CN1CCN(c2ccc([N+](=O)[O-])cc2/C=N/NC(=O)c2ccc(Br)cc2)CC1 409005916 GMUCNAPDTVJVTI-FYJGNVAPSA-N 446.305 2.873 50 40 IFGB C/C(=N/NC(=O)[C@@H](C)n1cnc2sc3c(c2c1=O)CCC3)c1ccc2c(c1)OCCO2 13959931 CHYHSTNFKMCWEI-IFUVNARDSA-N 438.509 2.819 50 40 IFGB CN(C)CN1C(=O)/C(=N\NC(=O)c2ccc(N(C)C)cc2)c2cc(Br)ccc21 20215566 DERQJYDLZCNVCN-PYCFMQQDSA-N 444.333 2.515 50 40 IFGB COCc1cc(C)n(CC(=O)N/N=C/c2ccc(OCc3ccccc3)cc2)c(=O)c1C#N 98087311 YFDRNFYJOIWHJX-MZJWZYIUSA-N 444.491 2.904 50 40 IFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(OC)cc1OC 408608848 WWPQCJXJNITDMM-GOSISDBHSA-N 427.530 2.957 50 40 IFGB CS(=O)(=O)N(CC(=O)NN=C1CCN(Cc2ccccc2)CC1)c1ccccc1Cl 409349144 UQBJEGOLYGXARK-UHFFFAOYSA-N 448.976 2.874 50 40 IFGB CNC(=O)/C(C#N)=C1\S[C@H](Cc2cccc([N+](=O)[O-])c2)C(=O)N1c1ccc(F)cc1 1888686 PAVREMFWRPWJNV-XUMLYMLNSA-N 426.429 2.906 50 40 IFGB COc1ccccc1S(=O)(=O)NNC(=O)c1ccccc1OCCOc1ccccc1 2657259 XFJHYHLLPDIAJH-UHFFFAOYSA-N 442.493 2.776 50 40 IFGB CCN(CC(=O)NNC(=O)COc1ccc(Br)cc1)Cc1cccc(F)c1 8922519 PLKFOYPPMBWRFD-UHFFFAOYSA-N 438.297 2.637 50 40 IFGB COc1ccc(CC(=O)N/N=C2\C(=O)N(C)c3ccc(Br)cc32)cc1OC 9289521 UUHJIWYSTOIBAO-PYCFMQQDSA-N 432.274 2.506 50 40 IFGB CN(CC(=O)N/N=C/c1c(O)ccc2ccccc12)S(=O)(=O)c1ccc(Cl)cc1 16186760 ZZJHXSWTNGHXPF-WSDLNYQXSA-N 431.901 2.970 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2cc(Cl)cc(Cl)c2)c1 409154504 KEFJEAKUGOQDFL-BHGWPJFGSA-N 449.294 2.763 50 40 IFGB O=C(COc1ccc2c(c1)CCCC2)NCC(=O)N/N=C/c1ccc(Br)o1 2121886 XOHXYENTBARVOL-LSHDLFTRSA-N 434.290 2.566 50 40 IFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)ccc1OCC(=O)NCc1ccccc1 9010459 BSEFVDUAPKSFJG-JOCHJYFZSA-N 445.479 2.640 50 40 IFGB CCN(CC)CN1C(=O)/C(=N\NC(=O)c2ccccn2)c2cc(Br)ccc21 13748860 YKJOZPLJPMCMHX-XLNRJJMWSA-N 430.306 2.624 50 40 IFGB Cc1cccc2c(=O)n(CCC(=O)NNC(=O)[C@H](C)Oc3ccc4ccccc4c3)cnc12 22080441 OAXPCJZDZHCSDP-KRWDZBQOSA-N 444.491 2.863 50 40 IFGB COc1cccc(NC(=O)C(=O)N/N=C\c2cc(C)n(-c3ccc(C(=O)O)cc3)c2C)c1 223155741 QBIAQLDHSQQLHU-CFRMEGHHSA-N 434.452 2.890 50 40 IFGB COc1cccc([C@H]2C(C#N)=C(N)N(N3CCOCC3)C3=C2C(=O)CC(C)(C)C3)c1OC 691453 VDKJMCOBLUPFFS-FQEVSTJZSA-N 438.528 2.687 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@@H]3[C@@H]4C[C@@H]([C@@H](Br)[C@H]4Br)[C@@H]3C2=O)c1 2079015 AQAXYDDYNVXYEF-DIQHKMFBSA-N 443.091 2.667 50 40 IFGB O=C(/C=C/c1ccc(F)cc1)NC(=S)NNC(=O)CCC(=O)Nc1ccccc1Cl 2551652 VHDJCFGNWPQDKJ-JXMROGBWSA-N 448.907 2.933 50 40 IFGB CCOc1cc(/C=N/NC(=O)CN(c2cccc3ccccc23)S(C)(=O)=O)ccc1O 19955115 HEAHNBJBMRINPD-OEAKJJBVSA-N 441.509 2.860 50 40 IFGB O=C(NNC(=O)c1c[nH]c2ccccc12)c1cn(-c2cccc(Br)c2)nn1 48344223 IPHPQCOTZQVFHB-UHFFFAOYSA-N 425.246 2.586 50 40 IFGB CC/C(=N\NC(=O)CN(c1ccc(CC)cc1)S(C)(=O)=O)c1ccc(OC)c(OC)c1 409027135 AOJYYRXFQTUGPI-FCDQGJHFSA-N 447.557 2.963 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2c(C)cc(C)cc2C)cc1 409270301 PAUDIGXPQVYQOD-PYGAFPFSSA-N 438.528 2.994 50 40 IFGB COc1ccc(Br)cc1S(=O)(=O)NNC(=O)c1cn(C)c2ccccc12 12592476 VSLUHYOQBMNYJP-UHFFFAOYSA-N 438.303 2.573 50 40 IFGB O=C(NNc1nc(=Nc2ccccc2)nc(N2CCOCC2)[nH]1)Nc1cccc(Cl)c1 408724384 DVLGVXJUOXZERJ-UHFFFAOYSA-N 440.895 2.676 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccc(F)c(Cl)c1 409157940 QRWAKGRMOIEPKG-BRJLIKDPSA-N 448.882 2.863 50 40 IFGB COC(=O)c1ccc([C@@H]2CC(=O)NC(SCC(=O)N3CCCC[C@@H]3C)=C2C#N)cc1 409328182 ZVOKAQIDUWZPNS-YOEHRIQHSA-N 427.526 2.946 50 40 IFGB O=C(CCCC(=O)OCCCc1ccccc1)NC(=S)NNC(=O)c1ccccc1 12137513 GAWAEEMDEPJMIY-UHFFFAOYSA-N 427.526 2.668 50 40 IFGB CCn1c(SCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1ccccc1C 13009385 IFTKRRWZWYMXJQ-UHFFFAOYSA-N 440.485 2.735 50 40 IFGB CCN(CC)C(=O)CSC1=C(C#N)[C@@H](c2ccccc2Cl)[C@H](C(=O)OC)C(=O)N1 13027157 LWVFGLUSDBYASD-SJORKVTESA-N 435.933 2.679 50 40 IFGB COc1ccc(N2C(=O)[C@H]3[C@@H]4C[C@H]([C@@H](Br)[C@H]4Br)[C@@H]3C2=O)cc1 100537416 KHYQVLDAIPZWMH-LQSBQDLSSA-N 429.108 2.978 50 40 IFGB CS(=O)(=O)N(CCc1ccccc1)CC(=O)N/N=C\c1cccc(Cl)c1Cl 108106350 NXTBPQQVLPMGGX-MTJSOVHGSA-N 428.341 2.948 50 40 IFGB COc1cc(C(=O)Nc2cccc(C(=O)NNC(=O)c3ccco3)c2)cc(OC)c1OC 10040864 KFCBTUDHPCVQOZ-UHFFFAOYSA-N 439.424 2.633 50 40 IFGB Cc1cccc[n+]1[C@@H]1[C@@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C(C(C#N)C#N)N[C@]1(O)C1CC1 33778145 UUHQFLQUMHGTRC-QTJGBDASSA-N 441.471 2.658 50 40 IFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)CNc1ccc(Br)cc1 409355576 DJVXLSMZDRPJII-AWQFTUOYSA-N 437.250 2.937 50 40 IFGB CCOc1cc(/C=N/NC(=O)c2ccccc2O)cc(I)c1O 993601 KGAOBFNHXDLJHY-GIJQJNRQSA-N 426.210 2.865 50 40 IFGB N#C/C(=C\c1c(Oc2ccc(Cl)cc2)nc2ccccn2c1=O)C(=O)N1CCOCC1 2424854 JUEWFGYKRZTIPD-FYWRMAATSA-N 436.855 2.906 50 40 IFGB Cc1cc(Br)cc(Br)c1OCC(=O)NNC(=O)C(F)(F)F 12040059 FQAFOGBGKFYEEU-UHFFFAOYSA-N 434.006 2.609 50 40 IFGB COc1cc(C(=O)NNS(=O)(=O)c2cccc(Br)c2)ccc1OC(C)C 12760746 SSJWKXKJRANGAS-UHFFFAOYSA-N 443.319 2.868 50 40 IFGB C/C(=N\NC(=O)c1ccco1)c1cc2c(cc1NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O)OCO2 20159401 MJYYRKOJVJQPCY-FDMDUGQKSA-N 439.424 2.768 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)CCSc2ccccc2)cc1)NC[C@H]1CCCO1 28214871 DFBGEVKMDWZUHE-PXMCARDJSA-N 441.553 2.993 50 40 IFGB COc1cc(/C=N\NC(=O)[C@@H](C)n2cnc3sc4c(c3c2=O)CCCC4)ccc1O 31858975 JHFBEXQXOQWOJB-MOQVIFSHSA-N 426.498 2.762 50 40 IFGB O=C1N=c2ccc(Cl)cc2=C1NNC(=O)c1cc(-c2cccs2)nc2ccccc12 100485034 KAFBGGUYNPLBLS-UHFFFAOYSA-N 432.892 2.819 50 40 IFGB O=C(N/N=C/c1cc(Br)c(O)c(I)c1)c1cccnc1 408738415 XEEUOFCMSMGYIJ-UBKPWBPPSA-N 446.042 2.918 50 40 IFGB COC(=O)[C@@H]1C(=O)NC(SCC(=O)Nc2ccccc2F)=C(C#N)[C@H]1c1ccccc1 409129959 SVKNPLMRFXRZNE-MOPGFXCFSA-N 439.468 2.935 50 40 IFGB CC(C)CNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccc(Cl)cc1 409163663 VWDVGZJKYUJWGF-WYMPLXKRSA-N 430.892 2.580 50 40 IFGB COc1cccc(/C=N\NC(=O)CCSCCC(=O)N/N=C\c2cccc(OC)c2)c1 31637226 HIENSDKBAVLDSG-MPKYGIEOSA-N 442.541 2.818 50 40 IFGB COc1cc(Br)cc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)c1O 57609305 FKBNNHLPVLQYPA-CNHKJKLMSA-N 425.308 2.813 50 40 IFGB CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(CCN(C)C)c(=O)c32)cc1OCC 2246445 JEKGBAYDTURXDT-OAQYLSRUSA-N 438.528 2.734 50 40 IFGB C/C(=N\NC(=O)C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O)c1ccc(Cl)s1 9209770 OSAIKYMMDQRTOU-SSDVNMTOSA-N 431.905 2.678 50 40 IFGB COc1ccc(C(=O)NC2=N/C(=C(/C#N)C(=O)N3C[C@H](C)O[C@@H](C)C3)c3ccccc32)cc1 9347859 XZKSTTHJHIHPGM-QRULDUIQSA-N 444.491 2.756 50 40 IFGB CN(CC(=O)NNC(=O)Cc1ccc2ccccc2c1)S(=O)(=O)c1ccc(Cl)cc1 14244763 FRXSHVBQLOGGAN-UHFFFAOYSA-N 445.928 2.504 50 40 IFGB O=C(COc1ccc(Cl)cc1)NNC(=O)CSc1nnc(COc2ccccc2)o1 408637470 KXJVFOZYUVBNMC-UHFFFAOYSA-N 448.888 2.621 50 40 IFGB Cc1c(Cl)cccc1NC(=O)COC(=O)[C@H]1[C@H]2C(=O)O[C@@H]3[C@@H](Br)[C@@H]1C[C@@H]32 408688143 VVBSDHXAHGJLEU-ANRWCUABSA-N 442.693 2.701 50 40 IFGB O=C(NNC(=O)c1ccc(C(=O)NNC(=O)Nc2ccccc2)cc1)Nc1ccccc1 671830 RXELVCJTBHGNQF-UHFFFAOYSA-N 432.440 2.620 50 40 IFGB CCOc1cc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(C#N)cc2)cc(OCC)c1OCC 12993352 PLZRKPXNAKRVKF-OAHLLOKOSA-N 441.484 2.983 50 40 IFGB CCN(CC)C(=O)CSC1=C(C#N)[C@H](c2ccccc2Cl)[C@@H](C(=O)OC)C(=O)N1 13027155 LWVFGLUSDBYASD-DLBZAZTESA-N 435.933 2.679 50 40 IFGB O=C(CN(CCc1ccccc1)S(=O)(=O)c1ccccc1)N/N=C/c1ccccc1O 16479049 MACJFKNZAAJGDJ-JJIBRWJFSA-N 437.521 2.776 50 40 IFGB O=C1N(CN2CCN(c3ccccc3F)CC2)c2ccccc2[C@]12OC[C@@H](CCl)O2 19907378 LTGBZDKDHHJQAE-OPAMFIHVSA-N 431.895 2.759 50 40 IFGB N#C/C(=C\c1cn(-c2ccccc2)nc1-c1cccs1)C(=O)N[C@H]1CCS(=O)(=O)C1 26966596 XBTASFPNSPMNFB-JMPLCFMRSA-N 438.534 2.811 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)CN(c2cc(Cl)ccc2C)S(C)(=O)=O)c1 408780496 CLJJOKMMRPPDRY-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB O=C(NNC(=O)c1cc2cc(Br)ccc2oc1=O)c1ccc([N+](=O)[O-])cc1 1506889 KZPVROPRDALRMM-UHFFFAOYSA-N 432.186 2.539 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@H]3C[C@@H](Br)[C@H](Br)C[C@@H]3C2=O)cc1 4157288 PESPVOFYLHXLOG-NNYUYHANSA-N 431.080 2.811 50 40 IFGB Cc1cccn2c(=O)c(/C=C(\C#N)C(=O)NC3CCCCC3)c(N3C[C@H](C)O[C@@H](C)C3)nc12 9346346 SZKLWQXPRSKBHX-NNWVJLEKSA-N 449.555 2.972 50 40 IFGB COc1ccc(/C=N/NC(=O)CSc2nnc(-c3cccc([N+](=O)[O-])c3)n2C)cc1 9353747 ZALCSZJNBSNLKC-RGVLZGJSSA-N 426.458 2.641 50 40 IFGB CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OC(C)C)cc2)c1 12868872 NJEPHSQPBADJSK-UHFFFAOYSA-N 433.530 2.579 50 40 IFGB COc1cc(C(=O)N/N=C/c2ccc(O)c([N+](=O)[O-])c2)ccc1I 36076739 FSCCQYRVIRRRQL-CAOOACKPSA-N 441.181 2.678 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@H]3C[C@@H](Br)[C@H](Br)C[C@H]3C2=O)c1 101052809 IBSRDFPISRPXAX-WRWGMCAJSA-N 431.080 2.811 50 40 IFGB O=C(COc1cccc(/C=N/NC(=O)C(=O)NC2CC2)c1)Nc1ccc(Cl)cc1Cl 409272802 SKWNOPQUZCGGQP-AUEPDCJTSA-N 449.294 2.740 50 40 IFGB COc1cc(C(=O)NNC(=O)c2ccc(NC(=O)C(C)(C)C)cc2)cc(OC)c1OC 825381 UDYLJUNFLNZPAD-UHFFFAOYSA-N 429.473 2.772 50 40 IFGB O=C(CNS(=O)(=O)c1ccc(Cl)cc1)N/N=C/c1[nH]c2ccccc2c1Cl 2750416 FVNZIYCRADKERE-AWQFTUOYSA-N 425.297 2.903 50 40 IFGB CSc1ccc(N2C[C@H](C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)CC2=O)cc1 12858088 ZWHSVBSBCFMNFC-UONOGXRCSA-N 431.489 2.515 50 40 IFGB CN(CC(=O)N/N=C/c1cccc(Br)c1)S(=O)(=O)c1ccc(Cl)cc1 16187031 CKXOZDXFQITNLI-VXLYETTFSA-N 444.738 2.873 50 40 IFGB CCOc1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)ccc1OCCN1CCOCC1 19852986 NBLDUFBWOKWINZ-JOCHJYFZSA-N 439.512 2.611 50 40 IFGB O=C(CCC(=O)OCC(=O)Nc1ccc(Cl)c(Cl)c1)NNC(=O)c1ccccc1 408644198 FCTGCMCQIAZHJB-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 408756339 ZBDXFDRCYWDEJQ-YPKZHZFPSA-N 431.514 2.567 50 40 IFGB O=C(CSc1ncc(C(F)(F)F)cc1Cl)NNC(=O)[C@H]1COc2ccccc2O1 9160136 OOIDRCQJGLNLNJ-CYBMUJFWSA-N 447.822 2.833 50 40 IFGB Cc1cccc(N2C[C@H](C(=O)NNC(=O)c3ccc(Br)cc3)CC2=O)c1C 17330570 YBRULMROWAOOFL-OAHLLOKOSA-N 430.302 2.880 50 40 IFGB COCc1c(Br)c(C)nc(OCC(=O)N/N=C/c2ccc(F)cc2)c1C#N 27519386 TXDWSUQYDOIADZ-GZIVZEMBSA-N 435.253 2.839 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 20207305 AGRFNAIUZQKIKN-FYJGNVAPSA-N 442.453 2.771 50 40 IFGB Cc1ccc(N2C(=O)[C@@H](/C=N/NC(=O)c3cc4ccccc4o3)C(=O)NC2=S)cc1C 103880212 RJCISKLRALUXQY-IMQYADFFSA-N 434.477 2.829 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2ccc(C)c(Cl)c2)S(C)(=O)=O)cc1OC 408782210 GAEVDGIMERHKAS-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc([N+](=O)[O-])c1)c1cc(Cl)ccc1Cl 409028917 TWFHFIHKJKSRHT-DJKKODMXSA-N 445.284 2.818 50 40 IFGB O=C(COc1ccccc1Cl)NNC(=O)COc1ccc(F)cc1Br 12854885 LZOQJFOQAPBLID-UHFFFAOYSA-N 431.645 2.847 50 40 IFGB C[C@H]1CCc2[nH]c3ccc(C(=O)NNC(=O)c4nn(C)c(=O)c5ccccc45)cc3c2C1 17191108 JLPJBZGVISILJN-ZDUSSCGKSA-N 429.480 2.614 50 40 IFGB C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(OCC(=O)NC[C@@H]2CCCO2)cc1 28214117 JZVJKAAQCOKHQV-CEMARSOISA-N 441.553 2.992 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@H]3[C@@H]4C[C@H]([C@@H](Br)[C@H]4Br)[C@@H]3C2=O)cc1 100159265 KXHQMAGGCJSUCQ-RHIYVLOFSA-N 443.091 2.667 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)c1cc(Cl)cc(Cl)c1 408768025 RZYOUXAXJWCMBG-DJKKODMXSA-N 445.284 2.818 50 40 IFGB CCOc1cc(/C=C(\C#N)C(=O)NCc2ccc(OC)cc2OC)ccc1OCC(=O)O 408880405 IUCQDIDYDDATEY-RQZCQDPDSA-N 440.452 2.789 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1cccc(Cl)c1Cl 409172904 GLSKMFRXRXYOQX-BHGWPJFGSA-N 449.294 2.763 50 40 IFGB COc1cc(/C=N/NC(=O)CNC(=O)c2ccccc2)ccc1OC(=O)c1ccccc1 2675743 UUJHEULOUVNAQQ-CVKSISIWSA-N 431.448 2.795 50 40 IFGB O=C1OC(=O)[C@@H]2[C@H]3C[C@@H]([C@@H]4Sc5[nH]c(=O)sc5[C@H](c5cc(Cl)ccc5O)[C@@H]43)[C@H]12 245241970 VFAWHSQATVLVIT-LINFNCPDSA-N 435.910 2.983 50 40 IFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccc(Br)cc1 408615169 MUNRVWIDAJIQFP-LBPRGKRZSA-N 436.693 2.917 50 40 IFGB N#C/C(=C\c1ccc(OCC(N)=O)cc1)C(=O)Nc1cccc(I)c1 408756080 XJNSUQQETFKIJJ-MDWZMJQESA-N 447.232 2.701 50 40 IFGB N#C/C(=C/c1ccc(CNC(=O)C(=O)Nc2ccccc2)o1)C(=O)NCc1ccccc1 408823872 GQWSKTZIVQBRFZ-AQTBWJFISA-N 428.448 2.758 50 40 IFGB CN(C)c1ccc(/C=N/NC(=O)CN(c2ccc(Cl)c(Cl)c2)S(C)(=O)=O)cc1 408926974 XBOMOSZXHIBQDE-SRZZPIQSSA-N 443.356 2.976 50 40 IFGB COC(=O)[C@H]1C(=O)NC(SCC(=O)Nc2ccc(F)cc2)=C(C#N)[C@@H]1c1ccccc1 409138821 IMXVROGGPROMLA-RBUKOAKNSA-N 439.468 2.935 50 40 IFGB C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H](C)n1c(=O)oc2ccccc21 14372622 PKNQCEHLYYGQIP-NEPJUHHUSA-N 448.273 2.533 50 40 IFGB COc1cc(/C=N/NC(=O)COc2ccc(Br)cc2)c([N+](=O)[O-])cc1OC 14923187 ASYXPFRRKLXCKR-DJKKODMXSA-N 438.234 2.904 50 40 IFGB CCCCCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)cc1 23015420 RHPVVUIDMDMORL-UHFFFAOYSA-N 447.513 2.714 50 40 IFGB CS(=O)(=O)N(CCc1ccccc1)CC(=O)N/N=C\c1ccc(Cl)c(Cl)c1 107720417 CPXIPUBTNDLGOS-MTJSOVHGSA-N 428.341 2.948 50 40 IFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1cccc(I)c1 409220109 UHQLALRTAFKZFF-RQZCQDPDSA-N 425.182 2.972 50 40 IFGB CN1C(=O)/C(=N/NC(=O)/C(=C/c2ccccc2O)NC(=O)c2ccccc2)c2ccccc21 3145858 SIXNPKMMZPQSFQ-NTOOCRERSA-N 440.459 2.660 50 40 IFGB Cc1cccc(NC(=O)C(=O)N/N=C/c2ccc(OCC(=O)NCc3ccccc3)cc2)c1 9329201 MEKCJCFMTQHHNM-JVWAILMASA-N 444.491 2.779 50 40 IFGB CSc1ccc(N2C[C@@H](C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)CC2=O)cc1 12858082 ZWHSVBSBCFMNFC-KBPBESRZSA-N 431.489 2.515 50 40 IFGB COc1ccc(CNC(=O)C(=O)N/N=C/c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 58911843 NNLSFOVPYNUQAR-CVKSISIWSA-N 434.496 2.878 50 40 IFGB CC(C)C(=O)N/N=C/c1ccc(CNC(=O)C(=O)Nc2ccc(Cl)c(Cl)c2)o1 408778879 ZBBCNGJRMIUMQU-LSFURLLWSA-N 425.272 2.947 50 40 IFGB CCOC(=O)CN1C(=O)/C(=N\NC(=O)CNc2cccc3ccccc23)c2ccccc21 1307923 FZHCVDIFJAVFSD-VYIQYICTSA-N 430.464 2.682 50 40 IFGB COc1cc(/C=N/NC(=O)Cc2cn3ccsc3n2)ccc1OC(=O)c1cccnc1 8778491 YBGRFCHSSTVCQK-FOKLQQMPSA-N 435.465 2.711 50 40 IFGB O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNC(=O)c1cccs1 9885466 QFTVRXOMPUOMEZ-UHFFFAOYSA-N 433.486 2.692 50 40 IFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)/C(=C/c1ccccc1O)NC(=O)c1ccccc1 15133315 IWZCKFFEDYUQFU-VAQLEAJTSA-N 446.419 2.927 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@@H]3C[C@H](Br)[C@@H](Br)C[C@H]3C2=O)c1 102065982 IBSRDFPISRPXAX-WYUUTHIRSA-N 431.080 2.811 50 40 IFGB Cc1cc(C)cc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)N2CCOCC2)c1 2411931 WBURYEKCCCEVQN-NBVRZTHBSA-N 430.464 2.869 50 40 IFGB CCOc1ccc(C(=O)NNC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)cc1OC 10287642 OGIOZPKBFUAUFH-UHFFFAOYSA-N 438.459 2.982 50 40 IFGB C[C@@H](C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1)n1c(=O)oc2ccccc21 14372623 PKNQCEHLYYGQIP-NWDGAFQWSA-N 448.273 2.533 50 40 IFGB C=CCNc1nc2[nH]c(=O)c3c(c2s1)OC(N)=C(C#N)[C@@H]3c1ccc(C(=O)OC)cc1 15084419 CTLUZSYDCHVRMA-ZDUSSCGKSA-N 435.465 2.587 50 40 IFGB CCn1c(C)nc2cc(C(=O)NNC(=O)Cn3c(-c4cccs4)n[nH]c3=S)ccc21 16502809 OTKOMAJEUMGKGT-UHFFFAOYSA-N 441.542 2.808 50 40 IFGB Cc1ccc(SCC(=O)N/N=C/c2ccc(OCC(=O)NC[C@@H]3CCCO3)cc2)cc1 28215214 KIHGNYNFCAJDTL-HMHIXTCJSA-N 441.553 2.911 50 40 IFGB COc1cccc(/C=N/NC(=O)C(=O)NCCCOC(C)C)c1OCc1ccc(F)cc1 408614742 HCPNHIGKSJWWHC-VULFUBBASA-N 445.491 2.795 50 40 IFGB CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2cc3ccccc3cc2O)c1 32719989 PBCHVYUMCOHGGU-UHFFFAOYSA-N 447.900 2.524 50 40 IFGB Cc1cc([N+](=O)[O-])ccc1-c1ccc(/C=N/NC(=O)CNC(=O)COc2ccccc2)o1 409158600 XRVUTKGMVBEINO-WYMPLXKRSA-N 436.424 2.809 50 40 IFGB Cc1cccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NCc3ccco3)cc2)c1C 409254853 JBNSHRPJBANKPV-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB O=C(CCCCCCCC(=O)NNC(=O)c1cccs1)NNC(=O)c1cccs1 8397991 WVISVLZAKXJKDN-UHFFFAOYSA-N 436.559 2.763 50 40 IFGB Cc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2)cc1S(=O)(=O)N1CCCCC1 8766831 ZWMDCUSYLFYMQI-UHFFFAOYSA-N 435.933 2.898 50 40 IFGB Cn1nc(C(=O)NNC(=O)c2ccccc2CCc2ccccc2)c2ccccc2c1=O 12808319 XSZZSJKLRZQPHJ-UHFFFAOYSA-N 426.476 2.794 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1O)c1ccc(Cl)c(C(F)(F)F)c1 408786044 KIZOFNDEBBSWDN-LSFURLLWSA-N 449.838 2.981 50 40 IFGB Cc1ccc(C)c(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NCc3ccco3)cc2)c1 409268277 RVWPNCNHXBWTFS-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB CCOc1cc(/C=N/NC(=O)CNC(=O)c2cccc(F)c2)cc(Br)c1O 3115543 FPLHBTGBGQGGHJ-LSFURLLWSA-N 438.253 2.573 50 40 IFGB Cc1noc(C)c1COc1ccc(C(=O)OCC(=O)NNC(=O)c2ccccc2F)cc1 8882806 WLSYROJHCWWOKE-UHFFFAOYSA-N 441.415 2.628 50 40 IFGB C[C@H]1CN(c2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)NC2CCCCC2)C[C@@H](C)O1 13647995 CDQQFEOSHNQWJU-AOGWUINGSA-N 435.528 2.664 50 40 IFGB COc1ccccc1NC(=O)COc1ccc(/C=N/NC(=O)c2ccccn2)cc1OC 15945561 UGMJWLNYFDKFIE-AFUMVMLFSA-N 434.452 2.880 50 40 IFGB O=C(N/N=C/c1cc2cc3c(cc2[nH]c1=O)OCCO3)c1ccc(Br)cc1 17016669 FMGICUAXNUVDOZ-UFFVCSGVSA-N 428.242 2.826 50 40 IFGB CCOc1cc(/C=N/NC(=O)C(=O)NC[C@H]2CCCO2)ccc1OCc1ccc(F)cc1 408611057 PSFIFRPLUNQKSW-KXQYEYADSA-N 443.475 2.549 50 40 IFGB COc1cccc(/C=N/NC(=O)C2CCN(C(=O)c3ccc(OC)c(OC)c3)CC2)c1 409007761 ZKVSGGSIXAZDCW-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB COc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)cc(Br)c1OCC(=O)O 409237811 JTLXCUFOIUWQBS-NKVSQWTQSA-N 439.237 2.753 50 40 IFGB CCCOc1ccc(C(=O)N/N=C\c2ccc(OCC(N)=O)c(OCC)c2)cc1OC 409331997 FNDXIDOXTKEBCN-CFRMEGHHSA-N 429.473 2.511 50 40 IFGB CC(=O)Oc1ccc(-c2ccc(C(=O)NNC(=O)COc3ccc(C#N)cc3)cc2)cc1 9597187 DMVNHUCDQWAHHT-UHFFFAOYSA-N 429.432 2.991 50 40 IFGB C[C@@H]1CCCC[C@H]1NC(=S)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3 13058679 MAVOJNTUTDYYIY-RHSMWYFYSA-N 427.574 2.811 50 40 IFGB COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)cc1 13534821 ZOKKQGMKWYDJAJ-SSZFMOIBSA-N 435.465 2.832 50 40 IFGB O=C(CN1C(=O)/C(=N/NC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21)Nc1ccccc1 13550274 YUBDHPFMAZVLFU-NJNXFGOHSA-N 443.419 2.714 50 40 IFGB CCNC(=S)NNC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(OC)cc1 16681751 BPMHKTVGCNFNFP-UHFFFAOYSA-N 442.570 2.550 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)[C@H]2COc3ccccc3O2)cc1)NC1CCCCC1 28214971 RWPFXMUTEYHQEP-FDCKDHBTSA-N 437.496 2.804 50 40 IFGB CCCOc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(OC)cc2)cc1OCC 32957536 YQEQXOZMGQZNBR-UHFFFAOYSA-N 430.457 2.501 50 40 IFGB COc1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc(Cl)c1OCC(N)=O 36612788 VYZWUBUDMKFUBC-KRWDZBQOSA-N 431.876 2.664 50 40 IFGB COc1ccc(N(CC(=O)N/N=C(\C)CCc2ccccc2)S(C)(=O)=O)c(OC)c1 408771179 FVTKXTDJHUTOPB-CJLVFECKSA-N 433.530 2.595 50 40 IFGB O=C(CN(c1ccccc1F)S(=O)(=O)c1ccccc1)N/N=C/c1ccccc1O 408773682 ISFHLUVZDMGRFX-OEAKJJBVSA-N 427.457 2.877 50 40 IFGB Cc1c(C(=O)N/N=C/c2ccc(I)o2)sc2ncnc(N)c12 408973305 LICDDIMDCPWNAG-JJPRUIFNSA-N 427.227 2.543 50 40 IFGB CC1(C)CC(=O)C2=C(C1)NC(SCC(=O)N1CCOCC1)=C(C#N)[C@H]2c1ccco1 9360009 FKPRHNOPAKDXFY-IBGZPJMESA-N 427.526 2.937 50 40 IFGB CCOc1cc(/C=N/NC(=O)C(=O)NC[C@@H]2CCCO2)ccc1OCc1ccc(F)cc1 408611055 PSFIFRPLUNQKSW-JMJNUIHMSA-N 443.475 2.549 50 40 IFGB COc1ccc(C)cc1S(=O)(=O)N(C)CC(=O)N/N=C\c1c(F)cccc1Cl 16291155 JNCGUZHGLYDCLA-FBHDLOMBSA-N 427.885 2.567 50 40 IFGB CC(=O)NC12C[C@H]3C[C@H](C1)CC(C(=O)NNC(=O)CCSc1ccc(F)cc1)(C3)C2 105855693 NMBIOKDMDPTIGA-TUKZGULFSA-N 433.549 2.930 50 40 IFGB CCOc1cc(/C=N/NC(=O)C(=O)NCc2ccc(C)cc2)cc(Br)c1O 409253140 DVJLLCVFNLOLAI-SSDVNMTOSA-N 434.290 2.628 50 40 IFGB COc1cc([C@H]2[C@@H](Cl)C(=O)N2NC(=O)c2ccc(NC(C)=O)cc2)cc(OC)c1OC 1633122 HIXFLJPXFRBGRX-MSOLQXFVSA-N 447.875 2.507 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)N2CCCCC2)cc1)Nc1ccccc1Cl 9057032 BTTILUKKVUPBHS-ZVHZXABRSA-N 442.903 2.820 50 40 IFGB CCN(CC)S(=O)(=O)c1ccc(C(=O)NNc2nc3cc4c(cc3s2)OCO4)cc1 9381945 PBNMNUOEJFPCOK-UHFFFAOYSA-N 448.526 2.812 50 40 IFGB O=C(Cn1c(COc2ccccc2)nc2ccccc21)NNC(=O)c1ccc2c(c1)OCO2 11776428 IWYKLMNMGYTUMO-UHFFFAOYSA-N 444.447 2.805 50 40 IFGB CC(=O)N1C(=O)/C(=N\NC(=O)COc2ccccc2)c2cc(C)c(Br)cc21 12446960 HACKUNKLJCSVDZ-PYCFMQQDSA-N 430.258 2.550 50 40 IFGB C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccccc3F)cc2)C1 16044598 NGMCWSUEWWGMGM-GASCZTMLSA-N 433.505 2.567 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)[C@H](C)N(c2ccc(OCC)cc2)S(C)(=O)=O)cc1 408925183 NJZFYUZSEGEVMR-CSUZIONRSA-N 445.541 2.955 50 40 IFGB COc1cc(OC)c(/C=N/NC(=O)c2nn(C)cc2Br)cc1Br 1089162 FNPQCGWFVBTMQP-UBKPWBPPSA-N 446.099 2.726 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@H]3C[C@H](Br)[C@H](Br)C[C@@H]3C2=O)cc1 4157285 PESPVOFYLHXLOG-FIQHERPVSA-N 431.080 2.811 50 40 IFGB O=C(CCCNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)c1ccc(F)cc1 9514280 UMDOCYSVIBYZGK-UHFFFAOYSA-N 448.303 2.652 50 40 IFGB N#C/C(=C\c1ccc(-c2ccc(Br)cc2)o1)C(=O)N[C@@H]1CCS(=O)(=O)C1 26966872 XGOKYFQNZQLHLX-BMQCOBNYSA-N 435.299 2.919 50 40 IFGB Cc1cc(Cl)ccc1NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)NC(C)C)cc1 58881329 SBZZNXSSBMMPOF-FOKLQQMPSA-N 430.892 2.641 50 40 IFGB COc1ccc(OC)c(N(CC(=O)N/N=C(\C)CCc2ccccc2)S(C)(=O)=O)c1 408780773 KBWGAMMKCBSPNM-CJLVFECKSA-N 433.530 2.595 50 40 IFGB O=C(CNC(=O)c1ccc(F)cc1)N/N=C1\C(=O)N(CCc2ccccc2)c2ccccc21 1246917 IDBYTGMATOOBAM-FAJYDZGRSA-N 444.466 2.665 50 40 IFGB CC(C)(C)NS(=O)(=O)c1cccc(C(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1 14248999 WVSXKTYCRHTNND-UHFFFAOYSA-N 433.574 2.741 50 40 IFGB COc1cc(/C=N/NC(=O)CN2C[C@H](c3ccccc3)CC2=O)c(Br)cc1O 16194802 IWXFHTZEANIVOZ-WPZNHYQYSA-N 446.301 2.630 50 40 IFGB COc1ccc(C(=O)N/N=C/c2cc(I)c(O)c(OC)c2)cc1 59433259 SRSLZAXBFYJRQH-GIJQJNRQSA-N 426.210 2.778 50 40 IFGB Cc1nn(C)cc1/C=N/NC(=O)CSc1nnc(-c2cccc(Br)c2)n1C 2314446 DSUZDLNAVJUUPK-UFWORHAWSA-N 448.350 2.529 50 40 IFGB CCN(CC)c1ccc(C(=O)NNS(=O)(=O)c2ccccc2Br)cc1 12557776 OCYWOTDAYXENLU-UHFFFAOYSA-N 426.336 2.919 50 40 IFGB COc1ccc(NC(=O)[C@H](NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc2)cc1 32853668 TZGPPUNDTZCKQK-FCHUYYIVSA-N 433.464 2.836 50 40 IFGB COc1cccc(/C=N/NC(=O)C(=O)NC[C@@H]2CCCO2)c1OCc1ccccc1Cl 408610304 NJZDCGNULYXJAX-BIXBROTJSA-N 445.903 2.673 50 40 IFGB CCN(CC)c1ccc(/C=C(\C#N)C(N)=O)c(OCC(=O)Nc2cccc([N+](=O)[O-])c2)c1 409063103 GYSJCJSOUFOZOX-MHWRWJLKSA-N 437.456 2.851 50 40 IFGB COC(=O)[C@@H]1C(=O)NC(SCC(=O)Nc2ccc(F)cc2)=C(C#N)[C@H]1c1ccccc1 409138819 IMXVROGGPROMLA-MOPGFXCFSA-N 439.468 2.935 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)c1 409152677 FZQGKCJSKGZEAE-BHGWPJFGSA-N 449.294 2.763 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccccc2Cl)c1 409166462 DPMROFUWURJGBJ-ZMOGYAJESA-N 430.892 2.724 50 40 IFGB Cc1ccc(C(=O)NNC(=O)c2cccc(Cl)c2)cc1S(=O)(=O)N1CCCCC1 2629691 MMGIXRMAEQNPEH-UHFFFAOYSA-N 435.933 2.898 50 40 IFGB O=C(CSc1nnc2c3c4c(sc3ncn12)CCCC4)NNC(=O)c1ccccc1 12490993 RQHUWPCYZPDAQM-UHFFFAOYSA-N 438.538 2.771 50 40 IFGB CC[C@@H](Oc1cc(Cl)ccc1Cl)C(=O)NNC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 102201768 APTZUNALKUCBEW-LWAVZIJFSA-N 427.284 2.821 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc(Br)cc1)c1ccccc1F 408786868 WUIVLSOVCQERAI-VXLYETTFSA-N 428.283 2.505 50 40 IFGB COc1cc(/C=N/NC(=O)CSc2ccc([N+](=O)[O-])cc2)ccc1O[C@H](C)C(=O)O 409015787 BFKFISFEJAPRJS-HMASQMOLSA-N 433.442 2.698 50 40 IFGB Cc1ccc(/C=C2/SC(=S)N(CCC(=O)NNC(=O)c3cccc(O)c3)C2=O)cc1 2307260 NDPMWPJAICPUTG-GZTJUZNOSA-N 441.534 2.753 50 40 IFGB Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CCCN(c3ccc(Cl)nn3)C2)c1C 32913624 CVEQOGVFJABJOQ-HZPDHXFCSA-N 431.924 2.578 50 40 IFGB Cc1ccccc1NC(=O)CCCC(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1 408654929 CAJXOXMNPFSPKZ-UHFFFAOYSA-N 431.876 2.762 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2)c(Cl)c1 409257046 REVXLDMPQJQYOB-CHOFVFFHSA-N 430.892 2.722 50 40 IFGB Nc1nonc1-n1nnc(C(=O)N/N=C/c2ccccc2C(F)(F)F)c1-c1cccs1 2446075 LVBVXQGNWUZDLS-GZIVZEMBSA-N 448.390 2.744 50 40 IFGB Cc1cc(Br)ccc1SCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 2662817 YGJNPLRTLVKHKS-HNNXBMFYSA-N 437.315 2.837 50 40 IFGB COC(=O)COc1c(Br)cc(/C=N/NC(=O)c2ccc(F)cc2)cc1OC 8812375 OUFWCZAYUGEEAQ-ZVBGSRNCSA-N 439.237 2.913 50 40 IFGB Cc1ccc(-c2csc3ncn(CCC(=O)NNC(=S)NC(C)C)c(=O)c23)cc1 16232711 KRVIAGNEVAKEGC-UHFFFAOYSA-N 429.571 2.727 50 40 IFGB COc1ccc(C)cc1S(=O)(=O)N(C)CC(=O)N/N=C\c1ccccc1C(F)(F)F 16291247 LWQRDGVAKLBINU-KSEXSDGBSA-N 443.447 2.793 50 40 IFGB CC1=NN(c2ccccc2)C(=O)[C@H]1/C=N/NC(=O)COc1ccc(Br)cc1 408741258 OXDGTMUTMXHQPF-RYFGYPJOSA-N 429.274 2.969 50 40 IFGB Cc1ccc(CN(c2ccc(C(=O)NN=C3CCN(C)CC3)cc2)S(C)(=O)=O)cc1 409028701 QNTVOZVAPGAQPF-UHFFFAOYSA-N 428.558 2.773 50 40 IFGB CCN(CC)c1ccc(C(=O)NNC(=O)[C@H](NC(=O)c2ccccc2F)C(C)C)cc1 12527813 LQPLKZFIXUBFMX-HXUWFJFHSA-N 428.508 2.888 50 40 IFGB CCOc1ccc(C(=O)NNC(=O)c2ccc(CN3C(=O)c4ccccc4C3=O)cc2)cc1 12733891 RPUVBGRHAHUURF-UHFFFAOYSA-N 443.459 2.956 50 40 IFGB Cc1c(CBr)[n+]([O-])c2c([n+]1[O-])[C@H](Br)CC[C@H]2Br 17595993 SJFFCHWYKKXQSL-RNFRBKRXSA-N 430.922 2.823 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2cc(Br)c(C)o2)S(C)(=O)=O)cc1C 20208759 JHSTZCDBGRULGL-DJKKODMXSA-N 442.335 2.884 50 40 IFGB COc1cc(C(=O)NN/C(C)=C2\C(=O)N(c3ccc(F)cc3)N=C2C)cc(OC)c1OC 103916713 UFTBZXQCXMFSTK-UNOMPAQXSA-N 442.447 2.783 50 40 IFGB O=C(CCC(=O)OCC(=O)Nc1ccc(Cl)cc1)NNC(=O)c1ccccc1Cl 408644548 GNOIKXVXCRPMPA-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB Cc1cccc(NC(=O)COc2cccc(/C=N/NC(=O)C(=O)NCc3ccco3)c2)c1C 409270901 IOCIOGUXQVWGBS-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB C[C@@]1(C(=O)NNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1(Br)Br 2344801 LDFOZGFCHUHKHU-LVDDQXARSA-N 447.083 2.652 50 40 IFGB Cc1cc(OCC(=O)NNC(=O)COc2ccc3c(C)cc(=O)oc3c2)ccc1Cl 3329828 GFWBRLNPRWWZGM-UHFFFAOYSA-N 430.844 2.668 50 40 IFGB Cc1cccc2c1NC(=O)/C2=N\NC(=O)Cn1cnc2scc(-c3ccccc3)c2c1=O 6166653 SUGAYJNMUNNRKN-UHFFFAOYSA-N 443.488 2.906 50 40 IFGB C/C(=N/NC(=O)CCSCCC(=O)N/N=C(/C)c1ccccc1O)c1ccccc1O 17313911 LRJLDNHNOVGVHH-MPKYGIEOSA-N 442.541 2.992 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2F)cc1)NCc1ccccc1 58880952 QVKRENIFBLZWPA-JFLMPSFJSA-N 448.454 2.610 50 40 IFGB CCOC(=O)C1=C(C(=O)OCC)[C@@H]2C=C[C@H]1[C@H]1[C@H](Br)[C@H](Br)[C@H]21 104279256 BMXZYPYGMGQTHX-WTLQHEMPSA-N 434.124 2.998 50 40 IFGB CC[C@H](Oc1cc(Cl)ccc1Cl)C(=O)NNC(=O)[C@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O 225642050 APTZUNALKUCBEW-CBULSKDDSA-N 427.284 2.821 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2cccnc2)S(=O)(=O)c2ccc(C)cc2)cc1 408845808 ZMKXVULRVPXWBH-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB COc1ccc(C(=O)NNC(=O)c2oc3ccccc3c2C)cc1S(=O)(=O)NC(C)C 12906554 ITDZDOMQZWOECD-UHFFFAOYSA-N 445.497 2.511 50 40 IFGB C[C@@H](SCc1ccccc1)C(=O)N/N=C/c1ccc(OCC(=O)N2CCOCC2)cc1 408719331 BVVASQBALXKCRN-LSPPGFKNSA-N 441.553 2.696 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)CN(c2cc(C)ccc2C)S(C)(=O)=O)cc1OC 408776238 VSMNDGJKBPQWQE-CJLVFECKSA-N 433.530 2.627 50 40 IFGB COc1ccccc1N(CC(=O)N/N=C/c1ccco1)S(=O)(=O)c1ccc(C)cc1 408910817 LKCVDVLEIUBQFR-HYARGMPZSA-N 427.482 2.942 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1OCC 409129591 UORQIEOEAIRYHY-PXLXIMEGSA-N 431.514 2.810 50 40 IFGB O=C(COc1cccc(C(F)(F)F)c1)NNC(=O)c1ccc2c(c1)NC(=O)CS2 3454471 ADPKTKCTPBMJNZ-UHFFFAOYSA-N 425.388 2.590 50 40 IFGB CC(C)Oc1ccc(C(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1 14238643 OTIOLWJDCNJUDK-QGZVFWFLSA-N 449.507 2.972 50 40 IFGB COC(=O)CC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(\C)NNC(=O)c1ccccc1 14257305 DIDHHVINOBGYJZ-CPNJWEJPSA-N 449.492 2.771 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2cc(Br)c(C)o2)S(C)(=O)=O)cc1 58926458 YRHYCJXJXPKZJB-GIJQJNRQSA-N 428.308 2.575 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(C)S(=O)(=O)c2cc(Cl)ccc2Cl)c1 16187054 PUOBRMXCIZHTJZ-KEBDBYFISA-N 430.313 2.773 50 40 IFGB CC[C@H](NC(=O)c1ccccc1NC(=O)c1ccccc1)C(=O)NNC(=O)c1ccccc1 3144129 XJKGLNCXCFSVAP-FQEVSTJZSA-N 444.491 2.909 50 40 IFGB CCCCn1nc(C(=O)NNC(=O)c2cc(Cl)ccc2OC)c2ccccc2c1=O 3397200 XFALQHIWFRMTFA-UHFFFAOYSA-N 428.876 2.933 50 40 IFGB N#CCOc1ccc(/C=N/NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)cc1 8451701 JWSGFEDNZLBREN-WQZUMXOESA-N 446.916 2.546 50 40 IFGB COc1cc(C(=O)NNC(=O)[C@@H]2CCCN(C(=O)c3cccs3)C2)ccc1OC(C)C 32755503 CMBKYHVCORYJEB-MRXNPFEDSA-N 445.541 2.857 50 40 IFGB COC(=S)O[C@@H]1C[C@H](n2cnc3c(=O)nc[nH]c32)O[C@H]1CO[Si](C)(C)C(C)(C)C 195759593 AKHWATRAUQBPHS-FRRDWIJNSA-N 440.598 2.745 50 40 IFGB Cc1ccc(NC(=O)COC(=O)CCC(=O)NNC(=O)c2ccc(Cl)cc2)c(C)c1 408663275 MZAAJPLGRKINLL-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB COc1ccc(C=NNC(=O)c2sc(N)c(C#N)c2C)cc1I 408729467 FMWGBQHGYCPXHA-UHFFFAOYSA-N 440.266 2.888 50 40 IFGB CCOc1cc(/C=N/NC(=O)CN(c2ccc(Cl)cc2C)S(C)(=O)=O)ccc1O 408767173 JOCKVLJPANLTQA-SRZZPIQSSA-N 439.921 2.669 50 40 IFGB O=C(N/N=C/[C@H]1C(=O)NC(=S)N(c2ccccc2)C1=O)c1ccc(Cl)cc1Cl 16488595 OWYFNBTYGNEJOQ-UWPAOYMWSA-N 435.292 2.773 50 40 IFGB C[C@H](S[C@@H](C)C(=O)N/N=C/c1ccc(C#N)cc1)C(=O)N/N=C/c1ccc(C#N)cc1 38801834 SCGSXWLYHQYFCW-KTNGLVDBSA-N 432.509 2.541 50 40 IFGB CCOc1cc(/C=N/NC(=O)CNc2ccccc2)cc(I)c1O 59419178 XESVCDIUQBPYHX-KEBDBYFISA-N 439.253 2.958 50 40 IFGB CCOc1cc(/C=C(/C#N)C(=O)Nc2ccccc2)ccc1OCC(=O)N1CCOCC1 409019149 YGAXMPSIDPIYAM-RGEXLXHISA-N 435.480 2.869 50 40 IFGB CCc1[nH]nc2c1[C@@]1(C(=O)N(Cc3cccc(OC)c3)c3ccccc31)C(C#N)=C(N)O2 9243359 BAYNOCKSQUJLLC-DEOSSOPVSA-N 427.464 2.900 50 40 IFGB O=C(COC(=O)CN(Cc1ccccc1)Cc1ccccc1)NNC(=O)c1ccccc1 138907261 MWXFPRSYDSQARR-UHFFFAOYSA-N 431.492 2.693 50 40 IFGB COc1cccc(NC(=O)C(=O)N/N=C/c2cccc(OCC(=O)Nc3ccccc3)c2)c1 409159417 ZUTVPJOWGAVLSY-MFKUBSTISA-N 446.463 2.802 50 40 IFGB Cc1ccc(C)c(NC(=O)COc2ccc(Cl)cc2/C=N/NC(=O)C(=O)NC2CC2)c1 409259051 ZCIDVKPURXGOAS-BHGWPJFGSA-N 442.903 2.703 50 40 IFGB Nc1nonc1-c1nc2ccccc2n1CC(=O)N/N=C/c1cc(Cl)cc(Cl)c1O 1060150 ZEVBDBVKPJSFPW-QPJQQBGISA-N 446.254 2.831 50 40 IFGB COc1cc2c3c(c1)[C@@]1(C(=O)N3C(C)(C)C[C@@H]2C)C(C#N)=C(N)Oc2cc(C)oc(=O)c21 1460197 ODUCSGYKDKLULQ-APXPCNQMSA-N 433.464 2.962 50 40 IFGB CCOC(=O)CSC1=C(C#N)[C@@H](c2cc(Br)c(O)c(OC)c2)CC(=O)N1 2349525 XTKUCFXHGFYRCW-SNVBAGLBSA-N 441.303 2.798 50 40 IFGB Cc1ccccc1N(CC(=O)N/N=C/c1cc(Br)c(C)o1)S(C)(=O)=O 8685791 XYIQTYNJHFDTPY-GIJQJNRQSA-N 428.308 2.575 50 40 IFGB COc1ccc(OC)c(S(=O)(=O)N(C)CC(=O)N/N=C\c2ccc(C(C)(C)C)cc2)c1 33787312 NYPUPDLTZQGSQX-UCQKPKSFSA-N 447.557 2.772 50 40 IFGB C=CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccncc2)c1 12941966 ZJLIMYAZZWDWCR-UHFFFAOYSA-N 436.493 2.538 50 40 IFGB CCN(CC)c1ccc(C(=O)NNC(=O)CCn2c(=S)[nH]c3ccccc3c2=O)cc1 26988163 JGFNCKWOPKNUST-UHFFFAOYSA-N 439.541 2.757 50 40 IFGB O=C(COc1ccc([N+](=O)[O-])cc1Br)N/N=C/c1ccc([N+](=O)[O-])c(O)c1 36020553 ZNFOFLTXEBPIRV-REZTVBANSA-N 439.178 2.500 50 40 IFGB COC(=O)C1=C(C)NC(C)=C(C(=O)OCCBr)[C@H]1c1cccc([N+](=O)[O-])c1 68606378 UJFBVNPYHVIYBF-INIZCTEOSA-N 439.262 2.941 50 40 IFGB biogenic COc1cc(OC)cc(C(=O)NNC(=O)CSc2nnc(-c3ccc(Cl)cc3)o2)c1 408637982 OXCIHFQQYHRLBM-UHFFFAOYSA-N 448.888 2.961 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cc(OC)cc(OC)c3)[C@H]2C1 6195024 GQVILTUHGBDNRJ-VQTJNVASSA-N 433.468 2.586 50 40 IFGB C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NC(=S)NNC(=O)c1ccccc1O 9553337 WGEVVLNNSWMWJH-SECBINFHSA-N 428.297 2.802 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C/c2cccc(Cl)c2Cl)cc1 16187110 UXLUFMQKBMNCAL-KEBDBYFISA-N 430.313 2.773 50 40 IFGB Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)c1cccc(CS(C)(=O)=O)c1 27204019 DCTPEVMELVMGRK-CQSZACIVSA-N 438.933 2.730 50 40 IFGB O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 408840628 CVZYQSAMKOXTBX-UHFFFAOYSA-N 449.379 2.830 50 40 IFGB CCOc1ccc(-n2nc(C(=O)N/N=C\c3ccc(OC)cc3)c(C)c(C#N)c2=O)cc1 409062509 VWODRWDMNRUOSA-QFEZKATASA-N 431.452 2.584 50 40 IFGB O=C(N/N=C/c1cccnc1)c1nn(Cc2cccc(Br)c2)cc1[N+](=O)[O-] 1092121 LYFBCLNLSSCLGV-AWQFTUOYSA-N 429.234 2.761 50 40 IFGB CCOc1cc(/C=N/NC(=O)c2cccnc2)cc(I)c1OC 10039094 IFQHIBUIKVJBDC-DJKKODMXSA-N 425.226 2.857 50 40 IFGB O=C(NC(=S)NNC(=O)c1ccccc1Br)c1ccc(Br)o1 12137277 UPPXXIDYGAUFHE-UHFFFAOYSA-N 447.108 2.754 50 40 IFGB O=C(Cc1csc(-c2ccc(F)cc2)n1)NNS(=O)(=O)c1cc(F)ccc1F 13009876 BVQWZKKZMJVZHJ-UHFFFAOYSA-N 427.429 2.780 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)S(C)(=O)=O)cc1C 20208750 QIVIJSZHRAMHHR-KEBDBYFISA-N 438.893 2.781 50 40 IFGB O=C(NCCc1ccc(F)cc1)NNC(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1 40058107 YOVURGJACGFTLH-UHFFFAOYSA-N 445.472 2.579 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1C(=O)O)c1cc(Cl)ccc1Cl 409026790 YJSGLOKHUJOXAQ-AWQFTUOYSA-N 444.296 2.608 50 40 IFGB COc1cccc(/C=N\NC(=O)c2nn(-c3ccc(C)c(C)c3)c(=O)c(C#N)c2C)c1OC 409053619 GMZLRGXILBCICZ-ZMFRSBBQSA-N 445.479 2.811 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(CC)cc2)c(Cl)c1 409161943 XKIQJVHIWDNZEP-WYMPLXKRSA-N 430.892 2.506 50 40 IFGB CCOc1ccc(C(=O)N/N=C\c2cc(Cl)c(OCC(N)=O)c(OCC)c2)cc1OC 409320222 AKXUWABDOLSCIZ-MYKKPKGFSA-N 449.891 2.774 50 40 IFGB N#C/C(=C/c1ccc(-c2cccc(Br)c2)o1)C(=O)N[C@H]1CCS(=O)(=O)C1 16791089 URAFBPOUDKQEHT-CTXBLAANSA-N 435.299 2.919 50 40 IFGB O=C(Cc1ccccc1)N/N=C(/c1nc2ccc([N+](=O)[O-])cc2nc1O)[C@H](O)c1ccco1 17211314 CHTOQGYSOSVQCR-JLJGYXLTSA-N 447.407 2.633 50 40 IFGB O=C(N/N=C/c1cccnc1)c1nn(Cc2ccc([N+](=O)[O-])cc2)cc1Br 1089124 BALVEDRXYUBQOD-AWQFTUOYSA-N 429.234 2.761 50 40 IFGB COc1ccccc1OCC(=O)N/N=C/c1ccc(OCC(=O)NCc2ccco2)cc1 16184142 QPRZWCUSVZONBR-DHRITJCHSA-N 437.452 2.513 50 40 IFGB Cc1ccc(C)c(N2C/C(=N/NC(=O)CC#N)[C@H](c3nc4ccccc4s3)C(=O)C2=O)c1 17189280 GAMXJKYDOOXCOF-ZWXNIRCYSA-N 445.504 2.999 50 40 IFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccccc1Br 20760539 DMTUWMOJKIOENL-UDWIEESQSA-N 433.262 2.958 50 40 IFGB Cc1ccc(C)c(NC(=O)C(=O)N/N=C/c2ccc(OCC(=O)NCc3ccco3)cc2)c1 58880857 ITYVWXCFTLTVDM-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB COc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc5c(c4)OCO5)c32)cc(OC)c1O 8410134 HQSVPOCGCOLKJJ-KRWDZBQOSA-N 434.408 2.746 50 40 IFGB COc1ccc(C(=O)NCCCCCC(=O)N/N=C/c2ccc3c(c2)OCO3)cc1OC 9349818 ZVIANWVJDBRYMV-AFUMVMLFSA-N 441.484 2.873 50 40 IFGB CC(C)C(=O)NNC(=O)COc1c(I)cc(Cl)c2cccnc12 12856404 NEMHYRXBPKSHDY-UHFFFAOYSA-N 447.660 2.675 50 40 IFGB CCOc1cc(/C=N/NC(=O)C2CCN(C(=O)c3ccc(OC)cc3)CC2)ccc1O 409004850 FMYAYPPUXMKCMM-BUVRLJJBSA-N 425.485 2.802 50 40 IFGB CCN(CC)c1ccc(/C=N/NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(O)c1 8826389 SZBXNLHMOPKAKN-XQNSMLJCSA-N 444.557 2.787 50 40 IFGB CCOc1ccccc1C(=O)NCC(=O)NNC(=O)c1cc2c(s1)CCCCCC2 12698434 CLCOAZMEXLJMMP-UHFFFAOYSA-N 429.542 2.997 50 40 IFGB CCOc1cc(/C=N\NC(=O)c2ccncc2)cc(I)c1OC 408974075 WSWNZOPGYSXRKT-GRSHGNNSSA-N 425.226 2.857 50 40 IFGB Cc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CSc2ccccc2)s1 13514008 QLQJEQQGJVMCFN-AWQFTUOYSA-N 440.514 2.659 50 40 IFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4ccccn4)c(=O)c32)cc2c1OCO2 37866367 CKWIQZXYBSYSLB-HXUWFJFHSA-N 444.447 2.556 50 40 IFGB O=C(CN1C(=O)[C@H]2C[C@@H](Br)[C@@H](Br)C[C@H]2C1=O)Nc1ccccc1 408673346 RGSNOYYCDPZIFD-FNFFVJSTSA-N 444.123 2.547 50 40 IFGB O=C(Cc1nnc(NC(=O)c2ccc(Cl)cc2)s1)N/N=C/c1ccc2c(c1)OCO2 825498 SVMDKFNJAIJNTE-ZVBGSRNCSA-N 443.872 2.865 50 40 IFGB Cc1cccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(Br)s2)c1C 12772534 JGKSYSKARBPSGX-NSHDSACASA-N 433.349 2.904 50 40 IFGB O=C(CN1CSCC1=O)NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 12784883 OLKKYCIWOZJEMT-UHFFFAOYSA-N 435.958 2.926 50 40 IFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)Cc2ccc(OC)c(OC)c2)c(OC)c1 101430594 SYTYGAMBPLDNMZ-ZVHZXABRSA-N 429.473 2.784 50 40 IFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cccc(I)c3)[C@H]2C1 8926224 ODBHAECLMWZLON-IRXDYDNUSA-N 441.276 2.646 50 40 IFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1cccc(OC)c1OC 408602283 BIKGVCKWWTXCOP-QGZVFWFLSA-N 427.530 2.957 50 40 IFGB CCOc1ccc(CC(=O)N/N=C\c2cc(Cl)c(OCC(=O)OC)c(OC)c2)cc1 408711976 TUIXZMCFQXODDC-FMCGGJTJSA-N 434.876 2.992 50 40 IFGB COc1cc(OC)c([N+](=O)[O-])cc1/C=N/NC(=O)C(O)(c1ccccc1)c1ccccc1 1078903 HWLXDSNHRCUDDU-BUVRLJJBSA-N 435.436 2.998 50 40 IFGB Cc1ccc2c(c1)[C@@]1(C=C3c4cc5c(cc4CCN3C(N)=C1C#N)OCCCO5)C(=O)N2 9129022 SNILHRWLAPLYFM-RUZDIDTESA-N 426.476 2.953 50 40 IFGB COc1cc([C@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4ccco4)c(=O)c32)cc2c1OCO2 12173180 PVJIUUBLZSAAAF-IBGZPJMESA-N 433.420 2.754 50 40 IFGB Cc1c(C)c(C)c(S(=O)(=O)NNC(=O)c2cc(Br)cn2C)c(C)c1C 12937089 ZFXUAZSPDUYKQE-UHFFFAOYSA-N 428.352 2.953 50 40 IFGB N#CC1=C(N)C(C#N)(C#N)[C@]2(C(=O)Nc3ccccc32)[C@H]2CN(Cc3ccccc3)CC[C@H]12 13899106 VCIDMTWIRSOUQT-JDITYXQVSA-N 434.503 2.798 50 40 IFGB COc1ccccc1N1CCN(C(=O)C(=O)N/N=C/c2ccc(Cl)c(Cl)c2)CC1 59434035 TVVNJVRDSLOKHW-YDZHTSKRSA-N 435.311 2.801 50 40 IFGB N#C/C(=C/[C@@H]1C(=O)NC(=S)N(c2ccc(Cl)cc2)C1=O)C(=O)Nc1ccccc1F 408819303 REOVBUFTPXHCGJ-RBJHHQRMSA-N 442.859 2.932 50 40 IFGB CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc(OCC(=O)N3CCOCC3)cc2)cc1 409233427 SDMPIZYJAALGOY-CYVLTUHYSA-N 435.480 2.869 50 40 IFGB COC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)c2ccc(-n3c(C)ccc3C)cc2)c1 12527518 WVXHCFOGPUQRKP-UHFFFAOYSA-N 441.509 2.812 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2cccnc2)c2ccccc2F)cc1 16309501 KVWLWUYPXLGGBC-ZVHZXABRSA-N 426.473 2.875 50 40 IFGB CCOc1ccccc1OCC(=O)N/N=C/c1ccc(O)c(I)c1 20100772 UGDMGAYHDAEDQI-VXLYETTFSA-N 440.237 2.925 50 40 IFGB COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)OCc3nc(N)nc(N(C)C)n3)c2C)cc1 23004509 OVERUWVPZRFVMD-GZTJUZNOSA-N 447.499 2.586 50 40 IFGB COc1cccc(N(CC(=O)N/N=C/c2c(Cl)cccc2Cl)S(C)(=O)=O)c1 408770773 ACGSDOYQRKTRGW-KEBDBYFISA-N 430.313 2.918 50 40 IFGB O=C(Cc1ccc2c(c1)OCCO2)N/N=C\c1cc([N+](=O)[O-])cc(Br)c1O 409364064 MYQPZNOZVQVLND-OCKHKDLRSA-N 436.218 2.527 50 40 IFGB COc1ccc(OC)c(/C=N\NC(=O)c2nn(-c3cccc(C)c3)c(=O)c(C#N)c2C)c1 9094775 BRDPJGJOEWBNTP-MXAYSNPKSA-N 431.452 2.502 50 40 IFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)C(=O)Nc1cccc(Cl)c1C 9805548 UXGYCSSFXLMSGB-BRJLIKDPSA-N 444.875 2.879 50 40 IFGB CCNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 21287165 TZBRCYUCKKSUTM-UHFFFAOYSA-N 446.407 2.977 50 40 IFGB N#C/C(=C/c1ccc2c(c1)OCO2)C(=O)Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1 34687812 YFXYWXRORUBFPN-GDNBJRDFSA-N 449.448 2.552 50 40 IFGB Cc1cc(/C=N/NC(=O)C(=O)NC[C@@H]2CCCO2)c(C)n1-c1cccc(Br)c1 58912220 YSZOCUNCVLPRDM-RIDKEVFESA-N 447.333 2.602 50 40 IFGB Cc1cc2c(c(=O)n1CCN(C)C)[C@@H](c1ccccc1Br)C(C#N)=C(N)O2 2247293 RHHMFDKECRMWKN-KRWDZBQOSA-N 429.318 2.699 50 40 IFGB COc1ccc2c(c1OC)C(=O)O[C@@H]2N1C(=O)/C(=N/NC(=O)c2ccco2)c2ccccc21 13814745 FZKXCRJWMRCIHE-UWODKOOBSA-N 447.403 2.647 50 40 IFGB N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)N[C@H]1CCS(=O)(=O)C1 26966722 LJNFRJKXATURQD-ZPBCLNFZSA-N 432.505 2.750 50 40 IFGB CCN(CC)c1ccc(/C=N/NC(=O)CN(c2ccc(OC)cc2)S(=O)(=O)CC)cc1 59490266 BTCMYZMLZIOTQZ-XQNSMLJCSA-N 446.573 2.848 50 40 IFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1cc(OC)c(OC)c(OC)c1 408603340 FWIFBRIUTUWHGN-MRXNPFEDSA-N 430.486 2.660 50 40 IFGB COc1cccc2cc(C(=O)N/N=C/c3ccc(OCC(N)=O)c(Br)c3)oc12 408970943 BGODMZSCJKGSSG-LSFURLLWSA-N 446.257 2.832 50 40 IFGB Cc1ccc(-n2nc(C(=O)N/N=C\c3ccc(C(=O)O)cc3)c(C)c(C#N)c2=O)cc1Cl 409051144 APUMMXFOIVIECA-GATIEOLUSA-N 449.854 2.837 50 40 IFGB COc1cccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(Br)cc3)C2)c1OC 409155399 QXVIHPLDIFNEON-HYLGSWLWSA-N 446.301 2.970 50 40 IFGB Cc1cc(C)c(S(=O)(=O)NCC(=O)N/N=C/c2cccc(Br)c2)c(C)c1 409161776 PNXTVPABLVFKLM-KEBDBYFISA-N 438.347 2.803 50 40 IFGB COc1cc([C@@H]2C(C#N)=C(N)N(c3ccc(F)cc3)C3=C2S(=O)(=O)CC3)ccc1O 1429891 PPSAGMBHHOWANP-LJQANCHMSA-N 427.457 2.868 50 40 IFGB CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(OCC(F)(F)F)nc2)cc1 12786803 RPCJYBYHHUNGON-GFCCVEGCSA-N 427.379 2.650 50 40 IFGB Cc1cc(Br)cc(Br)c1OCC(=O)NNC(=O)c1ccncc1 32118814 DWPUBBITTKJGBV-UHFFFAOYSA-N 443.095 2.755 50 40 IFGB Cc1ccc(N2C[C@@H](C(=O)NNC(=O)c3cccc(Br)c3)CC2=O)cc1C 408614755 HHDBDIFMWTWRPR-HNNXBMFYSA-N 430.302 2.880 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)[C@@H](C)N(c2ccccc2)S(C)(=O)=O)cc1OC 408923860 HLMNFDILRORYLW-QFNCUCFLSA-N 431.514 2.565 50 40 IFGB O=C(CCCOc1ccccc1)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3 3326217 TTYXLVHTTQEFBH-UHFFFAOYSA-N 434.496 2.743 50 40 IFGB Cc1ccc(S(=O)(=O)NNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc1C(=O)O 28940340 VGSUYKLCFKURHC-UHFFFAOYSA-N 445.472 2.863 50 40 IFGB O=C(CN1CCOCC1)N/N=C\c1cc(Br)ccc1OCc1ccccc1 33335334 MEBGMBBRPCQVNH-XKZIYDEJSA-N 432.318 2.810 50 40 IFGB CCOc1cccc(NC(=O)/C(C#N)=C\c2ccc(OCC(=O)N3CCOCC3)cc2)c1 409242593 RSIDPCQECXXLLK-RGEXLXHISA-N 435.480 2.869 50 40 IFGB Cc1cccc(OCC(=O)NNC(=O)c2cc3cc(Br)ccc3oc2=O)c1 649775 GUTHPCMOPDRPIF-UHFFFAOYSA-N 431.242 2.704 50 40 IFGB O=C(Cn1nnc(-c2ccccc2Cl)n1)N/N=C/c1cc(Br)ccc1O 408731255 ZMIHRIJWNSYBRI-UFWORHAWSA-N 435.669 2.612 50 40 IFGB C#CCN1C(=O)/C(=N\NC(=O)COc2ccc(C)cc2)c2cc(Br)ccc21 2322639 PJXLVLARTKTEPS-NMWGTECJSA-N 426.270 2.637 50 40 IFGB O=C(CS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)Nc1cccc(C(F)(F)F)c1 2561973 MDVOEZSBFSBLNF-UHFFFAOYSA-N 435.811 2.985 50 40 IFGB COCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc2cc3c(cc2nc1Cl)OCO3 6237951 RMIVMCWLBSUHTM-SFHVURJKSA-N 443.843 2.888 50 40 IFGB C/C(=N/NC(=O)[C@@H](C)n1cc([N+](=O)[O-])cn1)c1ccc(OCc2ccc(C(=O)O)o2)cc1 8815647 IDCGCQBEEUKICZ-IKTNTUJMSA-N 441.400 2.763 50 40 IFGB CCOc1ccc(OCc2ccc(C(=O)NNC(=O)[C@@H](NC(N)=O)[C@@H](C)CC)cc2)cc1 9579678 AZVAHELCGGBHKN-YWZLYKJASA-N 442.516 2.508 50 40 IFGB COc1ccc(OCC(=O)N/N=C(\C)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 12362334 ZDXZWXVIUMWCGY-LPYMAVHISA-N 430.417 2.512 50 40 IFGB CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccs3)CC2)cc1 12992953 DLGIGROIGBVJIQ-UHFFFAOYSA-N 435.571 2.733 50 40 IFGB CCOc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCCC3)c2)cc1 13141440 WCTVFRODHVCYJC-UHFFFAOYSA-N 445.541 2.725 50 40 IFGB CCn1nc(C(=O)N/N=C/c2cc3c(cc2Br)OCO3)c2ccccc2c1=O 89300028 GNYGTLGOFXKAJF-ZVBGSRNCSA-N 443.257 2.672 50 40 IFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(I)cc2)n1 409245356 RNOFUPOIICJBCG-CAOOACKPSA-N 426.283 2.940 50 40 IFGB COC(=O)c1ccc(N2C(=O)[C@H]3C[C@H](Br)[C@H](Br)C[C@@H]3C2=O)cc1 4156897 ZAMKNSHEIWXLKP-ZDEQEGDKSA-N 445.107 2.900 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@H]3[C@@H]4C[C@@H]([C@@H](Br)[C@H]4Br)[C@@H]3C2=O)c1 4157168 AQAXYDDYNVXYEF-XALSLBCYSA-N 443.091 2.667 50 40 IFGB CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CSc2ccc(C)c(C)c2)c1 14245976 JVKLXMIDLPEJSH-UHFFFAOYSA-N 449.598 2.887 50 40 IFGB COC(=O)COc1ccc(/C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1OC 15945127 FZNIPNFQZHIXFH-WOJGMQOQSA-N 433.464 2.994 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2)cc1)Nc1ccc(F)cc1 58880732 YALDHUXEULETRZ-AFUMVMLFSA-N 434.427 2.932 50 40 IFGB COCCCNC(=O)C(=O)N/N=C/c1cc(Br)ccc1Nc1ccccc1 408707131 HCANTTFJFUKDJJ-LPYMAVHISA-N 433.306 2.796 50 40 IFGB COc1cccc(N(CC(=O)N/N=C/c2cccnc2)S(=O)(=O)c2ccc(C)cc2)c1 409183312 ASVXFDOSABLGNJ-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB O=C(CC(=O)Nc1nccs1)N/N=C/c1ccc(N(CCCl)CCCl)cc1 1631073 KSURFFPMWNEDKY-CIAFOILYSA-N 428.345 2.906 50 40 IFGB CC1(CC(=O)N/N=C/c2ccc(Oc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])cc2)OCCO1 9028407 VZYKJZGEJZUSMF-UDWIEESQSA-N 430.373 2.899 50 40 IFGB Cc1cc(OCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1C(C)C 12733957 HZNMMVWYFSGKET-UHFFFAOYSA-N 432.546 2.560 50 40 IFGB CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)c2ccccc2O)[C@H]1c1ccc(OC)cc1 40049163 VCIQFWFLYLEDPY-SIKLNZKXSA-N 439.512 2.942 50 40 IFGB CCOc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccncc2)c2ccccc2)cc1 408921151 FJDSJBVJAGNTJH-LFVJCYFKSA-N 438.509 2.826 50 40 IFGB Cc1ccc(C(=O)Nc2ccccc2C(=O)N[C@@H](C)C(=O)NNC(=O)c2ccccc2)cc1 3144137 GQSIVEWTPKPYRA-KRWDZBQOSA-N 444.491 2.827 50 40 IFGB O=C(NNC(=S)NCc1ccccc1)c1cccc(S(=O)(=O)N2CCCCCC2)c1 15873394 WCTVMRQUGKRDEU-UHFFFAOYSA-N 446.598 2.560 50 40 IFGB COC(=O)c1cc(OC)c(OC)cc1N/C=C(/C#N)C(=O)NCc1ccc(OC)cc1 102673257 CVBOLKMEFJKVIF-SQFISAMPSA-N 425.441 2.635 50 40 IFGB C/C(=N\NC(=O)CNc1ccc(I)cc1)c1ccc(O)cc1O 409182898 PHGVWNMJLUQHIW-VXLYETTFSA-N 425.226 2.655 50 40 IFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4ccco4)c(=O)c32)cc2c1OCO2 12173177 PVJIUUBLZSAAAF-LJQANCHMSA-N 433.420 2.754 50 40 IFGB COc1cccc(N2C[C@H](C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)CC2=O)c1 12937235 ZWWFDFMPBOFPMY-MRXNPFEDSA-N 449.463 2.681 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)CN(c2ccc(OC)c(Cl)c2)S(C)(=O)=O)cc1 408771639 JVDCINIJOKWVAF-FYJGNVAPSA-N 439.921 2.664 50 40 IFGB CCc1cc2c(=O)n(CC(=O)N/N=C/c3ccc(OC(C)C)c(OC)c3)cnc2s1 1784443 MARYKVLJYCZEDG-AUEPDCJTSA-N 428.514 2.967 50 40 IFGB COc1ccc(/C=N/NC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cc1O 8879618 YEYRPCPCVMHZRU-ZVHZXABRSA-N 428.452 2.867 50 40 IFGB CCOc1ccccc1C(=O)N[C@H](C(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1)C(C)C 9910593 FEXPCWLQCFSRET-NRFANRHFSA-N 449.511 2.691 50 40 IFGB Cc1cccc(C)c1N(CC(=O)N/N=C/c1ccc(Br)cc1)S(C)(=O)=O 19955365 FXBGNGZRRSAKBX-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2cc(Br)c(C)o2)S(C)(=O)=O)c(C)c1 20208157 HADPTXMGHYKMRD-DJKKODMXSA-N 442.335 2.884 50 40 IFGB COc1cc(C(=O)N/N=C\c2cc([N+](=O)[O-])ccc2O)ccc1I 409108692 YQCKWIZVSOQWLO-IUXPMGMMSA-N 441.181 2.678 50 40 IFGB COc1ccc(/C=N/NC(=O)Cn2cnc3sc4c(c3c2=O)CC[C@H](C)C4)cc1OC 719444 CZMQMEVZOAOSHF-VRVUXBDFSA-N 440.525 2.750 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)CSc2ccccc2)cc1)NC[C@@H]1CCCO1 28213864 AJXSTOMZQAVHEO-BBMHEYIBSA-N 427.526 2.603 50 40 IFGB C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)S(=O)(=O)c1ccc(CCCl)cc1 40118793 LAHAJDAOMFEECR-HNNXBMFYSA-N 449.960 2.852 50 40 IFGB O=C(CO/N=C/c1ccccc1)N/N=C1\C(=O)N(CN2CCCCCC2)c2ccccc21 101560385 KIERSWWWCIQRBT-ATCIDIOVSA-N 433.512 2.738 50 40 IFGB Cc1cccn2c(=O)c(/C=C(\C#N)C(N)=O)c(Oc3ccc(Br)cc3)nc12 2401686 LSHKJVLFZQCUDW-FMIVXFBMSA-N 425.242 2.950 50 40 IFGB COc1cccc(-c2c(C(=O)N/N=C/C(C)=C/c3ccccc3)nnn2-c2nonc2N)c1 4465030 ACIQJXADZPFFIL-AVHWCGEESA-N 444.455 2.727 50 40 IFGB Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)cc12 12863707 CKKYTWLNZYSUJO-OAHLLOKOSA-N 436.534 2.640 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2c(Cl)cccc2Cl)S(C)(=O)=O)cc1 20060430 PBLHRXDBJCZCST-KEBDBYFISA-N 430.313 2.918 50 40 IFGB Cc1cc(C)cc(NC(=O)COC(=O)CCC(=O)NNC(=O)c2ccc(Cl)cc2)c1 408665108 UFTCPURFKWKSMF-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccc(C)c(Cl)c2)c1 409159048 YYQDSCNBCDVHBZ-WYMPLXKRSA-N 430.892 2.642 50 40 IFGB CCn1c(NNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)nc2ccccc2c1=O 10323642 ILMXZHFDXFXQEO-UHFFFAOYSA-N 436.472 2.684 50 40 IFGB COc1ccccc1OCCOc1c(Br)cc(/C=N/NC(N)=O)cc1OC 8984381 XHYIPRACWGSJDK-SRZZPIQSSA-N 438.278 2.926 50 40 IFGB O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)c1ccc(-n2cncn2)nc1 32905352 SNIQPRWWIQICSV-UHFFFAOYSA-N 435.271 2.589 50 40 IFGB CCc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NC3CC3)cc2Cl)cc1 409264663 QWXPIFCDUKUROA-WYMPLXKRSA-N 442.903 2.649 50 40 IFGB CCOC(=O)c1c(NC(=O)C(=O)N/N=C/c2cc(OC)ccc2OC)sc2c1CCC2 2424891 KRHIMJFHTPUFLF-SSDVNMTOSA-N 445.497 2.520 50 40 IFGB O=C(Oc1ccccc1/C=N/NC(=O)[C@@H]1COc2ccccc2O1)c1ccc2c(c1)OCO2 3025763 DTKCYMYLBHGGTK-RVRSLOCESA-N 446.415 2.925 50 40 IFGB CCOC(=O)c1cc(C(C)C)sc1NC(=O)CNNC(=O)COc1cccc(F)c1 12566612 YLROXNQHVNFROE-UHFFFAOYSA-N 437.493 2.826 50 40 IFGB CN(C)c1ccc(C(=O)c2ccccc2C(=O)NNC(=O)c2ccccc2)cc1[N+](=O)[O-] 24429477 KPQLYNAVDYSVAD-UHFFFAOYSA-N 432.436 2.967 50 40 IFGB Cc1cccc(C)c1OCC(=O)NNC(=O)[C@H](NC(=O)c1c(F)cccc1F)C(C)C 26536650 ZFPPTCZPMFARKA-LJQANCHMSA-N 433.455 2.562 50 40 IFGB O=C1[C@H]2[C@H](C(=O)N1c1ccc([N+](=O)[O-])cc1)[C@H]1C[C@H]2[C@H](Br)[C@@H]1Br 102055539 ZCDMNVVYMXYOLY-GRRRKWKPSA-N 444.079 2.877 50 40 IFGB COC(=O)c1ccccc1-n1c(C)cc(/C=N\NC(=O)C(=O)Nc2cccc(OC)c2)c1C 223155646 OVESDHVIFFFDDF-QFEZKATASA-N 448.479 2.978 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2cc(C)cc(C)c2)S(C)(=O)=O)cc1OC 20208487 ZPVAWQWOHNYTLO-OEAKJJBVSA-N 445.541 2.793 50 40 IFGB COc1cc(/C=N/NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc([N+](=O)[O-])c1O 59427788 PHILVMUFKSKYFH-WYMPLXKRSA-N 446.419 2.927 50 40 IFGB CCOC(=O)/C(=N/Nc1sc(C(=O)OCC)c(C)c1C(=O)OCC)C(=O)CCl 15905947 LEVOWJPUCZWWGT-XDHOZWIPSA-N 432.882 2.549 50 40 IFGB CC1=C(C#N)C(=O)NC(=O)/C1=C\Nc1ccc(C)c(CN2C(=O)c3ccccc3C2=O)c1 16312687 FYXAQALBCOQLJH-JAIQZWGSSA-N 426.432 2.584 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1[N+](=O)[O-])c1cccc(Cl)c1Cl 408907043 GCFLYIZKMMHIDW-DJKKODMXSA-N 445.284 2.818 50 40 IFGB COc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccco2)c2ccccc2OC)cc1 409027091 YBXWGNWVBPWENH-HYARGMPZSA-N 443.481 2.642 50 40 IFGB O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccc(I)c1 840347 YRNSOOGQEBDTCU-UHFFFAOYSA-N 445.600 2.928 50 40 IFGB Cc1cccc2c1NC(=O)[C@]21C=C2c3cc4c(cc3CCN2C(N)=C1C#N)OCCCO4 9130314 PMGLYWIBIMJSQZ-RUZDIDTESA-N 426.476 2.953 50 40 IFGB Cc1ccc(S(=O)(=O)CCC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1 9544500 HSTWSZLQRAUILK-KRWDZBQOSA-N 440.521 2.927 50 40 IFGB CCc1ccc(/C=N/NC(=O)CN(C)S(=O)(=O)c2ccc(Br)cc2)cc1 16161344 KITNDXBHCSQSKR-UDWIEESQSA-N 438.347 2.782 50 40 IFGB Cc1ccc(C)c(N2C[C@H](C(=O)NNC(=O)c3ccc(Br)cc3)CC2=O)c1 408641677 KYSJGOFVBPPNNY-OAHLLOKOSA-N 430.302 2.880 50 40 IFGB COc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)cc(Br)c1OCC(N)=O 409221854 BGZDRGMRMRFSOP-VIZOYTHASA-N 444.285 2.545 50 40 IFGB COc1ccc(-n2c(SCC(=O)N/N=C/c3cccn3C)nc3ccccc3c2=O)cc1 1478362 NOPKAIUGIMFEKQ-ZVHZXABRSA-N 447.520 2.975 50 40 IFGB Cc1cccc(OCC(=O)NNC(=O)CSc2nnc3cc(C)c4ccccc4n23)c1 6442678 JAZONIVUXCWGRH-UHFFFAOYSA-N 435.509 2.818 50 40 IFGB Cc1ccc(SCc2c(C(=O)N/N=C/c3ccsc3)nnn2-c2nonc2N)cc1 9499407 YSGGPCXEURVIEF-DNTJNYDQSA-N 440.514 2.659 50 40 IFGB O=C(NNC(=O)C1CCN(C(=O)/C=C/c2ccccc2)CC1)c1cc(-c2ccccc2)n[nH]1 15841597 QICHKROUHWCRAW-VAWYXSNFSA-N 443.507 2.790 50 40 IFGB CCOc1ccc(N2C[C@H](C(=O)N/N=C/c3cc(OC)c(OC)c(OC)c3)CC2=O)cc1 409158937 UKVVVZMMWJUTIA-ANDSAHIGSA-N 441.484 2.614 50 40 IFGB C#CCNS(=O)(=O)c1cccc(C(=O)NN(Cc2ccccc2)Cc2ccccc2)c1 16227538 LBCKKGSYQFBGGE-UHFFFAOYSA-N 433.533 2.945 50 40 IFGB C/C(=N\NC(=O)c1cc(O)cc(O)c1)c1cccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)c1 17101291 SBBYBMHDGVUBOQ-BVHMKYCRSA-N 437.452 2.857 50 40 IFGB COC(=O)COc1ccc(/C=N\NC(=O)COc2ccccc2C)cc1Br 32114471 CTVTZJCGVGTAFC-FBHDLOMBSA-N 435.274 2.838 50 40 IFGB O=C(CCCC[C@H]1SC[C@H]2NC(=O)N[C@@H]21)N/N=C/c1c(F)c(F)c(F)c(F)c1F 71790016 SUBCRWHUPDUERG-CYDSIULUSA-N 436.406 2.558 50 40 IFGB CC(=O)[C@H]1CC[C@@H]2[C@]1(C)C[C@H]1O[C@]13[C@@]1(C)CC[C@H](O)C[C@]14C=C[C@]23[C@H]1C(=O)OC(=O)[C@@H]14 118936376 UWJWRKKBRRCXGD-HRUYYLCISA-N 426.509 2.572 50 40 IFGB Cc1ccc(C(=O)NNC(=O)CSc2nc3sc4c(c3c(=O)n2C)CCCC4)cc1 877928 IZVAGGZIKXBHMU-UHFFFAOYSA-N 442.566 2.736 50 40 IFGB CC/C(=N\NC(=O)c1nnn(-c2nonc2N)c1-c1cccc(OC)c1)c1ccc(C)cc1 9308004 UTZXBKIICSVOAX-JJIBRWJFSA-N 446.471 2.761 50 40 IFGB C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)Cc1cnn(-c2ccccc2)c1 12808640 UYRNYQZIPGDMBY-CQSZACIVSA-N 443.301 2.792 50 40 IFGB Cc1ccc(S(=O)(=O)N[C@H](CC(C)C)C(=O)N/N=C/c2ccc(N(C)C)cc2)cc1 15229782 SHNBLDFYDQZNQU-CPOKCXMASA-N 430.574 2.904 50 40 IFGB Cc1cc2c(c(=O)n1CCCN1CCOCC1)[C@H](c1cccc(Cl)c1)C(C#N)=C(N)O2 20503404 JEFDLFLUYXYWEI-HXUWFJFHSA-N 440.931 2.751 50 40 IFGB COc1cccc(NC(=O)NNC(=O)c2ccc(=O)n(Cc3ccc(C)cc3)c2)c1OC 23136200 VIXOODUDZLOALW-UHFFFAOYSA-N 436.468 2.689 50 40 IFGB CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C\c2ccc(C(C)(C)C)cc2)cc1 39986472 NGNPKMHHLWAUDK-UCQKPKSFSA-N 444.557 2.713 50 40 IFGB C/C(=N\NC(=O)CN(c1ccccc1F)S(C)(=O)=O)c1cccc(Br)c1 408773684 ISHDEFBCGRZTGS-UDWIEESQSA-N 442.310 2.895 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)CNC(=O)c2ccccc2Br)cc1[N+](=O)[O-] 14921190 ZAZRAAAAWMJZBE-SRZZPIQSSA-N 449.261 2.636 50 40 IFGB O=C1[C@@H]2[C@@H]3C[C@H]([C@H](Br)[C@@H]3Br)[C@@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1 100537443 ZCDMNVVYMXYOLY-LVTVNPDKSA-N 444.079 2.877 50 40 IFGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)CN(c2cc(C)cc(C)c2)S(C)(=O)=O)c1 8452151 BNKMOUZMWUGRAJ-XQNSMLJCSA-N 430.530 2.568 50 40 IFGB Cc1cccc(C(=O)NNC(=O)[C@@H](C)N(C)CC(=O)Nc2ccccc2C(F)(F)F)c1 12734895 ZYPKOPXUJVMXIP-CQSZACIVSA-N 436.434 2.734 50 40 IFGB COc1c(/C=N/NC(=O)[C@H]2C[C@@H]2c2ccccc2)c(CCN(C)C(C)=O)cc2c1OCO2 13687804 JMYKJUGBBMAQPL-TXCGGMSCSA-N 437.496 2.699 50 40 IFGB Cc1noc(C)c1CSc1ncccc1C(=O)NNC(=O)c1ccc2c(c1)OCO2 32727168 SKGSYWLNRCJJQW-UHFFFAOYSA-N 426.454 2.782 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2cccc(Br)c2)S(C)(=O)=O)cc1C 408775518 HUGROFQIZXVMBE-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB CCOc1ccc(N([C@H](C)C(=O)N/N=C(\C)c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 408906326 GHAGTNUIMNWURH-HFITWMCCSA-N 448.501 2.688 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccc(Cl)cc1Cl 409157376 JAGOYPXFLWCFGS-AUEPDCJTSA-N 437.283 2.597 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccccc1Cl 409257226 RMZQFANYACDHGP-CHOFVFFHSA-N 430.892 2.722 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccc(F)c(Cl)c2)c1 409269498 JWFJKIXTSPNZHG-DKZNWEEVSA-N 448.882 2.861 50 40 IFGB CCc1ccc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)N2CCOCC2)cc1 2418758 XRJVUFAVKROBKL-OBGWFSINSA-N 430.464 2.815 50 40 IFGB Cc1nn(Cc2ccccc2)c(C)c1/C=N/NC(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 10024632 IGRIAOLIBTVTLO-CBFMJHRQSA-N 448.483 2.725 50 40 IFGB Cc1cccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)c1C 40071842 SGNHXAHWXMNVJZ-UHFFFAOYSA-N 432.571 2.623 50 40 IFGB CN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccccc2F)cc1 9662567 OOMUNRWLUCDIPI-UHFFFAOYSA-N 427.457 2.726 50 40 IFGB Cc1ccccc1-n1c(C)c(Br)c(/C=N/NC(=O)CN2CCOCC2)c1C 20243789 TVRRYFDQBCXLAJ-WSDLNYQXSA-N 433.350 2.947 50 40 IFGB CC/C(=N\NC(=O)CN(c1ccccc1CC)S(C)(=O)=O)c1ccc(OC)c(OC)c1 408869613 STUXFEUJKSBGRY-PTGBLXJZSA-N 447.557 2.963 50 40 IFGB Cc1ccc(-c2csc3ncn(CC(=O)N/N=C4\C(=O)Nc5ccccc54)c(=O)c23)cc1 1784616 OHTMJVATTDYXOT-UHFFFAOYSA-N 443.488 2.906 50 40 IFGB O=C(NCc1ccc(C(F)(F)F)cc1)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCC3 9578170 HROXYMZKEGPDJR-UHFFFAOYSA-N 445.401 2.506 50 40 IFGB CC(C)NC(=O)CC(=O)N/N=C\c1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1 58872961 JTHJUXQQVLZCLK-FMCGGJTJSA-N 430.892 2.722 50 40 IFGB O=C(COc1ccc(Cl)cc1)NNC(=O)CSc1nnc(Cc2ccccc2)o1 408637231 HWVWVNSPGVAVLS-UHFFFAOYSA-N 432.889 2.632 50 40 IFGB Cc1c(Cl)cccc1NC(=O)COc1ccc(/C=N/NC(=O)C(=O)NC(C)C)cc1 409171223 YUKIWLXRRBWNKI-FOKLQQMPSA-N 430.892 2.641 50 40 IFGB C=CCOc1ccc(C(=O)N/N=C\c2ccc(OCC(=O)O)c(OC)c2)cc1OCC 409327235 RNZCKFCMCCRRTB-QRVIBDJDSA-N 428.441 2.886 50 40 IFGB CC(=O)Nc1ccc(-c2n[nH]c(SCC(=O)NNC(=O)c3ccc(Cl)cc3)n2)cc1 