smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features COC(=O)[C@H]1C(O)=NC(SC)=C(C#N)[C@@H]1c1ccc(Cl)cc1 80962 LBDRRAQRHHONDC-NWDGAFQWSA-N 336.800 3.281 50 40 EGGB Cc1cc(OCCCC(=O)NN)c(C(C)C)cc1Br 1791868 UEGAURHDVTUPOQ-UHFFFAOYSA-N 329.238 3.030 50 40 EGGB COc1ccc(C2=C(C#N)c3nc4ccccc4n3C(=O)[C@H]2C#N)cc1 4342329 ULXJHZGLIABWNL-HNNXBMFYSA-N 340.342 3.273 50 40 EGGB COc1ccc(CSCC(=O)N/N=C/c2ccccc2F)cc1 59473664 JCPPYCQHDNFRAD-VXLYETTFSA-N 332.400 3.218 50 40 EGGB CNC(=O)/C(C#N)=C/c1ccc(-c2cc(C)c(C)cc2[N+](=O)[O-])o1 4499372 JLEXCESRMHDDNH-XYOKQWHBSA-N 325.324 3.125 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/C=C\c2ccccc2[N+](=O)[O-])c(F)c1 4739163 IZQMDNZVELXWMK-LXILKSQISA-N 338.298 3.035 50 40 EGGB COc1ccc(OC)c(/C=N\NC(=O)Cc2cc(C)ccc2C)c1 409366546 VYGGTYSOCVXKJI-NDENLUEZSA-N 326.396 3.013 50 40 EGGB CN(C)c1ccc(/C=N\NC(=O)COc2cccc3ccccc23)o1 408996114 KYWAOWACHUKNAB-NDENLUEZSA-N 337.379 3.028 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N2CCc3ccccc32)cc1OC 19723306 XGYOXKZQOCRZNA-LFIBNONCSA-N 334.375 3.200 50 40 EGGB CC(C)Oc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccccn2)cc1 188549 KLCPDNRZTGEADW-PVGUKEHMSA-N 343.452 3.500 50 40 EGGB O=C(CCl)N(Cc1nnc(-c2ccc(Cl)cc2)o1)C1CC1 32626739 ISEUJZDGUADLLF-UHFFFAOYSA-N 326.183 3.120 50 40 EGGB in-vitro C[C@]12CCCC[C@H]1[C@@H]2C(=O)N/N=C/c1ccc(Br)o1 408720637 AWISFTCZTGEBNJ-QJXNODSHSA-N 325.206 3.319 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)c(C)c1 408788467 DFLXYVQDHIKEAN-NTEUORMPSA-N 337.335 3.458 50 40 EGGB C[C@H](Br)C(=O)c1ccc(I)cc1 36903483 ZVIUWJYHZBDPQF-LURJTMIESA-N 338.970 3.257 50 40 EGGB COc1ccc2ccccc2c1/C=N/NC(=O)c1ccc(C#N)cc1 57786890 DNUYYUBBQCPPMJ-LPYMAVHISA-N 329.359 3.484 50 40 EGGB C=C(C)CSC1=C(C#N)[C@@H](c2ccc(O)c(OC)c2)CC(=O)N1 80892 MPSUUKLRZQZSKB-GFCCVEGCSA-N 330.409 3.049 50 40 EGGB O=C(O)c1ccc(-c2ccc(/C=N/NC(=O)c3cccs3)o2)cc1 9324524 GPGXJWBRHBHHTO-VCHYOVAHSA-N 340.360 3.470 50 40 EGGB COc1ccc(CNC(=O)/C(C#N)=C\c2ccc(OC)cc2C)cc1 408818402 PPNPFNKKYGYVEW-BOPFTXTBSA-N 336.391 3.236 50 40 EGGB Cc1cc(/C=N/NC(=O)c2ccccc2F)c(C)n1-c1ccccn1 409237714 BIVOBGBCFYYCGT-WSDLNYQXSA-N 336.370 3.392 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)Cc2cc(C)ccc2C)c(OC)c1 409366640 XLUUUIBPTNFNAP-RCCKNPSSSA-N 340.423 3.404 50 40 EGGB CC(/C=N\NC(=O)CSc1nc(C)cc(C)n1)=C\c1ccccc1 30750299 XJVDIZQVCKOAJP-DHDQDGEESA-N 340.452 3.391 50 40 EGGB CN(C(=O)CCl)c1nnc(C23CC4CC(CC(C4)C2)C3)s1 4078422 XSPMGIMHUOCPLU-UHFFFAOYSA-N 325.865 3.208 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)c2ccc(Cl)cc2Cl)o1 409002925 XISIDDRGJFQRIS-CAOOACKPSA-N 326.183 3.416 50 40 EGGB O=C(N/N=C\c1ccc(Br)c([N+](=O)[O-])c1)c1ccccc1 36174559 GHSYNBWXZICVAL-SXGWCWSVSA-N 348.156 3.121 50 40 EGGB Cc1cc(Cl)ccc1OCC(=O)N/N=C/c1ccccc1[N+](=O)[O-] 242759 OIAJNSTXNKNBAK-GIJQJNRQSA-N 347.758 3.086 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@@H](c2ccccc2[N+](=O)[O-])[C@@H]2CCCC=C12 573504 NGPHAOADWCMDAH-CXAGYDPISA-N 345.362 3.188 50 40 EGGB Cc1cc(C)nc(NNC(=O)Cc2ccc(Cl)cc2Cl)n1 11333984 ZKRMNMDBDZOKSA-UHFFFAOYSA-N 325.199 3.086 50 40 EGGB COc1ccc(/C=N/NC(=O)COc2cccc3cccnc23)cc1C 566183 FPYHYJPWIQWHHZ-WSDLNYQXSA-N 349.390 3.081 50 40 EGGB CCC[C@H]1CCc2c(sc(NC(=O)CCCl)c2C(N)=O)C1 2085401 VOSJLZBVFQIVJZ-VIFPVBQESA-N 328.865 3.319 50 40 EGGB C=CCSC1=C(C#N)[C@H](c2ccc(C)cc2)[C@@H](C(=O)OC)C(O)=N1 9059005 LPPNOYWIDPVYKN-LSDHHAIUSA-N 342.420 3.492 50 40 EGGB N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)Cn1cnc2ccccc21 408691706 MVWQMLPSUHTFPP-LFYBBSHMSA-N 348.318 3.280 50 40 EGGB O=C(N[C@H](Cc1ccccc1)C(=O)CCl)OCc1ccccc1 1731982 OYHLRJGDELITAF-MRXNPFEDSA-N 331.799 3.332 50 40 EGGB biogenic O=C(CCl)Nc1ccc(S(=O)(=O)c2ccccc2Cl)cc1 3116770 JLEGKAMJLMXKNK-UHFFFAOYSA-N 344.219 3.350 50 40 EGGB O=C(N/N=C/c1ccc2c(c1)OCO2)NC12CC3CC(CC(C3)C1)C2 4646771 VAOGDOUJNDDIFH-KEBDBYFISA-N 341.411 3.017 50 40 EGGB COc1ccc(/C=C(\C#N)C(N)=O)c(OCc2ccc(C)c(C)c2)c1 408867760 NFJPMHGAKZYRMF-RQZCQDPDSA-N 336.391 3.283 50 40 EGGB Cc1ccccc1/C=N\NC(=O)C(O)(c1ccccc1)c1ccccc1 33286552 SYTDBBXYPMLDBJ-KQWNVCNZSA-N 344.414 3.381 50 40 EGGB C/C(=N/NC(=O)c1cc(-c2ccc(F)cc2)n[nH]1)c1ccccc1O 100920326 SCKRTKGOKPKCMB-JAIQZWGSSA-N 338.342 3.075 50 40 EGGB O=C(N/N=C1/CCc2ccccc2C1)N/N=C1/CCc2ccccc2C1 8665350 PQJQIEQYWXYVAC-IKJQKJQYSA-N 346.434 3.375 50 40 EGGB C/C(=N\NC(=O)c1cc(-c2ccc(Cl)cc2)[nH]n1)c1ccco1 9324630 NZEAJBGLYDTGIJ-VCHYOVAHSA-N 328.759 3.477 50 40 EGGB Cc1ccsc1/C=N/NC(=O)CSc1ccc([N+](=O)[O-])cc1 59435249 XJPOSHPPWTYFBZ-OVCLIPMQSA-N 335.410 3.207 50 40 EGGB C#CCn1cc(/C=N/NC(=O)c2ccc(OCC)cc2)c2ccccc21 20764144 BSIQSKLIFBVYPH-HYARGMPZSA-N 345.402 3.437 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2ccccc2OCC#N)c(Cl)c1 409051938 HEEJYTSEYHEVMR-RGVLZGJSSA-N 327.771 3.315 50 40 EGGB COc1cc(/C=N\NC(=O)Cc2cc(C)ccc2C)cc(Cl)c1O 409360941 GCKAWDGOBIZKKW-JMIUGGIZSA-N 346.814 3.364 50 40 EGGB COc1ccc(NC(=O)N/N=C\c2ccc(N3CCCC3)cc2)cc1 33850786 PKYNSIDCHYZZLY-ZHZULCJRSA-N 338.411 3.451 50 40 EGGB Cc1ccccc1NCC(=O)N/N=C/c1ccc(Br)cc1 223315 MOJBFYFVBYFALX-VXLYETTFSA-N 346.228 3.320 50 40 EGGB COc1ccc(CSCC(=O)N/N=C/c2ccc(F)cc2)cc1 233594 WWIBSDGQJRCYCF-VXLYETTFSA-N 332.400 3.218 50 40 EGGB O=C(N/N=C/[C@@H]1C[C@H]2C=C[C@H]1C2)C(O)(c1ccccc1)c1ccccc1 102220277 MEIWVLWDWOXTGU-IOVNINHTSA-N 346.430 3.237 50 40 EGGB COc1cc2c(cc1/C=N/NC(=O)Cc1cccs1)CCCC2 1105144 IKBOBMRSOMIOEZ-XDHOZWIPSA-N 328.437 3.328 50 40 EGGB N#C/C(=C/C=C/c1ccccc1)C(=O)N1CCN(c2ccccc2)CC1 408777153 VZCOEEDGHAYEMB-VTGAJVDQSA-N 343.430 3.499 50 40 EGGB Br[C@H]1CCC[C@H]2N=C(N/N=C/c3ccccc3)S[C@@H]12 5899379 XGUGXCYNVHMVAJ-WKSRZWLGSA-N 338.274 3.398 50 40 EGGB C=CCn1c(C)c(/C=N/NC(=O)c2ccccc2N)c2ccccc21 573172 NSFUNIZADYBSCB-LPYMAVHISA-N 332.407 3.482 50 40 EGGB COc1ccc(/C=N/NC(=O)CCSc2ccccc2)cc1OC 233775 BPSKDLSVNXXNJM-CPNJWEJPSA-N 344.436 3.336 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)cc1OC 7158004 PAQUYLBHAIVTAD-RFQVVYOUSA-N 328.412 3.306 50 40 EGGB O=P(Cl)(Cl)N1CCN(c2cnc(Cl)nc2Cl)CC1 100484076 MWCAHXOAKNQZOE-UHFFFAOYSA-N 349.973 3.491 50 40 EGGB C/C(=N\NC(=O)c1ccccc1Br)c1ccc(C#N)cc1 12566126 DFJPUFJCLVPLPN-YBFXNURJSA-N 342.196 3.475 50 40 EGGB CC[C@@H](C(=O)NNC(=O)c1cc(Cl)ccc1OC)c1ccccc1 12806880 MLBMKAVUQPSIAJ-CQSZACIVSA-N 346.814 3.303 50 40 EGGB COC(=O)c1ccc(Cn2cc(C=C(C#N)C#N)c3ccccc32)o1 409392113 LEKKFPBNOVMQAF-UHFFFAOYSA-N 331.331 3.500 50 40 EGGB O=C/C(=C(/Br)I)c1ccccc1 1636046 ZKOMDKWMXRQBGK-CMDGGOBGSA-N 336.954 3.384 50 40 EGGB C/C(=N\OCC(=O)N/N=C/c1cc2ccccc2[nH]1)c1ccccc1 5517067 YKAJMJURFOKKIP-NEGHVCEZSA-N 334.379 3.059 50 40 EGGB C[C@@]1(C(=O)OC[C@@H]2CCC[N+]3(C)CCCC[C@H]23)C[C@H]1Br 4028525 CIGRASSTVHFEOB-CPXDDEENSA-N 345.301 3.112 50 40 EGGB COc1ccc([C@H]2C(C#N)=C(N)N3C(=C2C#N)Nc2ccccc23)cc1 493938 VOANLWNNBSSQGH-SFHVURJKSA-N 341.374 3.154 50 40 EGGB NC(=O)N/N=C/c1ccccc1OC(=O)c1cccc2ccccc12 566036 DIDSEYKFUCLFJP-CIAFOILYSA-N 333.347 3.061 50 40 EGGB C/C(=N/NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccc(C)o1 13110506 YTBLYGPMWHHOSA-JWGURIENSA-N 348.402 3.364 50 40 EGGB C/C(=N\NC(=O)c1cccnc1)c1cccc(NC(=O)c2ccco2)c1 17072357 WNLHHVBGFDWLBR-LPYMAVHISA-N 348.362 3.081 50 40 EGGB N#C/C(=C\c1ccc(Br)s1)C(=O)NCc1ccco1 5069296 SIXOYLQUOJXMSY-RMKNXTFCSA-N 337.198 3.327 50 40 EGGB C=CCOC(=O)C1=C(C)NC(S)=C(C#N)[C@H]1c1ccc(OC)cc1 20528831 HJRPHKGUPROXEP-MRXNPFEDSA-N 342.420 3.050 50 40 EGGB biogenic,in-vitro CCO[Si](Cc1cc(F)c(F)c(F)c1F)(OCC)OCC 221584054 GMBURRBATPCRSP-UHFFFAOYSA-N 326.362 3.373 50 40 EGGB CCOc1ccc(/C=N/NC(=O)[C@@H](C)Oc2cccc(C)c2)cc1 117842 