408639788 ZKPXKSXULHOPIR-UHFFFAOYSA-N 444.904 2.637 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2cc(Cl)ccc2Cl)S(C)(=O)=O)c1O 409027372 BKNGVNBLYQASKI-AWQFTUOYSA-N 446.312 2.624 50 40 IFGB CSCC[C@H](C(=O)NNC(=O)c1ccc(Cl)cc1)N1C(=O)c2ccccc2C1=O 3293006 UPADVEMLJXTZCK-MRXNPFEDSA-N 431.901 2.519 50 40 IFGB COc1cc(C=NNC(=O)Cn2cnc3sc(-c4ccccc4)cc3c2=O)ccc1O 11990293 LEKZOEJWWNBJKX-UHFFFAOYSA-N 434.477 2.990 50 40 IFGB CCCOc1ccc(C(=O)NNC(=O)c2ccc3c(c2)nc(C)c(=O)n3CC)cc1OC 21967137 CIRFHGDQNLKTFK-UHFFFAOYSA-N 438.484 2.597 50 40 IFGB CC(C)(C)NC(=S)NNC(=O)c1cc(Br)cc(Br)c1O 408585061 BLSFZCSWJAPBPD-UHFFFAOYSA-N 425.146 2.825 50 40 IFGB COCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)/C=C/c2ccc(OC)cc2)c(OC)c1 1810788 MTXBFDVGFDSQFS-YWLWZHKSSA-N 436.464 2.992 50 40 IFGB COc1ccccc1/C=C/C(=O)NCC(=O)N/N=C/c1cc(Br)ccc1OC 2286055 HNEKRFVNZRSTDT-FHWCKMEISA-N 446.301 2.746 50 40 IFGB biogenic COc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)c3cccnc3)cc2OC)cc1 3335062 XEZOUYXDFXGYQV-DHRITJCHSA-N 434.452 2.880 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1)NC[C@H]1CCCO1 28214827 XBZCZVVMBJROTE-WSSSDRMFSA-N 447.491 2.983 50 40 IFGB Cc1ccc(S(=O)(=O)N[C@H](CC(C)C)C(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 408756336 ZBDXFDRCYWDEJQ-FNLSEGDXSA-N 431.514 2.567 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc(C(=O)O)cc1)c1ccc(Cl)c(Cl)c1 408906968 FIFLESCMYMFKJE-AWQFTUOYSA-N 444.296 2.608 50 40 IFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1cc(OC)c(OC)c(OC)c1 408910332 KAFHHECPERRYQI-QIWJOQEQSA-N 429.473 2.520 50 40 IFGB Cc1ccc(/C=N/NC(=O)[C@H](NC(=O)c2ccccc2)c2n[nH]c(=O)c3ccccc23)cc1 8686146 MSEOQAHSWVULQK-QVGKIPNLSA-N 439.475 2.853 50 40 IFGB O=C(NNC(=O)c1ccccn1)c1cccc(NC(=O)c2ccc(Br)o2)c1 40142845 MRMZGVWKFXBNAH-UHFFFAOYSA-N 429.230 2.764 50 40 IFGB CCOc1ccc(/C=N/NC(=O)CN(c2cccc(C)c2)S(C)(=O)=O)cc1OCC 20207756 HBJUIAUFORLWRF-HYARGMPZSA-N 433.530 2.709 50 40 IFGB O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)s1)c1ccccc1Cl 25524698 PGGORLSQEHOVGW-LBPRGKRZSA-N 448.353 2.669 50 40 IFGB COC(=O)C1=C(C)NC(C)=C(C(=O)OCCBr)[C@@H]1c1cccc([N+](=O)[O-])c1 68606383 UJFBVNPYHVIYBF-MRXNPFEDSA-N 439.262 2.941 50 40 IFGB biogenic COc1ccc(N2C(=O)[C@@H]3[C@@H]4C[C@H]([C@H](Br)[C@@H]4Br)[C@@H]3C2=O)cc1 100537413 KHYQVLDAIPZWMH-ARFNZGECSA-N 429.108 2.978 50 40 IFGB C/C(=N/NC(=O)CCSCCC(=O)N/N=C(\C)c1ccccc1O)c1ccccc1O 104376794 LRJLDNHNOVGVHH-REPVBDINSA-N 442.541 2.992 50 40 IFGB COC(=O)c1ccc(NC(=O)C(=O)N/N=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 223162203 LOAITVANXJWITC-UUYOSTAYSA-N 436.380 2.730 50 40 IFGB Cc1cc(C)c(N2C(=O)NC(=O)/C(=C\NNC(=O)c3ccccc3Cl)C2=O)c(C)c1 408534953 RUSSLWXMHZCQIB-XNTDXEJSSA-N 426.860 2.667 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccco2)cc(I)c1OC(C)=O 408763244 RVILYRYTGVKAPU-CAOOACKPSA-N 428.182 2.582 50 40 IFGB CC(C)CNC(=O)/C(C#N)=C\c1ccc(CNC(=O)C(=O)Nc2cccc(Cl)c2)o1 408826935 UHLANPAVZCLQQG-ZSOIEALJSA-N 428.876 2.867 50 40 IFGB COc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)O)c(OC)c2)c([N+](=O)[O-])c1 408922844 GULKNELJGSRZQA-NTUHNPAUSA-N 427.369 2.621 50 40 IFGB COc1cc(C(=O)Nc2ccccc2C(=O)NNC(=O)C(C)(C)C)cc(OC)c1OC 408999330 UUDAMWHBAYIYEQ-UHFFFAOYSA-N 429.473 2.772 50 40 IFGB O=C(CSc1nnc(NCc2ccccc2)s1)NNC(=O)c1ccc([N+](=O)[O-])cc1 2629033 VXKKMBZBKHXCCQ-UHFFFAOYSA-N 444.498 2.612 50 40 IFGB CCOc1cc(/C=N/NC(N)=O)c(Br)cc1OCC(=O)Nc1ccccc1 2750576 IZMLIRZUUWOJLV-UFFVCSGVSA-N 435.278 2.868 50 40 IFGB COCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc2cc3c(cc2nc1Cl)OCO3 6232941 RMIVMCWLBSUHTM-GOSISDBHSA-N 443.843 2.888 50 40 IFGB C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1CSc1ccc(C)cc1)c1ccco1 9308424 VDDDDUVBKVTMHV-CIAFOILYSA-N 438.473 2.580 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccccn2)c2ccc(F)cc2)cc1 408868784 BHIVYWJPCZGORH-ZVHZXABRSA-N 426.473 2.875 50 40 IFGB CCOc1cc(/C=N/NC(=O)CNC2CCCCC2)cc(I)c1O 409382841 RXXSCCLMWCTZBM-KEBDBYFISA-N 445.301 2.768 50 40 IFGB C/C(=N\NC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)c1ccc([N+](=O)[O-])cc1 9007724 NRMCJKRDKFJSAA-XQNSMLJCSA-N 429.908 2.906 50 40 IFGB COc1ccc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c(OC)c1 58951743 GBOVUWBGZSZRBM-HZHRSRAPSA-N 445.541 2.563 50 40 IFGB Cc1ccc(C)c(N2C[C@@H](C(=O)NNC(=O)c3ccc(Br)cc3)CC2=O)c1 408641676 KYSJGOFVBPPNNY-HNNXBMFYSA-N 430.302 2.880 50 40 IFGB CCOc1cc(/C=N/NC(=O)c2ccccc2N)cc(I)c1O 408727513 FFVRHEKYQWYVAR-DJKKODMXSA-N 425.226 2.742 50 40 IFGB COc1ccccc1/C=N/NC(=O)CN(c1cc(Cl)cc(Cl)c1)S(C)(=O)=O 408782805 JSRIJNRXEWYDAC-KEBDBYFISA-N 430.313 2.918 50 40 IFGB Cc1cc(I)cc(/C=N/NC(=O)[C@H]2COc3ccccc3O2)c1O 2353026 UCJUVJVGKZJNCX-ODGHKMFZSA-N 438.221 2.595 50 40 IFGB Cn1cnnc1SCc1ccc(C(=O)N/N=C/c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 3243915 DYWCGZMBWSSQTE-DNTJNYDQSA-N 440.441 2.508 50 40 IFGB CCOC(=O)c1c(NC(=O)NNC(=O)c2ccc(O)cc2)sc2c1CC(C)(C)OC2 9410508 XWKNHFLXGYEPPG-UHFFFAOYSA-N 433.486 2.948 50 40 IFGB O=C(O)c1ccc(/C=N/NC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cc1 13352240 ZWOKIYDGYSTULQ-ZVHZXABRSA-N 426.436 2.851 50 40 IFGB Cc1ccccc1OCCCOc1ccc(/C=N/NC(=O)Cc2nnc(N)s2)cc1 13897877 AGROTPLAUGBZLN-OEAKJJBVSA-N 425.514 2.969 50 40 IFGB CCOc1cc(/C=N/NC(=O)C(=O)NCCOC)ccc1OCc1ccc(Cl)cc1 14922536 NMXOOWXZMKFEFL-ZMOGYAJESA-N 433.892 2.530 50 40 IFGB C=CCN1C(=O)/C(=N/NC(=O)c2cccc(I)c2)c2ccccc21 15930537 DXNAWCXZBAYUMG-CAPFRKAQSA-N 431.233 2.958 50 40 IFGB O=C1OC(=O)[C@H]2[C@H]1[C@H]1C[C@H]2[C@@H]2[C@H](c3cc(Cl)ccc3O)c3sc(=O)[nH]c3S[C@H]12 100211358 VFAWHSQATVLVIT-QFWOYFARSA-N 435.910 2.983 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@H]3C[C@H](Br)[C@@H](Br)C[C@H]3C2=O)cc1 100826475 PESPVOFYLHXLOG-USZNOCQGSA-N 431.080 2.811 50 40 IFGB COc1ccc(S(=O)(=O)N(CC(=O)N/N=C\c2ccco2)Cc2ccccc2)cc1C 107998121 NMVHYCVCWPDVTN-UCQKPKSFSA-N 441.509 2.938 50 40 IFGB CCc1ccccc1NC(=O)COC(=O)CCC(=O)NNC(=O)c1ccc(Cl)cc1 139092998 BPEMBEDZJDYSMB-UHFFFAOYSA-N 431.876 2.626 50 40 IFGB O=C(CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccccc1)N/N=C/c1ccncc1 409010022 JEGIQRAPMUNYDS-ZVHZXABRSA-N 426.473 2.562 50 40 IFGB O=C(Cc1cccc2ccccc12)N/N=C/c1ccc(OCC(=O)N2CCOCC2)cc1 409020185 MNIPFOMTPCHBEB-YZSQISJMSA-N 431.492 2.770 50 40 IFGB CCc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NC(C)C)cc2Cl)cc1 409174160 LRMBLUZTVVMEMR-WYMPLXKRSA-N 444.919 2.895 50 40 IFGB Cc1ccc(CNC(=O)C(=O)N/N=C/c2ccccc2OCC(=O)Nc2ccccc2)cc1 409261825 DHHUBXVAPNVTRR-JVWAILMASA-N 444.491 2.779 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)cc1OC 20493207 LMVHAKOBLGCALK-FYJGNVAPSA-N 439.921 2.664 50 40 IFGB O=C(CN1CCc2ccccc2C1)N/N=C/c1ccc(OCC(=O)N2CCCCC2)cc1 59953647 XOEZJJMJVHORLQ-WGOQTCKBSA-N 434.540 2.586 50 40 IFGB COC(=O)c1ccc(C(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)o1 89406819 WVRDMXKLZIKZAK-UHFFFAOYSA-N 430.420 2.994 50 40 IFGB COc1cc(Br)c(Br)c(/C=N/NC(=O)c2cc(C)n[nH]2)c1O 13844395 UCEYHMZSFXQRJN-FZSIALSZSA-N 432.072 2.721 50 40 IFGB COC(=O)c1ccc(/C=N/NC(=O)CN(c2cccc3ccccc23)S(C)(=O)=O)cc1 19955245 ACHCBXVTMBLFOI-OEAKJJBVSA-N 439.493 2.543 50 40 IFGB COc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2cccnc2)c2ccc(C)cc2)cc1 408925328 PFUOIKKJNFHODH-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(C)cc2)c(Cl)c1 409170280 VAVWYTRYUCBOMM-WYMPLXKRSA-N 430.892 2.642 50 40 IFGB Cc1cccc(C)c1N(CC(=O)NN=C1CCN(Cc2ccccc2)CC1)S(C)(=O)=O 409330536 KPVDCDRWMBGHJE-UHFFFAOYSA-N 442.585 2.838 50 40 IFGB C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc3c(s1)CCCC3)C2=O 9584745 UGMCYQCFUCNQOE-MCMMXHMISA-N 446.573 2.525 50 40 IFGB O=C(CN(Cc1ccco1)S(=O)(=O)c1ccccc1)N/N=C/c1ccccc1[N+](=O)[O-] 59435402 RERSUZZHUQKUTA-FYJGNVAPSA-N 442.453 2.529 50 40 IFGB COc1ccc(C(=O)N2CCC[C@H](C(=O)OCC(=O)/C(C#N)=C(/C)N)C2)c2ccccc12 105033864 TVJKRMZGZNMSGW-UKEODDKASA-N 435.480 2.569 50 40 IFGB Cc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccc(Br)cc3)CC2=O)c(C)c1 408645610 VBBUUVXGPSAFSX-OAHLLOKOSA-N 430.302 2.880 50 40 IFGB Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)cc1 408764716 SKRPANFBQQTZHM-IOVUBPJKSA-N 432.502 2.747 50 40 IFGB COc1cccc(/C=N/NC(=O)CSc2ccc([N+](=O)[O-])cc2)c1O[C@@H](C)C(=O)O 409249194 MUOUUNFWGSFLBH-QDBSGRMGSA-N 433.442 2.698 50 40 IFGB COc1cc(/C=N/NC(=O)CN2C[C@H](c3ccccc3)CC2=O)cc(Br)c1O 16195001 COYBLSJJKVWCQT-WPZNHYQYSA-N 446.301 2.630 50 40 IFGB CCOc1ccc(/C(C)=N/NC(=O)[C@@H](C)N(c2ccc(OC)cc2)S(C)(=O)=O)cc1 19953711 KBVVCWAIRBFLRV-QFNCUCFLSA-N 433.530 2.789 50 40 IFGB COc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccco2)Cc2ccccc2)cc1 59435395 RDLNLYDERJJYEF-HYARGMPZSA-N 427.482 2.629 50 40 IFGB O=C1OC(=O)[C@H]2[C@H]1[C@H]1C[C@H]2[C@@H]2[C@@H](c3cc(Cl)ccc3O)c3sc(=O)[nH]c3S[C@@H]12 100211354 VFAWHSQATVLVIT-DCWPCGSJSA-N 435.910 2.983 50 40 IFGB CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=C\c1ccc(OCC(=O)N2CCOCC2)cc1 409242795 VUAKGOCPISXLQU-ODLFYWEKSA-N 441.491 2.933 50 40 IFGB COc1cc(OC)cc(C(=O)NNC(=O)c2ccc(Cn3nnc4ccccc43)cc2)c1 17060775 ZDPOJWSZGCDLLM-UHFFFAOYSA-N 431.452 2.572 50 40 IFGB COc1ccc(NC(=O)[C@@H](NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc2)cc1 32853666 TZGPPUNDTZCKQK-VXKWHMMOSA-N 433.464 2.836 50 40 IFGB COc1ccc(/C=N/NC(=O)Cc2nnc(NC(=O)c3ccc(Cl)cc3)s2)cc1 408730814 ITKVBVSQQDSLIE-SRZZPIQSSA-N 429.889 3.145 50 40 IFGB Cc1ccccc1OCC(=O)N[C@H](CC(C)C)C(=O)N/N=C/c1ccc2c(c1)OCO2 408971855 MLAKTRMNTYWKCC-SZMVHAFZSA-N 425.485 2.784 50 40 IFGB Cc1ccc(OCC(=O)NNC(=O)c2ccc(Br)o2)c(Br)c1 672688 SLYSACMXFJAYCT-UHFFFAOYSA-N 432.068 2.953 50 40 IFGB CC1=C(C(=O)OC(C)(C)C)[C@]2(C(=O)Nc3ccc(Br)cc32)C(C#N)=C(N)O1 850190 SMRVBAUQWVAIOB-LJQANCHMSA-N 432.274 2.979 50 40 IFGB Cc1ccc(-c2nc(C(=O)NNS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)cs2)cc1 12739405 ZINHVPMNCUKWQT-UHFFFAOYSA-N 432.483 2.958 50 40 IFGB CCN(CC)S(=O)(=O)c1cccc(C(=O)N/N=C(\C)c2ccc3c(c2)OCCO3)c1 9140830 PFHIJZMLIZFYRV-PXLXIMEGSA-N 431.514 2.642 50 40 IFGB COCc1c(Br)c(C)nc(OCC(=O)N/N=C/c2ccccc2OC)c1C#N 59459480 OZOGGFKEPUCBCD-LSFURLLWSA-N 447.289 2.708 50 40 IFGB Cc1ccc(NC(=O)COc2cccc(/C=N/NC(=O)C(=O)NC(C)C)c2)cc1Cl 409170806 WMTOWWDTWWBFCU-FOKLQQMPSA-N 430.892 2.641 50 40 IFGB COc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)c(Br)cc1OCC(=O)O 409247266 LUPWZSRHJUVYQW-NKVSQWTQSA-N 439.237 2.753 50 40 IFGB CCc1ccc(NC(=O)COc2cccc(/C=N/NC(=O)C(=O)NCc3ccco3)c2)cc1 409260252 NIHCMSJUUVDEFK-VULFUBBASA-N 448.479 2.626 50 40 IFGB COc1cccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)CC2=O)c1 12937226 ZWWFDFMPBOFPMY-INIZCTEOSA-N 449.463 2.681 50 40 IFGB C/C(=N\NC(=O)CN(c1cccnc1)S(=O)(=O)c1ccccc1)c1ccc(F)cc1 58918614 ZNDXQUZMNIAQMV-LFVJCYFKSA-N 426.473 2.956 50 40 IFGB COc1cc(/C=N/NC(=O)C(=O)Nc2cccc(Cl)c2)cc(Br)c1O 59101792 HBLILKNCROQOIG-UFWORHAWSA-N 426.654 2.906 50 40 IFGB CCC(=O)N(NC(=O)c1ccccc1)[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1=O 100126227 KYSJQXCGCNVTPH-INIZCTEOSA-N 433.386 2.921 50 40 IFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3cc(OC)ccc3OC)CC2)cc1 409004284 BSGUSEGPNSSXDG-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB CCOc1cc(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])cc(Br)c1O 3050664 DSYBEIGKXJPNJZ-DJKKODMXSA-N 438.234 2.991 50 40 IFGB Cc1cc(Cl)ccc1OCC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12 8850754 ONTZGNUDNDOLMC-UHFFFAOYSA-N 428.876 2.779 50 40 IFGB CC1=C(C#N)C(=O)N([C@@H]2CCS(=O)(=O)C2)C(=O)/C1=C\Nc1cc(Cl)cc(Cl)c1 9477112 SCMDLKMFBYXFDI-MEFZMRIGSA-N 440.308 2.685 50 40 IFGB CCN1C(=O)/C(=N\NC(=O)Cc2ccc(OC)c(OC)c2)c2cc(Br)ccc21 101658181 NPALYOMWIKZKCI-NMWGTECJSA-N 446.301 2.896 50 40 IFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Br)cc2)C1)c1ccc(Cl)cc1 408637517 ABJWNVVUDUGDQG-GFCCVEGCSA-N 436.693 2.917 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1[N+](=O)[O-])c1cc(Cl)ccc1Cl 409027809 FKGVTKDQSQAKPF-DJKKODMXSA-N 445.284 2.818 50 40 IFGB O=C(COc1ccccc1/C=N/NC(=O)C(=O)NC1CC1)Nc1ccc(Cl)c(Cl)c1 409263575 HVTUQONRZKGSFN-AUEPDCJTSA-N 449.294 2.740 50 40 IFGB CCOC(=O)c1c(NC(=O)c2ccc(O[C@H](C)C(=O)NN)cc2)sc2c1CCCC2 958541 HQUXZPLWMUCMLH-GFCCVEGCSA-N 431.514 2.813 50 40 IFGB COc1ccc(/C=N/NC(=O)c2ccc3c(c2)OCCO3)cc1I 1437585 YXYBGNKFKWTZLX-VXLYETTFSA-N 438.221 2.835 50 40 IFGB COc1nc(Oc2cccc(/C=N/NC(=O)c3cccnc3)c2)nc(N2CCCCC2)n1 16248190 IADMFBLYPNYLLH-ZVHZXABRSA-N 433.472 2.822 50 40 IFGB CCN1C(=O)/C(=N/NC(=O)[C@H](C)n2cnc3sc4c(c3c2=O)CCCC4)c2ccccc21 103462140 IUIZOGUXUIECFI-IGVKVNPNSA-N 449.536 2.785 50 40 IFGB CCOC(=O)C1=C(C(=O)OCC)[C@@H]2C=C[C@H]1[C@H]1[C@@H](Br)[C@@H](Br)[C@H]21 104279260 BMXZYPYGMGQTHX-GSNAKJBFSA-N 434.124 2.998 50 40 IFGB Cc1ccc(Cl)cc1NC(=O)COc1ccccc1/C=N/NC(=O)C(=O)NCC(C)C 409162273 ZGQIJMQQELUHSN-BRJLIKDPSA-N 444.919 2.888 50 40 IFGB C/C(=N/NC(=O)c1ccc(C(=O)N/N=C(/C)c2ccc(O)cc2)nc1)c1ccc(O)cc1 16136628 PUIQJPLFWNHZJU-CPZPTNFUSA-N 431.452 2.801 50 40 IFGB COc1cccc(N2C[C@H](C(=O)NNC(=O)c3cc4c(s3)CC[C@H](C)C4)CC2=O)c1 40058411 UJSKYSPHQWIUAM-DZGCQCFKSA-N 427.526 2.696 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@@H]3[C@@H]4C[C@@H]([C@H](Br)[C@@H]4Br)[C@@H]3C2=O)cc1 100747824 KXHQMAGGCJSUCQ-FXGIYHRPSA-N 443.091 2.667 50 40 IFGB CS(=O)(=O)N(CCc1ccccc1)CC(=O)N/N=C\c1ccc(Cl)cc1Cl 107582618 QASGBLSKQGAPPD-MTJSOVHGSA-N 428.341 2.948 50 40 IFGB CCOc1ccc(/C=N/NC(=O)Cc2nnc(NC(=O)c3ccccc3)s2)cc1O 3045160 NRICXODWAJNLDK-CIAFOILYSA-N 425.470 2.588 50 40 IFGB O=C(N/N=C/c1ccc(O)c(I)c1)c1cncc(Br)c1 3155796 PCLAOWTYSMBLNV-YAXRCOADSA-N 446.042 2.918 50 40 IFGB CCOc1cc(/C=N\NC(=O)c2cnccn2)c(Br)c(Br)c1O 8842979 MTJCRXXWMPWYRB-SWNXQHNESA-N 444.083 2.870 50 40 IFGB O=C(Cn1c(C(F)(F)F)nc2ccccc21)NNC(=O)c1cc(-c2ccccc2)n[nH]1 9507984 QJBIGICFCWGFSW-UHFFFAOYSA-N 428.374 2.906 50 40 IFGB C=CCOc1cccc(/C=N/NC(=O)CN(c2ccc(OCC)cc2)S(C)(=O)=O)c1 20210650 VYLWWTURPPXDOY-PXLXIMEGSA-N 431.514 2.566 50 40 IFGB COc1ccc(C)cc1N(CC(=O)N/N=C/c1ccccc1C(F)(F)F)S(C)(=O)=O 20212166 HOLCJBRSACZKRV-FOKLQQMPSA-N 443.447 2.939 50 40 IFGB Cc1c(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cnn1-c1ccc(Br)cc1 25092153 COBOCPACSUTTOV-UHFFFAOYSA-N 444.245 2.926 50 40 IFGB N#C/C(=C\c1c(Oc2ccccc2F)nc2ccccn2c1=O)C(=O)NC[C@@H]1CCCO1 2411896 ZXTIAHYEMDEVSK-STTHAQSSSA-N 434.427 2.828 50 40 IFGB Cc1cc(C)c(C)c(S(=O)(=O)N[C@@H](C(=O)NNC(=O)c2cccs2)C(C)C)c1C 8877273 XYLREALZDOPJOU-QGZVFWFLSA-N 437.587 2.746 50 40 IFGB CCOCCOc1cccc(C(=O)NNC(=O)CCC(=O)Nc2ccc(OCC)cc2)c1 10216472 RLTRBHOVDGNQPR-UHFFFAOYSA-N 443.500 2.681 50 40 IFGB Cc1cc(S(=O)(=O)NNC(=O)CN2CCCc3ccccc32)ccc1Br 12534180 SPIYZYLZDDTZJL-UHFFFAOYSA-N 438.347 2.520 50 40 IFGB CCCCOc1ccc(C(=O)NNC(=O)c2cccc(NS(=O)(=O)CC)c2)cc1OC 12778703 JVBGWXWCIRHZOY-UHFFFAOYSA-N 449.529 2.711 50 40 IFGB C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1occc1CS(=O)(=O)c1ccccc1 22021430 MWNNPCSLYYHTDY-AWEZNQCLSA-N 446.456 2.621 50 40 IFGB Cc1ccc(NC(=O)CCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c(C)c1 138979103 PFXRKIZPJPTCRZ-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1OCC(=O)Nc1cc(C)ccc1C 409152910 LNEBLSCHXDKDND-BHGWPJFGSA-N 430.892 2.561 50 40 IFGB COc1ccc(NC(=O)COc2ccc([C@H]3C(C#N)=C(N)Oc4[nH]nc(C)c43)cc2)cc1 9715939 VCZLRZOXTVMNRL-NRFANRHFSA-N 431.452 2.962 50 40 IFGB COc1cc(/C=N/NC(=O)Cn2ccc(C(F)(F)F)n2)ccc1OC(=O)c1ccco1 3576944 VGOIFZFNNXSGGN-AUEPDCJTSA-N 436.346 2.873 50 40 IFGB CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)c1ccncc1 15272761 RQZHNIGPZMZXPY-HNNXBMFYSA-N 441.340 2.701 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2ccc(C(C)C)cc2)S(C)(=O)=O)cc1[N+](=O)[O-] 20209110 BXTORLWGNONHRI-CIAFOILYSA-N 448.501 2.643 50 40 IFGB CCc1ccccc1N(CC(=O)NN=C1CCN(C)CC1)S(=O)(=O)c1ccc(C)cc1 408859362 STWSCVSOXYVGJS-UHFFFAOYSA-N 442.585 2.951 50 40 IFGB COc1cc(NC(=O)C/C(C)=N/NC(=O)C(=O)NC2CCCCC2)c(OC)cc1Cl 12629109 BYRBTEWOZLESMH-WYMPLXKRSA-N 438.912 2.627 50 40 IFGB CCCN1C(=O)/C(=N\NC(=O)[C@@H]2COc3ccccc3O2)c2cc(Br)ccc21 13617804 FCSWSAZZLFDENR-CZEALIGGSA-N 444.285 2.866 50 40 IFGB CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c1 24399694 MLKYYEQBNBZXMK-UHFFFAOYSA-N 440.500 2.875 50 40 IFGB N#CC1=C(N)N(N2CCOCC2)C2=C(C(=O)CCC2)[C@@H]1c1cccc(Br)c1 691509 ALGQGYYHQZNSBA-GOSISDBHSA-N 429.318 2.796 50 40 IFGB C/C(Cn1nc([N+](=O)[O-])cc1C)=N\NC(=O)c1ccccc1I 8456358 MJOAEHQMWUUVCI-CXUHLZMHSA-N 427.202 2.510 50 40 IFGB CC1=C(C#N)C(=O)N(CCN2CCOCC2)C(=O)/C1=C\Nc1ccccc1C(F)(F)F 9420960 WZSHJDYZOUVHNZ-SSZFMOIBSA-N 434.418 2.542 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)CNc2ccc(I)cc2)c1 59720889 FRBDVZLUTOYGAW-KEBDBYFISA-N 439.253 2.871 50 40 IFGB CC[C@H](Oc1cc(Cl)ccc1Cl)C(=O)NNC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 102201767 APTZUNALKUCBEW-LGBUSMRCSA-N 427.284 2.821 50 40 IFGB COc1ccc(OC)c([C@@H]2C(C#N)=C(N)N(N3CCOCC3)C3=C2C(=O)CC(C)(C)C3)c1 691472 JOEHVTKRDJFMEX-OAQYLSRUSA-N 438.528 2.687 50 40 IFGB O=C(CCCN1C(=O)S/C(=C\c2ccccc2)C1=O)NNC(=O)c1ccccc1O 1770586 SGTBLOLIOXEEQZ-LGMDPLHJSA-N 425.466 2.670 50 40 IFGB O=C(CSc1nnc(Cc2ccc(Br)cc2)o1)NNC(=O)c1ccccc1 10475672 DIKHVBQAEYDLDV-UHFFFAOYSA-N 447.314 2.976 50 40 IFGB CCCCCn1nc(C(=O)NNC(=O)c2cccnc2SC)c2ccccc2c1=O 12922413 SLAUSFCVZKHSGL-UHFFFAOYSA-N 425.514 2.778 50 40 IFGB COc1ccccc1/C=N/NC(=O)CN(Cc1ccco1)S(=O)(=O)c1ccccc1 59443764 NHWKOBCEAJJXTA-HYARGMPZSA-N 427.482 2.629 50 40 IFGB O=c1c2ccccc2ncn1S(=O)(=O)c1ccc(N(CCCl)CCCl)cc1 1757187 VDKWSJASSJCPOG-UHFFFAOYSA-N 426.325 2.918 50 40 IFGB Cc1cc(C)nc(NNC(=O)c2ccc(C)c(S(=O)(=O)NCc3ccccc3)c2)n1 12775670 JRMAPSJWQRGTBA-UHFFFAOYSA-N 425.514 2.637 50 40 IFGB O=C(CN1CCOCC1)N/N=C/c1cc(Br)ccc1OCc1ccccc1 15019889 MEBGMBBRPCQVNH-LPYMAVHISA-N 432.318 2.810 50 40 IFGB C[C@@H](NC(=O)Nc1ccccc1)C(=O)NNC(=O)Cc1csc(-c2ccc(F)cc2)n1 39996914 PCDSHGMFEYZJLB-CYBMUJFWSA-N 441.488 2.849 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)N3CCCCCC3)cc2)cc1 58880672 ZNLWVVPKDMVNKY-PCLIKHOPSA-N 436.512 2.865 50 40 IFGB COc1ccccc1N1CCN(C(=O)C(=O)N/N=C/c2ccc(Cl)cc2Cl)CC1 59434034 DXCYHAGTGWUEKA-YDZHTSKRSA-N 435.311 2.801 50 40 IFGB O=C(N/N=C/c1ccc2c(c1)OCO2)[C@H]1CC(=O)N(c2ccc(Br)cc2)C1 409173191 HKRGHHPHPHEVJZ-UWPAOYMWSA-N 430.258 2.681 50 40 IFGB Cc1cc(=O)c(C(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)nn1-c1ccccc1 10600588 PNNXOYKZPPQZBT-UHFFFAOYSA-N 445.504 2.668 50 40 IFGB COc1ccc(C(=O)NNC(=O)C[C@H]2Sc3ccc(Cl)cc3NC2=O)cc1OC 12869161 SPRXCAVOKAYGJF-MRXNPFEDSA-N 435.889 2.621 50 40 IFGB Cc1cc(/C=N\NC(=O)CN2CCOCC2)c(C)n1-c1sc2c(c1C#N)CCCC2 15226303 BBGWUQJCDVEHMC-CFRMEGHHSA-N 425.558 2.688 50 40 IFGB COc1cc(C(=O)Nc2ccccc2C(=O)NNC(=O)c2ccco2)cc(OC)c1OC 409001794 KMGDIZOFTQRPKI-UHFFFAOYSA-N 439.424 2.633 50 40 IFGB Cc1cc(Br)ccc1SCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 2662816 YGJNPLRTLVKHKS-OAHLLOKOSA-N 437.315 2.837 50 40 IFGB O=C(O)COc1ccc(Br)cc1/C=N\NC(=O)Cc1ccccc1[N+](=O)[O-] 33489343 SRPSRNBUCZHSNP-OCKHKDLRSA-N 436.218 2.514 50 40 IFGB CCOc1ccc(/C=N/NC(=O)[C@H](C)N(c2ccc(OCC)cc2)S(C)(=O)=O)cc1 408925218 NTDHGOXSZWGDKD-PZBNQXIHSA-N 433.530 2.789 50 40 IFGB COC(=O)c1ccc(/C=N\NC(=O)c2nn(-c3ccc(C)c(C)c3)c(=O)c(C#N)c2C)cc1 409060891 AAJIQUVGFAJKEI-ZMFRSBBQSA-N 443.463 2.580 50 40 IFGB COc1cc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)cc(OC)c1OC 409170512 WAOMEVVVPGEJNV-KZKMUKRCSA-N 425.485 2.832 50 40 IFGB CCOC(=O)Cn1c(C)c(/C=N/NC(=O)Cc2ccc3c(c2)OCCO3)c2ccccc21 409366830 YZHSUKZYAIRXMC-AFUMVMLFSA-N 435.480 2.977 50 40 IFGB COc1ccccc1NC(=O)COc1ccc(/C=N/NC(=O)c2ccncc2)cc1OC 1093234 TVZKDUIUPHANDC-AFUMVMLFSA-N 434.452 2.880 50 40 IFGB O=C(CN(c1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-])N/N=C/c1ccco1 3664130 OZXZPHGLALSPKY-DEDYPNTBSA-N 428.426 2.533 50 40 IFGB CCOc1cc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc(Br)c1OC 9392543 ICRYGLQNVQLQOE-UHFFFAOYSA-N 437.246 2.660 50 40 IFGB CCOc1ccccc1OCC(=O)N/N=C/c1cc(I)ccc1O 20100774 IAJMCOLAWNNWLL-VXLYETTFSA-N 440.237 2.925 50 40 IFGB C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1occc1CS(=O)(=O)c1ccccc1 22024168 CUHBSCQKOUVCJI-CQSZACIVSA-N 446.456 2.621 50 40 IFGB Cc1cccc(C(=O)Nc2ccc(C(=O)NNC(=O)[C@H]3[C@@H](C(=O)O)[C@H]4C=C[C@H]3C4)cc2)c1 106213118 VRKDMKSKLRJJPG-FEHORTKBSA-N 433.464 2.531 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccc(C)c(Cl)c1 409174662 WSODOOKDBJYYTM-WYMPLXKRSA-N 430.892 2.642 50 40 IFGB O=C(NNC(=O)c1cccc(Cl)c1)c1ccc(S(=O)(=O)N2CCCCCC2)cc1 3452037 STEXKTPYJVQIGQ-UHFFFAOYSA-N 435.933 2.980 50 40 IFGB CCOC(=O)[C@@H](NC(C)=O)[C@@H](OC(C)=O)c1cccc(N(CCCl)CCCl)c1 6089434 KAEOBVIVPGBJCY-ROUUACIJSA-N 433.332 2.643 50 40 IFGB COc1ccc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1Br 12579471 IYUBDHLGRKDDLF-UHFFFAOYSA-N 439.262 2.558 50 40 IFGB CC1(CC(=O)N/N=C/c2ccc(OCC(=O)Nc3ccccc3Cl)cc2)OCCO1 28214486 SVQLPRWPJGEPHG-YDZHTSKRSA-N 431.876 2.961 50 40 IFGB O=C(N/N=C/c1ccc2c(c1)OCO2)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 1022536 SVDVWXFSORBBEK-WSDLNYQXSA-N 449.916 2.620 50 40 IFGB COc1ccc(OCC(=O)N/N=C2\C(=O)N(C)c3c(C)cc(Br)cc32)cc1 12445802 KOKNURCVCNCKJZ-XLNRJJMWSA-N 432.274 2.642 50 40 IFGB COc1cccc(-c2nc(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cs2)c1OC 12917173 RYUSCRNESHAJMY-UHFFFAOYSA-N 428.426 2.810 50 40 IFGB O=C(/C=C/c1ccc(Cl)cc1)NNC(=O)CCN1CCN(Cc2ccccc2)CC1 19371769 ZNYROJSWWQNNLJ-DHZHZOJOSA-N 426.948 2.709 50 40 IFGB CCOc1ccc([C@@H](O)CCC(=O)N/N=C/c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 58892650 COVSNFHFRHYGEM-ZFJBLLOBSA-N 431.445 2.975 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccn1)c1cc(C(F)(F)F)ccc1Cl 408906547 HBMJYBMOCRAXFW-LSFURLLWSA-N 434.827 2.670 50 40 IFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1cc(OC)c(O)c([N+](=O)[O-])c1)c1ccccc1 408982542 YNHGTXCETJCUDA-VRCTWVPOSA-N 430.417 2.637 50 40 IFGB COc1cccc(/C=N\NC(=O)c2nn(-c3cccc(C)c3)c(=O)c(C#N)c2C)c1OC 409058075 SHPMKJDFTLQOMO-MXAYSNPKSA-N 431.452 2.502 50 40 IFGB Cc1cccc(C(=O)Nc2ccc(C(=O)NNC(=O)[C@@H]3[C@@H](C(=O)O)[C@H]4C=C[C@H]3C4)cc2)c1 106213123 VRKDMKSKLRJJPG-FVCZOJIISA-N 433.464 2.531 50 40 IFGB CCc1ccccc1NC(=O)CCC(=O)OCC(=O)NNC(=O)c1ccccc1Cl 408644149 DVHLWNYJBUKAHE-UHFFFAOYSA-N 431.876 2.626 50 40 IFGB COc1ccc(NC(=O)N/N=C\c2cn(CC(=O)N3CCOCC3)c3ccccc23)cc1 408962192 QUGZTOPRQVVRLV-OYKKKHCWSA-N 435.484 2.664 50 40 IFGB Cc1ccc(-n2nc(C(=O)N/N=C\c3cccc([N+](=O)[O-])c3)c(C)c(C#N)c2=O)cc1C 409073393 YMNTZGPJRZZQLJ-MSXFZWOLSA-N 430.424 2.702 50 40 IFGB COc1cc(/C=N/NC(=O)Cn2ccc(C(F)(F)F)n2)ccc1OC(=O)c1cccnc1 3576946 QLMXGAGWYQWGHI-KIBLKLHPSA-N 447.373 2.675 50 40 IFGB O=C(CSc1nnc(-c2cccnc2)n1Cc1ccccc1)NNC(=O)c1ccccc1 9980536 HUKVKWUENIXBOL-UHFFFAOYSA-N 444.520 2.942 50 40 IFGB COc1cc(Br)cc(/C=N/NC(=O)CNC(=O)OCc2ccccc2)c1O 15228222 PXWIPQNHCABQMP-ZVBGSRNCSA-N 436.262 2.540 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)CN(c2cccnc2)S(=O)(=O)c2ccccc2)cc1 18191691 AATCVFUPKWSQCO-JJIBRWJFSA-N 438.509 2.826 50 40 IFGB C/C(=N\NC(=O)CN(c1ccc(Cl)cc1C)S(C)(=O)=O)c1ccc([N+](=O)[O-])cc1 408776612 XGOFHBGORDMKKU-DEDYPNTBSA-N 438.893 2.863 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)NC2CC2)cc1Cl)Nc1ccccc1Cl 409256937 QSCYEHWQJBADRA-AUEPDCJTSA-N 449.294 2.740 50 40 IFGB CC(C)c1ccc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cc1 8945729 MDNWALMEDCDMKD-UHFFFAOYSA-N 445.570 2.854 50 40 IFGB CC1=C(C#N)C(=O)N([C@H]2CCS(=O)(=O)C2)C(=O)/C1=C\Nc1cc(Cl)cc(Cl)c1 9477114 SCMDLKMFBYXFDI-XTIFCCNPSA-N 440.308 2.685 50 40 IFGB COc1ccc(Cl)cc1C(=O)NNC(=O)CN(Cc1cccs1)C[C@H]1CCCO1 29112697 MLXVOLGZDXNPFW-OAHLLOKOSA-N 437.949 2.852 50 40 IFGB Cc1ccc(C)c(N(CC(=O)N/N=C/c2ccccc2Br)S(C)(=O)=O)c1 408876472 PBLODJURKUPWKG-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB CCOc1ccc(/C=N/NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)cc1 408993607 WSDTVQUBIXTBJW-ZUICHYAESA-N 435.484 2.796 50 40 IFGB O=C(N[C@@H](C(=O)NN=Cc1ccccc1)c1n[nH]c(=O)c2ccccc12)c1ccccc1 13142886 INIJLTOZUZPYLC-OAQYLSRUSA-N 425.448 2.545 50 40 IFGB Cc1ccccc1NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)NC2CCCCC2)cc1 58882097 DJRFPFIBVSYFHJ-MFKUBSTISA-N 436.512 2.912 50 40 IFGB COc1ccc(C(=O)Nc2nnc(CC(=O)N/N=C/c3ccc(N(C)C)cc3)s2)cc1 1500612 MDNFKDKGYCVRHD-LPYMAVHISA-N 438.513 2.558 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@@H]3[C@@H]4C[C@H]([C@@H]3C2=O)[C@@H](Br)[C@@H]4Br)cc1 3659504 KXHQMAGGCJSUCQ-KISRQWFGSA-N 443.091 2.667 50 40 IFGB CCOc1ccccc1OCCC(=O)NNC(=O)COc1ccc(Br)cc1 9222479 NYZCLLBDKQPMDF-UHFFFAOYSA-N 437.290 2.843 50 40 IFGB C[C@@H]1CCCN(c2ccc(C(=O)NNC(=O)COc3ccccc3F)cc2[N+](=O)[O-])C1 9910601 HWRDQHXRYWPVCN-CQSZACIVSA-N 430.436 2.810 50 40 IFGB CCOc1ccc(/C=N/NC(=O)CN(c2ccc(C)cc2)S(C)(=O)=O)cc1OCC 59503048 PWLYAZWDVMQUKC-HYARGMPZSA-N 433.530 2.709 50 40 IFGB O=C(Cc1ccccc1)N/N=C(\c1nc2ccc([N+](=O)[O-])cc2nc1O)[C@@H](O)c1ccco1 104291176 CHTOQGYSOSVQCR-SWVLWACCSA-N 447.407 2.633 50 40 IFGB O=C(N/N=C/[C@@H]1C(=O)NC(=S)N(c2ccccc2)C1=O)c1ccc(Cl)c(Cl)c1 408742001 UDVTZFQEPPPUPW-PITUFAOZSA-N 435.292 2.773 50 40 IFGB Cc1cc(C)cc(N(CC(=O)N/N=C/c2cccc(Br)c2)S(C)(=O)=O)c1 408769659 YQNBTONYEMUXMR-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB CCOc1cc(/C=C(\C#N)C(=O)NCc2ccc(OC)cc2OC)cc([N+](=O)[O-])c1O 408876464 OZZSKCBNEDOAHC-VIZOYTHASA-N 427.413 2.940 50 40 IFGB COc1cc(/C=C(\C#N)C(=O)N2CCOCC2)ccc1OCC(=O)Nc1ccc(C)cc1 409008648 ZHIVHIJJKCNXIX-CPNJWEJPSA-N 435.480 2.787 50 40 IFGB O=C(Cc1ccccc1Cl)N/N=C1/C(=O)Nc2ccc(I)cc21 2380885 HDWVGNREEMOVRY-UHFFFAOYSA-N 439.640 2.960 50 40 IFGB COc1cc([C@H]2[C@H](Cl)C(=O)N2NC(=O)c2ccc(N)cc2)cc(Br)c1O 5733325 PKBYULAWXQAMBX-KBPBESRZSA-N 440.681 2.581 50 40 IFGB O=C(CN(c1ccccc1)S(=O)(=O)c1ccccc1)N/N=C/c1ccc2c(c1)OCO2 19947706 MLASCZPEAZJBTF-OEAKJJBVSA-N 437.477 2.761 50 40 IFGB C/C(=N\NC(=O)CN(c1ccc(Br)cc1)S(C)(=O)=O)c1cccs1 20209880 HVPUNGYOXHONRE-GZTJUZNOSA-N 430.349 2.817 50 40 IFGB NC(=O)CCn1cc(/C=N/NC(=O)c2cc(Br)ccc2O)c2ccccc21 33777832 OBTRRGSKHKKTES-LSHDLFTRSA-N 429.274 2.749 50 40 IFGB Cc1cccc(N(CC(=O)N/N=C/c2cccc(Br)c2)S(C)(=O)=O)c1C 57411702 WTBARIFSFVRQAH-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB Cc1cccc[n+]1[C@H]1[C@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C([C-](C#N)C#N)N[C@]1(O)C1CC1 100023559 VPFRCQCGNFASQJ-NHTMILBNSA-N 440.463 2.617 50 40 IFGB COc1ccccc1N1C(=O)NC(=O)[C@H](/C=N/NC(=O)c2ccc(Cl)cc2Cl)C1=O 408533553 KBCLWVJPMUFTBN-AMLNBPPMSA-N 449.250 2.617 50 40 IFGB CCOc1ccc(/C=N/NC(=O)CN(c2ccc(CC)cc2)S(C)(=O)=O)cc1OCC 409028286 LCKMAYQHRBFMKE-HZHRSRAPSA-N 447.557 2.963 50 40 IFGB CCc1ccccc1NC(=O)COc1ccc(/C=N/NC(=O)C(=O)NCc2ccco2)cc1 409254392 XEZJFEWSVUFVLC-VULFUBBASA-N 448.479 2.626 50 40 IFGB COc1ccc(C(=O)NC(=S)NNC(=O)c2c(-c3ccccc3)noc2C)cc1OC 2256326 VTKJAYVVGKZWNK-UHFFFAOYSA-N 440.481 2.617 50 40 IFGB COc1ccc(C=NNC(=O)CN2CCN(Cc3ccccc3)CC2)cc1Br 22939691 QCLGUCXHTZJQFZ-UHFFFAOYSA-N 445.361 2.726 50 40 IFGB Cc1cccc[n+]1[C@@H]1[C@@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C([C-](C#N)C#N)N[C@@]1(O)C1CC1 169298845 VPFRCQCGNFASQJ-QPTUXGOLSA-N 440.463 2.617 50 40 IFGB CCOC(=O)c1c(NC(=O)C(=O)N/N=C/c2cccc(OC)c2O)sc2c1CCCC2 13769208 DQMLKUQCVHLRIW-SSDVNMTOSA-N 445.497 2.607 50 40 IFGB Cc1ccccc1C[C@@H]1S/C(=C(\C#N)C(=O)NN2CCOCC2)N(c2ccccc2)C1=O 31906036 DYDVASCUWATGAN-VLBGROSNSA-N 448.548 2.785 50 40 IFGB O=C(NNC(=O)[C@@H](c1ccc(Cl)cc1Cl)N1CCOCC1)c1ccccc1F 72302643 MHFVGQOWBBVRQV-QGZVFWFLSA-N 426.275 2.967 50 40 IFGB CCOC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N/N=C/c1ccc(OC(C)=O)cc1 408999240 QESBVSUMZJDVSV-RNRKLAHPSA-N 436.468 2.901 50 40 IFGB CCCOc1ccc([C@@H]2C(C#N)=C(N)OC(CC(=O)OC)=C2C(=O)OC)cc1OCC 2269486 GWVBYPKSBRBTSL-LJQANCHMSA-N 430.457 2.672 50 40 IFGB CCc1nc2ccccc2n1CC(=O)NNC(=O)CCOc1cccc(Br)c1 9285097 JPLQTXDLIQDHDQ-UHFFFAOYSA-N 445.317 2.978 50 40 IFGB O=C(COC(=O)c1ccc(OCc2ccccc2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1 13150102 PRCMUANJLMXJKG-UHFFFAOYSA-N 449.419 2.792 50 40 IFGB O=C(N/N=C/c1ccc(OCC(=O)N2CCOCC2)cc1)c1cc2ccccc2cc1O 16157595 IPUHTVPYEJOUKE-MFKUBSTISA-N 433.464 2.547 50 40 IFGB COc1ccc(C)cc1N(CC(=O)N/N=C/c1ccco1)S(=O)(=O)c1ccccc1 19926433 UNJFNCUUIFYIRL-HYARGMPZSA-N 427.482 2.942 50 40 IFGB C[C@H](S[C@@H](C)C(=O)N/N=C\c1ccc(C#N)cc1)C(=O)N/N=C\c1ccc(C#N)cc1 104379530 SCGSXWLYHQYFCW-KOVJWTPHSA-N 432.509 2.541 50 40 IFGB COc1cc([C@@H]2[C@H](Cl)C(=O)N2NC(=O)c2ccc(N)cc2)cc(Br)c1O 5733322 PKBYULAWXQAMBX-UONOGXRCSA-N 440.681 2.581 50 40 IFGB CC(=O)Nc1ccc(C(=O)N/N=C\c2ccc(OCC(=O)O)c(Br)c2)cc1 35352070 JLEJVLXKORKYNZ-UKWGHVSLSA-N 434.246 2.635 50 40 IFGB COc1cccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(Br)cc3)C2)c1OC 409155395 QXVIHPLDIFNEON-DACUGSJHSA-N 446.301 2.970 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2Cl)c(Cl)c1 409156314 NLKQHMCADPFFDY-AUEPDCJTSA-N 437.283 2.597 50 40 IFGB CCc1ccccc1NC(=O)CNC(=O)NNC(=O)[C@@H](C)Nc1nc2ccccc2s1 10608633 ABZZJUPRWZMIPL-CYBMUJFWSA-N 440.529 2.628 50 40 IFGB Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3ccccc3O)cc2)c1 17576571 XWSXPOHSFASTLG-UHFFFAOYSA-N 439.493 2.885 50 40 IFGB COc1ccc(NC(=O)NNC(=O)c2ccc(=O)n(Cc3ccc(C)cc3)c2)c(OC)c1 23136203 XPWREMWFRZOIAG-UHFFFAOYSA-N 436.468 2.689 50 40 IFGB COc1cccc(/C=N\NC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1OC 31911631 SWDRFBFKQNMSIE-OYKKKHCWSA-N 430.936 2.625 50 40 IFGB O=C(NNC(=O)c1c[nH]c2ccccc12)c1cn(-c2ccccc2Br)nn1 48345674 XEKNVNWGVUSPAO-UHFFFAOYSA-N 425.246 2.586 50 40 IFGB CCOC(=O)C1=C(C(=O)OCC)[C@@H]2C=C[C@@H]1[C@H]1[C@H](Br)[C@H](Br)[C@H]21 104279253 BMXZYPYGMGQTHX-FFTZXLJSSA-N 434.124 2.998 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1Cl)c1cccc(Cl)c1 408873235 PDVBWHWVUDPOOH-DJKKODMXSA-N 445.284 2.818 50 40 IFGB O=C(COc1cccc(/C=N/NC(=O)C(=O)NC2CC2)c1)Nc1ccc(Cl)c(Cl)c1 409273313 XBNCUIGXEQFACN-AUEPDCJTSA-N 449.294 2.740 50 40 IFGB COc1ccccc1NS(=O)(=O)c1cccc(C(=O)N/N=C/c2ccc(O)c(O)c2)c1 4529029 WORMBJCOTTVYTE-LPYMAVHISA-N 441.465 2.671 50 40 IFGB O=C(CN(c1ccc(F)cc1)S(=O)(=O)c1ccc2c(c1)OCCO2)NN=C1CCCC1 9850386 FTTUCASDXOYIEJ-UHFFFAOYSA-N 447.488 2.838 50 40 IFGB CCOC(=O)C1=C(C)NC(SCC(=O)OC)=C(C#N)[C@@H]1c1ccc(C(=O)OC)cc1 100589751 FSPIIMLVWZQWBJ-SFHVURJKSA-N 430.482 2.638 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc2c(c1)OCO2)c1cccc(Cl)c1Cl 408923274 VMAGGRCNWQBNKI-DNTJNYDQSA-N 444.296 2.638 50 40 IFGB CCOc1cc(C(=O)N/N=C\c2cc(Cl)c(OCC(=O)O)c(OC)c2)ccc1OC 409315279 ISEZNUXMOHOQLB-YVNNLAQVSA-N 436.848 2.983 50 40 IFGB Cc1ccc(C)c(N(CC(=O)NN=C2CCN(Cc3ccccc3)CC2)S(C)(=O)=O)c1 409326702 DNHSJSFKCLNETH-UHFFFAOYSA-N 442.585 2.838 50 40 IFGB C/C(=N/NC(=O)c1ccc(C(=O)N/N=C(/C)c2ccccc2O)nc1)c1ccccc1O 16136630 YNMFWMZNXDUSHR-CPZPTNFUSA-N 431.452 2.801 50 40 IFGB Cc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1NS(C)(=O)=O 40058530 KOOJMBFTVXWFPZ-HNNXBMFYSA-N 441.509 2.748 50 40 IFGB Cc1cccc(C(=O)Nc2ccc(C(=O)NNC(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C(=O)O)cc2)c1 409383272 VRKDMKSKLRJJPG-CPLUKWAASA-N 433.464 2.531 50 40 IFGB CCCn1nc(C(=O)NNC(=O)COc2ccc(Cl)cc2C)c2ccccc2c1=O 12987871 SSQCXKSPYNZOIF-UHFFFAOYSA-N 428.876 2.608 50 40 IFGB CCOc1cccc(-c2c(C(=O)N/N=C(\C)c3ccc(C)cc3)nnn2-c2nonc2N)c1 13811240 RGDTWORICVTGPX-ZVHZXABRSA-N 446.471 2.761 50 40 IFGB CC(C)CNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccccc2Cl)c1 409168649 NPEMZKUGAZRXLL-WYMPLXKRSA-N 430.892 2.580 50 40 IFGB O=C(N/N=C1/C(=O)N(CCc2ccccc2)c2ccccc21)[C@H]1COc2ccccc2O1 9046461 PHWOUAMHAIOCET-NJGKLKBPSA-N 427.460 2.936 50 40 IFGB CC(C)C(=O)NNC(=O)CSc1nnc2c3c4c(sc3nc(C3CC3)n12)CCCC4 13502569 PBQBZYXGKLMCHZ-UHFFFAOYSA-N 444.586 2.991 50 40 IFGB Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccccc3O)c2)c1 17575599 XEQOKLYLCIZARJ-UHFFFAOYSA-N 425.466 2.576 50 40 IFGB CCc1ccc(-n2nc(C(=O)N/N=C\c3ccc(OC)cc3OC)c(C)c(C#N)c2=O)cc1 409051410 CFVMWYJNPQRYBW-WGARJPEWSA-N 445.479 2.756 50 40 IFGB Cc1ccc(Cl)cc1NC(=O)COc1ccc(/C=N/NC(=O)C(=O)NCC(C)C)cc1 409150182 AECBMOPTJYXUNW-BRJLIKDPSA-N 444.919 2.888 50 40 IFGB CCOC(=O)/C(C#N)=C/c1c(N2CCN(c3ccccc3)CC2)nc2c(C)cccn2c1=O 2202216 OMTGVARLLDDOQO-KNTRCKAVSA-N 443.507 2.800 50 40 IFGB COc1cc(C(=O)NNC(=S)NC(=O)/C=C/c2ccc(Cl)cc2)cc(OC)c1OC 2232248 DJPLMBILMAXOPY-RMKNXTFCSA-N 449.916 2.715 50 40 IFGB C/C(=N\NC(=O)C[C@H]1NC(Cc2ccccc2)=NNC1=O)c1ccc(Cl)cc1Cl 8934214 RTDGJNTYPFIARX-FQIOEHTJSA-N 432.311 2.868 50 40 IFGB CC[C@@H](C)C(=O)N(NC(=O)c1ccccc1)[C@@H]1CC(=O)N(c2cc(C)ccc2OC)C1=O 18223067 OZMXKHPNQBEBDH-VQIMIIECSA-N 437.496 2.855 50 40 IFGB O=C1C(NNC(=O)c2cccc(O)c2)=C/C(=N/S(=O)(=O)c2ccccc2)C2=C1CC=CC2 101181425 NDFNGXXDPLXXRD-QOMWVZHYSA-N 449.488 2.570 50 40 IFGB O=C(/C=C1\Nc2ccccc2NC1=O)N/N=C/c1cc2c(cc1Br)OCO2 408722463 UNJKRKJHNAYZFD-NKMUMMKQSA-N 429.230 2.576 50 40 IFGB COc1cc(/C=N/NC(=O)c2cccc3ccccc23)ccc1OCC(=O)N1CCOCC1 409021271 ZSVYVOKDTJJWRY-WGOQTCKBSA-N 447.491 2.850 50 40 IFGB Nc1nonc1-n1nnc(C(=O)N/N=C/c2cccc(Cl)c2Cl)c1-c1ccccc1 1056544 SMVNZAFUGJYMDX-LSFURLLWSA-N 443.254 2.970 50 40 IFGB C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1CSc1ccc(C)cc1)c1ccccc1 9234053 QNQORXVGOXEXBL-OEAKJJBVSA-N 448.512 2.987 50 40 IFGB O=C(Nc1cccnc1)OC[C@H](NC(=O)C(Cl)Cl)[C@@H](O)c1ccc([N+](=O)[O-])cc1 53291211 HHHIIBJOVPFLLU-KBPBESRZSA-N 443.243 2.560 50 40 IFGB COc1cc(/C=C2/C(=O)NC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc(SC#N)c1O 409043686 TUWCIBYHVWXLGV-MLPAPPSSSA-N 440.393 2.549 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccc(I)cc2)cc([N+](=O)[O-])c1O 37142991 LDVICEVAHCRBPE-CAOOACKPSA-N 441.181 2.678 50 40 IFGB C[N+](C)(C)CC(=O)NC(=O)N/N=C\[C@@H](CC#N)CN(Cc1ccccc1)Cc1ccccc1 73391208 CHOCXJOLMFXXPK-MAAPNWIXSA-O 449.579 2.736 50 40 IFGB COC(=O)c1ccc(N2C(=O)[C@H]3C[C@@H](Br)[C@H](Br)C[C@@H]3C2=O)cc1 102801474 ZAMKNSHEIWXLKP-WUHRBBMRSA-N 445.107 2.900 50 40 IFGB Cc1ccccc1NC(=O)CCCC(=O)OCC(=O)NNC(=O)c1ccccc1Cl 138551156 KBZWHONBPGWSCF-UHFFFAOYSA-N 431.876 2.762 50 40 IFGB C/C(=N\NC(=O)CN(c1ccc(C)c(Cl)c1)S(C)(=O)=O)c1cccc([N+](=O)[O-])c1 408780837 LVAUBMZNDBEMHD-DEDYPNTBSA-N 438.893 2.863 50 40 IFGB CCOc1ccc(/C(C)=N/NC(=O)CN(c2cc(C)ccc2OC)S(C)(=O)=O)cc1 408782180 IJGLAIWTHRAJRF-CJLVFECKSA-N 433.530 2.709 50 40 IFGB COc1ccc(/C=N\NC(=O)c2nn(-c3ccc(C)cc3)c(=O)c(C#N)c2C)cc1OC 409062629 XZTHNALPFBNULL-MXAYSNPKSA-N 431.452 2.502 50 40 IFGB O=C(N/N=C/c1sc(=O)[nH]c1-[n+]1ccc(C(=O)c2ccccc2)cc1)c1ccccc1 13739422 XBLVSXCXXQVUGK-UHFFFAOYSA-O 429.481 2.708 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2ccccc2)S(C)(=O)=O)cc1OCC 20207313 STGXUBKLXAFSIG-PXLXIMEGSA-N 431.514 2.566 50 40 IFGB CC(=O)[C@H]1CC[C@@H]2[C@]1(C)C[C@@H]1O[C@@]13[C@@]21C=C[C@]2(C[C@@H](O)CC[C@@]23C)[C@H]2C(=O)OC(=O)[C@@H]21 118936375 UWJWRKKBRRCXGD-AYXVOYKGSA-N 426.509 2.572 50 40 IFGB Cc1ccccc1NC(=O)COC(=O)CCCC(=O)NNC(=O)c1ccccc1Cl 408644171 DTCQQQVZTWEYHK-UHFFFAOYSA-N 431.876 2.762 50 40 IFGB CCOC(=O)[C@H]1C(=O)NC(SC)=C(C#N)[C@H]1c1ccccc1I 726121 CRBJIUSMKAIHOA-CHWSQXEVSA-N 442.278 2.782 50 40 IFGB C=C(C)C(=O)OCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc([N+](=O)[O-])ccc1Cl 1764075 INLAMLURSPPBGQ-QGZVFWFLSA-N 447.831 2.992 50 40 IFGB Nc1scc2c(C(=O)N/N=C/c3ccc([N+](=O)[O-])cc3)nn(-c3ccccc3)c(=O)c12 2051009 NPBAQWCPHFIBEK-LSHDLFTRSA-N 434.437 2.702 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1OCC(=O)Nc1ccc(C)c(C)c1 408611716 RUDBTPJKIKXJKO-BRJLIKDPSA-N 442.903 2.727 50 40 IFGB C[C@H](SCc1ccccc1)C(=O)N/N=C/c1ccc(OCC(=O)N2CCOCC2)cc1 408719334 BVVASQBALXKCRN-WORIPGKHSA-N 441.553 2.696 50 40 IFGB CCOc1cc(/C=N/NC(=O)[C@H](NC(=O)Cc2cccs2)C(C)C)ccc1OCC#N 12467440 AQNKDKDOGOQFEK-JHXRPTDYSA-N 442.541 2.883 50 40 IFGB COc1cc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1OC(F)F 14240092 PRHKWOSPYVDTSP-UHFFFAOYSA-N 446.410 2.662 50 40 IFGB Cc1cccc(O[C@@H](C)C(=O)NNC(=O)CCn2c(S)nnc2-c2cccs2)c1C 18103568 GZQXXKDTEGMYLI-AWEZNQCLSA-N 445.570 2.917 50 40 IFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccccc1Br 115258278 HHUKSRWBGCIAQK-NSHDSACASA-N 436.693 2.917 50 40 IFGB Cc1ccc(-n2nc(C(=O)N/N=C\c3ccc([N+](=O)[O-])cc3)c(C)c(C#N)c2=O)cc1C 409074658 UJXHNLBABUUFLB-MSXFZWOLSA-N 430.424 2.702 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2cc(Cl)cc(Cl)c2)c1 409152462 JANKJUWSSOUQHV-AUEPDCJTSA-N 437.283 2.597 50 40 IFGB CCOc1cc(/C=N/NC(=O)c2ccc(I)c(O)c2)ccc1O 832379 FIDBGQRECANINO-GIJQJNRQSA-N 426.210 2.865 50 40 IFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4ccccn4)c(=O)c32)c(OC)c1 1471760 KISDCZAHUWYVFJ-OAQYLSRUSA-N 430.464 2.835 50 40 IFGB COc1cc(OC)cc(C(=O)NNC(=O)CCNC(=O)c2ccc(C(C)(C)C)cc2)c1 6788030 DYRDPDQLRZSMSN-UHFFFAOYSA-N 427.501 2.582 50 40 IFGB COC(=O)COc1ccc(/C=N/NC(=O)c2ccc(I)cc2)cc1 10476106 LAVHVOFKODKQLX-VXLYETTFSA-N 438.221 2.607 50 40 IFGB COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2C[C@@H]2C)ccc1Cl 12733707 PCRVNEITPOBTGZ-AAEUAGOBSA-N 437.905 2.566 50 40 IFGB C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)N/N=C2/C(=O)Nc3ccccc32)cc1 14361279 IYFJFMJPZZAJFI-IYBDPMFKSA-N 434.496 2.941 50 40 IFGB O=C(NNC(=O)c1ccccc1OCc1ccc(Cl)cc1)c1ccc(-n2cnnn2)cc1 23159794 FASSVWRCFRWFEU-UHFFFAOYSA-N 448.870 2.970 50 40 IFGB COc1ccccc1NC(=O)COc1ccc(/C=N\NC(=O)c2ccncc2)cc1OC 28617610 TVZKDUIUPHANDC-QFEZKATASA-N 434.452 2.880 50 40 IFGB CCOC(=O)/C(C#N)=C\c1cc(Br)c(OCC(=O)N(C)C)c(OCC)c1 96662768 QPQQMYZPAXXYKB-QPEQYQDCSA-N 425.279 2.785 50 40 IFGB Cn1nnnc1[C@@H](Br)CC(Br)(Br)Br 2311466 DNNFSWCBNJHVGT-VKHMYHEASA-N 441.747 2.875 50 40 IFGB COc1ccc(C(=O)NC2=N/C(=C(/C#N)C(=O)N3C[C@@H](C)O[C@H](C)C3)c3ccccc32)cc1 9347861 XZKSTTHJHIHPGM-MWPIZSESSA-N 444.491 2.756 50 40 IFGB C[C@H]1CN(C(=O)/C(C#N)=C2\N=C(NC(=O)c3ccc(F)cc3)c3ccccc32)C[C@@H](C)O1 11692112 ICYIUICJMQBKAZ-MUDLRCDJSA-N 432.455 2.886 50 40 IFGB Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CNC(=O)c1cccc(Cl)c1 12689834 OACZEHNVFKOZIU-UHFFFAOYSA-N 428.901 2.963 50 40 IFGB O=C(CCN1C(=O)/C(=C/c2cccs2)SC1=S)NNC(=O)c1cccc(O)c1 2381772 ZTMIEMYQYNTOSF-UVTDQMKNSA-N 433.536 2.506 50 40 IFGB COC(=O)c1cc(OC)c(OC)cc1N/C=C(\C#N)C(=O)NCc1ccc(OC)cc1 9130373 CVBOLKMEFJKVIF-FYWRMAATSA-N 425.441 2.635 50 40 IFGB O=C(NNC(=O)c1cc(=O)c2ccccc2o1)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1 16839318 GPHIKNYUVOHQSO-UHFFFAOYSA-N 449.850 2.731 50 40 IFGB C[C@H]1C[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1 12605088 VAOWYLMCQBABOQ-MEDUHNTESA-N 441.431 2.923 50 40 IFGB Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)cc12 12863714 CKKYTWLNZYSUJO-HNNXBMFYSA-N 436.534 2.640 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C\c2c(F)cccc2Cl)cc1Cl 16187225 XXRKXAKNFOAUBA-NKVSQWTQSA-N 448.303 2.912 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)NCc2ccccc2)cc1)Nc1ccc(F)cc1 58873557 LAVGBALNCONAOW-JFLMPSFJSA-N 448.454 2.610 50 40 IFGB O=C1Nc2ccccc2/C1=N\NC(=O)c1ccccc1NS(=O)(=O)c1cccs1 103311759 LLYTZIIETPVEDC-UHFFFAOYSA-N 426.479 2.635 50 40 IFGB CC(C)[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NNC(=O)c1cc(Cl)cn1C 12394533 QWMBUEMQLSMHBR-CTEACUEPSA-N 434.968 2.797 50 40 IFGB C[C@@H]1C/C(=N\NC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC(C)(C)C1 12599601 WPWBUEOMELTWOC-XKAFOEQXSA-N 435.590 2.959 50 40 IFGB O=C(COc1ccccc1F)NNC(=O)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1 23109479 YOUURRATVIXEIF-UHFFFAOYSA-N 429.835 2.529 50 40 IFGB C=CCOc1c(Br)cc(/C=C(\C#N)C(=O)NC(N)=O)cc1Br 409229429 OXTCZCNWURKWJM-RUDMXATFSA-N 429.068 2.878 50 40 IFGB CCOc1ccc(/C=N/NC(=O)Cc2nnc(NC(=O)c3ccc(C)cc3)s2)cc1O 1953678 YRSNXUROGYOABT-WSDLNYQXSA-N 439.497 2.896 50 40 IFGB COc1ccccc1Nc1nnc(SCC(=O)NNC(=O)c2ccccc2F)s1 9221099 VWIQJJXQPZYVRZ-UHFFFAOYSA-N 433.490 2.983 50 40 IFGB CCCCN1C(=O)C(C#N)=C(C)/C(=C/Nc2cc(OC)c(OC)cc2C(=O)OC)C1=O 9419374 MPMUAFKQGNYEOS-VBKFSLOCSA-N 427.457 2.795 50 40 IFGB O=C(NNC(=O)[C@H]1CCCN(c2nc3ccccc3s2)C1)c1cccc([N+](=O)[O-])c1 40140078 MNLFLSNYMDVCRM-AWEZNQCLSA-N 425.470 2.882 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)NC2CCCC2)cc1)Nc1ccccc1Cl 59959689 OEXLSDBSJVSTLS-ZMOGYAJESA-N 442.903 2.866 50 40 IFGB CCCOc1ccc(-c2c(C(=O)N/N=C(\C)c3ccccc3)nnn2-c2nonc2N)cc1 13806662 VBXHNSSLEOOHEH-ZVHZXABRSA-N 446.471 2.842 50 40 IFGB CSCC[C@@H](NC(=O)C1CC1)C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C 30673643 NBWKFSYQCLWHHW-OAHLLOKOSA-N 432.571 2.527 50 40 IFGB O=C(N/N=C/c1cc(Br)c(O)c(I)c1)c1ccccn1 408737902 JPWOSFLEHMSFMV-REZTVBANSA-N 446.042 2.918 50 40 IFGB Cc1ccccc1NC(=O)COc1ccc(/C=N/NC(=O)C(=O)NCc2ccccc2)cc1 409175069 PMAVVBDIOSRKSE-JVWAILMASA-N 444.491 2.779 50 40 IFGB CN(C)CN1C(=O)/C(=N\NC(=O)CSc2nc3ccccc3s2)c2ccccc21 2369962 QDMZEYJCCNJOBQ-NKFKGCMQSA-N 425.539 2.775 50 40 IFGB Cc1ccc(SCC(=O)NNC(=O)c2ccc3c(=O)n4c(nc3c2)CCCCC4)cc1 15939119 CBDQJXIJZPNYQP-UHFFFAOYSA-N 436.537 2.985 50 40 IFGB CCOC(=O)CN1C(=O)/C(=N/NC(=O)CNc2ccc3ccccc3c2)c2ccccc21 17162419 DVWIAYGNDCKQJQ-SLEBQGDGSA-N 430.464 2.682 50 40 IFGB Cc1cc(C)c2[nH]c(C)c(CC(=O)NNC(=O)CCC(=O)NCc3cccs3)c2c1 23017757 LYYVCQJLYCXSCB-UHFFFAOYSA-N 426.542 2.941 50 40 IFGB COc1cccc(-c2nc(C(=O)NNC(=O)COc3cccc(C)c3)cs2)c1OC 29460013 ABBWPLIHPBRGSL-UHFFFAOYSA-N 427.482 2.976 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@@H]3C[C@H](Br)[C@H](Br)C[C@H]3C2=O)c1 102065977 IBSRDFPISRPXAX-KKOKHZNYSA-N 431.080 2.811 50 40 IFGB COc1cccc(/C=N\NC(=O)CN(C)S(=O)(=O)c2ccc3ccccc3c2)c1OC 16187442 PDECFSCPZCMHGW-UCQKPKSFSA-N 441.509 2.628 50 40 IFGB O=C(CSc1ncccn1)N/N=C/c1ccc(OCC(=O)NC2CCCCC2)cc1 28215048 PGTGQXRAVBPBBD-ZMOGYAJESA-N 427.530 2.547 50 40 IFGB O=C(Cc1ccccc1)NNC1=C/C(=N/S(=O)(=O)c2ccccc2)C2=C(CC=CC2)C1=O 101181421 OLIODRYWLUWMDY-MEFGMAGPSA-N 447.516 2.793 50 40 IFGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)CN(c2cccc(C)c2C)S(C)(=O)=O)c1 408910282 JIRMKQMDEUELLK-XQNSMLJCSA-N 430.530 2.568 50 40 IFGB O=C(N/N=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1cc(Br)ccc1O 409063497 LUWBYLSOTXLNIH-RGVLZGJSSA-N 449.261 2.663 50 40 IFGB COc1c(O)ccc(/C=N\NC(=O)[C@@H]2COc3ccc(C(C)(C)C)cc3O2)c1[N+](=O)[O-] 8721735 VXDMQRSDUOITKW-DDJHGGCISA-N 429.429 2.897 50 40 IFGB CCn1c(NNC(=O)CCC(=O)c2ccc3c(c2)OCCCO3)nc2ccccc2c1=O 9857490 INNKJDBDBWFYJK-UHFFFAOYSA-N 436.468 2.684 50 40 IFGB CCOc1cccc(/C=N/NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)c1 408990647 OIKAZTPZBSRGLQ-ZUICHYAESA-N 435.484 2.796 50 40 IFGB CCCCNC(=O)/C(C#N)=C/c1ccc(-c2ccc(S(=O)(=O)N3CCOCC3)cc2)o1 3361386 HLLATRNHJMFDFP-OBGWFSINSA-N 443.525 2.791 50 40 IFGB O=C(NNC(=O)c1n[nH]c(=O)c2ccccc12)c1nc(-c2ccccc2)n2c1CCCCC2 32671508 WPEFENRZCUMUSS-UHFFFAOYSA-N 442.479 2.588 50 40 IFGB Cc1ccccc1NC(=O)COc1ccccc1/C=N/NC(=O)C(=O)NCc1ccccc1 409164202 DXHRHLATSZQHPY-JVWAILMASA-N 444.491 2.779 50 40 IFGB COC(=O)c1ccc(/C=N/NC(=O)Cn2cnc3sc4c(c3c2=O)CC[C@@H](C)C4)cc1 954714 FCIBGBXSBWRLSY-OKYTWDAHSA-N 438.509 2.520 50 40 IFGB O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NNC(=O)c1cccc(O)c1 8871656 XVKBJFRTUZVFOW-RVDMUPIBSA-N 447.563 2.896 50 40 IFGB Cc1ccc(Cn2nc(C)c(/C=N/NC(=O)Cn3nnc(-c4ccccc4)n3)c2C)cc1 9634764 XSRJZUTYSVZMEK-ZMOGYAJESA-N 428.500 2.660 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc2c3c(cccc13)CC2)c1ccccc1F 20211617 AFKROZAAAHTYQO-ZMOGYAJESA-N 425.485 2.994 50 40 IFGB Cc1ccc(NC(=O)C(=O)N/N=C/c2ccc(OCC(=O)NC3CCCCC3)cc2)cc1 408834616 WRFCIDOSHGQKSI-MFKUBSTISA-N 436.512 2.912 50 40 IFGB NS(=O)(=O)c1ccc(-c2ccc(/C=N/NC(=O)CSc3ccccc3F)o2)cc1 9588530 IIISLOFNMLDYIP-SSDVNMTOSA-N 433.486 2.976 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)[C@@H]2COc3ccccc3O2)cc1)NCc1ccccc1 408867709 LPSSHJLZSLZCFK-HGQHNSGJSA-N 445.475 2.672 50 40 IFGB C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(OCC(=O)NC[C@H]2CCCO2)cc1 28214127 JZVJKAAQCOKHQV-FSJIFWRBSA-N 441.553 2.992 50 40 IFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 104516853 QAZGNKZCNVZQRS-PTNGSMBKSA-N 427.800 2.961 50 40 IFGB Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccc(Cl)cc3)CC2)cc1 1384009 CNLVWHPUBFVAQT-UHFFFAOYSA-N 435.933 2.510 50 40 IFGB Cc1cccc(Oc2nc3c(C)cccn3c(=O)c2/C=C(\C#N)C(=O)N2CCOCC2)c1 9158750 CFXOWTATSXRZMN-NBVRZTHBSA-N 430.464 2.869 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(C)S(=O)(=O)c2c(C)cc(C)cc2C)cc1 16267345 BCCTWPXMPMCGHD-OEAKJJBVSA-N 429.542 2.947 50 40 IFGB COc1cc(C)ccc1C(=O)N/N=C\c1cn(CC(=O)N2CCOCC2)c2ccccc12 408857411 MLLDJDKZNZFQKJ-QFEZKATASA-N 434.496 2.581 50 40 IFGB COC(=O)[C@@H]1C(=O)NC(SCC(=O)N2[C@H](C)CCC[C@H]2C)=C(C#N)[C@H]1c1ccccc1 409131872 PGYRQKOPKAYIFC-IONDEXAJSA-N 441.553 2.947 50 40 IFGB Cc1ccc(NC(=O)CN2C(=O)/C(=N\NC(=O)c3ccc(N)cc3)c3ccccc32)cc1 675476 IRJQKQHNCCGWKS-QYQHSDTDSA-N 427.464 2.697 50 40 IFGB COCCCNC(=O)/C(C#N)=C/c1c(Oc2ccc(F)cc2)nc2c(C)cccn2c1=O 3644193 SLTANZLDLTWTDV-DTQAZKPQSA-N 436.443 2.994 50 40 IFGB COc1ccc(/C=N/NC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cc1O 9665411 ACAAVSLHXYCMLS-AFUMVMLFSA-N 428.448 2.923 50 40 IFGB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)[C@@H](C)Oc1ccc2ccccc2c1 12891586 ZSPDJLIMWOKXAT-CQSZACIVSA-N 429.454 2.833 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)CN(c2cccc3ccccc23)S(C)(=O)=O)c1 19955101 JLCPJLDNNAUDDL-OEAKJJBVSA-N 441.509 2.773 50 40 IFGB COc1cc(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)cc(Br)c1OC 408724804 CNSPUWCPOURZRR-ODCIPOBUSA-N 436.262 2.757 50 40 IFGB O=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C/c1cccc([N+](=O)[O-])c1O 3144884 ZOJJRLHNNMOBHW-AFUMVMLFSA-N 432.436 2.699 50 40 IFGB CCNC(=S)NNC(=O)CCc1nc2cc(Cl)ccc2n(Cc2ccccc2)c1=O 9508899 SFKYOGFWBFONHV-UHFFFAOYSA-N 443.960 2.546 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(Br)cc2)c(OC)c1 408608924 QKPJSISZUJMALV-FSJBWODESA-N 446.301 2.789 50 40 IFGB NC(=O)CCn1cc(/C=N/NC(=O)CNc2ccc(Br)cc2)c2ccccc21 9510344 MXIOFBZQKFGOOA-BHGWPJFGSA-N 442.317 2.841 50 40 IFGB Cc1[nH]c(=O)c(C#N)c(C)c1CCC(=O)NNC(=O)COc1ccccc1-c1ccccc1 15512773 LADQSXKJZDQPEY-UHFFFAOYSA-N 444.491 2.689 50 40 IFGB O=C(CN(c1ccccc1)S(=O)(=O)c1ccccc1)N/N=C/c1ccc([N+](=O)[O-])cc1 19947720 ARRYLUYALZUNPV-PXLXIMEGSA-N 438.465 2.940 50 40 IFGB N#CC1=C(N)Oc2c(c3ccccc3oc2=O)[C@]12C(=O)Nc1ccc(Br)cc12 1053115 TYUPDMBGVKXMFH-HXUWFJFHSA-N 436.221 2.880 50 40 IFGB CCOc1ccc(NC(=O)Cn2nnc(-c3ccccc3NC(=O)[C@H](C)Cl)n2)cc1 1352329 DVCPRIXPDJZNSX-ZDUSSCGKSA-N 428.880 2.943 50 40 IFGB COCc1cc(C)nc(OCC(=O)N/N=C\c2c(C)nn(-c3ccccc3)c2C)c1C#N 408998345 ITXYEFOCIGKOPU-ROTLSHHCSA-N 432.484 2.740 50 40 IFGB CCc1ccc(-n2nc(C(=O)N/N=C\c3ccc(C(=O)OC)cc3)c(C)c(C#N)c2=O)cc1 409057652 HRRHGIWIPJXUML-WGARJPEWSA-N 443.463 2.526 50 40 IFGB COc1cc(C(=O)NNS(=O)(=O)c2ccccc2)cc(OCc2ccccc2)c1OC 1731970 AUEZHJYYHMAGSX-UHFFFAOYSA-N 442.493 2.906 50 40 IFGB CC(C)[C@H](NC(=O)c1ccccc1NC(=O)c1ccco1)C(=O)NNC(=O)c1ccccc1 3144084 GJFGKRUHMYUACA-FQEVSTJZSA-N 448.479 2.748 50 40 IFGB COc1ccc(CC(=O)N/N=C/c2cc(Br)cc([N+](=O)[O-])c2O)cc1OC 9289498 NNDGSMXYJJFVNA-DJKKODMXSA-N 438.234 2.773 50 40 IFGB Cc1ccc(S(=O)(=O)N2CCN(CC(=O)N/N=C\c3ccc(C(C)C)cc3)CC2)cc1 30743011 MCNBBIVBAQRESF-JLPGSUDCSA-N 442.585 2.575 50 40 IFGB Cc1cccc[n+]1[C@H]1[C@@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C([C-](C#N)C#N)N[C@]1(O)C1CC1 100023567 VPFRCQCGNFASQJ-XWGVYQGASA-N 440.463 2.617 50 40 IFGB COc1cc(C(=O)N/N=C/[C@H]2C(=O)Nc3ccccc32)ccc1I 100235649 XBGHHOKPMYUXQP-DKSCHZSNSA-N 435.221 2.751 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@H](C)NC(=O)c2ccc(Br)cc2)c(OC)c1 2765613 HDGBWAJAXPHOHI-OVMKCGGTSA-N 434.290 2.735 50 40 IFGB CNc1sc2c3c(c(=O)[nH]c2c1C#N)[C@@H](c1ccc(C(=O)OC)cc1)C(C#N)=C(N)O3 15083550 UKTBOJSRVIFHEA-ZDUSSCGKSA-N 433.449 2.508 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccccc2Cl)S(C)(=O)=O)cc1Cl 408779898 NBRGZURCJCQYNI-KEBDBYFISA-N 430.313 2.918 50 40 IFGB CCOC(=O)c1cccc(-c2ccc(/C=N/NC(=O)CNC(=O)COc3ccccc3)o2)c1 409160241 PYZHHEXKDPOVJN-VULFUBBASA-N 449.463 2.769 50 40 IFGB C=CCOc1ccc(NC(=O)C(=O)N/N=C/c2cc(Br)c(O)c(OC)c2)cc1 409255071 KIUWJRSZOBPBJY-SRZZPIQSSA-N 448.273 2.817 50 40 IFGB Nn1c(SCC(=O)NNC(=O)c2cccs2)nnc1-c1cc(Cl)ccc1Cl 9666349 KCJLXNPJSRSQJT-UHFFFAOYSA-N 443.341 2.581 50 40 IFGB COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2C[C@H]2C)ccc1Cl 12733709 PCRVNEITPOBTGZ-DGCLKSJQSA-N 437.905 2.566 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc([N+](=O)[O-])c1)c1cccc2ccccc12 19955151 QFJNZHKGRZKHFG-FYJGNVAPSA-N 426.454 2.664 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccc(F)c(Cl)c1 409257403 QRJLIWOVIXTCIT-DDFZXGMKSA-N 448.882 2.861 50 40 IFGB COc1cc(C(=O)NNC(=O)[C@@H](NC(=O)c2ccccc2F)C(C)C)ccc1OC(C)C 12908990 DMMOYOQXTFWUHH-FQEVSTJZSA-N 445.491 2.837 50 40 IFGB Cc1sc2nc(CC(=O)NNC(=O)c3cc(F)c(F)cc3Cl)[nH]c(=O)c2c1C 13057688 QLTCPMRWUKRUFE-UHFFFAOYSA-N 426.832 2.537 50 40 IFGB C=CCc1cc(/C=N\NC(=O)CN2CCOCC2)cc(OC)c1OCc1ccc(F)cc1 59247134 ZFODPCSAHVYJQC-YSMPRRRNSA-N 441.503 2.924 50 40 IFGB Cc1ccccc1NC(=O)[C@H]1[C@H](c2cccs2)C(C#N)=C(SCC(N)=O)N[C@]1(C)O 101171928 XRUZMSXODHJDKY-WAOWUJCRSA-N 442.566 2.660 50 40 IFGB CN(C)c1ccc(/C=N/NC(=O)CN(c2cccc(Cl)c2Cl)S(C)(=O)=O)cc1 408908151 UIBUXUUHRAZCQA-SRZZPIQSSA-N 443.356 2.976 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(Cl)cc2Cl)cc1 409161174 ZALNQUOMWTUUJX-BHGWPJFGSA-N 449.294 2.763 50 40 IFGB CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)Cc1c[nH]c2ccccc12 25489777 WTPBYBIWUFGGHN-FQEVSTJZSA-N 436.512 2.994 50 40 IFGB COc1ccc(NC(=O)C(=O)N/N=C\c2cc(C)n(-c3ccc(C(=O)O)cc3)c2C)cc1 223151911 IZQFDVOVMVLVOZ-CFRMEGHHSA-N 434.452 2.890 50 40 IFGB Cc1ccc(N2C(=O)[C@@H](/C=N\NC(=O)c3ccccc3-n3cccc3)C(=O)NC2=S)cc1 408754486 NQBCDNWSOJSSDZ-SMNNTEATSA-N 445.504 2.565 50 40 IFGB CCc1ccc(NC(=O)C(=O)N/N=C(\C)CC(=O)Nc2ccc(OC)cc2OC)cc1 13562697 GQGXLKBXFBPIKW-AFUMVMLFSA-N 426.473 2.726 50 40 IFGB Cc1[nH]c2ccccc2c1/C=N/NC(=O)Cc1nnc(NC(=O)C(Cl)Cl)s1 408732079 ROOCBMFJWJUSDJ-FBCYGCLPSA-N 425.301 2.763 50 40 IFGB C/C(=N\NC(=O)CN(c1cccc(Cl)c1C)S(C)(=O)=O)c1ccc([N+](=O)[O-])cc1 408773606 VPQVBVCHVDRBDA-DEDYPNTBSA-N 438.893 2.863 50 40 IFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(OCC(=O)N3CCCCC3)cc2)n1 408882990 PVCIBAYAWFFTAO-YDZHTSKRSA-N 441.557 2.727 50 40 IFGB Cc1nc(C)c(C(=O)N/N=C/c2ccc(O)cc2)cc1C(=O)N/N=C/c1ccc(O)cc1 820806 DNHJHJDLQUDTQD-DWGHPKEWSA-N 431.452 2.637 50 40 IFGB CCc1[nH]nc2c1[C@]1(C(=O)N(Cc3cccc(OC)c3)c3ccccc31)C(C#N)=C(N)O2 9243360 BAYNOCKSQUJLLC-XMMPIXPASA-N 427.464 2.900 50 40 IFGB O=C(CCN1CCN(Cc2ccccc2)CC1)NNC(=O)c1ccc(Cl)c(Cl)c1 22809186 ZGYRTNFTHQXKTO-UHFFFAOYSA-N 435.355 2.962 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccc(CN3CCOCC3)cc2)cc(Br)c1O 23410565 AZQNAFWZJNITJP-WSDLNYQXSA-N 448.317 2.759 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)CN(c2ccc(C(C)C)cc2)S(C)(=O)=O)c1 408783800 RGBBZNUCAAFNFN-LPYMAVHISA-N 433.530 2.744 50 40 IFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3cccc(OC)c3OC)CC2)cc1 409006939 SUKDRHRSTFLVRM-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)COc2ccc(I)cc2)c1 1429047 FUSSSDQPHGANPZ-VXLYETTFSA-N 440.237 2.838 50 40 IFGB Cn1c(SCC(=O)N/N=C/c2cccnc2)nnc1-c1cccc(Br)c1 2315211 SCJNFNACERLPDV-KEBDBYFISA-N 431.319 2.882 50 40 IFGB Cc1cc(OCCCC(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)ccc1Cl 9248439 YFIFNRJECWGNRW-UHFFFAOYSA-N 449.847 2.720 50 40 IFGB Cc1cc(C(=O)NNC(=O)C2CCN(C(=O)C(C)C)CC2)c(C)n1-c1ccc(F)cc1 12523404 GLMAXHOXHGWAQE-UHFFFAOYSA-N 428.508 2.889 50 40 IFGB O=C(CN1CCCCCC1=O)NNC(=O)c1cc(-c2cccs2)nn1-c1ccccc1 14199817 QLFMPRHJFLGTIT-UHFFFAOYSA-N 437.525 2.764 50 40 IFGB CSc1ncc(Br)c(C(=O)NNC(=O)c2ccccc2Br)n1 28289354 WSNGLHRKLZKJMO-UHFFFAOYSA-N 446.124 2.798 50 40 IFGB Cc1ccc(SCCC(=O)N/N=C/c2ccc(OCC(=O)N3CCOCC3)cc2)cc1 409129933 MTNKLQXXAPFVKE-LFVJCYFKSA-N 441.553 2.865 50 40 IFGB COc1cc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)cc(OC)c1OC 409170507 WAOMEVVVPGEJNV-FQIOEHTJSA-N 425.485 2.832 50 40 IFGB NC(=O)N[C@@H](CC(=O)NNC(=S)Nc1ccccc1)c1cccc(Br)c1 25400642 NGCGBOVMQLTTPX-AWEZNQCLSA-N 436.335 2.566 50 40 IFGB CCOc1ccc(/C=N/NC(=O)CN(c2cc(Cl)ccc2OC)S(C)(=O)=O)cc1 408782041 GSBQUOPKNLONFO-CIAFOILYSA-N 439.921 2.664 50 40 IFGB COc1cc(C(=O)N/N=C\c2cccc([N+](=O)[O-])c2O)ccc1I 409108711 VNHIYQSNAYSJNG-IUXPMGMMSA-N 441.181 2.678 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2c(C)cc(C)cc2C)cc1 409170567 WJXXUDNHSDSIMU-VULFUBBASA-N 438.528 2.996 50 40 IFGB COc1ccc(/C=N/NC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1OC 19861404 AIHABDBWUKBGKH-ZVHZXABRSA-N 430.936 2.625 50 40 IFGB COc1ccc(CCC(=O)NNC(=O)c2ccc(=O)n(Cc3ccc(Cl)cc3)c2)cc1 23109494 ZHCGVZKFCJVERU-UHFFFAOYSA-N 439.899 2.952 50 40 IFGB C=CCN1C(=O)/C(=N/NC(=O)[C@H]2COc3ccccc3O2)c2cc(Br)ccc21 100056987 BGWNJUVMMAVTDC-SFAXUQRRSA-N 442.269 2.642 50 40 IFGB O=C(NCc1ccc2c(c1)OCO2)C(=O)N/N=C/c1ccc(OCc2ccc(F)cc2)cc1 408609848 SEBFRALMHHENSB-UVHMKAGCSA-N 449.438 2.900 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1 409159757 XBYIJCMYLKNLDC-AUEPDCJTSA-N 437.283 2.597 50 40 IFGB Nc1nonc1-n1nnc(C(=O)N/N=C2\CCc3ccccc32)c1CSc1ccccc1 9087668 RLVFJDOONYJICU-XQNSMLJCSA-N 446.496 2.605 50 40 IFGB C[C@H]1CCCN(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccs3)cc2[N+](=O)[O-])C1 9612520 XFAUWLISBFEUMB-ZDUSSCGKSA-N 446.485 2.511 50 40 IFGB CC(C)(C)NC(=O)CCC(=O)NNC(=O)CCC(=O)N(c1ccccc1)c1ccccc1 9762975 KACCJFOREABMBQ-UHFFFAOYSA-N 438.528 2.974 50 40 IFGB COc1ccc(OCC(=O)N/N=C/c2ccc(OCC(=O)NCc3ccco3)cc2)cc1 28215197 MOZHYQBKAKQQFZ-DHRITJCHSA-N 437.452 2.513 50 40 IFGB Cc1cccc[n+]1[C@H]1[C@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C(C(C#N)C#N)N[C@]1(O)C1CC1 33778144 UUHQFLQUMHGTRC-NHTMILBNSA-N 441.471 2.658 50 40 IFGB CCOc1cc(/C=N/NC(=O)C(=O)N[C@H](C)c2ccccc2)cc(Br)c1O 59483268 DWKWXXLPPNQACD-KIHMUJGBSA-N 434.290 2.881 50 40 IFGB O=C(CNc1ccc(I)cc1)N/N=C/c1ccc([N+](=O)[O-])s1 59720885 JBHQESDRNCHDGL-FRKPEAEDSA-N 430.227 2.823 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccc(F)c(Cl)c2)c1 409269496 JWFJKIXTSPNZHG-DDFZXGMKSA-N 448.882 2.861 50 40 IFGB COc1cc([C@H]2C(C#N)=C(N)N(c3ccc(F)cc3)C3=C2S(=O)(=O)CC3)ccc1O 1429890 PPSAGMBHHOWANP-IBGZPJMESA-N 427.457 2.868 50 40 IFGB Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)c2ccc(Cl)cc2)cc1 14180759 PKZVEVKZCUAROX-SFHVURJKSA-N 435.933 2.653 50 40 IFGB O=C(NNC(=O)[C@@H]1CS[C@]2(c3ccccc3)CCC(=O)N12)c1cc2c(s1)CCCC2 22968083 KVMWBDSRAGEPTD-AOMKIAJQSA-N 441.578 2.979 50 40 IFGB CCc1ccc(N(CC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)S(C)(=O)=O)cc1 409023935 FPSSHQUUHWSSAU-RGVLZGJSSA-N 438.893 2.727 50 40 IFGB Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)C[C@H]3C=CCC3)cc2)cc1 12971891 GOHUTJHYDPXQSI-SFHVURJKSA-N 441.553 2.933 50 40 IFGB O=C(Cc1nnc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)s1)N/N=C/c1ccccc1 107822091 MZDVFQFIXFKRRB-YBFXNURJSA-N 425.430 2.783 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2cccc(Cl)c2Cl)c1 409168762 NKDYTEXGJXUCON-AUEPDCJTSA-N 437.283 2.597 50 40 IFGB O=C(CNC(=O)c1ccccc1F)N/N=C1\C(=O)N(CCc2ccccc2)c2ccccc21 1816949 IJWSGIFQSXRHNC-FAJYDZGRSA-N 444.466 2.665 50 40 IFGB Cc1cccc[n+]1[C@@H]1[C@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C(C(C#N)C#N)N[C@@]1(O)C1CC1 19805044 UUHQFLQUMHGTRC-GMKZXUHWSA-N 441.471 2.658 50 40 IFGB O=C(CSc1ncccn1)N/N=C/c1ccc(OCC(=O)Nc2ccc(F)cc2)cc1 28215067 KYYHKWYXKPYDSB-BRJLIKDPSA-N 439.472 2.876 50 40 IFGB COc1cc(/C=N/NC(N)=O)cc(Br)c1OS(=O)(=O)c1ccc(C)cc1 59535964 XDGAMODXMMZJJC-DJKKODMXSA-N 