FCBYQMIISKGABI-OOWUWCJESA-N 326.396 3.311 50 40 EGGB COc1ccccc1C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1Cl 13982342 USNKBSPJOABISL-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB CCOc1ccc2[nH]c(C(=O)N/N=C/c3cccc(OC)c3)cc2c1 2331171 AQMRKWZLQZBUHR-UDWIEESQSA-N 337.379 3.339 50 40 EGGB C=CCN1C(=O)/C(=N/NC(=O)c2ccccc2Cl)c2ccccc21 46085015 MUWJQUCXRPKGSN-CAPFRKAQSA-N 339.782 3.007 50 40 EGGB O=C(O)c1ccccc1C(=O)NNc1nc(-c2ccccc2)cs1 544758 FCCNKQVOOCICKH-UHFFFAOYSA-N 339.376 3.265 50 40 EGGB Cn1cc(/C=C(\C#N)S(=O)(=O)c2cc(Cl)ccc2Cl)cn1 14123052 GWQIACHBOHDOSW-NYYWCZLTSA-N 342.207 3.065 50 40 EGGB O=C(c1cccc(F)c1F)[C@H](Br)CBr 306227717 HEYMYCISLSVVEE-ZCFIWIBFSA-N 327.950 3.306 50 40 EGGB Cc1nnc(S[C@H](C)C(=O)C(C#N)=C2Nc3ccccc3N2)s1 7776601 JTZVKEBXZMRGGC-MRVPVSSYSA-N 343.437 3.169 50 40 EGGB CC(C)(C)OC(=O)N1CC[C@H](CCI)C1 95083454 WAZXDTKITHEPAQ-VIFPVBQESA-N 325.190 3.069 50 40 EGGB Cc1ccc(O)c(/C=N\NC(=O)Cc2ccc(Br)cc2)c1 13595274 HVVCOSNMEKMGLR-ZDLGFXPLSA-N 347.212 3.156 50 40 EGGB C[C@H](Oc1cccc2ccccc12)C(=O)N/N=C/c1ccccc1O 5515478 XAPPZEQREOWOGC-HADWXUJASA-N 334.375 3.463 50 40 EGGB Cc1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)cc1 5588065 LZGLJXNVVHBBIX-CYVLTUHYSA-N 331.419 3.251 50 40 EGGB C#CCOc1ccc(Cl)cc1/C=N/NC(=O)c1ccccc1C 9201711 DITGGJNYJPLUPM-UDWIEESQSA-N 326.783 3.424 50 40 EGGB N#C/C(=C\c1ccccc1[N+](=O)[O-])C(=O)Nc1cccc([N+](=O)[O-])c1 408790897 RVRYTQAGLBHFDJ-XYOKQWHBSA-N 338.279 3.049 50 40 EGGB CN(C)c1ccc(/C=C/C=N/NC(=O)c2ccc(C#N)cc2F)cc1 408967784 SBKWOMRSBCXMJF-DMRDCZSUSA-N 336.370 3.192 50 40 EGGB CCOc1cc(/C=N/NC(=O)c2ccccc2OC)cc(Cl)c1O 5872038 LVLTWRDHHJUYBI-VXLYETTFSA-N 348.786 3.217 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/c2ccc(Br)cc2)cc1 57787472 JSNVBFRJUSIGTK-VCHYOVAHSA-N 328.169 3.085 50 40 EGGB COc1ccccc1/C=C(\C#N)C(=O)NCCc1c[nH]c2ccccc12 530845 OIGJNOOPAAQMQX-SFQUDFHCSA-N 345.402 3.442 50 40 EGGB O=C(CC(=O)Nc1cccc(C(F)(F)F)c1)NN=C1CCCCC1 6321633 ISSCKLDDQSICBH-UHFFFAOYSA-N 341.333 3.470 50 40 EGGB Cc1ccc(/C=N/NC(=O)COc2c(C)cccc2C)cc1[N+](=O)[O-] 8496816 WPTVAADMHVEHFW-VXLYETTFSA-N 341.367 3.049 50 40 EGGB CC1(C)[C@]2(C)CC[C@]1(C(=O)N1CCCCC1)[C@H](Br)C2=O 100834619 SPFWMAKXCTWFLU-HFBAOOFYSA-N 342.277 3.158 50 40 EGGB CCOc1cccc(-c2cc(C(=O)N/N=C\c3cccs3)[nH]n2)c1 27489828 DRKDYHFIRFNSSV-WQRHYEAKSA-N 340.408 3.301 50 40 EGGB CC1CCN(c2c([N+](=O)[O-])cc(C(=O)Cl)cc2[N+](=O)[O-])CC1 26508977 IBLCERAMSVYJDB-UHFFFAOYSA-N 327.724 3.118 50 40 EGGB CC(C)(C)OC(=O)N[C@@H]1CCCC[C@@H]1N(C(=O)CCl)C1CC1 79392598 GFWXAAPRUTZVMC-OLZOCXBDSA-N 330.856 3.052 50 40 EGGB CCO[Si](Cc1c(F)c(F)cc(F)c1F)(OCC)OCC 575182223 IKFXHACYEPMOOG-UHFFFAOYSA-N 326.362 3.373 50 40 EGGB COc1ccc(C(=O)N/N=C/c2ccc(Br)cc2)cc1 493456 CJSJUXWOSDGMBC-LICLKQGHSA-N 333.185 3.222 50 40 EGGB COC(=O)c1ccc(/C=N/NC(=O)c2ccc3ccccc3c2)cc1 566047 JLBUMJFONXDLBZ-FYJGNVAPSA-N 332.359 3.390 50 40 EGGB Cn1/c(=N\NC(=O)/C=C/c2cccc(F)c2)sc2ccccc21 104923856 HSPAXOKYRMOJKR-QZPKHCKVSA-N 327.384 3.024 50 40 EGGB O=C(CBr)Nc1cccc(NC(=O)c2ccccc2)c1 35605371 FJDFOUVXOSKAGU-UHFFFAOYSA-N 333.185 3.272 50 40 EGGB N#C/C(C(=O)CSc1ncccn1)=C1\Nc2ccccc2S1 6913814 LQOCIHLZENPORZ-UVTDQMKNSA-N 326.406 3.091 50 40 EGGB O=C(NCc1cccc(C(F)(F)F)c1)NN=C1CCSCC1 84364533 JLEDIWJNCKMFDS-UHFFFAOYSA-N 331.363 3.388 50 40 EGGB Cc1ccccc1OCC(=O)N/N=C/c1ccc(OC(C)C)cc1 408858856 QJXHFDKBCGVSLF-UDWIEESQSA-N 326.396 3.311 50 40 EGGB Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)NNC(=O)c1ccoc1C 40140394 JGMKRKHUADJDPH-AWEZNQCLSA-N 344.411 3.248 50 40 EGGB CSC1=NC=C(C#N)C2=N[C@H](c3c(Cl)cccc3Cl)NN12 1590851 ZHLCCABHBFMOQP-NSHDSACASA-N 338.223 3.351 50 40 EGGB Cc1nc2ccccc2n1CC(=O)N/N=C/C1=CC[C@H]2C[C@H]1C2(C)C 102407133 MJDNFXQZNIBKAB-XIRVLSMDSA-N 336.439 3.439 50 40 EGGB Clc1cc(I)cc2c1C[C@H](Cl)CO2 4159449 XDWQKKZZJJRVOC-YFKPBYRVSA-N 328.964 3.487 50 40 EGGB N#C/C(=C/c1ccc(-c2ccc(Cl)c(C(=O)O)c2)o1)C(N)=S 5205111 XPFKMGZUYITWDG-UITAMQMPSA-N 332.768 3.491 50 40 EGGB Cc1cc(C(F)F)nn1[C@H](C)C(=O)N/N=C/c1ccc(F)s1 252485483 GWKIMRDKXIZATN-WTEYRUJWSA-N 330.335 3.041 50 40 EGGB COc1cc(/C=C(\C#N)S(=O)(=O)c2ccc(Cl)cc2)ccc1O 111967 SMHMINIRWGEWDN-RIYZIHGNSA-N 349.795 3.393 50 40 EGGB O=C(N/N=C/c1c[nH]c2ccccc12)c1cncc(Br)c1 257450 LXBRQHINQNRKRB-UFWORHAWSA-N 343.184 3.089 50 40 EGGB COc1ccc(/C=N/NC(=O)COc2c(C)cccc2C)cc1Cl 221081 GSTQHBUPFFLXFH-KEBDBYFISA-N 346.814 3.495 50 40 EGGB C/C(=N\NC(=O)COc1c(C)cccc1C)c1cccc([N+](=O)[O-])c1 221201 UFCSDZWGNDANJA-XMHGGMMESA-N 341.367 3.131 50 40 EGGB COc1ccc(CC(=O)N/N=C/c2c(O)ccc3ccccc23)cc1 369414 HGVXUENDHRTHPJ-FYJGNVAPSA-N 334.375 3.247 50 40 EGGB C/C(=N\NC(=O)COc1ccc(C(C)(C)C)cc1)c1cccc(N)c1 12490476 HIXASZAUJLNTNA-HYARGMPZSA-N 339.439 3.486 50 40 EGGB CN(C)c1ccc(NC(=O)/C(C#N)=C\c2ccc([N+](=O)[O-])cc2)cc1 408781231 BMZDQYRSXKKAKO-KAMYIIQDSA-N 336.351 3.206 50 40 EGGB CC/C=N/NC(=O)COc1ccc2ccccc2c1Br 4180993 SCWBPPJUISKTHM-RQZCQDPDSA-N 335.201 3.493 50 40 EGGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C(/c1ccccc1)C(C)C 408589547 LUAZNXAFWJFYJD-HTXNQAPBSA-N 341.367 3.394 50 40 EGGB Cc1ccc(C)c(CC(=O)N/N=C/c2ccc(Br)o2)c1 409362325 IYYOXIQIIRBVJI-RQZCQDPDSA-N 335.201 3.352 50 40 EGGB N#C/C(=C/c1cn(CC(N)=O)c2ccccc12)c1nc2ccccc2[nH]1 33629536 UTSQEGNDCHQZAU-LCYFTJDESA-N 341.374 3.067 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1cccn1-c1ccc(F)cc1 409232646 AVRPOBJOIYXUAK-XKZIYDEJSA-N 339.345 3.448 50 40 EGGB CC1(C)C(Br)=C(Br)C(=O)[C@@H]1Br 159519 GDOWPVPCUGJNFA-LURJTMIESA-N 346.844 3.360 50 40 EGGB COc1ccc(OCC(=O)N/N=C/c2ccc3ccccc3c2)cc1 499084 MTXNBLZIJRDSOP-FYJGNVAPSA-N 334.375 3.378 50 40 EGGB CCCC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(OC)cc2)cc1 62863 PUKXODJCJWYAAR-DEDYPNTBSA-N 339.395 3.198 50 40 EGGB C/C(CC(=O)Nc1ccc(Cl)cc1)=N\NC(=O)c1ccccc1N 100923079 XEADHTITQRKABA-SRZZPIQSSA-N 344.802 3.057 50 40 EGGB C=CCc1cc(/C=C(/C#N)C(=O)N(C)C)cc(Br)c1OC 59334800 XQORZWLQMAMZQD-JYRVWZFOSA-N 349.228 3.181 50 40 EGGB COC(=O)N/N=C/c1c(C)nn(-c2cccc(Cl)c2)c1Cl 2658711 HBSNMVBGMVTYQA-FRKPEAEDSA-N 327.171 3.177 50 40 EGGB Cc1ccc(NC(=O)/C(C#N)=C\c2ccc(O)c([N+](=O)[O-])c2)cc1C 408904336 HZRYRKBARDEBDD-ZSOIEALJSA-N 337.335 3.463 50 40 EGGB O=C(N/N=C/c1ccc(N2CCCC2)c(F)c1)c1ccccc1F 409068315 RVPGVEUVIYOXIL-CIAFOILYSA-N 329.350 3.329 50 40 EGGB CCOC(=O)/C(C#N)=C/c1ccc(-c2cc(C(=O)O)ccc2C)o1 408832399 QKKGQVYCOSPYQU-MDWZMJQESA-N 325.320 3.423 50 40 EGGB Cn1cc(/C=N/NC(=O)CNc2ccc(Cl)cc2)c2ccccc21 409363044 KTLFZKSFLBHDQR-UFFVCSGVSA-N 340.814 3.394 50 40 EGGB O=C(N/N=C\c1ccc(O)cc1O)C(c1ccccc1)c1ccccc1 36623620 QOJITGDLAXHZOF-HMAPJEAMSA-N 346.386 3.380 50 40 EGGB O=C(N/N=C/c1ccc(-c2ccccc2C(=O)O)o1)c1cccs1 509927 PXWLRXXSEOGCIO-VCHYOVAHSA-N 340.360 3.470 50 40 EGGB N#CC1=C(S)NC(=S)[C@H]([n+]2ccccc2)[C@@H]1c1ccc(F)cc1 101361788 TZQOMGDUKXLKSP-HUUCEWRRSA-O 342.444 3.034 50 40 EGGB COc1cc(/C=C(\C#N)c2nc3ccccc3n2C)cc2c1OCCO2 21322881 SLIFKFSDLXWBQG-NTEUORMPSA-N 347.374 3.417 50 40 EGGB C[C@]12CCC[C@@](C)(CO)[C@H]1CC[C@H]1C[C@@H]3C=C[C@]12[C@H]1C(=O)OC(=O)[C@@H]13 104073748 AWKLTAVAULXADV-WZRGVROLSA-N 344.451 3.093 50 40 EGGB CCOC(=O)/C(C#N)=C1\C[C@@H](C)CC[C@@H]1C(SC)=C(C#N)C#N 59662392 AEWZDTPSKXPNPT-VKLZKGDYSA-N 329.425 3.470 50 40 EGGB C/C(CC(C)(C)c1ccccc1)=N\NC(=O)CSc1ncccn1 14186050 SJRADMAQEZDXNU-KGENOOAVSA-N 342.468 3.429 50 40 EGGB CC(C)Oc1ccc(-c2cc(C(=O)N/N=C/c3cccnc3)[nH]n2)cc1 8816961 INJSWKGYHUPQSN-CIAFOILYSA-N 349.394 3.023 50 40 EGGB Cc1ccc(/C=C(\C#N)C(=O)N2CCC(Nc3cccnc3)CC2)cc1 96295016 SCZXFRQFPDLZGQ-QGOAFFKASA-N 346.434 3.400 50 40 EGGB O=C(c1cccc(F)c1F)[C@@H](Br)CBr 306227715 