442.291 2.536 50 40 IFGB O=C(COc1ccccc1/C=N/NC(=O)C(=O)NC1CC1)Nc1cccc(Cl)c1Cl 409260520 RMIHAJJBAAGRIT-AUEPDCJTSA-N 449.294 2.740 50 40 IFGB Cc1ccc(CN2CCN(CC(=O)N/N=C/c3ccc(Cl)c([N+](=O)[O-])c3)CC2)cc1 13581895 SDYBXCGDDVUQMH-YDZHTSKRSA-N 429.908 2.825 50 40 IFGB CCOc1ccccc1N(CC(=O)N/N=C/c1ccccn1)S(=O)(=O)c1ccccc1 59472753 VIMMTOLPOVKFDJ-LFVJCYFKSA-N 438.509 2.826 50 40 IFGB COCCOC(=O)C1=C(C)NC(SCC(=O)NC(C)(C)C)=C(C#N)[C@@H]1c1ccco1 100944790 PREAMKZIGUMBOS-GOSISDBHSA-N 433.530 2.813 50 40 IFGB Cc1ccccc1NC(=O)[C@@H]1[C@H](c2cccs2)C(C#N)=C(SCC(N)=O)N[C@]1(C)O 101171923 XRUZMSXODHJDKY-BBTUJRGHSA-N 442.566 2.660 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)cc1 408969683 RWUPRABTMBMXDP-HAVVHWLPSA-N 427.526 2.802 50 40 IFGB CCc1ccc(N(CC(=O)N/N=C(\C)c2ccc(OC)c(OC)c2)S(C)(=O)=O)cc1 409024960 OGBIFMPMJCVUOC-PXLXIMEGSA-N 433.530 2.573 50 40 IFGB CCOc1ccccc1/C=N\NC(=O)c1nn(-c2ccc(OC)cc2)c(=O)c(C#N)c1C 409057303 JPVSIPWSDPVIIC-QFEZKATASA-N 431.452 2.584 50 40 IFGB CCN(CC)c1ccc(C(=O)NNC(=O)[C@@H](NC(=O)c2ccccc2F)C(C)C)cc1 12527812 LQPLKZFIXUBFMX-FQEVSTJZSA-N 428.508 2.888 50 40 IFGB CCCn1nc(C(=O)NNS(=O)(=O)c2ccc([C@H](C)CC)cc2)c2ccccc2c1=O 12753036 QWDNPAFYVULTAZ-OAHLLOKOSA-N 442.541 2.943 50 40 IFGB CC1=C(C#N)C(=O)N([C@@H]2CCS(=O)(=O)C2)C(=O)/C1=C\Nc1ccc(Cl)cc1Cl 13655623 CPISOWKWPWQFEQ-UGMNDJHYSA-N 440.308 2.685 50 40 IFGB O=C(N/N=C/[C@H]1C(=O)NC(=S)N(c2ccc(Cl)cc2)C1=O)c1ccc(Cl)cc1 408741540 MPGSJQNGKJFHLZ-SLSPDHCBSA-N 435.292 2.773 50 40 IFGB COc1cc(C(=O)Oc2ccc(/C=N/NC(=O)c3cc(C)n[nH]3)cc2)cc(OC)c1OC 868306 ZKOFDAACSQCYCW-FSJBWODESA-N 438.440 2.727 50 40 IFGB CCc1nc2sc3c(c2c2nnc(SCC(=O)NNC(=O)C(C)C)n12)CC[C@@H](C)C3 13499821 SEMBMRCGEFOIRT-LLVKDONJSA-N 446.602 2.922 50 40 IFGB COc1ccccc1Oc1nc2ccccn2c(=O)c1/C=C(\C#N)C(=O)NC[C@H]1CCCO1 13769840 CMUKXQUFMMIWQT-HJUDDPQBSA-N 446.463 2.698 50 40 IFGB CCN(CC)S(=O)(=O)c1ccc2[nH]c(=O)cc(C(=O)NNc3cccc(Cl)c3)c2c1 30574553 GGEYIBUYSPJJKQ-UHFFFAOYSA-N 448.932 2.969 50 40 IFGB O=C(NNC(=O)c1ccccc1)C1=NO[C@H](CNc2ncc(C(F)(F)F)cc2Cl)C1 20365295 IJEMVEAWABCVAM-LBPRGKRZSA-N 441.797 2.772 50 40 IFGB Cc1ccc(CN2CCN(CC(=O)N/N=C/c3cc(Br)ccc3O)CC2)cc1 22942838 DVBOQEVVMXNVHP-YDZHTSKRSA-N 445.361 2.731 50 40 IFGB NC(=O)COc1ccc(/C=N/NC(=O)c2ccc(CN3CCc4ccccc4C3)cc2)cc1 408775032 FGNYWDKMAPWLAK-RWPZCVJISA-N 442.519 2.873 50 40 IFGB CCOC(=O)COc1c(Br)cc(/C=C(/C#N)C(=O)NC(C)C)cc1OC 408776962 TYCKFFAUOXOTHI-MLPAPPSSSA-N 425.279 2.831 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2cccc(F)c2)S(C)(=O)=O)cc1OCC 409134148 NJUULNJRTFLPJJ-OEAKJJBVSA-N 449.504 2.706 50 40 IFGB Nc1nonc1-n1nnc(C(=O)N/N=C/C=C/c2ccccc2)c1CSc1ccccc1 2264351 WETAQHHJDWTCNF-KSSPAFGBSA-N 446.496 2.954 50 40 IFGB CCn1c(C)nc2cc(C(=O)NNC(=O)COc3cccc(Br)c3)ccc21 3301309 QJCGEBSAAZHDMP-UHFFFAOYSA-N 431.290 2.967 50 40 IFGB O=C(/C=C/c1ccccc1)NCC(=O)N/N=C1\C(=O)N(Cc2ccccc2)c2ccccc21 13122700 IZTMNVNZGIUZGS-ZUTNVGRLSA-N 438.487 2.883 50 40 IFGB C[C@@H]1CCc2[nH]c3ccc(C(=O)NNC(=O)c4nn(C)c(=O)c5ccccc45)cc3c2C1 17191104 JLPJBZGVISILJN-CYBMUJFWSA-N 429.480 2.614 50 40 IFGB N#CCOc1ccc(/C=N/NC(=O)CN(c2ccccc2)S(=O)(=O)c2ccccc2)cc1 59472778 ZPWNVDYTICAULW-KOEQRZSOSA-N 448.504 2.935 50 40 IFGB CCOc1cc(/C=N/NC(=O)C(=O)NCCCOC)ccc1OCc1ccc(Cl)cc1 408612335 YFABPIRDYDLLLN-AFUMVMLFSA-N 447.919 2.921 50 40 IFGB Cc1ccc(NC(=O)C(=O)N/N=C/c2cccc(OCC(=O)N3CCCC3)c2)cc1Cl 409163827 YJQDCJLJLSFDEI-ZMOGYAJESA-N 442.903 2.738 50 40 IFGB Cc1ccc(Cl)cc1NC(=O)COc1ccccc1/C=N/NC(=O)C(=O)NC(C)C 409175421 RIQXXMPQPXSQOX-FOKLQQMPSA-N 430.892 2.641 50 40 IFGB CCCOc1ccc(-c2c(C(=O)N/N=C/[C@@H]3CC=CCC3)nnn2-c2nonc2N)cc1 9236354 YFTUSUAQOAVRKK-JMKVTYIUSA-N 436.476 2.760 50 40 IFGB C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H](C)n1c(=O)oc2ccccc21 14372621 PKNQCEHLYYGQIP-VXGBXAGGSA-N 448.273 2.533 50 40 IFGB Cc1nn(-c2ccc(F)cc2F)c(C)c1CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1 40128074 ZJYJPIVWROOBSR-UHFFFAOYSA-N 429.383 2.679 50 40 IFGB Cc1ccc(NC(=O)C(=O)N/N=C/c2ccc(OCC(=O)NCc3ccco3)cc2)cc1C 58880899 VOGYNLDHGVORLD-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB O=C(CC(=O)Nc1nccs1)N/N=C\c1ccc(N(CCCl)CCCl)cc1 104052291 KSURFFPMWNEDKY-MTJSOVHGSA-N 428.345 2.906 50 40 IFGB O=C(N/N=C/c1cc([N+](=O)[O-])cc(Br)c1O)c1cncc(Br)c1 3148125 BYQXZVUKJKWSKY-YAXRCOADSA-N 444.039 2.984 50 40 IFGB Cc1cc(C(=O)OCC(=O)NNC(=O)c2ccc(Br)cc2)c2ccccc2n1 3287301 PJSJULUHQGSPQM-UHFFFAOYSA-N 442.269 2.924 50 40 IFGB O=C(NN1C[C@@H](C(=O)O[C@@H](CCCl)C(=O)c2ccc(F)cc2)CC1=O)c1ccccc1 8927385 AWYNZACHXHJBOU-WMZOPIPTSA-N 446.862 2.743 50 40 IFGB COc1ccc(Cl)cc1N(CC(=O)N/N=C/c1ccccc1Cl)S(C)(=O)=O 408782371 HXEMZXNJXDUYKK-KEBDBYFISA-N 430.313 2.918 50 40 IFGB CN(C)c1cccc(OCC(=O)N/N=C\c2ccc(O)c(I)c2)c1 408907431 NNRGYZNWVAUJII-GRSHGNNSSA-N 439.253 2.592 50 40 IFGB Cc1ccc(N(CC(=O)NN=C2CCN(Cc3ccccc3)CC2)S(C)(=O)=O)cc1 409340505 YGOIPJYUTTWXLU-UHFFFAOYSA-N 428.558 2.529 50 40 IFGB C=CCn1c(SCC(=O)NNC(=O)c2ccc(F)cc2)nc2sc(C)c(C)c2c1=O 2660621 LBSJEMZDYZZURA-UHFFFAOYSA-N 446.529 2.953 50 40 IFGB CCOc1ccc(-n2nnc3c(N4CCN(C(=O)C(C)(C)CCl)CC4)ncnc32)cc1 9851279 DGWUPSDBPOJSQR-UHFFFAOYSA-N 443.939 2.523 50 40 IFGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1cccn(Cc2ccc(F)cc2)c1=O 23109342 VFJMZVNVDGKEEA-UHFFFAOYSA-N 429.835 2.773 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NC3CCCCC3)cc2)cc1 58873438 ZFJBLKNSFIGFLX-MFKUBSTISA-N 436.512 2.912 50 40 IFGB CCOC(=O)CN1C(=O)/C(=N\NC(=O)CNc2ccc3ccccc3c2)c2ccccc21 101499534 DVWIAYGNDCKQJQ-VYIQYICTSA-N 430.464 2.682 50 40 IFGB N#CCOc1ccccc1/C=N/NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 408866796 JBDYNZDJRMJAAY-TTXZLZEXSA-N 446.916 2.546 50 40 IFGB COc1cc(/C=N\NC(=O)c2cccnc2)ccc1OCC(=O)Nc1cccc([N+](=O)[O-])c1 409065483 SQAARBHTYJKWBZ-MSXFZWOLSA-N 449.423 2.780 50 40 IFGB C[C@@H](Nc1nc2ccccc2s1)C(=O)NNC(=O)CNC(=O)c1ccc2ccccc2c1 10675981 ZOMPEAFTLALEBO-CQSZACIVSA-N 447.520 2.827 50 40 IFGB CN(C)c1ccc(/C=N/NC(=O)CN(C)S(=O)(=O)c2cc(Cl)ccc2Cl)cc1 16186361 CVWWTTZHPXYZBA-SRZZPIQSSA-N 443.356 2.830 50 40 IFGB O=C(O)COc1ccc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc1Br 33429206 HJFRKLGEKMKUPG-OCKHKDLRSA-N 436.218 2.514 50 40 IFGB COc1ccc(OC)c(N(CC(=O)N/N=C(\C)c2ccc(Cl)cc2)S(C)(=O)=O)c1 408770858 BLCUMDSWKIVNTL-FYJGNVAPSA-N 439.921 2.664 50 40 IFGB COc1ccc(OCC(=O)N/N=C\c2ccc(O)c(I)c2)cc1 408905013 RYCPYVNQHUPNFL-NVMNQCDNSA-N 426.210 2.535 50 40 IFGB CC(=O)Nc1ccc(S(=O)(=O)N(CC(=O)NN=C2CCCC2)Cc2ccccc2)cc1 408979771 OLUNAMFPJMHDJU-UHFFFAOYSA-N 442.541 2.882 50 40 IFGB COC(=O)COc1ccc(/C=N/NC(=O)Cc2ccc(OC)cc2)cc1Br 8722687 HZQYPSJBHVXPIT-SRZZPIQSSA-N 435.274 2.702 50 40 IFGB C/C(=N/NC(=O)c1ccco1)c1cc2c(cc1NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O)OCO2 17103265 MJYYRKOJVJQPCY-FHRTVOODSA-N 439.424 2.768 50 40 IFGB CCOc1ccc(N(CC(=O)N/N=C/c2c(O)ccc3ccccc23)S(C)(=O)=O)cc1 19955067 ZBQRAMZVKXZMTQ-OEAKJJBVSA-N 441.509 2.860 50 40 IFGB Cc1ccc(N(CC(=O)NN=C2CCN(C)CC2)S(=O)(=O)c2ccc(F)cc2)cc1 20232045 OAPANNSAZOCLIP-UHFFFAOYSA-N 432.521 2.527 50 40 IFGB Cc1ccc(C)c(N(CC(=O)N/N=C/c2ccc(Br)cc2)S(C)(=O)=O)c1 408769698 ZOSNQCZVZPTZOS-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB CC1=CC(C(F)(F)F)(C(F)(F)F)C(C#N)=C(N)N1c1ccc(S(N)(=O)=O)cc1 1240346 OKYSPMIALZVBEP-UHFFFAOYSA-N 426.342 2.863 50 40 IFGB Cc1ccc(C(=O)Nc2ccccc2C(=O)N[C@H](C)C(=O)NNC(=O)c2ccccc2)cc1 3144138 GQSIVEWTPKPYRA-QGZVFWFLSA-N 444.491 2.827 50 40 IFGB O=C(NN1C[C@@H](C(=O)O[C@H](CCCl)C(=O)c2ccc(F)cc2)CC1=O)c1ccccc1 8927389 AWYNZACHXHJBOU-FUHWJXTLSA-N 446.862 2.743 50 40 IFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 12362376 DVAXFZNZWFDWLD-CIAFOILYSA-N 429.389 2.575 50 40 IFGB Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 12699054 MBJNBAMADLAPRS-UHFFFAOYSA-N 439.541 2.723 50 40 IFGB C/C(=N\NC(=O)CN(c1cccc(Cl)c1C)S(C)(=O)=O)c1cccc([N+](=O)[O-])c1 408776621 XLNUQOHSQZGIEZ-DEDYPNTBSA-N 438.893 2.863 50 40 IFGB COc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@H]2C[C@H]3[C@@H](Br)[C@H]2Br)cc1 4015938 KHYQVLDAIPZWMH-LRRLDJKKSA-N 429.108 2.978 50 40 IFGB CCOc1cc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)ccc1OCC(=O)O 4209682 LUWKQPXHRNDMOB-WGOQTCKBSA-N 448.475 2.935 50 40 IFGB COc1cccc(/C=N/NC(=O)C(=O)NCc2ccco2)c1OCc1ccc(F)cc1 408612284 UUPUHFKHQHMTFN-BRJLIKDPSA-N 425.416 2.773 50 40 IFGB O=C1NC[C@H](c2ccccc2)[C@@H]1C(=O)N/N=C\c1cc(Br)cc(Cl)c1O 15938660 ZRBLVZDXBNJEEB-SXHKOVJKSA-N 436.693 2.788 50 40 IFGB CC1=C(C#N)C(=O)N([C@@H]2CCS(=O)(=O)C2)C(=O)/C1=C/Nc1ccc(C(C)(C)C)cc1 102676097 ZKTWFUJQSGGFAU-MIQLPHMESA-N 427.526 2.676 50 40 IFGB O=C(O)c1ccc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)cc1 408970278 FCUBSTMRZODLGI-LPYMAVHISA-N 449.916 2.589 50 40 IFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2cc([N+](=O)[O-])cc(Br)c2O)n1 409108655 YAODNXGLVBHFPG-UBKPWBPPSA-N 440.279 2.712 50 40 IFGB O=C(NNC(=O)c1ccccc1C(F)(F)F)c1ccc(S(=O)(=O)N2CCCC2)cc1 13149508 GQCLJBULCVQQBB-UHFFFAOYSA-N 441.431 2.565 50 40 IFGB O=C(COC(=O)CCC(=O)Nc1cccc(Cl)c1)NNC(=O)c1ccccc1Cl 408662424 IDIVEQGGVSLBMO-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB CN(C)N(C(=O)c1cc(-c2cccs2)nn1-c1ccccc1)[C@H]1CCS(=O)(=O)C1 13148370 XEEYWYPWKAKQSI-INIZCTEOSA-N 430.555 2.707 50 40 IFGB CC(=O)NNC(=O)CSc1nnc2c3c4c(sc3nc(C3CC3)n12)C[C@H](C)CC4 13502586 OEYQANRLKMXSKT-SECBINFHSA-N 430.559 2.601 50 40 IFGB COc1ccc(/C=N\NC(=O)c2nn(-c3cccc(C)c3)c(=O)c(C#N)c2C)c(OC)c1 409054318 IXTIYUCJVCFKIW-MXAYSNPKSA-N 431.452 2.502 50 40 IFGB C[C@@H](C(=O)NN=C1CCN(Cc2ccccc2)CC1)N(c1ccccc1)S(C)(=O)=O 409334286 WPXDSMKUUJEANN-SFHVURJKSA-N 428.558 2.609 50 40 IFGB COc1cc([C@@H]2[C@@H](Cl)C(=O)N2NC(=O)Cc2ccccc2)cc(Br)c1O 5838496 KYUYQEKFSYROPZ-HZPDHXFCSA-N 439.693 2.928 50 40 IFGB CCc1ccccc1N(CC(=O)N/N=C/c1ccccc1Br)S(C)(=O)=O 20208997 SMOZGAWCCYEMFM-UDWIEESQSA-N 438.347 2.928 50 40 IFGB Cc1ccc(C)c(NC(=O)CCC(=O)OCC(=O)NNC(=O)c2ccccc2Cl)c1 408660555 APMFXZVNIMNCDZ-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2cccc(Cl)c2)c1 409167216 HXPKFRPWRBKZKR-ZMOGYAJESA-N 430.892 2.724 50 40 IFGB C#CCN1C(=O)/C(=N\NC(=O)CNc2ccc(C)cc2)c2cc(Br)ccc21 2330406 GQHOGSKQNOFPKY-CLCOLTQESA-N 425.286 2.670 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2cc(C)ccc2C)S(C)(=O)=O)cc1OC 14186073 XWWBETROAWHFAX-OEAKJJBVSA-N 445.541 2.793 50 40 IFGB O=C(CN1C(=O)[C@@H]2C[C@H](Br)[C@@H](Br)C[C@H]2C1=O)Nc1ccccc1 408673348 RGSNOYYCDPZIFD-NDBYEHHHSA-N 444.123 2.547 50 40 IFGB Cc1ccc(C)c(NC(=O)COc2ccc(Cl)cc2/C=N/NC(=O)C(=O)NC(C)C)c1 409172033 BAGCSKQRIXYCTR-BHGWPJFGSA-N 444.919 2.949 50 40 IFGB COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2C[C@@H]2C)ccc1Cl 12733705 PCRVNEITPOBTGZ-WCQYABFASA-N 437.905 2.566 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2cccc(OC3CSC3)c2)S(C)(=O)=O)cc1C 20208754 KJXYKMDLVRNETC-SSDVNMTOSA-N 447.582 2.714 50 40 IFGB Cc1cc2c(c(=O)n1CCCN1CCOCC1)[C@H](c1ccc(Cl)cc1)C(C#N)=C(N)O2 20519072 FMHUONXLVCCBDV-HXUWFJFHSA-N 440.931 2.751 50 40 IFGB CSCC[C@H](NC(=O)C1CC1)C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C 30673645 NBWKFSYQCLWHHW-HNNXBMFYSA-N 432.571 2.527 50 40 IFGB COc1cc(CC(=O)OC(=O)Cc2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC 100400154 WWQHLOVDTUCMGE-UHFFFAOYSA-N 434.441 2.593 50 40 IFGB COc1ccc([C@@H]2CC(=O)NC(SCC(=O)NC[C@H]3CCCO3)=C2C#N)cc1Cl 409313615 CXOYXAVAPRVJCE-KGLIPLIRSA-N 435.933 2.716 50 40 IFGB COc1ccc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc1 2417748 OQQOVSOFMBPSFK-NRMGUKERSA-N 446.463 2.698 50 40 IFGB COc1ccccc1NS(=O)(=O)c1cccc(C(=O)N/N=C/c2ccc([N+](=O)[O-])o2)c1 3204402 RYMBMAVHNVPXJR-UDWIEESQSA-N 444.425 2.761 50 40 IFGB CCOc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccc(Br)cc3)CC2=O)cc1 10092051 UGWGSIYIAJNDMV-CQSZACIVSA-N 446.301 2.662 50 40 IFGB O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 13129467 GLAFLDUGQVENSA-UHFFFAOYSA-N 445.585 2.839 50 40 IFGB O=C(COC(=O)CCC(=O)Nc1ccc(Cl)cc1)NNC(=O)c1ccccc1Cl 408664503 RATCVNJOKRSQLW-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB O=C(Cc1nnc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)s1)N/N=C/c1ccco1 408732544 WPHQYQYOAHUFHC-QGMBQPNBSA-N 434.821 2.638 50 40 IFGB COc1cccc(/C=N/NC(=O)[C@H](CC(C)C)NC(=O)COc2ccccc2C)c1O 408969715 SJKLNXNZXFZWOY-VQXFCIMOSA-N 427.501 2.769 50 40 IFGB C=CCOc1ccc(C(=O)N/N=C\c2ccc(OCC(N)=O)c(OCC)c2)cc1OCC 409325672 ZMCAKBABVCRCJT-QFEZKATASA-N 441.484 2.677 50 40 IFGB COc1cccc(/C=N\NC(=O)CCSCCC(=O)N/N=C/c2cccc(OC)c2)c1 31637231 HIENSDKBAVLDSG-REPVBDINSA-N 442.541 2.818 50 40 IFGB COc1cccc(C(=O)N2CCC(C(=O)N/N=C/c3ccc(OC)c([N+](=O)[O-])c3)CC2)c1 409006491 OFFBANXFRBBXEF-OEAKJJBVSA-N 440.456 2.615 50 40 IFGB O=C(CSc1ncnc2c1cnn2-c1ccccc1Cl)NNC(=O)c1ccco1 1346526 OSXRKCGEZASOSD-UHFFFAOYSA-N 428.861 2.615 50 40 IFGB COc1cc(C(=O)N[C@H](C(=O)N/N=C/c2ccc(F)cc2)C(C)C)cc(OC)c1OC 2328693 IUWKYPNYMPBYNE-OGBFJMLUSA-N 431.464 2.756 50 40 IFGB COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C[C@H]3C=CCC3)c2)cc1 12520929 DYTRPDHLGSNOMR-HNNXBMFYSA-N 429.498 2.613 50 40 IFGB O=C(NNC(=O)c1cc(-c2ccc(Br)cc2)n[nH]1)c1ccc2c(c1)OCCO2 58051807 KMJVKGNFFZYJOB-UHFFFAOYSA-N 443.257 2.685 50 40 IFGB COc1cc(/C=C(\C#N)C(=O)N2CCOCC2)ccc1OS(=O)(=O)c1ccc(C)cc1 408754103 LWNLMIZLZITZCH-QGOAFFKASA-N 442.493 2.537 50 40 IFGB CCc1cc(C)cc(OCC(=O)N/N=C\c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c1 409019225 ILCAJLKFJIXLNV-UCQKPKSFSA-N 426.473 2.831 50 40 IFGB COc1cc(/C=N/NC(=O)CNC2CCCCC2)cc(I)c1OC 409386942 OTLQXWHRBOTLSO-KEBDBYFISA-N 445.301 2.681 50 40 IFGB COc1c(O)ccc(/C=N\NC(=O)[C@H]2COc3ccc(C(C)(C)C)cc3O2)c1[N+](=O)[O-] 8721736 VXDMQRSDUOITKW-ATDNGYSZSA-N 429.429 2.897 50 40 IFGB COc1cc([C@H]2CC(=O)N3C(=C2C#N)SC[C@]3(O)c2ccco2)cc(OC)c1OC 12275508 RVUFBOFIUNKIPT-ASSNKEHSSA-N 428.466 2.949 50 40 IFGB O=C(NNC(=O)C1CCN(c2nc3ccccc3o2)CC1)c1cc(-c2ccccc2)n[nH]1 14331102 LCRIDIYRRXFXSO-UHFFFAOYSA-N 430.468 2.896 50 40 IFGB CCc1ccccc1N(CC(=O)N/N=C/c1cc(Br)c(C)o1)S(C)(=O)=O 20208942 HGSPQQPSPIUGKQ-VXLYETTFSA-N 442.335 2.829 50 40 IFGB Cc1cc(C)cc(OCC(=O)NNC(=O)CCCCCN2C(=O)c3ccccc3C2=O)c1 1800473 RLTRBBPHUIFCHA-UHFFFAOYSA-N 437.496 2.686 50 40 IFGB C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccccc3F)cc2)C1 16044596 NGMCWSUEWWGMGM-HUUCEWRRSA-N 433.505 2.567 50 40 IFGB CCOc1ccc(C(=O)NNC(=O)c2ccc(=O)n(Cc3ccccc3)c2)cc1OCC 16839271 MDKXZYAZVHEQHX-UHFFFAOYSA-N 435.480 2.769 50 40 IFGB CCOc1cc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc(Cl)c1OCC(=O)OC 35125114 CLCYOGDXFBXIRM-JJFYIABZSA-N 449.847 2.892 50 40 IFGB O=C(O)c1cccc(Cn2c(Cl)c(/C=N/NC(=O)c3ccc(O)cc3)sc2=O)c1 2235136 VCSDQLHEHATUIH-ZVBGSRNCSA-N 431.857 2.779 50 40 IFGB COc1ccc(/C=N/NC(=O)c2cccc(I)c2)cc1[N+](=O)[O-] 9948716 RNMWJKWZABIPFL-RQZCQDPDSA-N 425.182 2.972 50 40 IFGB COc1cc(OC)cc(C(=O)NNC(=O)CNC(=O)c2ccc(Oc3ccccc3)cc2)c1 12582037 IKVQDGXKVOQJCD-UHFFFAOYSA-N 449.463 2.687 50 40 IFGB CC1=C(C#N)C(=O)N([C@@H]2CCS(=O)(=O)C2)C(=O)/C1=C\c1ccc(-c2ccc(F)cc2)o1 13810790 RNOTXIYFCBWKER-LTKMBJGESA-N 440.452 2.865 50 40 IFGB O=C(Cn1c2ccccc2c(=O)c2ccccc21)N/N=C/c1cc([N+](=O)[O-])c(O)cc1O 59503533 VPXWHDZOHNDUAV-FOKLQQMPSA-N 432.392 2.624 50 40 IFGB COc1ccc(N2C(=O)[C@@H]3[C@H]4C[C@H]([C@@H]3C2=O)[C@@H](Br)[C@@H]4Br)cc1 169682438 KHYQVLDAIPZWMH-YOVYLDAJSA-N 429.108 2.978 50 40 IFGB CCOc1ccc(/C=N/NC(=O)CN(c2ccccc2C)S(C)(=O)=O)cc1OCC 408729887 KNYCZBXAJZZKON-HYARGMPZSA-N 433.530 2.709 50 40 IFGB Cc1nc2sccn2c1C(=O)N/N=C\c1ccc(CNS(=O)(=O)c2ccccc2)o1 408828643 NJVNDYLJQUNUEP-JAIQZWGSSA-N 443.510 2.540 50 40 IFGB Cc1ccccc1OCC(=O)N[C@H](CC(C)C)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 408973846 VTCULTMKBNQKRZ-QNDYCBLQSA-N 426.473 2.963 50 40 IFGB CCCCN1C(=O)c2ccc(C(=O)NNC(=O)c3ccc4c(c3)nc(C)n4CC)cc2C1=O 9662863 BJDMYDBBLWBJFU-UHFFFAOYSA-N 447.495 2.836 50 40 IFGB CCN1C(=O)/C(=N\NC(=O)[C@H](C)n2cnc3sc4c(c3c2=O)CCCC4)c2ccccc21 12374247 IUIZOGUXUIECFI-MIBOVRKWSA-N 449.536 2.785 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccccn2)c2ccccc2F)cc1 16309497 QOXLLZCNNUHSTC-ZVHZXABRSA-N 426.473 2.875 50 40 IFGB O=C(N/N=C/c1ccc(OCC(=O)N2CCOCC2)cc1)c1ccc(Cl)cc1Cl 408875085 CUAPNSUFMSUCMO-FSJBWODESA-N 436.295 2.995 50 40 IFGB CCOc1ccc(N2C(=O)/C(=C\NNC(=O)c3cccnc3)c3ccccc3C2=O)cc1 9491035 XCKWKDTTXCHXHR-QNGOZBTKSA-N 428.448 2.943 50 40 IFGB CC(C)C[C@@H](C(=O)NNC(=O)c1cn(C)c2ccccc12)N1C(=O)c2ccccc2C1=O 10736651 BEMKINRYTYDQQY-FQEVSTJZSA-N 432.480 2.650 50 40 IFGB COc1cc(/C=C(\C#N)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)cc2c1OCCO2 23215958 PLIRPBCQGSOKFF-GZTJUZNOSA-N 446.463 2.810 50 40 IFGB Cc1nc2ccccc2c(=O)n1[C@@H](C)C(=O)NNC(=O)c1ccc(COc2ccccc2)o1 32689670 PVOSRAAFOIFNNW-HNNXBMFYSA-N 446.463 2.899 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(C)cc2C)c(Cl)c1 409159162 QEOVIDOQNUFEQQ-BRJLIKDPSA-N 444.919 2.951 50 40 IFGB Cc1ccccc1OCC(=O)NNC(=O)c1nn(-c2ccccc2)c(=O)c2ccccc12 3451926 YPAQWYHBPBKOJW-UHFFFAOYSA-N 428.448 2.534 50 40 IFGB CCOc1cc(C(=O)NCC(=O)N/N=C/c2ccccc2OC)cc(OCC)c1OCC 3864904 JGBSTBQODXPGMA-AFUMVMLFSA-N 443.500 2.771 50 40 IFGB COc1ccc(OC)c([C@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4ccccn4)c(=O)c32)c1 37866395 TZXDZLWLXNWXRN-NRFANRHFSA-N 430.464 2.835 50 40 IFGB COc1ccc(C(=O)NNC(=O)c2ccc(OCc3c(C)noc3C)c(OC)c2)cc1 2630729 XPFAZIYWCNJQNJ-UHFFFAOYSA-N 425.441 2.962 50 40 IFGB C/C(CC(=O)Nc1ccc2c(c1)OCCO2)=N\NC(=O)C(=O)Nc1ccc(C)c(Cl)c1 12628857 IUBHJXDBGDDCCL-DHRITJCHSA-N 444.875 2.879 50 40 IFGB O=C(CN1C[C@H](c2ccccc2)CC1=O)N/N=C/c1cc2c(cc1Br)OCO2 16478311 BNPBPAIOXUUEOG-XUMUCCENSA-N 444.285 2.644 50 40 IFGB O=C(Cc1ccc2c(c1)OCO2)N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2C(=O)O)o1 409090523 NRDHOIDRJSMKMW-LSHDLFTRSA-N 437.364 2.975 50 40 IFGB COC(=O)COc1ccc(/C=N/NC(=O)Cc2ccc(Br)cc2)cc1OC 9204458 HZWQCTIFCCGBTC-SRZZPIQSSA-N 435.274 2.702 50 40 IFGB CC(C)(C)[Si](C)(C)OC[C@@H]1[C@@H]2[C@@H](O)N3[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H]3[C@H](O)N12 299803674 OIAGEYLUDDDVCA-MEIVTAPSSA-N 430.738 2.786 50 40 IFGB O=C(N/N=C/[C@H]1C(=O)NC(=O)N([C@H]2C[C@H]3CC[C@H]2C3)C1=O)c1ccc(Cl)cc1Cl 408536894 TUOUUHNFVIUNFM-YVNSINGJSA-N 437.283 2.592 50 40 IFGB Nc1nonc1-c1nc2ccccc2n1CC(=O)N/N=C/c1c(O)ccc2ccccc12 408721356 PXLGZKZXKRCPPF-BHGWPJFGSA-N 427.424 2.678 50 40 IFGB CC(C)CNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccccc1Cl 409171268 ZDOJBRJSQKZHCI-WYMPLXKRSA-N 430.892 2.580 50 40 IFGB COCCNC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc2c(c1)OCCO2 2647388 PTDPKLRKJOJYSQ-QGOAFFKASA-N 430.464 2.980 50 40 IFGB Cc1ccc(S(=O)(=O)N(CCc2ccccc2)CC(=O)N/N=C/c2ccco2)cc1 9056949 MLDRKPAXCFZJLX-XQNSMLJCSA-N 425.510 2.972 50 40 IFGB NC(=O)COc1ccc(/C=N/NC(=O)COc2ccc(C3SCCS3)cc2)cc1 408569430 NJVSMJCWTNFVAB-SSDVNMTOSA-N 431.539 2.558 50 40 IFGB O=C(COC(=O)CCCC(=O)Nc1ccc(F)cc1)NNC(=O)c1ccc(Cl)cc1 408666490 ZUMPQGAMVFGJHJ-UHFFFAOYSA-N 435.839 2.592 50 40 IFGB COc1cccc(/C=N\NC(=O)c2nn(-c3ccccc3C)c(=O)c(C#N)c2C)c1OC 409056445 DUYSQVDOEJLCQA-MXAYSNPKSA-N 431.452 2.502 50 40 IFGB CCOc1cc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)ccc1O 1058380 XUKLELVUSDQKQE-HZHRSRAPSA-N 445.541 2.650 50 40 IFGB C[C@@H](Oc1ccc(C#N)cc1)C(=O)NNC(=O)Cn1c(C(F)(F)F)nc2ccccc21 9376534 UVUBMSFPGNVMSX-GFCCVEGCSA-N 431.374 2.542 50 40 IFGB COc1cc(C(=O)NNC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)ccc1C 12904740 WPCLMZVZJWDAKJ-UHFFFAOYSA-N 428.466 2.645 50 40 IFGB Cc1nc(Sc2ccc(/C=N/NC(=O)c3cccc([N+](=O)[O-])c3)cc2[N+](=O)[O-])n[nH]1 409192089 URIOPGSKXKJPIQ-GIJQJNRQSA-N 427.402 2.845 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccc(C)c(C)c2C)S(C)(=O)=O)cc1OC 20211443 PHLFBLPZZBDYQM-WSDLNYQXSA-N 433.530 2.545 50 40 IFGB COC(=O)COc1c(Cl)cc(/C=N/NC(=O)c2ccc(OC)cc2OC)cc1OC 33526365 QOKCBHFXKQBTCH-LSHDLFTRSA-N 436.848 2.682 50 40 IFGB CC(C)CNC(=O)CC(=O)N/N=C\c1ccc(OCC(=O)N[C@H](C)c2ccccc2)cc1 59960439 LAUCXEXYNTUYHV-WTTSBOSASA-N 438.528 2.555 50 40 IFGB O=C(COC(=O)CCC(=O)Nc1cccc(Cl)c1Cl)NNC(=O)c1ccccc1 408661173 DTMLTEBKCZJQBN-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB COc1cc(OC)c(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)cc1Br 408725661 IHZCQXWMFHSDSI-ODCIPOBUSA-N 436.262 2.757 50 40 IFGB Cn1nnc([C@@H](Br)CC(Br)(Br)Br)n1 2344796 LMXRDIJTPNPVAQ-VKHMYHEASA-N 441.747 2.875 50 40 IFGB O=C(Cc1ccccc1)N/N=C(/c1nc2ccc([N+](=O)[O-])cc2nc1O)[C@@H](O)c1ccco1 17211317 CHTOQGYSOSVQCR-UZPCJBMISA-N 447.407 2.633 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1cccc(OC)c1OCc1ccc(Br)cc1 408602732 FKYUCQQIBORTDR-FSJBWODESA-N 446.301 2.789 50 40 IFGB COc1ccc(S(=O)(=O)N(CC(=O)NN=C2CCCC2)c2ccccc2)cc1OC 409117374 RAGGGRUWUZFDGN-UHFFFAOYSA-N 431.514 2.945 50 40 IFGB Cc1ccc(CNC(=O)C(=O)N/N=C/c2cccc(OCC(=O)Nc3ccccc3)c2)cc1 409261132 AGMDJANLPOZWLF-JVWAILMASA-N 444.491 2.779 50 40 IFGB COc1cc([C@H]2C(C#N)=C(N)Oc3c2oc(CO)cc3=O)ccc1OCc1ccccc1 6906976 VKSDQJZPMKYPEW-NRFANRHFSA-N 432.432 2.938 50 40 IFGB Cc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 96470222 UGBBUCMZSYUZMP-MOSHPQCFSA-N 434.521 2.965 50 40 IFGB C=CCOc1cccc(/C=N/NC(=O)[C@@H](C)N(c2ccc(OCC)cc2)S(C)(=O)=O)c1 408924502 JKHIATJRQHHBFQ-BXDFRRGMSA-N 445.541 2.955 50 40 IFGB COc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccco2)c2ccccc2)cc1OC 409122459 ZANPHWQLQPDRSO-HYARGMPZSA-N 443.481 2.642 50 40 IFGB CC1=C(C#N)C(=O)N(CCCN2CCCC2=O)C(=O)/C1=C\Nc1cccc2ncccc12 8991189 ZIWDXUDLAOXCTJ-CYVLTUHYSA-N 429.480 2.752 50 40 IFGB O=C(N/N=C/c1ccc(SCCO)c([N+](=O)[O-])c1)c1cc(Br)ccc1O 32124745 UTQSJQRBCDEBJD-GIJQJNRQSA-N 440.275 2.911 50 40 IFGB COc1cc(OC)cc(C(=O)N2CCC(C(=O)N/N=C/c3ccc([N+](=O)[O-])cc3)CC2)c1 59953145 SQHFAYSZLYYTKS-OEAKJJBVSA-N 440.456 2.615 50 40 IFGB CCCCOc1ccc(/C=N/NC(=O)CN(c2ccccc2OC)S(C)(=O)=O)cc1 408921116 DMYQMYABRHCHTQ-PXLXIMEGSA-N 433.530 2.790 50 40 IFGB COc1ccc(C)cc1N(CC(=O)N/N=C/c1cccc(C(F)(F)F)c1)S(C)(=O)=O 20212173 OEDUNGHZFFOQOZ-FOKLQQMPSA-N 443.447 2.939 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2c(C)cccc2C)S(C)(=O)=O)cc1OC 20213872 WMAAKWRNMZBKKK-OEAKJJBVSA-N 445.541 2.793 50 40 IFGB CCOC(=O)C1=C(C)NC(SCC(=O)OC)=C(C#N)[C@H]1c1ccc(C(=O)OC)cc1 100589756 FSPIIMLVWZQWBJ-GOSISDBHSA-N 430.482 2.638 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2cc(Cl)ccc2C)S(C)(=O)=O)cc1OC 408768535 GUZJVYZMWSHPEE-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB Cc1cc2c(c(=O)n1CCN(C)C)[C@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 2246230 TVWXBCZEEWUKTI-QGZVFWFLSA-N 429.318 2.699 50 40 IFGB O=C(CSc1nnc(-c2ccncc2)n1-c1ccccc1)NNC(=O)c1cccs1 15321305 MHSKACKKCFTDIF-UHFFFAOYSA-N 436.522 2.944 50 40 IFGB O=C(NNc1nc(N2CCCCC2)nc(N2CCCCC2)n1)Nc1ccc([N+](=O)[O-])cc1 16428404 FOTQIDXCGHTRFO-UHFFFAOYSA-N 441.496 2.909 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(OC)c(OC)c3)[C@@H]2C1 6194982 IIJLFGCSSSNMSQ-XLIONFOSSA-N 433.468 2.586 50 40 IFGB Cc1cc(C)c(C)c(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2cccs2)C(C)C)c1C 8877266 XYLREALZDOPJOU-KRWDZBQOSA-N 437.587 2.746 50 40 IFGB COC(=O)COc1ccc(/C=N/NC(=O)c2ccc(C#N)cc2F)cc1Br 9323631 JDMMAORQQSSYMP-LSFURLLWSA-N 434.221 2.776 50 40 IFGB Cc1cc(C)cc(N(CC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)S(C)(=O)=O)c1 20208531 GRIJGGZYEFUVAK-KEBDBYFISA-N 438.893 2.781 50 40 IFGB CCOc1cc(/C=N\NC(=O)CN2CCN(Cc3ccccc3Cl)CC2)ccc1O 32576982 QGYDUABWUVSJJE-OYKKKHCWSA-N 430.936 2.712 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1 409258192 RWHMHKBGIQBWBO-CHOFVFFHSA-N 430.892 2.722 50 40 IFGB CCNC(=S)NNC(=O)CSc1nnc(-c2ccc(OC)cc2)n1-c1ccccc1 1808708 JAIIAPDVADXZGW-UHFFFAOYSA-N 442.570 2.550 50 40 IFGB COc1ccc(N2C(=O)C[C@H](NNC(=O)CSc3ccc(C)cc3)C2=O)cc1Cl 3375113 YNLINEPHSCDWFW-INIZCTEOSA-N 433.917 2.702 50 40 IFGB COc1ccc(/C=N/NC(=O)C2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)c(OC)c1 8780676 ZGHSFXHNJCQJGF-OEAKJJBVSA-N 426.473 2.974 50 40 IFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)C1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 8780808 LCZJBMOGXXWBAB-CIAFOILYSA-N 427.417 2.571 50 40 IFGB O=C(NNC(=O)c1ccccn1)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1 21001277 BGXLPJDZCJXREO-UHFFFAOYSA-N 432.524 2.989 50 40 IFGB COC(=O)[C@H]1C(=O)NC(SCC(=O)Nc2ccccc2F)=C(C#N)[C@H]1c1ccccc1 409129973 SVKNPLMRFXRZNE-RTBURBONSA-N 439.468 2.935 50 40 IFGB COc1cc(/C=N/NC(=O)CSc2nnc(C)n2-c2ccccc2)cc(OC)c1OC 2740783 IVGQUSRGDPTYJD-WSDLNYQXSA-N 441.513 2.844 50 40 IFGB Cc1ccc(C(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1NC(=O)c1ccco1 9910646 SZDWAAOTTIFQLX-UHFFFAOYSA-N 431.452 2.731 50 40 IFGB O=C(CN1CCOCC1)N/N=C\c1ccc(-c2cc([N+](=O)[O-])c(Cl)cc2Cl)o1 59246507 KEDJYUSLWWXVRJ-UKWGHVSLSA-N 427.244 2.944 50 40 IFGB CCCOc1ccc(C(=O)N/N=C\c2ccc(OCC(N)=O)c(OCC)c2)cc1OCC 409318139 TVNONWNFZJHSEL-QFEZKATASA-N 443.500 2.901 50 40 IFGB CCn1c(SCC(=O)NNC(=O)c2ccc(OC)cc2)nnc1-c1ccc(OC)cc1 873200 FXIOLFQCVBQNKA-UHFFFAOYSA-N 441.513 2.536 50 40 IFGB COc1cc(/C=N/NC(=O)Cc2nnc(NC(=O)c3cccc(C)c3)s2)ccc1O 1952473 IDOJSAHWCSJSMD-SRZZPIQSSA-N 425.470 2.506 50 40 IFGB Cc1cc(=O)c(C(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)nn1-c1ccc(Cl)cc1 18055035 LOFRCBKAIZKTLL-CYBMUJFWSA-N 444.850 2.562 50 40 IFGB COc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccccc2O)c2ccccc2)cc1 19955691 MRIGOLDNWYLOAU-HZHRSRAPSA-N 439.493 2.746 50 40 IFGB O=C(CCCCC(=O)N/N=C\c1cccc([N+](=O)[O-])c1)N/N=C\c1cccc([N+](=O)[O-])c1 31729803 OIGXARFYWZPPQG-JZTLMNBPSA-N 440.416 2.664 50 40 IFGB O=C(CCC(=O)OCC(=O)Nc1ccc(Cl)cc1)NNC(=O)c1ccc(Cl)cc1 138797354 MSFFNCQGKHCLER-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccc(Cl)c(Cl)c1 409158384 XZIPISFTVZKKDI-AUEPDCJTSA-N 437.283 2.597 50 40 IFGB CCOc1cc(/C=N/NC(=O)[C@@H](O)c2ccccc2)cc(I)c1O 1431158 XIVGANJEKXFQBJ-RPJLVFAOSA-N 440.237 2.579 50 40 IFGB COc1ccccc1OCCN1C(=O)/C(=N\NC(=O)c2ccc(O)cc2)c2ccccc21 40137563 BEORKLRCYDQTPF-LVWGJNHUSA-N 431.448 2.961 50 40 IFGB N#CC1=C(N)Oc2[nH]c(=S)n(-c3ccccc3)c2[C@@]12C(=O)Nc1c([N+](=O)[O-])cccc12 8863679 OMQJXQXTZGGLNP-FQEVSTJZSA-N 432.421 2.768 50 40 IFGB Cc1cc(OCC(=O)NNC(=O)c2ccc(NC(=O)C3CC3)cc2)ccc1Br 9724472 PMFBXJQDCVZIOZ-UHFFFAOYSA-N 446.301 2.946 50 40 IFGB O=C(NNC(=O)c1cccc(NC(=O)c2ccc3c(c2)OCO3)c1)c1ccc([N+](=O)[O-])cc1 10038907 BNMSAJWUZGOMRS-UHFFFAOYSA-N 448.391 2.651 50 40 IFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3ccccc3[N+](=O)[O-])CC2)cc1OC 409007217 VMTCXOHAQVHDPI-OEAKJJBVSA-N 440.456 2.615 50 40 IFGB O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NNC(=O)c1ccc(O)cc1 8871637 QQDBGCFDJZARBA-RVDMUPIBSA-N 447.563 2.896 50 40 IFGB C/C(=N\NC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1Cl 12542905 ADIURRHXTGXUQR-XQNSMLJCSA-N 449.960 2.834 50 40 IFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)/C(=C/c1ccc2c(c1)OCO2)NC(=O)c1ccco1 13382101 KRWSPTMQNVYAAI-QYWMOJRTSA-N 448.391 2.838 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2cccc(Cl)c2Cl)cc1 409155769 MWVOGDMCDIOHCU-AUEPDCJTSA-N 437.283 2.597 50 40 IFGB COc1cccc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)c1O[C@H](C)C(=O)O 409251410 QDBQQTJHNYCSQC-MOROIOLQSA-N 448.475 2.933 50 40 IFGB CCOc1ccc(C(=O)N/N=C\c2cc(Cl)c(OCC(N)=O)c(OC)c2)cc1OCC 409336004 ZRZVHTLDLNORED-MYKKPKGFSA-N 449.891 2.774 50 40 IFGB CC[C@@H](C)C(=O)N(NC(=O)c1ccccc1)[C@H]1CC(=O)N(c2cc(C)ccc2OC)C1=O 96287349 OZMXKHPNQBEBDH-APWZRJJASA-N 437.496 2.855 50 40 IFGB COc1ccc(/C=N/NC(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)cc1[N+](=O)[O-] 409007192 UZVKNSQGYUGCIL-YDZHTSKRSA-N 428.420 2.745 50 40 IFGB COc1cc(/C=N/NC(=O)CNC(=O)c2ccccc2)ccc1OC(=O)c1cccs1 3663478 HVHOWIOSFRTJOK-ZMOGYAJESA-N 437.477 2.856 50 40 IFGB C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)CCC3)c1 10217293 YLLXTNSRNLYUIE-MRXNPFEDSA-N 441.553 2.813 50 40 IFGB N#CC1=C(N)N2CCc3cc4c(cc3C2=C[C@@]12C(=O)Nc1ccc(F)cc12)OCCCO4 13591374 ANAHWPGZGLJKPD-DEOSSOPVSA-N 430.439 2.784 50 40 IFGB Nc1nnnn1CC(=O)N/N=C/c1cn(Cc2ccc(Cl)c(Cl)c2)c2ccccc12 16525424 GQINVADIKZOVEA-LIMNOBDPSA-N 443.298 2.715 50 40 IFGB Cc1cccc[n+]1[C@H]1[C@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C([C-](C#N)C#N)N[C@@]1(O)C1CC1 169298850 VPFRCQCGNFASQJ-YFNKSVMNSA-N 440.463 2.617 50 40 IFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccc(Br)c1 408615072 LNDPZUDSBUPILU-GFCCVEGCSA-N 436.693 2.917 50 40 IFGB CCOc1cc(/C=N/NC(N)=O)cc(Br)c1OS(=O)(=O)c1ccccc1 408889350 CUSOCSHNLMMFKI-VXLYETTFSA-N 442.291 2.618 50 40 IFGB COc1ccc(OC)c(/C=N\NC(=O)c2nn(-c3ccc(C)c(C)c3)c(=O)c(C#N)c2C)c1 409055625 CQUYHRFIKLQSFV-ZMFRSBBQSA-N 445.479 2.811 50 40 IFGB CCOC(=O)c1c(NC(=O)c2ccc(O[C@@H](C)C(=O)NN)cc2)sc2c1CCCC2 958540 HQUXZPLWMUCMLH-LBPRGKRZSA-N 431.514 2.813 50 40 IFGB O=C(/C=C\c1ccco1)NCC(=O)N/N=C1\C(=O)N(CCc2ccccc2)c2ccccc21 38159785 PLWYVZQDLDAGCP-OCHFORBVSA-N 442.475 2.519 50 40 IFGB Cc1ccccc1NC(=O)CN1C(=O)/C(=N\NC(=O)c2ccccc2O)c2ccccc21 100484755 OKMCRXVDDUMYQM-ROMGYVFFSA-N 428.448 2.820 50 40 IFGB COC(=O)c1ccc(COc2ccc(/C=C(\C#N)c3nc(N)nc(N(C)C)n3)cc2)cc1 9503501 BDVBRLSSJXKTMH-LDADJPATSA-N 430.468 2.950 50 40 IFGB Cc1cc(O)ccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1C[C@H]2[C@@H](Br)[C@H]1Br 101052281 WHBYAKCYZUDQAB-DVAYIVIVSA-N 429.108 2.983 50 40 IFGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1ccc(O)c(I)c1 106225843 RTAYBFMAENTQNG-MFOYZWKCSA-N 425.182 2.598 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)NC2CC2)cc1)Nc1cccc(Cl)c1Cl 409254832 FZDSHENSVXVFFP-AUEPDCJTSA-N 449.294 2.740 50 40 IFGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)cc1 800962 ZOKKQGMKWYDJAJ-DTQAZKPQSA-N 435.465 2.832 50 40 IFGB CCn1c(SCC(=O)NNC(=O)c2ccc(Cl)cc2)nnc1-c1ccc(O)cc1 6878288 VBLBIWHDSHDSOF-UHFFFAOYSA-N 431.905 2.877 50 40 IFGB O=C(CCN1C(=O)/C(=C\c2ccco2)SC1=S)NNC(=O)c1cccc(Cl)c1 8820286 WJALNPRBDHRQFZ-GXDHUFHOSA-N 435.914 2.986 50 40 IFGB CCOc1ccccc1N(CC(=O)N/N=C/c1c(F)cccc1Cl)S(C)(=O)=O 20210566 XGJIZSKJSXKYLN-SRZZPIQSSA-N 427.885 2.794 50 40 IFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1)c1ccc(Br)cc1 408645364 SFZNQWIYCQNNIY-LBPRGKRZSA-N 436.693 2.917 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccc(Cl)cc1Cl 409161731 YZUZHNYFWXZHCB-BHGWPJFGSA-N 449.294 2.763 50 40 IFGB C[C@@H](NC(=O)COc1ccccc1)C(=O)N/N=C/c1ccc(-c2ccccc2C(=O)O)o1 409172339 COYILGAQYHKAOR-GMJSKMFWSA-N 435.436 2.679 50 40 IFGB C[C@@H]1CCc2c(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)csc2C1 5637473 PAWYKZWRZCEMCR-QGZVFWFLSA-N 426.586 2.846 50 40 IFGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)CN(c2ccc(C)cc2C)S(C)(=O)=O)c1 20208168 UXAYYZCZYZTRMJ-XQNSMLJCSA-N 430.530 2.568 50 40 IFGB CCc1ccc(N(CC(=O)N/N=C/c2ccc(OC3CSC3)cc2)S(C)(=O)=O)cc1 409026591 SYHAWSDEESAPER-WSDLNYQXSA-N 447.582 2.660 50 40 IFGB COc1ccccc1C(=O)NNC(=O)CCN1C(=O)/C(=C/c2cccs2)SC1=S 2087913 GRVSHOUSQFHPDS-PTNGSMBKSA-N 447.563 2.809 50 40 IFGB CCC(=O)NNC(=O)CSc1nnc2c3c4c(sc3nc(C3CC3)n12)C[C@H](C)CC4 13502588 WJXDVCWSHJYMHQ-SNVBAGLBSA-N 444.586 2.991 50 40 IFGB CCc1cc2c(=O)n(CC(=O)N/N=C\c3cc(Br)ccc3O)cnc2s1 31783509 SFONYYYAASCKFV-SCDVKCJHSA-N 435.303 2.639 50 40 IFGB COc1ccccc1NC(=O)N/N=C\c1cn(CC(=O)N2CCOCC2)c2ccccc12 96470355 CNZRJTOKVDCLEB-OYKKKHCWSA-N 435.484 2.664 50 40 IFGB O=C(N/N=C\[C@H]1C(=O)NC(=S)N(c2ccc(Cl)cc2)C1=O)c1cc2ccccc2o1 408848937 SVACRMRXMQOOPP-ISNLTARASA-N 440.868 2.866 50 40 IFGB CCn1c(SCC(=O)N/N=C/c2cccnc2)nnc1-c1ccc(OC)c(OC)c1 1477871 CAJWGPKTLPUGPS-WSDLNYQXSA-N 426.502 2.620 50 40 IFGB O=C(N/N=C/c1ccc(Br)cc1)c1cccc(S(=O)(=O)N2CCCC2)c1 3470079 YAKDTXZMYHFWGH-DEDYPNTBSA-N 436.331 2.998 50 40 IFGB CCC(=O)Nc1ccc(C(=O)NNC(=O)c2ccccc2I)cc1 670629 QXCUIENFIMPQEY-UHFFFAOYSA-N 437.237 2.715 50 40 IFGB CCn1ccc(C(=O)NNC(=O)c2cc3nc(-c4ccccc4)cc(C(F)(F)F)n3n2)n1 892516 ARZFJBHOGAEHAK-UHFFFAOYSA-N 443.389 2.706 50 40 IFGB N#C/C(=C\c1ccc(N2CCOCC2)cc1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCO2 9767724 LHGRGIQVGWKGNB-LFIBNONCSA-N 436.424 2.748 50 40 IFGB COc1cc([C@@H]2CC(=O)N3C(=C2C#N)SC[C@@]3(O)c2ccco2)cc(OC)c1OC 12275503 RVUFBOFIUNKIPT-YEJXKQKISA-N 428.466 2.949 50 40 IFGB Cc1ccc(C2=CS/C(=C(\C#N)C(=O)CN3CCN(C(=O)c4ccco4)CC3)N2)cc1 12555817 BSXBBQNZXCIOSU-RELWKKBWSA-N 434.521 2.985 50 40 IFGB COc1ccc(NC(=S)NNC(=O)c2ccc(I)c(O)c2)cc1 408585296 CSTAGYFMBXRRCD-UHFFFAOYSA-N 443.266 2.637 50 40 IFGB C[C@@H](NC(=O)COc1ccc(/C=N/NC(=O)CC2(C)OCCO2)cc1)c1ccccc1 408780720 JAIUOPXAXHMLSV-HIQXPHMNSA-N 425.485 2.546 50 40 IFGB CN1CCC(=NNC(=O)CN(c2ccccc2)S(=O)(=O)c2ccc(Cl)cc2)CC1 409027107 ZNYZFMUNMSGCDU-UHFFFAOYSA-N 434.949 2.733 50 40 IFGB Cc1c(C(=O)N/N=C\c2ccc(C(=O)O)cc2)nn(-c2ccc(Cl)cc2)c(=O)c1C#N 409058189 IXNPQZBWOVEZPF-MYKKPKGFSA-N 435.827 2.528 50 40 IFGB N#CC1=C(N)Oc2[nH]nc(-c3ccc(Cl)cc3)c2[C@]12C(=O)Nc1ccc([N+](=O)[O-])cc12 9359192 DYRGJXUMXDKNEX-HXUWFJFHSA-N 434.799 2.963 50 40 IFGB CCCn1c(=O)c(C(=O)N/N=C(\C)c2c(O)c3ccccc3[nH]c2=O)c(O)c2ccccc21 100669246 NWZZSJOTKAPQFH-LGJNPRDNSA-N 446.463 2.818 50 40 IFGB Cc1ccc(N2C(=O)[C@H](/C=N\NC(=O)c3ccccc3-n3cccc3)C(=O)NC2=S)cc1 408754492 NQBCDNWSOJSSDZ-YNJLWJOVSA-N 445.504 2.565 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccc(CSc3nncn3C)cc2)cc(OC)c1O 3238557 LOKRJGKVCJCDAV-UFFVCSGVSA-N 427.486 2.594 50 40 IFGB CCn1nc(C(=O)NNC(=O)COc2ccc(-c3ccccc3)cc2)c2ccccc2c1=O 9613341 PBGNJMXJMYGCIL-UHFFFAOYSA-N 442.475 2.923 50 40 IFGB COc1ccc(CC(=O)NNC(=O)c2csc(-c3cccc(OC)c3OC)n2)cc1 12868027 ZEMVADBYVZBMGM-UHFFFAOYSA-N 427.482 2.840 50 40 IFGB O=C(N[C@H](C(=O)NN=Cc1ccccc1)c1n[nH]c(=O)c2ccccc12)c1ccccc1 13142885 INIJLTOZUZPYLC-NRFANRHFSA-N 425.448 2.545 50 40 IFGB N#CC1=C(N)C(C#N)(C#N)[C@]2(C(=O)Nc3ccccc32)[C@H]2CN(Cc3ccccc3)CC[C@@H]12 13899104 VCIDMTWIRSOUQT-JCWFFFCVSA-N 434.503 2.798 50 40 IFGB COc1ccc(Br)cc1/C=N/NC(=O)CN1C[C@@H](c2ccccc2)CC1=O 16226506 RELWNZWPWCPEPS-RSFOSLOZSA-N 430.302 2.924 50 40 IFGB CCOc1cc(/C=N\NC(=O)[C@H](NC(=O)Cc2cccs2)C(C)C)ccc1OCC#N 35104045 AQNKDKDOGOQFEK-ZPZBNPFISA-N 442.541 2.883 50 40 IFGB O=C(N/N=C/c1ccc(N2CCCC2)o1)c1ccc(I)c(O)c1 59138215 OVEVNVLKAVFWBM-VCHYOVAHSA-N 425.226 2.954 50 40 IFGB CC(C)CNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2Cl)cc1 59959635 JUENCONBZQHOJR-WYMPLXKRSA-N 430.892 2.580 50 40 IFGB CCOc1ccc(/C(C)=N/NC(=O)CN(c2ccccc2OCC)S(C)(=O)=O)cc1 408771741 CAOMUGUFGVIYAJ-CJLVFECKSA-N 433.530 2.790 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2ccc(Cl)cc2C)S(C)(=O)=O)c1OC 408774336 CBZSITKSSMNQPG-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB COc1ccc(-n2ncc3c(SCC(=O)NNC(=O)C4CCCCC4)ncnc32)cc1 1346642 BANDYDUIBMCPKV-UHFFFAOYSA-N 440.529 2.644 50 40 IFGB COC(=O)c1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(Br)cc3)C2)cc1 2403441 BKFXYYOOWGOPTR-URMYYVDKSA-N 444.285 2.739 50 40 IFGB Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)NNC(=O)c1ccccc1O 12855216 JPRZFDSAOIZFRO-UHFFFAOYSA-N 443.456 2.715 50 40 IFGB CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc(Cl)c1OC 13069959 NFKUVHRIDWRPRP-MDWZMJQESA-N 435.889 2.940 50 40 IFGB CN(CC(=O)N/N=C/c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1cc(Cl)ccc1Cl 16187092 SEXCGWZWHQZBDL-DJKKODMXSA-N 445.284 2.672 50 40 IFGB O=C(NCc1ccc(Cl)cc1)NNC(=O)c1cccn(Cc2cccc(F)c2)c1=O 23136112 JVJZBPOEXKXICR-UHFFFAOYSA-N 428.851 2.833 50 40 IFGB COc1cc(N2CCOCC2)ccc1/C=N/NC(=O)COc1ccc(Br)cc1 409227079 OQABPZDWWGHPGW-LPYMAVHISA-N 448.317 2.823 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NCc3ccco3)cc2)c(C)c1 409263470 LDNZMDMKHOSSPF-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB COc1cc2c3c(c1)[C@]1(C(=O)N3C(C)(C)C=C2C)C(C#N)=C(N)Oc2cc(C)oc(=O)c21 2423879 DJNLPGCLERZLKF-DEOSSOPVSA-N 431.448 2.871 50 40 IFGB COc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)cc1CN1CCOCC1 20458699 AXZXXUIOFIOWHQ-NRFANRHFSA-N 445.475 2.852 50 40 IFGB COc1ccc(OC)c(S(=O)(=O)N(C)CC(=O)N/N=C\c2cccc3ccccc23)c1 39986658 ABCHBIZIJRRVAC-UCQKPKSFSA-N 441.509 2.628 50 40 IFGB O=C(NNC(=O)[C@@H]1CCCN(c2nc3ccccc3s2)C1)c1cccc([N+](=O)[O-])c1 40140079 MNLFLSNYMDVCRM-CQSZACIVSA-N 425.470 2.882 50 40 IFGB O=C(O)c1ccccc1N1C(=O)[C@@H]2[C@@H]3C[C@H]([C@H](Br)[C@@H]3Br)[C@@H]2C1=O 100537373 RVSOKZITIXHEOI-MBBWPEKLSA-N 443.091 2.667 50 40 IFGB COC(=S)O[C@@H]1C[C@@H](n2cnc3c(=O)[nH]cnc32)O[C@@H]1CO[Si](C)(C)C(C)(C)C 195495695 AKHWATRAUQBPHS-UPJWGTAASA-N 440.598 2.745 50 40 IFGB CCc1ccc(N2C[C@H](C(=O)N/N=C\c3cc(OC)c(OC)c(OC)c3)CC2=O)cc1 409163303 PHCJHBIFYRINFL-ZKDCOOFMSA-N 425.485 2.778 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(Br)cc3)C2)c1 409167680 JRUQNINJDQZCLT-DACUGSJHSA-N 446.301 2.970 50 40 IFGB COc1cc(/C=N/NC(=O)[C@H](C)n2cnc3sc4c(c3c2=O)CCCC4)ccc1O 958175 JHFBEXQXOQWOJB-RPCHLKFKSA-N 426.498 2.762 50 40 IFGB N#CC1=C(N)N(c2ccc(C(F)(F)F)cc2)C2=C(C(=O)OC2)[C@]12C(=O)Nc1ccccc12 12377306 KCCRJOWIBHDPSO-OAQYLSRUSA-N 438.365 2.920 50 40 IFGB C[N+](C)(C)CC(=O)NC(=O)N/N=C/[C@@H](CC#N)CN(Cc1ccccc1)Cc1ccccc1 16958074 CHOCXJOLMFXXPK-PVPASAESSA-O 449.579 2.736 50 40 IFGB Cc1ccc(NC(=O)COC(=O)CCC(=O)NNC(=O)c2ccccc2Cl)cc1C 408644949 JBWFGWQGCNJDFQ-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB O=C(O)c1cc([N+](=O)[O-])ccc1-c1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2O)o1 409079636 LLNQRKXLWOKGEO-AWQFTUOYSA-N 440.324 2.931 50 40 IFGB Cc1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)[C@H]3[C@@H](C(=O)O)[C@H]4C=C[C@H]3C4)cc2)cc1 409370548 SVCXBMKPJUAOPR-XEYPJELSSA-N 433.464 2.531 50 40 IFGB COc1ccccc1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 3396504 BYCASKFJBGPQFS-UHFFFAOYSA-N 428.448 2.528 50 40 IFGB COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNc3cccc(C(=O)O)c3)c2)cc1 3454424 FKRXWNVXRJUKNY-UHFFFAOYSA-N 441.465 2.951 50 40 IFGB O=C(CCl)NCCNC(=O)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F 8781899 XNHOZLJAMPLXDI-UHFFFAOYSA-N 436.736 2.654 50 40 IFGB COc1cc(/C=N/NC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(C)cc3)C2)cc(OC)c1 9613297 YBJNTVNKGGZWCJ-UEIZDATPSA-N 445.541 2.563 50 40 IFGB Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(F)c(Cl)cc2Cl)cc1 12729397 VRJCXYJFLYHGMQ-UHFFFAOYSA-N 448.303 2.523 50 40 IFGB CC1=C(C#N)C(=O)N([C@H]2CCS(=O)(=O)C2)C(=O)/C1=C\c1ccc(-c2ccc(F)cc2)o1 13810791 RNOTXIYFCBWKER-PMFHANACSA-N 440.452 2.865 50 40 IFGB Cc1ccc(N2C(=O)NC(=O)/C(=C/NNC(=O)C34CC5CC(CC(C5)C3)C4)C2=O)cc1C 16312130 WHPSBFIUFCGICU-UNOMPAQXSA-N 436.512 2.607 50 40 IFGB CC(=O)N1C[C@@H](C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)Oc2ccccc21 12698261 KIKFITLVPPQRPQ-SFHVURJKSA-N 427.526 2.982 50 40 IFGB Cc1ccc(NC(=O)COC(=O)CCCC(=O)NNC(=O)c2ccccc2)cc1Cl 138600704 MFQIRAVTWPLKLO-UHFFFAOYSA-N 431.876 2.762 50 40 IFGB COc1cc(/C=C(/C#N)C(=O)NC(C)C)cc(I)c1OCC#N 408783248 MYYQUWITQDQOCK-SDQBBNPISA-N 425.226 2.634 50 40 IFGB COc1cc(/C=N/NC(=O)CN(c2ccc(Cl)c(Cl)c2)S(C)(=O)=O)ccc1O 408926499 UINPDLVKJQPWIF-AWQFTUOYSA-N 446.312 2.624 50 40 IFGB Cc1ccc(/C=N/NC(=O)COc2ccc(OCC(=O)N/N=C/c3ccc(C)o3)cc2)o1 2261452 HZTNKLANAWUYNV-ASIDMNOUSA-N 438.440 2.548 50 40 IFGB CCCCCn1nc(C(=O)NNC(=O)NCCc2ccc(F)cc2)c2ccccc2c1=O 12898286 YDKZORHGHAIQBO-UHFFFAOYSA-N 439.491 2.913 50 40 IFGB CCOc1ccc(CC(=O)NNC(=O)c2ccc(=O)n(Cc3ccc(Cl)cc3)c2)cc1 16839359 CXOOQKKJDHFOEN-UHFFFAOYSA-N 439.899 2.952 50 40 IFGB Cc1ccc(S(=O)(=O)/C(C#N)=C\N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1C 36589902 HCRPWXZDJHTAQC-QNGOZBTKSA-N 439.537 2.989 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)NCCc2ccccc2)cc1)Nc1ccccc1 58873708 KHPKDEXWVAYVFC-WPWMEQJKSA-N 444.491 2.513 50 40 IFGB CCc1ccc(NC(=O)COC(=O)CCC(=O)NNC(=O)c2ccccc2Cl)cc1 138574581 PBWAYGMNPYNFCX-UHFFFAOYSA-N 431.876 2.626 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)c(C)c1 408875126 DHFZZXOGGSIKNK-MEGCXXLRSA-N 435.933 2.960 50 40 IFGB COc1cccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(Br)cc3)C2)c1O 409159098 QABLHRXKYYNFBB-IMRMQAIZSA-N 432.274 2.667 50 40 IFGB Cc1ccccc1Oc1nc2c(C)cccn2c(=O)c1/C=C(\C#N)C(=O)N1CCOCC1 3644318 MSSRZTXTELRNTP-NBVRZTHBSA-N 430.464 2.869 50 40 IFGB COc1cc([C@H]2CC(=O)N3C(=C2C#N)SC[C@@]3(O)c2ccco2)cc(OC)c1OC 12275505 RVUFBOFIUNKIPT-LRTDBIEQSA-N 428.466 2.949 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)c(C)c1 408875128 DHFZZXOGGSIKNK-PPRFWAEMSA-N 435.933 2.960 50 40 IFGB CC/C(=N\NC(=O)CN(c1cccc(F)c1)S(C)(=O)=O)c1ccc(OC)c(OC)c1 409110182 TXRJEOWTPAHVCZ-OQKWZONESA-N 437.493 2.539 50 40 IFGB Cc1cccc(C)c1N(CC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1Cl)S(C)(=O)=O 409184637 HRCIXPDCIVYCLK-KEBDBYFISA-N 438.893 2.781 50 40 IFGB Cc1sc2ncn(CC(=O)N/N=C3\C(=O)Nc4ccccc43)c(=O)c2c1-c1ccccc1 1783897 OFQSSPLYWPXTGB-UHFFFAOYSA-N 443.488 2.906 50 40 IFGB C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(OCC(=O)N2CCOCC2)cc1 16322165 OJWRITLYLZCXOB-HAFIMRKLSA-N 427.526 2.555 50 40 IFGB Cc1cccc(N(CC(=O)N/N=C2\C(=O)Nc3ccccc32)S(=O)(=O)c2ccccc2)c1 19947996 UBGMAQXRZVODRF-UHFFFAOYSA-N 448.504 2.663 50 40 IFGB O=C(Cc1csc(N2CCOCC2)n1)NNC(=O)c1cccc(Oc2ccccc2)c1 22601187 CKNHUSYFNVCFCC-UHFFFAOYSA-N 438.509 2.776 50 40 IFGB CCOC(=O)COc1c(Br)cc(/C=C(/C#N)C(=O)N(C)C)cc1OCC 59334681 VSLOYTYURTZTJI-QPEQYQDCSA-N 425.279 2.785 50 40 IFGB Cc1ccc(NC(=O)C(=O)N/N=C/c2cccc(OCC(=O)NCc3ccccc3)c2)cc1 409164531 JWGQRQGBFDGPMT-JVWAILMASA-N 444.491 2.779 50 40 IFGB COc1cc(/C=N/NC(=O)CNc2ccccc2)cc(I)c1O 57610973 CJYDEJFQFWHWCL-DJKKODMXSA-N 425.226 2.568 50 40 IFGB CCOc1ccc(N(CC(=O)N/N=C/c2ccccn2)S(=O)(=O)c2ccccc2)cc1 59472754 VKUXRDRZMCHPAN-LFVJCYFKSA-N 438.509 2.826 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)c1cccc(C(F)(F)F)c1 408779148 ANMBPQKIHBURMI-UFFVCSGVSA-N 444.391 2.530 50 40 IFGB COC(=O)c1ccc(/C=N/NC(=O)CN(c2ccc(C(C)C)cc2)S(C)(=O)=O)cc1 408782965 LNOHVJWZKQEZGN-LPYMAVHISA-N 431.514 2.513 50 40 IFGB COc1ccc(C(=O)NNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 408995262 BEHDPRDJACEARN-UHFFFAOYSA-N 434.408 2.931 50 40 IFGB Cc1ccccc1OCCCOc1cccc(/C=N/NC(=O)Cc2nnc(N)s2)c1 9113168 MEPXYNVTWMYFNL-OEAKJJBVSA-N 425.514 2.969 50 40 IFGB Cc1[nH]c2ccccc2c1[C@H]1c2ccccc2C(=O)N1CC(=O)NNC(=O)c1ccncc1 9581912 ROGNDNRMDWHUNL-HSZRJFAPSA-N 439.475 2.878 50 40 IFGB O=C(O)CC1(CC(=O)NNC(=O)COc2cccc(Br)c2)CCCCC1 13062619 RICMGTAXYKYNGZ-UHFFFAOYSA-N 427.295 2.791 50 40 IFGB CCOC(=O)c1ccc(NC(=O)C/C(C)=N/NC(=O)COc2ccc(OC)cc2)cc1 14921831 URBJXOVLDCMQOI-BUVRLJJBSA-N 427.457 2.772 50 40 IFGB CSc1ncccc1C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1 17518761 KFFPODXXOMESPI-UHFFFAOYSA-N 448.551 2.741 50 40 IFGB CC(=O)Nc1ccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(Cl)cc3)o2)cc1 408636644 BMQDRIJBJTXWKL-UHFFFAOYSA-N 445.888 2.902 50 40 IFGB O=C(N/N=C/[C@H]1C(=O)NC(=S)N(c2ccccc2)C1=O)c1ccc(Cl)c(Cl)c1 408741997 UDVTZFQEPPPUPW-NLTBIBMSSA-N 435.292 2.773 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc(Br)cc1)c1ccc(F)cc1 408778306 DCBPCPCIQJPADF-VXLYETTFSA-N 428.283 2.505 50 40 IFGB COc1cc(C(=O)Oc2ccccc2/C=N/NC(=O)c2cc(C)n[nH]2)cc(OC)c1OC 873044 OLMVBWXYOCTSTO-FSJBWODESA-N 438.440 2.727 50 40 IFGB C/C(=N\NC(=O)c1ccc2c(c1)OCO2)c1ccc(S(=O)(=O)NCc2ccco2)cc1 9439656 GNPYDKYHJDHWQL-OEAKJJBVSA-N 441.465 2.641 50 40 IFGB Cc1ccccc1NC(=O)[C@@H]1[C@H](c2cccs2)C(C#N)=C(SCC(N)=O)N[C@@]1(C)O 19830708 XRUZMSXODHJDKY-WFXMLNOXSA-N 442.566 2.660 50 40 IFGB CCOc1ccc(N(CC(=O)N/N=C/c2c(F)cccc2Cl)S(C)(=O)=O)cc1 58918979 TVXDKUMMOOPEDT-SRZZPIQSSA-N 427.885 2.794 50 40 IFGB CCOc1ccccc1N(CC(=O)N/N=C/c1ccncc1)S(=O)(=O)c1ccccc1 58924842 IEASHPZZEPSQDH-LFVJCYFKSA-N 438.509 2.826 50 40 IFGB COc1ccc(N2C(=O)C[C@@H](NNC(=O)CSc3ccc(C)cc3)C2=O)cc1Cl 102314226 YNLINEPHSCDWFW-MRXNPFEDSA-N 433.917 2.702 50 40 IFGB O=C(N/N=C\c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1cccc(Br)c1 409005175 DAXAROZVSJXGGC-NDENLUEZSA-N 433.262 2.958 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2Cl)cc1 409163174 MXKXFUOAIFAPLJ-ZMOGYAJESA-N 430.892 2.724 50 40 IFGB COc1cc(OC)cc(-c2nnc(SCC(=O)NNC(=O)c3cccs3)s2)c1 15021550 TVENZNDOFLOURB-UHFFFAOYSA-N 436.540 2.837 50 40 IFGB COc1ccc(/C=N\NC(=O)/C(=C\Nc2nccc(C)n2)NC(=O)c2ccccc2)cc1 100324043 WTAPNQLJGXVTTG-GBLDUJJRSA-N 430.468 2.627 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(Br)cc3)C2)c1 409167683 JRUQNINJDQZCLT-HYLGSWLWSA-N 446.301 2.970 50 40 IFGB CS(=O)(=O)c1ccc2nc(NC(=O)/C(C#N)=C/c3ccc4c(c3)OCO4)sc2c1 41074209 YBNWQAPIJUUSKF-WUXMJOGZSA-N 427.463 2.974 50 40 IFGB CCOc1ccccc1/C=N/NC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 59922217 WSAOYZAAUDCWKX-XQNSMLJCSA-N 429.542 2.945 50 40 IFGB CCOC(=O)C1=C(C(=O)OCC)[C@H]2C=C[C@H]1[C@H]1[C@H](Br)[C@H](Br)[C@H]21 104279265 BMXZYPYGMGQTHX-MQWJLDNFSA-N 434.124 2.998 50 40 IFGB O=C(N/N=C\[C@@H]1C(=O)NC(=S)N(c2ccc(Cl)cc2)C1=O)c1cc2ccccc2o1 408848933 SVACRMRXMQOOPP-FIEDDBFWSA-N 440.868 2.866 50 40 IFGB CCOc1cc(/C=C(/C#N)C(=O)NC2CCCCC2)ccc1OCC(=O)N1CCOCC1 409010401 KIFDQCGTIBYWOC-RGEXLXHISA-N 441.528 2.679 50 40 IFGB C#CCN1C(=O)/C(=N/NC(=O)COc2ccc(Cl)cc2Br)c2ccccc21 9379714 UHOBQJVJXBVKMO-PTGBLXJZSA-N 446.688 2.982 50 40 IFGB CCOc1ccc(/C=N/NC(=O)CN(c2ccc(F)cc2)S(C)(=O)=O)cc1OCC 20211872 MNEWEIGQHMVEMH-LPYMAVHISA-N 437.493 2.539 50 40 IFGB O=C(NN/C=C1\C(=O)N(c2cccc(C(F)(F)F)c2)C(=S)N=C1O)c1ccncc1 38163767 YHKPCXUWEGCGBH-LCYFTJDESA-N 435.387 2.507 50 40 IFGB COc1ccc(/C=N/NC(=O)c2cc[nH]n2)cc1Cn1nc(C)c(Br)c1C 8951338 KDBAKQDAFKJOAJ-ZVBGSRNCSA-N 431.294 2.806 50 40 IFGB Cn1c(CC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)nc2ccccc21 9882832 GANIKMDVIYCXJJ-UHFFFAOYSA-N 428.492 2.933 50 40 IFGB COc1ccc(Cl)cc1-c1nnc(SCC(=O)NNC(=O)COc2ccccc2)o1 408636618 BEKFDXNZMMDTNT-UHFFFAOYSA-N 448.888 2.717 50 40 IFGB CCOc1ccc(/C=N/NC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)cc1OC 408753164 DWLDHEKGGSPXQH-VSIOZEBNSA-N 447.557 2.856 50 40 IFGB N#C/C(=C\c1ccc(-c2ccc(S(N)(=O)=O)cc2)o1)C(=O)Nc1ccc(C(=O)O)cc1 408897678 SLQQRLAQAKOWKG-RVDMUPIBSA-N 437.433 2.838 50 40 IFGB O=C(N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2)c1cccc(I)c1 727779 IJJXXOLSNRXGFH-REZTVBANSA-N 439.165 2.692 50 40 IFGB COC(=O)C1=C(CSc2nc(C)cc(C)c2C#N)OC(N)=C(C#N)[C@H]1c1cccnc1 8451018 NUGYPODQGRYJRW-GOSISDBHSA-N 433.493 2.992 50 40 IFGB COc1ccc(/C=N/NC(=O)c2ccc(I)cc2)cc1[N+](=O)[O-] 10118448 APEDHWWQYLDNCB-RQZCQDPDSA-N 425.182 2.972 50 40 IFGB CN(c1ccc(C(=O)N/N=C2\C(=O)Nc3ccccc32)cc1)S(=O)(=O)c1ccccc1 20059315 MIDKTMYPHNTSKM-UHFFFAOYSA-N 434.477 2.598 50 40 IFGB COc1cc(/C=N/NC(=O)C(=O)Nc2ccccc2Cl)cc(Br)c1O 59101416 BGDRTVWFHCWEMI-UFWORHAWSA-N 426.654 2.906 50 40 IFGB Cc1cccc(C[C@@H]2S/C(=C(\C#N)C(=O)NN3CCOCC3)N(c3ccccc3)C2=O)c1 101179632 DDOTWASNXFGHRZ-VLBGROSNSA-N 448.548 2.785 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 408787315 XJLFPPIPJPNXFY-UFFVCSGVSA-N 444.391 2.530 50 40 IFGB O=C(N/N=C/c1ccccn1)c1nn(Cc2cccc(Br)c2)cc1[N+](=O)[O-] 1086846 XRVNRQGDLLIZIN-AWQFTUOYSA-N 429.234 2.761 50 40 IFGB CCn1c(SCC(=O)N/N=C/c2ccncc2)nnc1-c1ccc(OC)c(OC)c1 1477889 OPPXNUJMJMGHDY-WSDLNYQXSA-N 426.502 2.620 50 40 IFGB CCOc1ccc(-c2c(C(=O)N/N=C(\CC)c3ccccc3)nnn2-c2nonc2N)cc1 13540117 ZSXLLCFRVDRJSK-JJIBRWJFSA-N 446.471 2.842 50 40 IFGB CCc1ccc(-n2nc(C(=O)N/N=C\c3ccc(N(C)C)cc3)c(C)c(C#N)c2=O)cc1 409062070 MWMIEVRJEYUZDG-YSMPRRRNSA-N 428.496 2.805 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccc(F)c(Cl)c2)c1 409154119 FVJNXAUOOVYQLR-BRJLIKDPSA-N 448.882 2.863 50 40 IFGB Cc1cc(C)c(NC(=O)COc2ccccc2/C=N/NC(=O)C(=O)NCC(C)C)c(C)c1 409160393 WTRURRBJFPFFSR-LGJNPRDNSA-N 438.528 2.852 50 40 IFGB CCCOc1ccc(/C=N/NC(=O)C(=O)Nc2cc(OC)ccc2OC)cc1OCC 59515660 CDEHFGAJCFBEGU-OEAKJJBVSA-N 429.473 2.980 50 40 IFGB COc1ccc(-c2csc(NC(=S)N[C@H]3CS(=O)(=O)C[C@@H]3Cl)n2)cc1OC 575421102 HTCNHGFOJCJOHT-JQWIXIFHSA-N 447.991 2.518 50 40 IFGB N#C/C(=C\c1c(Oc2ccccc2Cl)nc2ccccn2c1=O)C(=O)N1CCOCC1 2398152 JQLHMGPMOHQWRW-FYWRMAATSA-N 436.855 2.906 50 40 IFGB C/C(=N\NC(=O)CN(c1ccccc1Br)S(C)(=O)=O)c1ccc(F)cc1 20214159 BJRQSKUXAAODLY-UDWIEESQSA-N 442.310 2.895 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1OCC(=O)Nc1ccc(CC)cc1 408609014 IZBJZSNKAOLTEW-DHRITJCHSA-N 442.903 2.672 50 40 IFGB COC(=O)c1ccc(/C=N/NC(=O)[C@@H](CC(C)C)NC(=O)COc2ccccc2C)cc1 408972110 SABPBNHIEGTQEH-UMFTVLFGSA-N 439.512 2.842 50 40 IFGB COCCCNC(=O)CSC1=C(C#N)[C@H](c2cccc(Br)c2)CC(=O)N1 409311811 IISLMNIOLBVQNP-AWEZNQCLSA-N 438.347 2.674 50 40 IFGB CCn1c(SCC(=O)N/N=C/c2cccc(O)c2)nnc1-c1ccc(OC)c(OC)c1 1477887 ZPVJOQUKPCWNGN-WSDLNYQXSA-N 441.513 2.930 50 40 IFGB CN(CC(=O)N/N=C/c1ccccc1Cl)S(=O)(=O)c1ccc(Br)cc1 16187171 UBASPRXLYRCAAA-VXLYETTFSA-N 444.738 2.873 50 40 IFGB COc1cc(C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)ccc1I 408746229 CRKBZFOWOJINSZ-RQZCQDPDSA-N 425.182 2.972 50 40 IFGB O=C(COc1ccccc1/C=N/NC(=O)C(=O)NC1CC1)Nc1ccc(Cl)cc1Cl 409257864 RAWHYDLDJAFKST-AUEPDCJTSA-N 449.294 2.740 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccccc2Cl)c1 409272885 TZNWWCHTJZRGSY-XMTZNVEYSA-N 430.892 2.722 50 40 IFGB CCOc1cc(/C=N\NC(=O)c2ccc(OC)c(OC)c2)cc(Cl)c1OCC(=O)O 409310227 SIKAMFLGSGQBKK-YVNNLAQVSA-N 436.848 2.983 50 40 IFGB COc1cc(C=C(C#N)C#N)ccc1OCC(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 16406543 RFIAVTDFAQDNPD-UHFFFAOYSA-N 443.463 2.941 50 40 IFGB CCc1cccc2c(/C=C(\C#N)C(=O)NCc3ccc4c(c3)OCO4)cn(CC(N)=O)c12 59087268 JYMCXQPFNBLQBO-RQZCQDPDSA-N 430.464 2.641 50 40 IFGB CCc1sc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)cc1C 9442936 DYZXFHUIUZRCER-LAJNKCICSA-N 434.562 2.517 50 40 IFGB O=C(CCN1C(=O)/C(=C/c2ccccc2Cl)SC1=S)NNC(=O)c1ccncc1 13799437 YOUIIVHRFWCFRH-PTNGSMBKSA-N 446.941 2.788 50 40 IFGB Cc1nn(-c2ccccc2)c(O)c1/C=N/NC(=O)COc1ccc(Cl)cc1[N+](=O)[O-] 67192562 GDAZLIGMCVEEDU-UFFVCSGVSA-N 429.820 2.977 50 40 IFGB O=C(/C=C/c1ccco1)NCC(=O)N/N=C1\C(=O)N(CCc2ccccc2)c2ccccc21 100813033 PLWYVZQDLDAGCP-KFKGYVHHSA-N 442.475 2.519 50 40 IFGB CCOc1cc(/C=N/NC(=O)[C@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)ccc1O 408759373 CYWLGAWPBWLLDU-CCULFSDZSA-N 433.530 2.553 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cc(OC)ccc3OC)[C@@H]2C1 6194979 MZHIUBKIYFQJRU-QUCCMNQESA-N 433.468 2.586 50 40 IFGB O=C(CCCCC(=O)N/N=C/c1ccccc1[N+](=O)[O-])N/N=C/c1ccccc1[N+](=O)[O-] 8756454 SEZBXHIOASDTAX-JFMUQQRKSA-N 440.416 2.664 50 40 IFGB CC(C)Oc1ccc(C(=O)NCC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1 14238646 OTIOLWJDCNJUDK-KRWDZBQOSA-N 449.507 2.972 50 40 IFGB CCOc1ccc([C@H](O)CCC(=O)N/N=C/c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 58892648 COVSNFHFRHYGEM-MNOULKQQSA-N 431.445 2.975 50 40 IFGB C=CCOc1ccc(C(=O)N/N=C\c2ccc(OCC(N)=O)c(Cl)c2)cc1OCC 409333967 KPGLENUWWHFOPK-MSXFZWOLSA-N 431.876 2.932 50 40 IFGB COc1ccc(CNC(=S)NNC(=O)Cc2ccc(OC)c(Br)c2)cc1 1273336 MTKHXWKMRAMOHQ-UHFFFAOYSA-N 438.347 2.704 50 40 IFGB COc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)ccc1OCC(=O)NCc1ccccc1 9631704 BSEFVDUAPKSFJG-QFIPXVFZSA-N 445.479 2.640 50 40 IFGB CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H](NC(=O)c2ccccc2F)C(C)C)cc1 13011350 CTUAPNMMAUTBJO-FOIQADDNSA-N 445.491 2.594 50 40 IFGB NC(=O)COc1ccc(/C=N/NC(=O)CSCc2cccc(Br)c2)cc1 28213803 CXKXCBXRWXRFDH-ZVBGSRNCSA-N 436.331 2.697 50 40 IFGB CC[C@H](Oc1cc(Cl)ccc1Cl)C(=O)NNC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 102201771 APTZUNALKUCBEW-VGFDRUHJSA-N 427.284 2.821 50 40 IFGB O=C(NC1CCN(C(=O)NNC(=O)c2ccccc2Br)CC1)c1ccccc1 9584038 OBZLHSNACVGORY-UHFFFAOYSA-N 445.317 2.698 50 40 IFGB Cc1ccc(C(=O)OCC(=O)NNC(=O)c2ccccc2F)cc1NC(=O)c1ccco1 11285330 MGEBYNJRWMQZHV-UHFFFAOYSA-N 439.399 2.597 50 40 IFGB CCOc1cc(/C=N\NC(=O)c2ccc(C)nc2)cc(I)c1O 30803010 CCOODIAZNMZPLO-UWVJOHFNSA-N 425.226 2.863 50 40 IFGB COC(=O)Cc1nn(-c2ccccc2)c2c1[C@@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 9972221 LGPMONYDCOCCJV-NRFANRHFSA-N 429.480 2.872 50 40 IFGB CCOc1ccc(/C=N/NC(=O)CN(C)S(=O)(=O)c2c(C)cc(C)cc2C)cc1OC 16692776 ROUMBLHDXCVKNH-YDZHTSKRSA-N 447.557 2.790 50 40 IFGB CS(=O)(=O)N(Cc1ccccc1)c1ccc(C(=O)N/N=C2\C(=O)Nc3ccccc32)cc1 20059292 CSOMXKCYNCJFJQ-UHFFFAOYSA-N 448.504 2.739 50 40 IFGB CC(=O)[C@H]1CC[C@@H]2[C@]1(C)C[C@@H]1O[C@]13[C@@]1(C)CC[C@H](O)C[C@]14C=C[C@]23[C@H]1C(=O)OC(=O)[C@@H]14 118936377 UWJWRKKBRRCXGD-IXENFGEVSA-N 426.509 2.572 50 40 IFGB O=C1OC(=O)[C@@H]2[C@H]3C[C@@H]([C@@H]4Sc5[nH]c(=O)sc5[C@H](c5cc(Cl)ccc5O)[C@H]43)[C@H]12 245241971 VFAWHSQATVLVIT-ZQBHEHACSA-N 435.910 2.983 50 40 IFGB COc1cc(/C=N/NC(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)cc(OC)c1OC 409004089 AKSFBLWPEQRAEJ-AFUMVMLFSA-N 443.475 2.854 50 40 IFGB C=CCn1c(SCC(=O)NNC(=O)c2ccc(Cl)cc2)nc2ccccc2c1=O 2618525 VOCUNQKBOSZNEN-UHFFFAOYSA-N 428.901 2.789 50 40 IFGB COc1ccc(COC(=O)NNC(=O)[C@@H]2CS[C@H](c3ccccc3)N2C(C)=O)cc1 6001773 JULVIBILHMRRNE-AZUAARDMSA-N 429.498 2.615 50 40 IFGB C/C(NNC(=O)c1ccccc1Cl)=C1/C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O 9318557 OLBIJCVSWFTYSM-XNTDXEJSSA-N 433.251 2.785 50 40 IFGB COc1ccc2o/c(=N/NC(=O)COc3ccc(Cl)cc3Cl)c(C(N)=O)cc2c1 11565680 QVBDPLRBTXGQJT-LYBHJNIJSA-N 436.251 2.858 50 40 IFGB Cc1ccc(Cl)cc1NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)NC(C)C)cc1 58881387 XSDXRQLUXYHNCE-FOKLQQMPSA-N 430.892 2.641 50 40 IFGB COc1ccccc1/C=N/NC(=O)CN(c1ccc(Cl)c(Cl)c1)S(C)(=O)=O 408905992 BWKYXMKULQBXQG-KEBDBYFISA-N 430.313 2.918 50 40 IFGB O=C(COc1ccccc1/C=N/NC(=O)C(=O)Nc1ccccc1F)Nc1ccccc1 409249955 KIJVWBCHJNVNRR-AFUMVMLFSA-N 434.427 2.932 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C\c2cccc3ccccc23)cc1C 16282947 HTVYFEQOORQCFD-UCQKPKSFSA-N 425.510 2.928 50 40 IFGB C/C(=N\NC(=O)c1cc(O)cc(O)c1)c1cccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)c1 17101293 SBBYBMHDGVUBOQ-BRPCQQFMSA-N 437.452 2.857 50 40 IFGB CC/C(=N\NC(=O)CN(c1ccc(C)cc1)S(C)(=O)=O)c1ccc(OC)c(OC)c1 20207890 MTLDKBPZVUDIDG-RELWKKBWSA-N 433.530 2.709 50 40 IFGB O=C(N/N=C/c1ccncc1)c1nn(Cc2cccc(Br)c2)cc1[N+](=O)[O-] 1087043 JVLKCPRBWVUYGP-AWQFTUOYSA-N 429.234 2.761 50 40 IFGB CC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(OC(F)(F)F)cc3)[C@H]2C1 8442026 IUARAPPASLFFLQ-ZWKOTPCHSA-N 427.386 2.857 50 40 IFGB COc1cc(OC)cc(C(=O)NN/C(C)=C2\C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2C)c1 103916701 UHPKIMLGRGTBGJ-UNOMPAQXSA-N 439.428 2.543 50 40 IFGB COc1ccc(C(=O)Nc2nnc(CC(=O)N/N=C/c3c[nH]c4ccccc34)s2)cc1 825492 NPQFULOLROSMPN-FSJBWODESA-N 434.481 2.973 50 40 IFGB C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H](C)n1c(=O)oc2ccccc21 14372624 PKNQCEHLYYGQIP-RYUDHWBXSA-N 448.273 2.533 50 40 IFGB Cc1ccc(N(CC(=O)NN=C2CCN(Cc3ccccc3)CC2)S(C)(=O)=O)cc1C 409349200 UUNJYWHZTLLVRG-UHFFFAOYSA-N 442.585 2.838 50 40 IFGB O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NNC(=O)c1cccnc1 2261994 CVFLOWUXPAKUMH-UVTDQMKNSA-N 432.552 2.586 50 40 IFGB CC(/C=C1\SC(=S)N(CC(=O)NNC(=O)c2ccncc2)C1=O)=C\c1ccccc1 8820666 JYCRMPSXMUYFAG-YYMXQEISSA-N 438.534 2.690 50 40 IFGB CCOC(=O)COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)OC)cc2)cc1OC 408798275 VPUAOKGKPLBVPI-GZTJUZNOSA-N 438.436 2.969 50 40 IFGB CCOC(=O)c1nn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1B(O)O 2382215950 LUQDTZNRQWTGFF-UHFFFAOYSA-N 426.281 2.580 50 40 IFGB CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2Nc2ccccc2)c1 16593869 KWDFKAZYQKKYEA-UHFFFAOYSA-N 438.509 2.755 50 40 IFGB CC(C)(C)[Si](C)(C)OC[C@@H]1[C@@H]2[C@H](O)N3[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H]3[C@H](O)N12 299803672 OIAGEYLUDDDVCA-FSTLZOQRSA-N 430.738 2.786 50 40 IFGB CCOC(=O)c1c(C)oc2ccc(OCC(=O)NNC(=O)c3ccc(OC)cc3)cc12 1248853 KETPLBFKFCDQBT-UHFFFAOYSA-N 426.425 2.767 50 40 IFGB biogenic COc1cccc(-c2c(C(=O)N/N=C/c3c(C)cc(C)cc3C)nnn2-c2nonc2N)c1 2452376 ZUDATZNJRCSJJK-BHGWPJFGSA-N 446.471 2.597 50 40 IFGB CC[C@H](C)C(=O)N(NC(=O)c1ccccc1)[C@@H]1CC(=O)N(c2cc(C)ccc2OC)C1=O 18223069 OZMXKHPNQBEBDH-QFBILLFUSA-N 437.496 2.855 50 40 IFGB Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1C 24976617 OUMSJIVVNYFYEN-UHFFFAOYSA-N 447.601 2.678 50 40 IFGB CCOC(=O)[C@H](NC(=O)C(Cl)Cl)[C@H](OC(=O)C(Cl)Cl)c1ccccc1 95705817 GPGUHASJQNXDSM-NXEZZACHSA-N 431.099 2.926 50 40 IFGB CCOc1ccc(-c2c(C(=O)N/N=C/C(C)=C/c3ccco3)nnn2-c2nonc2N)cc1 13751912 RDUKMGBVCBQOFI-REMMVFHUSA-N 448.443 2.710 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2ccc(OC3CSC3)cc2)S(C)(=O)=O)c(C)c1 20208079 OPYFETBEBTYEIT-SSDVNMTOSA-N 447.582 2.714 50 40 IFGB COc1cc(OC)c(/C=N/NC(=O)CNC(=O)c2ccc(C)cc2)cc1Br 2177692 PTMHLIVSHCCXCO-LSHDLFTRSA-N 434.290 2.655 50 40 IFGB CCN(CC)C(=O)CSC1=C(C#N)[C@H](c2ccco2)C(C(=O)OCCOC)=C(C)N1 100935170 OWOVYKQBAPVFGV-LJQANCHMSA-N 433.530 2.767 50 40 IFGB CCOc1ccc([C@H]2[C@H]3CN(C(C)=O)CC=C3C(C#N)=C(N)C2(C#N)C#N)cc1OCC 658830 XHCYNPCOCBHYGD-UGKGYDQZSA-N 431.496 2.756 50 40 IFGB COc1ccc(/C=N/NC(=O)Cc2nnc(NC(=O)c3ccc(OC)cc3)s2)cc1 1500609 VWKCXHRIUCKEPL-CIAFOILYSA-N 425.470 2.500 50 40 IFGB Cc1ccc(NC(=O)COC(=O)[C@H]2[C@H]3C(=O)O[C@H]4[C@@H]3C[C@H]2[C@H]4Br)cc1Cl 101879484 LHNFQEOINWNGMO-UXTSJCJBSA-N 442.693 2.701 50 40 IFGB CC(C)(C)[Si](C)(C)OC[C@@H]1[C@H]2[C@@H](O)N3[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H]3[C@H](O)N12 299803673 OIAGEYLUDDDVCA-HIPBYMCUSA-N 430.738 2.786 50 40 IFGB COC(=O)COc1ccc(Br)cc1/C=N/NC(=O)c1ccc(C#N)cc1F 408966840 NTCJCZMWGCBVDH-LSFURLLWSA-N 434.221 2.776 50 40 IFGB N#C/C(=C\c1ccc(OCC(N)=O)c(Br)c1)C(=O)Nc1cccc([N+](=O)[O-])c1 409224005 JVVHDXKRLZTIIV-WUXMJOGZSA-N 445.229 2.767 50 40 IFGB COc1cc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc(Cl)c1OCC(N)=O 409226501 TXTARFMXLUSYPC-LFYBBSHMSA-N 430.804 2.667 50 40 IFGB O=C(N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc(I)cc1 10118507 ZPKKAUZFZJFHNV-REZTVBANSA-N 439.165 2.692 50 40 IFGB Cc1cccc(N2N=C(C(=O)NNC(=O)c3ccc(Br)cc3)CCC2=O)c1 14242061 MXUDGSLKBNJISA-UHFFFAOYSA-N 429.274 2.702 50 40 IFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1cc2cc([N+](=O)[O-])ccc2o1 408904567 LNGIDEFCZHCIAA-CIAFOILYSA-N 439.384 2.850 50 40 IFGB COCCn1c(C)cc2c(c1=O)[C@H](c1ccc(OC)c(Br)c1)C(C#N)=C(N)O2 2326685 NGLUZVOVFXJQBG-QGZVFWFLSA-N 446.301 2.792 50 40 IFGB COc1ccccc1NC(=O)C/C(C)=N/NC(=O)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 12362378 QVABWPYSQQQKAV-CIAFOILYSA-N 429.389 2.575 50 40 IFGB CC1=C(C#N)C(=O)NC(=O)/C1=C\Nc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1 16694110 PZQXRISMLLEYEY-WQRHYEAKSA-N 442.884 2.933 50 40 IFGB CCN(CC)CN1C(=O)/C(=N\NC(=O)CO/N=C(\C)c2cccs2)c2ccccc21 25329617 ZWJDNDKXDXNKFT-UCEQWORRSA-N 427.530 2.655 50 40 IFGB COc1cc(/C=N\NC(=O)c2ccncc2)ccc1OCC(=O)Nc1cccc([N+](=O)[O-])c1 33340109 XKQJIUJNUROWJB-CFRMEGHHSA-N 449.423 2.780 50 40 IFGB C=CCc1cc(/C=N\NC(=O)CN2CCOCC2)ccc1OCc1ccc([N+](=O)[O-])cc1 59247107 XPGVITIVVTWXTA-IWIPYMOSSA-N 438.484 2.685 50 40 IFGB CCOc1ccc(NC(=O)/C(C#N)=C\[C@H]2C(=O)NC(=S)N(c3ccccc3)C2=O)cc1 408743442 FVJQEBBEWBHDCI-FFWXCITRSA-N 434.477 2.538 50 40 IFGB O=C(N/N=C/c1c(F)c(F)c(F)c(F)c1F)c1cccc(S(=O)(=O)N2CCCC2)c1 9467456 BRRYQFHYWVWDQC-PGGKNCGUSA-N 447.385 2.931 50 40 IFGB O=C(NNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1ccc2c(c1)OCCO2 12880756 QWEKMMIGZCMFPI-UHFFFAOYSA-N 436.795 2.753 50 40 IFGB COc1ccccc1/C=N/NC(=O)CN(c1cccc(Cl)c1Cl)S(C)(=O)=O 408914136 VPYMCPSPSHABKA-KEBDBYFISA-N 430.313 2.918 50 40 IFGB Cc1cccc(N2C(=O)NC(=O)[C@@H](/C=N/NC(=O)c3ccc(Cl)cc3Cl)C2=O)c1 408536166 QCTQJSHVQHICMR-BMZJSHLCSA-N 433.251 2.917 50 40 IFGB COc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccco2)c2ccc(C)cc2)cc1 408908969 ZNZWCOIQCRXAFX-HYARGMPZSA-N 427.482 2.942 50 40 IFGB Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1cccc(NS(C)(=O)=O)c1 12556941 CCRVTEFSMZJGPJ-UHFFFAOYSA-N 430.511 2.565 50 40 IFGB COc1ccccc1Oc1nc2c(C)cccn2c(=O)c1/C=C(\C#N)C(=O)N1CCOCC1 13759567 MQZNIGWTQJMNND-SAPNQHFASA-N 446.463 2.570 50 40 IFGB O=C1N(CN2CCN(c3ccccc3F)CC2)c2ccccc2[C@@]12OC[C@@H](CCl)O2 19907380 LTGBZDKDHHJQAE-ZHRRBRCNSA-N 431.895 2.759 50 40 IFGB C/C(=N\NC(=O)c1ccco1)c1cc2c(cc1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)O)OCO2 20159407 MJYYRKOJVJQPCY-NISMRDLLSA-N 439.424 2.768 50 40 IFGB N#Cc1ccc(/C=N\NC(=O)CCSCCC(=O)N/N=C/c2ccc(C#N)cc2)cc1 31629191 BWNNAWSSCIYJBW-WFOJNGAISA-N 432.509 2.544 50 40 IFGB CC(C)Oc1ccc(C(=O)NNC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)cc1 40143919 IMOSYWAOYMYWFX-UHFFFAOYSA-N 426.448 2.553 50 40 IFGB COc1ccc(C(=O)N/N=C\c2ccc(OCC(=O)NCc3ccco3)cc2)cc1OC 58882652 OBESMAFORCFXNB-MXAYSNPKSA-N 437.452 2.756 50 40 IFGB C[C@H](NC(=O)COc1ccc(/C=N/NC(=O)CC2(C)OCCO2)cc1)c1ccccc1 408780721 JAIUOPXAXHMLSV-SYXCRGJESA-N 425.485 2.546 50 40 IFGB Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccn3C)c2)c(C)c1 12544735 UONPLROBZFBKNS-UHFFFAOYSA-N 426.498 2.518 50 40 IFGB O=C(CCCC[C@H]1SC[C@@H]2NC(=O)N[C@@H]21)N/N=C/c1c(F)c(F)c(F)c(F)c1F 16158620 SUBCRWHUPDUERG-RVYQILEGSA-N 436.406 2.558 50 40 IFGB Cc1ccc(SCC(=O)N/N=C/c2ccc(OCC(=O)NC[C@H]3CCCO3)cc2)cc1 28215217 KIHGNYNFCAJDTL-ORBAKXMTSA-N 441.553 2.911 50 40 IFGB CCCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(OC)c(OC)c2)cc1OCC 59516215 BBRXRRAHQUMLLA-OEAKJJBVSA-N 429.473 2.980 50 40 IFGB COc1cccc(C(=O)N/N=C/c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)c1 408966155 LPHKJVUGMFESMH-YDZHTSKRSA-N 426.498 2.514 50 40 IFGB CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3C[C@H](Cl)C4=CC(=O)C=C[C@]4(C)[C@H]3C(=O)C[C@@]21C 4215309 RACDDTQBAFEERP-PLTZVPCUSA-N 434.916 2.554 50 40 IFGB biogenic,in-man O=C(O)c1ccc(N2C(=O)[C@@H]3[C@H]4C[C@H]([C@@H]3C2=O)[C@@H](Br)[C@@H]4Br)cc1 169619899 KXHQMAGGCJSUCQ-JOLBHGKHSA-N 443.091 2.667 50 40 IFGB N#C/C(=C\c1cc(Br)ccc1OCc1ccc(C(=O)O)cc1)C(=O)NC(N)=O 1103897 KHWRRWKCCNESDH-VGOFMYFVSA-N 444.241 2.828 50 40 IFGB COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4ccccn4)c(=O)c32)c(OC)c1 1471759 KISDCZAHUWYVFJ-NRFANRHFSA-N 430.464 2.835 50 40 IFGB O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C1C2CC3CC(C2)CC1C3 9139006 DEWLTTWQWGWLRJ-UHFFFAOYSA-N 445.585 2.568 50 40 IFGB N#CC1=C(N)Oc2[nH]nc(-c3ccc(Cl)cc3)c2[C@@]12C(=O)Nc1ccc([N+](=O)[O-])cc12 9359189 DYRGJXUMXDKNEX-FQEVSTJZSA-N 434.799 2.963 50 40 IFGB CCCS(=O)(=O)Nc1cccc(C(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)c1 12526328 AHHLDNNZJNSVNY-UHFFFAOYSA-N 449.529 2.709 50 40 IFGB C[C@H]1CCCC[C@H]1NC(=S)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3 13058681 MAVOJNTUTDYYIY-WMLDXEAASA-N 427.574 2.811 50 40 IFGB Cn1c(P(=O)(c2nc3ccccc3n2C)c2nc3ccccc3n2C)nc2ccccc21 103707548 ZEPCQLSLZWTLCZ-UHFFFAOYSA-N 440.447 2.986 50 40 IFGB O=C(CCN1C(=O)/C(=C\c2ccccc2Cl)SC1=S)NNC(=O)c1ccncc1 2198390 YOUIIVHRFWCFRH-RVDMUPIBSA-N 446.941 2.788 50 40 IFGB O=C(COC(=O)Cc1ccc(Cl)cc1)NNC(=O)c1ccc(Br)cc1 3259657 FXBLCGVSFRCLDQ-UHFFFAOYSA-N 425.666 2.649 50 40 IFGB COc1ccc(/C=N\NC(=O)Cn2cnc3sc4c(c3c2=O)CCCC4)c(OC)c1 16915904 FAOXGMYUSGPHKT-RMORIDSASA-N 426.498 2.504 50 40 IFGB COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)C(C)(C)C)ccc1Cl 30004188 YSLIMVMTEXBHGT-UHFFFAOYSA-N 439.921 2.957 50 40 IFGB CCOc1cc(/C=N\NC(=O)CN(C)S(=O)(=O)c2ccc3ccccc3c2)ccc1O 39986736 UVZPCBDMSJWYQI-UCQKPKSFSA-N 441.509 2.715 50 40 IFGB CCOc1ccc(/C=N/NC(=O)COc2nc(C)cc(COC)c2C#N)cc1OCC 59427774 GWVMKILOJHSSRG-WYMPLXKRSA-N 426.473 2.735 50 40 IFGB C[C@H](S[C@@H](C)C(=O)N/N=C/c1ccc(C#N)cc1)C(=O)N/N=C\c1ccc(C#N)cc1 104379535 SCGSXWLYHQYFCW-ZPXSHNHFSA-N 432.509 2.541 50 40 IFGB O=C(N/N=C/[C@@H]1C(=O)NC(=O)N(c2ccccc2F)C1=O)c1ccc(Cl)cc1Cl 105734071 BDPZYCJJWGZYAG-CEWLANGVSA-N 437.214 2.747 50 40 IFGB O=C(Nc1cccnc1)OC[C@H](NC(=O)C(Cl)Cl)[C@H](O)c1ccc([N+](=O)[O-])cc1 1763978 HHHIIBJOVPFLLU-UONOGXRCSA-N 443.243 2.560 50 40 IFGB O=C(CCN1C(=O)c2ccccc2[C@@H]1c1c[nH]c2ccccc12)NNC(=O)c1ccncc1 13955663 RPVBJROGFVWZIR-HSZRJFAPSA-N 439.475 2.959 50 40 IFGB COC(=O)N/N=C(/c1nc2ccc(Cl)cc2nc1O)[C@@H](O)c1ccc([N+](=O)[O-])cc1 104291300 VBCPPHSSHJQCQP-VOMLJKFNSA-N 431.792 2.691 50 40 IFGB CCCn1c(=O)c(C(=O)NNC(=O)c2ccccc2Br)c(O)c2ccccc21 100534785 GQEHLAXQZTYJGX-UHFFFAOYSA-N 444.285 2.954 50 40 IFGB O=C(N/N=C/c1ccccn1)c1nn(Cc2ccc([N+](=O)[O-])cc2)cc1Br 1092141 KONDCUGJAGXCRB-AWQFTUOYSA-N 429.234 2.761 50 40 IFGB COc1cc(/C=N/NC(N)=O)cc(I)c1OC(=O)c1ccccc1 408888907 CREOFILUAOGWKO-DJKKODMXSA-N 439.209 2.521 50 40 IFGB CCOc1ccccc1/C=N/NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1 408988672 IUGFZGJVVXNHLN-VEDIRDOVSA-N 435.484 2.796 50 40 IFGB Cc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 409235037 NPMQRIFQDBKGKB-CFRMEGHHSA-N 428.489 2.573 50 40 IFGB Cc1ccccc1OCCCOc1ccccc1/C=N/NC(=O)Cc1nnc(N)s1 8983575 DWHPLBUPLJAIGH-OEAKJJBVSA-N 425.514 2.969 50 40 IFGB Cc1ccc(S(=O)(=O)N(CCc2ccccc2)CC(=O)N/N=C/c2ccncc2)cc1 9056417 KFTKQBOGWPHJPW-KOEQRZSOSA-N 436.537 2.774 50 40 IFGB N#C/C(=C\c1ccc(OCC(=O)NC[C@H]2CCCO2)cc1)C(=O)NCCc1ccccc1 13424149 JWQMIVAVFNVQHP-JDCXBEBJSA-N 433.508 2.626 50 40 IFGB NC(=O)N[C@H](CC(=O)NNC(=S)Nc1ccccc1)c1cccc(Br)c1 25400647 NGCGBOVMQLTTPX-CQSZACIVSA-N 436.335 2.566 50 40 IFGB C[C@@H](NC(=O)COc1ccc(/C=N/NC(=O)CSc2ncccn2)cc1)c1ccccc1 28215051 DVZUTSZKJFFVRT-OXVLKEGXSA-N 449.536 2.975 50 40 IFGB N#C/C(=C\c1ccc(OCC(=O)Nc2ccccc2I)cc1)C(N)=O 408755635 RIBKIXZCWCADRQ-UKTHLTGXSA-N 447.232 2.701 50 40 IFGB CC(C)COc1ccc(/C=N/NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 409028733 RFKIYOPXNGHPOU-CIAFOILYSA-N 448.501 2.546 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccncc2)Cc2ccc(F)cc2)cc1 409056699 HVSXMCMCODQETL-AFUMVMLFSA-N 440.500 2.870 50 40 IFGB CCCOc1ccc(/C=N/NC(=O)CN(c2ccccc2OCC)S(C)(=O)=O)cc1 409185216 UHRUGLGHMIOHTD-PXLXIMEGSA-N 433.530 2.790 50 40 IFGB CN1C(=O)/C(=N/NC(=O)c2ccccc2N(C)S(=O)(=O)c2ccccc2)c2ccccc21 409339448 IDJPQNVVQUWPGB-DARPEHSRSA-N 448.504 2.622 50 40 IFGB COc1ccccc1C/C(C)=N/NC(=O)c1nnn(-c2nonc2N)c1-c1ccc(C)cc1 9307001 WUUNNGQMHGKOBD-ZVHZXABRSA-N 446.471 2.565 50 40 IFGB CCc1cc(C(=O)NNC(=O)CSc2nnnn2-c2cccc(C)c2C)sc1C 13164424 VIDGBVFHGRXHLQ-UHFFFAOYSA-N 430.559 2.765 50 40 IFGB COc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc(I)c1OC 15223460 VMKJKASSVYYBLH-UWUHSAQLSA-N 442.253 2.511 50 40 IFGB CS(=O)(=O)N(CCc1ccccc1)CC(=O)N/N=C\c1ccccc1C(F)(F)F 33524605 KBHQHSQPWRLMAB-QRVIBDJDSA-N 427.448 2.660 50 40 IFGB COc1cc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)ccc1OCC(=O)N1CCOCC1 207830015 NJKCYTFYPSPVNG-UYRXBGFRSA-N 435.480 2.787 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2cc(Cl)ccc2C)c1 409165475 YOGWFYTYVXQKIC-WYMPLXKRSA-N 430.892 2.642 50 40 IFGB CCOc1ccc(/C=N/NC(=O)Cc2nnc(NC(=O)c3cccc(C)c3)s2)cc1O 1885908 JFKVAJHBHSFUAL-WSDLNYQXSA-N 439.497 2.896 50 40 IFGB CC(C)c1c(C(=O)N/N=C/c2ccc(OCc3ccccc3)cc2)nnn1-c1nonc1N 9459442 WXARHKPSDBNQMV-WYMPLXKRSA-N 446.471 2.699 50 40 IFGB CC(=O)Oc1cccc(/C=N/NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)c1 408762510 BVUUCGITUSQOAR-VSIOZEBNSA-N 445.541 2.764 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2cc(Cl)ccc2C)S(C)(=O)=O)c(OC)c1 408786786 NSEXZDYYGCAXFS-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB CCOc1cccc(/C=N/NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)c1 408990646 OIKAZTPZBSRGLQ-QMPKWXHSSA-N 435.484 2.796 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc2c(c1)OCO2)c1cc(Cl)ccc1Cl 409027972 WCHRZYLYBDYJLH-DNTJNYDQSA-N 444.296 2.638 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1Br)c1cccc(F)c1 409124533 IBVQJMNOXGYXCD-VXLYETTFSA-N 428.283 2.505 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(C)c(Cl)c2)cc1 409174506 MYIMRMHKCZLLEX-WYMPLXKRSA-N 430.892 2.642 50 40 IFGB COc1ccc(Br)cc1/C=C(\C#N)C(=O)Nc1ccc(S(N)(=O)=O)cc1 778252 CRNXITNJXNVHMY-XYOKQWHBSA-N 436.287 2.651 50 40 IFGB Nc1nonc1-n1nnc(C(=O)N/N=C/c2ccco2)c1CSc1ccc(Cl)cc1 2448363 GVRIWCZEIJVRKJ-DNTJNYDQSA-N 444.864 2.535 50 40 IFGB C/C(=N\NC(=O)c1ccc(C(=O)N/N=C(\C)c2ccc(O)cc2)nc1)c1ccc(O)cc1 8434961 PUIQJPLFWNHZJU-LVSXPEEVSA-N 431.452 2.801 50 40 IFGB COc1cc([C@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4cccnc4)c(=O)c32)cc2c1OCO2 9089775 DVYOPSSURZLMDI-FQEVSTJZSA-N 444.447 2.556 50 40 IFGB CCCOc1ccc(/C=N/NC(=O)CN(C)S(=O)(=O)c2ccccc2)cc1OCC 39986637 ZUOGNOMBMCTSND-PXLXIMEGSA-N 433.530 2.645 50 40 IFGB CCOc1ccc(/C(C)=N/NC(=O)CN(c2ccc(OC)cc2)S(=O)(=O)CC)cc1 59490231 XBFCWJCQAXFWME-CJLVFECKSA-N 433.530 2.790 50 40 IFGB O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O)O[C@@H](CCCl)C(=O)c1ccc(F)cc1 102642659 WNUICOLQRVMPRT-NZMUHZMNSA-N 435.879 2.970 50 40 IFGB CS(=O)(=O)N(CCc1ccccc1)CC(=O)N/N=C\c1c(Cl)cccc1Cl 107812923 UVRRLWOTDZYIEW-MTJSOVHGSA-N 428.341 2.948 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2cccc3ccccc23)S(C)(=O)=O)cc1OC 408775825 VCPDXXPDGWNBPV-OEAKJJBVSA-N 441.509 2.773 50 40 IFGB COc1ccc(C(=O)NNC(=O)CSc2ncnc3c2cnn3-c2ccc(C)cc2)cc1 1346392 VALLDKRAVSSALP-UHFFFAOYSA-N 448.508 2.686 50 40 IFGB O=C(NN1C[C@H](C(=O)O[C@@H](CCCl)C(=O)c2ccc(F)cc2)CC1=O)c1ccccc1 8927383 AWYNZACHXHJBOU-AEFFLSMTSA-N 446.862 2.743 50 40 IFGB C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1CSc1ccccc1)c1ccccc1 13748680 WTOVQYJCAPQIGK-LPYMAVHISA-N 434.485 2.679 50 40 IFGB Cc1cccc(C)c1OCC(=O)NNC(=O)[C@@H](NC(=O)c1c(F)cccc1F)C(C)C 26536654 ZFPPTCZPMFARKA-IBGZPJMESA-N 433.455 2.562 50 40 IFGB CC(C)[C@H](NC(=O)Cc1cccs1)C(=O)N/N=C\c1ccc(N(C)C)c([N+](=O)[O-])c1 103723641 YMAYZKVAAZODFJ-VFAFIFLJSA-N 431.518 2.556 50 40 IFGB Cc1ccc(NC(=O)COC(=O)CCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1C 408661726 HGVZGXQXOGPMGI-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB O=C(CN(Cc1ccco1)S(=O)(=O)c1ccccc1)N/N=C/c1cccc([N+](=O)[O-])c1 408973258 AEKPIYIGOLYNSO-FYJGNVAPSA-N 442.453 2.529 50 40 IFGB CCc1ccc(N(CC(=O)N/N=C(\C)c2ccc(NC(C)=O)cc2)S(C)(=O)=O)cc1 409025222 ODEYWBRTUYBKPO-HZHRSRAPSA-N 430.530 2.514 50 40 IFGB Cc1cc(OCC(=O)NNC(=S)NC(=O)c2ccc(Br)o2)ccc1Cl 2135974 LAOBPFDYKYIWOR-UHFFFAOYSA-N 446.710 2.718 50 40 IFGB Cc1ccccc1/C=N/NC(=O)[C@H](NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12 13785308 OQPOFOTZBMHQAH-QVGKIPNLSA-N 439.475 2.853 50 40 IFGB COc1ccc(OC)c(/C=N\NC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1 32576959 QJXKJUZWFAPWLL-OYKKKHCWSA-N 430.936 2.625 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccccc2O)cc(I)c1OC 59418936 QJLGYBNVDMRCLY-GIJQJNRQSA-N 426.210 2.778 50 40 IFGB COc1cc(/C=N/NC(=O)COc2ccccc2)cc(I)c1O 408528901 XJKSUKGHTATAMW-GIJQJNRQSA-N 426.210 2.535 50 40 IFGB COc1cc(/C=C(\C#N)C(=O)N2CCOCC2)ccc1OCC(=O)Nc1cccc(C)c1 409007895 RLAKFVYSQSTNFY-CPNJWEJPSA-N 435.480 2.787 50 40 IFGB CC(C)CNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(Cl)cc2)cc1 409154640 HCTSVAXVLUEHRX-WYMPLXKRSA-N 430.892 2.580 50 40 IFGB CC(C)CNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2)c(Cl)c1 409166957 HEFXIZUIRPCBOM-WYMPLXKRSA-N 430.892 2.580 50 40 IFGB Cc1cc(SCC(=O)OCC(=O)NNC(=O)c2ccc(F)cc2)nc2ccccc12 9703352 YAKJPUIYANUZOP-UHFFFAOYSA-N 427.457 2.779 50 40 IFGB CN(CC(=O)NN=C(c1ccccc1)c1ccccc1)S(=O)(=O)c1ccccc1C#N 13012861 UJSLDULNBVNILB-UHFFFAOYSA-N 432.505 2.748 50 40 IFGB CCOc1ccc(-c2c(C(=O)N/N=C/c3ccc(CC)cc3)nnn2-c2nonc2N)cc1 2193531 NUEMIBSQILSTCI-ZMOGYAJESA-N 446.471 2.625 50 40 IFGB O=C(COC(=O)CCC(=O)Nc1ccc(Cl)c(Cl)c1)NNC(=O)c1ccccc1 138563572 SKIHZYBDALAOGA-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB CCOc1ccc(NC(=O)/C(C#N)=C\[C@@H]2C(=O)NC(=S)N(c3ccccc3)C2=O)cc1 408743445 FVJQEBBEWBHDCI-RXXLQFRUSA-N 434.477 2.538 50 40 IFGB COc1ccc(/C=N\NC(=O)c2nn(-c3ccc(C)cc3)c(=O)c(C#N)c2C)c(OC)c1 409056165 FMASHVHLLZGREW-MXAYSNPKSA-N 431.452 2.502 50 40 IFGB Cc1cccn2c(=O)c(/C=C(\C#N)C(=O)NC3CCCCC3)c(N3C[C@H](C)O[C@H](C)C3)nc12 13811475 SZKLWQXPRSKBHX-DYNFWSHFSA-N 449.555 2.972 50 40 IFGB COc1cc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)c3cccs3)C2)ccc1OC(C)C 32755505 CMBKYHVCORYJEB-INIZCTEOSA-N 445.541 2.857 50 40 IFGB O=C(CCC(=O)OCC(=O)Nc1cccc(Cl)c1Cl)NNC(=O)c1ccccc1 408673310 ZUBTYQSWVVPCFD-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB COc1cc(C(=O)N/N=C\c2ccccc2OCC(N)=O)ccc1OCc1ccccc1 409324674 UUIWSZQNXWLRMM-WGARJPEWSA-N 433.464 2.902 50 40 IFGB O=C1CC=C2[C@@H]3N1c1cc(O)c(O)cc1[C@]31CCN3C/C(=C\CBr)[C@H]2C[C@@H]31 5048151 VFOJBHJJEXIGII-KJVQVUTQSA-N 429.314 2.810 50 40 IFGB Cc1cccn2c(=O)c(/C=C(\C#N)c3nc4ccccc4n3C)c(N3CCOCC3)nc12 9075593 UHNGWWKNMBAJOK-SAPNQHFASA-N 426.480 2.790 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(C)S(=O)(=O)c2cc(Cl)ccc2Cl)cc1 16186949 SEKUMEDHGPJXIN-KEBDBYFISA-N 430.313 2.773 50 40 IFGB COc1ccc(N([C@@H](C)C(=O)N/N=C/c2c(O)ccc3ccccc23)S(C)(=O)=O)cc1 16322133 NOGJKDBGEKPUEC-FVQJWRHTSA-N 441.509 2.859 50 40 IFGB COCCCNC(=O)C(=O)N/N=C/c1cccc(OC)c1OCc1ccccc1Cl 408602530 DORIFDAURWTKQS-ZMOGYAJESA-N 433.892 2.530 50 40 IFGB COc1cc(/C=N/NC(=O)C(=O)NCCCOC(C)C)ccc1OCc1ccc(F)cc1 408615581 QWNFDPGKSSIBQH-VULFUBBASA-N 445.491 2.795 50 40 IFGB COc1cc(/C=N/NC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)cc(Cl)c1O 719722 UTJCASCXDAUNNW-LSHDLFTRSA-N 445.884 2.866 50 40 IFGB O=C(CNC(=O)c1cccc(F)c1)N/N=C1\C(=O)N(CCc2ccccc2)c2ccccc21 1501305 JUKWBNHSHOPGDJ-FAJYDZGRSA-N 444.466 2.665 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@@H](C)NC(=O)c2ccc(Br)cc2)c(OC)c1 2765615 HDGBWAJAXPHOHI-KIHMUJGBSA-N 434.290 2.735 50 40 IFGB O=C(COc1ccccc1)NNC(=O)CSc1ncnc2sc3c(c12)CCCC3 12489954 QMNLVQOFAALYAJ-UHFFFAOYSA-N 428.539 2.889 50 40 IFGB COCCOC(=O)C1=C(C)NC(SCC(=O)NC(C)(C)C)=C(C#N)[C@H]1c1ccco1 100944782 PREAMKZIGUMBOS-SFHVURJKSA-N 433.530 2.813 50 40 IFGB COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)/C2=C(/C)NNC(=O)C2CC2)cc1 112291857 XMMSLZGKYQYDSE-UYRXBGFRSA-N 435.440 2.659 50 40 IFGB COC(=O)c1ccc(Cl)cc1N/C=C1\C(=O)N(C[C@H]2CCCO2)C(=O)C(C#N)=C1C 13628786 JGDGXFZWIUMQOH-AYCSXLNKSA-N 429.860 2.810 50 40 IFGB Cc1c(Cl)cccc1NC(=O)COc1cccc(/C=N/NC(=O)C(=O)NCC(C)C)c1 409151971 IJVUYSKHQXLYRS-BRJLIKDPSA-N 444.919 2.888 50 40 IFGB O=C(COc1ccccc1/C=N/NC(=O)C(=O)NCc1ccccc1)Nc1ccc(F)cc1 409155734 MJOUFNCSUXMRLA-JFLMPSFJSA-N 448.454 2.610 50 40 IFGB O=C(NNC1=C(Cl)C(=O)c2ccccc2C1=O)C(=O)Nc1cccc(C(F)(F)F)c1 1574202 JWMSUVSEGIIHNR-UHFFFAOYSA-N 437.761 2.794 50 40 IFGB CCOc1ccc(NC(=O)C/C(C)=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 8701270 BHMFHBWZOPYRCU-LPYMAVHISA-N 443.416 2.965 50 40 IFGB COc1cc(/C=N/NC(=O)CN(c2cccc(Cl)c2Cl)S(C)(=O)=O)ccc1O 16196001 JQGUTVKUHLYJBE-AWQFTUOYSA-N 446.312 2.624 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2cccc(Cl)c2C)c1 103247161 DEGOZVOHHUPCOO-WYMPLXKRSA-N 430.892 2.642 50 40 IFGB CC(C)c1c(C(=O)N/N=C/c2cccc(OCc3ccccc3)c2)nnn1-c1nonc1N 2393448 GLZVHQXXRHVQQB-WYMPLXKRSA-N 446.471 2.699 50 40 IFGB C[C@@H]1CN(C(=O)/C(C#N)=C2\N=C(NC(=O)c3ccccc3F)c3ccccc32)C[C@@H](C)O1 2440066 RKRXGFBPKXTEJR-ITIGLASJSA-N 432.455 2.886 50 40 IFGB O=C(CCN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)NNC(=O)c1ccncc1 8820470 CWJVDMRYGZXNCF-GUSDSWBTSA-N 438.534 2.690 50 40 IFGB O=C(CNC(=O)c1ccc(Oc2ccccc2)cc1)NNC(=O)COc1ccccc1F 9508932 WNDRBYYDXMONGW-UHFFFAOYSA-N 437.427 2.574 50 40 IFGB O=C(Nc1cccnc1)OC[C@@H](NC(=O)C(Cl)Cl)[C@H](O)c1ccc([N+](=O)[O-])cc1 53291207 HHHIIBJOVPFLLU-ZIAGYGMSSA-N 443.243 2.560 50 40 IFGB Cc1ccc(-n2nc(C(=O)N/N=C\c3ccc(N(C)C)cc3)c(C)c(C#N)c2=O)cc1C 409058821 LKJUELZSJZPVMA-WGARJPEWSA-N 428.496 2.859 50 40 IFGB CCc1ccc(-n2nc(C(=O)N/N=C\c3ccccc3[N+](=O)[O-])c(C)c(C#N)c2=O)cc1 409069439 XRQBXDJRDIROBV-CFRMEGHHSA-N 430.424 2.647 50 40 IFGB COc1ccc([C@H]2C(C#N)=C(N)N(N3CCOCC3)C3=C2C(=O)CC(C)(C)C3)cc1OC 691395 QYNPURXLANWWCL-NRFANRHFSA-N 438.528 2.687 50 40 IFGB Cc1cccc[n+]1[C@@H]1[C@@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C(C(C#N)C#N)N[C@@]1(O)C1CC1 19805040 UUHQFLQUMHGTRC-QPTUXGOLSA-N 441.471 2.658 50 40 IFGB C/C(NNC(=O)c1cccnc1)=C1/C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1c1ccccc1 112292501 PXMDEBFNAVXGEO-HKWRFOASSA-N 442.435 2.949 50 40 IFGB COc1cccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)NC[C@H]3CCCO3)cc2)c1 408795362 KXSUUFPDTHJIQD-YGYUYSJASA-N 435.480 2.915 50 40 IFGB CCOc1cc(/C=N/NC(=O)Cn2nnc(-c3ccccc3Cl)n2)cc(Cl)c1O 408975243 LCIFRIVEUTUGEK-ZVBGSRNCSA-N 435.271 2.902 50 40 IFGB CCOc1ccc(-c2c(C(=O)N/N=C(\C)c3cccs3)nnn2-c2nonc2N)cc1 9233566 BWHPDQPJSXOYTL-SRZZPIQSSA-N 438.473 2.514 50 40 IFGB C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1occc1CS(=O)(=O)c1ccccc1 22024169 CUHBSCQKOUVCJI-AWEZNQCLSA-N 446.456 2.621 50 40 IFGB COc1ccc(C)cc1S(=O)(=O)N(C)CC(=O)N/N=C\c1cccc2ccccc12 34896097 BQSZMGVBWOQYNY-UCQKPKSFSA-N 425.510 2.928 50 40 IFGB CCCCn1nc(C(=O)NNC(=O)c2ccc3c(c2)nc(C)n3CC)c2ccccc2c1=O 9509904 FRAXSVLSGIPJCS-UHFFFAOYSA-N 446.511 2.949 50 40 IFGB N#C/C(=C\c1c(Oc2ccc(F)cc2)nc2ccccn2c1=O)C(=O)NC[C@@H]1CCCO1 13768224 ZXBUQVSHQVKAHT-XOVFHRFOSA-N 434.427 2.828 50 40 IFGB COc1cc(/C=N\NC(=O)CN2CCOCC2)cc(Cl)c1OCc1ccc(F)cc1 59246735 KFDYRJDZXOHXQV-MSXFZWOLSA-N 435.883 2.849 50 40 IFGB COc1ccc(Cl)cc1N(CC(=O)N/N=C/c1cccc(Cl)c1)S(C)(=O)=O 408779040 POTITFNEQUNJQN-KEBDBYFISA-N 430.313 2.918 50 40 IFGB COc1cc(/C=N/NC(=O)CSc2nc(C)cc(C)n2)c(Br)cc1O 409230622 DMGQNIIHPHOZHM-CNHKJKLMSA-N 425.308 2.813 50 40 IFGB C=CCn1c(CNc2ccccc2)nnc1SCC(=O)N/N=C/c1ccc(O)cc1O 695485 BWYOVQFSHQJYFQ-FSJBWODESA-N 438.513 2.730 50 40 IFGB CCn1cc(C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c(=O)c2ccc(C)nc21 2621097 JGKHXVCQUHDLHY-UHFFFAOYSA-N 436.512 2.997 50 40 IFGB O=C(COC(=O)COc1cccc(C(F)(F)F)c1)NNC(=O)c1ccc(Cl)cc1 9633944 BDGNZGPYLYOUBE-UHFFFAOYSA-N 430.766 2.742 50 40 IFGB CN1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cccc(I)c3)[C@H]2C1 13512376 ODBHAECLMWZLON-DLBZAZTESA-N 441.276 2.646 50 40 IFGB O=C(CSc1nnc(-c2ccncc2)n1Cc1ccccc1)NNC(=O)c1ccccc1 34791647 WNZSOPLQIJDQMB-UHFFFAOYSA-N 444.520 2.942 50 40 IFGB CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(SCC(=O)/C(C#N)=C(/C)N)n2CC 104873136 ZONAKVUTVPDSHF-SQFISAMPSA-N 435.575 2.504 50 40 IFGB CC(=O)Nc1cccc(-c2nnc(SCC(=O)NNC(=O)c3ccc(Cl)cc3)o2)c1 408639100 VEHXAQVDYJZVEO-UHFFFAOYSA-N 445.888 2.902 50 40 IFGB COc1ccccc1OCC(=O)N/N=C/c1ccc(OCC(=O)N2CCCCC2)cc1 408829326 PHKMETCQMJKZFM-BUVRLJJBSA-N 425.485 2.616 50 40 IFGB C#CCOc1cccc(/C=N/NC(=O)CNc2ccc(I)cc2)c1 409263726 MHQXZSPWHDIPPK-CIAFOILYSA-N 433.249 2.865 50 40 IFGB N#C/C(=C\c1cc(I)c(O)c([N+](=O)[O-])c1)C(=O)NCc1ccco1 13370996 XEICBRRTGTXURK-ONNFQVAWSA-N 439.165 2.721 50 40 IFGB C/C(N)=C(\C#N)C(=O)COC(=O)c1ccccc1OS(=O)(=O)c1cc(C)ccc1C 104863138 RTFMIPNTOCUGSC-ICFOKQHNSA-N 428.466 2.553 50 40 IFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccc(Cl)c([N+](=O)[O-])c1 408829323 PBSNCCQOHHWHHS-RGVLZGJSSA-N 433.808 2.757 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 409024558 DTIFSJRODIMSFH-UFFVCSGVSA-N 444.391 2.530 50 40 IFGB C=CCOc1ccc(C(=O)N/N=C\c2cc(Cl)c(OCC(N)=O)c(OC)c2)cc1OC 409331978 IYWQYXWYIQMWAQ-MYKKPKGFSA-N 447.875 2.550 50 40 IFGB O=C(CNC(=O)c1ccccc1)N/N=C1\C(=O)N(CCc2ccccc2)c2ccccc21 1305834 OOSOAQDCUKLOOC-NFFVHWSESA-N 426.476 2.526 50 40 IFGB C=CCOc1cccc(/C=N/NC(=O)[C@H](C)N(c2ccc(OC)cc2)S(C)(=O)=O)c1 20214771 IEEUIUXAHRBGDL-PZBNQXIHSA-N 431.514 2.565 50 40 IFGB O=C(COc1cccc(/C=N/NC(=O)C(=O)Nc2ccccc2F)c1)NCc1ccccc1 409271260 TVGCVDJPMNBADO-JFLMPSFJSA-N 448.454 2.610 50 40 IFGB O=C(Cc1nnc(NC(=O)c2ccc(Cl)cc2)s1)N/N=C/c1ccc(O)c(O)c1 3056501 LNJHIBVENSDILE-AWQFTUOYSA-N 431.861 2.548 50 40 IFGB O=C(CNC(=O)c1ccc(Oc2ccccc2)cc1)NNC(=O)COc1ccc(F)cc1 9508836 XYROBGKYOJBNLH-UHFFFAOYSA-N 437.427 2.574 50 40 IFGB CC(/C=C1\SC(=S)N(CC(=O)NNC(=O)c2cccnc2)C1=O)=C\c1ccccc1 12278506 DRDXANVOQRNZMS-RLGXRJJKSA-N 438.534 2.690 50 40 IFGB Cc1cc(C(=O)N/N=C/c2cc(Br)cc(I)c2O)[nH]n1 18240585 OGNIDPJFNCQVMJ-PJQLUOCWSA-N 449.046 2.555 50 40 IFGB Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccccc3O)cc2)cc1 17575639 AINYHBTUXFRQEF-UHFFFAOYSA-N 425.466 2.576 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C\c2ccc(SC)cc2)cc1Cl 39986739 NLQKGLFPBKRVPQ-JAIQZWGSSA-N 441.962 2.841 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1Cl 408908990 ZRNKASVABOMAOJ-DJKKODMXSA-N 445.284 2.818 50 40 IFGB C=CCOc1cccc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)c1 408971084 LSZZMYDRNZPIOI-HAVVHWLPSA-N 427.526 2.802 50 40 IFGB Cc1cccn2c(=O)c(/C=C(\C#N)C(=O)NC[C@H]3CCCO3)c(Oc3ccccc3)nc12 2423917 SZLZQJPCLMIHAW-XEYRCQSKSA-N 430.464 2.997 50 40 IFGB CCOc1ccccc1NC(=O)C(=O)N/N=C/c1cc(Br)c(O)c(OC)c1 13922629 HOZDBLRNDJXXGT-KEBDBYFISA-N 436.262 2.651 50 40 IFGB Cc1c(/C=N\NC(=O)CN2CCOCC2)c2ccccc2n1Cc1ccc([N+](=O)[O-])cc1 408992386 AWHUOYQASWNWKT-OYKKKHCWSA-N 435.484 2.689 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccc3c4c(cccc24)CC3)S(C)(=O)=O)cc1 409184831 OHKGOCRFZYLNMO-ZVHZXABRSA-N 437.521 2.863 50 40 IFGB CCOc1c(Br)cc(C(=O)NNC(=O)COc2ccccc2F)cc1OC 9440436 OGBZUTSVLIFSNB-UHFFFAOYSA-N 441.253 2.836 50 40 IFGB C/C(=N\NC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(Cl)s1 9443101 UDDFQUYBYDXOBH-XDHOZWIPSA-N 427.935 2.576 50 40 IFGB Cc1ccc(/C=C2/SC(=S)N(CCCC(=O)NNC(=O)c3cccnc3)C2=O)cc1 12032452 WCVOTDALHNQPQK-SFQUDFHCSA-N 440.550 2.833 50 40 IFGB CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3ccccc3c2)c2ccccc2c1=O 13005247 OZGHHPLNSOCLPF-UHFFFAOYSA-N 436.493 2.583 50 40 IFGB C=C(C)C(=O)OCCOC(=O)C1=C(N)OC(C)=C(C#N)[C@@H]1c1cc([N+](=O)[O-])ccc1Cl 8781309 IZJGJPPQCJCRFP-INIZCTEOSA-N 447.831 2.992 50 40 IFGB Cc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 9264977 UGBBUCMZSYUZMP-DEDYPNTBSA-N 434.521 2.965 50 40 IFGB COc1ccc(CSCC(=O)N/N=C/c2ccc(OCC(=O)NC(C)C)cc2)cc1 28213633 FNHQNVULLIGOPU-FSJBWODESA-N 429.542 2.982 50 40 IFGB COc1ccccc1/C=C1\SC(=S)N(CCC(=O)NNC(=O)c2ccccc2)C1=O 8819336 AJOQHYKWJTZVLA-LGMDPLHJSA-N 441.534 2.748 50 40 IFGB CC[C@H]1CCc2sc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2C1 9718253 MXMILENMQSMQCK-LBPRGKRZSA-N 431.470 2.789 50 40 IFGB O=C(CCn1[nH]c(=O)c2ccccc2c1=O)NN(Cc1ccccc1)Cc1ccccc1 17603070 INNULWNEZVYDCK-UHFFFAOYSA-N 428.492 2.814 50 40 IFGB CC1=NN(c2ccccc2)C(=O)[C@@H]1/C=N/NC(=O)COc1ccc(Br)cc1 408741257 OXDGTMUTMXHQPF-LASGFXPTSA-N 429.274 2.969 50 40 IFGB CCOC(=O)COc1ccc(/C=N/NC(=O)C[C@@H](NC(=O)OCC)c2ccccc2)cc1 408978562 JDEBVCWFLGBREP-FBTHGLLTSA-N 441.484 2.956 50 40 IFGB O=C(CSc1nnc(-c2cccs2)n1C[C@H]1CCCO1)NNC(=O)c1cccs1 3447218 DKMLFCVDYHOZGF-GFCCVEGCSA-N 449.583 2.800 50 40 IFGB COc1ccc(S(=O)(=O)N(Cc2ccccc2)Cc2ccc(C(=O)NN)cc2)cc1 12505419 YEBYAJBUUBBDGW-UHFFFAOYSA-N 425.510 2.690 50 40 IFGB CCOc1cc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc(Cl)c1OCC(=O)O 35151373 GGOCKRSEESZOFJ-FBHDLOMBSA-N 435.820 2.803 50 40 IFGB O=C(Cc1ccccc1)N/N=C(\c1nc2ccc([N+](=O)[O-])cc2nc1O)[C@H](O)c1ccco1 104291171 CHTOQGYSOSVQCR-WLVUNBRHSA-N 447.407 2.633 50 40 IFGB C/C(N)=C(\C#N)C(=O)COC(=O)CSc1nnc(-c2ccco2)n1Cc1ccccc1 104429365 UTBOUWNQYNXFHP-PEZBUJJGSA-N 437.481 2.547 50 40 IFGB O=C(CCCC(=O)OCC(=O)Nc1cccc2ccccc12)NNC(=O)c1ccccc1 408647515 UFKMNUZCIKUUFZ-UHFFFAOYSA-N 433.464 2.953 50 40 IFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1cc(Br)ccc1O 408913309 SSPJBWMAODZBSX-GKXUUXLPSA-N 434.290 2.962 50 40 IFGB CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)NNC(=O)c1ccccc1-n1cccc1 21007484 IYGXXLZXXAFAOW-FQEVSTJZSA-N 440.450 2.971 50 40 IFGB COc1ccc(C(=O)N2CCC[C@@H](C(=O)OCC(=O)/C(C#N)=C(/C)N)C2)c2ccccc12 105033861 TVJKRMZGZNMSGW-RUAUKMDKSA-N 435.480 2.569 50 40 IFGB COc1cc(/C=N/NC(=O)C(=O)NC[C@H]2CCCO2)ccc1OCc1ccc(Cl)cc1 408606738 APBIIDLTGNNYBT-LLXCYVELSA-N 445.903 2.673 50 40 IFGB O=C(COc1ccccc1)NNC(=O)CSc1nnc(COc2ccc(Cl)cc2)o1 408637342 ISWBAZOGIBIOJR-UHFFFAOYSA-N 448.888 2.621 50 40 IFGB COCCCNC(=O)/C(C#N)=C/c1c(Oc2ccccc2OC)nc2ccccn2c1=O 2415640 PVMIMZZWUYOAME-JQIJEIRASA-N 434.452 2.555 50 40 IFGB O=C(CCC(=O)Nc1ccc(Cl)cc1Cl)NNC(=O)[C@@H]1CCCC[C@@H]1C(=O)O 8400284 AELDTLRCHIVTJW-NEPJUHHUSA-N 430.288 2.751 50 40 IFGB CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)OC)c(OC)c2)cc1 408792699 BZRJCDIQTDUQMU-GZTJUZNOSA-N 438.436 2.969 50 40 IFGB COc1ccc(C(=O)NNC(=O)c2cc3cc(Br)ccc3oc2=O)cc1OC 8741805 CVIROEFMYPVRJC-UHFFFAOYSA-N 447.241 2.648 50 40 IFGB CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1 12364850 QSQGKEQHWTZSJZ-SNVBAGLBSA-N 446.312 2.729 50 40 IFGB CCn1nc(C(=O)NNC(=O)c2cc(C3CC3)nn2-c2ccccc2)c2ccccc2c1=O 14244410 NHRIGOBQOBVVLJ-UHFFFAOYSA-N 442.479 2.554 50 40 IFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(Br)cc2)C1)c1c(F)cccc1F 408615607 REQDBJZQYSUVDX-JTQLQIEISA-N 438.228 2.541 50 40 IFGB O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NNC(=O)Cc1c[nH]c2ccccc12 9910544 PTWMYTSDVKPGDW-UHFFFAOYSA-N 426.476 2.955 50 40 IFGB CCn1c(=O)c(C(=O)NNC(=O)c2ccccc2Br)c(O)c2ccccc21 100551295 ZGKFLGVGABDSQB-UHFFFAOYSA-N 430.258 2.564 50 40 IFGB CCOc1cc(/C=N/NC(=O)C(=O)NC)ccc1OCc1ccc(Br)cc1 408612707 XFWUBCQJASEYRY-SSDVNMTOSA-N 434.290 2.623 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccc(Cl)cc2Cl)c1 409152789 JXOPWQCDHVXXKN-AUEPDCJTSA-N 437.283 2.597 50 40 IFGB CC(C)CNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccc(F)c(Cl)c2)c1 409175247 ZIQQIFGPZGHWCG-OPEKNORGSA-N 448.882 2.719 50 40 IFGB C[C@H]1CCCC[C@@H]1NC(=S)NNC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3 13058677 MAVOJNTUTDYYIY-YOEHRIQHSA-N 427.574 2.811 50 40 IFGB O=C(N/N=C1\C(=O)N(CCc2ccccc2)c2ccccc21)[C@H]1COc2ccccc2O1 103735055 PHWOUAMHAIOCET-BQSZEUOTSA-N 427.460 2.936 50 40 IFGB O=C(Cc1nnc(NC(=O)c2ccc(Br)cc2)s1)N/N=C/c1ccccc1 408730573 IEMQRRCAULGLAC-RGVLZGJSSA-N 444.314 3.246 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)cc1OC 408753355 MCQIDTFRWRMXET-WQZUMXOESA-N 447.557 2.856 50 40 IFGB COC(=O)c1ccc(/C=N/NC(=O)Cn2cnc3sc4c(c3c2=O)CC[C@H](C)C4)cc1 954712 FCIBGBXSBWRLSY-VRVUXBDFSA-N 438.509 2.520 50 40 IFGB O=C(NNC(=O)C1CCN(C(=O)Nc2ccccc2)CC1)c1cc(-c2ccccc2)n[nH]1 9507980 CVZVKOWVJNLOMD-UHFFFAOYSA-N 432.484 2.782 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@@H]3[C@@H]4C[C@H]([C@H](Br)[C@@H]4Br)[C@@H]3C2=O)cc1 100159262 KXHQMAGGCJSUCQ-LVTVNPDKSA-N 443.091 2.667 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc([N+](=O)[O-])c1)c1ccc(Cl)c(Cl)c1 408927149 YJSWBLCCXIGMNO-DJKKODMXSA-N 445.284 2.818 50 40 IFGB Cc1ccccc1OCC(=O)N[C@H](CC(C)C)C(=O)N/N=C/c1ccc(C(=O)O)cc1 408972947 XEUFKOVGALTYLA-NZYROCMPSA-N 425.485 2.753 50 40 IFGB C[C@H]1CN(c2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)NC2CCCCC2)C[C@H](C)O1 9428132 CDQQFEOSHNQWJU-JXELUCIISA-N 435.528 2.664 50 40 IFGB Cc1ccc(NC(=O)COc2cccc(/C=N/NC(=O)C(=O)NCc3ccccc3)c2)cc1 409163691 WIZBNUXZYVNOIU-JVWAILMASA-N 444.491 2.779 50 40 IFGB O=C(CN1CCN(c2cccc(C(F)(F)F)c2)CC1)NNC(=O)c1ccccc1Cl 23701304 DPYKJQFNKUEKFS-UHFFFAOYSA-N 440.853 2.942 50 40 IFGB CCc1sc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1C 9442934 DYZXFHUIUZRCER-XUSGNXJCSA-N 434.562 2.517 50 40 IFGB C/C(=N\NC(=O)c1c(C)nnn1-c1nonc1N)c1ccc(OCc2ccc(C)cc2)cc1 25783053 LJFGHBNQOJCDJW-ZVHZXABRSA-N 446.471 2.582 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)N2CCCCCC2)cc1)Nc1ccc(F)cc1 58880684 LBZNQVHOCUZFSS-MFKUBSTISA-N 440.475 2.696 50 40 IFGB Cc1oc(/C=N/NC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)cc1Br 2173104 UZQKMTRTHOYAKC-QGMBQPNBSA-N 448.726 2.920 50 40 IFGB O=C(CCN1CCN(c2ccccc2)CC1)N/N=C/c1cc(Br)ccc1O 3247296 PYLVHOQLNNIHFO-PXLXIMEGSA-N 431.334 2.817 50 40 IFGB CCn1nc(C(=O)NNC(=O)Cc2c(C)nc3ccccc3c2C)c2ccccc2c1=O 17188974 GCNDTXBAHSLKTM-UHFFFAOYSA-N 429.480 2.585 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2ccccc2C)S(C)(=O)=O)cc1OCC 20207512 MPILIMIIDMLEPQ-HZHRSRAPSA-N 445.541 2.875 50 40 IFGB Cc1ccc(C(=O)N/N=C/c2ccc(OCC(=O)NCc3ccco3)cc2)cc1[N+](=O)[O-] 28215729 SOHDQJMAXLHKMA-WYMPLXKRSA-N 436.424 2.955 50 40 IFGB COc1ccc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc1I 33636812 MLCKFCMYPJHAIM-ZDLGFXPLSA-N 439.209 2.901 50 40 IFGB O=C(COC(=O)C12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2)NNC(=O)c1ccccc1 102395756 ODDAFAJMHZDDQA-RCRDTURJSA-N 435.318 2.725 50 40 IFGB Cc1ccc(Cl)cc1NC(=O)COC(=O)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@H]2Br 408687580 UQKUTDHLMYBEDZ-WRJRQJQLSA-N 442.693 2.701 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccco2)S(=O)(=O)c2ccccc2)cc1OC 408783428 LGTPZHSRBZGFTG-HYARGMPZSA-N 443.481 2.642 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2)c(Cl)c1 409152554 JHFRRMJAFYXEIN-ZMOGYAJESA-N 430.892 2.724 50 40 IFGB CCN(CC)S(=O)(=O)c1cc([N+](=O)[O-])ccc1NNC(=O)Nc1ccc(F)cc1 8680940 YWFRZQVGZLTZHX-UHFFFAOYSA-N 425.442 2.913 50 40 IFGB COCc1cc(C)nc(OCC(=O)N/N=C/c2cc(Br)ccc2OC)c1C#N 59427778 VIDVGVDFQQUQCW-LSFURLLWSA-N 447.289 2.708 50 40 IFGB COc1cc(OC)cc(C(=O)N2CCC(C(=O)N/N=C/c3ccccc3[N+](=O)[O-])CC2)c1 59953142 MXZVJMAHBPGVSL-OEAKJJBVSA-N 440.456 2.615 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc(C(=O)O)cc1)c1cccc(Cl)c1Cl 408906586 HYLJIKRKOJRTSK-AWQFTUOYSA-N 444.296 2.608 50 40 IFGB COc1ccccc1N(CC(=O)N/N=C/c1ccccc1C(F)(F)F)S(C)(=O)=O 408909792 IFRAWWDSERPLJA-SSDVNMTOSA-N 429.420 2.630 50 40 IFGB COc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccccn2)c2ccc(C)cc2)cc1 408922424 ARYRFRFBUNCXBE-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB O=C(NNC(=O)c1ccc(=O)[nH]n1)c1ccc(CSc2nc3ccccc3s2)cc1 9317252 RHMPDUUKABISDA-UHFFFAOYSA-N 437.506 2.747 50 40 IFGB CC[C@H](C)N1C(=O)C(C#N)=C(C)/C(=C/Nc2cc(OC)c(OC)cc2C(=O)OC)C1=O 9420496 UVZYLESTTQNDIB-IEMQHYRPSA-N 427.457 2.794 50 40 IFGB CC(=O)NNC(=O)CCCN1C(=O)/C(=C\c2cccc(Br)c2)SC1=S 9435953 SMKHHYMWDDAHKC-UKTHLTGXSA-N 442.360 2.598 50 40 IFGB COc1ccccc1C(=O)NNC(=O)CCN1C(=O)/C(=C\c2ccccc2)SC1=S 13476278 CSAHQMPIHOKTLZ-GHRIWEEISA-N 441.534 2.748 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2cc(Cl)cc(Cl)c2)S(C)(=O)=O)c1 20211562 LOSNCQUDFDKKDU-KEBDBYFISA-N 430.313 2.918 50 40 IFGB COc1ccc(-n2nnnc2SCC(=O)N/N=C\c2ccccc2OC(C)C)cc1 15277025 REEMRQMZBKUYOU-MTJSOVHGSA-N 426.502 2.701 50 40 IFGB CS(=O)(=O)N(Cc1ccc(C(=O)N/N=C2\C(=O)Nc3ccccc32)cc1)c1ccccc1 18193325 LEWCLUYEGOIODC-UHFFFAOYSA-N 448.504 2.739 50 40 IFGB O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NNC(=O)c1ccc(O)cc1 35638332 QQDBGCFDJZARBA-PTNGSMBKSA-N 447.563 2.896 50 40 IFGB Cc1cc(I)cc(/C=N/NC(=O)[C@@H]2COc3ccccc3O2)c1O 2353028 UCJUVJVGKZJNCX-UZSVJVCZSA-N 438.221 2.595 50 40 IFGB O=C(COc1ccc(Br)cc1)N/N=C1/SCC(=O)N1Cc1ccccc1 8685923 HHNCZXJPJRVQIB-DYTRJAOYSA-N 434.315 2.991 50 40 IFGB Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)NNC(=O)c3n[nH]c4c3CCCC4)c12 30569914 CLAFROLHQHVETE-UHFFFAOYSA-N 429.484 2.620 50 40 IFGB CCc1cc2c(=O)n(CC(=O)N/N=C\c3ccc(OC)c(Br)c3)cnc2s1 31783538 SLWFCXKLWJUFAN-WNFQYIGGSA-N 449.330 2.942 50 40 IFGB CCOc1cc(/C=N/NC(=O)[C@@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)ccc1O 408764115 RRLKYAGAHXHCTD-IXOWOOARSA-N 447.557 2.943 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2ccc(Br)cc2)S(C)(=O)=O)cc1C 408783775 MRBUCFDKHBWWBX-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB Cc1cc2c(cc1/C=N/NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1)OCO2 408863061 OTTLWXTYBATMCZ-CBVHTYNASA-N 449.916 2.681 50 40 IFGB COc1ccccc1NC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccccc1 409159685 RUOKDTNEEJPEQC-MFKUBSTISA-N 446.463 2.802 50 40 IFGB CC(=O)NN(C(C)=O)c1nc2sc3c(c2c(=O)n1-c1ccccc1)CC(C)(C)OC3 2275182 KWRIJBDZJMJQBB-UHFFFAOYSA-N 426.498 2.703 50 40 IFGB COc1cc(/C=N/NC(=O)C(=O)Nc2cccc(Br)c2)cc(OC)c1OC 3067277 RSXGLRZROYDPOA-KEBDBYFISA-N 436.262 2.564 50 40 IFGB CCOC(=O)C(Cc1ccccc1N(CCCl)CCCl)(NC(C)=O)C(=O)OCC 4830697 OENNSOMWXSKCLY-UHFFFAOYSA-N 447.359 2.514 50 40 IFGB COc1cccc(Nc2nnc(SCC(=O)N/N=C3/C(=O)Nc4ccccc43)s2)c1 6182026 WNCXHTCCWGYKHQ-UHFFFAOYSA-N 440.510 2.855 50 40 IFGB O=C(N/N=c1/c(=O)c2cccc3cccc1c32)c1cccc(S(=O)(=O)N2CCCCC2)c1 9119385 ZGIIVAGQVNVVSE-YYDJUVGSSA-N 447.516 2.649 50 40 IFGB CCOc1cccc(-c2c(C(=O)N/N=C(\C)c3cccs3)nnn2-c2nonc2N)c1 9291816 ROAMDCMDKLXFDJ-SRZZPIQSSA-N 438.473 2.514 50 40 IFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccc(C)cc2)ccc1OCC(N)=O 2605937 JYUPHXWIBYQJDW-JOCHJYFZSA-N 445.479 2.580 50 40 IFGB COc1ccc(OCc2nnc(SCC(=O)NNC(=O)c3ccc(Cl)cc3)o2)cc1 408639804 ZTRPIXPDARDNQH-UHFFFAOYSA-N 448.888 2.864 50 40 IFGB C/C(=N\NC(=O)CN(c1ccccc1F)S(C)(=O)=O)c1ccc(Br)cc1 408770933 BDJBFHFEFGCCEF-UDWIEESQSA-N 442.310 2.895 50 40 IFGB COc1cc(/C=N/NC(=O)CNc2ccc(Br)cc2)c([N+](=O)[O-])cc1OC 409346465 OIBKBCZDQPDURI-AWQFTUOYSA-N 437.250 2.937 50 40 IFGB CCOc1cc(/C=N/NC(=O)[C@H](O)c2ccccc2)cc(I)c1O 1431156 XIVGANJEKXFQBJ-GDXCHIGESA-N 440.237 2.579 50 40 IFGB O=C(CCCCC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc([N+](=O)[O-])cc1 8434986 NYROKVKTVMZWOU-JFMUQQRKSA-N 440.416 2.664 50 40 IFGB O=C(N[C@H](C(=O)N/N=C/c1ccccc1F)c1n[nH]c(=O)c2ccccc12)c1ccccc1 9065159 LNTNZPINWCEWQB-WMPMWDHYSA-N 443.438 2.684 50 40 IFGB O=C(CCN1C(=O)/C(=C/c2ccccc2Cl)SC1=S)NNC(=O)c1cccnc1 13686355 XVPBLPMEBBUYME-GDNBJRDFSA-N 446.941 2.788 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccncc2)Cc2ccccc2F)cc1 15225370 KNGZEAFSKXZTHD-AFUMVMLFSA-N 440.500 2.870 50 40 IFGB COc1ccc(N(CC(=O)NN=C2CCCC2)S(=O)(=O)c2ccccc2)c(OC)c1 19950575 WRYGCELJOCQGKC-UHFFFAOYSA-N 431.514 2.945 50 40 IFGB COc1cccc(N(CC(=O)N/N=C/c2ccc(Cl)c(Cl)c2)S(C)(=O)=O)c1 20210151 BZYNBNRMPSZJLF-KEBDBYFISA-N 430.313 2.918 50 40 IFGB CCOc1cc(C(=O)NNC(=O)Cn2cc3ccccc3n2)cc(OCC)c1OCC 78995416 YWHPNPUUUJVXRY-UHFFFAOYSA-N 426.473 2.694 50 40 IFGB COC(=O)COc1ccc(/C=N/NC(=O)COc2ccccc2C)cc1Br 12467909 CTVTZJCGVGTAFC-UFFVCSGVSA-N 435.274 2.838 50 40 IFGB COc1ccc(NC(=O)C(=O)N/N=C(\C)CC(=O)NC2CCCCCCC2)c(OC)c1 12468406 JYAXVRHMRAHWBP-MFKUBSTISA-N 432.521 2.754 50 40 IFGB CCCOc1ccc(-c2c(C(=O)N/N=C/[C@H]3CC=CCC3)nnn2-c2nonc2N)cc1 13540891 YFTUSUAQOAVRKK-WQEJZQBCSA-N 436.476 2.760 50 40 IFGB CCCn1nc(C(=O)NNC(=O)CSc2ccc(OCC)cc2)c2ccccc2c1=O 17163071 RNJCLNSSOBPAFT-UHFFFAOYSA-N 440.525 2.759 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccccc2O)S(=O)(=O)c2ccccc2)cc1 408771282 FGAZTMMUHUFPNJ-HZHRSRAPSA-N 439.493 2.746 50 40 IFGB O=C(NNC(=O)c1ccccc1O)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1 12521470 REIXDYRBRSGMTR-UHFFFAOYSA-N 447.419 2.546 50 40 IFGB CCOc1cc(/C=N/NC(=O)C(=O)NCCCOC)cc(Cl)c1OCc1ccccc1 408610359 TWGTZWXANYAWND-AFUMVMLFSA-N 447.919 2.921 50 40 IFGB O=C(CN(C1=NS(=O)(=O)c2ccccc21)c1ccccc1)N/N=C/c1ccc(F)cc1 1063612 IUPAVMOKHIOQMT-ZVHZXABRSA-N 436.468 2.932 50 40 IFGB COc1cc(C=NNC(=O)[C@H](C)n2cnc3sc4c(c3c2=O)CCCC4)ccc1O 11990281 JHFBEXQXOQWOJB-LBPRGKRZSA-N 426.498 2.762 50 40 IFGB Cc1cc(/C=C(\C#N)C(=O)OCC(=O)N2CCN(c3ccccn3)CC2)c(C)n1CC(C)C 12823048 PUIIPWJVYNWKTJ-HYARGMPZSA-N 449.555 2.955 50 40 IFGB O=C(N/N=C\c1ccc(-c2ccc3c(c2)C(=O)NC3=O)o1)c1cncc(Br)c1 16431460 ZTDLUOHQHYEKHF-AFPJDJCSSA-N 439.225 2.752 50 40 IFGB Cc1c(C(=O)NNC(=O)[C@@H](NS(=O)(=O)c2cccs2)C(C)C)oc2ccccc12 17448369 NCXNNAJNJNIJNL-INIZCTEOSA-N 435.527 2.567 50 40 IFGB Cc1cc(/C=C(/C#N)C(=O)NC(N)=O)c(C)n1-c1cccc(I)c1 409246784 BESHFVAPPCNEKA-QPEQYQDCSA-N 434.237 2.801 50 40 IFGB CCCCCOc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 9592777 KPQFQNPMYYBIOB-UHFFFAOYSA-N 429.429 2.782 50 40 IFGB Cn1cc(Br)cc1C(=O)NNS(=O)(=O)c1cc(Cl)ccc1Cl 12973655 RAZLNYLAGOAICS-UHFFFAOYSA-N 427.107 2.718 50 40 IFGB COc1cccc(/C=N/NC(=O)CCSCCC(=O)N/N=C/c2cccc(OC)c2)c1 16991638 HIENSDKBAVLDSG-DFEHQXHXSA-N 442.541 2.818 50 40 IFGB Cc1cc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccco2)c(C)n1-c1ccc(F)cc1 40051365 GAJKUAHEDDLKSO-LJQANCHMSA-N 438.459 2.892 50 40 IFGB O=C(NNC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2)c1cccc([N+](=O)[O-])c1 40140075 BPYAMMXHWBVGMQ-UHFFFAOYSA-N 427.367 2.622 50 40 IFGB COc1ccc(C(=O)NC2=N/C(=C(/C#N)C(=O)NCC(C)C)c3ccccc32)cc1OC 9449802 NUGIYAUNTRJPNC-UZYVYHOESA-N 432.480 2.901 50 40 IFGB O=C(Cc1csc(N2CCOCC2)n1)NNC(=O)c1ccccc1Nc1ccccc1 17525165 IUHVNLBTFUEWCO-UHFFFAOYSA-N 437.525 2.727 50 40 IFGB O=C(NNC(=O)N1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1)c1cccs1 28989805 NTEIQACBGSNARD-UHFFFAOYSA-N 428.436 2.819 50 40 IFGB O=C(NNc1ccccc1C(F)(F)F)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O 58345127 GZKBLOQIWCKJNC-UHFFFAOYSA-N 425.388 2.769 50 40 IFGB Cc1ccc(S(=O)(=O)N2CCC(C(=O)N/N=C/c3ccc(N(C)C)cc3)CC2)cc1 3095350 VVCZIFGBPPDTNW-XQNSMLJCSA-N 428.558 2.612 50 40 IFGB O=C(CCCCl)Nc1ccc(S(=O)(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 8883065 MOJGHKPPNHVCQQ-CVEARBPZSA-N 449.960 2.614 50 40 IFGB CCc1sc(C(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)cc1C 9442933 DYZXFHUIUZRCER-GTJPDFRWSA-N 434.562 2.517 50 40 IFGB O=C(CN1C(=O)COc2ccccc21)NNC(=O)c1csc(-c2ccc(Cl)cc2)n1 12922443 IIHDTQOIODBBIY-UHFFFAOYSA-N 442.884 2.650 50 40 IFGB COC(=O)N/N=C(\c1nc2ccc(Cl)cc2nc1O)[C@H](O)c1ccc([N+](=O)[O-])cc1 17211369 VBCPPHSSHJQCQP-CAUNFOBBSA-N 431.792 2.691 50 40 IFGB COc1ccc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)cc1 59921513 AXDQTPZXGJSKIS-HYARGMPZSA-N 435.933 2.900 50 40 IFGB O=C(Cc1ccccc1)NNC1=C/C(=N/S(=O)(=O)c2ccccc2)c2ccccc2C1=O 101027824 CYOYTMJWQIVPGI-MEFGMAGPSA-N 445.500 2.808 50 40 IFGB O=C(N/N=C/[C@@H]1C(=O)NC(=S)N(c2ccc(Cl)cc2)C1=O)c1ccccc1Cl 408744102 YRYJNAAWLXOZJA-FCQRQVBFSA-N 435.292 2.773 50 40 IFGB O=C(CCCSc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 9127373 BXWVSQRKYPMVLI-UHFFFAOYSA-N 447.582 2.805 50 40 IFGB CSc1ncccc1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 17576975 KGCBQNFYKALJIL-UHFFFAOYSA-N 448.551 2.741 50 40 IFGB COc1cc(/C=N/NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)ccc1C 408990516 NNOLRNXRAFTTRS-HTHFWCIQSA-N 435.484 2.715 50 40 IFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4cccnc4)c(=O)c32)cc1OC 727902 VZOSJGBUFJYWLC-OAQYLSRUSA-N 430.464 2.835 50 40 IFGB O=C(NNC(=O)c1cc2cc(Br)ccc2oc1=O)c1cccc([N+](=O)[O-])c1 2807124 PRNNNEPCEUIYNZ-UHFFFAOYSA-N 432.186 2.539 50 40 IFGB O=C(CCCSCCCC(=O)N/N=C/c1ccccc1O)N/N=C\c1ccccc1O 4748347 MWGPMYRFUXZJAS-REPVBDINSA-N 442.541 2.992 50 40 IFGB Cn1cc(Cl)cc1C(=O)NNC(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 12394813 VMFYAZYGUYGYIJ-UHFFFAOYSA-N 429.830 2.770 50 40 IFGB COc1ccc(C(=O)NNC(=O)[C@H](NC(=O)C23CC4CC(CC(C4)C2)C3)C(C)C)cc1 12991377 IYBHQWYTNUBIMJ-XOQVKLMPSA-N 427.545 2.813 50 40 IFGB Cc1cccc(OCC(=O)NNC(=O)c2ccc(CN3C(=O)c4ccccc4C3=O)cc2)c1 32909248 SBBCLJVIXWHMLL-UHFFFAOYSA-N 443.459 2.631 50 40 IFGB COc1ccccc1/C=N/NC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 59953111 RUAHEYOXXWEWMZ-HYARGMPZSA-N 435.933 2.900 50 40 IFGB COC(=O)CC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(/C)NNC(=O)CC(C)C 112289212 XJXHPTVBIRKLTM-PDGQHHTCSA-N 429.502 2.503 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)CSCc2ccccc2)cc1)NC[C@H]1CCCO1 8452166 LXYDFKWQCCEAKS-RNRKLAHPSA-N 441.553 2.744 50 40 IFGB CN(CC(=O)N/N=C/c1ccccc1[N+](=O)[O-])S(=O)(=O)c1cc(Cl)ccc1Cl 16187201 LRZMCJTUVUDVDI-DJKKODMXSA-N 445.284 2.672 50 40 IFGB CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C/c2cccc3ccccc23)cc1 16321303 BLJKJIKHCJAXGS-OEAKJJBVSA-N 438.509 2.569 50 40 IFGB Cc1cccc(O[C@@H](C)C(=O)NNC(=O)[C@H]2CCCN(c3ccc(Cl)nn3)C2)c1C 32913627 CVEQOGVFJABJOQ-HOTGVXAUSA-N 431.924 2.578 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccc(Cl)c(Cl)c1 409168422 MHGGYQXQOYUTQN-BHGWPJFGSA-N 449.294 2.763 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NC3CC3)cc2Cl)c(C)c1 409249513 IUTVDCPIZQZQNA-BHGWPJFGSA-N 442.903 2.703 50 40 IFGB COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(C)oc3C)c2)cc1 3569921 XXJIHOXYENHWOP-UHFFFAOYSA-N 443.481 2.781 50 40 IFGB COc1cc([C@H]2[C@H](Cl)C(=O)N2NC(=O)c2ccc(NC(C)=O)cc2)cc(OC)c1OC 5841543 HIXFLJPXFRBGRX-ROUUACIJSA-N 447.875 2.507 50 40 IFGB COc1ccc([C@@H]2C(C#N)=C(N)OC3=C2S(=O)(=O)N(C)c2ccccc23)cc1OC 57510511 YZZNYCJQSDQPDL-GOSISDBHSA-N 425.466 2.660 50 40 IFGB Cc1ccc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc1 13777452 LFPLYKWTUXESBQ-UMEYKSNOSA-N 430.464 2.997 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1 19861386 QPTZNSVWIOIOSE-ZVHZXABRSA-N 430.936 2.625 50 40 IFGB Cc1cc2c(c(=O)n1CCCN1CCOCC1)[C@H](c1ccccc1Cl)C(C#N)=C(N)O2 19890676 GCWBTQGMIJDBTE-HXUWFJFHSA-N 440.931 2.751 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2ccccc2F)S(C)(=O)=O)cc1OCC 20211657 WRAPKMNNPIKHLI-OEAKJJBVSA-N 449.504 2.706 50 40 IFGB CCOc1ccc(-n2nc(C(=O)N/N=C\c3ccccc3OCC)c(C)c(C#N)c2=O)cc1 409058587 SXRNPVRQGDDECV-YSMPRRRNSA-N 445.479 2.974 50 40 IFGB COc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)cc(I)c1O 409237073 VTSDONMIRIBSPE-OCKHKDLRSA-N 428.201 2.837 50 40 IFGB CCOc1ccc(/C=N/NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cc1OC 16692788 DYKLGIFDDRFILH-CIAFOILYSA-N 439.921 2.518 50 40 IFGB C/C(=N\NC(=O)CCSCCC(=O)N/N=C(\C)c1ccccc1O)c1ccccc1O 104376788 LRJLDNHNOVGVHH-DFEHQXHXSA-N 442.541 2.992 50 40 IFGB CCc1ccccc1N1C[C@@H](C(=O)NNC(=O)c2ccc(Br)cc2)CC1=O 17330629 XHWOKTZVFGPNJQ-HNNXBMFYSA-N 430.302 2.826 50 40 IFGB O=C(O)c1ccccc1N1C(=O)[C@@H]2[C@@H]3C[C@@H]([C@H](Br)[C@H]3Br)[C@@H]2C1=O 97951012 RVSOKZITIXHEOI-YVDDKPQSSA-N 443.091 2.667 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1O)c1cc(C(F)(F)F)ccc1Cl 408923119 FLTXREDWOZUYQT-LSFURLLWSA-N 449.838 2.981 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccncc2)ccc1OCC(=O)Nc1cccc([N+](=O)[O-])c1 799922 XKQJIUJNUROWJB-ZMOGYAJESA-N 449.423 2.780 50 40 IFGB CCN(CC)S(=O)(=O)c1cccc(C(=O)N/N=c2/c(=O)c3cccc4cccc2c43)c1 3233923 JBKAIHCGEAHJLY-DARPEHSRSA-N 435.505 2.505 50 40 IFGB O=C1[C@H]2[C@@H](C(=O)N1c1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@H]2[C@@H](Br)[C@H]1Br 4015936 ZCDMNVVYMXYOLY-BCFCROPCSA-N 444.079 2.877 50 40 IFGB COc1ccccc1NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2)cc1 58881491 VACCZHXSGFRKMV-MFKUBSTISA-N 446.463 2.802 50 40 IFGB O=C(CN(Cc1ccco1)S(=O)(=O)c1ccccc1)N/N=C/c1ccc([N+](=O)[O-])cc1 59443785 SPVBLTQQJRCMMY-FYJGNVAPSA-N 442.453 2.529 50 40 IFGB O=C(COc1ccccc1/C=N/NC(=O)C(=O)NCCc1ccccc1)Nc1ccccc1 409153124 CQKRNPHXCPAZCK-WPWMEQJKSA-N 444.491 2.513 50 40 IFGB Cc1nc2ccccn2c1C(=O)N/N=C/c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 9630912 WGXPLECOOCDYDG-KEBDBYFISA-N 436.457 2.595 50 40 IFGB Cc1nc(COc2ccc(F)cc2)sc1C(=O)OCC(=O)NNC(=O)c1cccs1 12903637 IBABLBNMSJISHI-UHFFFAOYSA-N 449.485 2.849 50 40 IFGB O=C(N/N=C\c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc(I)cc1 15938510 ZPKKAUZFZJFHNV-IDUWFGFVSA-N 439.165 2.692 50 40 IFGB O=C(NNc1nc(N2CCCCC2)nc(N2CCOCC2)n1)Nc1cccc(Cl)c1 408724322 BDKQREXWMWQFNI-UHFFFAOYSA-N 432.916 2.501 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)C2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)c1 8780797 BSOPMJINPDVKAO-OEAKJJBVSA-N 426.473 2.974 50 40 IFGB CCn1c(C)nc2cc(C(=O)NNC(=O)[C@@H](NC(=O)C3CCCCC3)C(C)C)ccc21 14205789 INAIUVFQBRQWSJ-FQEVSTJZSA-N 427.549 2.847 50 40 IFGB Cc1cccc(C)c1N(CC(=O)N/N=C/c1ccc(OC2CSC2)cc1)S(C)(=O)=O 20213826 LIVBWYJEXFQQTM-SSDVNMTOSA-N 447.582 2.714 50 40 IFGB O=C(N/N=C\c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)[C@@H]1COc2cc3ccccc3cc2O1 67197016 XLRHZEFBRHCBCO-JOUMHXNHSA-N 438.352 2.652 50 40 IFGB CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1 96003907 WUMPPMSTUDIRKH-ZIAGYGMSSA-N 426.311 2.615 50 40 IFGB C/C(=N/NC(=O)[C@H](C)S[C@@H](C)C(=O)N/N=C(/C)c1ccccc1O)c1ccccc1O 104382832 LCPLTURMCNZSNV-JBHTYQCFSA-N 442.541 2.989 50 40 IFGB Cn1c(SCC(=O)N/N=C/c2cccc([N+](=O)[O-])c2)nnc1-c1cccc([N+](=O)[O-])c1 2762473 JXWFHRQHINFXFD-VXLYETTFSA-N 441.429 2.541 50 40 IFGB Cc1cc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 33458506 UKTGCVNTQKDZBR-ATVHPVEESA-N 436.493 2.993 50 40 IFGB COC(=O)c1cc(OC)c(OC)cc1N/C=C1\C(=O)N(CC(C)C)C(=O)C(C#N)=C1C 9420322 HWOSWYYQNZZRMQ-YBEGLDIGSA-N 427.457 2.651 50 40 IFGB COc1cc(OC)cc(C(=O)N2CCC(C(=O)N/N=C/c3ccccc3OC)CC2)c1 59953163 TVTLPZXCKFHYAV-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB Cc1ccc(OCC(=O)NNC(=S)NC(=O)c2cccs2)c(Br)c1 2551592 PYLABPKGCSQVBZ-UHFFFAOYSA-N 428.333 2.534 50 40 IFGB N#CC1=C(N)Oc2[nH]c(=S)n(-c3ccccc3)c2[C@]12C(=O)Nc1c([N+](=O)[O-])cccc12 8863681 OMQJXQXTZGGLNP-HXUWFJFHSA-N 432.421 2.768 50 40 IFGB C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1-c1cccs1)c1cccc(Cl)c1 9307239 ZTNZPYNOPWONOA-AWQFTUOYSA-N 428.865 2.768 50 40 IFGB C[C@@H]1C[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1 12605085 VAOWYLMCQBABOQ-BZNIZROVSA-N 441.431 2.923 50 40 IFGB O=C(COc1ccc(F)cc1)NNC(=O)COc1ccc(Cl)cc1Br 13134978 BZBDORVDPAIAPB-UHFFFAOYSA-N 431.645 2.847 50 40 IFGB COCc1c(Br)c(C)nc(OCC(=O)N/N=C/c2ccc(OC)cc2)c1C#N 59459479 MERSPFJSASIGKQ-LSFURLLWSA-N 447.289 2.708 50 40 IFGB C[C@@H](c1ccccc1)N1C[C@H](C(=O)NNC(=O)c2ccc(Br)cc2)CC1=O 216298875 YZPCDJWYLJCLPJ-XJKSGUPXSA-N 430.302 2.820 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)cc1C 408845619 GUBAUEXXLXMGEI-ZFJBLLOBSA-N 435.933 2.960 50 40 IFGB Cc1c(C(=O)N/N=C/c2ccc(I)cc2)sc2ncnc(N)c12 408972926 HUZQVZXFCINCTL-CGOBSMCZSA-N 437.266 2.950 50 40 IFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3ccc(N(C)C)cc3)CC2)cc1OC 409004156 AUOHGBZIUZIZNX-PCLIKHOPSA-N 438.528 2.772 50 40 IFGB COc1cc2c3c(c1)[C@]1(C(=O)N3C(C)(C)C[C@H]2C)C(C#N)=C(N)Oc2cc(C)oc(=O)c21 1460194 ODUCSGYKDKLULQ-JNDILOIQSA-N 433.464 2.962 50 40 IFGB Cc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CSc2ccccc2)cc1 2381695 VCSUZQBAEHKMSQ-SSDVNMTOSA-N 434.485 2.597 50 40 IFGB Cc1cc(/C=C(\C#N)C(=O)NC(N)=O)c(C)n1-c1ccc(I)cc1 20920590 KSEOJCSNBPVHKJ-MDWZMJQESA-N 434.237 2.801 50 40 IFGB COc1ccccc1OCC(=O)N/N=C/c1ccc(OCC(=O)NCc2ccccc2)cc1 28214030 VYKPIMJOCXKAAK-JVWAILMASA-N 447.491 2.920 50 40 IFGB C[C@H]1CN(C(=O)/C(C#N)=C2\N=C(NC(=O)c3ccc(F)cc3)c3ccccc32)C[C@H](C)O1 9234102 ICYIUICJMQBKAZ-DPMQENLTSA-N 432.455 2.886 50 40 IFGB Cc1ccc2sc(NNC(=O)c3ccc(S(=O)(=O)N4CCOCC4)cc3)nc2c1C 9381848 OEVUDEBQJUOFSC-UHFFFAOYSA-N 446.554 2.691 50 40 IFGB Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1ccc(NS(C)(=O)=O)cc1 10887031 SVCPRRSFTFTZLV-UHFFFAOYSA-N 430.511 2.565 50 40 IFGB CCc1sc(C(=O)NCC(=O)NNC(=O)c2ccc(OC(C)C)c(OC)c2)cc1C 12869115 TUSXKDMFLPDFAF-UHFFFAOYSA-N 433.530 2.606 50 40 IFGB CCc1nc2sc3c(c2c2nnc(SCC(=O)NNC(=O)C(C)C)n12)CC[C@H](C)C3 13499820 SEMBMRCGEFOIRT-NSHDSACASA-N 446.602 2.922 50 40 IFGB O=C(N/N=C/[C@@H]1C(=O)NC(=S)N(c2ccccc2)C1=O)c1ccc(Cl)cc1Cl 16488591 OWYFNBTYGNEJOQ-FCQRQVBFSA-N 435.292 2.773 50 40 IFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C\c1ccccc1I 408551547 NDFIPUXJXZQOKT-MFOYZWKCSA-N 425.182 2.729 50 40 IFGB O=C(N/N=C/[C@H]1C(=O)NC(=S)N(c2ccc(Cl)cc2)C1=O)c1cccc(Cl)c1 408741668 NBZWGAUDGIQSDU-SLSPDHCBSA-N 435.292 2.773 50 40 IFGB Cc1ccc(CNC(=O)C(=O)N/N=C/c2ccc(OCC(=O)Nc3ccccc3)cc2)cc1 409259250 XSCVELOIQIROIQ-JVWAILMASA-N 444.491 2.779 50 40 IFGB Cn1c(SCC(=O)N/N=C/c2ccncc2)nnc1-c1cccc(Br)c1 2314197 JOEFHZADSOSHKG-KEBDBYFISA-N 431.319 2.882 50 40 IFGB COC(=O)c1cnc(NNC(=O)c2cnc(Cl)nc2C(F)(F)F)nc1C(F)(F)F 2577936 YNKHAPYZQHUATC-UHFFFAOYSA-N 444.679 2.501 50 40 IFGB CCn1c(O)c(C(=O)NNC(=O)c2ccccc2Br)c(=O)c2ccccc21 15994185 NEMCTIBDSVREQC-UHFFFAOYSA-N 430.258 2.564 50 40 IFGB C/C(=N\NC(=O)CN(c1ccccn1)S(=O)(=O)c1ccccc1)c1ccc(F)cc1 20213575 HAFKOFOOHFNEDS-LFVJCYFKSA-N 426.473 2.956 50 40 IFGB CCOc1cc(/C=N\NC(=O)c2nn(-c3ccc(CC)cc3)c(=O)c(C#N)c2C)ccc1O 409060347 QITDJQYJFVZFIO-WGARJPEWSA-N 445.479 2.843 50 40 IFGB CS(=O)(=O)N(CC(=O)NN=C1CCN(Cc2ccccc2)CC1)c1ccc(Cl)cc1 409341405 BLKOUZNQHCHNKY-UHFFFAOYSA-N 448.976 2.874 50 40 IFGB Cc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)cc1 1406883 AGJWDAPBMDXZIU-UHFFFAOYSA-N 435.933 2.510 50 40 IFGB COc1cc(/C=N/NC(=O)Cn2cnc3sc(-c4ccccc4)cc3c2=O)ccc1O 1784236 LEKZOEJWWNBJKX-BHGWPJFGSA-N 434.477 2.990 50 40 IFGB O=C(O)c1ccccc1N1C(=O)[C@@H]2[C@@H]3C[C@@H]([C@@H](Br)[C@H]3Br)[C@@H]2C1=O 2067957 RVSOKZITIXHEOI-SDSBWLLFSA-N 443.091 2.667 50 40 IFGB O=C(NNS(=O)(=O)c1ccc(Cl)cc1)C1CCN(Cc2cccc(F)c2)CC1 8873471 NXTMWBSPLKEKKP-UHFFFAOYSA-N 425.913 2.701 50 40 IFGB N#CC1=C(N)Oc2n[nH]c(-c3ccc([N+](=O)[O-])cc3)c2[C@@]12C(=O)Nc1ccc(Cl)cc12 9159529 BXHZAUHIXZGGKE-FQEVSTJZSA-N 434.799 2.963 50 40 IFGB COc1ccccc1OCC(=O)N/N=C/c1ccc(O)c(I)c1 9762905 ZHWFFXPTIMTEQT-GIJQJNRQSA-N 426.210 2.535 50 40 IFGB Cc1ccc(S(=O)(=O)/N=C(/NNC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2)cc1 15777274 ZIUKRGMATJPXBC-UHFFFAOYSA-N 438.465 2.973 50 40 IFGB O=C(CN(C1CCCCC1)S(=O)(=O)c1ccccc1)N/N=C\c1ccccc1C(=O)O 16491145 PDANOCAYTLDVCE-HAHDFKILSA-N 443.525 2.859 50 40 IFGB CCNC(=S)NNC(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1 16681748 VKBOCVUURROIOG-UHFFFAOYSA-N 447.973 2.646 50 40 IFGB Cc1ccccc1N(CC(=O)N/N=C1\C(=O)Nc2ccccc21)S(=O)(=O)c1ccccc1 20060551 CYODADKLPYCCEE-UHFFFAOYSA-N 448.504 2.663 50 40 IFGB C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)S(=O)(=O)c1ccc(CCCl)cc1 40118792 LAHAJDAOMFEECR-OAHLLOKOSA-N 449.960 2.852 50 40 IFGB O=C(COC(=O)CCC(=O)Nc1cc(Cl)ccc1Cl)NNC(=O)c1ccccc1 408671291 ZATAFFVYUMYCJC-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)[C@H]2COc3ccccc3O2)cc1)NCc1ccccc1 408867920 LPSSHJLZSLZCFK-QNBNLKTOSA-N 445.475 2.672 50 40 IFGB COc1ccccc1NC(=S)NNC(=O)CCn1nc(C)c(Br)c1C 655481 PFICIUIDBCHHIV-UHFFFAOYSA-N 426.340 2.679 50 40 IFGB CC1=C(C#N)C(=O)N([C@@H]2CCS(=O)(=O)C2)C(=O)/C1=C/c1ccc(-c2ccc(F)cc2)o1 6038661 RNOTXIYFCBWKER-VHWUNXFSSA-N 440.452 2.865 50 40 IFGB O=C(N[C@@H](C(=O)N/N=C/c1ccccc1F)c1n[nH]c(=O)c2ccccc12)c1ccccc1 9065160 LNTNZPINWCEWQB-ODDBZWQPSA-N 443.438 2.684 50 40 IFGB O=C(CCNC(=O)c1ccccc1)NNC(=O)c1cc(-c2ccccn2)nc2ccccc12 9633179 DPDOKRYGZHHSIU-UHFFFAOYSA-N 439.475 2.878 50 40 IFGB CCc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccccc3Br)CC2=O)cc1 17358569 VJRWTYUZQCARBX-CQSZACIVSA-N 430.302 2.826 50 40 IFGB CCOC(=O)C1CCN(CN2C(=O)/C(=N\NC(=O)c3ccc(C)cc3)c3ccccc32)CC1 19831202 RBDVSPYCPKJPFY-ROMGYVFFSA-N 448.523 2.708 50 40 IFGB O=C(COc1ccccc1-c1ccccc1)NNC(=O)[C@@H]1CCCN(c2ncccn2)C1 27605095 PXRZVIGVFUDMMH-LJQANCHMSA-N 431.496 2.586 50 40 IFGB Cc1ccc(NCC(=O)N/N=C/c2cn(CC(=O)N3CCOCC3)c3ccccc23)cc1C 408962722 TXEQDPFWKCYNQS-MZJWZYIUSA-N 447.539 2.679 50 40 IFGB N#CC1=C(N)Oc2c(c3ccccc3oc2=O)[C@@]12C(=O)Nc1ccc(Br)cc12 1053116 TYUPDMBGVKXMFH-FQEVSTJZSA-N 436.221 2.880 50 40 IFGB COc1ccc(OC)c([C@@H]2C(C#N)=C(N)OC3=C2S(=O)(=O)N(C)c2ccccc23)c1 20558285 GUVKEWHESDWYNI-GOSISDBHSA-N 425.466 2.660 50 40 IFGB CCc1ccc(-n2nc(C(=O)N/N=C\c3ccc(OC)c(OC)c3)c(C)c(C#N)c2=O)cc1 409055958 FPXGKGGLFGLMFD-WGARJPEWSA-N 445.479 2.756 50 40 IFGB COc1ccc([C@@H]2C(C#N)=C(N)N(N3CCOCC3)C3=C2C(=O)CC(C)(C)C3)cc1OC 691397 QYNPURXLANWWCL-OAQYLSRUSA-N 438.528 2.687 50 40 IFGB O=C(NN(C[C@H](O)COc1ccccc1)C[C@@H](O)COc1ccccc1)c1ccccc1 13143679 BPLIWWYTBBIZDG-SZPZYZBQSA-N 436.508 2.513 50 40 IFGB O=C(N/N=C/[C@@H]1C(=O)NC(=S)N(c2ccc(Cl)cc2)C1=O)c1cccc(Cl)c1 408741667 NBZWGAUDGIQSDU-SCDDIDHTSA-N 435.292 2.773 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)cc1O 408761744 BDLIXDFONBVNFA-ZFJBLLOBSA-N 433.530 2.553 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NCC(C)C)cc2)cc1Cl 409155403 QYAWFJWFLQDZIK-BRJLIKDPSA-N 444.919 2.888 50 40 IFGB COc1ccc(CC(=O)NNC(=O)c2ccc(=O)n(Cc3ccc(Cl)cc3)c2)cc1 