HEYMYCISLSVVEE-LURJTMIESA-N 327.950 3.306 50 40 EGGB Cc1ccc(OCC(=O)NNC(=O)Nc2cccc3ccccc23)cc1 11007198 RGPDJTNJHCMSPS-UHFFFAOYSA-N 349.390 3.380 50 40 EGGB Cc1ccc(C(=O)NNc2nc3ccc([N+](=O)[O-])cc3s2)cc1 59417521 CWCOGINIGRPOJG-UHFFFAOYSA-N 328.353 3.270 50 40 EGGB CC(=O)[C@@H]1C(=O)N(c2ccccc2)C(N)=C(C#N)[C@@H]1C1CCCCC1 108269201 WZPZOJIMSWGHME-ROUUACIJSA-N 337.423 3.129 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@H]1c1cccs1 3958904 WAWGIBHVOGEXJI-LLVKDONJSA-N 326.406 3.418 50 40 EGGB N#CCOc1ccc(/C=N/NC(=O)CCSc2ccccc2)cc1 4502848 IFSJCGZESJBHEA-XSFVSMFZSA-N 339.420 3.221 50 40 EGGB O=C(N/N=C\c1ccccc1)C(O)(c1ccccc1)c1ccccc1 31623632 HTNLCXNSUZNZDD-JWGURIENSA-N 330.387 3.073 50 40 EGGB CCOc1cccc(/C=N/NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 371002 HNIOTTOCKAMPKQ-WOJGMQOQSA-N 327.340 3.066 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)COc2ccccc2F)cc1 6318328 DKSOWVFAKWFBHK-FYJGNVAPSA-N 343.402 3.201 50 40 EGGB C[C@@H](Sc1nccs1)C(=O)C(C#N)=C1Nc2ccccc2N1 102388522 MATUGZNBEFUMHV-SECBINFHSA-N 328.422 3.466 50 40 EGGB CCCC(=O)Nc1ccc(C(=O)N/N=C2/CC(=O)CC(C)(C)C2)cc1 101490129 MPUQOORFGOVFEV-QNGOZBTKSA-N 343.427 3.290 50 40 EGGB COc1ccc(C(=O)/C=C(\C)NNC(=O)c2cccc(Cl)c2)cc1 101632426 HQNAVCSLCHDVEI-ZRDIBKRKSA-N 344.798 3.370 50 40 EGGB O=C(N/N=C/c1cc(Cl)ccc1O)c1ccc(N2CCCC2)cc1 7383942 BWNNXSSYNLEXAY-UDWIEESQSA-N 343.814 3.410 50 40 EGGB COc1ccc(C(=O)N/N=C/c2ccc(C)c(C)c2C)cc1OC 58927995 ZQDUDXUHBHUQRD-RGVLZGJSSA-N 326.396 3.393 50 40 EGGB O=C(NNC(=O)c1cccs1)Nc1ccc(C(F)(F)F)cc1 2561879 VCNVOFSSSHIDEM-UHFFFAOYSA-N 329.303 3.233 50 40 EGGB Cc1cc(C)n(CCC(=O)NN=C2c3ccccc3-c3ccccc32)n1 503616 NKUXULNLMPJMOH-UHFFFAOYSA-N 344.418 3.439 50 40 EGGB CCn1nc(C)c([C@H]2[C@H]3CCCC=C3C(C#N)=C(N)C2(C#N)C#N)c1C 2769701 FCZZYPKTQOKKEW-MAUKXSAKSA-N 346.438 3.113 50 40 EGGB Cc1ccc(NC(=O)C(=O)N/N=C/c2ccc(Cl)cc2)cc1C 3072731 MVKMJZYUGXFTSH-VXLYETTFSA-N 329.787 3.046 50 40 EGGB Cc1cc(Br)cc(/C=N/NC(=O)Cc2ccccc2)c1O 3153015 UZHTZPHAXRAHNT-VCHYOVAHSA-N 347.212 3.156 50 40 EGGB CC(=O)n1cc(/C=N/NC(=O)Cc2cccs2)c2ccccc21 3149510 RNTSTANBSCQSFA-VCHYOVAHSA-N 325.393 3.056 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@@H]1c1cccs1 3958907 WAWGIBHVOGEXJI-NSHDSACASA-N 326.406 3.418 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCCC3)o2)c(F)c1 408963710 AKCHRAXTXHAPLL-CIAFOILYSA-N 340.358 3.045 50 40 EGGB CO[C@@H](C(=O)N/N=C/c1ccc(N2CCCCC2)o1)c1ccccc1 408997653 SFKBYBQNHGYESA-SQVRNEIYSA-N 341.411 3.108 50 40 EGGB CC(=O)NNc1nc(C)c(C(=O)/C=C\C=C/c2ccccc2)s1 5834395 TTZULNFOELAVHR-SQXCDDPUSA-N 327.409 3.367 50 40 EGGB CCCOc1ccccc1/C=N\NC(=O)c1ccc(OC)c(OC)c1 6324714 ICZXLHILQAJERI-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB CCCC1=C(C(=O)OCC)[C@@H](c2cccc(OC)c2)C(C#N)=C(N)O1 71031 HZOGXMPEYFOJAK-INIZCTEOSA-N 342.395 3.120 50 40 EGGB O=C(CI)Nc1ccc(Cl)c(Cl)c1 1737717 SXYTXEAKLIDTJE-UHFFFAOYSA-N 329.952 3.367 50 40 EGGB CSc1sc(C(=C(C#N)C#N)c2ccccc2)c(N)c1C(N)=O 6794403 YMGSALHDFBFNNT-UHFFFAOYSA-N 340.433 3.000 50 40 EGGB CCOC(=O)c1ccc2nc(NC(=O)CCCCl)sc2c1 20133628 YVTRGXFAWMLJJJ-UHFFFAOYSA-N 326.805 3.431 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc(C)cc2C)c(O)c1 20195402 ZPKAOBKDFRUDPZ-XSFVSMFZSA-N 326.396 3.101 50 40 EGGB CCOc1cccc2cc(/C(C)=N/NC(=O)NC[C@@H]3CCCO3)oc12 84810973 VPGWXGZGLBEKQQ-PVGUKEHMSA-N 345.399 3.034 50 40 EGGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2sccc2C)cc1 408791110 UEOVVRJWQLGQAG-UKTHLTGXSA-N 326.377 3.389 50 40 EGGB CCCOc1ccc(C(=O)N/N=C\c2cccc(O)c2)cc1OCC 409324054 RPZWTMCERYFTLF-MOSHPQCFSA-N 342.395 3.344 50 40 EGGB COc1ccccc1/C=N/NC(=O)CNc1cccc2ccccc12 252331 FDIUCPCRDUTCDF-LPYMAVHISA-N 333.391 3.411 50 40 EGGB C=CCSC1=C(C#N)[C@@H](c2ccccc2OCC)[C@H](C#N)C(=O)N1 9110439 IBUQJZKOGSOOCN-BBRMVZONSA-N 339.420 3.093 50 40 EGGB Cc1ccc(-c2ccc(/C=C(\C#N)C(N)=O)o2)c(Br)c1 1411715 FOWOJIMMMTZPFY-JXMROGBWSA-N 331.169 3.410 50 40 EGGB CC(=O)NCc1cc(C)c(CBr)cc1CBr 1571525 QZOLVGXGIVJXQO-UHFFFAOYSA-N 349.066 3.421 50 40 EGGB O=C1c2ccccc2C(=O)N1OCCCCCCBr 3156367 AQZRBRIWMJSLLW-UHFFFAOYSA-N 326.190 3.170 50 40 EGGB C[C@@H]1CCc2sc(C(=O)N/N=C/c3cccc(O)c3O)cc2C1 3393664 PZXDJZABXDFMHL-SVXRXWARSA-N 330.409 3.048 50 40 EGGB CC(=O)Nc1cccc(CNC(=O)NNc2cccc(Cl)c2C)c1 45618455 WVPNITCKLMCUIZ-UHFFFAOYSA-N 346.818 3.433 50 40 EGGB CC(=O)N/N=C/c1ccccc1OCCCOc1ccccc1C 9434673 GAVYGBSCXFEVCG-XSFVSMFZSA-N 326.396 3.313 50 40 EGGB C/C(=N\NC(=O)Cn1cnc2ccccc21)c1cc(C)sc1C 7993182 VCHALRCVARICNQ-XDHOZWIPSA-N 326.425 3.255 50 40 EGGB N#CC1=C(SCCOc2ccccc2)NC(=O)C[C@H]1c1ccco1 409144001 OZALDJAITAIEOQ-CQSZACIVSA-N 340.404 3.430 50 40 EGGB CN(C)c1ccc(/C=C(\C#N)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 17070686 CKYFZZFGKUSCRK-SDNWHVSQSA-N 336.351 3.206 50 40 EGGB Cc1ccc(-c2n[nH]c3c2[C@H](c2ccccc2O)C(C#N)=C(N)O3)cc1 5941575 ZJSOUHCWFAXYAH-MRXNPFEDSA-N 344.374 3.309 50 40 EGGB C/C(=N\NC(=O)c1cccc([N+](=O)[O-])c1O)c1ccc(Cl)cc1 409084540 POTJHDVNSWCKNV-RQZCQDPDSA-N 333.731 3.108 50 40 EGGB Cc1ccsc1/C=N/NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 408967928 YDEZPBRYUMVSNB-LZYBPNLTSA-N 329.337 3.475 50 40 EGGB COc1ccc(CNC(=O)/C(C#N)=C/c2sccc2C)c(OC)c1 408867027 ILZJSGAZIPZROA-RIYZIHGNSA-N 342.420 3.297 50 40 EGGB O=C(O)c1c(F)cccc1P(=O)(c1ccccc1)c1ccccc1 95611996 FLPBSTBLLFFUAU-UHFFFAOYSA-N 340.290 3.163 50 40 EGGB CCOC(=O)[C@@H]1CCC/C1=N\NC(=O)[C@@H](C)Sc1ccccc1 5326125 JFTJXEQGYCJKFG-VMNNHZPZSA-N 334.441 3.003 50 40 EGGB COC(=O)c1ccc(/C=N/NC(=O)c2ccc(C)cc2Cl)cc1 567083 HINAQWZRUFRKQE-VXLYETTFSA-N 330.771 3.199 50 40 EGGB O=C1CCC/C(=N/NC(=O)COc2ccccc2-c2ccccc2)C1 103457718 KXOGSQNMOXCOPA-PGMHBOJBSA-N 336.391 3.348 50 40 EGGB C[C@@H]1CCc2sc(C(=O)N/N=C/c3ccccc3C(=O)O)cc2C1 3554639 DOOHMPLQKPBTSZ-VURRPDKYSA-N 342.420 3.335 50 40 EGGB O=C(NNC(=O)c1cccc(Cl)c1)c1ccc(C(F)(F)F)cc1 6221057 JVKYARYAFIBIDZ-UHFFFAOYSA-N 342.704 3.434 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/c2cccc(Br)c2)c(F)c1 408964278 CQZZUOGYSNMVTR-DJKKODMXSA-N 346.159 3.224 50 40 EGGB CC(=O)N(c1cccc(Cl)c1)c1nc(/C=C(/C#N)C(=O)O)cs1 44867230 LKDRJDQWZNJRDC-YHYXMXQVSA-N 347.783 3.473 50 40 EGGB CCOc1ccccc1-c1cc(C(=O)N/N=C(\C)c2ccco2)[nH]n1 232923 CKFUOQOQBPELRS-XDHOZWIPSA-N 338.367 3.222 50 40 EGGB O=C(c1ccccc1)[C@H](Br)S(=O)(=O)c1ccccc1 34286120 XCTHPMPRRKCKCR-CQSZACIVSA-N 339.210 3.064 50 40 EGGB Cc1cc(Cl)ccc1OCC(=O)N/N=C1\CC(=O)CC(C)(C)C1 100007723 RLADEAUZNLGRJK-CPNJWEJPSA-N 336.819 3.279 50 40 EGGB Cc1cc(N(CCCl)CCCl)ccc1/C=N\C(C)(C)CO 100372291 DXXXXIKWSFPEEU-ODLFYWEKSA-N 331.287 3.469 50 40 EGGB C/C(CCc1ccccc1)=N/NC(=O)C(=O)Nc1ccc(C)c(C)c1 59515729 CVAIKODOMNBSTL-JWGURIENSA-N 337.423 3.367 50 40 EGGB CCC/C(=N/NC(=O)COc1ccc([N+](=O)[O-])cc1)c1ccccc1 13943402 QAKMOPOIVUGRQM-ZPHPHTNESA-N 341.367 3.294 50 40 EGGB O=C(N/N=C\c1ccc(-c2cccc(Cl)c2)o1)c1cnccn1 67194086 JTRYKTUANFYEOP-UKWGHVSLSA-N 326.743 3.154 50 40 EGGB COc1cccc(NC(=O)/C(C#N)=C/c2cccc(OC(C)=O)c2)c1 408761430 FGBDKNVQCWBQEX-OQLLNIDSSA-N 336.347 3.166 50 40 EGGB C=CCn1cc(/C=N/NC(=O)c2ccc(OC)cc2O)c2ccccc21 409390599 FPUNMZUJXAWGGC-CIAFOILYSA-N 349.390 3.305 50 40 EGGB Cc1ccc(/C=N/NC(=O)c2ccccc2NC(=O)c2ccco2)o1 6278839 OIPIQZKSNPIHFN-YBFXNURJSA-N 337.335 3.197 50 40 EGGB CC(C)N(C(=O)CCl)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 242548812 LUIXCSYCYVMOGU-JOCQHMNTSA-N 332.872 3.298 50 40 EGGB COc1cccc(C(=O)NNc2nc3c(F)cc(F)cc3s2)c1 429775 UBLGMRGBCIHGQL-UHFFFAOYSA-N 335.335 3.340 50 40 EGGB N#C/C(=C\c1cccc(C#N)c1)c1nc(N)nc(Nc2ccccc2)n1 12641430 XELAULCGRKMJLZ-XNTDXEJSSA-N 339.362 3.133 50 40 EGGB Cc1ccc(CSCC(=O)N/N=C/c2ccc(N(C)C)cc2)cc1 