16839357 BHEYFQPJICYDQN-UHFFFAOYSA-N 425.872 2.562 50 40 IFGB Cc1cccc(C)c1OCC(=O)NCC(=O)N/N=C/c1ccc(-c2ccccc2C(=O)O)o1 409168048 KXWRQJFLXXIAJN-RPPGKUMJSA-N 449.463 2.907 50 40 IFGB COc1cc(C(=O)N[C@@H](C(=O)N/N=C/c2ccc(F)cc2)C(C)C)cc(OC)c1OC 2328697 IUWKYPNYMPBYNE-QVHMZZSFSA-N 431.464 2.756 50 40 IFGB Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1 408762454 KVAWKJLLGVCLAG-IOVUBPJKSA-N 432.502 2.747 50 40 IFGB C[C@H](NC(=O)Cc1cccc2ccccc12)C(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1 9219810 LRWXBZHXTCVFLQ-INIZCTEOSA-N 441.491 2.738 50 40 IFGB C[C@H](Nc1nc2ccccc2s1)C(=O)NNC(=O)CNC(=O)c1ccc2ccccc2c1 10675974 ZOMPEAFTLALEBO-AWEZNQCLSA-N 447.520 2.827 50 40 IFGB CCCCOc1c(Cl)cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC 3477609 RKDKIPGINITSFH-UHFFFAOYSA-N 444.879 2.578 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1OCC(=O)Nc1ccc(C)c(C)c1 408613272 YOLSQERRGGBSIE-BHGWPJFGSA-N 430.892 2.561 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2cccc(OC3CSC3)c2)S(C)(=O)=O)c(C)c1 408866336 FBRANXTYQJSNBB-SSDVNMTOSA-N 447.582 2.714 50 40 IFGB COc1ccccc1N(CC(=O)N/N=C/c1ccccn1)S(=O)(=O)c1ccc(C)cc1 408907437 NZJIDLVJYRVBNC-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB CCn1nc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2C)c2ccccc2c1=O 15939702 NFUNRVNAUQHRKQ-UHFFFAOYSA-N 442.903 2.998 50 40 IFGB O=C(COc1cccc(Br)c1)N/N=C\c1ccc(N2CCOCC2)c(F)c1 409141916 KFGKWSVNNWWOCZ-UUYOSTAYSA-N 436.281 2.954 50 40 IFGB COc1ccc(OC)c([C@H]2C(C#N)=C(N)N(N3CCOCC3)C3=C2C(=O)CC(C)(C)C3)c1 691470 JOEHVTKRDJFMEX-NRFANRHFSA-N 438.528 2.687 50 40 IFGB C[C@H]1CCc2c(sc3ncn([C@H](C)C(=O)N/N=C4\C(=O)N(C)c5ccccc54)c(=O)c23)C1 6166518 UULPLFRCUFSALN-UAHWZNFSSA-N 449.536 2.641 50 40 IFGB N#CC1=C(N)Oc2[nH]c(=S)n(-c3ccccc3)c2[C@@]12C(=O)Nc1ccc([N+](=O)[O-])cc12 8863684 BELMNBSQYWPFLJ-FQEVSTJZSA-N 432.421 2.768 50 40 IFGB CCC(=O)NNC(=O)CSc1nnc2c3c4c(sc3nc(C3CC3)n12)C[C@@H](C)CC4 13502589 WJXDVCWSHJYMHQ-JTQLQIEISA-N 444.586 2.991 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)CSc2ccccc2)cc1)NC[C@H]1CCCO1 28213867 AJXSTOMZQAVHEO-NZYROCMPSA-N 427.526 2.603 50 40 IFGB CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)C(=O)N/N=C/c1ccc(O)cc1O 106090192 ILFAYTGATULRPY-KCDOPAPYSA-N 429.473 2.658 50 40 IFGB Cc1ccc(Cl)cc1NC(=O)COC(=O)[C@H]1[C@H]2C(=O)O[C@H]3[C@@H]2C[C@H]1[C@H]3Br 138785446 UQKUTDHLMYBEDZ-UXTSJCJBSA-N 442.693 2.701 50 40 IFGB O=C(CCC(=O)OCC(=O)Nc1cccc(Cl)c1)NNC(=O)c1ccc(Cl)cc1 408665714 WGUJIQPLHWQOEZ-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB O=C(Nc1cccc(C(=O)N2CCCCC2)c1)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@H]2Br 408684813 ODSFTYWODOKHGI-WJQMWINMSA-N 447.329 2.822 50 40 IFGB COc1ccc(/C=N\NC(=O)CN(C)S(=O)(=O)c2ccc3ccccc3c2)c(OC)c1 16187367 ZCSUTICWULLOIY-UCQKPKSFSA-N 441.509 2.628 50 40 IFGB CCOC(=O)[C@H](Cc1ccccc1)NC(=O)NNC(=O)COc1ccc(Cl)cc1C 16739959 PBEIORVWBNTFNQ-KRWDZBQOSA-N 433.892 2.532 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccn1)c1ccc(Cl)c(C(F)(F)F)c1 20213365 KADIBWFCFQZSLH-LSFURLLWSA-N 434.827 2.670 50 40 IFGB Cc1ccc(NC(=O)CN2C(=O)/C(=N/NC(=O)c3ccccc3O)c3ccccc32)cc1 13550298 GCZUILBNHHEBFK-XTCLZLMSSA-N 428.448 2.820 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccncc1)c1ccc(Cl)c(C(F)(F)F)c1 20213357 SKQBEFSGWQMICB-LSFURLLWSA-N 434.827 2.670 50 40 IFGB O=C(NNC(=O)c1cnn2c(-c3ccccc3)ccnc12)c1cc(Br)c[nH]1 40144403 YZKZLMQSXKBCOX-UHFFFAOYSA-N 425.246 2.562 50 40 IFGB O=C(NNC(=O)[C@H](c1ccc(Cl)cc1Cl)N1CCOCC1)c1ccccc1F 72302644 MHFVGQOWBBVRQV-KRWDZBQOSA-N 426.275 2.967 50 40 IFGB C[C@]1(NNC(=O)NCc2ccc(-c3ccc(Br)cc3)o2)CCS(=O)(=O)C1 89919500 NRVFLFINYHBXCW-KRWDZBQOSA-N 442.335 2.590 50 40 IFGB CCCOc1ccc(N2C(=O)C[C@H](NNC(=O)c3cccc(Br)c3)C2=O)cc1 100154113 YEONOHSCEIJUCJ-KRWDZBQOSA-N 446.301 2.804 50 40 IFGB Cc1cccc(C[C@H]2S/C(=C(\C#N)C(=O)NN3CCOCC3)N(c3ccccc3)C2=O)c1 101179629 DDOTWASNXFGHRZ-KWLPWJRRSA-N 448.548 2.785 50 40 IFGB CCCOc1ccc(C(=O)N/N=C\c2ccc(OCC(N)=O)c(OC)c2)cc1OCC 409321714 HEJAIEUCONELRB-CFRMEGHHSA-N 429.473 2.511 50 40 IFGB C/C(CC(=O)NCc1ccco1)=N\NC(=O)c1ccc(I)cc1 13549980 CDNYCXLXMQIVLV-YBFXNURJSA-N 425.226 2.696 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C2\C(=O)Nc3ccccc32)c2ccccc2)cc1 16309546 DLYRUFXCNMVXDP-UHFFFAOYSA-N 448.504 2.663 50 40 IFGB CCN(CC)c1ccc(C(=O)NNC(=O)[C@@H](NC(=O)c2ccc(OC)cc2)C(C)C)cc1 26773724 RJNJSVGQCFYIBA-NRFANRHFSA-N 440.544 2.757 50 40 IFGB CCOC(=O)c1c(NC(=O)/C(C#N)=C\c2ccc3c(c2)OCO3)sc(C(N)=O)c1C 33499499 ZNLFPGYXLJPTOL-SDQBBNPISA-N 427.438 2.607 50 40 IFGB CCOc1ccc(N(CC(=O)N/N=C/c2cccnc2)S(=O)(=O)c2ccccc2)cc1 59401486 CCKYTNLSYPBOTE-LFVJCYFKSA-N 438.509 2.826 50 40 IFGB O=C(NN/C=C1/C(=O)N(Cc2ccc3c(c2)OCO3)C(=O)c2ccccc21)c1cccs1 89857688 QHMYCCYAKWOWTP-GZTJUZNOSA-N 447.472 2.935 50 40 IFGB Cc1cc(Br)ccc1OCC(=O)NNC(=O)c1ccc(NC(=O)C2CC2)cc1 675031 JXVZNCBHSGCBBO-UHFFFAOYSA-N 446.301 2.946 50 40 IFGB COc1ccc(C(=O)N/N=C/c2ccc(OCC(=O)N3CCCCC3)cc2)cc1OC 4502769 YPSDTUYDRXSPAD-BUVRLJJBSA-N 425.485 2.859 50 40 IFGB CCc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(Br)cc3)CC2=O)cc1 17330550 NMICYCPMIINZAC-HNNXBMFYSA-N 430.302 2.826 50 40 IFGB COc1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc(Cl)c1OCC(N)=O 36612787 VYZWUBUDMKFUBC-QGZVFWFLSA-N 431.876 2.664 50 40 IFGB COc1cc(OC)c(/C=N/NC(=O)C(=O)Nc2ccccc2OC)cc1Br 59483750 GBZDZRWYUAHLOS-KEBDBYFISA-N 436.262 2.564 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1[N+](=O)[O-])c1cc(Cl)cc(Cl)c1 408769705 ZUWOPEWSUPSHFW-DJKKODMXSA-N 445.284 2.818 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2ccccc2Br)S(C)(=O)=O)c(C)c1 409185155 SOBCGPGMOFRCOZ-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB COc1cccc(C(=O)NNC(=O)c2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3)c2)c1 409222814 DBHGLDKHZHZZAG-UHFFFAOYSA-N 434.408 2.931 50 40 IFGB CCc1cccc(CC)c1NC(=O)COC(=O)CCC(=O)NNC(=O)c1ccccc1 7939972 BWMQTJIPFSXDLS-UHFFFAOYSA-N 425.485 2.535 50 40 IFGB COc1ccc2nc(NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)sc2c1 9381808 WUEXAOFUVAMSTC-UHFFFAOYSA-N 432.527 2.846 50 40 IFGB CC(=O)[C@H]1CC[C@@H]2[C@]1(C)C[C@H]1O[C@@]13[C@@]21C=C[C@]2(C[C@@H](O)CC[C@@]23C)[C@H]2C(=O)OC(=O)[C@@H]21 118936374 UWJWRKKBRRCXGD-CAOKSXRASA-N 426.509 2.572 50 40 IFGB Cc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccc(Br)cc3)CC2=O)cc1C 408616701 ZWZHIOKGWQEVDO-OAHLLOKOSA-N 430.302 2.880 50 40 IFGB Cc1cc2c(c(=O)n1C)[C@@]1(C(=O)N(Cc3ccc(F)cc3)c3ccccc31)C(C#N)=C(N)O2 9972397 HPMXZUOGJGQJBE-VWLOTQADSA-N 442.450 2.752 50 40 IFGB CCCn1nc(C(=O)NNS(=O)(=O)c2ccc([C@@H](C)CC)cc2)c2ccccc2c1=O 12753031 QWDNPAFYVULTAZ-HNNXBMFYSA-N 442.541 2.943 50 40 IFGB Nc1nonc1-n1nnc(C(=O)N/N=C/c2ccc3ccccc3c2)c1-c1cccs1 13804864 TYRDMVDIBGJJLW-SSDVNMTOSA-N 430.453 2.878 50 40 IFGB CCOc1cc(C(=O)NNS(=O)(=O)c2cc(F)ccc2F)cc(OCC)c1OCC 20629525 ATLIJSASYLRQAG-UHFFFAOYSA-N 444.456 2.784 50 40 IFGB Cc1cc(O)ccc1N1C(=O)[C@H]2[C@H](C1=O)[C@H]1C[C@H]2[C@H](Br)[C@H]1Br 101215960 WHBYAKCYZUDQAB-JOJVEKOVSA-N 429.108 2.983 50 40 IFGB CN(C)c1ccc(/C=N/NC(=O)Cc2nnc(NC(=O)c3ccc(Cl)cc3)s2)cc1 408730767 IMZDWVPFMHQWRQ-WSDLNYQXSA-N 442.932 3.203 50 40 IFGB CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OCC#N)c(OCC)c1 408906366 IRDRHAXTIDAHNX-PTFSYIGCSA-N 438.484 2.795 50 40 IFGB CC1=C(C(N)=O)[C@H](c2ccco2)C(C#N)=C(SCC(=O)N2CCc3ccccc3C2)N1 9285003 NYVWYOMSYAHEQH-NRFANRHFSA-N 434.521 2.779 50 40 IFGB N#CC1=C(N)N(c2ccc(C(F)(F)F)cc2)C2=C(C(=O)OC2)[C@@]12C(=O)Nc1ccccc12 12377305 KCCRJOWIBHDPSO-NRFANRHFSA-N 438.365 2.920 50 40 IFGB COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C[C@@H]3C=CCC3)c2)cc1 12520930 DYTRPDHLGSNOMR-OAHLLOKOSA-N 429.498 2.613 50 40 IFGB O=C(NNC(=O)c1ccccc1[N+](=O)[O-])c1ccc(NS(=O)(=O)c2cccs2)cc1 12520931 CYGZKLGQCYZZOM-UHFFFAOYSA-N 446.466 2.532 50 40 IFGB O=C(CO/N=C/c1ccccc1Cl)N/N=C1\C(=O)N(CN2CCCC2)c2ccccc21 33247738 KTICSSZRQCTMJB-KOVXTZSBSA-N 439.903 2.611 50 40 IFGB COc1cc(OC)c(/C=N\NC(=O)Cc2ccc3c(c2)OCCO3)cc1Br 409361118 GRQDWKSZVYCJCB-NHDPSOOVSA-N 435.274 2.930 50 40 IFGB CCOC(=O)COc1c(Cl)cc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc1OC 107779815 STULWUJJTWWPMU-JJFYIABZSA-N 449.847 2.892 50 40 IFGB CC(=O)OCC(=O)[C@]1(O)CC[C@H]2[C@@H]3CC[C@@H]4[C@@H](Cl)C(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C 118932342 ACYCMKPAVQZVIQ-IZPBDFPDSA-N 438.948 2.858 50 40 IFGB N#CSc1ccc2nc(N/C=C3\C(=O)NC(=O)N(CCc4ccccc4)C3=O)sc2c1 408526883 CQDQKEBLGFKUSQ-RVDMUPIBSA-N 449.517 3.486 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2cc(Cl)cc(Cl)c2)S(C)(=O)=O)cc1 408767809 OTSLRBMWNBODTF-KEBDBYFISA-N 430.313 2.918 50 40 IFGB CC1=C(C(=O)OC(C)(C)C)[C@@]2(C(=O)Nc3ccc(Br)cc32)C(C#N)=C(N)O1 850189 SMRVBAUQWVAIOB-IBGZPJMESA-N 432.274 2.979 50 40 IFGB C=CCN1C(=O)/C(=N\NC(=O)[C@@H]2COc3ccccc3O2)c2cc(Br)ccc21 13880632 BGWNJUVMMAVTDC-CZEALIGGSA-N 442.269 2.642 50 40 IFGB CC(C)CNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccc(F)c(Cl)c1 409155334 IHPVVBFNJRNAOT-OPEKNORGSA-N 448.882 2.719 50 40 IFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O 409272515 QTXHHSZWROAQGE-REZTVBANSA-N 439.178 2.744 50 40 IFGB Cc1oc(/C=N/NC(=O)CN(c2cccc(Cl)c2)S(C)(=O)=O)cc1Br 20209548 SHKHNJOSFLPRNT-QGMBQPNBSA-N 448.726 2.920 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc2c(c1)OCO2)c1ccc(Cl)c(Cl)c1 408910800 LAVXHQDLSSGMQG-DNTJNYDQSA-N 444.296 2.638 50 40 IFGB CCC(=O)N(NC(=O)c1ccccc1)[C@@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1=O 2410581 KYSJQXCGCNVTPH-MRXNPFEDSA-N 433.386 2.921 50 40 IFGB CCOC(=O)C1=C(CSc2nccc(O)n2)OC(N)=C(C#N)[C@H]1c1ccccc1F 16682554 PPEKTMHLJOQVRB-MRXNPFEDSA-N 428.445 2.738 50 40 IFGB Cc1nc2ccccc2c(=O)n1[C@H](C)C(=O)NNC(=O)c1ccc(COc2ccccc2)o1 32689672 PVOSRAAFOIFNNW-OAHLLOKOSA-N 446.463 2.899 50 40 IFGB Cc1ccc(NC(=O)C(=O)NCc2ccc(/C=N/NC(=O)Cc3ccccc3)o2)cc1C 408869840 UGUFPUNSCYTSHG-CVKSISIWSA-N 432.480 2.844 50 40 IFGB COc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccncc2)c2ccc(C)cc2)cc1 408908221 VUVYDYPWJSLWDM-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(CC)cc2)c(Cl)c1 409151632 CQNVKVAFJXIKRZ-DHRITJCHSA-N 442.903 2.672 50 40 IFGB C#CCN1C(=O)[C@@]2(C(C#N)=C(N)OC(C)=C2C(=O)OCc2ccccc2)c2ccccc21 2497127 LKTWHQLGBLDGCK-RUZDIDTESA-N 425.444 2.646 50 40 IFGB COc1cc(Br)c(Br)c(/C=N\NC(=O)c2cc(C)n[nH]2)c1O 9272795 UCEYHMZSFXQRJN-BNCCVWRVSA-N 432.072 2.721 50 40 IFGB CCOc1ccc(N2C[C@H](C(=O)NNC(=O)c3cccc(Br)c3)CC2=O)cc1 408614943 KBNBHNANYQSEOC-CQSZACIVSA-N 446.301 2.662 50 40 IFGB Nc1nonc1-n1nnc(C(=O)N/N=C/c2c(F)cccc2Cl)c1-c1cccs1 2448505 MFKMTWPVVNFGAW-IFRROFPPSA-N 432.828 2.517 50 40 IFGB O=C(CSc1nnc(-c2ccncc2)n1Cc1ccccc1)NNC(=O)c1ccco1 13513037 GOMMVAOQZOBEKA-UHFFFAOYSA-N 434.481 2.535 50 40 IFGB O=C(NNC(=O)c1ccccc1F)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 26690694 FDWRCHDHKCPTLA-UHFFFAOYSA-N 431.420 2.840 50 40 IFGB Cc1cccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CCCN(c3ccc(Cl)nn3)C2)c1C 32913626 CVEQOGVFJABJOQ-CVEARBPZSA-N 431.924 2.578 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(F)cc2)cc1)NCc1ccccc1 58880988 TXAIUYFGQDFBGQ-JFLMPSFJSA-N 448.454 2.610 50 40 IFGB Cc1ccccc1CSCC(=O)N/N=C/c1ccc(OCC(=O)N2CCOCC2)cc1 59436984 DTMALFRCNLWPJH-ZVHZXABRSA-N 441.553 2.616 50 40 IFGB COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C)oc2C)c1 3392187 SKGQUKJIOICIKK-UHFFFAOYSA-N 443.481 2.781 50 40 IFGB Cc1cc(C)c(OCC(=O)N/N=C2/C(=O)Nc3ccc([N+](=O)[O-])cc32)c(Br)c1 8385635 CFPJUPFHRCUMOG-UHFFFAOYSA-N 447.245 2.826 50 40 IFGB Cc1cccc(C)c1N(CC(=O)N/N=C/c1cc(Br)c(C)o1)S(C)(=O)=O 8686632 DBJIMGGQBASBQY-DJKKODMXSA-N 442.335 2.884 50 40 IFGB Cc1c(C)n2c3c(=O)n(Cc4c(F)cccc4Cl)c(=O)n(C)c3nc2n1CCCl 10104456 XWAMQHHOEYZMND-UHFFFAOYSA-N 438.290 2.846 50 40 IFGB CCOC(=O)NC(=O)/C(C#N)=C/N1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 20405532 LMFYPQWRSBDJMV-ZHACJKMWSA-N 431.802 2.556 50 40 IFGB CCOc1ccccc1NC(=O)C(=O)N/N=C/c1cc2c(cc1Br)OCO2 58884883 UTUCJEPODBOVGS-AWQFTUOYSA-N 434.246 2.665 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@H]3C[C@H](Br)[C@@H](Br)C[C@H]3C2=O)c1 100926991 IBSRDFPISRPXAX-USZNOCQGSA-N 431.080 2.811 50 40 IFGB COCc1cc(C)nc(SCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2N(C)C)c1C#N 409003322 ZLQPAQKSJCYSNB-LSHDLFTRSA-N 442.501 2.625 50 40 IFGB CCOC(=O)CSC1=C(C#N)[C@H](c2cc(Br)c(O)c(OC)c2)CC(=O)N1 2349526 XTKUCFXHGFYRCW-JTQLQIEISA-N 441.303 2.798 50 40 IFGB CCOc1cc(/C=N/NC(=O)CCCc2ccc(OC)cc2C)ccc1OCC(N)=O 4544712 HBGNFFQVBQZMFE-AFUMVMLFSA-N 427.501 2.739 50 40 IFGB Cc1cccc[n+]1[C@@H]1[C@@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C([C-](C#N)C#N)N[C@]1(O)C1CC1 100023562 VPFRCQCGNFASQJ-QTJGBDASSA-N 440.463 2.617 50 40 IFGB COc1ccccc1OCCCOc1cccc(/C=N/NC(=O)Cc2nnc(N)s2)c1 9113053 ZFHRVUIFOZHDKW-OEAKJJBVSA-N 441.513 2.670 50 40 IFGB N#C/C(=C/c1ccc(OCC(=O)Nc2ccccc2)c(Br)c1)C(=O)NC(N)=O 409250813 YGMFLZGEICBBSG-JYRVWZFOSA-N 443.257 2.568 50 40 IFGB CCOC(=O)[C@@H]1C(=O)NC(SC)=C(C#N)[C@@H]1c1ccccc1I 726117 CRBJIUSMKAIHOA-STQMWFEESA-N 442.278 2.782 50 40 IFGB Cc1c(C(=O)NNC(=O)c2cccc(I)c2)cccc1[N+](=O)[O-] 13897390 PFYGFYZDHXAYOR-UHFFFAOYSA-N 425.182 2.583 50 40 IFGB O=C(CCCSCCCC(=O)N/N=C\c1ccccc1O)N/N=C\c1ccccc1O 104342008 MWGPMYRFUXZJAS-MPKYGIEOSA-N 442.541 2.992 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2ccc(Cl)c(Cl)c2)S(C)(=O)=O)c1O 408924673 LGIDBHAXHHABED-AWQFTUOYSA-N 446.312 2.624 50 40 IFGB COc1cc(/C=C(/C#N)C(=O)NC(N)=O)cc(Cl)c1OCc1ccc([N+](=O)[O-])cc1 409221556 RXLFVPVNEOVWOW-MLPAPPSSSA-N 430.804 2.938 50 40 IFGB O=C(N/N=C/c1ccc(OS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1)c1ccncc1 13943957 WBICOCAUGAPZGM-FYJGNVAPSA-N 426.410 2.521 50 40 IFGB CCOC(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(OCC)cc2)c1 21772292 IGVKUBQQIMQNKK-UHFFFAOYSA-N 441.893 2.930 50 40 IFGB COC(=O)COc1ccc(/C=N/NC(=O)c2c(C)nc3ccc(Br)cn23)cc1 58872860 ORXJJVSBLHBZFF-ZVBGSRNCSA-N 445.273 2.721 50 40 IFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1cc(OC)c(OC)cc1[N+](=O)[O-])c1ccccc1 408982776 ZBMFYXIWONXVKG-QLPFJNHISA-N 444.444 2.940 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)c(C)c1 408987611 FYISOAUSMLYAGD-KWCFBIRBSA-N 435.484 2.715 50 40 IFGB Cc1ccc(NC(=O)C(=O)N/N=C/c2ccccc2OCC(=O)N2CCCC2)cc1Cl 409159691 WHQADIUNQKXMGM-ZMOGYAJESA-N 442.903 2.738 50 40 IFGB C/C(=N\NC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cc2ccccc2o1 12561267 OZTFJNMWRMOOMF-PXLXIMEGSA-N 427.482 2.608 50 40 IFGB O=C(N/N=C1/C(=O)N(CCc2ccccc2)c2ccccc21)[C@@H]1COc2ccccc2O1 13596521 PHWOUAMHAIOCET-WWCBRRATSA-N 427.460 2.936 50 40 IFGB COc1cc(C(=O)NNC(=O)[C@H](NC(=O)c2cccs2)C(C)C)ccc1OC(C)C 22978875 OXDMQIDYDGYKLN-GOSISDBHSA-N 433.530 2.760 50 40 IFGB CCCCCn1nc(C(=O)NNC(=O)c2ccc(N(C)C)c(F)c2)c2ccccc2c1=O 58023313 KRVGLOCMXFYICK-UHFFFAOYSA-N 439.491 2.867 50 40 IFGB CCOc1cc(/C=C(/C#N)C(=O)N(C)C)cc(I)c1OCC#N 59334705 QPDDXCKIWFKMMJ-GHXNOFRVSA-N 425.226 2.587 50 40 IFGB COc1ccc(N2C[C@@H](C(=O)N/N=C\c3cc(Br)ccc3O)CC2=O)cc1 409164622 LDDAWZMOESHKIG-GMECJLQCSA-N 432.274 2.667 50 40 IFGB CCCOc1ccc(/C=N/NC(=O)Cn2cnc3sc(CC)cc3c2=O)cc1OC 1784404 VIQVOAWCFJPEGY-FOKLQQMPSA-N 428.514 2.968 50 40 IFGB COc1ccccc1C(=O)NCC(=O)N/N=C/c1ccc(OC(=O)/C=C/c2ccco2)cc1 1877390 QIEUAFBZQQSFCH-DUVNXGBBSA-N 447.447 2.787 50 40 IFGB O=C(N[C@H](C(=O)N/N=C/c1ccc(F)cc1)c1n[nH]c(=O)c2ccccc12)c1ccccc1 9065391 HCQJTQIZMJVMMK-WMPMWDHYSA-N 443.438 2.684 50 40 IFGB O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)c1n[nH]c(=O)c2ccccc12 9378039 JWGMTLWFQXGROJ-UHFFFAOYSA-N 435.267 2.850 50 40 IFGB Cc1ccccc1-n1c(SCC(=O)NNC(=O)c2ccco2)nnc1-c1cccnc1 35316157 QXCRKENSZHYCTR-UHFFFAOYSA-N 434.481 2.784 50 40 IFGB CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)C(=O)N/N=C/c1ccc([N+](=O)[O-])o1 409002644 OWERWHNRPSWRFJ-XYHOIZSOSA-N 432.433 2.748 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1OCC(=O)Nc1cc(C)ccc1C 409157178 QEQKLNJXDOGLHB-BRJLIKDPSA-N 442.903 2.727 50 40 IFGB O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NNC(=O)c1ccncc1 1764182 MWIWYPYHDXADGK-KAMYIIQDSA-N 432.552 2.586 50 40 IFGB CCOc1ccccc1NC(=O)C(=O)N/N=C/c1ccc(I)cc1 3127129 SRYPLSHRTJYCRL-YBFXNURJSA-N 437.237 2.779 50 40 IFGB O=C(N/N=C/[C@@H]1C(=O)NC(=O)N([C@@H]2C[C@H]3CC[C@H]2C3)C1=O)c1ccc(Cl)cc1Cl 408536891 TUOUUHNFVIUNFM-GQWNPXKYSA-N 437.283 2.592 50 40 IFGB O=C1N[C@@H](CSSC[C@@H]2NC(=O)N(c3ccccc3)C2=O)C(=O)N1c1ccccc1 1598777 LWWOTFAGDSYYIA-HOTGVXAUSA-N 442.522 2.618 50 40 IFGB CCn1c(NNC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])nc2ccccc2c1=O 11165267 SPYZAIVYYMMSIS-UHFFFAOYSA-N 449.370 2.692 50 40 IFGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)cc1 20209316 KGSDQDKGQWEVFT-LPYMAVHISA-N 436.921 2.605 50 40 IFGB Cc1cc2occ(CC(=O)NNC(=O)CCN3CCN(Cc4ccccc4)CC3)c2cc1C 21763120 PGZAWVFACWZZEH-UHFFFAOYSA-N 448.567 2.947 50 40 IFGB COc1ccc(-n2c(SCC(=O)/C(C#N)=C(/C)N)nc3ccccc3c2=O)cc1OC 104719614 MUIONQHLCANOCT-SSZFMOIBSA-N 436.493 2.820 50 40 IFGB COc1cccc(/C=N/NC(=O)C(=O)NC[C@H]2CCCO2)c1OCc1ccccc1Cl 408610305 NJZDCGNULYXJAX-YTIGJDNKSA-N 445.903 2.673 50 40 IFGB CN(C)c1ccc(/C=N/NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)cc1 408876682 PUERDHQSNRWETB-VZMFNRANSA-N 434.949 2.709 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2Cl)cc1 409257373 QMSMUJVIWOOEQD-CHOFVFFHSA-N 430.892 2.722 50 40 IFGB COC(=O)c1ccc([C@@H]2CC(=O)NC(SCC(=O)N3CCCC[C@H]3C)=C2C#N)cc1 409328174 ZVOKAQIDUWZPNS-PBHICJAKSA-N 427.526 2.946 50 40 IFGB COCCNC(=O)Cn1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c2ccccc21 6077164 MZSBSLZVQSEQLD-JOCHJYFZSA-N 448.523 2.855 50 40 IFGB COc1ccc(NC(=O)C(=O)N/N=C/c2cccc(OCC(=O)Nc3ccccc3)c2)cc1 15014043 VSCZEMGQNQHNBR-MFKUBSTISA-N 446.463 2.802 50 40 IFGB CCCn1nc(C)c2c(C(=O)N/N=C(\C)c3ccnn3C)cc(-c3cnn(C)c3C)nc21 17098465 SZOWFDBMHZNRNH-LGJNPRDNSA-N 433.520 2.746 50 40 IFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccc(Br)cc1 17330678 RZNUAMUJJXQRQT-GFCCVEGCSA-N 436.693 2.917 50 40 IFGB O=C(COc1ccccc1/C=N/NC(=O)C(=O)Nc1ccccc1F)NCc1ccccc1 409266570 PTYBAXPOISWJPE-JFLMPSFJSA-N 448.454 2.610 50 40 IFGB CCOC(=O)CC(=O)CSC1=C(C#N)[C@H](c2ccc(C)cc2)[C@@H](C(=O)OC)C(O)=N1 2226903 JNPAAZLQVRBIHF-ZWKOTPCHSA-N 430.482 2.829 50 40 IFGB CSc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2-c2ccc(C)cc2)cc1 2335307 GEGWFIMVPVBABN-SSDVNMTOSA-N 434.485 2.694 50 40 IFGB Cc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CSc2ccc(C)cc2)cc1 2451831 SUOHQLHVUCBDDI-FOKLQQMPSA-N 448.512 2.906 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C(=O)OCC)cc2)cc1OC 59434167 SNEJNVIDTYXABK-OEAKJJBVSA-N 425.441 2.526 50 40 IFGB O=C(CCC(=O)OCC(=O)Nc1ccc(Cl)cc1Cl)NNC(=O)c1ccccc1 408644569 GQCNYCPVNJUYRI-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB CCCN1C(=O)/C(=N\NC(=O)Cn2cnc3sc4c(c3c2=O)CCCC4)c2ccccc21 958324 BYLCPSFEZUKBHN-QOMWVZHYSA-N 449.536 2.614 50 40 IFGB Cc1ccc(NC(=O)COc2ccccc2/C=N/NC(=O)C(=O)NCC(C)C)cc1Cl 409165287 VYKDLWILMSVVQX-BRJLIKDPSA-N 444.919 2.888 50 40 IFGB CCCOc1ccc(-c2c(C(=O)N/N=C/c3ccc(C)cc3)nnn2-c2nonc2N)cc1 2347343 IFDFYQVTISHZLD-ZMOGYAJESA-N 446.471 2.761 50 40 IFGB CCOc1cc(/C=N/NC(=O)C(=O)Nc2ccccc2OC)cc(Br)c1O 13922265 VWYUTEATXNKMCB-KEBDBYFISA-N 436.262 2.651 50 40 IFGB C#CCN1C(=O)/C(=N\NC(=O)COc2c(C)cc(Br)cc2C)c2ccccc21 13942255 BTYFOOUQMDKWCL-CLCOLTQESA-N 440.297 2.945 50 40 IFGB Cc1cccc(N(CC(=O)N/N=C/c2cc(Br)c(C)o2)S(C)(=O)=O)c1 20207791 HWHJCYOFAKGLPS-GIJQJNRQSA-N 428.308 2.575 50 40 IFGB Cc1cc(C)c(S(=O)(=O)NCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)c(C)c1 33705601 VQDWUQRZSQPLNR-AWQFTUOYSA-N 438.893 2.602 50 40 IFGB O=C1OC(=O)[C@H]2[C@H]1[C@H]1C[C@H]2[C@H]2[C@H]1Sc1[nH]c(=O)sc1[C@H]2c1cc(Cl)ccc1O 100211351 VFAWHSQATVLVIT-KXYDBCRFSA-N 435.910 2.983 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1 409170181 UECDZKJZESOIKW-ZMOGYAJESA-N 430.892 2.724 50 40 IFGB Cc1cc(C)cc(C(=O)NCC(=O)NNC(=O)Cc2csc(-c3ccc(F)cc3)n2)c1 12855583 HHJXJQGQHYVSQA-UHFFFAOYSA-N 440.500 2.686 50 40 IFGB C#CCNS(=O)(=O)c1ccc(C(=O)NN(Cc2ccccc2)Cc2ccccc2)cc1 32865869 DLNRNYWXQMIMDB-UHFFFAOYSA-N 433.533 2.945 50 40 IFGB COc1cccc(/C=N/NC(=O)CSc2ccc([N+](=O)[O-])cc2)c1O[C@H](C)C(=O)O 409249191 MUOUUNFWGSFLBH-HMASQMOLSA-N 433.442 2.698 50 40 IFGB COc1ccccc1N(CC(=O)N/N=C/c1ccccc1O)S(=O)(=O)c1ccccc1 19949860 KUDNLQXWIIAPMK-HZHRSRAPSA-N 439.493 2.746 50 40 IFGB COc1cc(/C=N\NC(=O)CN2CCOCC2)cc(Cl)c1OCc1ccccc1C#N 59246745 LESFGGUPALVRAC-MXAYSNPKSA-N 442.903 2.582 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccc(C#N)cc2F)cc(I)c1O 408967774 SAJPYNDINDRKMJ-DNTJNYDQSA-N 439.184 2.780 50 40 IFGB COc1ccc(/C=N/NC(=O)CNc2ccc(I)cc2)cc1OC 1501015 SYITUZBWRFVTKB-KEBDBYFISA-N 439.253 2.871 50 40 IFGB COc1ccc(CCNC(=S)N/C=C(\C#N)S(=O)(=O)c2ccc(C)cc2)cc1OC 1637398 SNCNDCADSVQUBV-NBVRZTHBSA-N 445.566 2.858 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2)c(Cl)c1 409257047 REVXLDMPQJQYOB-XMTZNVEYSA-N 430.892 2.722 50 40 IFGB O=C1N[C@H](CSSC[C@H]2NC(=O)N(c3ccccc3)C2=O)C(=O)N1c1ccccc1 1598778 LWWOTFAGDSYYIA-HZPDHXFCSA-N 442.522 2.618 50 40 IFGB COCCCNC(=O)/C(C#N)=C/c1c(Oc2ccccc2F)nc2c(C)cccn2c1=O 2429438 WWIFDKGADGIZNK-DTQAZKPQSA-N 436.443 2.994 50 40 IFGB CC(C)(C)c1ccc(/C=N/NC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 3246444 HFBJAOATLPMAGZ-XQNSMLJCSA-N 429.542 2.769 50 40 IFGB O=C(CCC(=O)Nc1ccccc1[N+](=O)[O-])N/N=C/c1coc2ccc(F)cc2c1=O 28294409 YIWDHNHQXPWJGN-LSHDLFTRSA-N 426.360 2.709 50 40 IFGB COc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)COc1ccc(Br)cc1OC 1054867 CPVDICJIQZLZBJ-DJKKODMXSA-N 438.234 2.904 50 40 IFGB COc1cc2c3c(c1)[C@@]1(C(=O)N3C(C)(C)C=C2C)C(C#N)=C(N)Oc2cc(C)oc(=O)c21 2423880 DJNLPGCLERZLKF-XMMPIXPASA-N 431.448 2.871 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2ccc(Br)cc2)S(C)(=O)=O)c(C)c1 408785946 CFYXSBGFRNJHMN-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB CCOC(=O)COc1ccc(/C=N\NC(=O)COc2cccc3cccnc23)cc1OC 409015691 DGFULWZXGBDCLE-MXAYSNPKSA-N 437.452 2.714 50 40 IFGB CCOc1ccc(-n2nc(C(=O)N/N=C\c3ccc(N(C)C)cc3)c(C)c(C#N)c2=O)cc1 409062055 MRBQUTPNWHCNQF-YSMPRRRNSA-N 444.495 2.641 50 40 IFGB COc1cc(/C=N/NC(=O)OC(C)(C)C)cc(Br)c1OCC(=O)N(C)C 2657767 NPLFGTJFYDCQHV-DJKKODMXSA-N 430.299 2.783 50 40 IFGB COc1ccccc1NC(=O)N/N=C/c1cn(CC(=O)N2CCOCC2)c2ccccc12 9265084 CNZRJTOKVDCLEB-ZVHZXABRSA-N 435.484 2.664 50 40 IFGB O=C(N/N=C/C1=C(N2CCOCC2)/C(=C/c2ccc([N+](=O)[O-])cc2)CC1)c1cnccn1 15906714 QWMBKVBWYCJTQG-DONFXTHASA-N 434.456 2.564 50 40 IFGB O=C(NNC(=O)c1cc2ccccc2oc1=O)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1 16839370 DSOVEJXBDDGOSO-UHFFFAOYSA-N 449.850 2.731 50 40 IFGB O=C(N[C@H](C(=O)N/N=C\c1ccccc1F)c1n[nH]c(=O)c2ccccc12)c1ccccc1 33929461 LNTNZPINWCEWQB-IDEIYSCTSA-N 443.438 2.684 50 40 IFGB COc1cc(/C=C(/C#N)C(N)=S)ccc1OS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 35330498 IGTJMZJMQQDNLI-QPEQYQDCSA-N 433.467 2.873 50 40 IFGB CC(C)NC(=O)COc1ccc(/C=N/NC(=O)C(=O)Nc2cccc3ccccc23)cc1 58882007 AOVVEGKSRGSZTK-AFUMVMLFSA-N 432.480 2.832 50 40 IFGB Cc1ccccc1Nc1ccc(C(=O)O)cc1/C=N/NC(=O)C(=O)NCCCOC(C)C 408707902 MMAQGDFFBLELFK-AFUMVMLFSA-N 440.500 2.818 50 40 IFGB O=C(NN=Cc1ccc(-c2ccc3c(c2)C(=O)NC3=O)o1)c1cncc(Br)c1 254590862 ZTDLUOHQHYEKHF-UHFFFAOYSA-N 439.225 2.752 50 40 IFGB O=C(CN1C(=O)[C@H]2C[C@H](Br)[C@@H](Br)C[C@H]2C1=O)Nc1ccccc1 408673349 RGSNOYYCDPZIFD-RNJOBUHISA-N 444.123 2.547 50 40 IFGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)CN(c2cc(C)ccc2C)S(C)(=O)=O)c1 20208357 RSTIMKQMFOOCTK-XQNSMLJCSA-N 430.530 2.568 50 40 IFGB Cc1oc(/C=N/NC(=O)[C@@H](C)N(c2ccccc2)S(C)(=O)=O)cc1Br 408905872 AFZGVMHMBOCXFO-VDCVXVNISA-N 428.308 2.655 50 40 IFGB O=C(N/N=C/c1ccc([N+](=O)[O-])o1)/C(=C\c1ccc2c(c1)OCO2)NC(=O)c1ccccc1 3144605 INQTXQHAHWPJQC-LHDDCWEUSA-N 448.391 2.838 50 40 IFGB Cc1ccc(C)c(NC(=O)COc2cccc(/C=N/NC(=O)C(=O)NCc3ccco3)c2)c1 409267396 ULCGEHUDZIUNLN-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB C[C@@H](C(=O)N/N=C/c1cccc([N+](=O)[O-])c1)n1cnc2sc3c(c2c1=O)CCCC3 958171 RSBNSCLCUMOCQI-PGCIDKTFSA-N 425.470 2.956 50 40 IFGB CCOC(=O)CC(=O)CSC1=C(C#N)[C@@H](c2ccc(C)cc2)[C@@H](C(=O)OC)C(O)=N1 2226899 JNPAAZLQVRBIHF-QZTJIDSGSA-N 430.482 2.829 50 40 IFGB O=C(N/N=C/c1ccc(O)c(O)c1)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1 15018473 GHKGZSGCIGMHAR-IRVJDQMQSA-N 446.419 2.927 50 40 IFGB COc1ccc(S(=O)(=O)N2CCC(C(=O)N/N=C/c3ccc(C)cc3)CC2)cc1OC 408973622 ZQJYQEBBUCYCKC-HZHRSRAPSA-N 445.541 2.563 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(Cl)cc2)cc1 409150313 BIRSMRXZALNPJZ-ZMOGYAJESA-N 430.892 2.724 50 40 IFGB O=C(N/N=C/c1cccnc1)c1nn(Cc2ccc(Br)cc2)cc1[N+](=O)[O-] 1091956 DLEITRIWDBUIMY-AWQFTUOYSA-N 429.234 2.761 50 40 IFGB CC(C)(C)c1nnc2sc(SCC(=O)C(C#N)=C3Nc4ccccc4N3)nn2c1=O 4015100 IQPQLGRQMBFECJ-UHFFFAOYSA-N 439.526 2.777 50 40 IFGB O=C(CCN1C(=O)/C(=C\c2ccco2)SC1=S)NNC(=O)c1ccc(Cl)cc1 8820287 QKIIRQUANIITAW-GXDHUFHOSA-N 435.914 2.986 50 40 IFGB O=C(COc1ccc(Cl)cc1)NNC(=O)c1cccn(Cc2ccc(F)cc2)c1=O 23109270 XJYFTDPZWDQDFL-UHFFFAOYSA-N 429.835 2.529 50 40 IFGB COCCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1OCc1c(F)cccc1Cl 408603202 FVQJKLUPWREERL-YSURURNPSA-N 442.274 2.924 50 40 IFGB Cc1ccccc1S(=O)(=O)N1CCC2(CC1)CO[C@H](CI)C2 2056225749 AQFYXZPRCOVXCU-AWEZNQCLSA-N 435.327 2.990 50 40 IFGB Cn1cc(I)c(C(=O)N/N=C/c2ccc(Br)cc2)n1 825420 CYAXMYMQZMHJLK-GIDUJCDVSA-N 433.047 2.551 50 40 IFGB O=C(N/N=C/c1ccncc1)c1nn(Cc2ccc(Br)cc2)cc1[N+](=O)[O-] 1091903 HBOLGCAIVSODCH-AWQFTUOYSA-N 429.234 2.761 50 40 IFGB CCCCOc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2-c2ccccc2)cc1 2356456 QJBVAEPYEKRAGP-ZVHZXABRSA-N 446.471 2.842 50 40 IFGB O=C(Cc1ccccc1Cl)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 9634911 PMGHDLDLJPQESR-UHFFFAOYSA-N 435.933 2.518 50 40 IFGB Cc1ccccc1NC(=O)COc1cccc(/C=N/NC(=O)C(=O)NCc2ccccc2)c1 409153672 IQXBFNMCYLWASA-JVWAILMASA-N 444.491 2.779 50 40 IFGB COc1ccc(NC(=O)COc2ccccc2[C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1 9715950 IUCMETWJVUPPGI-NRFANRHFSA-N 431.452 2.962 50 40 IFGB Cc1c(/N=C2/NC[C@H](CI)S2)c(=O)n(-c2ccccc2)n1C 15228010 ZVEMEJOQVQVARJ-LBPRGKRZSA-N 428.299 2.612 50 40 IFGB O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N/N=C/c1ccc(OC(=O)c2ccccc2)cc1 2676420 XSXYBJWLLMNILD-AFUMVMLFSA-N 446.419 2.694 50 40 IFGB COc1cc([N+](=O)[O-])cc(/C=N\NC(=O)[C@H]2COc3ccc(C(C)(C)C)cc3O2)c1O 13898128 QGYMDYJYFZWXLE-CIQOZVAXSA-N 429.429 2.897 50 40 IFGB CCCN1C(=O)/C(=N\NC(=O)[C@H]2COc3ccccc3O2)c2cc(Br)ccc21 9358527 FCSWSAZZLFDENR-RTAFMGCNSA-N 444.285 2.866 50 40 IFGB O=C(NNC(=O)c1ccccc1)C1=NO[C@@H](CNc2ncc(C(F)(F)F)cc2Cl)C1 13395834 IJEMVEAWABCVAM-GFCCVEGCSA-N 441.797 2.772 50 40 IFGB CN(C)c1cccc(C(=O)NNC(=O)CSc2nncn2-c2cccc(Cl)c2)c1 26044746 TWVDQNAIPXUMTN-UHFFFAOYSA-N 430.921 2.540 50 40 IFGB COc1ccccc1/C=N\NC(=O)c1cccc(C(=O)N/N=C\c2ccccc2OC)n1 33758212 DINGXHCDCNNHOD-MQDDAKQZSA-N 431.452 2.627 50 40 IFGB CCN1C(=O)/C(=N/NC(=O)[C@@H](C)n2cnc3sc4c(c3c2=O)CCCC4)c2ccccc21 103462138 IUIZOGUXUIECFI-WRHVEKNASA-N 449.536 2.785 50 40 IFGB N#C/C(=C/c1ccc(OCc2ccc(C(=O)O)cc2)c(Br)c1)C(=O)NC(N)=O 409245349 RHDPTWHJQZCDOY-AUWJEWJLSA-N 444.241 2.828 50 40 IFGB CCOc1cc(/C=N/NC(=O)COc2ccc([N+](=O)[O-])cc2Br)ccc1O 9057129 XGEQWLIVPPEGTD-DJKKODMXSA-N 438.234 2.991 50 40 IFGB COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)C2CCC2)ccc1Cl 12526238 DOXYAOZZZUTJDI-UHFFFAOYSA-N 437.905 2.711 50 40 IFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@H]1CS[C@@]2(c3ccccc3)CCC(=O)N12 22965645 CWHLGTJRJLEQIB-WILHCJHDSA-N 439.581 2.941 50 40 IFGB COc1ccccc1NC(=O)c1nc(NNC(=O)COc2ccccc2)ncc1Cl 27987612 YEJDZMAPADHCRB-UHFFFAOYSA-N 427.848 2.913 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccncc2)c2ccccc2F)cc1 58925189 AHZJRDZQMQECCV-ZVHZXABRSA-N 426.473 2.875 50 40 IFGB O=C(O)c1ccccc1N1C(=O)[C@H]2C[C@@H](Br)[C@H](Br)C[C@H]2C1=O 98045418 MRHFWRGYDKVVEI-LMLFDSFASA-N 431.080 2.811 50 40 IFGB CCOc1cccc(/C=N/NC(=O)c2cc(Br)ccc2O)c1OCC(=O)O 409218506 VTPABQIAIDFTAC-AWQFTUOYSA-N 437.246 2.781 50 40 IFGB O=C1c2ccccc2S(=O)(=O)N1C[C@@H](Br)[C@H](Br)CCl 4107646 WCNUPMQBUXFKQT-RKDXNWHRSA-N 431.533 2.597 50 40 IFGB O=C(N/N=C/c1ccc(-c2ccc3c(c2)C(=O)NC3=O)o1)c1cncc(Br)c1 16431463 ZTDLUOHQHYEKHF-LSFURLLWSA-N 439.225 2.752 50 40 IFGB C[C@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(OCC(=O)NC[C@H]2CCCO2)cc1 28214130 JZVJKAAQCOKHQV-LPSMITJESA-N 441.553 2.992 50 40 IFGB CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1C[C@H]1c1cccc(Br)c1 96003910 WUMPPMSTUDIRKH-KBPBESRZSA-N 426.311 2.615 50 40 IFGB O=C(O)c1ccccc1N1C(=O)[C@H]2[C@@H]3C[C@@H]([C@@H](Br)[C@H]3Br)[C@@H]2C1=O 4157150 RVSOKZITIXHEOI-SOVHRMDPSA-N 443.091 2.667 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2cccc(C(F)(F)F)c2)S(C)(=O)=O)c1 20211050 WOEUKOYSCQOYNY-SSDVNMTOSA-N 429.420 2.630 50 40 IFGB COc1cc(/C=N/NC(N)=O)cc(I)c1OCc1ccccc1 59535653 NUFOOMUPIZHSAQ-DJKKODMXSA-N 425.226 2.881 50 40 IFGB CCOC(=O)COc1ccc(/C=N/NC(=O)C[C@H](NC(=O)OCC)c2ccccc2)cc1 408978564 JDEBVCWFLGBREP-UDIPQKBFSA-N 441.484 2.956 50 40 IFGB COC(=O)[C@@H]1C(=O)NC(SCC(=O)Nc2ccc(F)cc2)=C(C#N)[C@@H]1c1ccccc1 409138820 IMXVROGGPROMLA-OALUTQOASA-N 439.468 2.935 50 40 IFGB CC[C@@H](NC(=O)c1ccccc1NC(=O)c1ccco1)C(=O)NNC(=O)c1ccccc1 3146456 UYZKYRPJXZGDFP-QGZVFWFLSA-N 434.452 2.502 50 40 IFGB CC(C)c1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(Br)cc1 9125067 MTBMVKHFQIIYFE-UHFFFAOYSA-N 427.320 2.961 50 40 IFGB Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2sc3ccccc3c2C)cc1 14197096 KFIFCAMXIGESQI-UHFFFAOYSA-N 431.539 2.600 50 40 IFGB COc1ccccc1NC(=O)N/N=C\c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 408967497 SOWMXFBZWCBTGD-QRVIBDJDSA-N 441.513 2.906 50 40 IFGB COC(=O)[C@H]1C(=O)NC(SCC(=O)Nc2ccccc2F)=C(C#N)[C@@H]1c1ccccc1 409129969 SVKNPLMRFXRZNE-RBUKOAKNSA-N 439.468 2.935 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1OCC(=O)Nc1cc(C)ccc1C 409161012 SHUXVGYVDXMXNM-BRJLIKDPSA-N 444.919 2.951 50 40 IFGB COC(=O)c1ccc([C@H]2CC(=O)NC(SCC(=O)N3CCCCCC3)=C2C#N)cc1 409320976 RHSUUSNEBQYQGY-QGZVFWFLSA-N 427.526 2.948 50 40 IFGB COc1ccc(/C=N/NC(=O)COc2ccc([N+](=O)[O-])cc2Br)cc1OC 889172 NYBLKVVIONNWCW-DJKKODMXSA-N 438.234 2.904 50 40 IFGB O=C(CN(c1ccccc1)S(=O)(=O)c1ccccc1)N/N=C/c1ccccc1C(=O)O 19947821 DZHATWQHBVARNO-HZHRSRAPSA-N 437.477 2.730 50 40 IFGB C=CCOC(=O)C1=C(C)NC(SCC(=O)NC(=O)OCC)=C(C#N)[C@H]1c1cccnc1 100830487 FXICRDCGAVJNJN-GOSISDBHSA-N 442.497 2.513 50 40 IFGB COCCCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2ccc(Br)cc2)c1C 408869790 UDQVUZVYBHINMZ-QRVIBDJDSA-N 449.349 2.850 50 40 IFGB NC(=O)COc1ccc(/C=N/NC(=O)C[C@H](NC(=O)c2ccccc2)c2ccccc2)cc1 408981169 UZPCZCYWEKRUQX-PSZYXBCASA-N 444.491 2.562 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2c(C)cc(C)cc2C)c1 409167032 GQDOAJYMJACMHP-VULFUBBASA-N 438.528 2.996 50 40 IFGB Cc1cc2c(c(=O)n1CCN(C)C)[C@@H](c1cccc(Br)c1)C(C#N)=C(N)O2 2247687 JISJVYNLYPMBIN-KRWDZBQOSA-N 429.318 2.699 50 40 IFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccc(Br)cc1 17330677 RZNUAMUJJXQRQT-LBPRGKRZSA-N 436.693 2.917 50 40 IFGB Cc1ccc(C)c(N(CC(=O)N/N=C/c2ccc(OC3CSC3)cc2)S(C)(=O)=O)c1 20208259 ZAOJEUAPEOVRNP-SSDVNMTOSA-N 447.582 2.714 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(C2=NS(=O)(=O)c3ccccc32)c2ccccc2)cc1 8683224 GLKFNAUHVYRMSI-BUVRLJJBSA-N 448.504 2.801 50 40 IFGB CCN(CC)c1ccc(N2/C(=N\C(=O)CCl)S[C@H]3CS(=O)(=O)C[C@H]32)c(C)c1 101319370 JZBXTGOQOMVTPL-FTFAEBDGSA-N 429.995 2.681 50 40 IFGB O=C(COC(=O)CCC(=O)Nc1ccccc1Cl)NNC(=O)c1ccccc1Cl 408663193 LYKSFMFTUCQLHT-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccncc2)c2ccc(F)cc2)cc1 408861177 OUCSOLKEBHXOQO-ZVHZXABRSA-N 426.473 2.875 50 40 IFGB O=C(NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)c1cccc(Cl)c1 3390945 HSCWRASALSPFBY-UHFFFAOYSA-N 442.324 2.853 50 40 IFGB C=CCNC(=O)/C(C#N)=C/c1c(NCc2ccc3c(c2)OCO3)nc2c(C)cccn2c1=O 16733916 JZXDVKGWLIZGEP-GZTJUZNOSA-N 443.463 2.553 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1OCC(=O)Nc1ccc(C)c(C)c1 408608977 IRMOQYLLUOZDMX-BRJLIKDPSA-N 444.919 2.951 50 40 IFGB Cc1ccc(NC(=O)COc2cccc(/C=N/NC(=O)C(=O)NCc3ccco3)c2)cc1C 409258349 URDVDMBRGCZWKK-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NNS(=O)(=O)c1ccccc1[N+](=O)[O-] 1083974 VHKMKZDZCAOLID-VIFPVBQESA-N 434.257 2.679 50 40 IFGB Cc1ccc(OCC(=O)NNC(=O)CSc2nnc3cc(C)c4ccccc4n23)cc1 2072198 BPCCTLYOXNXZGH-UHFFFAOYSA-N 435.509 2.818 50 40 IFGB CN(C)c1ccc([P@@](=O)(CC(=O)N/N=C/c2ccc(C#N)cc2)OCCCl)cc1 9087005 GAIZIBJVBYJOQI-WNVMKCEGSA-N 432.848 2.933 50 40 IFGB CCOc1cccc(/C(C)=N/NC(=O)c2nnn(-c3nonc3N)c2-c2cccs2)c1 9235388 CBAADMUGMZQQIW-SRZZPIQSSA-N 438.473 2.514 50 40 IFGB CC(C)CCN1C(=O)c2ccc(C(=O)NNC(=O)COc3ccc(Cl)cc3)cc2C1=O 9255378 QRTMXKGOGYXRAI-UHFFFAOYSA-N 443.887 2.822 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2ccccc2OCC)S(C)(=O)=O)cc1 20210470 XSWWOQPAPFCYPB-PXLXIMEGSA-N 431.514 2.566 50 40 IFGB O=C(COC(=O)[C@H]1[C@H]2C(=O)O[C@@H]3[C@@H](Br)[C@@H]1C[C@@H]32)Nc1cccc2ccccc12 408679439 FCXLZOKLUDIBRL-DJQNJWNESA-N 444.281 2.893 50 40 IFGB CCc1ccc(NC(=O)COc2ccccc2/C=N/NC(=O)C(=O)NCc2ccco2)cc1 409261241 BHGOBNKZQTTXGK-VULFUBBASA-N 448.479 2.626 50 40 IFGB Cc1nc(C)c(C(=O)N/N=C/c2cccc(O)c2)cc1C(=O)N/N=C/c1cccc(O)c1 820810 PPDCHNJMROZFGE-DWGHPKEWSA-N 431.452 2.637 50 40 IFGB CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(C)n(C[C@@H]4CCCO4)c(=O)c32)cc1OC 1264781 FKCFWYNHXGOBNA-KKSFZXQISA-N 437.496 2.961 50 40 IFGB O=C(CCN1C(=O)/C(=C\c2ccccc2F)SC1=S)NNC(=O)c1ccccc1 12032348 ISNONFPVSBAUMN-FOWTUZBSSA-N 429.498 2.878 50 40 IFGB Cc1ccc(C)c(N(CC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)S(C)(=O)=O)c1 20208341 WNDZSQRBFJEUHF-KEBDBYFISA-N 438.893 2.781 50 40 IFGB Cc1nc(-c2ccc(F)cc2)sc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1 21967503 ARVJTPRJARACKP-UHFFFAOYSA-N 447.517 2.626 50 40 IFGB CCN1C(=O)C[C@H](C(=O)Nc2ccc(Cl)cc2)S/C1=N\NC(=O)c1ccncc1 33475744 DLQJPPOEDCGTQN-ZLVLUESYSA-N 431.905 2.729 50 40 IFGB O=C(Cc1ccc2c(c1)OCCO2)N/N=C\c1cc(Br)cc([N+](=O)[O-])c1O 409366093 SOYAOIYWYGMQTK-OCKHKDLRSA-N 436.218 2.527 50 40 IFGB CCN(CC)c1ccc(C(=O)NNC(=O)c2ccccc2SCC(=O)NC2CC2)cc1 12593381 LUDYFPFTEHYSBM-UHFFFAOYSA-N 440.569 2.978 50 40 IFGB O=NN(CC(=O)N/N=C\c1ccc(Cl)cc1)CC(=O)N/N=C\c1ccc(Cl)cc1 31623548 WHUAAKATOFVDKO-KGIZCEIGSA-N 435.271 2.577 50 40 IFGB COc1ccc([N+](=O)[O-])cc1-c1ccc(/C=N/NC(=O)Cn2nnc(-c3ccccc3)n2)o1 408720996 HWAHHLYRIVHQDQ-WSDLNYQXSA-N 447.411 2.667 50 40 IFGB COc1ccc(C)cc1N(CC(=O)N/N=C/c1c(O)ccc2ccccc12)S(C)(=O)=O 408772956 OERNYMMJWWLGDN-YDZHTSKRSA-N 441.509 2.779 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccccc2I)ccc1OC(C)=O 668233 NKHXJKBZKBSKNM-VXLYETTFSA-N 438.221 2.989 50 40 IFGB O=C1c2ccccc2C(=O)c2cc(S(=O)(=O)NNC(=O)[C@H]3C[C@@H]3c3ccccc3)ccc21 8404729 HMROIRBPSHSLDJ-CTNGQTDRSA-N 446.484 2.575 50 40 IFGB CC/C(=N\NC(=O)C(=O)N/N=C(\CC)c1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 9056998 ZYLSOMAEBVCYOB-KSTNYAOJSA-N 440.416 2.664 50 40 IFGB C=CCOc1cccc(/C=N/NC(=O)[C@@H](C)N(c2ccc(OC)cc2)S(C)(=O)=O)c1 20214774 IEEUIUXAHRBGDL-QFNCUCFLSA-N 431.514 2.565 50 40 IFGB Cc1cc(C(F)(F)F)nc(SCC(=O)NNC(=O)COc2ccccc2Cl)n1 2341407 HECMVQUSYQDNFQ-UHFFFAOYSA-N 434.827 2.776 50 40 IFGB COc1cc(OC)cc(C(=O)N/N=C\c2ccc(OCC(=O)NCc3ccco3)cc2)c1 58882611 UDSYWXCDHIMVCK-MXAYSNPKSA-N 437.452 2.756 50 40 IFGB COc1ccc(OC)c(NC(=O)C(=O)N/N=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)c1 58914748 XNODGRLLPSUVBS-UUYOSTAYSA-N 438.396 2.961 50 40 IFGB COc1cc(N2CCOCC2)ccc1/C=N/NC(=O)CSc1ccc([N+](=O)[O-])cc1 409238958 XOBJMYLCTNGWDB-FYJGNVAPSA-N 430.486 2.682 50 40 IFGB COc1cccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1O[C@H](C)C(=O)O 409243274 ZRKDGGNSVLQKNU-OHBSIKEHSA-N 427.369 2.965 50 40 IFGB COc1cccc(/C=N/NC(=O)CSc2nnc(-c3cccc([N+](=O)[O-])c3)n2C)c1 1839366 VMWJKQFZXLAAHK-RGVLZGJSSA-N 426.458 2.641 50 40 IFGB COc1ccc(C(=O)NNC(=O)COCC(=O)N(c2ccccc2)c2ccccc2)cc1 9934479 ITJQNXNEHCRJPR-UHFFFAOYSA-N 433.464 2.838 50 40 IFGB COc1ccc([C@@H]2C(C#N)=C(SCC(N)=O)NC3=C2C(=O)CC(C)(C)C3)cc1OC 16577798 ZWKOYCQYKDGFNQ-LJQANCHMSA-N 427.526 2.987 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)COc2nc(C)cc(COC)c2C#N)cc1OCC 16689008 IJVXQZVPXBBMJE-DHRITJCHSA-N 438.484 2.901 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)[C@H]2COc3ccccc3O2)cc1)Nc1ccccc1 28214992 VVHMBSHYZCJSKP-FDCKDHBTSA-N 431.448 2.994 50 40 IFGB Cc1cc(/C=N/NC(=O)C(=O)NC[C@H]2CCCO2)c(C)n1-c1cccc(Br)c1 58912223 YSZOCUNCVLPRDM-TYLRVVQJSA-N 447.333 2.602 50 40 IFGB COc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1ccc(OCC(=O)O)c(OC)c1 408924708 NRBIVYJFRPOYHY-NTUHNPAUSA-N 427.369 2.621 50 40 IFGB O=C(O)c1ccccc1N1C(=O)[C@H]2C[C@H](Br)[C@H](Br)C[C@@H]2C1=O 4133795 MRHFWRGYDKVVEI-XWLWVQCSSA-N 431.080 2.811 50 40 IFGB COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)/C=C/c2ccco2)c1 6144563 MOKWRCIPNQNMBD-VAWYXSNFSA-N 441.465 2.563 50 40 IFGB Cc1nc2ccc(Cl)cn2c1C(=O)N/N=C/c1ccc(OCC(=O)NC(C)C)cc1 58872836 QWFJEUHRYFFBCX-AUEPDCJTSA-N 427.892 2.963 50 40 IFGB CCCOc1ccc(N2C(=O)C[C@H](NNC(=O)c3ccc(Br)cc3)C2=O)cc1 2320194 NPFTUWKENDIVFD-KRWDZBQOSA-N 446.301 2.804 50 40 IFGB O=C(N/N=C/c1ccc2c(c1)OCCO2)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 9634649 JYRXOUCJGACYGJ-MFKUBSTISA-N 440.463 2.924 50 40 IFGB Cc1nn(Cc2ccccc2)c(C)c1/C=N/NC(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1 10024594 IGRIAOLIBTVTLO-ANDSAHIGSA-N 448.483 2.725 50 40 IFGB COc1ccc(Cl)cc1N(CC(=O)N/N=C/c1ccc(Cl)cc1)S(C)(=O)=O 408769571 VRUPEOFKFLOKIY-KEBDBYFISA-N 430.313 2.918 50 40 IFGB C[C@H]1CCCN(c2ccc(C(=O)NNC(=O)COc3ccccc3F)cc2[N+](=O)[O-])C1 9910606 HWRDQHXRYWPVCN-AWEZNQCLSA-N 430.436 2.810 50 40 IFGB O=C(C[C@@H](NS(=O)(=O)c1ccccc1)c1ccc(Cl)cc1)NNC(=O)c1ccco1 12768548 OZGOEZVGKPCTKP-QGZVFWFLSA-N 447.900 2.804 50 40 IFGB O=NN(CC(=O)N/N=C/c1ccc(Cl)cc1)CC(=O)N/N=C/c1ccc(Cl)cc1 16969457 WHUAAKATOFVDKO-VGENTYGXSA-N 435.271 2.577 50 40 IFGB CC(=O)NNc1nc(C)c(C(/C=C\c2ccccc2O)=N/NC(=O)c2ccncc2)s1 17215524 HVRQPULLOZMIFZ-LQWVPYAGSA-N 436.497 2.863 50 40 IFGB CN(C)c1ccc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)cc1 59922081 HPJHJQYBIJTDGR-HZHRSRAPSA-N 448.976 2.957 50 40 IFGB N#CC1=C(N)N(N2CCOCC2)C2=C(C(=O)CCC2)[C@H]1c1cccc(Br)c1 691507 ALGQGYYHQZNSBA-SFHVURJKSA-N 429.318 2.796 50 40 IFGB O=C1c2ccccc2S(=O)(=O)N1C[C@H](Br)[C@H](Br)CCl 4107643 WCNUPMQBUXFKQT-BDAKNGLRSA-N 431.533 2.597 50 40 IFGB CC1=C(C(N)=O)[C@@H](c2ccco2)C(C#N)=C(SCC(=O)N2CCc3ccccc3C2)N1 9285004 NYVWYOMSYAHEQH-OAQYLSRUSA-N 434.521 2.779 50 40 IFGB O=C(CNC(=O)C1CCCCC1)NNC(=S)NC(=O)c1ccc(-c2ccccc2)cc1 12292014 GGETZLTZDBXGSD-UHFFFAOYSA-N 438.553 2.686 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C/c2ccc(Cl)cc2Cl)cc1 16187006 IHKVQCWXKJDAAO-KEBDBYFISA-N 430.313 2.773 50 40 IFGB COCCCNC(=O)CC(=O)N/N=C\c1cc(C)n(-c2cccc(Br)c2)c1C 58914040 AALMADRIQHRYDZ-QRVIBDJDSA-N 449.349 2.850 50 40 IFGB CCOc1ccc(NC(=O)C(=O)N/N=C/c2ccc(I)cc2)cc1 59503534 APOJCWXQYYNNCL-YBFXNURJSA-N 437.237 2.779 50 40 IFGB Cn1c(SCC(=O)N/N=C/c2ccccn2)nnc1-c1cccc(Br)c1 2319854 AEPOGFINZJIGIA-KEBDBYFISA-N 431.319 2.882 50 40 IFGB C/C(CC(=O)N[C@H](C)c1ccccc1)=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 12401925 SGCIGTVAHMFCTB-CYGNYLSHSA-N 427.417 2.805 50 40 IFGB CC(=O)N1C[C@H](C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)Oc2ccccc21 12698258 KIKFITLVPPQRPQ-GOSISDBHSA-N 427.526 2.982 50 40 IFGB C=CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc3c(s2)CCCCCC3)c1 12698782 PIGLFRDWRSWGBU-UHFFFAOYSA-N 447.582 2.946 50 40 IFGB CCCCN1C(=O)CC[C@@H](C(=O)NNC(=O)c2ccccc2O)[C@@H]1c1ccc(OC)cc1 40049162 VCIQFWFLYLEDPY-KNQAVFIVSA-N 439.512 2.942 50 40 IFGB CN1C(=O)/C(=N/NC(=O)c2ccc(NS(=O)(=O)c3cccs3)cc2)c2ccccc21 102977976 JLGFSBXAGXMCMF-DYTRJAOYSA-N 440.506 2.659 50 40 IFGB COc1ccc(OC)c(N(CC(=O)N/N=C/c2ccc(C(C)C)cc2)S(C)(=O)=O)c1 408776841 RTYKLQPJQYNUKG-LPYMAVHISA-N 433.530 2.744 50 40 IFGB COc1ccc(C(=O)NNC(=O)c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2)cc1 408838566 GEHKSSWLDMKANY-UHFFFAOYSA-N 434.408 2.931 50 40 IFGB CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@@H](NC(=O)c2ccccc2F)C(C)C)cc1 13011344 CTUAPNMMAUTBJO-YWZLYKJASA-N 445.491 2.594 50 40 IFGB Cc1cc(C)c(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NCC(C)C)cc2)c(C)c1 409171172 YLDUEHFLAIDALT-LGJNPRDNSA-N 438.528 2.852 50 40 IFGB CCOc1cc(/C=N/NC(=O)CNC(=O)c2ccc(C)cc2)cc(Br)c1O 9305438 FXNNMEAQCIKPNL-LSHDLFTRSA-N 434.290 2.742 50 40 IFGB COc1cc(OC)cc(-c2nnc(SCC(=O)NNC(=O)c3ccc(Cl)cc3)o2)c1 12170790 FCXCYCIHXDJDSL-UHFFFAOYSA-N 448.888 2.961 50 40 IFGB Cc1cc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c2cnn(Cc3cccs3)c2n1 12733839 DVDOYISIPOYGNH-UHFFFAOYSA-N 436.453 2.833 50 40 IFGB CC/C(=N\NC(=O)CN(c1ccccc1F)S(C)(=O)=O)c1ccc(OC)c(OC)c1 20211653 BHNYFNYPLPNABN-CJLVFECKSA-N 437.493 2.539 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(Cl)cc2/C=N/NC(=O)C(=O)NC(C)C)cc1C 408610656 OUDKYRVVCNWSFF-BHGWPJFGSA-N 444.919 2.949 50 40 IFGB Cc1ccccc1OCC(=O)N[C@H](CC(C)C)C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1O 408971118 MKVLEWXOWSVZPV-BYWZACNXSA-N 442.472 2.669 50 40 IFGB CCc1ccc(N(CC(=O)N/N=C/c2cc(Br)c(C)o2)S(C)(=O)=O)cc1 409026280 KWKSWVIDRJYYGE-VXLYETTFSA-N 442.335 2.829 50 40 IFGB C[C@@H]1CCc2c(sc3ncn([C@H](C)C(=O)N/N=C4\C(=O)N(C)c5ccccc54)c(=O)c23)C1 6732120 UULPLFRCUFSALN-QSEZRVNESA-N 449.536 2.641 50 40 IFGB COc1ccc(CCNC(=S)NNC(=O)CSCc2cccs2)cc1OC 14092687 GJORRCQYSYZTRC-UHFFFAOYSA-N 425.601 2.737 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2ccccc2)S(=O)(=O)c2ccccc2)c1O 19947787 HKKFTVKYWOAKPD-HZHRSRAPSA-N 439.493 2.746 50 40 IFGB Cc1cc(C)c(S(=O)(=O)NCC(=O)N/N=C/c2ccc(Br)cc2)c(C)c1 409149409 FMGPBKJTIVZTJY-KEBDBYFISA-N 438.347 2.803 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)c1 409151534 HNISPLYASVGLGD-AUEPDCJTSA-N 437.283 2.597 50 40 IFGB C[C@@H]1CCCN(c2ccc(C(=O)OCC(=O)NNC(=O)c3cccs3)cc2[N+](=O)[O-])C1 9612519 XFAUWLISBFEUMB-CYBMUJFWSA-N 446.485 2.511 50 40 IFGB Cc1cc(Cl)ccc1OCCCC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1 10869525 WTBDSNZDTNUHTF-UHFFFAOYSA-N 449.847 2.720 50 40 IFGB CC(C)n1nc(C(=O)NNC(=O)CCc2cnn(-c3ccccc3)c2)c2ccccc2c1=O 17197647 TWBSVWVSMIRHLX-UHFFFAOYSA-N 444.495 2.557 50 40 IFGB Cc1ccccc1NC(=O)[C@H]1[C@H](c2cccs2)C(C#N)=C(SCC(N)=O)N[C@@]1(C)O 19830709 XRUZMSXODHJDKY-UEXGIBASSA-N 442.566 2.660 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc2c3c(cccc13)CC2)c1ccc(F)cc1 20211796 OIMQJHZTDWEEJS-ZMOGYAJESA-N 425.485 2.994 50 40 IFGB CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(C#N)=C2C(=O)c3ccccc3C2=O)c1 6144218 NTCBUOYFOJPBIH-UHFFFAOYSA-N 439.493 2.994 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1Cl)c1ccccc1Cl 20209347 IDVKMLLISXTNEQ-DJKKODMXSA-N 445.284 2.818 50 40 IFGB Cc1ccc(C)c(N2C/C(=N\NC(=O)CC#N)[C@H](c3nc4ccccc4s3)C(=O)C2=O)c1 102915109 GAMXJKYDOOXCOF-NTRYICDMSA-N 445.504 2.999 50 40 IFGB Cc1c(C(=O)N/N=C\c2ccncc2)nn(-c2cccc(C(F)(F)F)c2)c(=O)c1C#N 409054522 BCKXUCAJWFRXCE-RAWMCFOBSA-N 426.358 2.590 50 40 IFGB Cc1cc(C)cc(N(CC(=O)N/N=C/c2ccccc2Br)S(C)(=O)=O)c1 20208591 KZZZMZMVJOKIBR-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)cc1CN1CCOCC1 20458697 AXZXXUIOFIOWHQ-OAQYLSRUSA-N 445.475 2.852 50 40 IFGB CC(C)CNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1cccc(Cl)c1 409163012 KRCPRJPOGGJONS-WYMPLXKRSA-N 430.892 2.580 50 40 IFGB CS(=O)(=O)N(CC(=O)NN=C1CCN(Cc2ccccc2)CC1)c1cccc(Cl)c1 409345281 KTRHXGQRWKOEKF-UHFFFAOYSA-N 448.976 2.874 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cc(OC)cc(OC)c3)[C@@H]2C1 6194975 GQVILTUHGBDNRJ-UXHICEINSA-N 433.468 2.586 50 40 IFGB C[C@H]1CN(C(=O)/C(C#N)=C2\N=C(NC(=O)c3ccccc3F)c3ccccc32)C[C@H](C)O1 11692120 RKRXGFBPKXTEJR-XXJQKADDSA-N 432.455 2.886 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2ccccn2)Cc2ccccc2F)cc1 15225366 NADXHNSIVGIJPT-AFUMVMLFSA-N 440.500 2.870 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc1)NC[C@@H]1CCCO1 28215164 IWUUVYJFWPURRF-GRMYTIJRSA-N 445.903 2.543 50 40 IFGB C/C(=N\NC(=O)CN(c1cccc(F)c1)S(C)(=O)=O)c1ccc(Br)cc1 409148562 ZIXQDTGZIFGCJE-UDWIEESQSA-N 442.310 2.895 50 40 IFGB O=C(CSc1nnc(Cc2ccccc2)o1)NNC(=O)c1cccc(Br)c1 849782 RHPRTPPLIXFXFH-UHFFFAOYSA-N 447.314 2.976 50 40 IFGB N#Cc1ccc(OCC(=O)NNC(=O)COc2ccc(Cl)cc2Br)cc1 8734271 AHGLQABDVYPSNQ-UHFFFAOYSA-N 438.665 2.579 50 40 IFGB CCn1c(C)nc2cc(C(=O)NNC(=O)CNC(=O)c3ccc(C(C)(C)C)cc3)ccc21 9508460 DXDYZINYAUGREM-UHFFFAOYSA-N 435.528 2.853 50 40 IFGB Cc1ccc(C)c(N(CC(=O)NN=C2CCN(C)CC2)S(=O)(=O)c2ccccc2)c1 57347682 VRRTXMIAJYCHTM-UHFFFAOYSA-N 428.558 2.697 50 40 IFGB COCCCNC(=O)CSC1=C(C#N)[C@@H](c2cccc(Br)c2)CC(=O)N1 409311812 IISLMNIOLBVQNP-CQSZACIVSA-N 438.347 2.674 50 40 IFGB COc1cc(/C=N/NC(=O)c2cccc(I)c2)ccc1OCC#N 409377844 LKZJQXVDXNKZNA-RGVLZGJSSA-N 435.221 2.966 50 40 IFGB COc1ccc(/C=C/C(=O)NCC(=O)N/N=C/c2cc(Br)ccc2OC)cc1 8801910 WLOHPFIRQKCIGH-DUDOGNRESA-N 446.301 2.746 50 40 IFGB biogenic N#CC1=C(N)Nc2nc(SCc3ccc(F)cc3)[nH]c(=O)c2[C@@]12C(=O)Nc1ccccc12 12377350 DAMPWJGWLUOYGR-QFIPXVFZSA-N 446.467 2.559 50 40 IFGB CC[C@@H](Oc1cc(Cl)ccc1Cl)C(=O)NNC(=O)[C@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O 225642020 APTZUNALKUCBEW-PDSBVLEXSA-N 427.284 2.821 50 40 IFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1cc(OC)c(OC)c(OC)c1 408910331 KAFHHECPERRYQI-DMGPTTAYSA-N 429.473 2.520 50 40 IFGB COc1cc([C@H]2[C@H](Cl)C(=O)N2NC(=O)Cc2ccccc2)cc(Br)c1O 1632078 KYUYQEKFSYROPZ-HOTGVXAUSA-N 439.693 2.928 50 40 IFGB COC(=O)COc1ccc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1OC 4209666 VPYDCJXFCROLBS-WGOQTCKBSA-N 448.475 2.633 50 40 IFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Br)cc2)C1)c1c(F)cccc1F 408615608 REQDBJZQYSUVDX-SNVBAGLBSA-N 438.228 2.541 50 40 IFGB CC(=O)NNC(=O)CSc1nnc2c3c4c(sc3nc(C3CC3)n12)C[C@@H](C)CC4 13502587 OEYQANRLKMXSKT-VIFPVBQESA-N 430.559 2.601 50 40 IFGB CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2(c3cccc(C)c3)CCC2)c1 24575043 GVWUYDXOZIUNSU-UHFFFAOYSA-N 443.569 2.908 50 40 IFGB Cc1ccc(Cl)cc1NC(=O)COC(=O)CCCC(=O)NNC(=O)c1ccccc1 408647944 VMSQSBHKXLIUML-UHFFFAOYSA-N 431.876 2.762 50 40 IFGB O=C(NNC(=O)c1ccc[n+]([O-])c1)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1 3312762 GZOPWGTVWWEXBE-UHFFFAOYSA-N 438.443 2.708 50 40 IFGB COc1cc(/C=N/NC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)ccc1O 9632699 FYXBDNYYUJOXGZ-AFUMVMLFSA-N 428.448 2.923 50 40 IFGB CCOc1ccc2ccccc2c1/C=N/NC(=O)CNC(=O)[C@@H]1COc2ccccc2O1 13764590 MLRJGNLOSKPBPM-BTSCWMHGSA-N 433.464 2.645 50 40 IFGB CN(C)c1ccc(/C=N\NC(=O)CCCCC(=O)N/N=C/c2ccc(N(C)C)cc2)cc1 31629059 LZDPNPOQTNNHAC-WTHRLWDASA-N 436.560 2.979 50 40 IFGB O=C(CCC(=O)Nc1cccc(Br)c1)N/N=C/c1cc([N+](=O)[O-])ccc1O 36020617 HATIXLAUWNRAJZ-VXLYETTFSA-N 435.234 2.932 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2ccc(Cl)c(Cl)c2)S(C)(=O)=O)c1 408922447 AYAPZQUQEVVOPJ-KEBDBYFISA-N 430.313 2.918 50 40 IFGB COc1ccccc1C(=O)NCCC(=O)NNC(=O)COc1ccccc1-c1ccccc1 9994354 VZYFIKNWUGRAKU-UHFFFAOYSA-N 447.491 2.709 50 40 IFGB C/C(=N\NC(=O)C[C@@H]1NC(Cc2ccccc2)=NNC1=O)c1ccc(Cl)cc1Cl 13739089 RTDGJNTYPFIARX-KZKMUKRCSA-N 432.311 2.868 50 40 IFGB COc1cccc(NC(=O)[C@@H](NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc2)c1 15472251 DEEDHBNQJPPHGZ-VXKWHMMOSA-N 433.464 2.836 50 40 IFGB CNC(=O)/C(C#N)=C1\S[C@@H](Cc2cccc([N+](=O)[O-])c2)C(=O)N1c1cccc(OC)c1 1858946 OCCWTEFZLLHLFR-HGBKYHTQSA-N 438.465 2.776 50 40 IFGB CCOC(=O)c1csc(N(/N=C/c2cc(OC)c(OC)c(OC)c2)C(=O)CCl)n1 8755059 GDYYEFZLCLDOAW-AWQFTUOYSA-N 441.893 2.952 50 40 IFGB O=C(CN(c1ccc(F)cc1)S(=O)(=O)c1ccccc1)N/N=C/c1ccccc1O 19950241 BMWNOWXBUFNBKZ-OEAKJJBVSA-N 427.457 2.877 50 40 IFGB COc1ccccc1N(CC(=O)N/N=C/c1cccnc1)S(=O)(=O)c1ccc(C)cc1 408911296 MTOQDTXPBVCVQZ-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB O=C(CCN1C(=O)S/C(=C\c2ccc(Cl)cc2)C1=O)NNC(=O)c1ccccc1O 1236522 SKUBMHGEEZGXNU-WJDWOHSUSA-N 445.884 2.933 50 40 IFGB COc1ccc(Oc2nc3c(C)cccn3c(=O)c2/C=C(\C#N)C(=O)N2CCOCC2)cc1 9282106 XIMIREVZGSTRCS-SAPNQHFASA-N 446.463 2.570 50 40 IFGB Cc1ccc(/C=C2/SC(=S)N(CCCC(=O)NNC(=O)c3ccncc3)C2=O)cc1 12032404 GXOOLKNNABMWJH-GHRIWEEISA-N 440.550 2.833 50 40 IFGB COc1cc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc(C)c2)ccc1OCC(N)=O 16349911 QRLCMPDIXDFNFY-QFIPXVFZSA-N 445.479 2.580 50 40 IFGB COc1cccc(/C=N\NC(=O)[C@H](C)S[C@@H](C)C(=O)N/N=C\c2cccc(OC)c2)c1 38799035 RGOGHTJKUCHEDX-JBHTYQCFSA-N 442.541 2.814 50 40 IFGB COC(=O)c1ccccc1-n1c(C)cc(/C=N\NC(=O)C(=O)Nc2ccc(OC)cc2)c1C 223151816 ZWESMOUFEYAEHF-QFEZKATASA-N 448.479 2.978 50 40 IFGB COCCNC(=O)C(=O)N/N=C/c1cc(Br)ccc1Nc1cccc(C)c1 408707271 IUDLUMZWAHARHY-WSDLNYQXSA-N 433.306 2.714 50 40 IFGB COc1ccc(COC(=O)NNC(=O)[C@H]2CS[C@H](c3ccccc3)N2C(C)=O)cc1 6001777 JULVIBILHMRRNE-UYAOXDASSA-N 429.498 2.615 50 40 IFGB O=C(CCCCl)Nc1ccc(S(=O)(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 8883061 MOJGHKPPNHVCQQ-JKSUJKDBSA-N 449.960 2.614 50 40 IFGB Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2sc3cccc(F)c3c2C)cc1 17406778 XNSXVJXULPDQKX-UHFFFAOYSA-N 449.529 2.739 50 40 IFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(Br)cc2)C1)c1ccc(Cl)cc1 60512536 ABJWNVVUDUGDQG-LBPRGKRZSA-N 436.693 2.917 50 40 IFGB CCOc1ccccc1N(CC(=O)N/N=C/c1c(O)ccc2ccccc12)S(C)(=O)=O 408777098 VKJWEMROHVERDK-OEAKJJBVSA-N 441.509 2.860 50 40 IFGB CCOc1cc(/C=N/NC(=O)CN(c2ccc(C)c(Cl)c2)S(C)(=O)=O)ccc1O 408788410 FKDWDFWRQZWVOE-SRZZPIQSSA-N 439.921 2.669 50 40 IFGB Cc1cc(C)cc(N(CC(=O)N/N=C/c2cccc(OC3CSC3)c2)S(C)(=O)=O)c1 408865111 BOTVWUCRZXMTLS-SSDVNMTOSA-N 447.582 2.714 50 40 IFGB COC(=O)c1cccc(Cn2c(Cl)c(/C=N/NC(=O)c3ccccc3O)sc2=O)c1 2212551 KFZMHDSOOXDQCT-LSHDLFTRSA-N 445.884 2.868 50 40 IFGB Cc1ccc(-c2ccsc2C(=O)NNS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)cc1 12949792 TWBGHUPARTWBDH-UHFFFAOYSA-N 443.506 2.792 50 40 IFGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)CN(c2cc(C)ccc2C)S(C)(=O)=O)cc1 20208298 NDOBRPLURLSODJ-XQNSMLJCSA-N 430.530 2.568 50 40 IFGB COc1ccc(N(CC(=O)N/N=C(\C)c2ccc(F)cc2)S(C)(=O)=O)cc1Cl 20213297 XRMQIIIPQLTDAG-CIAFOILYSA-N 427.885 2.794 50 40 IFGB O=C(NNC(=O)[C@H]1CS[C@]2(c3ccccc3)CCC(=O)N12)c1cc2c(s1)CCCC2 22968087 KVMWBDSRAGEPTD-ZHRRBRCNSA-N 441.578 2.979 50 40 IFGB COc1cc(C(=O)NNC(=O)CNC(=O)c2cc(C)oc2C)ccc1OCCC(C)C 40156783 LVHJJIRIUBGWFZ-UHFFFAOYSA-N 431.489 2.521 50 40 IFGB CCOc1cc(/C=N/NC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)ccc1OC 408762321 OBLNNRMUXWQGDE-VSIOZEBNSA-N 447.557 2.856 50 40 IFGB N#C/C(=C/c1ccc(CNC(=O)C(=O)Nc2ccccc2)o1)C(=O)NCCc1ccccc1 408821368 GRVFHPQCSIWUAQ-CYVLTUHYSA-N 442.475 2.800 50 40 IFGB COc1ccc(/C=C2\SC(=O)N(CC(=O)NN(C)c3ccccc3)C2=O)cc1OC 1470502 DHSJVQZJUWXFPW-PDGQHHTCSA-N 427.482 2.908 50 40 IFGB Cn1nc(C(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)c2ccccc2c1=O 2646106 AXGINCWHKKFJNT-UHFFFAOYSA-N 449.294 2.861 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc2c1OCCO2)c1cccc2ccccc12 16158230 UWQUBEOPDMSFJX-OEAKJJBVSA-N 439.493 2.527 50 40 IFGB CN1C(=O)/C(=N\NC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c2ccccc21 102375963 WRXIVJPXFQCIBC-UZYVYHOESA-N 440.506 2.659 50 40 IFGB CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)OC)cc2)ccc1OCC(=O)OC 408796521 YMUBYDSRVLUHRW-GZTJUZNOSA-N 438.436 2.969 50 40 IFGB CCOc1ccc(-n2nc(C(=O)N/N=C\c3ccccc3OC)c(C)c(C#N)c2=O)cc1 409053352 JCFVZSLFWJRCPE-QFEZKATASA-N 431.452 2.584 50 40 IFGB Cc1ccc(C)c(NC(=O)COC(=O)CCC(=O)NNC(=O)c2ccc(Cl)cc2)c1 408661654 GJVODFVHUASOCV-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB CCc1ccc(N(CC(=O)NN=C2CCN(Cc3ccccc3)CC2)S(C)(=O)=O)cc1 409332106 PZXOWZSLCQFXHS-UHFFFAOYSA-N 442.585 2.783 50 40 IFGB Cc1ccc(S(=O)(=O)Oc2ccc(/C=N/NC(=O)c3c(Cl)cnn3C)cc2)cc1 2100148 HEFJRHHOZHXLLO-SRZZPIQSSA-N 432.889 2.914 50 40 IFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3c2oc(CO)cc3=O)ccc1OCc1ccccc1 6906977 VKSDQJZPMKYPEW-OAQYLSRUSA-N 432.432 2.938 50 40 IFGB O=C(CSc1nnc(-c2cccs2)n1C1CC1)NNC(=O)c1cccc([N+](=O)[O-])c1 8778239 FJQZBSQVNJGUOP-UHFFFAOYSA-N 444.498 2.803 50 40 IFGB CCOc1ccc(C(=O)NNC(=O)c2cc(C(C)C)nc3c2c(C)nn3C)cc1OC 22507536 NQWSDCGYTRTVQK-UHFFFAOYSA-N 425.489 2.882 50 40 IFGB CN(CC(=O)N/N=C\c1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccc2ccccc2c1 16187515 NTPLILKNGYRQSR-BKUYFWCQSA-N 426.454 2.519 50 40 IFGB CCCOc1ccc(/C=N\NC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1OCC 39986607 PLDIMWIGRVDLEI-HAHDFKILSA-N 447.557 2.953 50 40 IFGB CCc1sc(C(=O)NNC(=O)CN(C)[C@@H](c2cccc(F)c2)c2cnn(C)c2)cc1C 72305151 FTBMCOQMKQVDMW-NRFANRHFSA-N 443.548 2.974 50 40 IFGB N#C/C(=C/c1ccc(N2CCOCC2)cc1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCO2 97990770 LHGRGIQVGWKGNB-WJDWOHSUSA-N 436.424 2.748 50 40 IFGB Cc1ccc(C(=O)N/N=C/[C@@H]2C(=O)NC(=O)N(c3cccc(C(F)(F)F)c3)C2=O)cc1 108214008 HMWISUDGULBPEP-BYXSLANXSA-N 432.358 2.629 50 40 IFGB Cc1cccc(C)c1NC(=O)CCC(=O)OCC(=O)NNC(=O)c1ccccc1Cl 408673150 ZADJGVTVQQODBK-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB COc1ccccc1/C=N/NC(=O)CN(c1cccc(C(F)(F)F)c1)S(C)(=O)=O 408771864 KSXAEKNHRIJHPW-SSDVNMTOSA-N 429.420 2.630 50 40 IFGB CCOc1ccc(/C=N/NC(=O)[C@@H](C)N(c2ccc(OCC)cc2)S(C)(=O)=O)cc1 408925220 NTDHGOXSZWGDKD-QFNCUCFLSA-N 433.530 2.789 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc(C(=O)O)cc1)c1cc(Cl)ccc1Cl 409028886 SJSHOHDQUYTZGW-AWQFTUOYSA-N 444.296 2.608 50 40 IFGB O=C(OCCCl)SC(=S)NCCNC(=S)SC(=O)OCCCl 4428882 DAZWICABWHQGLD-UHFFFAOYSA-N 425.406 2.953 50 40 IFGB CCCn1nc(C(=O)NNC(=O)c2ccc3c(c2)nc(C)n3CC)c2ccccc2c1=O 9509744 GZUYWNGRGIXQIX-UHFFFAOYSA-N 432.484 2.559 50 40 IFGB C=C(C)C(=O)OCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1ccc([N+](=O)[O-])c(Cl)c1 12857145 GVCBPEALHYBQGC-QGZVFWFLSA-N 447.831 2.992 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(Br)cc3)C2)cc1OC 409272686 RPFKZMBBLKHZLN-DACUGSJHSA-N 446.301 2.970 50 40 IFGB Cc1cc(S(=O)(=O)N2CCOC23CCN(C(=O)C(C)(C)CCl)CC3)ccc1F 16837456 RIZMJUIYAQAPFJ-UHFFFAOYSA-N 432.945 2.739 50 40 IFGB COc1cc(C(=O)NNC(=S)NCc2ccccc2)ccc1I 408585003 AEDSTJXKFZHOEI-UHFFFAOYSA-N 441.294 2.609 50 40 IFGB COc1ccccc1/C=N/NC(=O)C1CCN(C(=O)c2ccc(OC)c(OC)c2)CC1 409006551 OXGRPDKZZFHLBT-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB COc1cccc(OCCOc2c(Br)cc(/C=N/NC(N)=O)cc2OC)c1 8984919 HHBXDOMJKBGXPF-SRZZPIQSSA-N 438.278 2.926 50 40 IFGB COc1ccc(CCNC(=O)CC(=O)N/N=C\c2ccccc2C(F)(F)F)cc1OC 9056954 QCFOKJDESGDIIX-ZMFRSBBQSA-N 437.418 2.922 50 40 IFGB C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 16322374 FITOQQHMZXXNFD-SECBINFHSA-N 434.257 2.679 50 40 IFGB COc1ccc(NC(=O)[C@@H](NNC(=O)[C@H]2COc3ccccc3O2)c2ccccc2)cc1 32853670 TZGPPUNDTZCKQK-YADHBBJMSA-N 433.464 2.836 50 40 IFGB Cc1ccccc1/C=N\NC(=O)[C@H](NC(=O)c1ccccc1)c1n[nH]c(=O)c2ccccc12 33344359 OQPOFOTZBMHQAH-XLBQOGMNSA-N 439.475 2.853 50 40 IFGB C[C@@]1([P+](c2ccccc2)(c2ccccc2)c2ccccc2)CCC(=O)N(C(N)=O)C1=O 96022394 YTKWBFHIWXCXPJ-RUZDIDTESA-O 431.452 2.967 50 40 IFGB Cc1cccc(/C=N/NC(=O)[C@@H](NC(=O)c2ccccc2)c2n[nH]c(=O)c3ccccc23)c1 8854164 KXWQEURXXQVHKV-WGLQLPMYSA-N 439.475 2.853 50 40 IFGB CC(=C(C#N)C#N)c1cnc(-c2sc(N3CCOCC3)nc2N2CCOCC2)s1 