408774289 UMSAACKZKVHDJP-UDWIEESQSA-N 341.480 3.445 50 40 EGGB CCOc1cccc(/C=N\NC(=O)c2ccc(OC)c(OCC)c2)c1 409319576 IPBQHTJCBDQJAL-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB O=C(N/N=C/c1ccc2c(c1)OCCO2)c1ccccc1-n1cccc1 6831437 DAPJXPAPUWUGAR-KGENOOAVSA-N 347.374 3.012 50 40 EGGB COc1cc(OC)cc(C(=O)NNc2nc3c(C)cccc3s2)c1 4121292 GXZCQEGBNTVIDI-UHFFFAOYSA-N 343.408 3.379 50 40 EGGB Cc1cc2c(c(=O)o1)[C@@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 61411 MYSIOPAOBNTDFR-GFCCVEGCSA-N 349.173 3.473 50 40 EGGB COc1ccccc1OCC(=O)N/N=C/c1cccc2ccccc12 510845 IOXFBPAAUHBAFH-FYJGNVAPSA-N 334.375 3.378 50 40 EGGB C=CCOc1c(CC=C)cc(/C=C(/C#N)C(=O)N(C)C)cc1OCC 59334904 OGDDFOWRDSKFHU-ATVHPVEESA-N 340.423 3.374 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)CCc2c[nH]c3ccccc23)cc1 1497065 TYBXARLGCUQDBF-LPYMAVHISA-N 334.423 3.317 50 40 EGGB COc1cc(/C=N/NC(=O)[C@@H](C)Sc2ccc(C)cc2)ccc1O 409111798 CFHWCANARLRRAX-OTGIAGGSSA-N 344.436 3.340 50 40 EGGB O=C(N/N=C/c1ccc(O)cc1)[C@@H](c1ccccc1)N1CCCCC1 1698285 LOOMXCCCBNBOIO-DDNKWHRWSA-N 337.423 3.070 50 40 EGGB O=C(Nc1ccccc1C(=O)N/N=C/c1ccccc1O)c1ccco1 135692 JBBKWAAYLPAMOZ-UDWIEESQSA-N 349.346 3.001 50 40 EGGB CC(=O)Nc1ccc(C2=NN(C(=O)CCl)[C@@H](c3ccco3)C2)cc1 23175892 IMTVYULEFDSSKG-OAHLLOKOSA-N 345.786 3.155 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)Nc2ccc(F)cc2)ccc1O 3570259 SKALUMZTYNERIV-UKTHLTGXSA-N 326.327 3.476 50 40 EGGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1cccc2ccccc12 4720964 JPJKFJWTHSNWOO-UDWIEESQSA-N 349.346 3.277 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)N2CCCC2)ccc1OC(F)F 192557125 LETNEKOLELPIHX-UKTHLTGXSA-N 336.338 3.216 50 40 EGGB CCn1cc(/C=N/NC(=O)CNc2ccc(F)cc2)c2ccccc21 487164 HMGYHACSMPPFKK-SSDVNMTOSA-N 338.386 3.363 50 40 EGGB Cc1ccc(C(=O)CCC(=O)NNc2ccccc2[N+](=O)[O-])cc1C 32747748 OPKOXAPBVPPZEH-UHFFFAOYSA-N 341.367 3.318 50 40 EGGB COc1ccc(CCCC(=O)N/N=C/c2ccccc2OC)c(C)c1 408905833 FJPCHFJKYIXIOM-KGENOOAVSA-N 340.423 3.485 50 40 EGGB CC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1cccc([N+](=O)[O-])c1 408764639 XYHIJKXDUYHBJP-ZROIWOOFSA-N 335.319 3.343 50 40 EGGB O=C(Br)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F 95681929 CJRZVDYMJZXUDK-UHFFFAOYSA-N 326.940 3.376 50 40 EGGB COc1ccc(OC)c(C(=O)Oc2ccc([N+](=O)[O-])cc2Cl)c1 101099420 ZVHSGNPKONIDKS-UHFFFAOYSA-N 337.715 3.485 50 40 EGGB O=C(N/N=C/c1cccc(Cl)c1)C(=O)Nc1cccc(Cl)c1 59515989 CPIJVWROJXQWHN-GIJQJNRQSA-N 336.178 3.082 50 40 EGGB Cn1cc(/C=C/C(=O)NN=C(c2ccccc2)c2ccccc2)cn1 32537824 DBVBMCOBSCUZEB-OUKQBFOZSA-N 330.391 3.002 50 40 EGGB CCC[C@@H](Br)C(=O)NCCC(=O)Nc1ccccc1C 8733130 RMKSQGJNMSJZQE-GFCCVEGCSA-N 341.249 3.003 50 40 EGGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)c2cccc(Cl)c2)cc1 408884965 WFNMTZQEXRDAJG-RGVLZGJSSA-N 329.787 3.452 50 40 EGGB CCOc1ccc(C(=O)N/N=C\c2ccc(O)c(Cl)c2)cc1OC 409330919 CRKOFMHOVRWXDB-GRSHGNNSSA-N 348.786 3.217 50 40 EGGB CCc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3)C2)cc1 342603 HEOORIMEZOPHAG-ZFJBLLOBSA-N 349.434 3.061 50 40 EGGB NC(=O)N/N=C/c1ccc(OCc2ccc(Br)cc2)cc1 222920 YYWGZODIAFDGIG-GIJQJNRQSA-N 348.200 3.030 50 40 EGGB COc1ccc([C@@H]2C(C#N)=C(N)OC(C)=C2C(=O)OC(C)(C)C)cc1 2697927 DPUOKTNKCXIURH-MRXNPFEDSA-N 342.395 3.119 50 40 EGGB Cc1cc2c(c(=O)n1CCc1ccccc1)[C@H](C(C)C)C(C#N)=C(N)O2 2231088 KUPVBGDOEINQAG-GOSISDBHSA-N 349.434 3.225 50 40 EGGB CCCCc1ccc(NC(=S)NNC(=O)c2cccc(O)c2)cc1 6517196 XKULAMAFTDFOAY-UHFFFAOYSA-N 343.452 3.366 50 40 EGGB N#CC1=C(N)Oc2n[nH]c(-c3ccc(F)cc3)c2[C@H]1c1ccc(O)cc1 9109623 CUJBWMXEYXZZJN-HNNXBMFYSA-N 348.337 3.140 50 40 EGGB biogenic,in-vitro O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1cccs1 3237089 VLJWATIDZXJRKY-UFWORHAWSA-N 327.331 3.329 50 40 EGGB C[C@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(OCC#N)cc1 8218146 YWBVRUUKUBOVPY-ZXOFLVKFSA-N 339.420 3.220 50 40 EGGB C/C(N)=C(\C#N)C(=O)CSc1nc2ccccc2n1CCC(C)C 104837399 BHDRDLKILBLGSD-YPKPFQOOSA-N 342.468 3.500 50 40 EGGB C[C@H](c1ccc(Cl)cc1)N(C)C(=O)NNC(=O)c1ccccc1 12972912 SLWPUYCVNJCFEW-GFCCVEGCSA-N 331.803 3.387 50 40 EGGB Cc1c(C(=O)NNC(=S)Nc2ccccc2)oc2ccccc12 6572113 OWAWZGYMPZPKOC-UHFFFAOYSA-N 325.393 3.373 50 40 EGGB Cc1ccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1 5578963 IURUCGXSQXLERX-UHFFFAOYSA-N 326.440 3.363 50 40 EGGB O=C(NNC(=O)c1cccs1)c1cc(-c2cccc(Cl)c2)on1 47525849 IHDIPECWWHUEOO-UHFFFAOYSA-N 347.783 3.131 50 40 EGGB COc1cc(C(=O)N/N=C(\C)[C@@H]2C[C@H]3CC[C@@H]2C3)cc(OC)c1OC 15938568 AVTPWNSWYYPBDO-INZXJBHHSA-N 346.427 3.254 50 40 EGGB N#C/C(C(=O)CN1CCCCC1)=C1\NC(c2ccccc2)=CS1 3171508 JAFAUNUQZVYGCO-SDXDJHTJSA-N 325.437 3.112 50 40 EGGB CCSC1=C(C#N)[C@@H](c2ccc(C)cc2)[C@H](C(=O)OC)C(O)=N1 189682 MDCHVJODMWTRQK-KGLIPLIRSA-N 330.409 3.326 50 40 EGGB N#C/C(=C\c1coc2ccccc2c1=O)C(=O)NCc1ccccc1 3313721 BKNQLOKKSXVMNF-XNTDXEJSSA-N 330.343 3.016 50 40 EGGB COc1ccc(N(CCC#N)C(=O)/C(C#N)=C\c2ccc(C)o2)cc1 1770591 WTYGNTDQGIYXGR-QINSGFPZSA-N 335.363 3.450 50 40 EGGB Cc1cc(C)c2cc(C(=O)NNC(=O)Cc3cccs3)[nH]c2c1C 58183995 GLGQDWZTAXWHOG-UHFFFAOYSA-N 341.436 3.158 50 40 EGGB COc1ccc(CSCC(=O)N/N=C/c2cccc(OC)c2)cc1 59473075 QRXMMTMIULCDDK-YBFXNURJSA-N 344.436 3.087 50 40 EGGB Cc1cc(/C=N/NC(=O)c2cccc(F)c2)c(C)n1-c1ccccn1 409232278 PSZSLUGYJSHZBI-WSDLNYQXSA-N 336.370 3.392 50 40 EGGB C[C@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1ccc(O)cc1 31069 YQKCEONOBVXLBB-HADWXUJASA-N 333.391 3.496 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)[C@@H](OC)c2ccccc2)cc1 4199148 ZJRZYHNQDKAAMI-OFBHVFLISA-N 326.396 3.313 50 40 EGGB COc1cccc(NC(=O)/C(C#N)=C\c2cccc(OC)c2OC)c1 208865999 JYNDKFHAKWBCAI-UVTDQMKNSA-N 338.363 3.258 50 40 EGGB COc1cc(/C=C/C(=O)NN)cc(Cl)c1OCc1ccc(C)cc1 226335624 NLRBGZXFBOBAHF-BQYQJAHWSA-N 346.814 3.239 50 40 EGGB Cc1cc(C)cc(OCC(=O)N/N=C2\C(O)=Nc3ccc(C)cc32)c1 8404867 DKSBWQAJNQYEAD-UHFFFAOYSA-N 337.379 3.113 50 40 EGGB N#CCCN(C(=O)/C(C#N)=C\c1ccc([N+](=O)[O-])cc1)c1ccccc1 6229365 XTYYRKVMPPBDCQ-SSZFMOIBSA-N 346.346 3.449 50 40 EGGB Cc1ccn2c(C(=O)N/N=C/c3ccc(Cl)cc3)c(C)nc2c1 51133 HNELMKCJXUBJAZ-VXLYETTFSA-N 326.787 3.368 50 40 EGGB N#C/C(=C\c1ccccc1)C(=O)Nc1ccc(N2CCOCC2)cc1 2886653 VIADKMSMDRWVEY-SAPNQHFASA-N 333.391 3.069 50 40 EGGB Nc1c(Cl)c(Cl)nc(C(=O)N/N=C/c2ccccc2)c1Cl 23486119 FHDVBPGFJBTTGM-NGYBGAFCSA-N 343.601 3.388 50 40 EGGB Cc1ccc(C)c(OCCCOc2cccc(/C=N/NC(N)=O)c2)c1 4592081 AZMIMXRBAAWVRA-FYJGNVAPSA-N 341.411 3.154 50 40 EGGB CC(C)(C)c1ccc(OCC(=O)N/N=C/c2ccc(C#N)cc2)cc1 5119665 IZKITEIARKOYOV-LPYMAVHISA-N 335.407 3.385 50 40 EGGB CC(=O)c1ccc(/N=N/c2ccc(O)c(/C=N/NC(N)=O)c2)cc1 5379239 DIHNBGZSWCBWLQ-HWEFLWFZSA-N 325.328 3.012 50 40 EGGB Cc1cc(C)nc(NNC(=O)C(c2ccccc2)c2ccccc2)n1 11333960 IIGIUBYSENQTFO-UHFFFAOYSA-N 332.407 3.369 50 40 EGGB Cc1cc(Cl)ccc1OCC(=O)N/N=C/c1ccc(N(C)C)cc1 249341 QWZNPXQIYZHLAD-RGVLZGJSSA-N 345.830 3.244 50 40 EGGB Cc1noc(C)c1COc1ccc(/C=C(\C#N)C(=O)NC2CC2)cc1 32534552 KNQFIRGPDWABOL-OQLLNIDSSA-N 337.379 3.056 50 40 EGGB Cc1ccccc1C(=O)NNc1nc2ccc([N+](=O)[O-])cc2s1 59417519 CDFJFRCOXHEUPX-UHFFFAOYSA-N 328.353 3.270 50 40 EGGB C=CCOc1cccc(/C=N\NC(=O)c2c(C)nc3sccn23)c1 59516149 OLNMAXSTJSFEMN-WQRHYEAKSA-N 340.408 3.033 50 40 EGGB COc1cccc(/C=N/NC(=O)NC23CC4CC(CC(C4)C2)C3)c1 4897513 XMEJUOANTRAUPZ-UDWIEESQSA-N 327.428 3.297 50 40 EGGB O=C(CCc1ccccc1)N/N=C/c1cccc(OC2CSC2)c1 409149086 XBNQZFBNKURGDD-UDWIEESQSA-N 340.448 3.264 50 40 EGGB Cc1cc(C(=O)NN)c(C)n1-c1ccc(Cl)cc1Br 223706614 LMPVCHPBCNRPJZ-UHFFFAOYSA-N 342.624 3.114 50 40 EGGB CCCCCN1C(=O)/C(=N\NC(=O)c2ccccc2)c2ccccc21 3573078 PCHOEXVGYICASA-UZYVYHOESA-N 335.407 3.358 50 40 EGGB N#CC1=C(N)OC2=C(C(=O)CCC2)[C@H]1c1cc([N+](=O)[O-])ccc1Cl 62505 NCROOISRKDCTFQ-AWEZNQCLSA-N 345.742 3.063 50 40 EGGB COC(=O)c1ccccc1N/C=C(\C#N)c1nc2ccccc2n1C 13749075 ULFYJRUNGOLFFY-OUKQBFOZSA-N 332.363 3.336 50 40 EGGB COc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)c(OC)c1 313750 DQAJRZCFRLPQGN-KZKLBEMASA-N 344.436 3.335 50 40 EGGB CCCC/C(C)=N/NC(=O)C(=O)Nc1ccccc1Br 59435838 FOSHCAITTUQQLI-LICLKQGHSA-N 340.221 3.070 50 40 EGGB N#Cc1c(NC(=S)NC(=O)CCCCl)sc2c1CCCC2 4703943 DPNMBXNYJOOUCZ-UHFFFAOYSA-N 341.889 3.331 50 40 EGGB O=C(Cn1c(C(F)(F)F)nc2ccccc21)N/N=C1/C[C@H]2C=CC[C@@H]12 22287028 JRAAYNSTYLQGLF-DXTZAFSQSA-N 348.328 3.123 50 40 EGGB O=C(c1ccc(F)c(F)c1)[C@H](Br)CBr 306907512 DGRXQJXTDXNJGZ-ZCFIWIBFSA-N 327.950 3.306 50 40 EGGB COc1ccc(OCC(=O)N/N=C/c2ccc(C(C)C)cc2)cc1 381244 FVRWZELQJBRMCH-UDWIEESQSA-N 326.396 3.348 50 40 EGGB CCOc1ccc2[nH]c(C(=O)N/N=C/c3ccccc3OC)cc2c1 2194850 ZHOISXASBUHVGO-UDWIEESQSA-N 337.379 3.339 50 40 EGGB C/C(=N/NC(=O)[C@]1(C)CC1(Cl)Cl)c1cc(Cl)ccc1O 17070666 NYJADIOBPIIIGV-MSBCHBQFSA-N 335.618 3.470 50 40 EGGB Cc1ccc(C)c(SCC(=O)NNC(=O)c2cc(C)oc2C)c1 2644433 OEOHPUSTBSFGBG-UHFFFAOYSA-N 332.425 3.067 50 40 EGGB COc1ccc(C)cc1NC(=O)C/C(C)=N/NC(=O)c1ccoc1C 4679959 IBMKHEMNFBMFBE-UDWIEESQSA-N 343.383 3.040 50 40 EGGB CC[C@H](C(=O)N/N=C/c1ccc(F)s1)n1nc(C)c(Cl)c1C 252484271 FTISJEXZJRAYDX-RGOWCBCBSA-N 342.827 3.455 50 40 EGGB CCCc1n[nH]c2c1[C@@H](c1ccc(OC(C)C)cc1)C(C#N)=C(N)O2 806422 VRINMTRMLUQGPI-INIZCTEOSA-N 338.411 3.368 50 40 EGGB CCCC(=O)Nc1ccc(O)c(/C(C)=N/NC(=O)c2ccoc2C)c1 7783786 QCHLENWDZAHHFJ-RGVLZGJSSA-N 343.383 3.186 50 40 EGGB CCOc1ccc(Cl)cc1/C=N/NC(=O)CNc1ccccc1 409377452 IFQWSVJEDPNGDJ-RGVLZGJSSA-N 331.803 3.301 50 40 EGGB CCOc1cc(/C=N\NC(=O)[C@H](C)Oc2ccc(C)cc2)ccc1O 32109253 MVUBCCAFGLMMOL-GQFJFNLSSA-N 342.395 3.017 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)c2ccccc12 44023141 XPPMKDZGQANOJG-RBFDBLARSA-N 336.391 3.051 50 40 EGGB Cc1cc(C)n(Cc2cccc(C(=O)N/N=C/c3cccs3)c2)n1 130592 ANJOYYAXUFTENY-YBFXNURJSA-N 338.436 3.374 50 40 EGGB Cc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc(F)cc4)c32)o1 92417 SRANNWQNLBONBT-CQSZACIVSA-N 336.326 3.335 50 40 EGGB COc1ccc(Cl)cc1/C=N/NC(=O)COc1ccc(C)c(C)c1 60102 JFGLXHGOBXPUNI-KEBDBYFISA-N 346.814 3.495 50 40 EGGB Cc1ccc([C@H](NC(=O)N2CCOCC2)C(Cl)Cl)cc1F 3205612 OQXDUDFMCOATCG-LBPRGKRZSA-N 335.206 3.021 50 40 EGGB O=C(N/N=C/c1ccc(O)c(Br)c1)c1cccc(F)c1 408738109 OFDWQZRVITZPJC-CAOOACKPSA-N 337.148 3.058 50 40 EGGB N#Cc1ccccc1-c1ccc(/C=N/NC(=O)c2ccccc2O)o1 409047852 NKZFGWMLRFKNPC-CIAFOILYSA-N 331.331 3.288 50 40 EGGB Cc1ccc(/C=N\NC(=O)Cc2ccc(Br)cc2)cc1 36144799 YTUTWHPYPCHUCF-WQRHYEAKSA-N 331.213 3.450 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)NC2CC2)ccc1OCc1ccccc1 17072369 KIJSVUFHVQSAGA-BOPFTXTBSA-N 348.402 3.460 50 40 EGGB CC(=O)/C(C#N)=C1\NC(=O)[C@H](Cc2cc(Cl)ccc2Cl)S1 100968629 PPMIGUPFYAKEII-LQELWAHVSA-N 341.219 3.092 50 40 EGGB O=C(CCCC(=O)N/N=C/[C@H]1CC=CCC1)N/N=C\[C@@H]1CC=CCC1 4962744 GLFGNHUMMQQQNN-PJRUNNDMSA-N 344.459 3.073 50 40 EGGB N#CC(C#N)=C(C#N)c1ccc(-c2ccc(N3CCOCC3)s2)o1 101002716 MVLMEFFVXIWXKM-UHFFFAOYSA-N 336.376 3.169 50 40 EGGB CC(C)OP(=O)(OC(C)C)c1cc(CBr)on1 2273146 KQZQVPVKMIUJOZ-UHFFFAOYSA-N 326.127 3.238 50 40 EGGB Cc1cc(C(=O)N/N=C\c2c(C)nn(-c3ccccc3)c2C)c(C)o1 5010087 PPJJKOWAZTYUCE-JAIQZWGSSA-N 336.395 3.463 50 40 EGGB CSc1nc2c(cc1C#N)C(=O)[C@H](Br)C(C)(C)C2 4994271 IUXMYQSYAAGQIT-NSHDSACASA-N 325.231 3.204 50 40 EGGB CC(C)c1cccc(OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1 32831010 SRLUCTFZNMBZOU-UHFFFAOYSA-N 346.814 3.303 50 40 EGGB O=C(N/N=C/c1ccc(Br)o1)c1ccc(Cl)cc1 6221300 TXIKCHVGXMVIHR-VIZOYTHASA-N 327.565 3.459 50 40 EGGB CCOC(=O)C1=C(C)NC(SCC#N)=C(C#N)[C@@H]1c1cccs1 20609355 WVZMUKDLYWGMJC-CQSZACIVSA-N 345.449 3.264 50 40 EGGB Cc1cccc(C)c1N[C@H](C)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 356642 CMKWHMYNEVNGTE-HIPSJFSSSA-N 340.383 3.162 50 40 EGGB Cc1ccc(C)c(OCC(=O)N/N=C/c2ccccc2[N+](=O)[O-])c1C 307889 SLXTZTJYFSOHML-VXLYETTFSA-N 341.367 3.049 50 40 EGGB Cc1ccc(CC(=O)N/N=C/c2ccc(Br)o2)c(C)c1 20194288 KTWKVXNBFLJJHU-RQZCQDPDSA-N 335.201 3.352 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)NCCc2ccccc2)ccc1O 4615885 REJXBYCRVSDDDU-SFQUDFHCSA-N 336.391 3.057 50 40 EGGB Cc1ccc(Oc2nc3ccccn3c(=O)c2C=C(C#N)C#N)cc1 5531681 YGQIZAKRIORRNE-UHFFFAOYSA-N 328.331 3.226 50 40 EGGB Cc1cccc(NC(=O)/C(C#N)=C/c2ccccc2OCC(=O)O)c1 7158469 SXMWUFNMYVGQND-XNTDXEJSSA-N 336.347 3.004 50 40 EGGB Cc1ccc(CC(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c(C)c1 20194658 UNVQAEIOIBNTBS-AWQFTUOYSA-N 344.798 3.378 50 40 EGGB N#C/C(=C/c1ccncc1)C(=O)Nc1cccc(Br)c1 408753506 NCGLIIKHXPJCFF-WQLSENKSSA-N 328.169 3.390 50 40 EGGB N#C/C(=C\c1ccc(Br)o1)C(=O)NCCc1ccccc1 206487448 GNAWSMKHAITPRV-JLHYYAGUSA-N 345.196 3.308 50 40 EGGB O=C(N/N=C/c1ccc(Cl)cc1Cl)c1ccc2c(c1)OCO2 3474805 WMWKHXUPVSPILI-CNHKJKLMSA-N 337.162 3.486 50 40 EGGB CCOC(=O)/C(C#N)=C\c1ccc(OCc2ccncc2)c(OC)c1 20100743 MBHRAZIVNZSLMQ-YBEGLDIGSA-N 338.363 3.139 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)O)cc2)cc1C 11293697 RDCYLRLYGNZJDB-XNTDXEJSSA-N 336.347 3.248 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2C)cc1 2176205 XMHFHLJBJIQTFS-XDHOZWIPSA-N 341.367 3.456 50 40 EGGB COc1ccccc1N1C=C(C#N)S(=O)(=O)c2ccc(F)cc21 38654509 LBXVKIIAOCNBMY-UHFFFAOYSA-N 330.340 3.125 50 40 EGGB O=C(N/N=C/c1ccccc1Br)c1ccc([N+](=O)[O-])cc1 140727 HTGGZRVJUPKXEO-CXUHLZMHSA-N 348.156 3.121 50 40 EGGB CCOC(=O)NNC1=C(CC(=O)c2ccccc2)C(=O)CC(C)(C)C1 5395814 QOXCFOHZIFAWGR-UHFFFAOYSA-N 344.411 3.153 50 40 EGGB C[C@@H](NC(=O)/C(C#N)=C/c1ccc(OCC#N)cc1)c1ccccc1 8220641 ILLDDZVIIWTAOT-COYFKBPASA-N 331.375 3.373 50 40 EGGB O=C(CNc1ccc2ccccc2c1)N/N=C/c1ccc(C(=O)O)cc1 60527 ZWXVOKHGRSAQRF-WSDLNYQXSA-N 347.374 3.100 50 40 EGGB CN1/C(=C(\C#N)C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)Nc2ccccc21 4059109 BWBFQKBQBINPSY-URDYEQAASA-N 346.346 3.474 50 40 EGGB CN(C)c1ccc(C(=O)NNc2nc3c(F)cccc3s2)cc1 4061270 VLPNSZXFRPNRMS-UHFFFAOYSA-N 330.388 3.258 50 40 EGGB CC[C@H](C)c1ccccc1OCC(=O)N/N=C/c1ccc(O)cc1O 586876 CPAJBILXWKPOEJ-HSWQHBDASA-N 342.395 3.140 50 40 EGGB COc1ccccc1CC(=O)N/N=C1/CCSc2ccccc21 63386869 PBTUXOXEYMFMBR-CYVLTUHYSA-N 326.421 3.254 50 40 EGGB C#CCOc1ccc(OC)cc1/C=N/NC(=O)c1ccccc1Cl 408592625 ZUFMQQCCFVVHSE-UDWIEESQSA-N 342.782 3.125 50 40 EGGB CCc1ccc(-n2c(=O)c3ccccc3n3c(CCl)nnc23)cc1 147511503 IQTREWSPKFIOSC-UHFFFAOYSA-N 338.798 3.335 50 40 EGGB CC[C@H](C)[C@H](N)C(=O)N/N=C/c1cc2ccc(C)cc2nc1Cl 2399228 YETIBTUKPHFSCK-JUEUBRAISA-N 332.835 3.020 50 40 EGGB COc1ccc(/C=C(\C#N)C(N)=O)c(Cc2ccccc2Cl)c1 408865654 DHVQHHCMXOVEDY-OVCLIPMQSA-N 326.783 3.332 50 40 EGGB C[C@H](SCc1ccccc1)C(=O)N/N=C/c1ccc(N(C)C)o1 408995029 KVNLBKYAFQDPIO-FHXOWUIVSA-N 331.441 3.118 50 40 EGGB C[C@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1cccc(O)c1 31134 WJDUIBQQSQAMDJ-HADWXUJASA-N 333.391 3.496 50 40 EGGB CC/C(=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(OC)cc1 17071374 WAINCXFVBALCSJ-HTXNQAPBSA-N 341.367 3.076 50 40 EGGB COc1ccc2nc(/C(C#N)=C\c3ccc4c(c3)OCCO4)[nH]c2c1 409392458 PNXYNHBJXMVUAS-JYRVWZFOSA-N 333.347 3.407 50 40 EGGB COc1cc(/C=N/NC(=O)Cc2cccs2)ccc1OCC(C)C 8446701 SBRUFKLNCHKVKS-YBFXNURJSA-N 346.452 3.484 50 40 EGGB COc1ccc(NC(=O)[C@H](Cl)C(=O)c2ccc([N+](=O)[O-])cc2)cc1 3267319 RAEYVOXNODOQDW-CQSZACIVSA-N 348.742 3.032 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(N(C)C)cc2)cc1 222932 