16138562 BLRGIGWMMGPJBD-UHFFFAOYSA-N 428.543 2.760 50 40 IFGB CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2CCC(C(C)(C)C)CC2)cc1 16321332 AWHRVWMPQIVSOY-UHFFFAOYSA-N 436.578 2.974 50 40 IFGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)CN(c2ccc(C)c(C)c2)S(C)(=O)=O)cc1 20208715 ITKAIKYAMRTXIQ-XQNSMLJCSA-N 430.530 2.568 50 40 IFGB CC1=C(C#N)C(=O)N([C@H]2CCS(=O)(=O)C2)C(=O)/C1=C/c1ccc(-c2ccc(F)cc2)o1 101228793 RNOTXIYFCBWKER-HKJBKDEOSA-N 440.452 2.865 50 40 IFGB N#C/C(=C/[C@H]1C(=O)NC(=S)N(c2ccc(Cl)cc2)C1=O)C(=O)Nc1ccccc1F 408819297 REOVBUFTPXHCGJ-FPAJZGIOSA-N 442.859 2.932 50 40 IFGB Cc1ccccc1NC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)NCc1ccccc1 409151461 HAPAWGVJUKVDBO-JVWAILMASA-N 444.491 2.779 50 40 IFGB CCOc1cccc(-c2c(C(=O)N/N=C(\CC)c3ccccc3)nnn2-c2nonc2N)c1 9290868 JEULNNREEMYMOO-JJIBRWJFSA-N 446.471 2.842 50 40 IFGB O=C1NC[C@@H](c2ccccc2)[C@@H]1C(=O)N/N=C\c1cc(Br)cc(Cl)c1O 15938664 ZRBLVZDXBNJEEB-XIVSLRPRSA-N 436.693 2.788 50 40 IFGB N#C/C(=C/c1ccc(-c2cccc(Br)c2)o1)C(=O)N[C@@H]1CCS(=O)(=O)C1 16791087 URAFBPOUDKQEHT-UZGISAJGSA-N 435.299 2.919 50 40 IFGB CCOc1ccc(N(CC(=O)N/N=C/c2ccc(N(CC)CC)cc2)S(C)(=O)=O)cc1 19955063 FHLFYJISXXYWPV-XQNSMLJCSA-N 446.573 2.848 50 40 IFGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)CN(c2ccc(C)c(C)c2)S(C)(=O)=O)c1 20208774 QSHYWGDBDQYBOC-XQNSMLJCSA-N 430.530 2.568 50 40 IFGB O=C(NCc1ccc2c(c1)OCO2)C(=O)N/N=C/c1cccc(OCc2ccc(F)cc2)c1 408601284 ARYWJESHZQDLNY-UVHMKAGCSA-N 449.438 2.900 50 40 IFGB CCOc1cc(/C=C(/C#N)C(=O)NC(N)=O)cc(Cl)c1OCC(=O)Nc1ccccc1 409240894 LXZOMZDVBZNGSS-ZSOIEALJSA-N 442.859 2.858 50 40 IFGB COc1ccc(NC(=O)C(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)cc1 1800570 QOOYHJLOLPKPKP-JTQLQIEISA-N 426.256 2.555 50 40 IFGB Cc1cccc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)c1 3643993 WJQUQCHTASCPEK-UMEYKSNOSA-N 430.464 2.997 50 40 IFGB O=C(NN(C[C@@H](O)COc1ccccc1)C[C@@H](O)COc1ccccc1)c1ccccc1 9236960 BPLIWWYTBBIZDG-FGZHOGPDSA-N 436.508 2.513 50 40 IFGB C/C(=N/NC(=O)c1ccco1)c1cc2c(cc1NC(=O)[C@H]1CC=CC[C@@H]1C(=O)O)OCO2 17103267 MJYYRKOJVJQPCY-BTNWABHWSA-N 439.424 2.768 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2ccccc2CC)S(C)(=O)=O)cc1OC 20208906 XNZRRRWYDTVHTI-HZHRSRAPSA-N 445.541 2.739 50 40 IFGB COc1cc(/C=N/NC(=O)C(=O)Nc2ccccc2Br)cc(OC)c1OC 59435822 HVDKAPHYRBJILM-KEBDBYFISA-N 436.262 2.564 50 40 IFGB COc1ccc(C)cc1N(CC(=O)N/N=C/c1ccncc1)S(=O)(=O)c1ccccc1 408878265 ZELIQTBNYXLFDY-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB COc1cc([C@H]2[C@@H](Cl)C(=O)N2NC(=O)c2ccc(N)cc2)cc(Br)c1O 1633089 PKBYULAWXQAMBX-KGLIPLIRSA-N 440.681 2.581 50 40 IFGB O=C(N[C@@H](C(=O)N/N=C/c1ccc(F)cc1)c1n[nH]c(=O)c2ccccc12)c1ccccc1 9065392 HCQJTQIZMJVMMK-ODDBZWQPSA-N 443.438 2.684 50 40 IFGB Cn1cnnc1SCc1ccc(C(=O)N/N=c2/c(=O)c3cccc4cccc2c43)cc1 9140985 NCBUXDORBVXSTM-LKUDQCMESA-N 427.489 2.895 50 40 IFGB CC(=O)Oc1ccc(/C=N/NC(=O)CN(c2cccc3ccccc23)S(C)(=O)=O)cc1 19955171 ZMUDPDOQNICPST-OEAKJJBVSA-N 439.493 2.681 50 40 IFGB COc1cc(C(=O)N/N=C/c2ccccc2[N+](=O)[O-])ccc1I 408746709 FYJYEXWPSAFCGJ-RQZCQDPDSA-N 425.182 2.972 50 40 IFGB CC(=O)Oc1ccc(/C=N/NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)cc1 408760122 RZCMIARPHGTPDY-VSIOZEBNSA-N 445.541 2.764 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2cccc(Br)c2)S(C)(=O)=O)c(C)c1 408776614 XHHORUOWTJAENF-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB COc1ccc(C(O)(C(=O)N/N=C/c2cccc(OC)c2O)c2ccc(OC)cc2)cc1 1241290 WLSZMTYNRMVPPB-MFKUBSTISA-N 436.464 2.804 50 40 IFGB CCOc1ccc([C@@H]2[C@@H]3CN(C(C)=O)CC=C3C(C#N)=C(N)C2(C#N)C#N)cc1OCC 2588428 XHCYNPCOCBHYGD-DENIHFKCSA-N 431.496 2.756 50 40 IFGB CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1 21896549 JUFNBWKPJPDTOM-UHFFFAOYSA-N 426.517 2.971 50 40 IFGB Cc1c(C(=O)N/N=C\c2ccc(Br)cc2)nn(-c2ccccc2)c(=O)c1C#N 409056741 HZKORNLIVMZNGR-FMCGGJTJSA-N 436.269 2.939 50 40 IFGB O=C(CNC(=O)c1cccs1)N/N=C1\C(=O)N(CCc2ccccc2)c2ccccc21 1259023 DKJURZZUOHHZDN-QLYXXIJNSA-N 432.505 2.588 50 40 IFGB COc1ccc(COC(=O)NNC(=O)[C@H]2CS[C@@H](c3ccccc3)N2C(C)=O)cc1 6001782 JULVIBILHMRRNE-QUCCMNQESA-N 429.498 2.615 50 40 IFGB COc1cc(C(=O)NNC(=O)[C@H](NC(=O)c2ccccc2F)C(C)C)ccc1OC(C)C 12908995 DMMOYOQXTFWUHH-HXUWFJFHSA-N 445.491 2.837 50 40 IFGB O=C(Oc1ccccc1/C=N\NC(=O)[C@@H]1COc2ccccc2O1)c1ccc2c(c1)OCO2 16102539 DTKCYMYLBHGGTK-KWNLIYPVSA-N 446.415 2.925 50 40 IFGB Cc1ccc(C[C@@H]2S/C(=C(\C#N)C(=O)NN3CCOCC3)N(c3ccccc3)C2=O)cc1 31829063 IACFEEUTVNBDLU-VLBGROSNSA-N 448.548 2.785 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)c1 408754028 LQGFIUJDNCUBPJ-BTVXTAIASA-N 447.557 2.856 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)CN(c2ccc(Cl)cc2C)S(C)(=O)=O)c1 408782803 ZDMYOOCBOODNFJ-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB Cc1ccc(NC(=O)C(=O)NCc2ccc(/C=N/NC(=O)COc3ccccc3)o2)cc1C 408877414 RMBDGHYOLBPEOJ-VULFUBBASA-N 448.479 2.680 50 40 IFGB CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(C)n(C[C@H]4CCCO4)c(=O)c32)cc1OC 1264779 FKCFWYNHXGOBNA-IERDGZPVSA-N 437.496 2.961 50 40 IFGB CCc1ccc(OCC(=O)NNC(=S)NC(=O)C2CCCCC2)c(Br)c1 2135933 HCUGFPVXYMTSRY-UHFFFAOYSA-N 442.379 2.993 50 40 IFGB Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CCS(=O)(=O)c1ccccc1 9439312 XMNDHTVWRAATNM-UHFFFAOYSA-N 429.523 2.744 50 40 IFGB CCOc1cc(/C=N/NC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)ccc1O 19682729 RMBXRYLZKBTZJG-ZVHZXABRSA-N 430.936 2.712 50 40 IFGB C=CCOC(=O)C1=C(C)NC(SCC(=O)OC)=C(C#N)[C@@H]1c1ccc(O)c(OC)c1 20102461 ADELYZAWBRMVMU-IBGZPJMESA-N 430.482 2.732 50 40 IFGB O=C(Cl)C[C@@](O)(C(=O)c1ccc(Cl)cc1)[C@H](O)[C@H](O)C(=O)c1ccc(Cl)cc1 21302726 HWBPAGFLYJHNSJ-BHIYHBOVSA-N 445.682 2.667 50 40 IFGB Cc1cccc2c(=O)n(CCC(=O)NNC(=O)[C@@H](C)Oc3ccc4ccccc4c3)cnc12 22080438 OAXPCJZDZHCSDP-QGZVFWFLSA-N 444.491 2.863 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(Cc2ccco2)S(=O)(=O)c2ccccc2)c1 59443766 OIQROOMQTSRYEQ-HYARGMPZSA-N 427.482 2.629 50 40 IFGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)CN(c2c(C)cccc2C)S(C)(=O)=O)cc1 408884593 UXVWMTUOABXJPW-XQNSMLJCSA-N 430.530 2.568 50 40 IFGB N#CC(C#N)=C1c2cc([N+](=O)[O-])ccc2-c2c(C(=O)N3CCOCC3)cc([N+](=O)[O-])cc21 3137975 JQKUQTZEOKSGFV-UHFFFAOYSA-N 431.364 2.805 50 40 IFGB COc1cc(/C=N/NC(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)cc(OC)c1OC 4079625 IUWXUEHLFLXDFM-DHRITJCHSA-N 427.501 2.890 50 40 IFGB COc1ccc(C)cc1NC(=O)C(=O)N/N=C(\C)CC(=O)Nc1ccc(N(C)C)cc1 4697893 YRKJYERROBQCJZ-MFKUBSTISA-N 425.489 2.529 50 40 IFGB COCCn1c(SCC(=O)NNC(=O)c2cc(Cl)ccc2OC)nc2ccccc21 9119835 DFRMTTWMSFBJRF-UHFFFAOYSA-N 448.932 2.898 50 40 IFGB COc1cc(/C=N/NC(=O)C(=O)NC[C@@H]2CCCO2)cc(Cl)c1OCc1ccccc1 408612260 USXRBRKRZKMZHJ-BIXBROTJSA-N 445.903 2.673 50 40 IFGB Cc1cccc(NC(=O)COc2ccccc2/C=N/NC(=O)C(=O)NCc2ccco2)c1C 409258345 STXCDPZHSRZRRA-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB COc1cc(C(=O)NNC(=O)c2sc(NC(=O)C3CC3)cc2C)cc(OC)c1OC 10042896 GCZBHMWRCGYUTB-UHFFFAOYSA-N 433.486 2.506 50 40 IFGB COc1cccc(/C=N/NC(=O)[C@H](C)S[C@@H](C)C(=O)N/N=C/c2cccc(OC)c2)c1 38807225 RGOGHTJKUCHEDX-AVJRFCSFSA-N 442.541 2.814 50 40 IFGB COc1cc(C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)ccc1I 408746199 CDGRPKQLUOMKJF-RQZCQDPDSA-N 425.182 2.972 50 40 IFGB CCOc1ccc(/C=N/NC(=O)CN(c2cccc(F)c2)S(C)(=O)=O)cc1OCC 409119388 SJIROQSNGHXEAI-LPYMAVHISA-N 437.493 2.539 50 40 IFGB CC(=O)OCC(=O)[C@]1(O)CC[C@H]2[C@@H]3C[C@@H](Cl)C4=CC(=O)C=C[C@]4(C)[C@H]3C(=O)C[C@@]21C 608249 RACDDTQBAFEERP-ISAYWRDVSA-N 434.916 2.554 50 40 IFGB O=C(NNC(=S)NC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccncc1 3195911 PNVNPJFJJFBJHR-UHFFFAOYSA-N 442.504 2.884 50 40 IFGB COc1ccc(N2C(=O)[C@H]3[C@@H]4C[C@@H]([C@@H](Br)[C@H]4Br)[C@@H]3C2=O)cc1 4015939 KHYQVLDAIPZWMH-WHCZJHEKSA-N 429.108 2.978 50 40 IFGB CCOC(=O)c1c(NC(=O)NNC(=O)c2cccc(O)c2)sc2c1CC(C)(C)OC2 9410469 LAPUUBWGPMQQMQ-UHFFFAOYSA-N 433.486 2.948 50 40 IFGB COc1cccc(N(CC(=O)N/N=C/c2ccncc2)S(=O)(=O)c2ccc(C)cc2)c1 9425709 IVIUSSLOAKVHCM-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB O=C(CNC(=O)c1ccc2ccccc2c1)NNC(=O)COc1cccc(C(F)(F)F)c1 9882823 DMEXLERLCPFUQU-UHFFFAOYSA-N 445.397 2.815 50 40 IFGB CCOc1cc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)ccc1OCC(=O)OC 59333082 NBWHGAZCAPUMJN-HKWRFOASSA-N 449.507 2.893 50 40 IFGB O=C(COc1cccc(/C=N/NC(=O)C(=O)NC2CC2)c1)Nc1cccc(Cl)c1Cl 409265213 SZKIHSOUHOHHJU-AUEPDCJTSA-N 449.294 2.740 50 40 IFGB COc1cc(/C=N/NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)ccc1C 408990517 NNOLRNXRAFTTRS-KSRKCLLLSA-N 435.484 2.715 50 40 IFGB O=C(/C=C/c1ccccc1OC(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccccc1O 409033622 FUFYCODNNDCSJS-SDNWHVSQSA-N 447.403 2.994 50 40 IFGB O=C(COc1cccc(/C=N/NC(=O)C(=O)NCc2ccccc2)c1)Nc1ccc(F)cc1 409164730 MXCBCIQHQYQCQS-JFLMPSFJSA-N 448.454 2.610 50 40 IFGB COc1cc(/C=C(/C#N)C(=O)NC(N)=O)cc(Cl)c1OCC(=O)Nc1ccc(C)cc1 409220632 CMGFCISFFVNHEO-AUWJEWJLSA-N 442.859 2.776 50 40 IFGB O=C(COc1cccc(/C=N/NC(=O)C(=O)Nc2ccccc2F)c1)Nc1ccccc1 409256095 JRKIHIMGVKHNGC-AFUMVMLFSA-N 434.427 2.932 50 40 IFGB COCCCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(Cl)cc2)c(OC)c1 408602606 DXBZYSWQGXOIGD-ZMOGYAJESA-N 433.892 2.530 50 40 IFGB COc1ccc(N2C(=O)NC(=O)[C@H](/C=N/NC(=O)c3ccc(Cl)cc3Cl)C2=O)cc1 108972532 RCOLLSXZXVNGLP-DKNGMTOASA-N 449.250 2.617 50 40 IFGB COc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)NC[C@H]3CCCO3)cc2)cc1 408796486 PDPNMOKHJDUJDX-MKRMIXIUSA-N 435.480 2.915 50 40 IFGB N#CC(C(=O)COC(=O)CCC(=O)c1ccc2c(c1)OCCO2)=C1Nc2ccccc2N1 9511188 OUQGAZYZFPRVSW-UHFFFAOYSA-N 433.420 2.806 50 40 IFGB O=C(COc1ccc([N+](=O)[O-])cc1Br)N/N=C/c1cc(O)ccc1[N+](=O)[O-] 36020556 UCRJSODPWJKYMB-REZTVBANSA-N 439.178 2.500 50 40 IFGB CCOC(=O)COc1cc(Br)c(/C=C(/C#N)C(=O)NC(C)C)cc1OC 408777865 KNVHGNBJCJTBON-MLPAPPSSSA-N 425.279 2.831 50 40 IFGB CCCC(=O)Nc1ccc(C(=O)NNC(=O)CCC(=O)OCCc2ccccc2)cc1 12137172 VYTMOYCYDYGDJN-UHFFFAOYSA-N 425.485 2.752 50 40 IFGB COc1cc(C(=O)Oc2cccc(/C=N/NC(=O)c3cc(C)n[nH]3)c2)cc(OC)c1OC 18240599 STIOFRCOZUTIAS-FSJBWODESA-N 438.440 2.727 50 40 IFGB CC/C(=N\NC(=O)[C@H](C)N(c1ccccc1)S(C)(=O)=O)c1ccc(OC)c(OC)c1 408905955 BJNKUPJAPODEPM-CYNURGJPSA-N 433.530 2.789 50 40 IFGB CCOc1ccc(N([C@H](C)C(=O)N/N=C(\C)c2ccc([N+](=O)[O-])cc2)S(C)(=O)=O)cc1 408922831 TYNXSRLBNZGDPM-HFITWMCCSA-N 448.501 2.688 50 40 IFGB O=C(N/N=C/C=C/c1ccccc1[N+](=O)[O-])c1cccc(S(=O)(=O)N2CCCC2)c1 2660489 QUSKQHWRTDHBDI-XZHCKZKCSA-N 428.470 2.808 50 40 IFGB O=C(COc1ccc2c(c1)CCCC2)NCC(=O)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 9305734 YTGBUFXPDKHRQH-BHGWPJFGSA-N 444.875 2.772 50 40 IFGB CCOc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccccc3Br)CC2=O)cc1 10093209 VUDUZEKSUFOLTD-CYBMUJFWSA-N 446.301 2.662 50 40 IFGB COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=N/NC(=O)Cn2nnc(-c3ccccc3)n2)o1 16215041 MYVSRZGHFZFTBE-WSDLNYQXSA-N 447.411 2.667 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2ccccc2Br)S(C)(=O)=O)cc1C 20208799 UCONZJYLAJITIB-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB N#Cc1ccccc1OCC(=O)N/N=C/c1ccc(OC(=O)c2ccc([N+](=O)[O-])o2)cc1 3085585 JXLVIJTVMNWJAO-FSJBWODESA-N 434.364 2.808 50 40 IFGB CCN1C(=O)C[C@@H](C(=O)Nc2ccc(Cl)cc2)S/C1=N\NC(=O)c1ccncc1 33475741 DLQJPPOEDCGTQN-KHJVFXTQSA-N 431.905 2.729 50 40 IFGB CCOc1ccccc1N(CC(=O)N/N=C/c1cccnc1)S(=O)(=O)c1ccccc1 58924840 SWHSUSIMGWJFDV-LFVJCYFKSA-N 438.509 2.826 50 40 IFGB COc1ccccc1NC(=O)C(=O)N/N=C1/C(=O)N(Cc2ccccc2)c2ccccc21 3182387 RCDWRUKXFMFCAQ-YYADALCUSA-N 428.448 2.701 50 40 IFGB COc1ccc2c(c1OC)C(=O)O[C@@H]2NNC(=O)c1nc(Cl)c(Cl)c(N)c1Cl 12436751 GCYXRZPYLFHMHT-HNNXBMFYSA-N 447.662 2.745 50 40 IFGB Cc1cccc[n+]1[C@H]1[C@@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C(C(C#N)C#N)N[C@]1(O)C1CC1 33778146 UUHQFLQUMHGTRC-XWGVYQGASA-N 441.471 2.658 50 40 IFGB COc1ccc(C(=O)N/N=C/c2cc(Br)c(OCC(=O)O)c(OC)c2)cc1 408748862 ILOAVPBPYOVEJL-AWQFTUOYSA-N 437.246 2.694 50 40 IFGB C/C(=N\NC(=O)CN(c1ccc(C)c(Cl)c1)S(C)(=O)=O)c1ccc([N+](=O)[O-])cc1 408780208 VGONZMKAGNRYNQ-DEDYPNTBSA-N 438.893 2.863 50 40 IFGB CN(C(=O)c1ccccc1C(=O)OCC(=O)NNC(=O)c1ccccc1)c1ccccc1 9634179 MGNRQPPNTFJIQI-UHFFFAOYSA-N 431.448 2.581 50 40 IFGB O=C(CSc1nnnn1-c1ccccc1)N/N=C\c1cccn1-c1ccc([N+](=O)[O-])cc1 35241244 FPZRZATXACASHM-BKUYFWCQSA-N 448.468 2.604 50 40 IFGB COc1ccccc1N1C(=O)/C(=C\NNC(=O)c2ccccc2Cl)C(O)=NC1=S 38165676 NVCSHJQCEIFDAG-BENRWUELSA-N 430.873 2.755 50 40 IFGB Cc1ccc(NC(=O)C(=O)N/N=C/c2ccc(OCC(=O)NCc3ccccc3)cc2)cc1 58880770 WMZBSWLMPGVNPF-JVWAILMASA-N 444.491 2.779 50 40 IFGB O=C1C(NNC(=O)c2ccccc2O)=C/C(=N/S(=O)(=O)c2ccccc2)C2=C1CC=CC2 101181447 CSOKQJDPUCIHQC-XHPQRKPJSA-N 449.488 2.570 50 40 IFGB COc1cc(/C=N/NC(=O)COc2ccccc2C)cc(I)c1O 1434070 BYOLKUNLMUULES-DJKKODMXSA-N 440.237 2.843 50 40 IFGB C/C(CCc1ccccc1)=N\NC(=O)c1nnn(-c2nonc2N)c1-c1ccc(C)cc1 9234683 MHRYJHTZBYPRRW-BUVRLJJBSA-N 430.472 2.946 50 40 IFGB CN(CC(=O)N/N=C/c1ccc(Cl)cc1)S(=O)(=O)c1ccc(Br)cc1 16186936 FGZMXHBBTRXSSR-VXLYETTFSA-N 444.738 2.873 50 40 IFGB COc1ccc(/C=N\NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)c(OC)c1OC 223154626 DSCLVTJFYDHQLW-RMORIDSASA-N 425.363 2.820 50 40 IFGB Nc1nonc1-n1nnc(C(=O)N/N=C/c2ccoc2)c1CSc1ccc(Cl)cc1 9479192 IXOKUZCXROCHEI-IFRROFPPSA-N 444.864 2.535 50 40 IFGB O=C(NNC(=O)c1ccccc1)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccccc1 13305450 YDHVOIPKSXGNEA-HKWRFOASSA-N 430.420 2.827 50 40 IFGB Cc1cccn2c(=O)c(/C=C(\C#N)C(=O)NC3CCCCC3)c(N3C[C@@H](C)O[C@H](C)C3)nc12 13811474 SZKLWQXPRSKBHX-BLSACVOKSA-N 449.555 2.972 50 40 IFGB COc1cc(/C=N/NC(=O)CN2CCOCC2)cc(Cl)c1OCc1cccc(F)c1 15018715 HBNRWUYNQLTFJE-WYMPLXKRSA-N 435.883 2.849 50 40 IFGB CC(C)(C)NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2Cl)cc1 59959656 RXDOWXQTJIDEME-FSJBWODESA-N 430.892 2.722 50 40 IFGB CCOc1cc(/C=N\NC(=O)c2nn(-c3ccc(C)c(C)c3)c(=O)c(C#N)c2C)ccc1O 409055978 FSSLKEXMVVXQCH-ZMFRSBBQSA-N 445.479 2.898 50 40 IFGB C#CCN1C(=O)[C@]2(C(C#N)=C(N)OC(C)=C2C(=O)OCc2ccccc2)c2ccccc21 2211847 LKTWHQLGBLDGCK-VWLOTQADSA-N 425.444 2.646 50 40 IFGB Cn1cnnc1SCc1ccc(C(=O)N/N=C/c2ccc(N3CCOCC3)cc2)cc1 8825619 XKCIBNCEWPSPAL-OEAKJJBVSA-N 436.541 2.708 50 40 IFGB CCCCOc1ccc(C(=O)NNC(=O)CCc2nc3ccccc3c(=O)[nH]2)cc1OC 12694489 NAOMRTYQBXEGDT-UHFFFAOYSA-N 438.484 2.504 50 40 IFGB CCOc1ccc(/C=N/NC(=O)CN(c2ccccn2)S(=O)(=O)c2ccccc2)cc1 19951194 LMGWYZYCHKXMTR-LFVJCYFKSA-N 438.509 2.826 50 40 IFGB O=C(N/N=C/c1ccc2c(c1)OCO2)c1nn(Cc2ccccc2)c(=O)c2ccccc12 33748920 HUMYFLWSFBXDHT-DHRITJCHSA-N 426.432 2.937 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc(Br)c1)c1ccc(F)cc1 408766636 DQDIRAXKJXCPKW-VXLYETTFSA-N 428.283 2.505 50 40 IFGB O=C(CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccccc1)N/N=C/c1ccccc1O 409018170 XZIJIRPNMKHZHN-ZVHZXABRSA-N 441.484 2.873 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(Cl)cc2Cl)cc1 409167388 IMCZPPINFVECEM-AUEPDCJTSA-N 437.283 2.597 50 40 IFGB N#C/C(=C/c1cc([N+](=O)[O-])cc(I)c1O)C(=O)NC1CCCC1 409194544 OZYRRWQFWOVLDO-YHYXMXQVSA-N 427.198 2.871 50 40 IFGB COC(=O)c1ccc(/C=N/NC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cc1 9665412 GTUZSJPGVUJQPW-CVKSISIWSA-N 440.459 2.995 50 40 IFGB CCOc1cc(/C=N/NC(=O)[C@@H](NC(=O)Cc2cccs2)C(C)C)ccc1OCC#N 12467435 AQNKDKDOGOQFEK-GQBLCDNYSA-N 442.541 2.883 50 40 IFGB C[C@H]1CCc2sc(C(=O)NNC(=O)CCN3C(=O)[C@H](C)Oc4ccccc43)cc2C1 12568122 YMRGHLFNQMFQEU-KBPBESRZSA-N 427.526 2.838 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(Cl)cc2/C=N/NC(=O)C(=O)NC2CC2)cc1C 408606723 AKKDSQBJWBOGEO-BHGWPJFGSA-N 442.903 2.703 50 40 IFGB COC(=O)[C@H]1C(=O)NC(SCC(=O)Nc2ccc(F)cc2)=C(C#N)[C@H]1c1ccccc1 409138822 IMXVROGGPROMLA-RTBURBONSA-N 439.468 2.935 50 40 IFGB C#CCN1C(=O)/C(=N\NC(=O)c2cc(C(C)(C)C)n[nH]2)c2cc(Br)ccc21 4113035 SMVHFEBUUYPHNJ-KQWNVCNZSA-N 428.290 2.584 50 40 IFGB O=C(NNC(=O)c1cc(F)cc(F)c1)c1ccc(NS(=O)(=O)c2cccs2)cc1 9224142 FKKRGGWFXLOQIM-UHFFFAOYSA-N 437.449 2.902 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C\c2ccccc2Cl)cc1Cl 39986662 ZYRGFTULLLDIBX-JMIUGGIZSA-N 430.313 2.773 50 40 IFGB C[C@@H](NC(=O)COC(=O)CCCC(=O)NNC(=O)c1ccccc1Cl)c1ccccc1 408645065 JPMGCPPFFBZNIE-OAHLLOKOSA-N 445.903 2.692 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)[C@H](C)N(c2ccccc2)S(C)(=O)=O)cc1OC 408923858 HLMNFDILRORYLW-PZBNQXIHSA-N 431.514 2.565 50 40 IFGB CCOc1ccc([C@H]2[C@@H]3CN(C(C)=O)CC=C3C(C#N)=C(N)C2(C#N)C#N)cc1OCC 803676 XHCYNPCOCBHYGD-KNQAVFIVSA-N 431.496 2.756 50 40 IFGB Cc1cc(C)c2sc(NNC(=O)c3ccc(S(=O)(=O)N4CCOCC4)cc3)nc2c1 9381880 QLAMKZZVLFSYIG-UHFFFAOYSA-N 446.554 2.691 50 40 IFGB Cc1cc(/C=N/NC(=O)CSc2nnc(-c3cccc(Br)c3)n2C)n(C)n1 12446032 VKUJHEVFKKBDME-DJKKODMXSA-N 448.350 2.529 50 40 IFGB O=C(CCN1C(=O)c2ccccc2[C@H]1c1c[nH]c2ccccc12)NNC(=O)c1ccncc1 13955665 RPVBJROGFVWZIR-QHCPKHFHSA-N 439.475 2.959 50 40 IFGB COc1ccc(Cl)cc1C(=O)NNC(=O)CN1CCC[C@H]1c1ccc2c(c1)OCCO2 25044147 ZMQZLDWGKGKEOT-KRWDZBQOSA-N 445.903 2.718 50 40 IFGB CC(C)NC(=O)COc1ccc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)cc1 28213834 VLDSLEFPZYTUQO-SSDVNMTOSA-N 444.513 2.882 50 40 IFGB Cc1ccccc1OCC(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1O 408971119 MKVLEWXOWSVZPV-KCDOPAPYSA-N 442.472 2.669 50 40 IFGB C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1-c1cccs1)c1ccc(Cl)s1 9308273 FUMGXYUEOSBUSO-CNHKJKLMSA-N 434.894 2.830 50 40 IFGB COc1cc(C(=O)NNC(=O)c2cccc(NC(=O)c3ccccc3)c2)ccc1OC(C)=O 10040937 GDSCBZBAPJNUNL-UHFFFAOYSA-N 447.447 2.948 50 40 IFGB Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)[C@@H](C)NC(=O)C(C)(C)C)cc2)n1 12946847 IEAXFFFJSHXXMC-OAHLLOKOSA-N 443.573 2.698 50 40 IFGB CCc1ccc(NC(=O)COc2ccc(Cl)cc2/C=N/NC(=O)C(=O)NC(C)C)cc1 408608595 HUFWNUDMBVYLCD-WYMPLXKRSA-N 444.919 2.895 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(Cl)cc2)cc1 409265379 UNRFRKOQQYBZKO-CHOFVFFHSA-N 430.892 2.722 50 40 IFGB O=C(COc1ccc(Cl)cc1)NCC(=O)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 2177700 AWWWLDMDMIYPKM-ODCIPOBUSA-N 425.228 2.547 50 40 IFGB Cc1ccsc1/C=N/NC(=O)c1nnn(-c2nonc2N)c1CSc1ccccc1 2265211 QFOCANIJCXHMRV-AWQFTUOYSA-N 440.514 2.659 50 40 IFGB COc1ccc(S(=O)(=O)Oc2ccc(/C=N/NC(=O)c3ccc(O)cc3)cc2)cc1 3082078 QIXODZBMVUNBDA-HYARGMPZSA-N 426.450 2.932 50 40 IFGB CN(CC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1Cl)S(=O)(=O)c1ccc(Cl)cc1 16186786 NVQHEWOTKLLXIX-DJKKODMXSA-N 445.284 2.672 50 40 IFGB Cc1cccc(NC(=O)COC(=O)CCCC(=O)NNC(=O)c2ccccc2Cl)c1 408644453 FUPNNMVFAAIWIX-UHFFFAOYSA-N 431.876 2.762 50 40 IFGB Cc1ccc(NC(=O)COc2cccc(/C=N/NC(=O)C(=O)NCc3ccco3)c2)c(C)c1 409257535 SOHJQYKAGQOVGF-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB CCN(Cc1ccc(Cl)s1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 9579223 JTHDCVZUAMPHAG-UHFFFAOYSA-N 429.955 2.571 50 40 IFGB COc1ccc([C@@H]2C(C#N)=C(N)OC3=C2S(=O)(=O)N(C)c2ccccc23)c(OC)c1 20558301 MJHCCYONHFBOPI-GOSISDBHSA-N 425.466 2.660 50 40 IFGB Cc1cccc[n+]1[C@@H]1[C@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C([C-](C#N)C#N)N[C@@]1(O)C1CC1 169298849 VPFRCQCGNFASQJ-GMKZXUHWSA-N 440.463 2.617 50 40 IFGB NNC(=O)/C=C/c1ccc(OCc2ccc([N+](=O)[O-])cc2)c(I)c1 226334723 DGEMTNOKGMCBSD-XBXARRHUSA-N 439.209 2.782 50 40 IFGB O=C(NC[C@H]1CCCO1)C(=O)N/N=C/c1cc(Br)ccc1Nc1ccccc1 408709187 YKFYKAYZTZQGPG-UXHMZNKVSA-N 445.317 2.938 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2cc(Cl)cc(Cl)c2)S(C)(=O)=O)c1O 408775057 YFWPFYBMLAQEPC-AWQFTUOYSA-N 446.312 2.624 50 40 IFGB CCOc1cc([N+](=O)[O-])cc(/C=c2\sc3nc4ccccc4n3c2=O)c1OC(C)=O 408917046 LLNZKPWLIINMGO-MFOYZWKCSA-N 425.422 2.689 50 40 IFGB CCOc1cc(/C=N\NC(=O)c2nn(-c3ccccc3C)c(=O)c(C#N)c2C)ccc1O 409051423 ACRMZXCATIOMJW-MXAYSNPKSA-N 431.452 2.589 50 40 IFGB CCOC(=O)c1ccc(-c2ccc(/C=N/NC(=O)Cn3c([N+](=O)[O-])cnc3C)o2)cc1 4112710 CDIDDXBGOLFPCF-LSHDLFTRSA-N 425.401 2.687 50 40 IFGB Cc1cc2c(cc1Br)NC(=O)/C2=N\NC(=O)COc1ccccc1[N+](=O)[O-] 12446968 QJPKJWUYVYWBSF-UHFFFAOYSA-N 433.218 2.517 50 40 IFGB CC(C)Oc1c(Br)cc(Br)cc1/C=N/NC(=O)c1nonc1N 16575571 GTKUZBWQIVLGNY-YAXRCOADSA-N 447.087 2.728 50 40 IFGB Cc1nc2cc(C(=O)NNC(=O)[C@@H](C)Oc3cccc(Br)c3)ccc2n1C 58269080 OVKHFTHYHTXNPW-LLVKDONJSA-N 431.290 2.873 50 40 IFGB C[N+](C)(C)CC(=O)NC(=O)N/N=C\[C@H](CC#N)CN(Cc1ccccc1)Cc1ccccc1 73391210 CHOCXJOLMFXXPK-PXDDYHHSSA-O 449.579 2.736 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1cccc(Cl)c1Cl 409166595 FJPXYXJBKBRBDT-AUEPDCJTSA-N 437.283 2.597 50 40 IFGB C=C(C)C(=O)OCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc([N+](=O)[O-])ccc1Cl 1764074 INLAMLURSPPBGQ-KRWDZBQOSA-N 447.831 2.992 50 40 IFGB O=C(Cc1nnc(NC(=O)c2ccc(Cl)cc2)s1)N/N=C/c1ccc(O)cc1O 2069303 FSKHBWFNBRVFOQ-AWQFTUOYSA-N 431.861 2.548 50 40 IFGB Cc1ccc(-n2nc(C(=O)N/N=C\c3ccccc3[N+](=O)[O-])c(C)c(C#N)c2=O)cc1C 409072650 KECPJLUWXCCDBH-MSXFZWOLSA-N 430.424 2.702 50 40 IFGB Cc1cccc2c1NC(=O)/C2=N\NC(=O)Cn1cnc2sc(-c3ccccc3)cc2c1=O 6886921 NHYUBWCIFDORJB-UHFFFAOYSA-N 443.488 2.906 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccc(Cl)cc2Cl)S(C)(=O)=O)cc1 20060370 SNGQCZHLSIYFAW-KEBDBYFISA-N 430.313 2.918 50 40 IFGB COc1cc(OC)cc(C(=O)NNC(=O)CSc2nc(-c3ccc(C)cc3)no2)c1 408636650 BNCNIBLJPNJJTD-UHFFFAOYSA-N 428.470 2.616 50 40 IFGB O=C(CCC(=O)N1CCN(c2cccc(Cl)c2)CC1)NNC(=O)CCc1ccccc1 9850504 BXOJTPQADNAVPH-UHFFFAOYSA-N 442.947 2.549 50 40 IFGB CCOc1ccc(Nc2ncccc2C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 40007622 JXVZPXGTMTWLSB-HXUWFJFHSA-N 434.452 2.825 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2cccc3ccccc23)S(C)(=O)=O)c(OC)c1 408778134 BOZMGQZSUNFSAB-OEAKJJBVSA-N 441.509 2.773 50 40 IFGB CC(C)[C@@H](NC(=O)c1ccccc1F)C(=O)OCC(=O)C(C#N)=C1Nc2ccccc2N1 3285349 ZWWVURVDCGZVFP-HXUWFJFHSA-N 436.443 2.965 50 40 IFGB CCOC(=O)c1c(NC(=O)C(=O)N/N=C(\C)c2ccc(O)cc2O)sc2c1CCCC2 9158465 AWCFQXNLIHUTGW-FOKLQQMPSA-N 445.497 2.694 50 40 IFGB N#C/C(=C\c1c(Oc2ccc(F)cc2)nc2ccccn2c1=O)C(=O)NC[C@H]1CCCO1 13768226 ZXBUQVSHQVKAHT-NKAIQICCSA-N 434.427 2.828 50 40 IFGB COc1ccccc1NC(=O)COc1ccc(/C=N\NC(=O)c2ccccn2)cc1OC 32109711 UGMJWLNYFDKFIE-QFEZKATASA-N 434.452 2.880 50 40 IFGB Cc1ccc(-n2c(C)c(Br)c(/C=N/NC(=O)CN3CCOCC3)c2C)cc1 20243787 CIZBBLGIMWLYNZ-WSDLNYQXSA-N 433.350 2.947 50 40 IFGB COc1cc(/C=N/NC(=O)C(=O)NCCCOC(C)C)ccc1OCc1ccccc1 408616132 WKALNHSZESTUCX-MFKUBSTISA-N 427.501 2.656 50 40 IFGB O=C(NCc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc(I)cc1 408718198 ADWBWGJQPNZZAV-KEBDBYFISA-N 441.656 2.711 50 40 IFGB COc1ccc(N2C(=O)NC(=O)/C(=C/c3cc(OC)c(O)c(SC#N)c3)C2=O)cc1 409040563 GSCHVPDVUJPTHI-AUWJEWJLSA-N 425.422 2.649 50 40 IFGB COc1ccc(/C=N\NC(=O)c2nn(-c3ccc(C)c(C)c3)c(=O)c(C#N)c2C)cc1OC 409058136 IJNAQWKQHGIDCQ-ZMFRSBBQSA-N 445.479 2.811 50 40 IFGB CCc1ccc(/C=c2\sc3n(c2=O)C(N)=C(C#N)[C@@H](c2ccc(CC)cc2)C=3C#N)cc1 714559 PJNYGSUCNUGLHR-ZWULCIMOSA-N 438.556 2.986 50 40 IFGB CCOc1ccc([C@@H]2[C@H]3CN(C(C)=O)CC=C3C(C#N)=C(N)C2(C#N)C#N)cc1OCC 803679 XHCYNPCOCBHYGD-SIKLNZKXSA-N 431.496 2.756 50 40 IFGB Cc1ccc(C)c(N2N=C(C(=O)NNC(=O)c3cc(-c4ccccc4)n[nH]3)CCC2=O)c1 9285099 DMLPIBKEFNXVNO-UHFFFAOYSA-N 430.468 2.638 50 40 IFGB CCc1ccc(/C=c2/sc3n(c2=O)C(N)=C(C#N)[C@H](c2ccc(CC)cc2)C=3C#N)cc1 32107550 PJNYGSUCNUGLHR-YQZDYSOMSA-N 438.556 2.986 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)NC2CC2)cc1)Nc1ccc(Cl)c(Cl)c1 409252090 SHOBRELRNZLNTR-AUEPDCJTSA-N 449.294 2.740 50 40 IFGB COc1ccc(C(=O)N/N=C\c2ccc(OCC(=O)O)c(Br)c2)cc1OC 409310614 BLNRVLUMQFDFAH-UKWGHVSLSA-N 437.246 2.694 50 40 IFGB C#CCN1C(=O)/C(=N\NC(=O)CNc2cccc(C)c2)c2cc(Br)ccc21 2338208 AKRCTCBMIZEECI-CLCOLTQESA-N 425.286 2.670 50 40 IFGB O=C(CSc1nnc(-c2ccco2)n1Cc1cccnc1)NNC(=O)c1cccs1 12743462 VEAAAMABPXPNIG-UHFFFAOYSA-N 440.510 2.596 50 40 IFGB COc1cc(C(=O)NNS(=O)(=O)c2ccccc2Br)ccc1OC(C)C 12758240 GGDZZOSSWCBKDD-UHFFFAOYSA-N 443.319 2.868 50 40 IFGB O=C(NNC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(S(=O)(=O)N2CCCC2)cc1 12869709 VUWHHKKNKVRNQF-UHFFFAOYSA-N 446.916 2.681 50 40 IFGB Cc1cc(C)cc(N2C[C@@H](C(=O)NNC(=O)c3ccc(Br)cc3)CC2=O)c1 408645295 UPIATMLOTSEANG-HNNXBMFYSA-N 430.302 2.880 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccco2)ccc1OCC(=O)Nc1cccc([N+](=O)[O-])c1 409063080 GQFZWNMMLJORNZ-WSDLNYQXSA-N 438.396 2.978 50 40 IFGB CCOc1cc(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)cc(Br)c1O 1085943 TYAYPXLERICZFQ-ODCIPOBUSA-N 436.262 2.844 50 40 IFGB COc1ccc(-c2ccc(/C=N/NC(=O)Cn3nnc(-c4ccccc4)n3)o2)c([N+](=O)[O-])c1 39389333 XOGKDHVBLAFQJA-WSDLNYQXSA-N 447.411 2.667 50 40 IFGB COc1cc(/C=N\NC(=O)c2cc3cc(Br)ccc3o2)ccc1OCC(N)=O 100249371 PWWSQRGRQUSLAB-AFPJDJCSSA-N 446.257 2.832 50 40 IFGB Cc1cccc(C)c1NC(=O)CCC(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1 408664717 DITIHCBBQLBZSD-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB Cc1ccc(N2C(=O)[C@@H](/C=C(\C#N)C(=O)Nc3ccccc3F)C(=O)NC2=S)cc1C 408811732 AJSIYLCVGHFTPY-DKGMDFAASA-N 436.468 2.895 50 40 IFGB COc1ccc(C)cc1N(CC(=O)N/N=C/c1ccccn1)S(=O)(=O)c1ccccc1 409185614 NKRJEEAODAINGX-BUVRLJJBSA-N 438.509 2.744 50 40 IFGB COc1ccc(C(=O)Nc2nnc(CC(=O)N/N=C/c3ccccc3OC)s2)cc1 726394 IZMZUBDZKPYSKH-CIAFOILYSA-N 425.470 2.500 50 40 IFGB CCOc1ccc(N(CC(=O)N/N=C/c2ccc(OC(C)C)cc2)S(C)(=O)=O)cc1 8683245 JIRWPJDDVMRHKP-HYARGMPZSA-N 433.530 2.789 50 40 IFGB CCc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2CSc2ccccc2)cc1 9088237 UJWIBOSZEGIWGV-FSJBWODESA-N 448.512 2.851 50 40 IFGB O=C(N/N=C/c1cccc(I)c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 9891848 HJMQOFDGWUCXHZ-LZYBPNLTSA-N 440.153 2.872 50 40 IFGB O=C(CCCC(=O)OCC(=O)Nc1ccc(F)cc1)NNC(=O)c1ccccc1Cl 408645116 KDHXBTDDWSJBES-UHFFFAOYSA-N 435.839 2.592 50 40 IFGB O=C(O[C@@H](CCl)C(=O)c1ccccc1)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@@H]2Br 408682505 JIGDPJZFKGQLGY-QHLDEJQSSA-N 427.678 2.591 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc(F)cc1)c1ccc(Br)cc1 408773369 IIUNDJSGJCUYDY-VXLYETTFSA-N 428.283 2.505 50 40 IFGB O=C(NNC(=O)c1cc(Br)ccc1I)c1ccco1 3424560 PLMRLWQPPVDBLS-UHFFFAOYSA-N 435.015 2.722 50 40 IFGB CCOc1ccccc1NC(=O)C/C(C)=N/NC(=O)C(=O)Nc1ccc(OC)cc1OC 9763185 UEEBOOHRXWVIIG-AFUMVMLFSA-N 442.472 2.562 50 40 IFGB CCOC(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1cc(OC)c(OC)c(OC)c1 408603338 FWIFBRIUTUWHGN-INIZCTEOSA-N 430.486 2.660 50 40 IFGB CCc1ccccc1NC(=O)COC(=O)CCC(=O)NNC(=O)c1ccccc1Cl 408644082 CWVLPQRYUYRGTO-UHFFFAOYSA-N 431.876 2.626 50 40 IFGB CCOc1cc(/C=N/NC(=O)CN(c2ccc(C(C)C)cc2)S(C)(=O)=O)ccc1O 408770818 AZCOCWKUGAJJQQ-LPYMAVHISA-N 433.530 2.831 50 40 IFGB CCOC(=O)COc1ccc(/C=N/NC(=O)CNc2ccc(Br)cc2)cc1 409361833 RBMZWJJOSBLBOB-SSDVNMTOSA-N 434.290 2.953 50 40 IFGB COc1ccc(N2CCN(c3nc4c(C)cccn4c(=O)c3C=C(C#N)C#N)CC2)cc1 2200729 VSAGRHMYXNQDRI-UHFFFAOYSA-N 426.480 2.769 50 40 IFGB C[C@H]1CCc2c(sc3ncn([C@@H](C)C(=O)N/N=C4\C(=O)N(C)c5ccccc54)c(=O)c23)C1 6166514 UULPLFRCUFSALN-ODDJFLISSA-N 449.536 2.641 50 40 IFGB O=C(COCC(=O)Nc1cccc(Br)c1)NNC(=O)CC1CCCCC1 9849417 PYJWNGQQRGQNFF-UHFFFAOYSA-N 426.311 2.522 50 40 IFGB COc1cccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1O[C@@H](C)C(=O)O 409243188 ZRKDGGNSVLQKNU-JYQBEENSSA-N 427.369 2.965 50 40 IFGB N#C/C(=C/c1cc(Br)ccc1OCc1ccc(C(=O)O)cc1)C(=O)NC(N)=O 1103898 KHWRRWKCCNESDH-AUWJEWJLSA-N 444.241 2.828 50 40 IFGB CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(C[C@@H]4CCCO4)c(=O)c32)cc1OC 1264780 FKCFWYNHXGOBNA-HRAATJIYSA-N 437.496 2.961 50 40 IFGB Cc1c(/C=N/NC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cc(C#N)n1C 6093343 LDEDVVQOHNHSIA-CIAFOILYSA-N 427.511 2.831 50 40 IFGB Cc1cc(=O)oc2cc(OCC(=O)N/N=C/c3cc(Cl)cc([N+](=O)[O-])c3O)ccc12 9042139 LBYBDBXDOXXUHS-ODCIPOBUSA-N 431.788 2.898 50 40 IFGB CCOc1ccc(-c2c(C(=O)N/N=C(\C)c3ccc(C)cc3)nnn2-c2nonc2N)cc1 9109839 WRLWPOYIRVTWGK-ZVHZXABRSA-N 446.471 2.761 50 40 IFGB O=C1N(CN2CCN(c3ccccc3F)CC2)c2ccccc2[C@@]12OC[C@H](CCl)O2 19907384 LTGBZDKDHHJQAE-AOMKIAJQSA-N 431.895 2.759 50 40 IFGB CCN1c2ccccc2C2=C([C@@H](c3ccc(C(=O)OC)cc3)C(C#N)=C(N)O2)S1(=O)=O 57510567 VGRZHOCPZRHEPB-SFHVURJKSA-N 437.477 2.819 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cc(OC)ccc3OC)[C@@H]2C1 6194993 MZHIUBKIYFQJRU-UYAOXDASSA-N 433.468 2.586 50 40 IFGB N#CC1=C(N)Oc2[nH]c(=S)n(-c3ccccc3)c2[C@]12C(=O)Nc1ccc([N+](=O)[O-])cc12 8863685 BELMNBSQYWPFLJ-HXUWFJFHSA-N 432.421 2.768 50 40 IFGB CCOC(=O)CSC1=C(C#N)[C@@H](c2ccccc2OCC)[C@@H](C(=O)OCC)C(=O)N1 9110612 YMOZHARHKKSQPT-QZTJIDSGSA-N 432.498 2.509 50 40 IFGB C[C@H](Oc1ccc(C#N)cc1)C(=O)NNC(=O)Cn1c(C(F)(F)F)nc2ccccc21 9376533 UVUBMSFPGNVMSX-LBPRGKRZSA-N 431.374 2.542 50 40 IFGB COc1ccccc1OCC(=O)NNC(=O)CCC(=O)Nc1ccc(Cl)cc1Cl 9762271 YSLQBOOUMDNRKM-UHFFFAOYSA-N 440.283 2.947 50 40 IFGB COc1ccc(Br)cc1/C=N\NC(=O)CN1CCN(Cc2ccccc2)CC1 32576929 MXNKLMLCCQMSHE-UCQKPKSFSA-N 445.361 2.726 50 40 IFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@H]1c1ccc(C(=O)OC)cc1 408607699 UJGYEQZXWQBGOL-KRWDZBQOSA-N 425.514 2.726 50 40 IFGB COc1ccc(/C=N\NC(=O)c2nn(-c3ccccc3C)c(=O)c(C#N)c2C)cc1OC 409062521 VZUONAMELGJQEJ-MXAYSNPKSA-N 431.452 2.502 50 40 IFGB COc1ccccc1C(=O)N/N=C/c1cc(I)c(O)c(OC)c1 409224479 LSXMYQMSQFONON-GIJQJNRQSA-N 426.210 2.778 50 40 IFGB COc1c(OC(C)=O)ccc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)c1[N+](=O)[O-] 855662 ZEBAATZRLSOEJV-LSHDLFTRSA-N 429.429 2.983 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1C(=O)O)c1cccc(Cl)c1Cl 2263704 KHXRNHKWNRSEFJ-AWQFTUOYSA-N 444.296 2.608 50 40 IFGB COc1ccccc1C(=O)NCCC(=O)NNC(=O)c1ccc(COc2ccccc2)cc1 10109348 DWGJAUSJQUPBQM-UHFFFAOYSA-N 447.491 2.855 50 40 IFGB Cc1nn(Cc2ccccc2)c(C)c1/C=N/NC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 33045806 WTKZIWDWWGMRKJ-FOKLQQMPSA-N 445.932 2.613 50 40 IFGB Cc1ccc2nc(O)c(/C=N\NC(=O)c3nn(-c4ccccc4)c(=O)c(C#N)c3C)cc2c1 409057845 LMGLWBCCHVNKTN-ZMFRSBBQSA-N 438.447 2.739 50 40 IFGB C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cc3c(s1)CCCC3)C2=O 9584739 UGMCYQCFUCNQOE-XMHCIUCPSA-N 446.573 2.525 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@@H]3[C@H]4C[C@H]([C@@H]3C2=O)[C@@H](Br)[C@@H]4Br)c1 169618848 AQAXYDDYNVXYEF-JOLBHGKHSA-N 443.091 2.667 50 40 IFGB CN1CCC(=NNC(=O)CN(c2ccccc2Cl)S(=O)(=O)c2ccccc2)CC1 408841726 KEIAAWNIKRFNNQ-UHFFFAOYSA-N 434.949 2.733 50 40 IFGB COc1cc(C(=O)N/N=C\c2ccc(OCC(N)=O)cc2)ccc1OCc1ccccc1 409326553 LWJVQLXTSGLAAJ-WGARJPEWSA-N 433.464 2.902 50 40 IFGB O=C(/C=C/c1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)c1ccccc1 12532877 BKWDDVQQGUCZHA-NTCAYCPXSA-N 427.526 2.726 50 40 IFGB CCN(CC)c1ccc(/C=N\NC(=O)C(=O)N/N=C/c2ccc(N(CC)CC)cc2)cc1 31637152 ZOTUMTITZGNJDR-WTHRLWDASA-N 436.560 2.979 50 40 IFGB O=C(CNC(=O)c1cccnc1)N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21 95346041 DBVFDWPDSGUABD-HFTWOUSFSA-N 447.882 2.532 50 40 IFGB O=C(Nc1cccc(C(=O)N2CCCCC2)c1)[C@H]1[C@H]2C(=O)O[C@@H]3[C@@H](Br)[C@@H]1C[C@@H]32 408684814 ODSFTYWODOKHGI-ZXLDYLNASA-N 447.329 2.822 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)cc1 408990509 NMCGMZLCRFGFBK-QESWDSMOSA-N 447.495 2.962 50 40 IFGB N#C/C(=C\c1cc(Br)ccc1OCC(N)=O)C(=O)Nc1cccc([N+](=O)[O-])c1 409220337 XDSFXGMVKMNWDC-WUXMJOGZSA-N 445.229 2.767 50 40 IFGB Cc1cc(C)cc(NC(=O)COc2cccc(/C=N/NC(=O)C(=O)NCc3ccco3)c2)c1 409268082 ZFKHGHZPXICNJH-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB Cc1ccc(N(CC(=O)NN=C2CCN(C)CC2)S(=O)(=O)c2ccccc2)c(C)c1 58189432 SDQZYFBFBXQUTC-UHFFFAOYSA-N 428.558 2.697 50 40 IFGB COc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCc3cccnc3)c2C)cc1Cl 408969340 MERJNNSCWFZJHI-LGJNPRDNSA-N 439.903 2.918 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1c(C)cc(C)cc1C 409247906 DUJFTMDYOLRPGJ-YBNTXHARSA-N 438.528 2.994 50 40 IFGB CCOc1cc([C@H]2C(C#N)=C(N)OC(C)=C2C(=O)OC)c(Cl)cc1OCC(=O)OC 814143 XFIJMPBBXKPLEB-SFHVURJKSA-N 436.848 2.545 50 40 IFGB C[C@@H]1CN(C(=O)/C(C#N)=C2\N=C(NC(=O)c3ccc(F)cc3)c3ccccc32)C[C@@H](C)O1 2328170 ICYIUICJMQBKAZ-JZWCPIJFSA-N 432.455 2.886 50 40 IFGB Cc1cc(C)c2nc(NNC(=O)c3ccc(S(=O)(=O)N4CCOCC4)cc3)sc2c1 9381867 RSNAMDFZOCIBQI-UHFFFAOYSA-N 446.554 2.691 50 40 IFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2cccc(C)c2)ccc1OCC(N)=O 16349908 QRLCMPDIXDFNFY-JOCHJYFZSA-N 445.479 2.580 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@H]3[C@@H]4C[C@@H]([C@@H](Br)[C@@H]4Br)[C@@H]3C2=O)cc1 33354064 KXHQMAGGCJSUCQ-LIBFEPKXSA-N 443.091 2.667 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C\c2ccc(Cl)cc2)cc1Cl 33793659 WAYXQWZAXHLFMU-JMIUGGIZSA-N 430.313 2.773 50 40 IFGB O=C(CCCCl)Nc1ccc(S(=O)(=O)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 100820031 MOJGHKPPNHVCQQ-HZPDHXFCSA-N 449.960 2.614 50 40 IFGB COC(=O)c1ccc(NC(=O)C(=O)N/N=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)cc1 223162042 HFLDJFIIIQWGRJ-UUYOSTAYSA-N 436.380 2.730 50 40 IFGB O=C(C[C@@H]1NC(Cc2ccccc2)=NNC1=O)N/N=C/c1cccc(Oc2ccccc2)c1 973015 VWRAJQKYRJVYLM-KDPMPHTCSA-N 441.491 2.963 50 40 IFGB COc1cc(OC)c(OC)cc1/C=C(\C#N)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCO2 9126092 AGUXVJSFMLUXAA-AWNIVKPZSA-N 441.396 2.937 50 40 IFGB COc1cccc(/C=N/NC(=O)COc2ccc(I)cc2)c1OC 9846050 SSUZJTDQNRTTAH-VXLYETTFSA-N 440.237 2.838 50 40 IFGB O=C(CCN1CCN(Cc2ccccc2)CC1)NNC(=O)COc1ccc2ccccc2c1 22938727 GIFPNTAEBZWGAS-UHFFFAOYSA-N 446.551 2.574 50 40 IFGB COc1ccc(C(=O)Nc2nnc(S(=O)(=O)/C(C#N)=C\c3ccccc3O)s2)cc1 31773494 PEAWBZXPTNFBGU-GDNBJRDFSA-N 442.478 2.843 50 40 IFGB O=C(O)c1ccccc1N1C(=O)[C@@H]2[C@@H]3C[C@H]([C@@H]2C1=O)[C@@H](Br)[C@@H]3Br 33353339 RVSOKZITIXHEOI-SUONKVAMSA-N 443.091 2.667 50 40 IFGB O=C1[C@H]2[C@H](C(=O)N1c1ccc([N+](=O)[O-])cc1)[C@H]1C[C@H]2[C@H](Br)[C@H]1Br 102055542 ZCDMNVVYMXYOLY-PTEOKISQSA-N 444.079 2.877 50 40 IFGB OCC[C@@]12[C@H]3[C@@H]4C[C@H]5[C@@H]([C@H]4[C@H]1I)[C@H]2[C@@H](I)[C@H]53 261361222 LPPSJDDLSOALBA-YWWORKNESA-N 442.078 2.734 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccc(Cl)cc2)c1 409262323 HSJGMBIXQLNEDH-CHOFVFFHSA-N 430.892 2.722 50 40 IFGB CCOc1ccc(NC(=O)Cn2nnc(-c3ccccc3NC(=O)[C@@H](C)Cl)n2)cc1 1352325 DVCPRIXPDJZNSX-CYBMUJFWSA-N 428.880 2.943 50 40 IFGB Nc1nonc1-c1nc2ccccc2n1CC(=O)N/N=C\c1cc(Cl)cc(Cl)c1O 8809519 ZEVBDBVKPJSFPW-HOEBFWFUSA-N 446.254 2.831 50 40 IFGB O=C(COC(=O)CCCOc1ccccc1)NNC(=O)c1ccc(Br)cc1 13109935 DNFAWKKNADBOSU-UHFFFAOYSA-N 435.274 2.613 50 40 IFGB N#CC1=C(N)N(c2ccc(Br)cc2)C2=C(C(=O)OC2)[C@@]12C(=O)Nc1ccccc12 20719914 LHXCXBJHOCPJKI-NRFANRHFSA-N 449.264 2.664 50 40 IFGB O=C(N/N=C/[C@H]1C(=O)NC(=S)N(c2ccc(Cl)cc2)C1=O)c1ccccc1Cl 408744104 YRYJNAAWLXOZJA-UWPAOYMWSA-N 435.292 2.773 50 40 IFGB Cc1cc([N+](=O)[O-])cc(C)c1OCC(=O)N/N=C/c1ccc(I)o1 865441 GVJQXLUEAGROJL-REZTVBANSA-N 443.197 2.938 50 40 IFGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1cc(Br)cc([N+](=O)[O-])c1O 3102444 QDTZPDWHAOZHAC-REZTVBANSA-N 439.178 2.500 50 40 IFGB CCOC(=O)[C@H](NC(C)=O)[C@H](OC(C)=O)c1cccc(N(CCCl)CCCl)c1 6089422 KAEOBVIVPGBJCY-QZTJIDSGSA-N 433.332 2.643 50 40 IFGB COc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@H](C(=O)c2ccccc2)N2C=CC(C#N)=C[C@H]32)cc1 20130826 CMLWMRDJKKMKIP-YSFYHYPLSA-N 425.444 2.714 50 40 IFGB C/C(=N\NC(=O)CN(c1ccc(C(C)C)cc1)S(C)(=O)=O)c1ccc2c(c1)OCCO2 20209021 KXMLOQNMYGTMHK-XQNSMLJCSA-N 445.541 2.888 50 40 IFGB Cn1c(=O)n(C)c2cc(/C=N/NC(=O)COc3ccc(C4SCCS4)cc3)ccc21 408570045 RRFPQDZDQQYKEG-WSDLNYQXSA-N 442.566 2.885 50 40 IFGB N#C/C(C(=O)NCc1ccco1)=C1/N=C(NC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 2326803 RJRRUUVGDUJOMA-VXPUYCOJSA-N 441.403 2.929 50 40 IFGB COC(=O)c1c(NC(=O)C(=O)N/N=C(\C)c2ccc(OC)c(OC)c2)sc2c1CCC2 5910737 KFWLPQXBTRXGSQ-FOKLQQMPSA-N 445.497 2.520 50 40 IFGB CCOC(=O)NNC(=O)Cc1ccc(NS(=O)(=O)c2ccc3ccccc3c2)cc1 9783071 JCADDAJJVIYNDJ-UHFFFAOYSA-N 427.482 2.960 50 40 IFGB Cc1ccc(/C=C2\SC(=S)N(CCC(=O)NNC(=O)c3ccc(O)cc3)C2=O)cc1 13809737 IMMOFQNXMQPZHL-ATVHPVEESA-N 441.534 2.753 50 40 IFGB CN(CC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1cc(Cl)ccc1Cl 16186986 PQNXCXVSCVWXEW-DJKKODMXSA-N 445.284 2.672 50 40 IFGB CCOc1cc(/C=C(\C#N)C(=O)NCc2ccco2)ccc1OCCN1CCOCC1 17094427 WNXNUKQIUFQLKV-XMHGGMMESA-N 425.485 2.613 50 40 IFGB O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccc(Br)c1 408615073 LNDPZUDSBUPILU-LBPRGKRZSA-N 436.693 2.917 50 40 IFGB O=C(COC(=O)CCC(=O)Nc1ccc(Cl)cc1)NNC(=O)c1ccc(Cl)cc1 408665125 UKBAAAPOFQTLPM-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB COc1ccc(O)c(/C=N/NC(=O)CNc2ccc(I)cc2)c1 1444146 WUXDFOUJYVBARL-DJKKODMXSA-N 425.226 2.568 50 40 IFGB CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1ccc(F)cc1)n2C 12525503 JBYREGMVPMANIO-UHFFFAOYSA-N 447.536 2.819 50 40 IFGB C[C@@H]1Cc2cc(C(=O)NNC(=O)Cc3cccc4ccccc34)ccc2N1S(C)(=O)=O 12636802 HSEGLLOHLIYORB-OAHLLOKOSA-N 437.521 2.554 50 40 IFGB C/C(=N/NC(=O)CCn1cc([N+](=O)[O-])cn1)c1ccc(OCc2ccc(C(=O)O)o2)cc1 8816354 MHTGVAZSKHOYEH-XKZIYDEJSA-N 441.400 2.592 50 40 IFGB Cc1ccc(Oc2nc3c(C)cccn3c(=O)c2/C=C(\C#N)C(=O)N2CCOCC2)cc1 9209895 QTLMQUBOZRLQSR-NBVRZTHBSA-N 430.464 2.869 50 40 IFGB CC(=O)[C@@H]1CC(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)=NN1c1ccccc1 58249763 YIIUDZFRLVRZKM-NRFANRHFSA-N 446.463 2.844 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2cccc(Cl)c2C)S(C)(=O)=O)c(OC)c1 408781582 CLPXNQFCMDQQTQ-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB Cc1ccc(N(CC(=O)NN=C2CCN(Cc3ccccc3)CC2)S(C)(=O)=O)c(C)c1 409346829 LMZCOMGTDBOFNP-UHFFFAOYSA-N 442.585 2.838 50 40 IFGB COC(=O)COc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1Br 8722688 HVSXJGZKNHVNBA-DJKKODMXSA-N 436.218 2.673 50 40 IFGB COc1ccc(CCNC(=S)NNC(=O)CSCc2ccc(C)cc2)cc1OC 15526365 YXKADQDFUOISEF-UHFFFAOYSA-N 433.599 2.983 50 40 IFGB CN(CC(=O)NNC(=O)COc1ccc(Br)cc1)Cc1ccc(Cl)s1 19530439 VMHKRIGBJDWDNA-UHFFFAOYSA-N 446.754 2.822 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc(I)c1O 105738871 CEBIGHXUTPKDKH-CAOOACKPSA-N 441.181 2.678 50 40 IFGB O=C(CCCNS(=O)(=O)c1ccc(Cl)c(Cl)c1)NNC(=O)c1cccs1 8880697 FFTGXDLGSMBFCL-UHFFFAOYSA-N 436.342 2.575 50 40 IFGB COC(=O)c1ccc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4cccnc4)c(=O)c32)cc1 11640057 BEHXKDRCJWQJMO-HXUWFJFHSA-N 428.448 2.605 50 40 IFGB Cc1ccc(Cl)cc1NC(=O)COc1cccc(/C=N/NC(=O)C(=O)NC(C)C)c1 409153809 NCMRKCHMBNSPCJ-FOKLQQMPSA-N 430.892 2.641 50 40 IFGB CCOc1cc(/C=N/NC(=O)Cn2cnc3sc4c(c3c2=O)CC[C@@H](C)C4)ccc1O 954738 GRIAFDVPHXBPGM-OKYTWDAHSA-N 440.525 2.837 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccn(Cc3ccc(Cl)cc3)n2)c(O)c([N+](=O)[O-])c1 8780677 SDAUBVLWXKCHOC-UFFVCSGVSA-N 429.820 2.971 50 40 IFGB CCc1sc(C(=O)NCC(=O)NNC(=O)[C@@H](C)Nc2nc3ccccc3s2)cc1C 12983163 NSVQULJEKBKBDP-GFCCVEGCSA-N 445.570 2.606 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)[C@H](C)N(c2ccc(OC)cc2)S(C)(=O)=O)cc1 20214785 OIIPKBHUVBIODA-PZBNQXIHSA-N 431.514 2.565 50 40 IFGB CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H](NC(=O)c2ccccc2F)C(C)C)cc1 13011346 CTUAPNMMAUTBJO-QRWLVFNGSA-N 445.491 2.594 50 40 IFGB COC(=O)c1ccc(Cl)cc1N/C=C1\C(=O)N(C[C@@H]2CCCO2)C(=O)C(C#N)=C1C 13628783 JGDGXFZWIUMQOH-XGHPXPSOSA-N 429.860 2.810 50 40 IFGB COc1cc(OC)cc(-c2nc(SCC(=O)NNC(=O)c3ccc(Cl)cc3)n[nH]2)c1 408637414 KAJPWIHQUATSKU-UHFFFAOYSA-N 447.904 2.696 50 40 IFGB C[C@H](NC(=O)COC(=O)CCCC(=O)NNC(=O)c1ccccc1Cl)c1ccccc1 408645061 JPMGCPPFFBZNIE-HNNXBMFYSA-N 445.903 2.692 50 40 IFGB Cc1c(C(=O)N/N=C\c2ccccc2O)nn(-c2cccc(C(F)(F)F)c2)c(=O)c1C#N 409059366 MQZASYMLTGRIHG-RAWMCFOBSA-N 441.369 2.901 50 40 IFGB CN(CC(=O)NNC(=O)c1ccc(C(C)(C)C)cc1)S(=O)(=O)c1ccc(Cl)cc1 12881293 FTDYTNNVDPJJGZ-UHFFFAOYSA-N 437.949 2.719 50 40 IFGB O=C(N/N=C/c1c(Sc2ccccn2)nc2ccccn2c1=O)c1cccc([N+](=O)[O-])c1 19833294 QUKBVJFBYXLTEZ-YDZHTSKRSA-N 446.448 2.913 50 40 IFGB COc1ccc(Br)cc1/C=N\NC(=O)CN(C1CCCCC1)S(C)(=O)=O 35351986 LXJZAJIHCUOOLM-ODLFYWEKSA-N 446.367 2.502 50 40 IFGB N#C/C(=C\c1cn(CC(=O)NC2CC2)c2ccccc12)C(=O)NCc1ccc2c(c1)OCO2 59087271 WLJRZERSFIEQOQ-LICLKQGHSA-N 442.475 2.872 50 40 IFGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1ccccc1I 408566892 IXRMCAHJJWHHNA-RQZCQDPDSA-N 425.182 2.972 50 40 IFGB COc1cc(N2CCCC2)c(OC)cc1/C=N/NC(=O)CSc1nc(C)cc(C)n1 409107753 QHGOLEHIJINALW-WSDLNYQXSA-N 429.546 2.953 50 40 IFGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cc(Cl)c(OCC(N)=O)c(OC)c2)cc1 409221827 AVJJVTVSMXSLDK-VGOFMYFVSA-N 443.843 2.545 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1c(C)cc(C)cc1C 409247905 DUJFTMDYOLRPGJ-PYGAFPFSSA-N 438.528 2.994 50 40 IFGB O=C(NNS(=O)(=O)c1ccc(CCCl)cc1)C(O)(c1ccccc1)c1ccccc1 853683 IZUOVQVAKIOHPP-UHFFFAOYSA-N 444.940 2.714 50 40 IFGB COC(=O)c1ccc(OCC(=O)NNC(=S)Nc2ccc(OC(F)(F)F)cc2)cc1 2562177 JKIQUMRAUUAZGB-UHFFFAOYSA-N 443.403 2.768 50 40 IFGB CCn1c(C)nc2cc(C(=O)NNC(=O)CCNC(=O)c3ccccc3Cl)ccc21 3373255 IKFYLBUMUSXXSU-UHFFFAOYSA-N 427.892 2.599 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@H]3[C@@H]4C[C@@H]([C@@H](Br)[C@H]4Br)[C@@H]3C2=O)cc1 4157165 KXHQMAGGCJSUCQ-XALSLBCYSA-N 443.091 2.667 50 40 IFGB COc1ccc(/C=C/C(=O)NC(=S)NNC(=O)[C@H]2C[C@@H]2c2ccccc2)cc1OC 9168016 CAVMJJOKKASCAE-IEPXPHTDSA-N 425.510 2.543 50 40 IFGB CCCCCn1nc(C(=O)NNS(=O)(=O)c2ccc(C)cc2)c2ccccc2c1=O 12977538 LFLSWAPWXVLYTB-UHFFFAOYSA-N 428.514 2.518 50 40 IFGB CCc1ccccc1NC(=O)CCC(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1 408647657 TWQOSXSAQMZRRT-UHFFFAOYSA-N 431.876 2.626 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccc(Cl)cc2)S(C)(=O)=O)cc1Cl 408768806 JOCMDWRKQJZUOT-KEBDBYFISA-N 430.313 2.918 50 40 IFGB CC1=C(C#N)C(=O)NC(=O)/C1=C\Nc1ccc(S(=O)(=O)Nc2ccc(C)c(C)c2)cc1 16312537 OUKRRYWULCAOHS-NDENLUEZSA-N 436.493 2.897 50 40 IFGB O=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C\c1ccc([N+](=O)[O-])c(O)c1 32929276 XILCVJJHEMWCTD-QFEZKATASA-N 432.436 2.699 50 40 IFGB COc1cc(C(=O)N/N=C\c2ccc(S(O)(O)O)o2)c([N+](=O)[O-])c(OC)c1OC 100568708 JAWLKRPXBBFQHF-APSNUPSMSA-N 431.379 2.560 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2cc(Cl)ccc2C)S(C)(=O)=O)c1OC 408782551 IFCGZIILGGMEOS-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB Cc1cc(C)c(S(=O)(=O)NCC(=O)N/N=C/c2ccccc2Br)c(C)c1 409160813 JEPPKMYUTSCBJE-KEBDBYFISA-N 438.347 2.803 50 40 IFGB O=C(CSc1nnc(C2CC2)n1Cc1ccccc1)NNC(=O)c1ccccc1F 9882279 PBLZLDHZXRKBQI-UHFFFAOYSA-N 425.489 2.896 50 40 IFGB CNc1sc2c3c(c(=O)[nH]c2c1C#N)[C@H](c1ccc(C(=O)OC)cc1)C(C#N)=C(N)O3 15083548 UKTBOJSRVIFHEA-CYBMUJFWSA-N 433.449 2.508 50 40 IFGB Cc1ccc(C)c(NC(=O)COC(=O)CCC(=O)NNC(=O)c2ccccc2Cl)c1 408644405 FNJQVIWNXLNHPN-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB CCOc1ccc(C(=O)NC(=S)NNC(=O)CCC(=O)Nc2ccccc2Cl)cc1 12137581 VXCURCSIAOQSKR-UHFFFAOYSA-N 448.932 2.793 50 40 IFGB O=C(COc1ccc(Cl)cc1)NNC(=O)CN(Cc1cccs1)C[C@@H]1CCCO1 17307933 MDWOOKVAURLLSM-KRWDZBQOSA-N 437.949 2.609 50 40 IFGB CC(C)CNC(=O)CC(=O)N/N=C\c1ccc(OCC(=O)Nc2ccccc2Cl)cc1 59960430 IUSFEXZEFNDHLA-MXAYSNPKSA-N 444.919 2.970 50 40 IFGB CCc1ccc(-n2nc(C(=O)N/N=C\c3cc(OC)ccc3OC)c(C)c(C#N)c2=O)cc1 409054501 AQJRZJMVZVPYPZ-WGARJPEWSA-N 445.479 2.756 50 40 IFGB COc1ccc(Cl)cc1N(CC(=O)N/N=C(\C)c1ccc(F)cc1)S(C)(=O)=O 409185432 YWNRPBXLVXSVOL-CIAFOILYSA-N 427.885 2.794 50 40 IFGB O=C(NNC(=O)c1ccccc1O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1 8825353 MLJOUKNMDMYURK-UHFFFAOYSA-N 445.884 2.921 50 40 IFGB CS(=O)(=O)c1ccc(C(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)cc1 9838380 HFOXUJAZDTWENY-UHFFFAOYSA-N 436.489 2.816 50 40 IFGB N#CC1=C(N)N2CCc3cc4c(cc3C2=C[C@]12C(=O)Nc1ccc(F)cc12)OCCCO4 9059095 ANAHWPGZGLJKPD-XMMPIXPASA-N 430.439 2.784 50 40 IFGB CN(CC(=O)N/N=C\c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc2ccccc2c1 39986705 ANBVYPWWGRVAKX-BKUYFWCQSA-N 426.454 2.519 50 40 IFGB COc1cccc(N2C[C@H](C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)CC2=O)c1 40058408 UJSKYSPHQWIUAM-UKRRQHHQSA-N 427.526 2.696 50 40 IFGB O=C1c2ccccc2S(=O)(=O)N1C[C@@H](Br)[C@@H](Br)CCl 4107650 WCNUPMQBUXFKQT-DTWKUNHWSA-N 431.533 2.597 50 40 IFGB C=CCOc1cccc(/C=N/NC(=O)CN(c2ccccc2OCC)S(C)(=O)=O)c1 20210458 RARYCKBDDQCIRG-PXLXIMEGSA-N 431.514 2.566 50 40 IFGB Cc1ccc(C(=O)NNC(=O)COC(=O)c2c(NC(=O)C3CC3)sc(C)c2C)cc1 25444846 UTNKBOXWYASPLK-UHFFFAOYSA-N 429.498 2.640 50 40 IFGB COc1cc(/C=N/NC(=O)CN2C[C@@H](c3ccccc3)CC2=O)c(Br)cc1O 16194800 IWXFHTZEANIVOZ-GTQIFZCBSA-N 446.301 2.630 50 40 IFGB O=C(CCC(=O)Nc1ccc(Cl)cc1Cl)NNC(=O)[C@@H]1CCCC[C@H]1C(=O)O 17096761 AELDTLRCHIVTJW-VXGBXAGGSA-N 430.288 2.751 50 40 IFGB O=C(CNC(=O)c1ccco1)N/N=C1\C(=O)N(Cc2ccccc2Cl)c2ccccc21 9067198 UQRWTYMGWGMLIE-QOMWVZHYSA-N 436.855 2.730 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1F)c1cccc(Br)c1 20060496 WUWGCOUJUFZXSF-VXLYETTFSA-N 428.283 2.505 50 40 IFGB COc1cccc(/C=N/NC(=O)[C@@H](CC(C)C)NC(=O)COc2ccccc2C)c1O 408969714 SJKLNXNZXFZWOY-QJTDOHDFSA-N 427.501 2.769 50 40 IFGB CCCCOc1ccc(/C=N/NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 409025512 WFLNMZXGFXKNDU-KGENOOAVSA-N 448.501 2.690 50 40 IFGB C/C(=N\NC(=O)c1nnn(-c2nonc2N)c1-c1cccs1)c1ccccc1Cl 9478588 LSHWAMNJGSCMDS-AWQFTUOYSA-N 428.865 2.768 50 40 IFGB Cc1cccc(CN2C(=O)[C@]3(C(C#N)=C(N)Oc4cc(C)n(C)c(=O)c43)c3ccccc32)c1 9743069 CXZWDIWGPQPEGZ-SANMLTNESA-N 438.487 2.921 50 40 IFGB Cn1c(C(=O)NNC(=O)COCC(=O)Nc2cccc(Cl)c2Cl)cc2ccccc21 9850009 STIZPQOBCQGLPS-UHFFFAOYSA-N 449.294 2.901 50 40 IFGB COc1cc(/C=N\NC(=O)CN2CCOCC2)cc(Cl)c1OCc1ccccc1F 59246730 RVYNSXNMCHFXLA-MSXFZWOLSA-N 435.883 2.849 50 40 IFGB C[C@H](Oc1ccc(/C=N/NC(=O)c2cccc(I)c2)cc1)C(=O)O 59303291 WQUHRBALILEXAD-VSMYLPJWSA-N 438.221 2.907 50 40 IFGB CCCOc1ccc2[nH]c(C(=O)NNC(=O)CCC(=O)NCc3cccs3)cc2c1 199413053 OKSPJDAZGIFVQI-UHFFFAOYSA-N 428.514 2.876 50 40 IFGB CCOc1cc([N+](=O)[O-])cc(/C=C(\C#N)C(=O)NCc2ccc(OC)cc2OC)c1O 408875791 HSIIAUAANANNON-VIZOYTHASA-N 427.413 2.940 50 40 IFGB O=C(CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccccc1)N/N=C/c1cccnc1 409013335 UNLMIBDJXDYNJA-ZVHZXABRSA-N 426.473 2.562 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(Cl)cc2/C=N/NC(=O)C(=O)NC(C)C)c(C)c1 409153238 MDBBGQPMKGLXCO-BHGWPJFGSA-N 444.919 2.949 50 40 IFGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2ccc(C)c(NS(C)(=O)=O)c2)c1 12536256 SDJAELPIZFPOSY-UHFFFAOYSA-N 433.530 2.638 50 40 IFGB O=C(CN1CCOCC1)N/N=C/c1ccccc1OCc1ccc(Br)cc1 15018711 MBGQUZRTAHXERK-LPYMAVHISA-N 432.318 2.810 50 40 IFGB O=C(O)c1ccccc1N1C(=O)[C@@H]2[C@@H]3C[C@@H]([C@H](Br)[C@@H]3Br)[C@@H]2C1=O 97951013 RVSOKZITIXHEOI-JFVYGOQOSA-N 443.091 2.667 50 40 IFGB COc1cc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)ccc1O[C@@H](C)C(=O)O 409020301 NRTLRDHGJNDTOF-JYQBEENSSA-N 427.369 2.965 50 40 IFGB Cc1ccc2c(c1)[C@]1(C=C3c4cc5c(cc4CCN3C(N)=C1C#N)OCCCO5)C(=O)N2 9129024 SNILHRWLAPLYFM-VWLOTQADSA-N 426.476 2.953 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccc(OCC(C)C)cc2)S(C)(=O)=O)cc1 20210179 USOKJKIBCAUIIX-LPYMAVHISA-N 433.530 2.646 50 40 IFGB Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCCC[C@@H]1CCSS1 22698466 SCGXYIDOXLMFDK-CYBMUJFWSA-N 430.621 2.763 50 40 IFGB COc1cccc(NC(=O)C(=O)N/N=C/c2ccc(OCC(=O)Nc3ccccc3)cc2)c1 58881524 HPTQDADSTVYAPJ-MFKUBSTISA-N 446.463 2.802 50 40 IFGB COc1ccc(/C=N/NC(=O)C2CCN(C(=O)c3cc(OC)cc(OC)c3)CC2)cc1 59953167 XCYHQVXSNWDFMT-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB CCOC(=O)C1=C(CBr)NC(C)=C(C(=O)OC)[C@H]1c1cccc([N+](=O)[O-])c1 68605201 WQTLFARIUNGLPK-OAHLLOKOSA-N 439.262 2.941 50 40 IFGB biogenic COc1ccc(/C=N/NC(=O)CN(c2ccc(Cl)cc2C)S(C)(=O)=O)cc1OC 408787415 ZVBYBWHGJKFZLD-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NCC(C)C)cc2Cl)cc1 409160501 QLTOQUQDWUUSEA-BRJLIKDPSA-N 444.919 2.888 50 40 IFGB N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)CCNC(=O)c3ccccc3)cc2)cc1 9438818 UZGUFPHQPABKET-UHFFFAOYSA-N 442.475 2.572 50 40 IFGB CC(C)CNC(=O)COc1ccc(/C=N\NC(=O)C(=O)Nc2ccc(Cl)cc2)cc1 223150474 KQUKKCLAWXMGDG-MSXFZWOLSA-N 430.892 2.580 50 40 IFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3ccc(OC)c(OC)c3)CC2)cc1 409007230 VTDCHXISLJUTBJ-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB COc1ccc(OC)c(N(CC(=O)NN=C2CCCC2)S(=O)(=O)c2ccccc2)c1 19951435 PRKRCGVDRHYCED-UHFFFAOYSA-N 431.514 2.945 50 40 IFGB COc1cc([C@H]2C(C#N)=C(N)Oc3cc(C)n(C)c(=O)c32)cc(Br)c1OC 20086760 DNOYTPGHSWXQNG-HNNXBMFYSA-N 432.274 2.692 50 40 IFGB COc1ccc(OC)c([C@@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4ccccn4)c(=O)c32)c1 37866394 TZXDZLWLXNWXRN-OAQYLSRUSA-N 430.464 2.835 50 40 IFGB COc1ccc(OC)c(N(CC(=O)N/N=C/c2ccc(C)c(C)c2C)S(C)(=O)=O)c1 409185536 MFLOQZLSVIUQEV-WSDLNYQXSA-N 433.530 2.545 50 40 IFGB CCCOc1ccc([C@@H]2[C@@H]3CN(C(C)=O)CC=C3C(C#N)=C(N)C2(C#N)C#N)cc1OC 1789978 DVGAKCRXQWQNPA-DENIHFKCSA-N 431.496 2.756 50 40 IFGB Cc1nn(Cc2ccccc2Cl)c(C)c1/C=N/NC(=O)c1ccc(-n2cnnn2)cc1 40161343 AEKAHYVHBGSQKR-FOKLQQMPSA-N 434.891 2.941 50 40 IFGB COc1cc(/C=N\NC(=O)c2nn(-c3ccc(C)c(C)c3)c(=O)c(C#N)c2C)ccc1O 409062139 OIOPCSFLZKKVTG-ROTLSHHCSA-N 431.452 2.508 50 40 IFGB CCOc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)ccc1OCC(=O)N1CCOCC1 409169116 OVMSCHXPZZSTBD-KGENOOAVSA-N 449.507 2.546 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1 2178192 MBSNEFVMCNNCEC-BHGWPJFGSA-N 449.294 2.763 50 40 IFGB N#C/C(=C\c1ccc(-c2ccc(S(N)(=O)=O)cc2)o1)C(=O)Nc1ccccc1C(=O)O 2801586 AZKKSEZBSLUNBI-SDNWHVSQSA-N 437.433 2.838 50 40 IFGB Cc1cccc(C(=O)NCC(=O)N/N=C/c2ccc(OCC(=O)Nc3ccccc3)cc2)c1 8722665 FHUVQEURWMAQAF-JFLMPSFJSA-N 444.491 2.893 50 40 IFGB O=C(COc1ccc2ccccc2c1)NNS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 33026426 GQRXMBHQRIYQQZ-UHFFFAOYSA-N 435.845 2.790 50 40 IFGB O=C(CCSc1ccccc1)N/N=C/c1ccc(OCC(=O)N2CCOCC2)cc1 59474316 KJSPUDYVGOMYCA-XQNSMLJCSA-N 427.526 2.557 50 40 IFGB C/C(NNC(=O)c1ccncc1)=C1/C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1c1ccccc1 112292502 QGKKLDIROAKXNS-HKWRFOASSA-N 442.435 2.949 50 40 IFGB COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2)c1 89481805 BUZXVZXYHKJGQI-UHFFFAOYSA-N 425.466 2.571 50 40 IFGB O=C(NNC(=O)c1nn(-c2ccc(F)cc2)c2c1CCCC2)c1ccc2c(c1)OCCO2 9811109 ABHLWEZQHNPIGT-UHFFFAOYSA-N 436.443 2.736 50 40 IFGB CCCOc1ccc(C(=O)NNC(=O)c2cc(OCC)c(OC)cc2[N+](=O)[O-])cc1OC 15762010 MXUQHVJSKIYPDP-UHFFFAOYSA-N 447.444 2.874 50 40 IFGB Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NNC(=O)c1ccc2ccccc2n1 21007905 PIUYAJSNCIJHGR-UHFFFAOYSA-N 440.525 2.695 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)[C@@H]2COc3ccccc3O2)cc1)Nc1ccccc1 28214990 VVHMBSHYZCJSKP-PWYGXMRTSA-N 431.448 2.994 50 40 IFGB O=C(COc1ccc2ccccc2c1)NNS(=O)(=O)c1ccc(Br)cc1 33028550 RZRMAAYVBVJABT-UHFFFAOYSA-N 435.299 2.991 50 40 IFGB C/C(=N\NC(=O)CN(c1cccc(F)c1)S(C)(=O)=O)c1cccc(Br)c1 409111499 IZPGSVGZYBPBKX-UDWIEESQSA-N 442.310 2.895 50 40 IFGB COCCCNC(=O)/C(C#N)=C/c1c(Oc2ccccc2OC)nc2c(C)cccn2c1=O 2407807 WEASNDOGXCOUHY-SAPNQHFASA-N 448.479 2.864 50 40 IFGB Cc1ccc(-n2c(C)nnc2SCC(=O)NNC(=O)COc2ccc(Cl)cc2)cc1 6280014 KAUNMLZGAOTGFD-UHFFFAOYSA-N 445.932 2.856 50 40 IFGB COc1ccc(C(=O)NNC(=O)CSc2nnc3c4c(C)c(C)sc4ncn23)cc1 12640671 OGLHHLBXXMCGLD-UHFFFAOYSA-N 442.526 2.518 50 40 IFGB O=C(N/N=C1\C(=O)N(CN2CCOCC2)c2ccccc21)c1ccc(Cl)cc1Cl 19818576 PYSABRKQHATNDG-NKFKGCMQSA-N 433.295 2.764 50 40 IFGB COc1cc(/C=N/NC(=O)CNc2ccccc2)cc(I)c1OC 59419188 LLVLFHHZIKSODF-KEBDBYFISA-N 439.253 2.871 50 40 IFGB O=C(CSc1cc(Cl)ccc1Cl)NNC(=O)Cn1cnc2ccccc2c1=O 14244759 KAQJZIIPRSGMJA-UHFFFAOYSA-N 437.308 2.643 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)[C@@H](C)N(c2ccccc2)S(C)(=O)=O)cc1OCC 408923944 IMLCAPSMABJMED-BXDFRRGMSA-N 445.541 2.955 50 40 IFGB CN(C)c1cccc(OCC(=O)N/N=C\c2cc([N+](=O)[O-])cc(Br)c2O)c1 409069921 YOZULWRHUQEEHP-OCKHKDLRSA-N 437.250 2.658 50 40 IFGB CNC(=O)/C(C#N)=C/c1c(N2CCC(Cc3ccccc3)CC2)nc2ccccn2c1=O 2204293 APRQPUUTEZIPSZ-CAPFRKAQSA-N 427.508 2.807 50 40 IFGB CCc1ccccc1N(CC(=O)N/N=C/c1ccc(OC2CSC2)cc1)S(C)(=O)=O 20208861 KULJFZMGYBIARE-WSDLNYQXSA-N 447.582 2.660 50 40 IFGB COc1cc(C(=O)NNC(=O)[C@@H](NC(=O)c2cccs2)C(C)C)ccc1OC(C)C 22978873 OXDMQIDYDGYKLN-SFHVURJKSA-N 433.530 2.760 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@H]2C[C@H]3[C@@H](Br)[C@H]2Br)c1 4157166 AQAXYDDYNVXYEF-BCFCROPCSA-N 443.091 2.667 50 40 IFGB O=C(NNS(=O)(=O)c1ccc(Br)cc1)c1sccc1-n1cccc1 8888340 LKZRORTVMFAZKC-UHFFFAOYSA-N 426.317 2.925 50 40 IFGB Cc1cc(C(=O)NNC(=O)c2cccc(CS(C)(=O)=O)c2)c(C)n1-c1ccc(F)cc1 12558102 RTXMHJYQNOXTGI-UHFFFAOYSA-N 443.500 2.853 50 40 IFGB C/C(=N\NC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1)c1cccc([N+](=O)[O-])c1 16136897 SOYNACJFFSCZSB-XQNSMLJCSA-N 429.908 2.906 50 40 IFGB COc1cc(/C=C/C(=O)NN)cc(I)c1OC(=O)c1ccccc1 226364567 ODKCVQKRZVPPBV-BQYQJAHWSA-N 438.221 2.522 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1OCC(=O)Nc1ccc(C)cc1C 409164435 IKKXONOHVHCCMR-BRJLIKDPSA-N 444.919 2.951 50 40 IFGB Cc1cccc(/C=N/NC(=O)[C@H](NC(=O)c2ccccc2)c2n[nH]c(=O)c3ccccc23)c1 12462702 KXWQEURXXQVHKV-QVGKIPNLSA-N 439.475 2.853 50 40 IFGB O=C(N[C@@H](C(=O)N/N=C\c1ccc(F)cc1)c1n[nH]c(=O)c2ccccc12)c1ccccc1 33745235 HCQJTQIZMJVMMK-WZRHPCBOSA-N 443.438 2.684 50 40 IFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(OC)c(OC)c1 408607690 UIOMERWZAHIHLZ-GOSISDBHSA-N 427.530 2.957 50 40 IFGB CCc1ccc(NC(=O)COc2ccc(Cl)cc2/C=N/NC(=O)C(=O)NC2CC2)cc1 408609625 KPVGYHCLSWXHAG-WYMPLXKRSA-N 442.903 2.649 50 40 IFGB CCNC(=S)NNC(=O)CSc1nnc(-c2ccc(C)cc2)n1-c1ccccc1 1741329 GLKMBCLOKZNKAL-UHFFFAOYSA-N 426.571 2.850 50 40 IFGB CCCCN1C(=O)c2ccc(C(=O)NNC(=O)COc3ccccc3Cl)cc2C1=O 9284075 QKBHRURQCSBPMA-UHFFFAOYSA-N 429.860 2.576 50 40 IFGB Cc1cccc(OCC(=O)NCC(=O)N/N=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)c1 9305754 FNQPKOCPKBDHPE-BRJLIKDPSA-N 435.436 2.599 50 40 IFGB CC(C)(C)NC(=S)NNC(=O)COc1ccc(Br)cc1Br 14895357 LJZBMJCXWYYKJM-UHFFFAOYSA-N 439.173 2.884 50 40 IFGB O=C(N/N=C/c1ccccc1[N+](=O)[O-])[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 408879261 CMQYAUIRHGASHL-XNHPLOEXSA-N 436.877 2.552 50 40 IFGB COc1cc(N2CCOCC2)ccc1/C=N/NC(=O)C(O)(c1ccccc1)c1ccccc1 409243615 XDQPLJHSZWMKAL-ZXVVBBHZSA-N 445.519 2.918 50 40 IFGB Cc1cc2cc3c(cc2n2c(SCC(=O)NNC(=O)C4CCCCC4)nnc12)OCO3 887104 AAVDKHKSCCNMGM-UHFFFAOYSA-N 441.513 2.739 50 40 IFGB CCOc1ccc(-c2n[nH]c(=S)n2CCC(=O)NNC(=O)c2cc(Cl)cn2C)cc1 12394827 DRPLTTAJSDAAFH-UHFFFAOYSA-N 448.936 2.850 50 40 IFGB Cn1c(SCC(=O)N/N=C/c2cccnc2)nnc1-c1ccc(Br)cc1 13751953 ZUHKRGICIDKWFI-KEBDBYFISA-N 431.319 2.882 50 40 IFGB COc1ccc(C)cc1S(=O)(=O)N(CC(=O)N/N=C\c1ccco1)Cc1ccccc1 33779603 UHDHOUAYYSFSDP-UCQKPKSFSA-N 441.509 2.938 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)NN=C2CCN(C)CC2)c2ccccc2F)cc1 57502598 BYTYDIHMQWWHTQ-UHFFFAOYSA-N 432.521 2.527 50 40 IFGB Cc1cccc2c1NC(=O)/C2=N\NC(=O)[C@@H](C)n1cnc2sc3c(c2c1=O)CC[C@@H](C)C3 6166501 MKLAYLHVVBEPPC-DGCLKSJQSA-N 449.536 2.925 50 40 IFGB COC(=O)COc1c(Cl)cc(/C=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1OC 14407924 OMWGTEHGAOZGJU-UFFVCSGVSA-N 435.820 2.501 50 40 IFGB CN(C)c1cccc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c1 17576912 KYPCPZCVYBKBHK-UHFFFAOYSA-N 444.538 2.690 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@@H]3[C@@H]4C[C@@H]([C@H](Br)[C@H]4Br)[C@@H]3C2=O)cc1 100747822 KXHQMAGGCJSUCQ-QFHDERPTSA-N 443.091 2.667 50 40 IFGB COc1cc(C(=O)N/N=C\c2cccc(OC)c2O)ccc1I 408747179 KBQSOHFTYNMJAL-NVMNQCDNSA-N 