XQGAQGBYFHNSON-RCCKNPSSSA-N 338.455 3.363 50 40 EGGB COc1ccccc1/C=N/NC(=O)c1ccccc1Br 262948 YSTIUXHVUDPBMG-LICLKQGHSA-N 333.185 3.222 50 40 EGGB O=C(N/N=C/c1ccccc1F)C(=O)Nc1cccc2ccccc12 59515501 XFLSHLAKMNXRCA-CIAFOILYSA-N 335.338 3.068 50 40 EGGB CCOc1ccccc1[C@@H]1C(C#N)=C(SC)N=C(O)[C@@H]1C(=O)OC 8970588 XUHOQRJQLUCHQS-ZIAGYGMSSA-N 346.408 3.026 50 40 EGGB CC12CC3C[C@@]([C@H](Cl)C(=O)O)(C1)C[C@@]([C@H](Cl)C(=O)O)(C3)C2 104110373 ZUPVATIOXGRXBN-LIUILVGASA-N 335.227 3.347 50 40 EGGB COC(=O)c1ccc(-c2ccc(/C=N/NC(=O)c3ccco3)o2)cc1 408718727 CBVJJXDXNMWHHL-YBFXNURJSA-N 338.319 3.090 50 40 EGGB Cc1c(C(=O)O)cccc1-c1ccc(/C=C(/C#N)C(=O)NC(C)C)o1 96476441 DFUZXFVLFRPJNA-LCYFTJDESA-N 338.363 3.385 50 40 EGGB C/C(=N/NC(=O)c1cc(-c2ccc(F)cc2)n[nH]1)c1cccc(O)c1 232691 GDCTXZYMMLYRIT-JAIQZWGSSA-N 338.342 3.075 50 40 EGGB CC12CC3(C)CC(C)(C1)CC(C(=O)NNC(=O)c1cccnc1)(C2)C3 5696453 DNXXIWDVNRNZLH-UHFFFAOYSA-N 341.455 3.229 50 40 EGGB CCOC(=O)c1ccc(NC(=O)N(CCCl)CCCl)cc1 1691574 JSLRCSJIFRUZNP-UHFFFAOYSA-N 333.215 3.175 50 40 EGGB C=CCOc1cccc(/C=N/NC(=O)COc2ccc(Cl)cc2)c1 59471534 YECFCQZEMXOWFO-UDWIEESQSA-N 344.798 3.434 50 40 EGGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@@H]2CC=CCC2)c1 24768308 VJUQHTZMLWPUDU-OAHLLOKOSA-N 330.428 3.001 50 40 EGGB O=C(N/N=C/c1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 4505791 KLKAZYCVRAEZNP-DJKKODMXSA-N 337.257 3.378 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(F)cc2)cc1C(=O)O 408769351 RUDDLQKJFWHDLD-WQLSENKSSA-N 340.310 3.078 50 40 EGGB Cc1ccc(/C=N/NC(=O)CSCc2ccccc2)cc1[N+](=O)[O-] 408719919 PYBIWUQJJCRFCP-VCHYOVAHSA-N 343.408 3.287 50 40 EGGB CCOC(=O)NC(=O)/C(C#N)=C\Nc1ccc(Cl)cc1Cl 100911955 MQYTXOBCVAEPIM-FPLPWBNLSA-N 328.155 3.085 50 40 EGGB Cc1ccccc1N1C(=O)CS/C1=C(/C#N)C(=O)Nc1ccccc1 527684 SMCULGFHUVXKNQ-CYVLTUHYSA-N 349.415 3.449 50 40 EGGB Cc1cc(N2CCCC2)ccc1/C=N/NC(=O)c1cccc(F)c1 59147811 HPBZZIFNLDJFLH-FYJGNVAPSA-N 325.387 3.498 50 40 EGGB COc1ccc(CNC(=O)/C(C#N)=C\c2c[nH]c3ccccc23)cc1 408809717 IKIMETKDUTXQBH-GDNBJRDFSA-N 331.375 3.400 50 40 EGGB CCOC(=O)[C@@]1(C#N)C(N)=C(C#N)C2=C(CCC2)[C@H]1c1ccccc1 35193591 JPYJMELVGHVDJM-YLJYHZDGSA-N 333.391 3.074 50 40 EGGB CC(C)NC(=O)/C(C#N)=C\c1cc(Cl)c(OCC#N)c(Cl)c1 408781281 BEKARJTWUJLILS-WZUFQYTHSA-N 338.194 3.327 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/c2ccc(Br)cc2)cc1 260037 IHPOFXTZEGBETO-VCHYOVAHSA-N 347.212 3.287 50 40 EGGB CCc1ccccc1NC(=O)C(=O)N/N=C/c1c(F)cccc1Cl 3080389 HGOLRTAKOSGKPS-KEBDBYFISA-N 347.777 3.130 50 40 EGGB N#CC1=C(Nc2ccccc2Cl)S[C@@H](c2ccncc2)NC1=O 140050 QYZOOZUXCBFMHV-HNNXBMFYSA-N 342.811 3.444 50 40 EGGB COc1ccc(/C=N/NC(=O)c2cc(C)nc3ccccc23)c(OC)c1 254416 ZOJWEGGVFQBITI-CIAFOILYSA-N 349.390 3.324 50 40 EGGB CC(C)(C)OC(=O)[C@]12CC[C@@](CBr)(C(=O)C1)C2(C)C 103707854 IKCSFVXVONKHOK-LSDHHAIUSA-N 331.250 3.489 50 40 EGGB CCCCOc1ccc(/C=N/NC(=O)c2cccnc2)cc1OCC 2759083 XHVSQKRSJGYCCN-FYJGNVAPSA-N 341.411 3.423 50 40 EGGB Cn1/c(=N\NC(=O)c2nccc3ccccc23)sc2ccccc21 104109738 WRMDBBDGJCSIEW-DYTRJAOYSA-N 334.404 3.034 50 40 EGGB O=C(N/N=C\c1ccc(O)cc1)[C@H](c1ccccc1)N1CCCCC1 104083013 LOOMXCCCBNBOIO-SLOMDMAXSA-N 337.423 3.070 50 40 EGGB COc1cc(/C=C(/C#N)c2ccc([N+](=O)[O-])cc2)cc(OC)c1O 33347181 WBTFEAAUHXHXPN-QPEQYQDCSA-N 326.308 3.382 50 40 EGGB COc1ccc(C(=O)NN)cc1COc1ccc(C(C)(C)C)cc1 224177269 GQTATPVRRQNFKR-UHFFFAOYSA-N 328.412 3.175 50 40 EGGB COc1ccccc1/C=N\NC(=O)Cc1ccc(Br)cc1 13595267 KXZYYUJMJNAFCQ-WQRHYEAKSA-N 347.212 3.151 50 40 EGGB Cc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2ccoc2)cc1 499705 IPVHWOSWRVBKFJ-KRWDZBQOSA-N 332.363 3.300 50 40 EGGB O=C(CSCc1cccc(Cl)c1)N/N=C/c1ccccc1O 59473542 GDHNOQBOQHVHLP-GIJQJNRQSA-N 334.828 3.429 50 40 EGGB Cc1cc(/C=N/NC(=O)c2cccnc2)c(C)n1-c1ccccc1F 28217047 PVCIUHNQJKXKBA-WSDLNYQXSA-N 336.370 3.392 50 40 EGGB CCOc1ccc2[nH]c(C(=O)N/N=C/c3ccc(OC)cc3)cc2c1 2323800 UMYPBFSBSUJPAE-UDWIEESQSA-N 337.379 3.339 50 40 EGGB CSc1ccc(Cl)c(C(=O)NNC(=O)c2cccs2)c1 6603066 SYAWPSWQBZETOI-UHFFFAOYSA-N 326.830 3.198 50 40 EGGB Cc1ccc(NC(=O)C(=O)N/N=C/c2ccc(C(C)(C)C)cc2)cc1 4702948 CMKNHEIFIOQBAA-FYJGNVAPSA-N 337.423 3.381 50 40 EGGB CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1N(C(=O)CCl)C1CC1 79392602 GFWXAAPRUTZVMC-CHWSQXEVSA-N 330.856 3.052 50 40 EGGB Brc1ccc2c(c1)C[C@H](CI)O2 85539403 SBYZEICPPQPFLY-MRVPVSSYSA-N 338.970 3.188 50 40 EGGB NNC(=O)/C=C/c1ccc(-c2ccc(Cl)cc2Br)o1 226256374 WJLCENFKKIZYRR-ZZXKWVIFSA-N 341.592 3.366 50 40 EGGB C/C(CC(=O)Nc1ccccc1C#N)=N\NC(=O)c1cccc(C)c1 16349055 KAXRWKZJLVGJSZ-HYARGMPZSA-N 334.379 3.001 50 40 EGGB O=C(COc1cccc(Br)c1)N/N=C/c1cccs1 60639 ACZLVDVQXPCDBR-OVCLIPMQSA-N 339.214 3.040 50 40 EGGB COc1cc(/C=C(/C#N)c2ccccc2F)ccc1OCC(=O)O 107917582 MCRVRHDAIPLLQD-JYRVWZFOSA-N 327.311 3.362 50 40 EGGB CCOc1cccc(NC(=O)/C(C#N)=C\c2ccc([N+](=O)[O-])o2)c1 408745800 PEGFZPGEEAAZPX-FLIBITNWSA-N 327.296 3.132 50 40 EGGB C/C(NCc1cccc(F)c1)=C(\C#N)C(=O)NCCc1ccccc1 4812007 VERKBGJJOKBQIS-CYVLTUHYSA-N 337.398 3.072 50 40 EGGB COc1ccc(C(=O)N/N=C(\C)c2cc(C)ccc2C)c(OC)c1 33628800 XJCYWEABDXARDV-XSFVSMFZSA-N 326.396 3.475 50 40 EGGB Cc1nn(C)cc1/C=N\NC(=O)c1sc2ccccc2c1Cl 13111514 XJHHGVFXENYMIW-IDUWFGFVSA-N 332.816 3.361 50 40 EGGB O=C(Nc1cccc(I)c1)OCCCl 1732322 KLSOIIRDJFJTCU-UHFFFAOYSA-N 325.533 3.079 50 40 EGGB CC(C)CCN1C(=O)/C(=N\NC(=O)Cc2ccccc2)c2ccccc21 17877648 YMRNEIFMTYHGPJ-ATJXCDBQSA-N 349.434 3.142 50 40 EGGB C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)OC(C)(C)C 17398487 PDPJSYLFFRSPNH-MRVPVSSYSA-N 349.214 3.317 50 40 EGGB COc1cc(/C=N\NC(=O)Cc2cccc3ccccc23)ccc1O 36645996 WXPWYIWISXEQIU-BKUYFWCQSA-N 334.375 3.247 50 40 EGGB CCOc1cc(/C=N/NC(=O)Cc2ccccc2)cc(Cl)c1O 562627 AVZRZRIOOGADTK-YBFXNURJSA-N 332.787 3.137 50 40 EGGB CC(C)c1ccc2c(c1)/C(=N\NC(=O)c1ccccc1F)C(=O)N2 6171611 ZLACCRDCWJXKNS-UHFFFAOYSA-N 325.343 3.035 50 40 EGGB Cc1cc(C)cc(OCCCOc2cccc(/C=N/NC(N)=O)c2)c1 4673029 XALANIQASQFWNX-FYJGNVAPSA-N 341.411 3.154 50 40 EGGB Cc1ccc(NCC(=O)N/N=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1 4739461 MZIXJAVZRRUDSM-FGHRRNBQSA-N 338.367 3.131 50 40 EGGB C[C@H](NC(=O)/C(C#N)=C\c1cc(O)ccc1[N+](=O)[O-])c1ccccc1 98056361 DMCKESBFYYRPIS-ZENNRRHLSA-N 337.335 3.085 50 40 EGGB Cc1cc2c(cc1C)CN(CC(=O)N/N=C/c1ccc(Cl)cc1)C2 409204179 CVAWLCZYLWUFSH-ZVBGSRNCSA-N 341.842 3.423 50 40 EGGB CO[C@@](C)(C(=O)Nc1ccc(OCCBr)cc1)C1CC1 225643320 PWWBWQSMXNKJNC-OAHLLOKOSA-N 342.233 3.214 50 40 EGGB COc1ccc(CC(=O)N/N=C(C)/C=C/c2ccco2)cc1OC 5638628 IEJIGDNBEGNDTA-SRQUHQSVSA-N 328.368 3.045 50 40 EGGB O=C(CCSc1ccccc1)N/N=C/c1ccc(C(=O)O)cc1 5604174 BPHITZWUTHOCGH-LDADJPATSA-N 328.393 3.017 50 40 EGGB Cc1cc(C)nc(SCC(=O)N/N=C/C2=CC[C@H]3C[C@H]2C3(C)C)n1 102375227 HPLPZQOBHWAKRR-VEHWSPSYSA-N 344.484 3.280 50 40 EGGB O=C(N/N=C/c1cccc2c1OCCO2)c1cc2ccccc2cc1O 58916029 UZPHGFVFCDNIAF-CIAFOILYSA-N 348.358 3.081 50 40 EGGB C/C(=N/NC(=O)C1CCCC1)c1ccc(NC(=O)C(F)(F)F)cc1 15934167 QXFVQXRFCWCTQE-FBHDLOMBSA-N 341.333 3.218 50 40 EGGB COc1cc(/C=C(\C#N)c2nc3ccccc3[nH]2)c([N+](=O)[O-])cc1O 8777674 SUGMGRKCYZNAKF-IZZDOVSWSA-N 336.307 3.249 50 40 EGGB Cc1cc(/C=N\NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(C)n1C 38202804 WLVPXOSGZSUOHH-NVMNQCDNSA-N 340.339 3.060 50 40 EGGB COc1cc(OC)c(C(=O)CBr)cc1Br 43463498 YXFSZNFZTYAEAZ-UHFFFAOYSA-N 337.995 3.044 50 40 EGGB CCCC[C@@H](C(=O)NN)N1c2cc(OC)ccc2C(C)=CC1(C)C 223228642 VIUDSPQYZMIQHF-INIZCTEOSA-N 331.460 3.246 50 40 EGGB CC(C)COc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1 169880140 VZJZMEDEMZVREY-YBFXNURJSA-N 341.367 3.394 50 40 EGGB CCCOc1ccc(C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)cc1 3089788 VVZDYQIRXHCMCW-LDADJPATSA-N 327.340 3.148 50 40 EGGB N#C/C(=C\c1ccccc1F)c1nc(N)nc(Nc2ccccc2)n1 11296466 VXICNKKPUBGCCE-JLHYYAGUSA-N 332.342 3.401 50 40 EGGB CCOC(=O)/C(C#N)=C\c1ccc(N2CCCCC2)c([N+](=O)[O-])c1 33466749 SSVCGXHHLBSZGL-UVTDQMKNSA-N 329.356 3.055 50 40 EGGB Cc1c(/C=N\NC(=O)c2sc3ccccc3c2Cl)cnn1C 13111508 CCBJTZUSIZXOKG-IDUWFGFVSA-N 332.816 3.361 50 40 EGGB CCn1nc(C)c2c(C(=O)N/N=C/c3ccc(F)s3)cc(C)nc21 252501328 UEDJXMROIDZLOJ-QGMBQPNBSA-N 345.403 3.033 50 40 EGGB COc1cc(OC)cc(C(=O)N/N=C/c2c(F)cccc2Cl)c1 241511 UBWIZIMAHBXECV-DJKKODMXSA-N 336.750 3.260 50 40 EGGB COc1ccc(/C=N/NC(=O)COc2c(C)cc(C)cc2C)cc1 349421 PZJGZSBFTIRUJG-RGVLZGJSSA-N 326.396 3.150 50 40 EGGB COc1ccc(Br)cc1/C=N/NC(=O)c1ccccc1 60061 CSNCTCLYZWDAIS-LICLKQGHSA-N 333.185 3.222 50 40 EGGB CCOc1ccc(/C=N\NC(=O)c2ccc(F)cc2)c(OCC)c1 30803269 BDNITDQNDWNEOG-NDENLUEZSA-N 330.359 3.387 50 40 EGGB O=C(CCCCCNC(=O)c1ccccc1)N/N=C/c1ccccc1 1956248 OVYLEHMYYWAMDO-CJLVFECKSA-N 337.423 3.127 50 40 EGGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1cccc(Cl)c1 3547468 LGOWUPZVPUZAQT-UHFFFAOYSA-N 339.178 3.077 50 40 EGGB N#C/C(=C/n1ccc(=O)[nH]c1=S)C(=O)c1ccc2ccccc2c1 8665290 FWIHLTNOIRCSRX-PTNGSMBKSA-N 333.372 3.306 50 40 EGGB O=C(O)COc1ccc(/C=N/NC(=O)c2ccc3ccccc3c2)cc1 565970 OSLOOIUWVILONQ-CIAFOILYSA-N 348.358 3.067 50 40 EGGB N#CC1=C(N)OC(c2ccccc2)=C(C#N)[C@@H]1c1ccc2c(c1)OCO2 2218240 NKIMFXDEADKZNG-SFHVURJKSA-N 343.342 3.158 50 40 EGGB CC(=O)Oc1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)cc1 408797716 GWYGVMLFIINUFI-PSZAOFEKSA-N 326.396 3.214 50 40 EGGB C#CCn1cc(/C=N/NC(=O)c2ccc(C#N)cc2F)c2ccccc21 408968786 ZCJAPPKDSYYXEE-FSJBWODESA-N 344.349 3.049 50 40 EGGB CCC1=C(C(=O)OC)[C@H](c2c(F)cccc2Cl)C(C#N)=C(N)O1 4652918 SIMSEZFDIJFKPW-LBPRGKRZSA-N 336.750 3.124 50 40 EGGB CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OC)o2)cc1 408794296 HZETVSJDXQEDEA-JLHYYAGUSA-N 340.335 3.011 50 40 EGGB O=C(N/N=C\c1cccnc1)c1cc2cc(Br)ccc2o1 83252630 XHXDYVPXLUWYTH-NVMNQCDNSA-N 344.168 3.354 50 40 EGGB O=C(Cc1ccccc1)N/N=C/c1ccc(-c2ccccc2C(=O)O)o1 562650 GIALSEXALPQGHY-FYJGNVAPSA-N 348.358 3.338 50 40 EGGB N/C(=N\OC(=O)CCl)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 4277451 MUZPHEHZZSTTOO-UHFFFAOYSA-N 348.630 3.127 50 40 EGGB COc1cccc(/C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)c1 529550 FIYZDGPQZAYAOZ-GZTJUZNOSA-N 345.402 3.442 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)Nc2cccc(OC)c2)ccc1O 3317072 ZZLDSEVYEBHDJF-NTEUORMPSA-N 338.363 3.345 50 40 EGGB O=C(N/N=C/C=C/c1ccc(Br)cc1)c1ccncc1 4616868 CCDNSPIMWOCICH-HZSRDGRYSA-N 330.185 3.273 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)CCc2ccccc2)cc1OC 5620834 IGXRPNDXFKTVHR-XSFVSMFZSA-N 326.396 3.177 50 40 EGGB N#CC1=C(Nc2ccccc2Cl)S[C@H](c2ccncc2)NC1=O 140047 QYZOOZUXCBFMHV-OAHLLOKOSA-N 342.811 3.444 50 40 EGGB CC(C)NC(=O)/C(C#N)=C/c1cc(Cl)c(O)c(Br)c1 1410896 OVDBWRLDTPTBOP-YCRREMRBSA-N 343.608 3.240 50 40 EGGB C#CC(CC)(CC)N/C=C(\C#N)S(=O)(=O)c1ccc(Cl)cc1 35167993 PWOQKNMMMATAGP-NTCAYCPXSA-N 336.844 3.260 50 40 EGGB CCOc1ccccc1/C=N/NC(=O)COc1ccc(C)c(C)c1 8182771 DKLSQURBLXIHOP-UDWIEESQSA-N 326.396 3.231 50 40 EGGB C#CCOc1c(Cl)cc(/C=N/NC(=O)c2ccco2)cc1OCC 4545176 WLQBBXYEZVBYHU-YBFXNURJSA-N 346.770 3.108 50 40 EGGB CCc1ccc(OCCCOc2cccc(/C=N/NC(N)=O)c2)cc1 4603462 OBGYWKGTVPANIQ-KGENOOAVSA-N 341.411 3.099 50 40 EGGB COc1ccc(/C(C#N)=C/c2ccc(OCC(=O)O)c(OC)c2)cc1 408581562 IXLIYLJHBYDKBI-OQLLNIDSSA-N 339.347 3.231 50 40 EGGB COc1ccc(/C=C(/C#N)c2nn(-c3ccccc3)c(N)c2C#N)cc1 4596724 BQTLZRSIKJJXGE-PTNGSMBKSA-N 341.374 3.399 50 40 EGGB CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=C\c1ccc(O)cc1O 100215950 NGLFIMPXXLMBQH-ACAGNQJTSA-N 330.347 3.106 50 40 EGGB COc1ccc(CC(=O)N/N=C/c2ccc(Cl)s2)cc1OC 506947 CKGWXHGSTBCCLE-RQZCQDPDSA-N 338.816 3.112 50 40 EGGB C=CCOC(=O)C1=C(C)NC(S)=C(C#N)[C@@H]1c1ccc(OC)cc1 20528833 HJRPHKGUPROXEP-INIZCTEOSA-N 342.420 3.050 50 40 EGGB biogenic,in-vitro COc1cc(C)c([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1C(C)C 5818172 RCTUWCPIXTZDAY-QGZVFWFLSA-N 338.411 3.377 50 40 EGGB CCOc1cc2c(cc1/C=N\NC(=O)c1ccccc1Cl)OCO2 409097609 MTOMLAXNFNNXAP-OCKHKDLRSA-N 346.770 3.231 50 40 EGGB CC(=O)N/N=C/c1ccc(OCc2cccc(C(=O)O)c2)c(Cl)c1 409009339 DKAXHVYCJFJNQX-DJKKODMXSA-N 346.770 3.087 50 40 EGGB Cc1ccccc1NNC(=O)C(O)(c1ccccc1)c1ccccc1 51199 KEBHJBKFRAUBAL-UHFFFAOYSA-N 332.403 3.374 50 40 EGGB CCOP(=S)(OCC)Oc1cc(C)c2c(C)nn(C)c2n1 160891 OBZDSDZDUHLODP-UHFFFAOYSA-N 329.362 3.261 50 40 EGGB O=C(CCCC(=O)N/N=C/[C@@H]1CC=CCC1)N/N=C\[C@H]1CC=CCC1 4962738 GLFGNHUMMQQQNN-WNJLMVIYSA-N 344.459 3.073 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 13847785 ZQHWTLGESSCGDC-YRIIZNAFSA-N 341.367 3.188 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C/c2ccc(OC(C)=O)cc2)cc1 408761059 HCLPOXVEJKFEQM-RVDMUPIBSA-N 336.347 3.166 50 40 EGGB CC(=O)Oc1ccc(/C=N/NC(=O)CCSc2ccccc2)cc1 233780 ZIQKJJNESWJGSU-CPNJWEJPSA-N 342.420 3.244 50 40 EGGB O=C(Cc1ccccc1)Nc1ccc(C(=O)N/N=C/c2ccco2)cc1 6222908 HGVYDQBSIYQNAG-KGENOOAVSA-N 347.374 3.225 50 40 EGGB COc1cc(/C=C(/C#N)c2cccc([N+](=O)[O-])c2)cc([N+](=O)[O-])c1O 6229721 WUJUDTANLFPSOT-XGICHPGQSA-N 341.279 3.281 50 40 EGGB COC(=O)c1ccc(/C=C(\C#N)C(=O)NC2CCCCCC2)cc1 4515064 KZQLJDDKZVTLTF-FOWTUZBSSA-N 326.396 3.219 50 40 EGGB O=C(CNC(=O)c1ccccc1)NN(c1ccccc1)c1ccccc1 72628025 CTFZGSSHUCGJDE-UHFFFAOYSA-N 345.402 3.286 50 40 EGGB O=S(=O)(c1ccc(F)c(C(F)(F)F)c1)N1CCC(Cl)CC1 1261018433 ZYGFXLNJTQSLFM-UHFFFAOYSA-N 345.745 3.236 50 40 EGGB O=C(/C=C/c1ccco1)NNC(=O)C(c1ccccc1)c1ccccc1 70571 UBGODWYTOWMMHS-BUHFOSPRSA-N 346.386 3.272 50 40 EGGB Cc1ccccc1OCC(=O)N/N=C/c1ccc(Br)cc1 260058 UMLJISDAFJOWQP-VCHYOVAHSA-N 347.212 3.287 50 40 EGGB CCOc1ccc(CC(=O)N/N=C/c2cc(Cl)ccc2O)cc1 10475928 UPDAOJYQBJOEGY-YBFXNURJSA-N 332.787 3.137 50 40 EGGB COc1ccccc1OCC(=O)N/N=C/c1ccc(C)c(C)c1C 58927926 UFUDBPQVQFFDFB-RGVLZGJSSA-N 326.396 3.150 50 40 EGGB C[C@H](SCc1ccccc1)C(=O)N/N=C/c1ccc(C(=O)O)cc1 59166056 LTHFUBQSJRPRIA-MDBUFAAASA-N 342.420 3.157 50 40 EGGB Cc1cccc(C)c1OCCCOc1cccc(/C=N/NC(N)=O)c1 4675897 CCXKRWCHSISJGP-FYJGNVAPSA-N 341.411 3.154 50 40 EGGB COc1ccc(/C(C#N)=C/c2cc(Cl)ccc2OCC(N)=O)cc1 408581014 GBEUDZRMEVQEMW-RIYZIHGNSA-N 342.782 3.277 50 40 EGGB COc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1ccc(C)c(C)c1 408878772 AYGXXIZLJIQJHH-RQZCQDPDSA-N 336.391 3.283 50 40 EGGB C/C(=N/NC(=O)CSc1nc2ccccc2o1)c1ccccc1 550920 XBBSWYUUHZXAIX-UNOMPAQXSA-N 325.393 3.460 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)c2ccccc2[N+](=O)[O-])cc1 369726 QSRWYODOBSWATK-LDADJPATSA-N 327.340 3.148 50 40 EGGB COCCCNC(=O)/C(C#N)=C/c1ccc2[nH]c3ccccc3c2c1 408808731 FVHXXTUGVMMWLI-RVDMUPIBSA-N 333.391 3.381 50 40 EGGB O=C(N/N=C(/CC(=O)c1cccs1)C(F)(F)F)c1ccco1 408958409 YPFZQYARICQNKJ-BOPFTXTBSA-N 330.287 3.262 50 40 EGGB CC(C)(C)OC(=O)N(C1CC1)[C@H]1CCCC[C@@H]1NC(=O)CCl 83318756 XHGHBHVVCBCTJG-STQMWFEESA-N 330.856 3.052 50 40 EGGB CCOC(=O)c1sc(NC(=O)/C(C#N)=C/c2ccccc2)nc1C 95663453 VORKYIREDSAHSA-UKTHLTGXSA-N 341.392 3.174 50 40 EGGB CNC(=O)/C(C#N)=C/c1ccc(-c2ccc(Br)cc2)o1 277564 HUZFDDLXUABGNK-DHZHZOJOSA-N 331.169 3.362 50 40 EGGB CCOc1ccc(C(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)cc1 8082246 ULAVUEJQXARCSM-VCHYOVAHSA-N 347.758 3.411 50 40 EGGB COC(=O)c1ccc(/C=N/NC(=O)c2cccc3ccccc23)cc1 5719967 ZFDCEUZSYBGYSU-FYJGNVAPSA-N 332.359 3.390 50 40 EGGB O=C(O)c1ccc(-n2cccc2/C=N/NC(=O)c2cccs2)cc1 559083 ZRQUHXJVMGNBCC-WOJGMQOQSA-N 339.376 3.001 50 40 EGGB