426.210 2.778 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)cc1 408969673 RUBOOPBIYRRDRJ-LFVJCYFKSA-N 445.516 2.942 50 40 IFGB Cc1ccc(OCC(=O)N/N=C2/C(=O)Nc3ccc(Br)cc32)c([N+](=O)[O-])c1 2337946 GBAYXUSECYSRDA-UHFFFAOYSA-N 433.218 2.517 50 40 IFGB CCOC(=O)CSC1=C(C#N)[C@@H](c2ccccc2OCC)[C@H](C(=O)OCC)C(=O)N1 9110610 YMOZHARHKKSQPT-MSOLQXFVSA-N 432.498 2.509 50 40 IFGB COc1cc(C(=O)NNC(=O)c2cccc(NC(=O)c3ccco3)c2)cc(OC)c1OC 10040217 OBUMTAXBDDHBGW-UHFFFAOYSA-N 439.424 2.633 50 40 IFGB Cc1cc(OCc2ccc(C(=O)NNC(=O)CN3CSCC3=O)cc2)ccc1Cl 12821386 YAYVNGHLPVINEC-UHFFFAOYSA-N 433.917 2.521 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@@H]3[C@@H]4C[C@@H]([C@H](Br)[C@@H]4Br)[C@@H]3C2=O)c1 100749344 AQAXYDDYNVXYEF-FXGIYHRPSA-N 443.091 2.667 50 40 IFGB CC(=O)Oc1cccc(/C=N/NC(=O)[C@@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)c1 408762509 BVUUCGITUSQOAR-KURUZVKSSA-N 445.541 2.764 50 40 IFGB COc1cccc(C(=O)N2CCC(C(=O)N/N=C/c3ccc(OC)c(OC)c3)CC2)c1 409007537 XRIRSSHZJCHXCI-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB COC(=O)c1cccc(Cn2c(Cl)c(/C=N/NC(=O)c3cccc(O)c3)sc2=O)c1 2238415 DSMOULCCFGGHAI-LSHDLFTRSA-N 445.884 2.868 50 40 IFGB CCOc1ccccc1N(CC(=O)N/N=C/c1ccc(OC(C)C)cc1)S(C)(=O)=O 20210478 CKPMGCSJEDSHTE-HYARGMPZSA-N 433.530 2.789 50 40 IFGB COc1cccc(/C=N/NC(=O)[C@H](COCc2ccccc2)NC(=O)OC(C)(C)C)c1O 109029295 ZAXJPWGZAZYNOB-VQXFCIMOSA-N 443.500 2.961 50 40 IFGB Cc1cc(C)cc(NC(=O)COc2ccccc2/C=N/NC(=O)C(=O)NCc2ccco2)c1 409259078 XFLYEODLJWUPSW-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1Cl)c1ccc(Cl)cc1 20209692 JTVGXZVGHOCZCP-DJKKODMXSA-N 445.284 2.818 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccc(Cl)c(Cl)c2)S(C)(=O)=O)cc1 20210356 SHJILVRYCBMDNF-KEBDBYFISA-N 430.313 2.918 50 40 IFGB O=C(COc1ccccc1-c1ccccc1)NNC(=O)[C@]1(O)CCN(Cc2ccccc2)C1 72284093 VGVJENCPDQOXGQ-SANMLTNESA-N 445.519 2.517 50 40 IFGB CCN(CC)c1ccc(/C=N/NC(=O)Cc2nnc(NC(=O)C(Cl)Cl)s2)cc1 110284679 DNVVEVUBQOWXDR-KEBDBYFISA-N 443.360 2.819 50 40 IFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1ccc(OCC#N)c(OCC)c1 408906365 IRDRHAXTIDAHNX-DUYBAWCLSA-N 438.484 2.795 50 40 IFGB CCOc1ccc(-n2nc(C(=O)N/N=C\c3cccc(OC)c3)c(C)c(C#N)c2=O)cc1 409055429 BUSKBWKPUDBPQR-QFEZKATASA-N 431.452 2.584 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(C2=NS(=O)(=O)c3ccccc32)c2ccccc2)c1 3638909 INYWSWCSEDCOIN-BUVRLJJBSA-N 448.504 2.801 50 40 IFGB Cn1c(=O)[nH]c(=O)c2c1nc(SCCCl)n2Cc1cccc(Br)c1 6444891 LFRAFYLKWCWMHW-UHFFFAOYSA-N 429.727 2.565 50 40 IFGB O=C(CSc1cccc2cccnc12)NNC(=O)C[C@](O)(c1ccco1)C(F)(F)F 14241828 DBRFRGYAINAJQY-SFHVURJKSA-N 439.415 2.908 50 40 IFGB CC(C)n1nc(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)c2ccccc2c1=O 9129527 WHAYYWUTYMUNJH-UHFFFAOYSA-N 429.436 2.976 50 40 IFGB Cc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)[C@H](C)Oc1c(C)cc(Cl)cc1C 15385733 GUBVZULBOGMFCL-AWEZNQCLSA-N 438.933 2.897 50 40 IFGB COc1ccc(CC(=O)N/N=C\c2cc(Br)cc([N+](=O)[O-])c2O)cc1OC 96912446 NNDGSMXYJJFVNA-OCKHKDLRSA-N 438.234 2.773 50 40 IFGB C[C@H]1CN(c2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)NCc2ccccc2)C[C@@H](C)O1 13659400 SVTWQVBXNAWYRC-OQSZKCJDSA-N 443.507 2.531 50 40 IFGB CCOc1ccc(/C=N/NC(=O)CN(c2cccnc2)S(=O)(=O)c2ccccc2)cc1 19952661 UIDWWVOKURZBEB-BUVRLJJBSA-N 438.509 2.826 50 40 IFGB C#CCN1C(=O)/C(=N\NC(=O)COc2ccccc2C)c2cc(Br)ccc21 2321450 JFVDRNJCDHRNMH-NMWGTECJSA-N 426.270 2.637 50 40 IFGB Cc1cc(C(=O)NNC(=O)Cc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2)c(C)o1 9378524 ZOQXCVBUZDIADV-UHFFFAOYSA-N 445.472 2.840 50 40 IFGB O=C(Cn1nnc(-c2ccc(F)cc2)n1)N/N=C/c1ccc(-c2ccccc2C(=O)O)o1 16450610 XMUQGBIALVGFPU-FOKLQQMPSA-N 434.387 2.588 50 40 IFGB O=C(/C=C/c1ccccc1Cl)NNC(=O)CCN1CCN(Cc2ccccc2)CC1 22038493 CBPWWLMFLURZFQ-ZHACJKMWSA-N 426.948 2.709 50 40 IFGB COc1ccccc1OCC(=O)N/N=C1/C(=O)N(C)c2c(C)cc(Br)cc21 100026724 VDUISVPHUCTATK-OQKWZONESA-N 432.274 2.642 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1 408906023 CEEUWRISHBNMTN-DJKKODMXSA-N 445.284 2.818 50 40 IFGB CCOCCCNC(=O)/C(C#N)=C/c1c(Oc2ccccc2OC)nc2ccccn2c1=O 3644082 RABKCZNKWKRLSE-BMRADRMJSA-N 448.479 2.945 50 40 IFGB COc1cc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)ccc1OCC(=O)O 4209660 ADTQGJBMGNYUGX-MFKUBSTISA-N 434.448 2.545 50 40 IFGB O=C(CCC(=O)Nc1ccc(Cl)cc1Cl)NNC(=O)[C@H]1CCCC[C@@H]1C(=O)O 17096760 AELDTLRCHIVTJW-RYUDHWBXSA-N 430.288 2.751 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)S(C)(=O)=O)c(C)c1 20208153 XASMUQQKXCPALN-KEBDBYFISA-N 438.893 2.781 50 40 IFGB Cc1cc(C)cc(N(CC(=O)N/N=C/c2ccc(OC3CSC3)cc2)S(C)(=O)=O)c1 20208444 ISJLCRZZJNSURV-SSDVNMTOSA-N 447.582 2.714 50 40 IFGB COc1cccc(/C=N/NC(=O)Cc2nnc(NC(=O)c3ccc(C)cc3)s2)c1O 1885918 DPGCHKJCGMDQSJ-SRZZPIQSSA-N 425.470 2.506 50 40 IFGB O=C(CCN1C(=O)/C(=C\c2ccccc2Cl)SC1=S)NNC(=O)c1cccnc1 2306894 XVPBLPMEBBUYME-XNTDXEJSSA-N 446.941 2.788 50 40 IFGB COc1c(O)cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc1I 8815974 ZRUQXBIVKQKVOI-CAOOACKPSA-N 441.181 2.678 50 40 IFGB CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@@H]1C[C@H]1c1cccc(Br)c1 96003909 WUMPPMSTUDIRKH-UONOGXRCSA-N 426.311 2.615 50 40 IFGB C[C@H](NC(=O)COc1ccccc1)C(=O)N/N=C/c1ccc(-c2ccccc2C(=O)O)o1 409172340 COYILGAQYHKAOR-MMTYYTLLSA-N 435.436 2.679 50 40 IFGB CCCOc1ccc([C@H]2[C@H]3CN(C(C)=O)CC=C3C(C#N)=C(N)C2(C#N)C#N)cc1OC 1789979 DVGAKCRXQWQNPA-UGKGYDQZSA-N 431.496 2.756 50 40 IFGB COc1ccc(C)cc1N(CC(=O)N/N=C/c1ccc(OCC(C)C)cc1)S(C)(=O)=O 20212170 ILPCUAXICMQADA-YDZHTSKRSA-N 447.557 2.955 50 40 IFGB Cc1ccc(OCC(=O)NNC(=O)CNc2nc3ccccc3s2)c2c1[C@H](C)CC2=O 32909682 HTMVUWRUPMNSBO-CYBMUJFWSA-N 438.509 2.933 50 40 IFGB COc1cc(/C=N/NC(=O)C(=O)NC[C@H]2CCCO2)cc(Cl)c1OCc1ccccc1 408612267 USXRBRKRZKMZHJ-YTIGJDNKSA-N 445.903 2.673 50 40 IFGB Cc1ccccc1N1C(=O)NC(=O)[C@H](/C=N/NC(=O)c2ccc(Cl)cc2Cl)C1=O 408528768 BWCOMLHSLCRBFT-IKDHMPEHSA-N 433.251 2.917 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccc3ccccc3c2)ccc1OCC(=O)N1CCOCC1 409012046 IPMRUQQBRFSXMM-WGOQTCKBSA-N 447.491 2.850 50 40 IFGB CCOc1cc(/C=N/NC(=O)Cn2cnc3sc4c(c3c2=O)CC[C@H](C)C4)ccc1O 954736 GRIAFDVPHXBPGM-VRVUXBDFSA-N 440.525 2.837 50 40 IFGB CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\Nc1ccc(S(=O)(=O)Nc2ccccc2C)cc1 8742116 ZLKOOMLWQVZPFZ-UYRXBGFRSA-N 436.493 2.930 50 40 IFGB C=C(C)C(=O)OCCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1ccc([N+](=O)[O-])c(Cl)c1 12857150 GVCBPEALHYBQGC-KRWDZBQOSA-N 447.831 2.992 50 40 IFGB O=C(N/N=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1ccc(Br)cc1 33957572 HYUWEASECPDOOD-UDWIEESQSA-N 433.262 2.958 50 40 IFGB CCOc1cc(/C=N/NC(=O)COc2ccccc2)cc(I)c1O 408526959 IHMYNXAVONJBBQ-VXLYETTFSA-N 440.237 2.925 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccco2)ccc1OS(=O)(=O)c1cccc([N+](=O)[O-])c1 408760687 DCRKWFHBPLWJRS-UDWIEESQSA-N 445.409 2.728 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1cc(Cl)cc(Cl)c1 409153326 LCXDDDPJXPAQFZ-AUEPDCJTSA-N 437.283 2.597 50 40 IFGB CC(C)(C)C(=O)Nc1ccc(C(=O)NNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 2054996 XEXKGKSFIHVKPZ-UHFFFAOYSA-N 429.389 2.562 50 40 IFGB N#CCCN1C(=O)/C(=N\NC(=O)CNC(=O)c2ccc(Cl)cc2Cl)c2ccccc21 2328183 SOUHGNRYTNINJM-ITYLOYPMSA-N 444.278 2.504 50 40 IFGB COc1cccc(/C=N/NC(=O)C(=O)Nc2ccccc2OC(F)(F)C(F)F)c1O 3083861 SPYQUUZBXVDPJN-NUGSKGIGSA-N 429.326 2.726 50 40 IFGB O=C1OC(=O)[C@H]2[C@H]1[C@H]1C[C@H]2[C@@H]2[C@@H](c3cc(Cl)ccc3O)c3sc(=O)[nH]c3S[C@H]12 100211363 VFAWHSQATVLVIT-HCWRQXKJSA-N 435.910 2.983 50 40 IFGB CCc1ccc(N2C[C@@H](C(=O)OCC(=O)C(C#N)=C3Nc4ccccc4N3)CC2=O)cc1 3358249 SCBXUDZMPJZBCW-INIZCTEOSA-N 430.464 2.987 50 40 IFGB O=C(CSc1nc2ccccc2c(=O)n1Cc1ccco1)NNC(=O)c1ccccc1 3372124 SWGMZJFITDAPLQ-UHFFFAOYSA-N 434.477 2.591 50 40 IFGB CCn1c(SCC(=O)NNC(=O)c2ccccc2-n2cccc2)nnc1-c1ccco1 9339043 JFTNXVPNZSWJFL-UHFFFAOYSA-N 436.497 2.902 50 40 IFGB COc1ccc(Cl)cc1C(=O)NNC(=O)C[C@H](NC(N)=O)c1ccccc1Cl 13134539 VFQGCCZICBRKQA-AWEZNQCLSA-N 425.272 2.563 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1)NC[C@@H]1CCCO1 28214824 XBZCZVVMBJROTE-XYGFXTTESA-N 447.491 2.983 50 40 IFGB Cc1ccc(N2C(=O)NC(=O)[C@@H](/C=N/NC(=O)c3ccc(Cl)cc3Cl)C2=O)cc1 408531988 HTMHYXYBVGRNJU-BMZJSHLCSA-N 433.251 2.917 50 40 IFGB COc1cccc(N(CC(=O)N/N=C/c2ccccc2O)S(=O)(=O)c2ccccc2)c1 408781597 CPMFODLVUAXCBJ-HZHRSRAPSA-N 439.493 2.746 50 40 IFGB COc1ccc(OC)c(/C=N\NC(=O)c2nn(-c3ccc(C)cc3)c(=O)c(C#N)c2C)c1 409065208 FBBMLIZYZNLKBJ-MXAYSNPKSA-N 431.452 2.502 50 40 IFGB COc1cccc(NC(=O)C(=O)N/N=C/c2ccccc2OCC(=O)Nc2ccccc2)c1 409158958 YPWIDSWUGZLFKB-MFKUBSTISA-N 446.463 2.802 50 40 IFGB CCOC(=O)[C@@](NC(=O)CCl)(Nc1sc(C)c(CC)c1C(=O)OC)C(F)(F)F 2308681 LXMJQVGHXFVEBQ-OAHLLOKOSA-N 444.859 2.994 50 40 IFGB O=C(N/N=C/c1ccc(-c2ccc(S(=O)(=O)Nc3ncccn3)cc2)o1)c1cccnc1 9491567 OCHRVQWFTDPQAK-AFUMVMLFSA-N 448.464 2.696 50 40 IFGB CC(C)(C)c1ccc(SCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 10292567 LCWSDRCEALMFHG-UHFFFAOYSA-N 434.587 2.831 50 40 IFGB CC(C)c1ccc(N(CC(=O)N/N=C/c2ccc(OCC#N)cc2)S(C)(=O)=O)cc1 20209133 KXFACLCEQQNNPU-OEAKJJBVSA-N 428.514 2.629 50 40 IFGB COc1cc(/C=N/NC(=O)[C@@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)ccc1O 408752419 AMPQLJOXKPYGKN-MNOULKQQSA-N 433.530 2.553 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2ccc(Cl)c(Cl)c2)S(C)(=O)=O)cc1 408913921 VGFXRSZZRJDJRY-KEBDBYFISA-N 430.313 2.918 50 40 IFGB COc1cc(N2CCOCC2)ccc1/C=N\NC(=O)COc1cccc(Br)c1 409228355 XTTRQYFBKVKMHT-XKZIYDEJSA-N 448.317 2.823 50 40 IFGB CC[C@@H](C)Oc1c(I)cc(/C=C(/C#N)C(=O)NC(N)=O)cc1OC 409237739 BPDVWTRFQOVNDX-QQCYMQAYSA-N 443.241 2.579 50 40 IFGB C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)c3ccccc3)ccc2Cl)C1 9545785 XWPRPACGAYYXMK-AWEZNQCLSA-N 435.933 2.835 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)[C@H](C)N(c2ccccc2)S(C)(=O)=O)cc1OCC 408923946 IMLCAPSMABJMED-CSUZIONRSA-N 445.541 2.955 50 40 IFGB COc1cc(/C=C(\C#N)C(=O)Nc2ccccc2)cc(Br)c1OCC(N)=O 409220356 XUCCRBXUZVWBIF-NTUHNPAUSA-N 430.258 2.867 50 40 IFGB COc1ccc(-c2csc(NC(=S)N[C@@H]3CS(=O)(=O)C[C@@H]3Cl)n2)cc1OC 575421093 HTCNHGFOJCJOHT-CMPLNLGQSA-N 447.991 2.518 50 40 IFGB O=C(NN(C[C@H](O)COc1ccccc1)C[C@H](O)COc1ccccc1)c1ccccc1 9236948 BPLIWWYTBBIZDG-VXKWHMMOSA-N 436.508 2.513 50 40 IFGB Cc1cc2c(c(=O)n1CCCN1CCOCC1)[C@@H](c1cccc(Cl)c1)C(C#N)=C(N)O2 20503407 JEFDLFLUYXYWEI-FQEVSTJZSA-N 440.931 2.751 50 40 IFGB CCOc1ccccc1OCC(=O)NNC(=O)c1cc(C)nc2c1nc1n2CCCCC1 40050940 SSDVIVLDDCTISP-UHFFFAOYSA-N 437.500 2.705 50 40 IFGB COc1ccc(N2C(=O)[C@H]3[C@H]4C[C@@H]([C@@H](Br)[C@@H]4Br)[C@@H]3C2=O)cc1 169682439 KHYQVLDAIPZWMH-UYYXNEDZSA-N 429.108 2.978 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 409026263 KGCVNEUQEUGRGI-UFFVCSGVSA-N 444.391 2.530 50 40 IFGB O=C(CN1CCOCC1)N/N=C/c1c(Oc2nc(Cl)ncc2F)ccc2ccccc12 409063158 HURHAEIEAOTESX-OPEKNORGSA-N 443.866 2.997 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)NC2CC2)cc1)Nc1cc(Cl)cc(Cl)c1 409259319 YTAZGXRBIFSOJI-AUEPDCJTSA-N 449.294 2.740 50 40 IFGB Cc1cccc2c1NC(=O)/C2=N\NC(=O)[C@H](C)n1cnc2sc3c(c2c1=O)CC[C@H](C)C3 6166504 MKLAYLHVVBEPPC-AAEUAGOBSA-N 449.536 2.925 50 40 IFGB CCOc1ccc(C(=O)NNC(=O)[C@@H](NC(=O)c2c(F)cccc2F)C(C)C)cc1OC 9634248 DUTFZUBONCYYRE-IBGZPJMESA-N 449.454 2.588 50 40 IFGB O=C(CSc1nncn1-c1ccccc1)NNC(=O)c1ccc(Br)cc1 9963784 FDPMMEOXDJTXFC-UHFFFAOYSA-N 432.303 2.583 50 40 IFGB COC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1 12917550 NPYJFORIXSXGAN-UHFFFAOYSA-N 444.465 2.577 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C\c2cccc(Cl)c2)cc1Cl 33743324 HUUKZAHAHYLSGI-JMIUGGIZSA-N 430.313 2.773 50 40 IFGB CN1C(=O)/C(=N\NC(=O)Cn2cnc3sc(-c4ccccc4)cc3c2=O)c2ccccc21 958358 YTSHXLAYGRKFFZ-QOMWVZHYSA-N 443.488 2.622 50 40 IFGB Cc1c(CBr)[n+]([O-])c2c([n+]1[O-])[C@@H](Br)CC[C@H]2Br 1232535 SJFFCHWYKKXQSL-NKWVEPMBSA-N 430.922 2.823 50 40 IFGB CCOc1ccc(-c2[nH]nc3c2[C@H](c2ccc(OCC(N)=O)cc2)C(C#N)=C(N)O3)cc1 9159486 SLRXMCLIKHBOHT-LJQANCHMSA-N 431.452 2.558 50 40 IFGB O=C(CN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)NNC(=O)c1ccccc1O 8661004 YNZICOVAKUSEEF-NPDFUIFFSA-N 439.518 2.611 50 40 IFGB CC[C@@H](C)c1ccc(OCC(=O)NNC(=S)NC(=O)c2cccc([N+](=O)[O-])c2)cc1 12291914 UDZLXRQFHCFVLP-CYBMUJFWSA-N 430.486 2.823 50 40 IFGB O=C(NNC(=O)c1cc(S(=O)(=O)Nc2ccc(F)cc2)ccc1Cl)c1ccccn1 12811521 ZDIJXMBERIEQNZ-UHFFFAOYSA-N 448.863 2.750 50 40 IFGB Cc1ccc(SCc2c(C(=O)N/N=C/[C@H]3CC=CCC3)nnn2-c2nonc2N)cc1 13143949 YTPILWYEXPDZFM-HYLGSWLWSA-N 438.517 2.905 50 40 IFGB CCc1sc(C(=O)NNC(=O)CN(C)[C@H](c2cccc(F)c2)c2cnn(C)c2)cc1C 72305152 FTBMCOQMKQVDMW-OAQYLSRUSA-N 443.548 2.974 50 40 IFGB COc1c(Br)cc(/C=C(\C#N)C(=O)N2CCOCC2)cc1Br 408753339 LZXMTXVUQYEEBR-IZZDOVSWSA-N 430.096 2.986 50 40 IFGB COC(=O)c1ccc(/C=N/NC(=O)COc2ccc([N+](=O)[O-])cc2Br)cc1 1427507 XVYDSVHDDNESQG-DJKKODMXSA-N 436.218 2.673 50 40 IFGB CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc3ccccc3c2)c2ccccc2c1=O 13019257 PXNUAFRTLZCCNZ-UHFFFAOYSA-N 436.493 2.754 50 40 IFGB C/C(=N\NC(=O)c1ccc(C)cc1C)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1 13459873 JSLYXXBFDWUOKM-XQNSMLJCSA-N 431.514 2.601 50 40 IFGB COC(=O)COc1c(Cl)cc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc1OC 33623863 FLHBIEFNMVORNK-FBHDLOMBSA-N 435.820 2.501 50 40 IFGB CCCOc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(OC)cc2OC)cc1OCC 59515656 FPGKJXFJSTZJQC-OEAKJJBVSA-N 429.473 2.980 50 40 IFGB Cc1c(C(=O)N/N=C\c2ccc([N+](=O)[O-])cc2)nn(-c2ccc(Cl)cc2)c(=O)c1C#N 409064306 CNFDMLGHHGWHIX-KSEXSDGBSA-N 436.815 2.738 50 40 IFGB CCc1sc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccs3)CC2)cc1C 13137818 KGASDLQTOMRAHS-UHFFFAOYSA-N 441.600 2.542 50 40 IFGB COc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)Nc3ccccc3)cc2)cc1 58880745 KWEDWEXOSZVGGM-MFKUBSTISA-N 446.463 2.802 50 40 IFGB COc1cccc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)c1 59921755 QNJXDFSWVRDIKF-HYARGMPZSA-N 435.933 2.900 50 40 IFGB Cc1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C(=O)O)cc2)cc1 409370547 SVCXBMKPJUAOPR-RAUXBKROSA-N 433.464 2.531 50 40 IFGB Cc1nn(-c2ccccc2)c(Cl)c1/C=N/NC(=O)C(=O)Nc1ccc2c(c1)OCO2 2786850 GCSDNWHDKTVJAJ-LSHDLFTRSA-N 425.832 2.652 50 40 IFGB O=C(O)c1ccccc1N1C(=O)[C@H]2C[C@@H](Br)[C@H](Br)C[C@@H]2C1=O 4133801 MRHFWRGYDKVVEI-UKKRHICBSA-N 431.080 2.811 50 40 IFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)[C@H]1CC(=O)N(c2ccc(Br)cc2)C1 8691537 VSZZBHCIDZHCAX-NPNVKNKFSA-N 431.246 2.861 50 40 IFGB COc1cccc(NC(=O)C(=O)N/N=C(\C)CC(=O)Nc2ccccc2Br)c1 16136787 AZGZYRJLCBULTF-FSJBWODESA-N 447.289 2.917 50 40 IFGB COc1ccc(N([C@@H](C)C(=O)N/N=C/c2c(F)cccc2Cl)S(C)(=O)=O)cc1 20214898 RDGJAUXIELFLHM-OVMKCGGTSA-N 427.885 2.793 50 40 IFGB O=C(N/N=C1\C(=O)N(CCc2ccccc2)c2ccccc21)[C@@H]1COc2ccccc2O1 103735049 PHWOUAMHAIOCET-NFLAHJKKSA-N 427.460 2.936 50 40 IFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Br)cc2)C1)c1ccccc1Cl 115132074 BYPNOOLFQLWLHA-LLVKDONJSA-N 436.693 2.917 50 40 IFGB CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)cc1 12364849 QSQGKEQHWTZSJZ-JTQLQIEISA-N 446.312 2.729 50 40 IFGB CC(C)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NNC(=O)c1cc(Cl)cn1C 12394535 QWMBUEMQLSMHBR-IYZRDUGGSA-N 434.968 2.797 50 40 IFGB COc1ccc2cc(/C=N/NC(=O)CN(c3ccccc3)S(C)(=O)=O)c(Cl)nc2c1 13371834 WJLVQTKKBSXDQG-WSDLNYQXSA-N 446.916 2.813 50 40 IFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)C(=O)Nc1ccccc1OC(F)(F)C(F)F 38187739 NTXYJHICDRZASU-GZIVZEMBSA-N 444.297 2.626 50 40 IFGB COC(=O)c1ccc(N2C(=O)[C@@H]3C[C@H](Br)[C@H](Br)C[C@H]3C2=O)cc1 102065875 ZAMKNSHEIWXLKP-LPWJVIDDSA-N 445.107 2.900 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2cccnc2)c2ccc(F)cc2)cc1 408880910 KIYXUGOILKLHGI-ZVHZXABRSA-N 426.473 2.875 50 40 IFGB COc1ccc(-c2csc(NC(=S)N[C@H]3CS(=O)(=O)C[C@H]3Cl)n2)cc1OC 575421103 HTCNHGFOJCJOHT-PWSUYJOCSA-N 447.991 2.518 50 40 IFGB Cc1nc2cc(C(=O)NNC(=O)[C@H](C)Oc3cccc(Br)c3)ccc2n1C 58269083 OVKHFTHYHTXNPW-NSHDSACASA-N 431.290 2.873 50 40 IFGB CCOc1ccc(/C=N/NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)cc1 408993603 WSDTVQUBIXTBJW-QMPKWXHSSA-N 435.484 2.796 50 40 IFGB COc1ccc(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1OC 713373 HRALPONOJGDXOB-HZHRSRAPSA-N 445.541 2.563 50 40 IFGB O=C(NNC(=O)C1CCN(C(=O)c2ccc(F)cc2)CC1)c1cc(-c2ccccc2)n[nH]1 9546056 BLKHGKROLGPOHP-UHFFFAOYSA-N 435.459 2.529 50 40 IFGB CCOC(=O)[C@@H](NC(=O)C(Cl)Cl)[C@@H](OC(=O)C(Cl)Cl)c1ccccc1 100538198 GPGUHASJQNXDSM-UWVGGRQHSA-N 431.099 2.926 50 40 IFGB Cc1ccc(N2C[C@H](C(=O)NNC(=O)c3cccc(Br)c3)CC2=O)cc1C 408614756 HHDBDIFMWTWRPR-OAHLLOKOSA-N 430.302 2.880 50 40 IFGB COc1cccc(/C=N\NC(=O)c2nn(-c3ccc(Cl)cc3)c(=O)c(C#N)c2C)c1O 409062137 OHQAQABIDAWWIQ-MYKKPKGFSA-N 437.843 2.544 50 40 IFGB Nn1c(SCC(=O)NNC(=O)c2ccccc2)nnc1-c1cc(Cl)ccc1Cl 9666348 ZUSDZNPNQDYEBV-UHFFFAOYSA-N 437.312 2.519 50 40 IFGB O=C1NC[C@@H](c2ccccc2)[C@H]1C(=O)N/N=C\c1cc(Br)cc(Cl)c1O 15938662 ZRBLVZDXBNJEEB-WMZFCMMGSA-N 436.693 2.788 50 40 IFGB CC/C(=N\NC(=O)CN(c1ccccc1C)S(C)(=O)=O)c1ccc(OC)c(OC)c1 20207510 SLQBORXYCDFDJV-OQKWZONESA-N 433.530 2.709 50 40 IFGB COCCCNC(=O)C(=O)N/N=C/c1cc(Cl)c(OCc2ccccc2)c(OC)c1 408613219 ZVADDNUVMYBUEM-ZMOGYAJESA-N 433.892 2.530 50 40 IFGB Cc1cc(C)c2[nH]c(C)c(CC(=O)NNC(=O)CCC(=O)NCCc3ccccc3)c2c1 9762391 MYJNWOPSULVZDQ-UHFFFAOYSA-N 434.540 2.922 50 40 IFGB Cc1ccc(S(=O)(=O)NNC(=O)c2sc(-c3ccccc3)nc2C)cc1[N+](=O)[O-] 12747252 ZXMJWBCRPQUEBT-UHFFFAOYSA-N 432.483 2.958 50 40 IFGB COc1ccc(OC)c(NC(=O)C(=O)N/N=C/c2cc(Br)ccc2OC)c1 59515659 QTUQIGPNNVNCLU-KEBDBYFISA-N 436.262 2.564 50 40 IFGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccccc1 408979049 KYIVGUSBFQAWLR-UGVMZYNRSA-N 428.401 2.651 50 40 IFGB Cn1nnnc1[C@H](Br)CC(Br)(Br)Br 2311465 DNNFSWCBNJHVGT-GSVOUGTGSA-N 441.747 2.875 50 40 IFGB COc1cc(/C=N/NC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)ccc1OCC(N)=O 9305876 SURDYWHMOWVXBX-XARWVIDASA-N 440.283 2.784 50 40 IFGB O=S(=O)(CBr)Nc1ccc2c(c1)CCCN2S(=O)(=O)c1ccccc1 12180422 XLLNIKQLAJVWPG-UHFFFAOYSA-N 445.360 2.922 50 40 IFGB CSCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)c1ccncc1 15272760 RQZHNIGPZMZXPY-OAHLLOKOSA-N 441.340 2.701 50 40 IFGB CCCS(=O)(=O)Nc1cccc(C(=O)NNC(=O)c2cc3ccccc3cc2O)c1 24745420 NWGMQUNIOIRYDF-UHFFFAOYSA-N 427.482 2.772 50 40 IFGB CCN(CC)c1ccc(/C=N\NC(=O)C(=O)N/N=C\c2ccc(N(CC)CC)cc2)cc1 31637150 ZOTUMTITZGNJDR-MFYXSQMNSA-N 436.560 2.979 50 40 IFGB CC(C)C(=O)NNC(=O)CSc1nnc(-c2cccnc2)n1-c1ccc(Cl)cc1 35310724 WFINOKUDUOGGIX-UHFFFAOYSA-N 430.921 2.878 50 40 IFGB Cc1ccc(S[C@H](C)C(=O)N/N=C/c2ccc(OCC(=O)N3CCOCC3)cc2)cc1 409116200 LFDKHVGNEPGEOQ-LSPPGFKNSA-N 441.553 2.864 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1Br)c1ccccc1F 409184761 MZIRBKMONLUCJM-VXLYETTFSA-N 428.283 2.505 50 40 IFGB C#CCOc1ccc(Br)cc1/C=N/NC(=O)Cc1ccc2c(c1)OCCO2 9489287 LBKBJOBVSSGBRY-LPYMAVHISA-N 429.270 2.925 50 40 IFGB C[C@H]1CN(C(=O)/C(C#N)=C2\N=C(NC(=O)c3ccccc3F)c3ccccc32)C[C@@H](C)O1 11692119 RKRXGFBPKXTEJR-MWFYHVDJSA-N 432.455 2.886 50 40 IFGB COc1cccc(/C=N/NC(=O)CN2CCN(Cc3ccccc3Cl)CC2)c1OC 22807430 SWDRFBFKQNMSIE-ZVHZXABRSA-N 430.936 2.625 50 40 IFGB CCOC(=O)COc1ccc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc1OCC 33792939 LCNBAALFDIVQCR-XKZIYDEJSA-N 429.429 2.628 50 40 IFGB O=C(N/N=C1\C(=O)N(CN2CCCC2)c2ccc(Br)cc21)c1ccccc1 100057019 CVWDIQNKWJLVOW-PYCFMQQDSA-N 427.302 2.983 50 40 IFGB CCN(CC)C(=O)C1=C(C)N=C2SC(C#N)=C(N)N2[C@@H]1c1ccc(C(=O)OC)cc1 408607702 UJGYEQZXWQBGOL-QGZVFWFLSA-N 425.514 2.726 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)CN(c2ccc(C)cc2C)S(C)(=O)=O)cc1OC 408778658 JTCBTJOLNVXGII-CJLVFECKSA-N 433.530 2.627 50 40 IFGB Cc1ccc(CN2C[C@H](C(=O)NNC(=O)CSc3cccc4cccnc34)CC2=O)cc1 9995964 QUOLTTLLVPJNHQ-LJQANCHMSA-N 448.548 2.831 50 40 IFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1ccc(I)cc1 10476090 RFIVOSAPNFCKHG-YBFXNURJSA-N 449.204 2.975 50 40 IFGB COc1ccccc1N1C(=O)NC(=O)[C@@H](/C=N/NC(=O)c2ccc(Cl)cc2Cl)C1=O 408533558 KBCLWVJPMUFTBN-JZKLSJHFSA-N 449.250 2.617 50 40 IFGB COc1cc(/C=N/NC(=O)c2ccccc2N)cc(I)c1OC 409039349 GJQHNONVUYJYSB-DJKKODMXSA-N 425.226 2.655 50 40 IFGB O=C(COc1cccc(/C=N/NC(=O)C(=O)NC2CC2)c1)Nc1cc(Cl)cc(Cl)c1 409261224 BZSAFSOJSIOHKC-AUEPDCJTSA-N 449.294 2.740 50 40 IFGB COc1ccc(C)cc1N(CC(=O)N/N=C/c1ccc(OC(C)C)cc1)S(C)(=O)=O 20212262 PCAPKRALENEFRY-LPYMAVHISA-N 433.530 2.707 50 40 IFGB COc1ccc(/C=N\NC(=O)c2nn(-c3ccc(C)c(C)c3)c(=O)c(C#N)c2C)c(OC)c1 409056805 IJHYUMDBMHZLEQ-ZMFRSBBQSA-N 445.479 2.811 50 40 IFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1cc(Br)ccc1O 409066473 VRDSHQFELMMOKC-RGVLZGJSSA-N 449.261 2.663 50 40 IFGB COc1c(O)ccc(/C=N/NC(=O)c2cccc(I)c2)c1[N+](=O)[O-] 2744350 FXODRIDIUORUQF-CAOOACKPSA-N 441.181 2.678 50 40 IFGB CCOc1ccc(-c2[nH]nc3c2[C@@H](c2ccc(OCC(N)=O)cc2)C(C#N)=C(N)O3)cc1 9159485 SLRXMCLIKHBOHT-IBGZPJMESA-N 431.452 2.558 50 40 IFGB Cc1ccc(S(=O)(=O)CCC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1 9544499 HSTWSZLQRAUILK-QGZVFWFLSA-N 440.521 2.927 50 40 IFGB C[C@@H]1C[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1 12605087 VAOWYLMCQBABOQ-BDJLRTHQSA-N 441.431 2.923 50 40 IFGB COc1ccc(-c2ccc(/C=C3\C(=O)N(CCCO)C(=O)C(C#N)=C3C)o2)c([N+](=O)[O-])c1 16694012 GWZGEGUHRHNGEI-YVLHZVERSA-N 437.408 2.838 50 40 IFGB COc1cc(/C=N/NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc(Br)c1O 59459043 SACCJCAUDULCIW-REZTVBANSA-N 439.178 2.744 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)cc1C 408845608 GUBAUEXXLXMGEI-MNOULKQQSA-N 435.933 2.960 50 40 IFGB Cc1cccc(C(=O)NNC(=O)CSc2nnc3c(C)cc4cc5c(cc4n23)OCO5)c1 887105 ZVOJVZKARIIHAG-UHFFFAOYSA-N 449.492 2.781 50 40 IFGB COCc1cc(C)n(CC(=O)N/N=C/c2cc(C)n(-c3ccc(F)cc3)c2C)c(=O)c1C#N 98087084 IPVBKFNGSSEYBD-KKMKTNMSSA-N 449.486 2.872 50 40 IFGB CN(C)c1ccc(/C=N/NC(=O)CN(Cc2ccco2)S(=O)(=O)c2ccccc2)cc1 408974693 GWLKAYLULVDOBP-HZHRSRAPSA-N 440.525 2.687 50 40 IFGB COCCn1c(SCC(=O)C(C#N)=C2Nc3ccccc3N2)nc2ccccc2c1=O 3322366 PBDSWDCBWPKUGD-UHFFFAOYSA-N 433.493 2.977 50 40 IFGB COc1cc(/C=N/NC(=O)c2cccnc2)ccc1OS(=O)(=O)c1ccc(C)cc1 3335239 RFYHZLAPBIYWOM-YDZHTSKRSA-N 425.466 2.930 50 40 IFGB O=C(CN(c1ccccc1)S(=O)(=O)c1ccccc1)N/N=C/c1cccc([N+](=O)[O-])c1 19947716 PPRORPYUEOQZMP-PXLXIMEGSA-N 438.465 2.940 50 40 IFGB O=C(CSc1nnc(Nc2ccccc2)s1)NNC(=O)c1ccc([N+](=O)[O-])cc1 3532140 SABKLQAYZDDHFB-UHFFFAOYSA-N 430.471 2.743 50 40 IFGB O=C(N/N=C/c1ccc(O)cc1O)/C(=C\c1ccc2c(c1)OCO2)NC(=O)c1ccccc1 9514051 DEXQXCCLSSGWBI-FRPIRNKASA-N 445.431 2.748 50 40 IFGB Cc1ccc(C(=O)NNC(=O)CSc2nnc3c4c(C)c(C)sc4ncn23)cc1 12491103 ACWZWARZURHBML-UHFFFAOYSA-N 426.527 2.818 50 40 IFGB Cc1cc(OCc2ccc(C(=O)NNC(=O)CCSCC(N)=O)cc2)ccc1Cl 32772289 LSOVPIPJHFGZQK-UHFFFAOYSA-N 435.933 2.597 50 40 IFGB Cc1ccc(N2C(=O)[C@@H](/C=N\NC(=O)Cc3cccc4ccccc34)C(=O)NC2=S)cc1 408765100 ZHRBPBICLRKUHC-FQOPDIHJSA-N 444.516 2.857 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc(Cl)cc1Cl)c1cccc([N+](=O)[O-])c1 409027347 CMUAMZBXGRYFJN-DJKKODMXSA-N 445.284 2.818 50 40 IFGB COc1cccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(Br)cc3)C2)c1O 409159107 QABLHRXKYYNFBB-WVISFHDSSA-N 432.274 2.667 50 40 IFGB C[C@@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1N)C(=O)NNC(=O)c1ccccc1 14240692 LCOBZEGHSGVKRU-CQSZACIVSA-N 438.557 2.898 50 40 IFGB COc1cc(/C=N/NC(=O)c2cc(Br)ccc2OC)ccc1OCC(=O)O 408749011 JVLJREXCFOIMOM-AWQFTUOYSA-N 437.246 2.694 50 40 IFGB COc1cc(/C=N/NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)ccc1C 408868336 NZVDYIBZVHRYGW-MNOULKQQSA-N 435.933 2.960 50 40 IFGB Cc1cccc(N(CC(=O)N/N=C/c2ccc(Br)cc2)S(C)(=O)=O)c1C 408922736 RRJYOKQXNJSBRI-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB O=C(CSc1nnnn1-c1ccccc1)N/N=C/c1ccc(-c2ccccc2C(=O)O)o1 2190365 NOEJXYIQBFBWOS-WSDLNYQXSA-N 448.464 2.863 50 40 IFGB O=C(Oc1cccc(/C=N/NC(=O)[C@H]2COc3ccccc3O2)c1)c1ccc2c(c1)OCO2 3143910 KWYGDBSTTBORAG-XZVVGHKBSA-N 446.415 2.925 50 40 IFGB O=C(NNc1ccccc1C(F)(F)F)C1CCN(S(=O)(=O)c2cccnc2)CC1 40086635 HOIBDPMPRVZWAL-UHFFFAOYSA-N 428.436 2.644 50 40 IFGB CCCN1C(=O)/C(=N/NC(=O)[C@@H]2COc3ccccc3O2)c2cc(Br)ccc21 100180713 FCSWSAZZLFDENR-VPMFXMNOSA-N 444.285 2.866 50 40 IFGB N#C/C(=C/c1ccc(OCC(N)=O)cc1)C(=O)Nc1ccccc1I 408766141 ZREJKXHMNHDZGY-LCYFTJDESA-N 447.232 2.701 50 40 IFGB Cc1ccc(NC(=O)COC(=O)[C@@H]2[C@@H]3C[C@@H]4[C@@H]2C(=O)O[C@@H]4[C@@H]3Br)cc1Cl 9581304 LHNFQEOINWNGMO-YYNMDHDQSA-N 442.693 2.701 50 40 IFGB CN(CC(=O)NNC(=O)c1cc2ccccc2s1)S(=O)(=O)c1ccc(Cl)cc1 12859209 VCIXUWWJYFCJIJ-UHFFFAOYSA-N 437.930 2.636 50 40 IFGB CC1=C(C#N)C(=O)N([C@H]2CCS(=O)(=O)C2)C(=O)/C1=C\Nc1ccc(Cl)cc1Cl 13655625 CPISOWKWPWQFEQ-QENILXLESA-N 440.308 2.685 50 40 IFGB O=C(NNC(=S)Nc1ccccc1F)c1ccc(S(=O)(=O)N2CCCCC2)cc1 15847426 UJXWOBJBPGLTDW-UHFFFAOYSA-N 436.534 2.632 50 40 IFGB COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc(C)cc3)c2)cc1 17254553 YGFMNRBPOXHWCT-UHFFFAOYSA-N 439.493 2.879 50 40 IFGB COc1ccc(Cl)cc1N(CC(=O)N/N=C/c1ccc(SC)cc1)S(C)(=O)=O 20212130 HJGZMMKITQEION-RGVLZGJSSA-N 441.962 2.987 50 40 IFGB C[C@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(OCC(=O)NC[C@@H]2CCCO2)cc1 28214121 JZVJKAAQCOKHQV-IUCABKQXSA-N 441.553 2.992 50 40 IFGB Cn1/c(=N/NC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)sc2ccccc21 12524114 NSJOZYQWWGONPI-XDOYNYLZSA-N 430.555 2.660 50 40 IFGB O=C(NNS(=O)(=O)c1ccc(Cl)cc1)c1ccc(I)cc1 16401031 DOTUECYWLZQNDQ-UHFFFAOYSA-N 436.658 2.568 50 40 IFGB CC(C)(C)OC(=O)NCCC(=O)NNC(=O)[C@H]1C[C@@H]1c1cccc(Br)c1 96003908 WUMPPMSTUDIRKH-KGLIPLIRSA-N 426.311 2.615 50 40 IFGB COC(=O)COc1cc(Br)c(/C=C(/C#N)C(=O)NC2CCCC2)cc1OC 409188801 AOUCDPRKSCZMKF-QPEQYQDCSA-N 437.290 2.975 50 40 IFGB Cc1c(C(=O)N/N=C/c2ccc(OCC(=O)NCc3ccco3)cc2)cccc1[N+](=O)[O-] 13942815 SYSSSPJFKPRAKG-WYMPLXKRSA-N 436.424 2.955 50 40 IFGB COc1ccccc1OCC(=O)N/N=C1\C(=O)N(CN2CCCCCC2)c2ccccc21 101084799 FDFROPGVBPCPTF-RWEWTDSWSA-N 436.512 2.775 50 40 IFGB CCN(CC)c1ccc(N2/C(=N\C(=O)CCl)S[C@@H]3CS(=O)(=O)C[C@H]32)c(C)c1 101319373 JZBXTGOQOMVTPL-SJTPKYKMSA-N 429.995 2.681 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccc(C(C)C)cc2)S(C)(=O)=O)cc1OC 408783121 KGZINIHIRVKQHQ-LPYMAVHISA-N 433.530 2.744 50 40 IFGB COc1ccc(N(CC(=O)N/N=C(\C)c2ccc(Cl)cc2)S(C)(=O)=O)cc1OC 408784864 CTCINZLGFIFPOW-FYJGNVAPSA-N 439.921 2.664 50 40 IFGB CCOC(=O)CC(=O)CSC1=C(C#N)[C@@H](c2ccc(C)cc2)[C@H](C(=O)OC)C(O)=N1 2226901 JNPAAZLQVRBIHF-MSOLQXFVSA-N 430.482 2.829 50 40 IFGB O=C(NNC(=O)[C@@H]1CS[C@@]2(c3ccccc3)CCC(=O)N12)c1cc2c(s1)CCCC2 22968085 KVMWBDSRAGEPTD-KSFYIVLOSA-N 441.578 2.979 50 40 IFGB CCN1c2ccccc2C2=C([C@H](c3ccc(C(=O)OC)cc3)C(C#N)=C(N)O2)S1(=O)=O 57510562 VGRZHOCPZRHEPB-GOSISDBHSA-N 437.477 2.819 50 40 IFGB O=C(COC(=O)c1n[nH]c(=O)c2ccccc12)NN=C(c1ccccc1)c1ccccc1 8825254 QCPIXRHBTHCJJR-UHFFFAOYSA-N 426.432 2.649 50 40 IFGB Cc1c(CBr)[n+]([O-])c2c([n+]1[O-])[C@H](Br)CC[C@@H]2Br 17595991 SJFFCHWYKKXQSL-RQJHMYQMSA-N 430.922 2.823 50 40 IFGB O=C(NNS(=O)(=O)c1ccc(F)cc1)c1cc(C(F)(F)F)nc(C(F)(F)F)c1 22996452 XEGQLQMMATXPRC-UHFFFAOYSA-N 431.289 2.882 50 40 IFGB CCOC(=O)COc1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1OC 59333015 JASUSYFHVZCHNA-HKWRFOASSA-N 449.507 2.893 50 40 IFGB COc1cc(/C=C/C(=O)NNC(N)=S)cc(Br)c1OCc1ccccc1 62715017 FZDRJISIWZGZGB-BQYQJAHWSA-N 436.331 2.914 50 40 IFGB CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(C[C@H]4CCCO4)c(=O)c32)cc1OC 1264778 FKCFWYNHXGOBNA-IIBYNOLFSA-N 437.496 2.961 50 40 IFGB COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4ccccn4)c(=O)c32)cc1OC 1471749 YUBGFWXCUDRZJD-NRFANRHFSA-N 430.464 2.835 50 40 IFGB COC(=O)Cc1nn(-c2ccccc2)c2c1[C@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 9972222 LGPMONYDCOCCJV-OAQYLSRUSA-N 429.480 2.872 50 40 IFGB O=C(N/N=C/c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1)c1ccccc1O 15134705 RSHYVTPMALFNDA-FYJGNVAPSA-N 441.421 2.832 50 40 IFGB CCCOc1ccc(/C=N/NC(=O)[C@@H](C)N(c2ccc(OC)cc2)S(C)(=O)=O)cc1 20214793 UEJGXAWYXYKMLR-QFNCUCFLSA-N 433.530 2.789 50 40 IFGB COc1ccc(-c2noc(CCC(=O)NNC(=O)Cc3c[nH]c4ccccc34)n2)cc1OC 32780861 RTNVNNTUVGUGFT-UHFFFAOYSA-N 449.467 2.558 50 40 IFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccccc1Br 115258277 HHUKSRWBGCIAQK-LLVKDONJSA-N 436.693 2.917 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)[C@@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)c1 408754030 LQGFIUJDNCUBPJ-RXULLKCLSA-N 447.557 2.856 50 40 IFGB Cc1cc(C)cc(N(CC(=O)NN=C2CCN(Cc3ccccc3)CC2)S(C)(=O)=O)c1 409335773 ZJSLKQLNXVIPNX-UHFFFAOYSA-N 442.585 2.838 50 40 IFGB Nc1nonc1-n1nnc(C(=O)N/N=C/c2cccc3ccccc23)c1-c1cccs1 2453477 ZSHHFUBSAFPJMH-SSDVNMTOSA-N 430.453 2.878 50 40 IFGB CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3C[C@@H](Cl)C4=CC(=O)C=C[C@]4(C)[C@H]3C(=O)C[C@@]21C 118926890 RACDDTQBAFEERP-RWWZUALXSA-N 434.916 2.554 50 40 IFGB COCCNC(=O)C(=O)N/N=C/c1cc(Br)ccc1Nc1ccc(F)cc1 408708926 VKUHMOVMUBHDIF-SSDVNMTOSA-N 437.269 2.545 50 40 IFGB CC(C)C(=O)N/N=C/c1ccc(CNC(=O)C(=O)Nc2cc(Cl)cc(Cl)c2)o1 408870546 SXMYWGCCSHKHOL-LSFURLLWSA-N 425.272 2.947 50 40 IFGB COc1cc(/C=N/NC(=O)CNC(=O)c2cccc(F)c2)ccc1OC(=O)c1ccccc1 3116365 XLRLGLDNYYMYDQ-MZJWZYIUSA-N 449.438 2.934 50 40 IFGB N#Cc1ccccc1-c1nnn(CC(=O)N/N=C/c2cc([N+](=O)[O-])c(Cl)cc2Cl)n1 3205796 FODKKIQTEAMGQT-ODCIPOBUSA-N 445.226 2.577 50 40 IFGB CCOC(=O)Cn1c(C)c(/C=N/NC(=O)CNc2ccc3c(c2)OCO3)c2ccccc21 409171658 BZIUSIYQPCYODU-OPEKNORGSA-N 436.468 2.804 50 40 IFGB O=C(NNC(=O)c1ccccc1F)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1 2616492 YIQODFFOKRCDKF-UHFFFAOYSA-N 439.468 2.652 50 40 IFGB CN(C)c1ccc(/C=C(\C#N)C(=O)OCC(=O)Nc2ccccc2C(=O)NC2CC2)cc1 11162330 DAPUWTQOWWRBFY-GHRIWEEISA-N 432.480 2.734 50 40 IFGB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)[C@H](C)Oc1ccc2ccccc2c1 12891593 ZSPDJLIMWOKXAT-AWEZNQCLSA-N 429.454 2.833 50 40 IFGB COc1ccc(N2C(=O)NC(=O)[C@@H](/C=N/NC(=O)c3ccc(Cl)cc3Cl)C2=O)cc1 108972525 RCOLLSXZXVNGLP-BMZJSHLCSA-N 449.250 2.617 50 40 IFGB Cc1cccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NCc3ccccc3)cc2)c1 409173276 ICEGGVNVHCIMPJ-JVWAILMASA-N 444.491 2.779 50 40 IFGB O=C(COc1ccc(I)cc1)N/N=C/c1ccc([N+](=O)[O-])s1 3174941 AKNNOPWTUXIXCF-VIZOYTHASA-N 431.211 2.790 50 40 IFGB O=C(CNC(=O)c1ccc(Oc2ccccc2)cc1)NNC(=O)COc1cccc(F)c1 9882423 BPNKBRPVGLQNKD-UHFFFAOYSA-N 437.427 2.574 50 40 IFGB COc1cc(C(=O)NNC(=O)N(C)CCOc2cc(C)cc(C)c2)cc(OC)c1OC 9884890 LJOFXBPYZIYUQT-UHFFFAOYSA-N 431.489 2.694 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2cccc3ccccc23)S(C)(=O)=O)cc1OC 19955106 TVLICLHDBZTJMR-OEAKJJBVSA-N 441.509 2.773 50 40 IFGB CCN(CC)c1ccc(C(=O)NNC(=O)C23C[C@H]4C[C@@H](CC(NC(C)=O)(C4)C2)C3)cc1 102825342 MJVICKAWSIJVFY-RDNZODCXSA-N 426.561 2.769 50 40 IFGB CCOc1cc(/C=C(/C#N)C(=O)NC(C)C)c(Br)cc1OCC(=O)OC 408767773 NUQHFWDPWOBCEW-MLPAPPSSSA-N 425.279 2.831 50 40 IFGB COc1ccccc1N(CC(=O)N/N=C/c1ccc(Cl)c(Cl)c1)S(C)(=O)=O 408927262 YWKYLGIDVWUQAL-KEBDBYFISA-N 430.313 2.918 50 40 IFGB O=C(CSc1cccc2cccnc12)NNC(=O)C[C@@](O)(c1ccco1)C(F)(F)F 14241829 DBRFRGYAINAJQY-GOSISDBHSA-N 439.415 2.908 50 40 IFGB O=C(CCN1C(=O)COc2ccccc21)NNC(=O)COc1ccccc1-c1ccccc1 14252778 BUWDFJYIDUVXGF-UHFFFAOYSA-N 445.475 2.696 50 40 IFGB CCc1ccc(N2C[C@@H](C(=O)NNC(=O)c3cccc(Br)c3)CC2=O)cc1 408615321 OWURITCZOOSHNA-HNNXBMFYSA-N 430.302 2.826 50 40 IFGB COC(=O)c1ccc(/C=N/NC(=O)c2ccc(I)c(OC)c2)cc1 408747120 JJPKEOHIQYIJJD-VXLYETTFSA-N 438.221 2.850 50 40 IFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccccc1 408979047 KYIVGUSBFQAWLR-FPQGOQEYSA-N 428.401 2.651 50 40 IFGB Cc1ccc([C@@H]2CC(=O)C3=C(C2)OC(N)=C(C#N)[C@@]32C(=O)N(CO)c3ccccc32)cc1 17095365 ZRVDCLMXVAPTES-PUAOIOHZSA-N 427.460 2.654 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2cccnc2)S(=O)(=O)c2ccc(F)cc2)cc1 20231962 SIQMRDJQXFCISZ-ZVHZXABRSA-N 426.473 2.875 50 40 IFGB CC[C@H](C)C(=O)N(NC(=O)c1ccccc1)[C@H]1CC(=O)N(c2cc(C)ccc2OC)C1=O 96287350 OZMXKHPNQBEBDH-LPHOPBHVSA-N 437.496 2.855 50 40 IFGB Cc1ccc(N2C[C@H](C(=O)NNC(=O)c3ccccc3Br)CC2=O)cc1C 408616183 WYPDBVLROSDFQD-CQSZACIVSA-N 430.302 2.880 50 40 IFGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 408868986 QIUKPSAIXBGMMC-RONKMWSCSA-N 436.877 2.552 50 40 IFGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1cc(OC)c(O)c([N+](=O)[O-])c1)c1ccccc1 408982541 YNHGTXCETJCUDA-NGZBARDMSA-N 430.417 2.637 50 40 IFGB COc1ccc(Br)cc1S(=O)(=O)NNC(=O)c1cc2c(s1)CCC2 12816627 IXVQYUGIDADKKW-UHFFFAOYSA-N 431.333 2.631 50 40 IFGB COc1ccc(C(=O)NNC(=O)C[C@@H]2Sc3ccc(Cl)cc3NC2=O)cc1OC 12869155 SPRXCAVOKAYGJF-INIZCTEOSA-N 435.889 2.621 50 40 IFGB COc1ccccc1N1CCN(Cc2ccc(C(=O)NN=C3CCN(C)CC3)cc2)CC1 16189028 HMNCIOJKLSWBKL-UHFFFAOYSA-N 435.572 2.829 50 40 IFGB C/C(=N\NC(=O)c1ccco1)c1cc2c(cc1NC(=O)[C@H]1CC=CC[C@@H]1C(=O)O)OCO2 20159404 MJYYRKOJVJQPCY-AOEPBBORSA-N 439.424 2.768 50 40 IFGB CC(=O)c1c(NNC(=O)CSCC(=O)N(c2ccccc2)C(C)C)oc(C)cc1=O 22079574 CIARMIJJCHISDT-UHFFFAOYSA-N 431.514 2.769 50 40 IFGB COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNc3ccccc3C(F)(F)F)C2=O)cc1 68773287 PZLZNWKRPCGKNI-IBGZPJMESA-N 436.390 2.624 50 40 IFGB Cc1ccccc1NC(=O)CN1C(=O)/C(=N/NC(=O)c2ccccc2O)c2ccccc21 100511479 OKMCRXVDDUMYQM-XTCLZLMSSA-N 428.448 2.820 50 40 IFGB COc1ccccc1/C=N/NC(=O)Cc1nnc(NC(=O)c2ccc(Cl)cc2)s1 408732302 UCISYEGODUQJIZ-SRZZPIQSSA-N 429.889 3.145 50 40 IFGB COc1ccccc1C(=O)N/N=C/c1cc(C)n(-c2ccc(S(N)(=O)=O)cc2)c1C 408968480 ZIYLMWBGWPOINX-YDZHTSKRSA-N 426.498 2.514 50 40 IFGB COC(=O)c1ccc([C@H]2CC(=O)NC(SCC(=O)NCc3ccccc3)=C2C#N)cc1 409309701 LJJNDKDLYGYZBH-GOSISDBHSA-N 435.505 2.861 50 40 IFGB CC(=O)Oc1ccc(/C=N/NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(Cl)cc2)cc1 1014040 PXJGEKUCRDQDJW-MEGCXXLRSA-N 449.916 2.569 50 40 IFGB Cc1cc2c(c(=O)n1CCN(C)C)[C@@H](c1ccc(Br)cc1)C(C#N)=C(N)O2 2246229 TVWXBCZEEWUKTI-KRWDZBQOSA-N 429.318 2.699 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3ccc(OC)c(OC)c3)[C@H]2C1 6195014 IIJLFGCSSSNMSQ-PXNSSMCTSA-N 433.468 2.586 50 40 IFGB COc1ccc(Br)cc1/C=N/NC(=O)CN1C[C@H](c2ccccc2)CC1=O 16226508 RELWNZWPWCPEPS-CNPYVQQSSA-N 430.302 2.924 50 40 IFGB COc1cc(C(=O)NNC(=O)c2ccccc2NC(=O)c2ccco2)cc(OC)c1OC 32660809 QKTTZIPCAJWOEX-UHFFFAOYSA-N 439.424 2.633 50 40 IFGB O=C(Cl)C[C@@](O)(C(=O)c1ccc(Cl)cc1)[C@H](O)[C@@H](O)C(=O)c1ccc(Cl)cc1 100288892 HWBPAGFLYJHNSJ-QXAKKESOSA-N 445.682 2.667 50 40 IFGB O=C(N/N=C1\C(=O)N(CN2CCCCC2)c2ccc(Br)cc21)c1ccco1 100685938 KEOBSBIQGPESRL-FXBPSFAMSA-N 431.290 2.966 50 40 IFGB CCc1cccc(CC)c1NC(=O)COC(=O)CCCC(=O)NNC(=O)c1ccccc1 408644177 DVUQJAFLHZOBGL-UHFFFAOYSA-N 439.512 2.925 50 40 IFGB N#CCOc1ccccc1/C=N/NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 408866797 JBDYNZDJRMJAAY-UEIZDATPSA-N 446.916 2.546 50 40 IFGB CCOc1cc(/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)ccc1OCC(N)=O 408955937 VHXCGTXOSUBLEE-WQRHYEAKSA-N 432.480 2.697 50 40 IFGB CNC(=O)/C(C#N)=C1\S[C@H](Cc2cccc([N+](=O)[O-])c2)C(=O)N1c1cccc(OC)c1 1858945 OCCWTEFZLLHLFR-QUWSGOTNSA-N 438.465 2.776 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2cccc3ccccc23)S(C)(=O)=O)c(OC)c1 19955096 SVLCZRGCQATBAT-OEAKJJBVSA-N 441.509 2.773 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@@H]3[C@@H]4C[C@@H]([C@H](Br)[C@H]4Br)[C@@H]3C2=O)c1 100749340 AQAXYDDYNVXYEF-QFHDERPTSA-N 443.091 2.667 50 40 IFGB CCCOc1ccc([C@H]2[C@@H]3CN(C(C)=O)CC=C3C(C#N)=C(N)C2(C#N)C#N)cc1OC 1789976 DVGAKCRXQWQNPA-KNQAVFIVSA-N 431.496 2.756 50 40 IFGB COc1ccc(NC(=O)C(=O)N/N=C/c2cc(Br)c(OC)cc2OC)cc1 2751542 OLSWNYHIKJNASY-KEBDBYFISA-N 436.262 2.564 50 40 IFGB CN(C)c1ccc(-c2cc[n+](-c3[nH]c(=O)sc3/C=N/NC(=O)c3ccncc3)cc2)cc1 8564607 KDSALQNFKKPZDA-UHFFFAOYSA-O 445.528 2.605 50 40 IFGB COc1cccc(N(CC(=O)N/N=C/c2cccc(C(F)(F)F)c2)S(C)(=O)=O)c1 20209972 YEASWSGJXCRZKG-SSDVNMTOSA-N 429.420 2.630 50 40 IFGB Cc1ccc(CSCC(=O)N/N=C/c2ccc(OCC(=O)N3CCOCC3)cc2)cc1 59473717 ZDUSHELTUWQUIR-ZVHZXABRSA-N 441.553 2.616 50 40 IFGB COC(=O)COc1ccc(/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1OC 96930583 FZNIPNFQZHIXFH-WQRHYEAKSA-N 433.464 2.994 50 40 IFGB O=C(CCC(=O)NNC(=O)c1c(F)c(F)c(F)c(F)c1F)NCCC1=CCCCC1 199428224 MNLNLJMHTXQECB-UHFFFAOYSA-N 433.377 2.930 50 40 IFGB COc1ccc(C(=O)NNC(=O)CSc2ncc(-c3ccc(F)cc3)[nH]2)cc1OC 920488 QAOVULHCAYQVRN-UHFFFAOYSA-N 430.461 2.786 50 40 IFGB O=C(CSc1nnc(-c2ccncc2)o1)N/N=C/c1cc(Br)ccc1O 8951859 SMKKVFNNIWLCPR-UFWORHAWSA-N 434.275 2.842 50 40 IFGB N#Cc1ccccc1OCC(=O)NNC(=O)CCCOc1ccc(Br)cc1 15978504 ZEDBYZRBCOKQGW-UHFFFAOYSA-N 432.274 2.706 50 40 IFGB Cc1cccc[n+]1[C@@H]1[C@@H](c2ccc([N+](=O)[O-])cc2)C(C#N)=C(C(=C=N)C#N)N[C@]1(O)C1CC1 61942066 XYKRUTFELYKHCC-QTJGBDASSA-N 441.471 2.694 50 40 IFGB Cc1ccccc1OCC(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c1ccccc1OCC#N 408972618 PTTLHWCXJUXOHA-WNFNFYEPSA-N 436.512 2.957 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(Br)cc3)C2)c(OC)c1 409154032 FOZFJTIKSTYGDY-DACUGSJHSA-N 446.301 2.970 50 40 IFGB O=C(CSc1nnnn1-c1ccccc1)N/N=C/c1cccn1-c1ccc([N+](=O)[O-])cc1 4045988 FPZRZATXACASHM-FYJGNVAPSA-N 448.468 2.604 50 40 IFGB CCOC(=O)CSC1=C(C#N)[C@H](c2ccccc2OCC)[C@H](C(=O)OCC)C(=O)N1 9110609 YMOZHARHKKSQPT-ROUUACIJSA-N 432.498 2.509 50 40 IFGB COc1cc(/C=N/NC(=O)CN2C[C@@H](c3ccccc3)CC2=O)cc(Br)c1O 16194999 COYBLSJJKVWCQT-GTQIFZCBSA-N 446.301 2.630 50 40 IFGB Cc1cc(=O)c(C(=O)NNC(=O)[C@H](C)Oc2ccccc2F)nn1-c1ccc(Cl)cc1 18055037 LOFRCBKAIZKTLL-ZDUSSCGKSA-N 444.850 2.562 50 40 IFGB O=C(NNC(=O)[C@H]1CS[C@@]2(c3ccccc3)CCC(=O)N12)c1cc2c(s1)CCCC2 22968089 KVMWBDSRAGEPTD-OPAMFIHVSA-N 441.578 2.979 50 40 IFGB CCCN1C(=O)C(C#N)=C(C)/C(=C\c2ccc(-c3ccc(S(N)(=O)=O)cc3)o2)C1=O 96193237 OLHWGYIIDVKGHR-GZTJUZNOSA-N 425.466 2.596 50 40 IFGB CCC(=O)Nc1ccc(C(=O)NNC(=O)COc2ccc(Br)cc2C)cc1 675025 IOIJVVRZHWBJPI-UHFFFAOYSA-N 434.290 2.946 50 40 IFGB O=C(NN[C@@H](CNS(=O)(=O)c1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 16758516 VZLVKCVUSAXHLG-FQEVSTJZSA-N 440.481 2.549 50 40 IFGB COc1cc(/C=N\NC(=O)CN(C2CCCCC2)S(=O)(=O)c2ccccc2)ccc1O 39986449 FEYGXKLZEPQPGE-HAHDFKILSA-N 445.541 2.875 50 40 IFGB C#CCOc1c(Br)cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cn2)cc1OC 2290457 JGPVWLZNCGQRQY-AWQFTUOYSA-N 433.218 2.537 50 40 IFGB O=C(O)COc1ccc(/C=N\NC(=O)c2cccs2)cc1I 30813973 WOIFRPYKUNJSIU-APSNUPSMSA-N 430.223 2.580 50 40 IFGB Cc1cc(/C=N/NC(=O)C(=O)NC[C@@H]2CCCO2)c(C)n1-c1ccccc1C(F)(F)F 58912232 FULLZVDVPZZZMM-OLWYRFLESA-N 436.434 2.858 50 40 IFGB CCOc1cc(/C=C(/C#N)C(=O)NC(N)=O)cc(I)c1OC(C)C 409240786 HYEDXEZRWARJEB-WZUFQYTHSA-N 443.241 2.579 50 40 IFGB CC[C@H](NC(=O)c1ccccc1NC(=O)c1ccco1)C(=O)NNC(=O)c1ccccc1 3146455 UYZKYRPJXZGDFP-KRWDZBQOSA-N 434.452 2.502 50 40 IFGB O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NNC(=O)c1cc(-c2ccccc2)n[nH]1 9115898 ORNZQQXAVCBDTD-UHFFFAOYSA-N 439.475 2.935 50 40 IFGB O=C(NNC(=O)c1cccs1)c1ccc(S(=O)(=O)N2CCCc3ccccc32)cc1 9252981 DTGSPWNVUZXERY-UHFFFAOYSA-N 441.534 2.964 50 40 IFGB CCOC(=O)COc1cc(Br)c(/C=C(/C#N)C(=O)N(C)C)cc1OCC 59334738 JDMMREHJOLSXDE-QPEQYQDCSA-N 425.279 2.785 50 40 IFGB CCc1ccc(-n2nc(C(=O)N/N=C\c3cccc([N+](=O)[O-])c3)c(C)c(C#N)c2=O)cc1 409067923 QTPWEMQERBTRHF-CFRMEGHHSA-N 430.424 2.647 50 40 IFGB COC(=O)[C@@H]1C(=O)NC(SCC(=O)N2[C@H](C)CCC[C@H]2C)=C(C#N)[C@@H]1c1ccccc1 409131876 PGYRQKOPKAYIFC-IPZZXCBHSA-N 441.553 2.947 50 40 IFGB CCc1ccc(/C=c2\sc3n(c2=O)C(N)=C(C#N)[C@H](c2ccc(CC)cc2)C=3C#N)cc1 714557 PJNYGSUCNUGLHR-UWYGHVLSSA-N 438.556 2.986 50 40 IFGB CCOc1cc(C(=O)N/N=C2/C(=O)Nc3ccc([N+](=O)[O-])cc32)cc(OCC)c1OCC 9140203 PTMALOQYEVAZCH-UHFFFAOYSA-N 442.428 2.877 50 40 IFGB COc1ccc(C2=CS/C(=C(\C#N)C(=O)CN3C(=O)c4ccccc4C3=O)N2)cc1OC 12580598 FIOHGXOJVCIKPS-LTGZKZEYSA-N 447.472 2.939 50 40 IFGB CCOc1cccc(/C=N/NC(=O)CN2CCN(Cc3ccc(Cl)cc3)CC2)c1O 23473126 KSFXZCUOAKBQLN-ZVHZXABRSA-N 430.936 2.712 50 40 IFGB CC(=O)Nc1cccc(C(=O)N/N=C/c2cc(Br)c(N3CCOCC3)o2)c1 34880488 NMFLDNRLTYUCJI-RGVLZGJSSA-N 435.278 2.601 50 40 IFGB O=C(Cc1nnc(NC(=O)Nc2ccccc2)s1)N/N=C/c1ccc([N+](=O)[O-])cc1 1920491 HNGCCWBVRCHUEB-YBFXNURJSA-N 425.430 2.783 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cccc(OC)c3OC)[C@H]2C1 6195034 CLFYTHAIFVKTAI-PKOBYXMFSA-N 433.468 2.586 50 40 IFGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1occc1CS(=O)(=O)c1ccccc1 22020191 WIABBNGOZCLKIC-UHFFFAOYSA-N 448.884 2.990 50 40 IFGB COc1ccc(-c2n[nH]cc2/C=N\NC(=O)c2cc(OC)c(OC)c(OC)c2)cc1OC 32565542 QHGRLUJDJSFESK-MSXFZWOLSA-N 440.456 2.884 50 40 IFGB O=C(Cn1nnc(-c2ccccc2)n1)N/N=C/c1ccccc1OC(=O)c1ccccc1 408721359 QBMCUZWZGFQSMU-BUVRLJJBSA-N 426.436 2.710 50 40 IFGB Cc1nc2sccn2c1C(=O)N/N=C/c1ccc(OCC(=O)NCc2ccco2)cc1 408999463 LFZRKRLDOWSMDS-FOKLQQMPSA-N 437.481 2.756 50 40 IFGB O=C(Cc1csc(N2CCOCC2)n1)NNC(=O)c1ccccc1Oc1ccccc1 14231672 QMZPMXFAFLJTIP-UHFFFAOYSA-N 438.509 2.776 50 40 IFGB Cc1c(C(=O)N/N=C\c2cccnc2)nn(-c2cccc(C(F)(F)F)c2)c(=O)c1C#N 409060691 SXYJKXRVOMGNGB-RAWMCFOBSA-N 426.358 2.590 50 40 IFGB COCc1cc(C)nc(OCC(=O)N/N=C/c2ccc(-c3cccc(C(=O)O)c3)o2)c1C#N 1959174 VKPDISQBIGSEIP-OPEKNORGSA-N 448.435 2.895 50 40 IFGB NC(=O)CSCCC(=O)NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12 32776829 SMUGFONLDSOLOT-UHFFFAOYSA-N 442.928 2.925 50 40 IFGB O=C(N[C@@H](C(=O)N/N=C\c1ccccc1)c1nnc(O)c2ccccc12)c1ccccc1 100751181 INIJLTOZUZPYLC-QEMKNDADSA-N 425.448 2.957 50 40 IFGB COc1cccc(/C=N/NC(=O)CNc2ccc(I)cc2)c1OC 409059821 XPWZGVMWLZNSHE-KEBDBYFISA-N 439.253 2.871 50 40 IFGB Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccc(F)cc3)c2)c(C)o1 2649857 RQQLYXOCGMSZDZ-UHFFFAOYSA-N 431.445 2.911 50 40 IFGB COc1cc([N+](=O)[O-])cc(/C=N\NC(=O)[C@@H]2COc3ccc(C(C)(C)C)cc3O2)c1O 30713759 QGYMDYJYFZWXLE-NLIBPXKJSA-N 429.429 2.897 50 40 IFGB O=C(CCC(=O)N1CCN(c2cccc(Cl)c2)CC1)NNC(=O)CC1CCCCC1 199413576 AXVSXLYMKBAEPG-UHFFFAOYSA-N 434.968 2.887 50 40 IFGB C=CCOc1cccc(/C=N/NC(=O)[C@H](C)N(c2ccc(OCC)cc2)S(C)(=O)=O)c1 408924504 JKHIATJRQHHBFQ-CSUZIONRSA-N 445.541 2.955 50 40 IFGB N#CC1=C(N)N(c2ccc(Br)cc2)C2=C(C(=O)OC2)[C@]12C(=O)Nc1ccccc12 20719910 LHXCXBJHOCPJKI-OAQYLSRUSA-N 449.264 2.664 50 40 IFGB CC(C)CCOc1ccc(C(=O)NNC(=O)CCNC(=O)NCc2ccccc2)cc1 40024518 NVHXOKWGBNEQTJ-UHFFFAOYSA-N 426.517 2.762 50 40 IFGB CC1(C)OC(=O)C2=C1NC(N)=C(C#N)[C@@]21C(=O)N(CCCc2ccccc2)c2ccccc21 79484146 QVUQMDCYRWRQEV-AREMUKBSSA-N 440.503 2.790 50 40 IFGB COc1cccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)NC[C@@H]3CCCO3)cc2)c1 408795353 KXSUUFPDTHJIQD-JMOSNPTESA-N 435.480 2.915 50 40 IFGB CCc1ccccc1NC(=O)COc1cccc(/C=N/NC(=O)C(=O)NCc2ccco2)c1 409263369 MITAKSFDCKVKGF-VULFUBBASA-N 448.479 2.626 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2c(C)cc(C)cc2C)cc1 409270302 PAUDIGXPQVYQOD-YBNTXHARSA-N 438.528 2.994 50 40 IFGB C/C(=N/NC(=O)[C@H](C)n1cc([N+](=O)[O-])cn1)c1ccc(OCc2ccc(C(=O)O)o2)cc1 8815646 IDCGCQBEEUKICZ-QGNWGPJTSA-N 441.400 2.763 50 40 IFGB CCOC(=O)CSC1=C(C#N)[C@H](c2ccccc2OCC)[C@@H](C(=O)OCC)C(=O)N1 9110611 YMOZHARHKKSQPT-ZWKOTPCHSA-N 432.498 2.509 50 40 IFGB O=C(NNC(=O)c1ccc2c(c1)OCO2)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 10039241 VGELLHBOXYMPKK-UHFFFAOYSA-N 448.391 2.651 50 40 IFGB CCc1cccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(OC(C)C)c(OC)c3)CC2=O)c1 12933056 KGFNTPXRYRFVHV-SFHVURJKSA-N 439.512 2.859 50 40 IFGB CC/C(NNC(=O)c1ccccc1Cl)=C1/C(=O)NC(=O)N(c2ccc(C)cc2)C1=O 13511086 YDTJDVSYYZENDP-WUKNDPDISA-N 426.860 2.830 50 40 IFGB Cc1ccc(N2C(=O)/C(=C/NNC(=O)Cn3nc(C)cc3C)c3ccccc3C2=O)cc1 33014850 USBDBYMMSNHLAA-FYJGNVAPSA-N 429.480 2.657 50 40 IFGB CCOc1cc(/C=N\NC(=O)c2cccc(Cl)c2)ccc1OCC(=O)N1CCOCC1 409013912 OLADOYXIPQZKBX-OYKKKHCWSA-N 445.903 2.740 50 40 IFGB CCCOc1ccc(/C=N/NC(=O)CN(Cc2ccccc2)S(C)(=O)=O)cc1OCC 409149986 XFCDGDWHPDSTRK-HZHRSRAPSA-N 447.557 2.786 50 40 IFGB COc1ccccc1NC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccccc2)c1 409158119 SCPCRAAAPITQFU-MFKUBSTISA-N 446.463 2.802 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1cccc(Cl)c1 409166475 DQNVOSSRQXYHEJ-ZMOGYAJESA-N 430.892 2.724 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2cccc(Cl)c2Cl)c1 409167907 KDOHEXXZOWTIBE-BHGWPJFGSA-N 449.294 2.763 50 40 IFGB Cc1ccc(Oc2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)N2CCOCC2)c(C)c1 2703569 MLSFQZOGMKFIMG-NBVRZTHBSA-N 430.464 2.869 50 40 IFGB O=C(N/N=C/c1cccc(Br)c1)c1cccc(S(=O)(=O)N2CCCC2)c1 9283607 SQWZNAYPGOUWQA-DEDYPNTBSA-N 436.331 2.998 50 40 IFGB Cn1ccnc1COc1ccc(C(=O)NNC(=O)c2ccccc2Br)cc1 40143077 QZZIGSYUXCVMSQ-UHFFFAOYSA-N 429.274 2.836 50 40 IFGB COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(C)n(Cc4cccnc4)c(=O)c32)cc1OC 727901 VZOSJGBUFJYWLC-NRFANRHFSA-N 430.464 2.835 50 40 IFGB COc1cc(Br)cc(/C=N/NC(=O)COc2ccc(C)cc2[N+](=O)[O-])c1O 9355263 AOPIZJYAOWNGNO-UFWORHAWSA-N 438.234 2.909 50 40 IFGB C[C@@H]1Oc2ccccc2N(CCC(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)C1=O 12568121 YMRGHLFNQMFQEU-KGLIPLIRSA-N 427.526 2.838 50 40 IFGB CCOC(=O)COc1ccc(/C=N/NC(=O)c2ccc(NC(C)=O)cc2)cc1OCC 33412394 ZQHXVSYOUPWRIC-YDZHTSKRSA-N 427.457 2.750 50 40 IFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccc(Br)cc1 409002430 UQEAIEHOMTZPFM-UDWIEESQSA-N 433.262 2.958 50 40 IFGB Cc1c(Cl)cccc1NC(=O)COc1cccc(/C=N/NC(=O)C(=O)NC(C)C)c1 409171560 DPKZVFXVVVNXIK-FOKLQQMPSA-N 430.892 2.641 50 40 IFGB COc1ccc([C@H]2CC(=O)NC(SCC(=O)NC[C@@H]3CCCO3)=C2C#N)cc1Cl 409313616 CXOYXAVAPRVJCE-UONOGXRCSA-N 435.933 2.716 50 40 IFGB COc1cc(C(=O)N/N=C\c2cccc(OCC(N)=O)c2)ccc1OCc1ccccc1 409314052 DXQRGSZRDLXTAI-WGARJPEWSA-N 433.464 2.902 50 40 IFGB CCOC(=O)C1=C(C)N(c2nonc2NC(C)=O)C(N)=C(C#N)[C@H]1c1ccccc1Cl 718964 BXTDJMAIGYPIIM-MRXNPFEDSA-N 442.863 2.816 50 40 IFGB COc1cccc(-c2c(C(=O)N/N=C(\C)CCc3ccccc3)nnn2-c2nonc2N)c1 9307808 JBHCIRQRCVNWPO-ZVHZXABRSA-N 446.471 2.647 50 40 IFGB CCC(=O)NNC(=O)CSc1nnc2c3c4c(sc3nc(CC)n12)C[C@H](C)CC4 13499822 YDMCZXHIICHENP-SNVBAGLBSA-N 432.575 2.676 50 40 IFGB O=C(CN1CCOCC1)N/N=C\c1ccc(OCc2ccccc2)c(Br)c1 59246390 DJAQXBJDGYCXRY-XKZIYDEJSA-N 432.318 2.810 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(C)cc2C)c(Cl)c1 409170255 UZKSVPAVZCVBER-BRJLIKDPSA-N 442.903 2.727 50 40 IFGB Cc1ccc(OCC(=O)N/N=C/c2ccc(I)o2)c([N+](=O)[O-])c1 9972322 RUBPUVJQWXYOJP-FRKPEAEDSA-N 429.170 2.630 50 40 IFGB O=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C\c1cc(O)ccc1[N+](=O)[O-] 12376007 HUSZLEUNFXESNH-QFEZKATASA-N 432.436 2.699 50 40 IFGB Cc1ccc(NC(=O)CCCC(=O)OCC(=O)NNC(=O)c2ccccc2)cc1Cl 408662625 GBXQANFIGWROOK-UHFFFAOYSA-N 431.876 2.762 50 40 IFGB COc1ccc(C(=O)N/N=C/c2ccc(CNS(=O)(=O)c3ccc(C)cc3)o2)cc1 408777218 WOBQBDGKUDYGJT-LPYMAVHISA-N 427.482 2.839 50 40 IFGB COc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NCc3ccncc3)c2C)cc1Cl 408974339 YBNMXPDWXBXUFX-LGJNPRDNSA-N 439.903 2.918 50 40 IFGB COc1cccc(C(=O)NNC(=O)c2cccc(NC(=O)c3ccc4c(c3)OCO4)c2)c1 10040750 XFMYXQIZYSSFLP-UHFFFAOYSA-N 433.420 2.751 50 40 IFGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1cccc(Br)c1 408997522 MUHHBDNTWAMLSU-UDWIEESQSA-N 433.262 2.958 50 40 IFGB Cc1ccccc1-n1cnnc1SCC(=O)NNC(=O)c1ccc(Br)cc1 9635511 SFACTSVRLBJHLQ-UHFFFAOYSA-N 446.330 2.892 50 40 IFGB CCN(CC)c1ccc(/C=N/NC(=O)[C@@H](C)N(c2ccc(OC)cc2)S(C)(=O)=O)cc1 19953862 JWURWRFXARCTGP-BXDFRRGMSA-N 446.573 2.846 50 40 IFGB COc1ccc(C(=O)N/N=C/c2ccc(CNS(=O)(=O)c3ccccc3)o2)cc1OC 408776206 NHUVTCOQFFMTPY-LPYMAVHISA-N 443.481 2.539 50 40 IFGB CCOc1ccc(N([C@@H](C)C(=O)N/N=C(\C)c2ccc([N+](=O)[O-])cc2)S(C)(=O)=O)cc1 408922830 TYNXSRLBNZGDPM-HBBMIWKISA-N 448.501 2.688 50 40 IFGB Cn1cc(Br)c(C(=O)Oc2ccc(/C=N/NC(=O)c3ccccc3O)cc2)n1 673191 NUICZFYJXVFIOQ-UFFVCSGVSA-N 443.257 2.871 50 40 IFGB O=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C/c1cc([N+](=O)[O-])ccc1O 12376006 ZVFRWDAHJUIKRP-AFUMVMLFSA-N 432.436 2.699 50 40 IFGB O=C(CN(c1ccccc1)S(=O)(=O)c1ccccc1)N/N=C/c1ccccc1[N+](=O)[O-] 19947711 OFPYJASMYDXFNX-PXLXIMEGSA-N 438.465 2.940 50 40 IFGB N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)N[C@@H]1CCS(=O)(=O)C1 26966716 LJNFRJKXATURQD-ITICKHJUSA-N 432.505 2.750 50 40 IFGB COc1ccc(CC(=O)N/N=C(\C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1OC 16347335 JKLLKAUQYRMRMT-OEAKJJBVSA-N 428.445 2.984 50 40 IFGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)CN(c2ccc(C)cc2C)S(C)(=O)=O)cc1 20208125 QCJHLEBHQNGPMW-XQNSMLJCSA-N 430.530 2.568 50 40 IFGB CCCCOc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(OC)cc2)cc1OCC 20977795 XVDQPTCGVWSLNG-UHFFFAOYSA-N 444.484 2.891 50 40 IFGB CCOc1ccccc1N1C[C@H](C(=O)NNC(=O)c2ccc(Br)cc2)CC1=O 17330547 QNNPYRCJUCOHPN-CQSZACIVSA-N 446.301 2.662 50 40 IFGB Cc1ccc(/C=C2/SC(=S)N(CCC(=O)NNC(=O)c3ccccc3O)C2=O)cc1 33395629 MTAGDYOZILTVRD-SFQUDFHCSA-N 441.534 2.753 50 40 IFGB CCOc1ccc(NC(=O)COc2ccc(/C=C(\C#N)C(=O)N3CCOCC3)cc2)cc1 408752795 CHUNXGHPMULJBQ-XDJHFCHBSA-N 435.480 2.869 50 40 IFGB Cc1ccccc1OCC(=O)N[C@H](CC(C)C)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 408970007 YMWQVYNAJMZBQI-QNDYCBLQSA-N 426.473 2.963 50 40 IFGB CCN(CC)c1ccc(/C=N/NC(=O)CN(c2cc(C)ccc2OC)S(C)(=O)=O)cc1 6078468 DQTUEDQLHBGNSK-HZHRSRAPSA-N 446.573 2.766 50 40 IFGB Cc1ccc(S(=O)(=O)N[C@H](CC(C)C)C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)cc1 408764710 SKRPANFBQQTZHM-DBRLUCFCSA-N 432.502 2.747 50 40 IFGB COc1cc(/C=N/NC(=O)Cc2nnc(NC(=O)Nc3ccccc3)s2)ccc1O 1885945 KKTRMRZRTXYZEH-RGVLZGJSSA-N 426.458 2.589 50 40 IFGB Cc1cc(Br)ccc1OCC(=O)NNC(=O)CCC(=O)Nc1ccccc1 2135178 TYAZRCPSXCMJJV-UHFFFAOYSA-N 434.290 2.703 50 40 IFGB N#CC1=C(N)OC2=C(C(=O)CCC2)[C@]12C(=O)N(CC(=O)Nc1ccccc1)c1ccccc12 8914485 OFFQQEFNLRJWKB-RUZDIDTESA-N 440.459 2.641 50 40 IFGB CCCC(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1 12557217 RMXWSRCTJCUUQD-UHFFFAOYSA-N 440.319 2.811 50 40 IFGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@@H]1CS[C@@]2(c3ccccc3)CCC(=O)N12 22965638 CWHLGTJRJLEQIB-YYUUUBJNSA-N 439.581 2.941 50 40 IFGB CN1CCN([C@H](CNS(=O)(=O)c2ccc(CCCl)cc2)c2cccs2)CC1 48314031 YKBRJJVPUYWUOE-GOSISDBHSA-N 428.023 2.796 50 40 IFGB COc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC(N)=O)c(Br)c2)cc1 409217260 ARQSMVDKPOLNSR-MDWZMJQESA-N 430.258 2.867 50 40 IFGB COc1ccc(/C=N/NC(=O)c2cccc(C(=O)N/N=C/c3ccc(OC)cc3)n2)cc1 1302285 VSQVEZJWLNDTPO-KOJZRSEWSA-N 431.452 2.627 50 40 IFGB Cn1/c(=N\NC(=O)c2ccc(S(=O)(=O)N3CCCCC3)cc2)sc2ccccc21 1958666 NSJOZYQWWGONPI-LSDHQDQOSA-N 430.555 2.660 50 40 IFGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)CN(c2cccc(C)c2C)S(C)(=O)=O)cc1 408908997 ZVBNPIHKXCDQDQ-XQNSMLJCSA-N 430.530 2.568 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc(Cl)c(Cl)c1)c1cccc([N+](=O)[O-])c1 409026154 HNBPHGPNQOZSBX-DJKKODMXSA-N 445.284 2.818 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2ccc(CC)cc2)S(C)(=O)=O)cc1OC 409026724 WFAPFQGMFSUOGD-HZHRSRAPSA-N 445.541 2.739 50 40 IFGB O=C(N/N=C/c1ccc2c(c1)OCO2)[C@@H]1CC(=O)N(c2ccc(Br)cc2)C1 409173190 HKRGHHPHPHEVJZ-FCQRQVBFSA-N 430.258 2.681 50 40 IFGB CC(=O)NNC(=O)CCCN1C(=O)/C(=C/c2cccc(Br)c2)SC1=S 2303668 SMKHHYMWDDAHKC-LCYFTJDESA-N 442.360 2.598 50 40 IFGB COC(=O)c1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(Br)cc3)C2)cc1 2403443 BKFXYYOOWGOPTR-XHADFYDMSA-N 444.285 2.739 50 40 IFGB CC(C)(C)NC(=S)NNC(=O)c1cc(Br)c(O)c(Br)c1 408586707 PWLCZOIZDZFDKG-UHFFFAOYSA-N 425.146 2.825 50 40 IFGB Cc1ccc(Cl)cc1NC(=O)COC(=O)[C@H]1[C@H]2C(=O)O[C@@H]3[C@@H](Br)[C@@H]1C[C@@H]32 408687578 UQKUTDHLMYBEDZ-RJTBJPLASA-N 442.693 2.701 50 40 IFGB C/C(CC(=O)Nc1ccc2c(c1)OCO2)=N\NC(=O)C(=O)Nc1ccc(C)c(Cl)c1 16312903 OQOCFDIDBHQWHU-WYMPLXKRSA-N 430.848 2.837 50 40 IFGB C[C@H](c1ccccc1)N1C[C@@H](C(=O)NNC(=O)c2ccc(Br)cc2)CC1=O 216298827 YZPCDJWYLJCLPJ-CJNGLKHVSA-N 430.302 2.820 50 40 IFGB OCC[C@]12[C@H](I)[C@@H]3[C@@H]4[C@@H]5C[C@H]3[C@@H]1[C@@H]5[C@@H](I)[C@H]42 261361219 LPPSJDDLSOALBA-BNVNWCAXSA-N 442.078 2.734 50 40 IFGB Cc1cccc(C)c1N1C[C@H](C(=O)NNC(=O)c2ccc(Br)cc2)CC1=O 408640611 JPZGZZJDWLZNFO-OAHLLOKOSA-N 430.302 2.880 50 40 IFGB COc1cc(/C=N/NC(=O)C(=O)Nc2cccc(C(F)(F)F)c2)cc(OC)c1OC 3097548 IZYATULDKMEASE-AUEPDCJTSA-N 425.363 2.820 50 40 IFGB COc1cc(C(=O)NNC(=S)NC(=O)/C=C/c2ccccc2Cl)cc(OC)c1OC 9288473 HIJFBNFROQXKQU-CMDGGOBGSA-N 449.916 2.715 50 40 IFGB CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)[C@H](NC(=O)c2ccccc2F)C(C)C)cc1 13011348 CTUAPNMMAUTBJO-MGPUTAFESA-N 445.491 2.594 50 40 IFGB O=C(O[C@@H](CCl)C(=O)c1ccccc1)[C@H]1[C@H]2C(=O)O[C@@H]3[C@@H](Br)[C@@H]1C[C@@H]32 408682503 JIGDPJZFKGQLGY-AVFMAPHYSA-N 427.678 2.591 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccc(Cl)cc2)cc1 409265380 UNRFRKOQQYBZKO-XMTZNVEYSA-N 430.892 2.722 50 40 IFGB Cc1ccc(S(=O)(=O)N(CCc2ccccc2)CC(=O)N/N=C/c2ccccn2)cc1 2174031 RAHPKAVZSGVVRO-KOEQRZSOSA-N 436.537 2.774 50 40 IFGB Cc1ccc(-c2c(C(=O)N/N=C/c3ccc(OC(C)C)cc3)nnn2-c2nonc2N)cc1 2242230 LUIYNPRBTWSLID-WYMPLXKRSA-N 446.471 2.759 50 40 IFGB CC(C)NC(=O)CC(=O)N/N=C\c1ccc(OCC(=O)Nc2ccccc2Cl)cc1 59960398 CSFHTKCSMGNZNA-FMCGGJTJSA-N 430.892 2.722 50 40 IFGB O=C(N/N=C\c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O)[C@H]1COc2cc3ccccc3cc2O1 67197014 XLRHZEFBRHCBCO-KSPQIECSSA-N 438.352 2.652 50 40 IFGB CC(C)c1ccc(OCC(=O)NNC(=O)c2cccn(Cc3ccc(F)cc3)c2=O)cc1 23109282 FCFQIGMAXCOWEU-UHFFFAOYSA-N 437.471 2.999 50 40 IFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3cccc([N+](=O)[O-])c3)CC2)cc1OC 409006622 QFGOSZSMYZRNKY-OEAKJJBVSA-N 440.456 2.615 50 40 IFGB COc1ccccc1N(CC(=O)N/N=C/c1ccc(C#N)cc1)S(=O)(=O)c1ccccc1 3089019 OBOSAFHDYVGJRB-PCLIKHOPSA-N 448.504 2.912 50 40 IFGB CCOC(=O)/C(C#N)=C/Nc1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2 9509267 YSDYOJAFNMEZOW-BUHFOSPRSA-N 429.454 2.641 50 40 IFGB O=C(CSc1cc(Cl)ccc1Cl)NNC(=O)CN1C(=O)c2ccccc2C1=O 14141306 HAPBWTPZHOJPOH-UHFFFAOYSA-N 438.292 2.529 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C/c2ccc(Cl)c(Cl)c2)cc1 16186840 JDKJTAOTFFSFRR-KEBDBYFISA-N 430.313 2.773 50 40 IFGB Cc1ccc(C)c(N2C/C(=N/NC(=O)CC#N)[C@@H](c3nc4ccccc4s3)C(=O)C2=O)c1 104277607 GAMXJKYDOOXCOF-WWAUWJAYSA-N 445.504 2.999 50 40 IFGB Cc1ccc(NC(=O)C(=O)N/N=C/c2ccccc2OCC(=O)NCc2ccccc2)cc1 409156438 FVAHXJADINWMQA-JVWAILMASA-N 444.491 2.779 50 40 IFGB CCOCCCNC(=O)/C(C#N)=C/c1c(Oc2ccc(OC)cc2)nc2ccccn2c1=O 2436351 BSWHLORDSRRQQA-BMRADRMJSA-N 448.479 2.945 50 40 IFGB C[C@H]1C[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1 12605086 VAOWYLMCQBABOQ-ZBEGNZNMSA-N 441.431 2.923 50 40 IFGB Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)c1C 12747709 SUEDNERIPPHEIE-ZDUSSCGKSA-N 426.441 2.528 50 40 IFGB O=C(Cc1csc(N2CCOCC2)n1)N/N=C(/C(=O)c1ccccc1)c1ccccc1 13097440 CPSDTHPBUPNCJD-YYADALCUSA-N 434.521 2.926 50 40 IFGB C=CCc1cc(/C=N/NC(=O)[C@H](Cc2ccccc2)NC(=O)OCC)cc(OC)c1O 408906084 HEYNVSZAMRMWIT-WWJLXRQJSA-N 425.485 2.937 50 40 IFGB CCOc1ccc(C(=O)N/N=C\c2cc(Cl)c(OCC(=O)O)c(OC)c2)cc1OC 409312641 GAWZRPMFIUMLOU-YVNNLAQVSA-N 436.848 2.983 50 40 IFGB COc1cc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)ccc1OCC(=O)Nc1ccccc1 9715943 FRPGCZDJDOIBCI-NRFANRHFSA-N 431.452 2.962 50 40 IFGB Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)c3nn(C(C)C)c(=O)c4ccccc34)cc2)n1 12860854 WNPSPTSRNUPRAW-UHFFFAOYSA-N 444.495 2.855 50 40 IFGB CCOc1c(Br)cc(C(=O)NNC(=O)Cc2cccc(F)c2)cc1OC 12885460 WTEXPTHWBDMWPB-UHFFFAOYSA-N 425.254 2.999 50 40 IFGB CC(C)(C)NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1 58873387 DUCUFPGRCRFJRX-FSJBWODESA-N 430.892 2.722 50 40 IFGB CCOc1ccc(/C=N/NC(=O)[C@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)cc1OC 408753160 DWLDHEKGGSPXQH-KURUZVKSSA-N 447.557 2.856 50 40 IFGB COc1cc([C@@H]2CC(=O)N3C(=C2C#N)SC[C@]3(O)c2ccco2)cc(OC)c1OC 12275507 RVUFBOFIUNKIPT-ZSEKCTLFSA-N 428.466 2.949 50 40 IFGB Cc1cc(I)cc(/C=N\NC(=O)[C@@H]2COc3ccccc3O2)c1O 13617357 UCJUVJVGKZJNCX-CPIUSTHESA-N 438.221 2.595 50 40 IFGB COc1ccc(/C=N\NC(=O)CN2CCN(Cc3ccccc3Cl)CC2)cc1OC 32576984 JMJWJLKMYZNKHP-OYKKKHCWSA-N 430.936 2.625 50 40 IFGB COc1ccc(NC(=O)C(=O)N/N=C/c2ccc(OCC(=O)Nc3ccccc3)cc2)cc1 58881573 INCQJMGBEGPADZ-MFKUBSTISA-N 446.463 2.802 50 40 IFGB CCOc1ccc(N([C@H](C)C(=O)N/N=C(\C)c2ccc(OC)cc2)S(C)(=O)=O)cc1 408906234 DELGIVQBCDDILI-QFNCUCFLSA-N 433.530 2.789 50 40 IFGB CCOc1ccc(N([C@@H](C)C(=O)N/N=C(\C)c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)cc1 408906320 GHAGTNUIMNWURH-HBBMIWKISA-N 448.501 2.688 50 40 IFGB CCCn1nc(C(=O)NNC(=O)COc2cccc(C(C)(C)C)c2)c2ccccc2c1=O 36394216 CENSMADLEFKQFW-UHFFFAOYSA-N 436.512 2.944 50 40 IFGB CCN(CC)C(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2Cl)cc1 59959940 RRDYCIXPJUDFJL-YDZHTSKRSA-N 430.892 2.676 50 40 IFGB CCOc1ccc(N(CC(=O)N/N=C2\CCCc3cc(OC)ccc32)S(C)(=O)=O)cc1 408724790 AQZIJVFZXZOJAW-XTQSDGFTSA-N 445.541 2.717 50 40 IFGB Cc1cccc(C)c1N(CC(=O)N/N=C/c1cccc(OC2CSC2)c1)S(C)(=O)=O 20213905 XOYWFQQEDPKZGB-SSDVNMTOSA-N 447.582 2.714 50 40 IFGB COc1ccc(OC)c([C@H]2C(C#N)=C(N)OC3=C2S(=O)(=O)N(C)c2ccccc23)c1 20558287 GUVKEWHESDWYNI-SFHVURJKSA-N 425.466 2.660 50 40 IFGB CCn1c(SCC(=O)NNC(=O)c2ccccc2)nnc1-c1cc(OC)cc(OC)c1 408637014 FJCUHMNHNZHYFH-UHFFFAOYSA-N 441.513 2.536 50 40 IFGB CCc1ccc(NC(=O)COc2ccc(/C=N/NC(=O)C(=O)NCc3ccco3)cc2)cc1 409259610 BISMPJUSCLVTRA-VULFUBBASA-N 448.479 2.626 50 40 IFGB O=C(NNC(=O)c1ccccc1C(F)(F)F)c1cccc(S(=O)(=O)N2CCCC2)c1 3534019 LUVCPMOGTNNQQB-UHFFFAOYSA-N 441.431 2.565 50 40 IFGB Cc1ccc2[nH]c(SCC(=O)NNC(=O)COc3ccc(Br)cc3)nc2c1 9119727 YZIXYTQEKYUPFA-UHFFFAOYSA-N 449.330 2.952 50 40 IFGB CCn1c(SCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)nnc1-c1ccccc1 9484845 GPLBDHKOJYXUCS-UHFFFAOYSA-N 441.513 2.536 50 40 IFGB Cc1onc(-c2ccccc2)c1C(=O)OCC(=O)NNC(=O)COc1ccc(Cl)cc1 13057761 JJLDCLNWZGWQTO-UHFFFAOYSA-N 443.843 2.687 50 40 IFGB Cc1ccc(NC(=O)CCC(=O)OCC(=O)NNC(=O)c2ccccc2Cl)c(C)c1 408665698 VYPZKNBCVIZUCA-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB CCc1ccc(-n2nc(C(=O)N/N=C\c3ccc([N+](=O)[O-])cc3)c(C)c(C#N)c2=O)cc1 409069547 DISMNGZYHPPDKN-CFRMEGHHSA-N 430.424 2.647 50 40 IFGB O=C(COc1cccc(/C=N/NC(=O)C(=O)Nc2ccc(F)cc2)c1)Nc1ccccc1 409266612 QLFMJWYCCFIWGF-AFUMVMLFSA-N 434.427 2.932 50 40 IFGB COc1ccc(C(=O)N/N=C/c2ccc(CNC(=O)C(=O)Nc3ccc(C)c(C)c3)o2)cc1 408865246 CDGMAKPOYRBWIO-VULFUBBASA-N 448.479 2.924 50 40 IFGB COc1cccc(C(=O)N2CCC(C(=O)N/N=C/c3ccc(OC)cc3OC)CC2)c1 409007604 YFIBEBPZZYMRMP-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB CCOC(=O)[C@@H]1C(=O)NC(SC)=C(C#N)[C@H]1c1ccccc1I 726120 CRBJIUSMKAIHOA-OLZOCXBDSA-N 442.278 2.782 50 40 IFGB CCN(CC)c1ccc(N2/C(=N\C(=O)CCl)S[C@H]3CS(=O)(=O)C[C@@H]32)c(C)c1 101319371 JZBXTGOQOMVTPL-VFAFWLKOSA-N 429.995 2.681 50 40 IFGB COCCNC(=O)C(=O)N/N=C/c1cc(Br)ccc1Nc1ccccc1F 408708431 QCAVLHDTVRLZFP-SSDVNMTOSA-N 437.269 2.545 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)CN(c2cccc(Cl)c2C)S(C)(=O)=O)c1 408774236 CEANTMMEMKLXFZ-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB COC(=O)COc1c(Br)cc(/C=C(/C#N)C(=O)NC2CCCC2)cc1OC 409191719 LLMUHHBPHBGILD-QPEQYQDCSA-N 437.290 2.975 50 40 IFGB O=C(COC(=O)c1cnc(Cl)c(Cl)c1)NNC(=O)c1ccc(Br)cc1 3329431 MLGOMBKIZPZQGX-UHFFFAOYSA-N 447.072 2.769 50 40 IFGB O=C(COC(=O)c1cccnc1Nc1ccccc1F)NNC(=O)c1ccccc1F 9349799 FBMLDPPAQCNSFN-UHFFFAOYSA-N 426.379 2.721 50 40 IFGB CC(=O)OCC(=O)[C@]1(O)CC[C@H]2[C@@H]3C[C@H](Cl)C4=CC(=O)C=C[C@]4(C)[C@H]3C(=O)C[C@@]21C 118926885 RACDDTQBAFEERP-HSHQSABQSA-N 434.916 2.554 50 40 IFGB O=C(O)c1cccc(N2C(=O)[C@H]3[C@@H]4C[C@@H]([C@@H](Br)[C@@H]4Br)[C@@H]3C2=O)c1 169618847 AQAXYDDYNVXYEF-LIBFEPKXSA-N 443.091 2.667 50 40 IFGB COCCOC(=O)/C(C#N)=C/c1cc(Br)c(I)o1 408954422 SXSQSHYGCPCHDC-QPJJXVBHSA-N 426.004 2.743 50 40 IFGB C#CCN1C(=O)/C(=N\NC(=O)CNc2ccccc2C)c2cc(Br)ccc21 2361048 NHEVIXJBBLOBMW-CLCOLTQESA-N 425.286 2.670 50 40 IFGB Cc1cccc2c1NC(=O)/C2=N\NC(=O)[C@H](C)n1cnc2sc3c(c2c1=O)CCCC3 6166299 NRCWANWNWKFHNX-LBPRGKRZSA-N 435.509 2.679 50 40 IFGB COc1ccc(N(CC(=O)N/N=C/c2ccc(SC)cc2)S(C)(=O)=O)cc1Cl 20213302 ZSFZXXNCHIXAMC-RGVLZGJSSA-N 441.962 2.987 50 40 IFGB CCCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2cc(Cl)ccc2C)cc1 409151599 HJLWSGDCDVNMOO-WYMPLXKRSA-N 430.892 2.642 50 40 IFGB COCCCNC(=O)/C(C#N)=C/c1c(Oc2ccc(OC)cc2)nc2c(C)cccn2c1=O 2406828 WRWOMSSAGOVXMO-SAPNQHFASA-N 448.479 2.864 50 40 IFGB COc1ccc(COC(=O)NNC(=O)[C@@H]2CS[C@@H](c3ccccc3)N2C(C)=O)cc1 6001779 JULVIBILHMRRNE-ICSRJNTNSA-N 429.498 2.615 50 40 IFGB Cc1ccc(S(=O)(=O)NNC(=O)c2csc(-c3ccc(F)cc3)n2)cc1[N+](=O)[O-] 12971792 NNDATRVZOQKWRI-UHFFFAOYSA-N 436.446 2.789 50 40 IFGB Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NNC(=O)c1cc(C)n(-c2ccccc2)c1C 30529907 NXPDGZSQBMWVSA-UHFFFAOYSA-N 428.470 2.934 50 40 IFGB COC(=O)C1=C(CSc2nc(C)cc(C)c2C#N)OC(N)=C(C#N)[C@@H]1c1cccnc1 2118209 NUGYPODQGRYJRW-SFHVURJKSA-N 433.493 2.992 50 40 IFGB CN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccccc2F)c1 2726398 ABLKKFGOLRBQMT-UHFFFAOYSA-N 427.457 2.726 50 40 IFGB CC(C)[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NNC(=O)c1ccc2c(c1)OCO2 14244365 GAHWBQFXQKKVAV-JHXAUMMHSA-N 441.528 2.534 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)cc1OC 408753346 MCQIDTFRWRMXET-IXOWOOARSA-N 447.557 2.856 50 40 IFGB COc1ccc(OC)c(/C=N\NC(=O)c2nn(-c3ccccc3C)c(=O)c(C#N)c2C)c1 409051448 ADWRJCPUNCYBKD-MXAYSNPKSA-N 431.452 2.502 50 40 IFGB CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\Nc1ccc(C)c(CN2C(=O)c3ccccc3C2=O)c1 2071128 XGVHDHRVLVXMJS-MTJSOVHGSA-N 440.459 2.926 50 40 IFGB N#C/C(=C/c1ccc(OCc2ccc(I)cc2)cc1)C(=O)NC(N)=O 409231887 LOGAVROWICHYGF-ZROIWOOFSA-N 447.232 2.972 50 40 IFGB Cc1cccn2c(=O)c(/C=C(\C#N)C(=O)N3CCOCC3)c(Oc3ccccc3F)nc12 13810754 HGVJUWHPNPHJNG-DTQAZKPQSA-N 434.427 2.700 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)[C@@H]2COc3ccccc3O2)cc1)NC1CCCCC1 28214968 RWPFXMUTEYHQEP-PWYGXMRTSA-N 437.496 2.804 50 40 IFGB C/C(Cn1nc([N+](=O)[O-])cc1C)=N/NC(=O)c1ccccc1I 38204263 MJOAEHQMWUUVCI-SXGWCWSVSA-N 427.202 2.510 50 40 IFGB CCOc1cc(/C=N/NC(=O)[C@@H](NS(=O)(=O)c2ccc(C)cc2)C(C)C)ccc1O 408759372 CYWLGAWPBWLLDU-BOURKTIISA-N 433.530 2.553 50 40 IFGB CCOc1cc(/C=N/NC(=O)CN(c2cc(Cl)ccc2C)S(C)(=O)=O)ccc1O 408790562 SKHXMNCNAFGOIC-SRZZPIQSSA-N 439.921 2.669 50 40 IFGB CCOc1ccccc1/C=N/NC(=O)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 408972052 RGSJODIQUASNRS-HZHRSRAPSA-N 433.505 2.775 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc(Br)c1)c1cccc(F)c1 409117093 KPVVQXCBAIWFQS-VXLYETTFSA-N 428.283 2.505 50 40 IFGB CCCCN1C(=O)c2ccc(C(=O)NNC(=O)c3cc(Cl)ccc3OC)cc2C1=O 3364037 AAHUWTUPJPRJPY-UHFFFAOYSA-N 429.860 2.820 50 40 IFGB CCOc1cc(C(=O)NNC(=O)c2ccc(F)cc2)ccc1OCC(=O)N1CCCCC1 8778417 HAQHSKHLBJWLLY-UHFFFAOYSA-N 443.475 2.691 50 40 IFGB O=C1N(CN2CCN(c3ccccc3F)CC2)c2ccccc2[C@]12OC[C@H](CCl)O2 19907382 LTGBZDKDHHJQAE-KSFYIVLOSA-N 431.895 2.759 50 40 IFGB Cn1c(CC(=O)NNC(=O)c2csc(COc3ccc(F)cc3)n2)nc2ccccc21 29463106 MTYWONSUWMAYPX-UHFFFAOYSA-N 439.472 2.752 50 40 IFGB COc1ccc(N(CC(=O)N/N=C(\C)c2ccc(Cl)cc2)S(C)(=O)=O)c(OC)c1 408780381 BLRNYTYYNUYENU-FYJGNVAPSA-N 439.921 2.664 50 40 IFGB Cc1ccc(S(=O)(=O)CC(=O)NNC(=S)Nc2ccc(OC(F)(F)F)cc2)cc1 2381065 KPYIHHIMPUXXAG-UHFFFAOYSA-N 447.460 2.685 50 40 IFGB NS(=O)(=O)c1cc(C(=O)NNC(=S)Nc2cccc3ccccc23)ccc1Cl 9509550 LXUAITMVLNFEGV-UHFFFAOYSA-N 434.930 2.772 50 40 IFGB CCOc1ccccc1N(CC(=O)N/N=C/c1ccc(N(CC)CC)cc1)S(C)(=O)=O 408773035 OXJPTLNULDUSAJ-XQNSMLJCSA-N 446.573 2.848 50 40 IFGB Cc1cc(C)c(S(=O)(=O)NCC(=O)N/N=C/c2c(O)ccc3ccccc23)c(C)c1 409143467 GTHDGBZVRFXVIJ-FSJBWODESA-N 425.510 2.899 50 40 IFGB CN1C(=O)/C(=N/NC(=O)c2ccc(N(C)S(=O)(=O)c3ccccc3)cc2)c2ccccc21 409341921 CIJNJAOWDNITLL-DARPEHSRSA-N 448.504 2.622 50 40 IFGB CCC(=O)Nc1ccc(C(=O)NNC(=O)COc2ccc(Br)c(C)c2)cc1 674563 PJZNOFCUMCBKCG-UHFFFAOYSA-N 434.290 2.946 50 40 IFGB CCCOc1ccc(-c2c(C(=O)N/N=C/c3cccs3)nnn2-c2nonc2N)cc1 2239632 LWQISNUWCXVVCJ-SRZZPIQSSA-N 438.473 2.514 50 40 IFGB COc1ccc(/C=N/NC(=O)COc2ccc(I)cc2)c(OC)c1 9948972 DJVQWKGFAPCECC-VXLYETTFSA-N 440.237 2.838 50 40 IFGB CCn1c(CCC(=O)NNc2ccc(F)cc2)nc2cc(S(=O)(=O)N(C)C)ccc21 12520538 AFKNSXJPSTZFTC-UHFFFAOYSA-N 433.509 2.522 50 40 IFGB COc1cccc(/C=N/NC(=O)C2CCN(C(=O)c3cc(OC)cc(OC)c3)CC2)c1 15225700 NDOGKQIGDIUYAY-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2ccc(OCC)cc2)S(C)(=O)=O)cc1 20210662 VISYGBPZRHTRBZ-PXLXIMEGSA-N 431.514 2.566 50 40 IFGB O=C(CN(C1CCCCC1)S(=O)(=O)c1ccccc1)N/N=C\c1ccc(C(=O)O)cc1 39986466 BOYCZEXKYZLRHT-HAHDFKILSA-N 443.525 2.859 50 40 IFGB COC(=O)COc1c(Br)cc(/C=C(/C#N)C(=O)N(C)C)cc1Br 59333960 GXVIBTGKTSMRGT-WMZJFQQLSA-N 446.095 2.759 50 40 IFGB COc1ccc(CCNC(=O)CC(=O)N/N=C\c2c(O)ccc3ccccc23)cc1OC 59444521 YCTMEIQVPITIGI-YSMPRRRNSA-N 435.480 2.762 50 40 IFGB Cc1c(Cl)cccc1NC(=O)COC(=O)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@H]2Br 408688148 VVBSDHXAHGJLEU-KUIBADSUSA-N 442.693 2.701 50 40 IFGB O=C(CSc1ncc(C(F)(F)F)cc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1 9160138 OOIDRCQJGLNLNJ-ZDUSSCGKSA-N 447.822 2.833 50 40 IFGB C[C@H]1C/C(=N\NC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC(C)(C)C1 12599603 WPWBUEOMELTWOC-BUVGWWEQSA-N 435.590 2.959 50 40 IFGB COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2C[C@H]2C)ccc1Cl 12733711 PCRVNEITPOBTGZ-YPMHNXCESA-N 437.905 2.566 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1)c1cccc2ccccc12 19955155 WOWZFFMYEPHETQ-FYJGNVAPSA-N 426.454 2.664 50 40 IFGB O=C(COc1ccccc1-c1ccccc1)NNC(=O)c1cnn(CCN2CCCCC2)c1 72284113 NHFMRJXNOUSISY-UHFFFAOYSA-N 447.539 2.876 50 40 IFGB CCOc1ccc(/C=N/NC(=O)CN(c2ccc(OC)c(Cl)c2)S(C)(=O)=O)cc1 408771229 DSEXHVXJEBLCAI-CIAFOILYSA-N 439.921 2.664 50 40 IFGB Cc1cccc(C)c1NC(=O)COc1ccc(/C=N/NC(=O)C(=O)NCc2ccco2)cc1 409270985 SKVKKGQAYIQHOL-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB Cc1cccc2c1NC(=O)/C2=N\NC(=O)[C@@H](C)n1cnc2sc3c(c2c1=O)CCCC3 6166297 NRCWANWNWKFHNX-GFCCVEGCSA-N 435.509 2.679 50 40 IFGB O=C(N/N=C/c1ccc2c(c1)OCO2)c1nc2ccccc2c(=O)n1Cc1ccccc1 28218166 WGVPLZRBBKMMLZ-DHRITJCHSA-N 426.432 2.937 50 40 IFGB CCOC(=O)/C(C#N)=C\c1ccc(OCC(=O)Nc2ccc(C(=O)OC)cc2)c(OC)c1 33344350 AFWXQVIDYVPEQS-BOPFTXTBSA-N 438.436 2.969 50 40 IFGB N#C/C(=C/c1ccc(OCc2ccccc2)c(I)c1)C(=O)NC(N)=O 409238975 XWWMVQMTMTXFMI-ZSOIEALJSA-N 447.232 2.972 50 40 IFGB CSCC[C@@H](C(=O)NNC(=O)c1ccc(Cl)cc1)N1C(=O)c2ccccc2C1=O 3293004 UPADVEMLJXTZCK-INIZCTEOSA-N 431.901 2.519 50 40 IFGB O=C(N/N=C/c1ccccc1Br)c1cccc(S(=O)(=O)N2CCCC2)c1 3470356 XSDNTVQEVRPXFS-DEDYPNTBSA-N 436.331 2.998 50 40 IFGB C[C@H]1Cc2cc(C(=O)NNC(=O)Cc3cccc4ccccc34)ccc2N1S(C)(=O)=O 12636812 HSEGLLOHLIYORB-HNNXBMFYSA-N 437.521 2.554 50 40 IFGB COc1ccc(-c2cc(C(=O)NNC(=S)Nc3ccc(OC)c(OC)c3)n[nH]2)cc1 15023477 XLESEUHBPFIPBB-UHFFFAOYSA-N 427.486 2.734 50 40 IFGB Cc1ccc(NC(=O)CCC(=O)OCC(=O)NNC(=O)c2ccccc2Cl)cc1C 408661125 DIHDXHBTNXMBPD-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB CC(C)[C@@H](NC(=O)c1ccccc1NC(=O)c1ccco1)C(=O)NNC(=O)c1ccccc1 3144085 GJFGKRUHMYUACA-HXUWFJFHSA-N 448.479 2.748 50 40 IFGB O=C(COc1ccc(Br)cc1)NC(=S)NNC(=O)c1ccc(Cl)cc1 12572073 IRKCKKXGLQNZOT-UHFFFAOYSA-N 442.722 2.817 50 40 IFGB COc1ccc(Cl)cc1NC(=O)C/C(C)=N/NC(=O)C(=O)Nc1ccccc1OC 16136798 UVYQYLDDKBROPX-WYMPLXKRSA-N 432.864 2.817 50 40 IFGB COC(=O)c1ccc(N2C(=O)[C@H]3C[C@@H](Br)[C@@H](Br)C[C@H]3C2=O)cc1 102065872 ZAMKNSHEIWXLKP-FNFFVJSTSA-N 445.107 2.900 50 40 IFGB C/C(N)=C(\C#N)C(=O)COC(=O)CSc1nnc(-c2ccccc2)n1-c1ccccc1 104417639 ROOSHSLWWAVSQW-SDXDJHTJSA-N 433.493 2.895 50 40 IFGB CCc1ccc(N2C[C@@H](C(=O)N/N=C\c3cc(OC)c(OC)c(OC)c3)CC2=O)cc1 409163302 PHCJHBIFYRINFL-GHRPQRKGSA-N 425.485 2.778 50 40 IFGB COc1cccc(-c2csc3nnc(SCC(=O)NNC(=O)c4ccco4)n23)c1 12878717 CPAPGPXACKWURN-UHFFFAOYSA-N 429.483 2.613 50 40 IFGB O=C(CN(c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccccc1)N/N=C/c1ccco1 19952431 HGAHEVPEZYBCRP-DEDYPNTBSA-N 428.426 2.533 50 40 IFGB COc1cc(/C=N\NC(=O)c2ccc(C)nc2)cc(I)c1OC 30721918 FNEOUGSUNPVWPU-UWVJOHFNSA-N 425.226 2.776 50 40 IFGB O=C(NNS(=O)(=O)c1ccc(Br)cc1C(F)(F)F)NC1CCCC1 84339178 DRJCEGFRCACMMP-UHFFFAOYSA-N 430.246 2.903 50 40 IFGB C[C@@H](Oc1ccccc1Br)C(=O)NNC(=O)c1cc2ccccc2oc1=O 649804 CYWWWQJVQDRETR-LLVKDONJSA-N 431.242 2.784 50 40 IFGB CCCOc1ccc2[nH]c(C(=O)NNC(=O)CCC(=O)NCCc3ccccc3)cc2c1 9762541 LVBRCUJTESTRRX-UHFFFAOYSA-N 436.512 2.857 50 40 IFGB COc1cc(/C=N\NC(=O)[C@H](C)n2cnc3sc4c(c3c2=O)CCCC4)ccc1O 31858977 JHFBEXQXOQWOJB-XNIDKHOESA-N 426.498 2.762 50 40 IFGB CCc1ccc(-n2nc(C(=O)N/N=C\c3cccc(OC)c3OC)c(C)c(C#N)c2=O)cc1 409062697 ZCZBDQXOGKEQFS-WGARJPEWSA-N 445.479 2.756 50 40 IFGB O=C(NNC(=O)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1)c1ccc([N+](=O)[O-])cc1 409225126 OPMISSFEWGNVIS-UHFFFAOYSA-N 449.379 2.830 50 40 IFGB COc1cc(/C=N\NC(=O)Cc2ccc3c(c2)OCCO3)cc(Br)c1OC 409363096 KXYFJRPENYDPBS-NHDPSOOVSA-N 435.274 2.930 50 40 IFGB Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc43)c2)cc1 3376562 OIDDXQIPQRVBAC-UHFFFAOYSA-N 435.505 2.821 50 40 IFGB Cc1cc2c(c(=O)n1C)[C@]1(C(=O)N(Cc3ccc(F)cc3)c3ccccc31)C(C#N)=C(N)O2 9972396 HPMXZUOGJGQJBE-RUZDIDTESA-N 442.450 2.752 50 40 IFGB Cc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(Br)cc3)CC2=O)c(C)c1 408645607 VBBUUVXGPSAFSX-HNNXBMFYSA-N 430.302 2.880 50 40 IFGB O=C(Nc1cccc(C(=O)N2CCCCC2)c1)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@@H]2Br 408684811 ODSFTYWODOKHGI-KKFZBWNWSA-N 447.329 2.822 50 40 IFGB COC(=O)c1ccc(/C=N/NC(=O)[C@H](CC(C)C)NC(=O)COc2ccccc2C)cc1 408972108 SABPBNHIEGTQEH-LEEXQRRLSA-N 439.512 2.842 50 40 IFGB Cc1cc(C)n(C(=O)/C(C#N)=C/c2cc(I)c(O)c([N+](=O)[O-])c2)n1 408980782 XKHAXCWTUQRKFY-NYYWCZLTSA-N 438.181 2.966 50 40 IFGB Cc1c(C(=O)N/N=C\c2ccc(N(C)C)cc2)nn(-c2ccc(Cl)cc2)c(=O)c1C#N 409060136 TZEUIEUXQGEZRC-MXAYSNPKSA-N 434.887 2.896 50 40 IFGB Cc1cc2nnc(SCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)n2c2ccccc12 6195126 NKYIICOGAJMBCX-UHFFFAOYSA-N 436.453 2.652 50 40 IFGB CCOC(=O)c1c(C)n(C)c2ccc(OCC(=O)N/N=C3\C(=O)Nc4ccccc43)cc12 8739831 IFTXMZJUCBXWLW-UHFFFAOYSA-N 434.452 2.515 50 40 IFGB Cc1cc(Cl)ccc1OCCCC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 9868525 LMAIUDZGYHPOBZ-UHFFFAOYSA-N 449.847 2.720 50 40 IFGB O=C(Cc1ccccc1)N/N=C/c1ccc(CNC(=O)C(=O)Nc2cccc(Cl)c2)o1 408867703 JSJBPBYDMNTOOP-AFUMVMLFSA-N 438.871 2.881 50 40 IFGB CC(=O)Oc1ccc(/C=N/NC(=O)COc2ccccc2Br)c(OC(C)=O)c1 994347 CGLYBUUEAJTRDW-UFFVCSGVSA-N 449.257 2.829 50 40 IFGB COc1ccc(OC)c(/C=N\NC(=O)Cn2cnc3sc4c(c3c2=O)CCCC4)c1 6166594 WOVZKNBMPUOWKM-RMORIDSASA-N 426.498 2.504 50 40 IFGB Cc1cccc2c1NC(=O)[C@@]21C=C2c3cc4c(cc3CCN2C(N)=C1C#N)OCCCO4 9130313 PMGLYWIBIMJSQZ-VWLOTQADSA-N 426.476 2.953 50 40 IFGB O=C(Cc1ccc(Br)cc1)N/N=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 9204015 ZBBSVBHAISSVPU-FYJGNVAPSA-N 447.289 2.887 50 40 IFGB COc1ccc(C(=O)NC2=N/C(=C(/C#N)C(=O)N3C[C@H](C)O[C@H](C)C3)c3ccccc32)cc1 13120383 XZKSTTHJHIHPGM-MVFCNCFGSA-N 444.491 2.756 50 40 IFGB Cc1ccc(S(=O)(=O)NCc2ccc(/C=C(/C#N)C(=O)NCc3cccnc3)o2)cc1 13425210 CYFYRTGRBGQZSW-WQRHYEAKSA-N 436.493 2.685 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2c(C)cc(C)cc2C)c1 409266010 JBLRAJHZRQIEMI-PYGAFPFSSA-N 438.528 2.994 50 40 IFGB COc1ccc(CC(=O)N/N=C\c2cc([N+](=O)[O-])cc(Br)c2O)cc1OC 409360014 CXRDOPUMBOSJEC-OCKHKDLRSA-N 438.234 2.773 50 40 IFGB Nc1nonc1-c1nc2ccccc2n1CC(=O)N/N=C/c1cccc(Br)c1 9210845 KPNDFCDFANXXQI-ZVBGSRNCSA-N 440.261 2.581 50 40 IFGB CCN(C[C@H]1COc2ccccc2O1)C(=O)NNC(=O)c1cncn1-c1ccc(F)cc1 9467329 AHOSGIPGNVGAMT-KRWDZBQOSA-N 439.447 2.528 50 40 IFGB CC/C(=N\NC(=O)CN(c1ccc(F)cc1)S(C)(=O)=O)c1ccc(OC)c(OC)c1 20211830 MCRZDMIPCWLKNT-OQKWZONESA-N 437.493 2.539 50 40 IFGB Cc1cccc(C)c1NC(=O)COc1cccc(/C=N/NC(=O)C(=O)NCc2ccco2)c1 409249666 KESNPQOWBXERGN-LGJNPRDNSA-N 448.479 2.680 50 40 IFGB Cc1cc2c(c(=O)n1CCN(C)C)[C@H](c1cccc(Br)c1)C(C#N)=C(N)O2 2247688 JISJVYNLYPMBIN-QGZVFWFLSA-N 429.318 2.699 50 40 IFGB Cc1cc2c(c(=O)n1Cc1ccc3c(c1)OCO3)[C@@H](c1ccc(O)cc1)C(C#N)=C(N)O2 2424299 DGQWFYIVDRQNSB-NRFANRHFSA-N 429.432 2.858 50 40 IFGB C/C(=N/NC(=O)CCC(=O)N/N=C(/C)c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1 4181543 GBPWNUGDGSMULY-JZTLMNBPSA-N 440.416 2.664 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3ccc(OC)c(OC)c3)[C@H]2C1 6195030 IIJLFGCSSSNMSQ-FXAWDEMLSA-N 433.468 2.586 50 40 IFGB Cc1cccc(NC(=O)C(=O)N/N=C/c2cccc(OCC(=O)NCc3ccccc3)c2)c1 409157371 IYQXRYLRYOIBNI-JVWAILMASA-N 444.491 2.779 50 40 IFGB COc1ccc(CCNC(=O)C(=O)N/N=C/c2cc(C)n(-c3ccccc3)c2C)cc1OC 6177841 PCXHZWOGANFVBN-JVWAILMASA-N 448.523 2.920 50 40 IFGB Cn1cc(/C=N/NC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)c(=O)n(C)c1=O 9885057 RDQHMRQJOWPRDZ-FOKLQQMPSA-N 442.928 2.794 50 40 IFGB C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 16322376 FITOQQHMZXXNFD-VIFPVBQESA-N 434.257 2.679 50 40 IFGB COc1ccc(Nc2ccc(Br)cc2/C=N/NC(=O)C(=O)NC2CC2)cc1 408707361 JJYLQBVRTJCJFL-SRZZPIQSSA-N 431.290 2.930 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(Br)cc3)C2)cc1OC 409272687 RPFKZMBBLKHZLN-HYLGSWLWSA-N 446.301 2.970 50 40 IFGB CCOC(=O)[C@](NC(=O)CCl)(Nc1sc(C)c(CC)c1C(=O)OC)C(F)(F)F 2308680 LXMJQVGHXFVEBQ-HNNXBMFYSA-N 444.859 2.994 50 40 IFGB O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)c1ccc2c(c1)OCCO2 3347231 IPPWZEDUQULYKF-UHFFFAOYSA-N 434.448 2.877 50 40 IFGB O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C1=O)O[C@H](CCCl)C(=O)c1ccc(F)cc1 102642661 WNUICOLQRVMPRT-GAIWEEKLSA-N 435.879 2.970 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)CN(c2ccc(C)c(Cl)c2)S(C)(=O)=O)c1 408775849 KKRNZROQGIYRRU-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB Cc1nc2ccccn2c1C(=O)N/N=C/c1ccc(OCC(=O)NCc2ccco2)cc1 409000092 MLAWLIKFVMJDJN-DHRITJCHSA-N 431.452 2.695 50 40 IFGB COc1cc(N2CCCC2)c(OC)cc1/C=N\NC(=O)COc1cccc(N(C)C)c1 409087771 JXTAKULEMYVAHV-IWIPYMOSSA-N 426.517 2.899 50 40 IFGB CCCCNC(=O)C(=O)N/N=C/c1ccccc1OCC(=O)Nc1ccccc1Cl 409151194 GRSPWYFUDOWPCF-ZMOGYAJESA-N 430.892 2.724 50 40 IFGB COCCNC(=O)Cn1cc(/C=C(\C#N)C(=O)Nc2ccc(OC)cc2)c2ccccc21 1769383 YPQTVFYDMXPWNZ-GHRIWEEISA-N 432.480 2.958 50 40 IFGB C/C(=N\NC(=O)c1ccccc1O)c1cccc(/C(C)=N/NC(=O)c2ccccc2O)n1 5664876 LZZXYEOYZNOUPB-LVSXPEEVSA-N 431.452 2.801 50 40 IFGB Cc1cccc(C)c1N(CC(=O)N/N=C/c1cccc(Br)c1)S(C)(=O)=O 19955361 DOBHJONUMFLDQJ-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB CN(C)C(=O)/C(C#N)=C\c1cc(Br)c(OCC(=O)O)c(Br)c1 59333958 AIEHSWFPMCTCEI-OQFOIZHKSA-N 432.068 2.670 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2cccc(Cl)c2)c1 409264148 PFRWCCQREPFDAJ-XMTZNVEYSA-N 430.892 2.722 50 40 IFGB COc1cccc(C(=O)Nc2cccc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)c2)c1 9970972 LEYFEJOOGWKFCI-UHFFFAOYSA-N 433.420 2.751 50 40 IFGB CCN(CC)CN1C(=O)/C(=N\NC(=O)c2cccnc2)c2cc(Br)ccc21 13387801 AVHXBFBDEDPBQH-XLNRJJMWSA-N 430.306 2.624 50 40 IFGB OCC[C@]12[C@H](I)[C@@H]3[C@@H]4[C@@H]5C[C@H]3[C@@H]1[C@@H]5[C@H](I)[C@H]42 261361221 LPPSJDDLSOALBA-VQRMTDLWSA-N 442.078 2.734 50 40 IFGB Cc1ccc(NC(=O)/C(C#N)=C/c2c(N3CCN(C)CC3)nc3c(C)cccn3c2=O)cc1 2204582 RPYXBLMRSNOJLT-XDJHFCHBSA-N 442.523 2.609 50 40 IFGB C/C(N)=C(\C#N)C(=O)CSc1nc2nn(-c3ccccc3)c(=O)c-2c2n1CCCCC2 104350380 VWTONBXQHHMNPY-PEZBUJJGSA-N 434.525 2.678 50 40 IFGB CC[C@H](C)Oc1c(I)cc(/C=C(/C#N)C(=O)NC(N)=O)cc1OC 409237735 BPDVWTRFQOVNDX-BVBCSLMJSA-N 443.241 2.579 50 40 IFGB COC(=O)C(C#N)=Cc1ccc(OCCOCCOS(=O)(=O)c2ccc(C)cc2)cc1 2362797585 MQVPCXZIQRYNMP-UHFFFAOYSA-N 445.493 2.876 50 40 IFGB Cc1cc2c(c(=O)n1C)[C@@]1(C(=O)N(Cc3cccc(F)c3)c3ccccc31)C(C#N)=C(N)O2 9743091 RZDCPHZMHIFLMS-VWLOTQADSA-N 442.450 2.752 50 40 IFGB CCc1ccc(N(CC(=O)NN=C2CCN(C)CC2)S(=O)(=O)c2ccccc2)cc1 409027881 ICMOMVNGAUDZAG-UHFFFAOYSA-N 428.558 2.642 50 40 IFGB Cc1ccccc1C[C@H]1S/C(=C(\C#N)C(=O)NN2CCOCC2)N(c2ccccc2)C1=O 11690289 DYDVASCUWATGAN-KWLPWJRRSA-N 448.548 2.785 50 40 IFGB O=C(NN[C@H](CNS(=O)(=O)c1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 16758519 VZLVKCVUSAXHLG-HXUWFJFHSA-N 440.481 2.549 50 40 IFGB CCCCOC(=O)c1cc([N+](=O)[O-])cc2c1-c1ccc([N+](=O)[O-])cc1/C2=N/NC(N)=O 33361293 DMOCFVXVUCEVFL-FXBPSFAMSA-N 427.373 2.861 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)N2CCCCC2)cc1)Nc1cccc(Cl)c1 58880663 MALWMZNABPNKJS-ZVHZXABRSA-N 442.903 2.820 50 40 IFGB O=C1CC=C2[C@@H]3N1c1cc(O)c(O)cc1[C@]31CCN3C/C(=C/CBr)[C@H]2C[C@@H]31 61953317 VFOJBHJJEXIGII-DCHOBVASSA-N 429.314 2.810 50 40 IFGB O=C(N/N=C/[C@H]1C(=O)NC(=O)N(c2ccccc2F)C1=O)c1ccc(Cl)cc1Cl 105734078 BDPZYCJJWGZYAG-SBRBXRRPSA-N 437.214 2.747 50 40 IFGB COCc1cc(C)n(CC(=O)N/N=C/c2ccc(-c3ccc(F)cc3F)o2)c(=O)c1C#N 408605986 ZXISDCSKBXISEY-NSKAYECMSA-N 440.406 2.863 50 40 IFGB COc1cc(/C=N/NC(=O)C2CCN(C(=O)c3ccccc3)CC2)cc(OC)c1OC 409004393 CJEKYPXOLWZGGY-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB O=C(Cc1cccc2ccccc12)N/N=C/[C@H]1C(=O)NC(=S)N(c2ccccc2)C1=O 18193309 VYUQMXFZSMLRKI-OEBVFIGYSA-N 430.489 2.548 50 40 IFGB Cc1ccc(SCC(=O)NNC(=O)C2CCN(C(=O)OCC(F)(F)F)CC2)cc1 25500674 LBSFXIQNKRJJCL-UHFFFAOYSA-N 433.452 2.645 50 40 IFGB CCOC(=O)c1ccc(NC(=O)C(=O)N/N=C/c2cc(Br)ccc2OC)cc1 59434178 LMQJLAWUICNPLW-SRZZPIQSSA-N 448.273 2.723 50 40 IFGB Cc1ccc(NC(=O)CCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1C 408663941 PTTPSAFSBKCADB-UHFFFAOYSA-N 431.876 2.680 50 40 IFGB COc1ccc(NC(=O)/C(C#N)=C/c2cc(Br)ccc2OCC(N)=O)cc1 409226709 RRFLNVDTRJNGGG-MDWZMJQESA-N 430.258 2.867 50 40 IFGB Cc1ccc(C[C@H]2S/C(=C(\C#N)C(=O)NN3CCOCC3)N(c3ccccc3)C2=O)cc1 9970596 IACFEEUTVNBDLU-KWLPWJRRSA-N 448.548 2.785 50 40 IFGB Cc1ccc(N(CC(=O)N/N=C/c2ccccn2)S(=O)(=O)c2ccc(F)cc2)cc1 20231981 PNOPJYFBQCEPMQ-ZVHZXABRSA-N 426.473 2.875 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc1)NC[C@H]1CCCO1 28215168 IWUUVYJFWPURRF-GZQNEBGJSA-N 445.903 2.543 50 40 IFGB COc1ccc([C@H]2C(C#N)=C(N)OC3=C2S(=O)(=O)N(C)c2ccccc23)cc1OC 57510514 YZZNYCJQSDQPDL-SFHVURJKSA-N 425.466 2.660 50 40 IFGB COc1cc(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])ccc1OC(=O)c1ccco1 1435634 HDAWUERQDQYPAA-WSDLNYQXSA-N 439.380 2.945 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2cccc(C)c2C)S(C)(=O)=O)cc1OC 2085090 NXMBTDHVWPHJMM-OEAKJJBVSA-N 445.541 2.793 50 40 IFGB CCCCOc1ccc(/C=N/NC(=O)C(=O)NCCc2ccc(OC)c(OC)c2)cc1 5466185 WUHVLGVINUQYRV-PCLIKHOPSA-N 427.501 2.692 50 40 IFGB CC(C)n1nc(C(=O)N/N=C/c2ccc(N3CCOCC3)s2)c2ccccc2c1=O 9506910 PHBIXAUCFFJADO-LPYMAVHISA-N 425.514 2.639 50 40 IFGB O=C(CC1(CC(=O)N2CCOCC2)CCCC1)NNC(=O)c1cc2c(s1)CCCCC2 12741794 IXIKGTRVEMVSCM-UHFFFAOYSA-N 447.601 2.977 50 40 IFGB CSc1ccc(N2C[C@@H](C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)CC2=O)cc1 12858069 ZWHSVBSBCFMNFC-KGLIPLIRSA-N 431.489 2.515 50 40 IFGB CCOc1ccccc1N1C(=O)N=C(O)/C(=C/NNC(=O)c2ccccc2Cl)C1=O 38163600 DRDQAYJSRQNPSJ-QBFSEMIESA-N 428.832 2.980 50 40 IFGB Cc1cccc(N(CC(=O)N/N=C/c2ccc(OC3CSC3)cc2)S(C)(=O)=O)c1C 57525429 KNONINOXSHZMTK-SSDVNMTOSA-N 447.582 2.714 50 40 IFGB CC1=C(C#N)C(=O)N([C@H]2CCS(=O)(=O)C2)C(=O)/C1=C/Nc1ccc(Cl)cc1Cl 102675958 CPISOWKWPWQFEQ-ACLQVGRQSA-N 440.308 2.685 50 40 IFGB CCOc1ccc(/C=N/NC(=O)[C@@H](C)N(c2ccccc2)S(C)(=O)=O)cc1OCC 408906275 FCRSZASGXYMHBI-QFNCUCFLSA-N 433.530 2.789 50 40 IFGB CC1(C)CC(=O)C2=C(C1)N(c1ccc(S(N)(=O)=O)cc1)C(N)=C(C#N)[C@@H]2c1ccco1 2211518 HQPWYIXXBTZYQI-LJQANCHMSA-N 438.509 2.868 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccnc1)c1cc(C(F)(F)F)ccc1Cl 408906593 IBLHMJSDKOSKHM-LSFURLLWSA-N 434.827 2.670 50 40 IFGB CCOc1cc(/C=N\NC(=O)c2ccc(Cl)cc2)ccc1OCC(=O)N1CCOCC1 409011308 FZVXCSYEEQCXLE-OYKKKHCWSA-N 445.903 2.740 50 40 IFGB CN(C)c1ccc(/C=N/NC(=O)CN(c2cc(Cl)ccc2Cl)S(C)(=O)=O)cc1 409026199 IQODQTPITMHBCX-SRZZPIQSSA-N 443.356 2.976 50 40 IFGB COc1cccc(NC(=O)[C@H](NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc2)c1 15472253 DEEDHBNQJPPHGZ-FCHUYYIVSA-N 433.464 2.836 50 40 IFGB O=C(CCn1cnc2sc3c(c2c1=O)CCCC3)NNC(=O)c1ccc(Cl)cc1 16202474 HTBPPWUIZDOHAG-UHFFFAOYSA-N 430.917 2.842 50 40 IFGB O=C(CN1CCOCC1)N/N=C\c1ccccc1OCc1ccc(Br)cc1 33349255 MBGQUZRTAHXERK-XKZIYDEJSA-N 432.318 2.810 50 40 IFGB COC(=O)COc1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1OC 408967100 SEOGPEQIQGVXIT-UFFVCSGVSA-N 427.369 2.665 50 40 IFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3cc(C)n(C)c(=O)c32)cc(Br)c1OC 20086758 DNOYTPGHSWXQNG-OAHLLOKOSA-N 432.274 2.692 50 40 IFGB O=C(CSc1nc2sccc2c(=O)n1-c1ccccc1)NNC(=O)c1ccco1 23591756 OLUNLNCHPLJHAN-UHFFFAOYSA-N 426.479 2.594 50 40 IFGB CCOC(=O)[C@@H](NC(=O)C(Cl)Cl)[C@H](OC(=O)C(Cl)Cl)c1ccccc1 100538195 GPGUHASJQNXDSM-VHSXEESVSA-N 431.099 2.926 50 40 IFGB Cc1ccccc1OCC(=O)NCC(=O)N/N=C/c1ccc(-c2ccccc2C(=O)O)o1 409150202 AUXZWLNDJRIYAY-BRJLIKDPSA-N 435.436 2.599 50 40 IFGB O=C1[C@H]2[C@@H]3C[C@@H]([C@@H](Br)[C@H]3Br)[C@@H]2C(=O)N1c1ccc([N+](=O)[O-])cc1 4015937 ZCDMNVVYMXYOLY-XALSLBCYSA-N 444.079 2.877 50 40 IFGB COC(=O)c1ccc(N2C(=O)[C@H]3C[C@@H](Br)[C@H](Br)C[C@H]3C2=O)cc1 4156902 ZAMKNSHEIWXLKP-YVECIDJPSA-N 445.107 2.900 50 40 IFGB Cc1cccc(CN2C(=O)[C@@]3(C(C#N)=C(N)Oc4cc(C)n(C)c(=O)c43)c3ccccc32)c1 9743076 CXZWDIWGPQPEGZ-AREMUKBSSA-N 438.487 2.921 50 40 IFGB O=C(CN(C1CCCCC1)S(=O)(=O)c1ccccc1)N/N=C\c1ccc2c(c1)OCO2 39986436 ZKCZQYTURALUEF-UCQKPKSFSA-N 443.525 2.889 50 40 IFGB O=C(CCC(=O)OCC(=O)Nc1ccccc1Cl)NNC(=O)c1ccc(Cl)cc1 138767221 OFMLVIXEMDDUGL-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3ccc(OC)cc3OC)CC2)cc1 409005442 IQKWYNYOHKLIRK-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2cc(Cl)ccc2Cl)S(C)(=O)=O)c1 409028082 JRMBMEDPALAKOR-KEBDBYFISA-N 430.313 2.918 50 40 IFGB O=C(N/N=C/c1cc(Br)cc(I)c1O)c1cccnc1 1434032 QXZNUKBOHVTOSE-REZTVBANSA-N 446.042 2.918 50 40 IFGB CCOc1ccc2ccccc2c1/C=N/NC(=O)CNC(=O)c1ccc2c(c1)OCCO2 2268638 PFSGFDIGLXFVKJ-VULFUBBASA-N 433.464 2.890 50 40 IFGB O=C(NNS(=O)(=O)c1cccc(OC(F)(F)F)c1)c1ccccc1Br 12895230 YPELYPIUYQJDNX-UHFFFAOYSA-N 439.209 2.971 50 40 IFGB CC(C)(C)c1ccc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCCc4ccccc43)C2=O)cc1 12973646 SWYVYXYMKXHCRY-RUZDIDTESA-N 448.523 2.529 50 40 IFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3ccc([N+](=O)[O-])cc3)CC2)cc1OC 409005705 KACKEWBNYKANPD-OEAKJJBVSA-N 440.456 2.615 50 40 IFGB Cc1c(C(=O)N/N=C\c2ccc(O)cc2)nn(-c2cccc(C(F)(F)F)c2)c(=O)c1C#N 409053693 HBEXQTFBPOOCNL-RAWMCFOBSA-N 441.369 2.901 50 40 IFGB CCOc1cc(C(=O)NNC(=O)c2cccs2)ccc1OCC(=O)N1CCCCC1 9509380 XUXKRWHMLDQPMQ-UHFFFAOYSA-N 431.514 2.613 50 40 IFGB C=CCOC(=O)C1=C(C)NC(SCC(=O)NC(=O)OCC)=C(C#N)[C@@H]1c1cccnc1 100830484 FXICRDCGAVJNJN-SFHVURJKSA-N 442.497 2.513 50 40 IFGB COc1ccccc1N(CC(=O)N/N=C/c1ccc(OCC(C)C)cc1)S(C)(=O)=O 408907130 LEDLFTFZLBOIIA-LPYMAVHISA-N 433.530 2.646 50 40 IFGB Cc1ccc(Cl)cc1NC(=O)COc1cccc(/C=N/NC(=O)C(=O)NCC(C)C)c1 409172296 BXEIQVGPINLXRT-BRJLIKDPSA-N 444.919 2.888 50 40 IFGB Cc1cc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)c2cccs2)c(C)n1CC(C)C 8876630 FQKQJKKLGGEKBU-RQZCQDPDSA-N 428.514 2.734 50 40 IFGB O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2cccc3ccccc23)C1)c1ccc2c(c1)OCO2 49600770 LDUAVHJPODPWAT-GOSISDBHSA-N 445.475 2.882 50 40 IFGB Cc1ccc(S(=O)(=O)N(CCc2ccccc2)CC(=O)N/N=C/c2cccnc2)cc1 59427947 OKWWHLVMYQAKJK-KOEQRZSOSA-N 436.537 2.774 50 40 IFGB C=CCn1c(Cl)c(/C=N\NC(=O)OCC)s/c1=N/S(=O)(=O)c1cccs1 105477535 KBLKRQRAURKSHO-ULAZCBQLSA-N 434.952 2.820 50 40 IFGB Cc1ccc(NC(=O)COc2ccc(Cl)cc2/C=N/NC(=O)C(=O)NC2CC2)c(C)c1 409264726 RMLZUEDMNOHINT-BHGWPJFGSA-N 442.903 2.703 50 40 IFGB C#CCOc1c(I)cc(/C=C(\C#N)C(=O)N2CCCC2)cc1OC 409372863 RQXFIIRDLPSWJH-NTEUORMPSA-N 436.249 2.841 50 40 IFGB COc1cc([C@@H]2[C@@H](Cl)C(=O)N2NC(=O)c2ccc(NC(C)=O)cc2)cc(OC)c1OC 1633123 HIXFLJPXFRBGRX-QZTJIDSGSA-N 447.875 2.507 50 40 IFGB COc1cc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4cccc([N+](=O)[O-])c4)c32)cc(OC)c1O 8926582 SYWOWJQSAUPRNJ-MRXNPFEDSA-N 435.396 2.926 50 40 IFGB Cc1ccc(C(=O)Nc2ccc(C(=O)NNC(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C(=O)O)cc2)cc1 409370546 SVCXBMKPJUAOPR-QGZVKYPTSA-N 433.464 2.531 50 40 IFGB C#CCN1C(=O)/C(=N\NC(=O)COc2cccc(C)c2)c2cc(Br)ccc21 2304398 SXSRPVHRCZFFMF-NMWGTECJSA-N 426.270 2.637 50 40 IFGB Cc1cccn2c(=O)c(/C=C(\C#N)C(=O)NC[C@@H]3CCCO3)c(Oc3ccccc3)nc12 2423919 SZLZQJPCLMIHAW-UMEYKSNOSA-N 430.464 2.997 50 40 IFGB CCc1ccc2c(CC(=O)NNC(=O)Cc3nc4sc(C)c(C)c4c(=O)[nH]3)coc2c1 8986959 KCZOWEVVLAPNAU-UHFFFAOYSA-N 438.509 2.843 50 40 IFGB Cc1ccsc1/C=N/NC(=O)CN(c1ccc(Br)cc1)S(C)(=O)=O 20209947 CMBANMQXGHBXBG-RQZCQDPDSA-N 430.349 2.735 50 40 IFGB CCOc1cc(/C=N/NC(=O)C(=O)NCCOC)cc(Cl)c1OCc1ccccc1 408601500 BDFCOECCPHZJCP-ZMOGYAJESA-N 433.892 2.530 50 40 IFGB O=C(CNC(=O)c1ccc(F)cc1)N/N=C1\C(=O)N(Cc2ccccc2)c2ccccc21 2280168 ZQIATZPKTKXTKO-SLMZUGIISA-N 430.439 2.623 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@@H](c3cccc(OC)c3OC)[C@H]2C1 6195020 CLFYTHAIFVKTAI-HKUYNNGSSA-N 433.468 2.586 50 40 IFGB COc1ccccc1N(CC(=O)N/N=C/c1cccc(C(F)(F)F)c1)S(C)(=O)=O 8384155 HBQSRHQMQKCELN-SSDVNMTOSA-N 429.420 2.630 50 40 IFGB O=C(CCN1C(=O)/C(=C\c2ccccc2F)SC1=S)NNC(=O)c1ccc(O)cc1 12032355 DKTBUTNKMFYFOA-LFIBNONCSA-N 445.497 2.584 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(O)c1 12570091 JHNZYSTZBHAVKC-PXLXIMEGSA-N 431.514 2.729 50 40 IFGB COc1ccc(N(CC(=O)NN=C(C)C)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 19956097 ISBHBCRPHWWBCK-UHFFFAOYSA-N 434.474 2.619 50 40 IFGB CCCSc1ncc(Br)c(C(=O)NNC(=O)c2ccccc2[N+](=O)[O-])n1 28287070 SNTPYGXQVXFZIW-UHFFFAOYSA-N 440.279 2.724 50 40 IFGB Cc1cc(O)ccc1N1C(=O)[C@H]2[C@@H]3C[C@H]([C@@H](Br)[C@H]3Br)[C@@H]2C1=O 101052279 WHBYAKCYZUDQAB-IHLSGCPSSA-N 429.108 2.983 50 40 IFGB CCOc1ccc(N2C[C@@H](C(=O)NNC(=O)c3cccc(Br)c3)CC2=O)cc1 408614942 KBNBHNANYQSEOC-AWEZNQCLSA-N 446.301 2.662 50 40 IFGB COc1cccc(C(=O)N2CCC(C(=O)N/N=C/c3cc(OC)ccc3OC)CC2)c1 409007221 VPVFLYFACOEZCH-BUVRLJJBSA-N 425.485 2.715 50 40 IFGB Cc1cccc(N(CC(=O)N/N=C/c2ccccc2Br)S(C)(=O)=O)c1C 8384191 SXIKSFUPMYFZBY-RGVLZGJSSA-N 438.347 2.982 50 40 IFGB Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)c2ccc(COc3ccccc3)o2)c1C 13079370 CUAZOEZOCKAQGV-UHFFFAOYSA-N 444.465 2.797 50 40 IFGB COc1ccc(-n2c(C)cc(/C=N/NC(=O)C(=O)NC[C@H]3CCCO3)c2C)cc1Cl 15231444 HNFDBKLNAWKCJM-SCWWFSKWSA-N 432.908 2.501 50 40 IFGB CCCOc1ccc(/C=N/NC(=O)CN(c2ccc(OCC)cc2)S(C)(=O)=O)cc1 6500675 FUUDUWRXULCJFC-PXLXIMEGSA-N 433.530 2.790 50 40 IFGB CCc1ccc(OCC(=O)NNC(=O)CSc2nnc(-c3ccc(C)cc3)n2C)cc1 6843855 UVEKLFNQXDLTBN-UHFFFAOYSA-N 439.541 2.671 50 40 IFGB aggregator COc1ccc(CN2C(=O)/C(=C\NNC(=O)c3ccncc3)c3ccccc3C2=O)cc1 9509244 HXHRZWOLEOQMLT-STZFKDTASA-N 428.448 2.548 50 40 IFGB O=C(C[C@H](NS(=O)(=O)c1ccccc1)c1ccc(Cl)cc1)NNC(=O)c1ccco1 12768553 OZGOEZVGKPCTKP-KRWDZBQOSA-N 447.900 2.804 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccccc1Br)c1ccc(F)cc1 20211978 GENLRIYDVOLOBN-VXLYETTFSA-N 428.283 2.505 50 40 IFGB Cc1cc(O)ccc1N1C(=O)[C@H]2[C@@H]3C[C@@H]([C@@H](Br)[C@H]3Br)[C@@H]2C1=O 101052282 WHBYAKCYZUDQAB-NNHPCIIKSA-N 429.108 2.983 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1ccc(OCc2ccc(Br)cc2)c(OC)c1 408612965 XXVOCFMHCIAGKD-SSDVNMTOSA-N 434.290 2.623 50 40 IFGB COc1cc(I)c(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc1OC 408734957 MCAZPSMVWJRFQN-UWUHSAQLSA-N 442.253 2.511 50 40 IFGB Cc1cc(I)ccc1NCC(=O)N/N=C/c1ccc2c(c1)OCO2 1497528 BGLSCUFXLSDCKQ-DNTJNYDQSA-N 437.237 2.891 50 40 IFGB CCC(=O)c1ccc(OCC(=O)NNC(=O)COc2ccc(Br)cc2)cc1 2662964 RZWDJTPHLBPOKS-UHFFFAOYSA-N 435.274 2.647 50 40 IFGB O=C(CCN1C(=O)/C(=C\c2ccccc2F)SC1=S)NNC(=O)c1cccc(O)c1 12032352 INJNWIUVSUZGCY-LFIBNONCSA-N 445.497 2.584 50 40 IFGB Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)c1C 12747704 SUEDNERIPPHEIE-CYBMUJFWSA-N 426.441 2.528 50 40 IFGB Cc1cc(=O)c(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)nn1-c1ccccc1 14200398 GLWNRSJVWOWLIZ-UHFFFAOYSA-N 444.447 2.788 50 40 IFGB Cc1ccc(S(=O)(=O)N(CC(=O)N/N=C/c2cccnc2)Cc2ccccc2F)cc1 15225368 LSAXYNCDGOMMQK-AFUMVMLFSA-N 440.500 2.870 50 40 IFGB CCOC(=O)C1=C(CSc2nccc(O)n2)OC(N)=C(C#N)[C@@H]1c1ccccc1F 16682553 PPEKTMHLJOQVRB-INIZCTEOSA-N 428.445 2.738 50 40 IFGB Cc1cc(C(=O)NNC(=O)[C@@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c(C)o1 27666767 BYNPMOFYGNNHBN-FQEVSTJZSA-N 443.525 2.814 50 40 IFGB Cc1ccc(NC(=O)COc2ccccc2/C=N/NC(=O)C(=O)NC(C)C)cc1Cl 409156276 NPLQTGAZFKJAJN-FOKLQQMPSA-N 430.892 2.641 50 40 IFGB O=C(Cc1nnc(NC(=O)Nc2ccccc2)s1)N/N=C/c1cccc([N+](=O)[O-])c1 1920487 QTXAZZMZFLPUGS-YBFXNURJSA-N 425.430 2.783 50 40 IFGB COC(=O)COc1cccc(/C=N/NC(=O)c2ccc(I)cc2)c1 10118613 QDHZULSLYBGQFR-VXLYETTFSA-N 438.221 2.607 50 40 IFGB CCN1CCN(c2nc3c(C)cccn3c(=O)c2/C=C(\C#N)C(=O)NC2CCCCC2)CC1 13658862 IDVCZWZRPZJXDA-KNTRCKAVSA-N 448.571 2.501 50 40 IFGB O=C(CC(=O)N/N=C\c1ccc(OCC(=O)Nc2ccccc2)cc1)NCc1ccccc1 58873213 FQMVLHBKEVEDRJ-PKAZHMFMSA-N 444.491 2.861 50 40 IFGB C=CCOc1ccc(C(=O)N/N=C\c2ccc(OCC(=O)O)c(OCC)c2)cc1OC 409310545 VSISTBHAVUKMML-QRVIBDJDSA-N 428.441 2.886 50 40 IFGB COc1ccc(NC(=O)[C@@H]2CC(=O)N=C(NNC(=O)c3ccc(Cl)cc3)S2)cc1 9330002 ZGLBWPNKQIHGGK-HNNXBMFYSA-N 432.889 2.610 50 40 IFGB COc1ccc(CC(=O)NNC(=O)c2csc(-c3ccc(OC)c(OC)c3)n2)cc1 16491072 QPIACCFBOAEGIB-UHFFFAOYSA-N 427.482 2.840 50 40 IFGB COc1ccc(OC)c(/C=N/NC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1 58895647 DDHSFPJGYDWMHX-HZHRSRAPSA-N 445.541 2.563 50 40 IFGB CCn1c(SCC(=O)N/N=C/c2ccc(O)cc2)nnc1-c1ccc(OC)c(OC)c1 1477915 MANLRBYIKNEEKN-WSDLNYQXSA-N 441.513 2.930 50 40 IFGB COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNc3ccccc3C(F)(F)F)C2=O)cc1 68773292 PZLZNWKRPCGKNI-LJQANCHMSA-N 436.390 2.624 50 40 IFGB O=C(CN1C[C@@H](c2ccccc2)CC1=O)N/N=C/c1ccc(Br)c([N+](=O)[O-])c1 408974422 ZOOOFTKIVYOZLU-LKKXKRCMSA-N 445.273 2.824 50 40 IFGB COc1cc(/C=C2/C(=O)NC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc(SC#N)c1O 409046623 KOFUWDSNTYCUIV-ACAGNQJTSA-N 440.393 2.549 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2ccccc2Cl)c(Cl)c1 409174468 MOSWBDKROOYRIR-BHGWPJFGSA-N 449.294 2.763 50 40 IFGB COc1ccc(NC(=O)C(=O)N/N=C/c2ccc(OC(=O)c3ccco3)c(OC)c2)cc1 2420889 LAQDTLNDJLDAJM-YDZHTSKRSA-N 437.408 2.605 50 40 IFGB O=C(COC(=O)CCC(=O)Nc1ccc(Cl)cc1Cl)NNC(=O)c1ccccc1 408655558 LACFTZMKDMTQOU-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB O=C(COC(=O)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@@H]2Br)Nc1cccc2ccccc12 408679442 FCXLZOKLUDIBRL-YWALVYIISA-N 444.281 2.893 50 40 IFGB CN1CCN(c2ccc([N+](=O)[O-])cc2/C=N/NC(=O)c2cccc(Br)c2)CC1 409005035 CDRGZOKIYNVKJY-FYJGNVAPSA-N 446.305 2.873 50 40 IFGB COc1cccc(/C=N/NC(=O)c2ccc(N(C)S(=O)(=O)c3ccccc3)cc2)c1O 14166309 DAIAOUPKWXZKBV-HZHRSRAPSA-N 439.493 2.990 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)CN(c2cccc(C)c2)S(C)(=O)=O)cc1OCC 20207709 NVTRKQWKTHIGQJ-HZHRSRAPSA-N 445.541 2.875 50 40 IFGB COc1cccc(/C=N/NC(=O)Cc2nnc(NC(=O)c3cccc(C)c3)s2)c1O 59498628 VCVINNMFDABYCA-SRZZPIQSSA-N 425.470 2.506 50 40 IFGB COc1cccc(/C=N/NC(=O)CN(c2ccc(C)c(Cl)c2)S(C)(=O)=O)c1OC 408782199 WVBSJGMFWWRUNX-SRZZPIQSSA-N 439.921 2.582 50 40 IFGB Cc1ccc(C(=O)NNC(=O)N2CCN(c3c(F)c(F)c(F)c(F)c3F)CC2)cc1 9945505 BABKMCJFNCDWAG-UHFFFAOYSA-N 428.361 2.867 50 40 IFGB C/C(CC(=O)N[C@@H](C)c1ccccc1)=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 12401924 SGCIGTVAHMFCTB-KOUDTOEKSA-N 427.417 2.805 50 40 IFGB Cc1ccc(S(=O)(=O)N[C@H](CC(C)C)C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1 408762452 KVAWKJLLGVCLAG-DBRLUCFCSA-N 432.502 2.747 50 40 IFGB Cc1csc(CC(=O)NNC(=O)Cn2c(COc3ccccc3)nc3ccccc32)n1 12506256 KLIQWSJMBAKUDX-UHFFFAOYSA-N 435.509 2.770 50 40 IFGB COc1ccc(N2C(=O)[C@H]3[C@@H]4C[C@@H]([C@@H](Br)[C@@H]4Br)[C@@H]3C2=O)cc1 33353347 KHYQVLDAIPZWMH-XNBXPENISA-N 429.108 2.978 50 40 IFGB CCCN1C(=O)/C(=N/NC(=O)[C@H]2COc3ccccc3O2)c2cc(Br)ccc21 100180720 FCSWSAZZLFDENR-SFAXUQRRSA-N 444.285 2.866 50 40 IFGB O=C(CCCCl)Nc1ccc(S(=O)(=O)N2C[C@@H]3C[C@@H](C2)Cn2c3cccc2=O)cc1 100820032 MOJGHKPPNHVCQQ-HOTGVXAUSA-N 449.960 2.614 50 40 IFGB Cc1ccc(N2C(=O)[C@H](/C=N/NC(=O)c3cc4ccccc4o3)C(=O)NC2=S)cc1C 103880207 RJCISKLRALUXQY-BRUSPLQXSA-N 434.477 2.829 50 40 IFGB COc1cc(/C=N/NC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(C)cc3)C2)cc(OC)c1 2654567 YBJNTVNKGGZWCJ-TTXZLZEXSA-N 445.541 2.563 50 40 IFGB COc1cccc(C(=O)NCC(=O)N/N=C/c2cccc(OC(=O)c3cccs3)c2)c1 3117949 VXKYTQXPPYXCSC-ZMOGYAJESA-N 437.477 2.856 50 40 IFGB O=C(Cc1ccc(Br)cc1)N/N=C/c1cc([N+](=O)[O-])ccc1N1CCOCC1 9204008 UTGSIASUBCTISU-FYJGNVAPSA-N 447.289 2.887 50 40 IFGB CCCc1c(C(=O)N/N=C/c2ccc(OCc3ccccc3)cc2)nnn1-c1nonc1N 9308401 ZJKDTUAJVSQIAO-ZMOGYAJESA-N 446.471 2.528 50 40 IFGB COc1ccc(C(=O)N2CCC(C(=O)N/N=C/c3ccc(OC)c([N+](=O)[O-])c3)CC2)cc1 409007701 ZADBXFSNYKKZNO-OEAKJJBVSA-N 440.456 2.615 50 40 IFGB CC1CCN(c2ccc(/C=N/NC(=O)Cn3nnc(-c4ccccc4)n3)cc2[N+](=O)[O-])CC1 8407169 XEMCCINQLVLYTM-OEAKJJBVSA-N 448.487 2.635 50 40 IFGB C[C@H]1CN(c2nc3ccccn3c(=O)c2/C=C(\C#N)C(=O)NCc2ccccc2)C[C@H](C)O1 13659403 SVTWQVBXNAWYRC-XENGFHBVSA-N 443.507 2.531 50 40 IFGB Cc1ccc(/C=C2\SC(=S)N(CCC(=O)NNC(=O)c3cccc(O)c3)C2=O)cc1 13810372 NDPMWPJAICPUTG-BOPFTXTBSA-N 441.534 2.753 50 40 IFGB NNC(=O)/C(=C\c1ccc(Br)cc1)NC(=O)c1cccc(Br)c1 13940380 YRTSSASWESTVIE-RIYZIHGNSA-N 439.107 2.972 50 40 IFGB N#CC(C(=O)COC(=O)CCNC(=O)CCC(=O)c1ccccc1)=C1Nc2ccccc2N1 16699085 LJBZRARONHNWNX-UHFFFAOYSA-N 446.463 2.541 50 40 IFGB CC1=C(C#N)C(=O)N([C@@H]2CCS(=O)(=O)C2)C(=O)/C1=C/Nc1ccc(Cl)cc1Cl 102675957 CPISOWKWPWQFEQ-ZBQKXELDSA-N 440.308 2.685 50 40 IFGB CCc1ccc(N(CC(=O)N/N=C/c2ccc(Br)cc2)S(C)(=O)=O)cc1 409023102 JZMFGBCCTGXGFT-UDWIEESQSA-N 438.347 2.928 50 40 IFGB Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3ccsc3)cc2)cc1 12735546 FGQUOVNIZUBKDC-UHFFFAOYSA-N 443.550 2.952 50 40 IFGB CSc1ccc(N2C[C@H](C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)CC2=O)cc1 12858075 ZWHSVBSBCFMNFC-ZIAGYGMSSA-N 431.489 2.515 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C/c2c(Cl)cccc2Cl)cc1 16186744 VMBZWYIIMIPASG-KEBDBYFISA-N 430.313 2.773 50 40 IFGB CCN(CC)C(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1 58874012 SQJVMGUETVBLAR-YDZHTSKRSA-N 430.892 2.676 50 40 IFGB CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CC[C@H]4[C@@H](Cl)C(=O)CC[C@]4(C)[C@H]3C(=O)C[C@@]21C 118932341 ACYCMKPAVQZVIQ-KGHACUNTSA-N 438.948 2.858 50 40 IFGB COc1cc(/C=N/NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)ccc1O 408752422 AMPQLJOXKPYGKN-ZFJBLLOBSA-N 433.530 2.553 50 40 IFGB COc1cc(/C=N/NC(=O)Cc2nnc(NC(=O)c3ccc(C)cc3)s2)ccc1O 1885915 NGLUTWVLKCDFNJ-SRZZPIQSSA-N 425.470 2.506 50 40 IFGB O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NNC(=O)c1cccc(O)c1 2454541 XVKBJFRTUZVFOW-PTNGSMBKSA-N 447.563 2.896 50 40 IFGB O=C(CNC(=O)c1cccc(F)c1)N/N=C1\C(=O)N(Cc2ccccc2)c2ccccc21 8456306 UYELBBUCENECKD-SLMZUGIISA-N 430.439 2.623 50 40 IFGB CC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)NNC(=O)c1ccc(Br)cc1)(C3)C2 12766222 JHNNCDWXJGTISA-LWYUSKRHSA-N 434.334 2.685 50 40 IFGB C/C(=N\OCC(=O)N/N=C1\C(=O)N(CN2CCCCC2)c2ccccc21)c1cccs1 13618253 CNQZSGNHSVQCMO-XCMAFMLDSA-N 439.541 2.799 50 40 IFGB O=C(N/N=C/c1ccccn1)c1nn(Cc2ccc(Br)cc2)cc1[N+](=O)[O-] 1086863 AINMZVJVBVEPOC-AWQFTUOYSA-N 429.234 2.761 50 40 IFGB COc1ccccc1C(=O)NNC(=O)CCN1C(=O)/C(=C/c2ccccc2)SC1=S 2346941 CSAHQMPIHOKTLZ-LGMDPLHJSA-N 441.534 2.748 50 40 IFGB O=C(CCCN1C(=O)/C(=C\c2ccco2)SC1=S)NNC(=O)c1ccc(F)cc1 12278480 LJEPYGCEDYVWEK-RVDMUPIBSA-N 433.486 2.861 50 40 IFGB C[C@@H](Sc1ccc(Cl)cc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 12936126 RRQLYPOSFWBHMU-LLVKDONJSA-N 426.951 2.575 50 40 IFGB CCOc1cc(/C=C2\S/C(=N\NC(C)=O)NC2=O)cc(Br)c1OCC 14162167 TVFCEDDPYHZNDY-JYRVWZFOSA-N 428.308 2.858 50 40 IFGB N#C/C(=C\c1ccc(-c2ccc(Br)cc2)o1)C(=O)N[C@H]1CCS(=O)(=O)C1 26966880 XGOKYFQNZQLHLX-GLNPCMGASA-N 435.299 2.919 50 40 IFGB O=C(N[C@@H](Cc1ccccc1)C(=O)NNC(=O)c1ccccc1O)OCc1ccccc1 39984880 KEVIHMAGFBLGKK-FQEVSTJZSA-N 433.464 2.691 50 40 IFGB O=C(NCc1ccc2c(c1)OCO2)C(=O)N/N=C/c1ccccc1OCc1ccccc1 408606007 KWGGDTAYBIWNQA-VULFUBBASA-N 431.448 2.761 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1cccc([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 408786292 OLKZHFSSODVACG-UFFVCSGVSA-N 444.391 2.530 50 40 IFGB Cc1c(Cl)cccc1NC(=O)COc1ccc(/C=N/NC(=O)C(=O)NCC(C)C)cc1 409157895 QMZASUPHCJVKCQ-BRJLIKDPSA-N 444.919 2.888 50 40 IFGB CC(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(C)c(I)c2)cc1 9805640 RCKHUAIHQFADPY-UHFFFAOYSA-N 437.237 2.633 50 40 IFGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccccc2I)n1 35352236 MHJQCTURLHMYFD-CAOOACKPSA-N 426.283 2.940 50 40 IFGB CC[C@@H](C)NC(=O)C(=O)N/N=C/c1cccc(OCC(=O)Nc2ccccc2Cl)c1 409272883 TZNWWCHTJZRGSY-CHOFVFFHSA-N 430.892 2.722 50 40 IFGB O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccc(Br)cc1 408615168 MUNRVWIDAJIQFP-GFCCVEGCSA-N 436.693 2.917 50 40 IFGB COc1ccc(/C=N\NC(=O)c2nn(-c3ccccc3C)c(=O)c(C#N)c2C)c(OC)c1 409062106 NQWWOOPHNSLIMU-MXAYSNPKSA-N 431.452 2.502 50 40 IFGB O=C(Cc1cccs1)N/N=C/c1cc(I)c(O)c([N+](=O)[O-])c1 409207047 ZLJKXVCHVSGEKN-VIZOYTHASA-N 431.211 2.659 50 40 IFGB CCCOc1ccc(C(=O)N/N=C\c2cc(Cl)c(OCC(N)=O)c(OC)c2)cc1OC 409336915 VLTNYDZLPJTOCM-MYKKPKGFSA-N 449.891 2.774 50 40 IFGB NC(=O)Cn1cc(/C=N/NC(=O)c2cccc(Br)c2)c(-c2ccccc2)n1 2219134 OTNXZRRRSFDCDZ-LSHDLFTRSA-N 426.274 2.562 50 40 IFGB O=C(NNC(=O)c1cccnc1-n1cncn1)c1ccc(COc2ccc(Cl)cc2)cc1 12736439 LAGQEITVCPXGJA-UHFFFAOYSA-N 448.870 2.970 50 40 IFGB CCCOc1ccc(-c2c(C(=O)N/N=C/C3CCCCC3)nnn2-c2nonc2N)cc1 9233330 OSAGAHSVXMPPTH-YDZHTSKRSA-N 438.492 2.984 50 40 IFGB C/C(=N\NC(=O)c1cc(O)cc(O)c1)c1cccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)c1 17101295 SBBYBMHDGVUBOQ-OWXNAOLUSA-N 437.452 2.857 50 40 IFGB CC[C@H](C)NC(=O)C(=O)N/N=C/c1ccc(OCC(=O)Nc2cccc(Cl)c2)cc1 409258193 RWHMHKBGIQBWBO-XMTZNVEYSA-N 430.892 2.722 50 40 IFGB Cc1cc(/C=C(\C#N)C(=O)OCC(=O)NNC(=O)c2ccc(F)cc2)c(C)n1CC(C)C 9111972 ONGWVDFPTFZXOR-VXLYETTFSA-N 440.475 2.811 50 40 IFGB O=C(COc1ccc(/C=N/NC(=O)C(=O)NC2CC2)cc1)Nc1ccc(Cl)cc1Cl 409263874 COOLOXUYIIDUCH-AUEPDCJTSA-N 449.294 2.740 50 40 IFGB CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(-c3ccccc3)sc2N)cc1 2631218 GBNYNLFKWGTTDY-UHFFFAOYSA-N 445.522 2.797 50 40 IFGB COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccs2)cc1 9284687 ZKGFSBTZLQMUJX-UHFFFAOYSA-N 431.495 2.632 50 40 IFGB COc1cc(N2N=C(C)/C(=C/NNC(=O)c3ccc([N+](=O)[O-])cc3)C2=O)ccc1Cl 408535671 ZMSMKMNPPYVIKH-GDNBJRDFSA-N 429.820 2.798 50 40 IFGB O=C(N/N=C/c1ccccc1[N+](=O)[O-])[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 408879260 CMQYAUIRHGASHL-RONKMWSCSA-N 436.877 2.552 50 40 IFGB Cc1cccc(OCC(=O)NCC(=O)N/N=C/c2ccc(-c3ccccc3C(=O)O)o2)c1 409158667 RVXXWFLKEDPZSF-BRJLIKDPSA-N 435.436 2.599 50 40 IFGB C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)CCC3)c1 10217296 YLLXTNSRNLYUIE-INIZCTEOSA-N 441.553 2.813 50 40 IFGB CCOc1ccccc1N1C[C@@H](C(=O)NNC(=O)c2ccc(Br)cc2)CC1=O 17330546 QNNPYRCJUCOHPN-AWEZNQCLSA-N 446.301 2.662 50 40 IFGB CCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1OCC(=O)Nc1ccc(CC)cc1 408612373 VCYDJNXQTZXIMQ-WYMPLXKRSA-N 430.892 2.506 50 40 IFGB N#C/C(=C\c1ccc(OCC(N)=O)c(Br)c1)C(=O)NCCc1ccccc1 408812691 SZCHLYYHFVUQMM-MHWRWJLKSA-N 428.286 2.579 50 40 IFGB C=CCOc1ccc(/C=N/NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)cc1 408990510 NMCGMZLCRFGFBK-VATWTLTGSA-N 447.495 2.962 50 40 IFGB O=C(N/N=C/c1ccc(OCC(=O)N2CCOCC2)cc1)c1cccc(C(F)(F)F)c1 409247237 CPKXSSBKDMLLLV-DHRITJCHSA-N 435.402 2.707 50 40 IFGB O=C(Oc1ccccc1/C=N/NC(=O)[C@H]1COc2ccccc2O1)c1ccc2c(c1)OCO2 3025758 DTKCYMYLBHGGTK-XZVVGHKBSA-N 446.415 2.925 50 40 IFGB CCCCCCC(=O)NN/C=C1\C(=O)NC(=O)N(c2ccc(Br)cc2)C1=O 9424073 JBPAZBYUIYXFIZ-SDNWHVSQSA-N 437.294 2.507 50 40 IFGB COc1ccccc1/C=C/C(=O)NC(=S)NNC(=O)COc1ccc(Cl)c(C)c1 10040748 FLCOCHLONGMMFC-JXMROGBWSA-N 433.917 2.771 50 40 IFGB Cc1cc(I)cc(/C=N\NC(=O)[C@H]2COc3ccccc3O2)c1O 13617359 UCJUVJVGKZJNCX-XXZGICNZSA-N 438.221 2.595 50 40 IFGB COc1ccc(/C(C)=N/NC(=O)CN(c2ccc(Cl)cc2)S(C)(=O)=O)cc1OC 19954278 VXMNYTPJAQZQEN-FYJGNVAPSA-N 439.921 2.664 50 40 IFGB Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)NNC(=O)c1cccc(CS(C)(=O)=O)c1 27204027 DCTPEVMELVMGRK-AWEZNQCLSA-N 438.933 2.730 50 40 IFGB Cc1cc(O)ccc1N1C(=O)[C@@H]2[C@@H]3C[C@H]([C@H](Br)[C@@H]3Br)[C@@H]2C1=O 101052278 WHBYAKCYZUDQAB-VYEAZLRYSA-N 429.108 2.983 50 40 IFGB O=C(CCC(=O)OCC(=O)Nc1cc(Cl)ccc1Cl)NNC(=O)c1ccccc1 138912176 VOVCPMMSVFLLNC-UHFFFAOYSA-N 438.267 2.717 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)cc1C 408986767 DNCNVARXNAPSRB-KSRKCLLLSA-N 435.484 2.715 50 40 IFGB COC(=O)[C@@H]1C(=O)NC(SCC(=O)Nc2ccccc2F)=C(C#N)[C@@H]1c1ccccc1 409129964 SVKNPLMRFXRZNE-OALUTQOASA-N 439.468 2.935 50 40 IFGB Cc1cccc(N(CC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)S(C)(=O)=O)c1C 2085288 CFYVMBDCLREPPR-KEBDBYFISA-N 438.893 2.781 50 40 IFGB O=C(CCN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S)NNC(=O)c1cccnc1 8820469 TTZAANIEGCHILQ-KCTVJHQVSA-N 438.534 2.690 50 40 IFGB COc1ccc(N([C@H](C)C(=O)N/N=C/c2c(F)cccc2Cl)S(C)(=O)=O)cc1 20214901 RDGJAUXIELFLHM-KIHMUJGBSA-N 427.885 2.793 50 40 IFGB CCOc1ccc(/C=N\NC(=O)c2nn(-c3ccc(OCC)cc3)c(=O)c(C#N)c2C)cc1 409058310 MHCFTBZJNPFBKU-YSMPRRRNSA-N 445.479 2.974 50 40 IFGB O=C(CSc1nnc(-c2ccncc2)n1-c1ccccc1)NNC(=O)Cc1ccccc1 886435 HNKFUSFKIFRLJJ-UHFFFAOYSA-N 444.520 2.812 50 40 IFGB CCOc1ccc(/C(C)=N/NC(=O)c2nnn(-c3nonc3N)c2-c2cccs2)cc1 9307040 YYEWRWZJVYIOTA-SRZZPIQSSA-N 438.473 2.514 50 40 IFGB CC(C)Oc1ccc(/C=N/NC(=O)c2nnn(-c3nonc3N)c2-c2cccs2)cc1 9499343 JFOODRBBWLDJNY-UFFVCSGVSA-N 438.473 2.512 50 40 IFGB COc1cc(Br)c(OC)c(C(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1 12736367 MYEUPBHQFQESJH-UHFFFAOYSA-N 439.262 2.558 50 40 IFGB COc1cccc(N2C[C@@H](C(=O)NNC(=O)c3cc4c(s3)CC[C@@H](C)C4)CC2=O)c1 40058415 UJSKYSPHQWIUAM-HIFRSBDPSA-N 427.526 2.696 50 40 IFGB COc1ccc(CC(=O)N/N=C/c2cc(I)c(O)c(OC)c2)cc1 408729160 YFMKNCYITSIDLA-VXLYETTFSA-N 440.237 2.707 50 40 IFGB COc1ccc(N(CC(=O)NN=C2CCCC2)S(=O)(=O)c2ccccc2)cc1OC 408773453 KVVHGLMCXNYLBQ-UHFFFAOYSA-N 431.514 2.945 50 40 IFGB CCN1CCN(c2nc3ccccn3c(=O)c2/C=C(\C#N)c2nc3ccccc3[nH]2)CC1 8740629 JTXNZAVERWOSGU-BMRADRMJSA-N 425.496 2.777 50 40 IFGB Cc1ccc(CNC(=O)NNC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)cc1 12745288 ATQXEDWQHUNTIA-UHFFFAOYSA-N 427.482 2.706 50 40 IFGB COc1ccc(S(=O)(=O)N(C)CC(=O)N/N=C/c2cccc3ccccc23)cc1OC 16187128 IDDXXVICRGTHTF-OEAKJJBVSA-N 441.509 2.628 50 40 IFGB O=C(CN1CCOCC1)N/N=C\c1ccc(OCc2ccc(Br)cc2)cc1 33335354 RBIFVDAPKKGVGR-XKZIYDEJSA-N 432.318 2.810 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2ccc(C(C)C)cc2)S(C)(=O)=O)cc1OC 408776560 PQFYISODGHISOK-LPYMAVHISA-N 433.530 2.744 50 40 IFGB C#CCOc1ccc([N+](=O)[O-])cc1/C=N\NC(=O)C(O)(c1ccccc1)c1ccccc1 33792302 PFYKENBLWNUTOJ-UQQQWYQISA-N 429.432 2.993 50 40 IFGB COc1cc(/C=N\NC(=O)CN2CCOCC2)cc(Cl)c1OCc1cccc(F)c1 59246733 HBNRWUYNQLTFJE-MSXFZWOLSA-N 435.883 2.849 50 40 IFGB Cc1cccc(C)c1N1C[C@@H](C(=O)NNC(=O)c2ccc(Br)cc2)CC1=O 408640610 JPZGZZJDWLZNFO-HNNXBMFYSA-N 430.302 2.880 50 40 IFGB O=C(COc1ccccc1-c1ccccc1)NNC(=O)[C@@]1(O)CCN(Cc2ccccc2)C1 72284089 VGVJENCPDQOXGQ-AREMUKBSSA-N 445.519 2.517 50 40 IFGB Cc1ccccc1OCC(=O)N[C@@H](CC(C)C)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 408973845 VTCULTMKBNQKRZ-QMFLXTPQSA-N 426.473 2.963 50 40 IFGB CCN(CC)C(=O)CSC1=C(C#N)[C@@H](c2ccccc2Cl)[C@@H](C(=O)OC)C(=O)N1 13027153 LWVFGLUSDBYASD-IAGOWNOFSA-N 435.933 2.679 50 40 IFGB CC(C)[C@@H](NC(=O)c1c(F)cccc1F)C(=O)NNC(=O)c1ccccc1-n1cccc1 33018816 IYGXXLZXXAFAOW-HXUWFJFHSA-N 440.450 2.971 50 40 IFGB O=C(CSc1nnc(COc2ccc(Cl)cc2)o1)NNC(=O)Cc1ccccc1 104977703 UMTKZCSEYNZOJJ-UHFFFAOYSA-N 432.889 2.784 50 40 IFGB COc1ccc(/C=N/NC(=O)CN(c2cccc(C(F)(F)F)c2)S(C)(=O)=O)cc1 408770758 CBZOSFZZAMQLHV-SSDVNMTOSA-N 429.420 2.630 50 40 IFGB CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N/N=C/c1cc(Br)ccc1O 408913311 SSPJBWMAODZBSX-SVZNOHIVSA-N 434.290 2.962 50 40 IFGB C/C(=N\NC(=O)C(=O)N/N=C(\C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(C)c([N+](=O)[O-])c1 12462428 WFJKBVXTAMAWLO-JFMUQQRKSA-N 440.416 2.500 50 40 IFGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)Cc2ccc(OC)c(OC)c2)c([N+](=O)[O-])c1 13943763 XGUVGGKDJJIIKG-YDZHTSKRSA-N 444.444 2.684 50 40 IFGB COc1cc(/C=N/NC(=O)[C@@H](CC(C)C)NC(=O)COc2ccccc2C)ccc1O 408969023 FXPZLDYZLHIXFL-QJTDOHDFSA-N 427.501 2.769 50 40 IFGB C=CCNC(=O)C(=O)N/N=C/c1cc(Cl)ccc1OCC(=O)Nc1ccc(C)cc1C 409170717 XEQIBYKIGVBDEM-BRJLIKDPSA-N 442.903 2.727 50 40 IFGB Cc1cccc(C(=O)Nc2ccc(C(=O)NNC(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C(=O)O)cc2)c1 409383274 VRKDMKSKLRJJPG-XAMWDVODSA-N 433.464 2.531 50 40 IFGB Nc1nonc1-c1nc2ccccc2n1CC(=O)N/N=C/c1ccc(Br)cc1 793511 YMAZLENZYRKKCS-ZVBGSRNCSA-N 440.261 2.581 50 40 IFGB O=C(Cc1ccccc1)NN=C1C=CC(=NOC(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C=C1 3078415 BWXCINPYWJYLJE-UHFFFAOYSA-N 449.379 2.857 50 40 IFGB CN(C)CN1C(=O)/C(=N/NC(=O)CSc2nc3ccccc3s2)c2ccccc21 20135371 QDMZEYJCCNJOBQ-PTGBLXJZSA-N 425.539 2.775 50 40 IFGB COc1ccccc1NC(=O)COc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2)cc1 58880758 XFIVTZAJXPEXSQ-MFKUBSTISA-N 446.463 2.802 50 40 IFGB C/C(=N\NC(=O)CN(c1ccc(F)cc1)S(C)(=O)=O)c1ccc(Br)cc1 408773617 RXZMGXQYUKPRGJ-UDWIEESQSA-N 442.310 2.895 50 40 IFGB CCOc1cc(/C=N/NC(=O)CN(c2cccc(Cl)c2C)S(C)(=O)=O)ccc1O 408782469 IVWMMIJCABQOQS-SRZZPIQSSA-N 439.921 2.669 50 40 IFGB COc1ccc(C(=O)NNC(=O)CSc2nnc3n2C(C)(C)Cc2ccccc2-3)cc1 6232596 CLPKGUKOPUOFLM-UHFFFAOYSA-N 437.525 2.798 50 40 IFGB O=C(CSc1nc2ccccc2c(=O)n1Cc1ccco1)NNC(=O)Cc1ccccc1 915526 LXJFJYQBTWPMQM-UHFFFAOYSA-N 448.504 2.520 50 40 IFGB COCc1cc(C)nc(OCC(=O)N/N=C/c2ccc(OC)c(Br)c2)c1C#N 1502015 AGKCOAKDETZBFA-LSFURLLWSA-N 447.289 2.708 50 40 IFGB COc1ccccc1N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccccc2)cc1 3375528 GPDUVWIHIIYRKJ-UHFFFAOYSA-N 439.493 2.595 50 40 IFGB CCN1C(=O)/C(=N\NC(=O)[C@@H](C)n2cnc3sc4c(c3c2=O)CCCC4)c2ccccc21 12374246 IUIZOGUXUIECFI-ARSNBXNASA-N 449.536 2.785 50 40 IFGB CC1(CC(=O)N/N=C/c2ccc(OCC(=O)Nc3cccc(Cl)c3)cc2)OCCO1 28214517 WKUMVPMGKUKRAF-YDZHTSKRSA-N 431.876 2.961 50 40 IFGB Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(Oc3ccccc3)c2)n1 70017401 WVHNMTGKAGKRNW-UHFFFAOYSA-N 425.466 2.791 50 40 IFGB CCOc1c(Br)cc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1OC 9509439 HFLJHWWXWRGEOA-UHFFFAOYSA-N 437.246 2.660 50 40 IFGB COc1cccc(NC(=O)C(=O)N/N=C(\C)CC(=O)Nc2ccc(OC)c(Cl)c2)c1 100372549 VAMLIHKZLKLQMT-WYMPLXKRSA-N 432.864 2.817 50 40 IFGB O=C(CSc1nnc(C2CC2)n1-c1ccccc1)NNC(=O)c1ccc([N+](=O)[O-])cc1 2619895 NUXAEICWLIOHBI-UHFFFAOYSA-N 438.469 2.606 50 40 IFGB COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)OC(C)(C)C)c2)cc1 8825145 IOUADSQNJRMBHY-UHFFFAOYSA-N 435.502 2.690 50 40 IFGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)c1 58925048 DIRQSEOXVHYXCQ-LPYMAVHISA-N 436.921 2.605 50 40 IFGB CCc1ccc(N(CC(=O)N/N=C/c2cccc(OC3CSC3)c2)S(C)(=O)=O)cc1 409025769 WENQAMWRMYDNDX-WSDLNYQXSA-N 447.582 2.660 50 40 IFGB COc1cc(OC)cc(C(=O)NNC(=O)COc2ccc(Cl)cc2Br)c1 14141308 HVYTURFNYMEXPL-UHFFFAOYSA-N 443.681 2.960 50 40 IFGB N#C/C(=C\c1ccc(OCCC(=O)O)cc1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCO2 32931550 QBLWQDCUNQJUSY-NTEUORMPSA-N 439.380 2.765 50 40 IFGB COc1ccc(N([C@H](C)C(=O)N/N=C/c2c(O)ccc3ccccc23)S(C)(=O)=O)cc1 16322135 NOGJKDBGEKPUEC-QKIXXSFTSA-N 441.509 2.859 50 40 IFGB O=C(COc1ccc(F)cc1)NNC(=O)c1ccc(=O)n(Cc2ccc(Cl)cc2)c1 16839310 RQTSTGKFCVXHIV-UHFFFAOYSA-N 429.835 2.529 50 40 IFGB Cc1cccc(O[C@@H](C)C(=O)NNC(=O)[C@@H]2CCCN(c3ccc(Cl)nn3)C2)c1C 32913625 CVEQOGVFJABJOQ-JKSUJKDBSA-N 431.924 2.578 50 40 IFGB Cc1c(Cl)cccc1NC(=O)COC(=O)[C@@H]1[C@H]2C[C@H]3[C@H](OC(=O)[C@@H]13)[C@@H]2Br 408688151 VVBSDHXAHGJLEU-SPLFTWIJSA-N 442.693 2.701 50 40 IFGB COc1cc(OC)cc(C(=O)NNC(=O)COc2ccc(C(=O)c3ccccc3)cc2)c1 3443577 KHWNQFFJPUFDEM-UHFFFAOYSA-N 434.448 2.775 50 40 IFGB Cc1cc(Cl)cc2c1NC(=O)[C@]2(O)C/C(=N\NC(=O)CC#N)c1cccc([N+](=O)[O-])c1 17176537 SRNIKBHYSWLXRZ-WEKPXBEKSA-N 441.831 2.521 50 40 IFGB CC(=O)Oc1ccc(/C=N/NC(=O)CN(c2ccc(C(C)C)cc2)S(C)(=O)=O)cc1 408768530 XSSPFVVEGWMUNC-LPYMAVHISA-N 431.514 2.652 50 40 IFGB COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)C(C)C)ccc1Cl 12526033 XZLMMONOSGENGN-UHFFFAOYSA-N 425.894 2.566 50 40 IFGB CCOC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(=O)n(Cc3ccc(C)cc3)c2)cc1 23136192 SEWGURRNFUJLDJ-UHFFFAOYSA-N 448.479 2.848 50 40 IFGB COc1ccc(/C(C)=N/OCC(=O)N/N=C2\C(=O)Nc3ccc(Br)cc32)cc1 101034774 HSNOBEPUGPHDNZ-BHGWPJFGSA-N 445.273 2.671 50 40 IFGB CCOc1cc(/C=N\NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)ccc1OCC(=O)O 408904710 NKODWVDXBYBRES-FBHDLOMBSA-N 427.369 2.967 50 40 IFGB Nc1nonc1-n1nnc(C(=O)N/N=C/c2c(O)ccc3ccccc23)c1-c1ccccc1 3117773 SCQWHTCTNHIRTL-WYMPLXKRSA-N 440.423 2.522 50 40 IFGB CCCn1nc(C(=O)NNS(=O)(=O)c2c(C)c(C)cc(C)c2C)c2ccccc2c1=O 16095543 JUZQFZYOMDCPNH-UHFFFAOYSA-N 442.541 2.663 50 40 IFGB Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)NNC(=O)[C@@H](C)Oc1ccccc1F 40129492 MVNSPNAVQCUOHE-OAHLLOKOSA-N 428.439 2.925 50 40 IFGB CC[C@H](Oc1cc(Cl)ccc1Cl)C(=O)NNC(=O)[C@@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O 225641988 APTZUNALKUCBEW-BDUBRWIHSA-N 427.284 2.821 50 40 IFGB COc1ccc(/C=N/NC(=O)[C@H](CC(C)C)NS(=O)(=O)c2ccc(C)cc2)c(OC)c1 408762828 MLGCJEXNWKQBIT-BTVXTAIASA-N 447.557 2.856 50 40 IFGB COc1ccccc1N(CC(=O)N/N=C/c1ccc(Cl)cc1Cl)S(C)(=O)=O 408907497 PIKCBDFSQJELTD-KEBDBYFISA-N 430.313 2.918 50 40 IFGB CCOC(=O)N1CC=C2C(C#N)=C(N)C(C#N)(C#N)[C@H](c3cc(OC)cc(OC)c3)[C@@H]2C1 6194990 GQVILTUHGBDNRJ-WOJBJXKFSA-N 433.468 2.586 50 40 IFGB COc1cccc(/C=N\NC(=O)CN(C2CCCCC2)S(=O)(=O)c2ccccc2)c1O 16228149 HKHNCEYLAPPYFZ-HAHDFKILSA-N 445.541 2.875 50 40 IFGB CCOc1cc(/C=N/NC(=O)C(=O)N[C@@H](C)c2ccccc2)cc(Br)c1O 59483266 DWKWXXLPPNQACD-OVMKCGGTSA-N 434.290 2.881 50 40 IFGB O=C(O)c1ccc(N2C(=O)[C@@H]3[C@@H]4C[C@@H]([C@@H](Br)[C@H]4Br)[C@@H]3C2=O)cc1 100747820 KXHQMAGGCJSUCQ-DIQHKMFBSA-N 443.091 2.667 50 40 IFGB CS(=O)(=O)N(CC(=O)N/N=C/c1ccc2c3c(cccc13)CC2)c1cccc(F)c1 409112289 LATWJELXNCLZFP-ZMOGYAJESA-N 425.485 2.994 50 40 IFGB COC(=O)c1ccc([C@H]2CC(=O)NC(SCC(=O)N3CCCC[C@H]3C)=C2C#N)cc1 409328179 ZVOKAQIDUWZPNS-RHSMWYFYSA-N 427.526 2.946 50 40 IFGB Cc1ccc(C)c(N2N=C(C(=O)NNC(=O)c3cncn3-c3ccc(F)cc3)CCC2=O)c1 9884222 VNIDPIFMHPNDKQ-UHFFFAOYSA-N 448.458 2.572 50 40 IFGB CCOc1cc(/C=N\NC(=O)[C@@H](NC(=O)Cc2cccs2)C(C)C)ccc1OCC#N 35104046 AQNKDKDOGOQFEK-ZJVWCJDDSA-N 442.541 2.883 50 40 IFGB CCN(CC)C(=O)CSC1=C(C#N)[C@@H](c2ccco2)C(C(=O)OCCOC)=C(C)N1 100935171 OWOVYKQBAPVFGV-IBGZPJMESA-N 433.530 2.767 50 40 IFGB COCCNC(=O)C(=O)N/N=C/c1cc(Br)ccc1Nc1ccccc1C 408708908 VEIHMHMLCIKONA-WSDLNYQXSA-N 433.306 2.714 50 40 IFGB