COc1ccc([C@H]2NC(N)=C(C#N)C3=C2[C@H](C)CCC3)cc1OC 1652464 GUWTUEWWTLWBKU-ADLMAVQZSA-N 325.412 3.159 50 40 EGGB C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(N(C)C)cc1 20248698 FOZGEOQZJMZULJ-NFECSFHCSA-N 327.453 3.384 50 40 EGGB CCOc1ccc(CC(=O)N/N=C(\C)c2cccc([N+](=O)[O-])c2)cc1 408712028 WHPSJXUGAHYWTI-CPNJWEJPSA-N 341.367 3.076 50 40 EGGB O=C(Cl)[C@H]1CC(=O)N(c2ccc(N3CCCCC3)c(Cl)c2)C1 45958286 RDTCYLSFPHJHIK-NSHDSACASA-N 341.238 3.449 50 40 EGGB C[C@@]12[C@@H]3[C@H]4[C@H]5C[C@@H]([C@H]4[C@H]1Br)[C@@H]2[C@H]5[C@]3(O)c1ccccc1 195528701 SZCGKEUXKLALMI-VXFJSAKCSA-N 331.253 3.416 50 40 EGGB COc1ccc(/C=C(\C#N)S(=O)(=O)c2ccc(C)cc2)c(OC)c1 148239 ARFLPDYVSMVYTN-LICLKQGHSA-N 343.404 3.351 50 40 EGGB N#CC1=C(SCc2ccc(C#N)cc2)NC(=O)C[C@@H]1c1ccco1 3407032 SJLQNUOGTNUGMC-AWEZNQCLSA-N 335.388 3.423 50 40 EGGB C#CCOc1ccc(/C=C(/C#N)C(=O)NC2CCCC2)cc1OCC 409195608 UIQXYCIRFRPPTH-VBKFSLOCSA-N 338.407 3.063 50 40 EGGB N#C/C(=C\c1c[nH]nc1-c1ccccc1)C(=O)NCCc1ccccc1 5729016 PYVOCBQAVMUFBF-QGOAFFKASA-N 342.402 3.343 50 40 EGGB CCN(CC)c1ccc(C(=O)NNC(=O)c2cc(C)cc(C)c2)cc1 15834308 FHRZRSCHNUEPIG-UHFFFAOYSA-N 339.439 3.224 50 40 EGGB O=C(CCl)OCC1(Cc2ccccc2)C(=O)c2ccccc2C1=O 5602885 HVGAYJQCVKIDOP-UHFFFAOYSA-N 342.778 3.077 50 40 EGGB O=C(N/N=C/c1ccc(OC/C=C/Cl)cc1)c1cccc(O)c1 3147901 UQKGUUZXTZRJHJ-ARTIUUFBSA-N 330.771 3.287 50 40 EGGB C/C(=N\NC(=O)c1cc(-c2ccc(C)cc2)n[nH]1)c1ccc(N)cc1 229498 NJFKHAHVAVEWPC-FYJGNVAPSA-N 333.395 3.121 50 40 EGGB CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1ccccc1F 6945732 DQNQTCRJXHHOIE-OQLLNIDSSA-N 340.354 3.196 50 40 EGGB COc1cc(Br)c(C(=O)CBr)cc1OC 3048158 ZAHGDIOJHXXBSB-UHFFFAOYSA-N 337.995 3.044 50 40 EGGB C/C(=N/NC(=O)c1ccc(N2CCCC2=O)cc1)c1cccs1 5282387 UBDZHUVEHGREGP-PDGQHHTCSA-N 327.409 3.029 50 40 EGGB COc1ccc(-c2ccc([C@H]3C(C#N)=C(N)Oc4n[nH]c(C)c43)o2)cc1 9087843 JKTOYRRIZGTMHN-QGZVFWFLSA-N 348.362 3.205 50 40 EGGB O=C(N/N=C\C=C\c1ccco1)c1cc2cc([N+](=O)[O-])ccc2o1 408904958 RBHFQUXMEJRESI-IOULAPPISA-N 325.280 3.363 50 40 EGGB COc1ccc(/C=N/NC(=O)c2c(-c3ccccc3)noc2C)cc1 138017 MIFFUEZGZFISMU-UDWIEESQSA-N 335.363 3.423 50 40 EGGB Cc1nn(-c2ccccc2)c2c1[C@@H](c1ccccc1O)C(C#N)=C(N)O2 546654 BBSSBCBJMNTVKF-SFHVURJKSA-N 344.374 3.105 50 40 EGGB N#CC(C#N)=Cc1ccccc1OCCOc1ccc([N+](=O)[O-])cc1 4182037 HMNXZDNZZCAWFR-UHFFFAOYSA-N 335.319 3.483 50 40 EGGB C/C(=N\OCC(=O)N/N=C/c1c[nH]c2ccccc12)c1ccccc1 5829763 MBVUDLHQZMVCIX-TYTORPJISA-N 334.379 3.059 50 40 EGGB Cn1cc(C(=O)NNC(=O)[C@@H]2CCCc3ccccc32)c2ccccc21 84314276 ACKIDOIPERBBPO-QGZVFWFLSA-N 347.418 3.059 50 40 EGGB Cc1cc(C)n(C(=O)/C(C#N)=C/c2ccc(O)c(Br)c2)n1 408980764 XFLWANIWKIDWLW-WUXMJOGZSA-N 346.184 3.215 50 40 EGGB CO[C@](C)(C(=O)Nc1ccc(OCCBr)cc1)C1CC1 225643351 PWWBWQSMXNKJNC-HNNXBMFYSA-N 342.233 3.214 50 40 EGGB C/C(=N/NC(=O)c1cccs1)c1ccc(NC(=O)C2CC2)cc1 4155437 KWAGFQOVBTUTKZ-ODLFYWEKSA-N 327.409 3.251 50 40 EGGB COc1cccc(/C=N/NC(=O)c2ccccc2-n2cccc2)c1OC 6367638 DOCYZNCDIQPZJJ-KGENOOAVSA-N 349.390 3.258 50 40 EGGB N#CCCn1cc(/C=C(\C#N)C(=O)O)c(-c2cccc(Cl)c2)n1 3393988 OAEUHOCCXNIWDR-KPKJPENVSA-N 326.743 3.109 50 40 EGGB CC(C)Oc1ccccc1/C=N/NC(=O)[C@@H](C)Oc1ccccc1 23410725 WFFUXHJZXROAIH-OOWUWCJESA-N 326.396 3.391 50 40 EGGB O=C(/C=C/c1ccccc1)NNc1nc2ccc([N+](=O)[O-])cc2s1 59417528 OPFAGIJAIALQFA-RMKNXTFCSA-N 340.364 3.361 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C/c2cccs2)c([N+](=O)[O-])c1 408888328 ZETCBMMJWBWHFI-JXMROGBWSA-N 329.337 3.211 50 40 EGGB CCCCC(=O)N/N=C(\C)CC(=O)Nc1cc(Cl)ccc1OC 4691001 QXHSECJBSSPYJW-YBFXNURJSA-N 339.823 3.360 50 40 EGGB N#C/C(=C\c1ccccc1O)c1nn(-c2ccccc2)c(N)c1C#N 408721644 WELZNHPPHCHYEC-GXDHUFHOSA-N 327.347 3.096 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)Nc2cc(OC)ccc2OC)cc1 140235 IEXZMKKVFZCWIK-GXDHUFHOSA-N 338.363 3.258 50 40 EGGB CCOC(=O)/C(C#N)=C/c1ccc(-c2ccccc2C(=O)OC)o1 443908 PAQMXMMJFNSLMY-ZRDIBKRKSA-N 325.320 3.203 50 40 EGGB COc1ccccc1C(=O)N/N=C/c1ccc(Br)cc1 5527563 VVUVWEZYJYFHEV-LICLKQGHSA-N 333.185 3.222 50 40 EGGB N#CS[C@H](CS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1 124751 UTRXMFMXMUDCMV-CQSZACIVSA-N 348.405 3.324 50 40 EGGB N#C/C(=C/c1ccc(Cl)cc1Cl)C(=O)NC[C@H]1CCCO1 16804889 KBTMNDJGNJJXSM-TUOYRWMMSA-N 325.195 3.196 50 40 EGGB O=C(NNC(=O)C1CC1)c1ccccc1OCc1ccc(Cl)cc1 12923975 OFLHFUUVKVTZPK-UHFFFAOYSA-N 344.798 3.090 50 40 EGGB CC[C@@H](C)NC(=O)/C(C#N)=C/c1ccc(-c2ccccc2C(=O)O)o1 408804892 ZWHNRTRGHITLPD-GMCKNXKJSA-N 338.363 3.466 50 40 EGGB CCOc1cc(C(=O)NN)cc(Cl)c1OCc1ccccc1C 216836449 WSRKRXQCGYSIJP-UHFFFAOYSA-N 334.803 3.230 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 486675 ZUTGWNRLOYGBSC-VCHYOVAHSA-N 347.758 3.411 50 40 EGGB Cc1ccc(NCC(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)cc1 7009366 BEJCOUSDAFJXRR-DJKKODMXSA-N 346.774 3.119 50 40 EGGB CCc1ccc2[nH]c(C(=O)N/N=C/c3ccc([N+](=O)[O-])cc3)cc2c1 492428 DHEPRVJEMPMSLC-YBFXNURJSA-N 336.351 3.402 50 40 EGGB COc1ccc(-n2c(C)cc(/C=C(\C#N)C(N)=O)c2C)cc1Cl 409063632 AKBGDOVPVAMOPZ-NTUHNPAUSA-N 329.787 3.148 50 40 EGGB Cc1cccc(NC(=O)N/N=C\c2ccc(O[C@@H](C)C(=O)O)cc2)c1 408850235 IZOCTLKOSSAZJT-JFENUBAZSA-N 341.367 3.003 50 40 EGGB O=S(=O)(c1cc(Cl)cc(Cl)c1)N1CCSSCC1 95454404 SPMBLFURVXNNGE-UHFFFAOYSA-N 344.310 3.379 50 40 EGGB COc1cc(/C=N/NC(=O)c2ccccc2C)cc(Cl)c1OC 6959528 RSOIQHYHOSWWIY-VXLYETTFSA-N 332.787 3.430 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)c2cccc([N+](=O)[O-])c2C)cc1 59447398 PVBMJHRUVLLMKG-LDADJPATSA-N 327.340 3.066 50 40 EGGB CCc1[nH]nc2c1[C@H](c1ccc(OC)c3ccccc13)C(C#N)=C(N)O2 8382691 HUXVNNSODJEMBU-QGZVFWFLSA-N 346.390 3.352 50 40 EGGB CCCCCN(C(=O)CCl)[C@@H](C)c1nc2ccccc2c(=O)[nH]1 4025587 IVJGDDFALSUZPX-LBPRGKRZSA-N 335.835 3.242 50 40 EGGB CCOc1ccc(NCC(=O)N/N=C(\C)c2ccc(OC)cc2)cc1 358224 ZCAQLTGYKZPTKW-KGENOOAVSA-N 341.411 3.046 50 40 EGGB CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=CCCC[C@H]2[C@@H]1c1ccccc1 19855570 OLUGSZUWEAVXBJ-MMOPVJDHSA-N 347.418 3.320 50 40 EGGB N#Cc1cccc([C@H](Br)S(=O)(=O)c2ccccc2)c1 6575506 HTRHSHLIGDKBTK-CQSZACIVSA-N 336.210 3.426 50 40 EGGB Cc1cc2c(c(=O)n1Cc1ccccc1)[C@H](C(C)C)C(C#N)=C(N)O2 2350928 COWKDLCFYIHKQN-QGZVFWFLSA-N 335.407 3.031 50 40 EGGB O=C(CCCc1cccs1)NNC(=O)c1cc2c(s1)CCCC2 14244397 FCFBABATFPHOKV-UHFFFAOYSA-N 348.493 3.472 50 40 EGGB CCOCCCNC(=O)/C(C#N)=C/c1cccc(C(F)(F)F)c1 6536595 BFFQELLMLXUPBZ-UKTHLTGXSA-N 326.318 3.155 50 40 EGGB Cc1ccccc1CSCC(=O)N/N=C/c1ccccc1C(=O)O 20246270 LYRRFFVXXARWJU-VXLYETTFSA-N 342.420 3.077 50 40 EGGB CCC[C@@H](C(=O)OCC)/C(C)=N\NC(=O)COc1ccc(C)c(C)c1 408952950 LBWGUMWGJUCJIJ-MNTXUITRSA-N 348.443 3.154 50 40 EGGB CCc1ccccc1-n1c(=O)c2ccccc2n2c(CCl)nnc12 15424629 RNYNKCJZFFISBA-UHFFFAOYSA-N 338.798 3.335 50 40 EGGB O=C(Cc1cccc2ccccc12)N/N=C\c1ccccc1[N+](=O)[O-] 4982829 CBZZFAQFTCCRJB-MOSHPQCFSA-N 333.347 3.441 50 40 EGGB O=C(/C=C/c1ccccc1)NNC(=O)Cc1cccc2ccccc12 486778 DYLMQFMGHINZAS-BUHFOSPRSA-N 330.387 3.243 50 40 EGGB N#C/C(=C\c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NCc1ccco1 3320495 KWZLJFNOAWGCFT-IZZDOVSWSA-N 331.715 3.065 50 40 EGGB COc1ccc(C(=O)N/N=C/c2c[nH]nc2-c2ccc(C)cc2)cc1 4016536 FYEXFZOZFFQFOF-CIAFOILYSA-N 334.379 3.158 50 40 EGGB CC/C(Cc1ccccc1)=N\NC(=O)Cc1cn2ccsc2n1 6583633 ABBWEDVCANEIBU-XMHGGMMESA-N 326.425 3.063 50 40 EGGB Cc1cccc(OCC(=O)N/N=C\c2cccc(Br)c2)c1 33401512 WRMADYZEFSCVPS-ZDLGFXPLSA-N 347.212 3.287 50 40 EGGB CNC(=O)/C(C#N)=C/c1cn(CCOc2ccccc2)c2ccccc12 348650 ORGLNQAAMUJCOB-DTQAZKPQSA-N 345.402 3.373 50 40 EGGB C[C@H](Sc1ccccc1)C(=O)N/N=C/c1cccc2c1OCCO2 58915770 BQYJIXDPOVEVEZ-HCZVKUGISA-N 342.420 3.089 50 40 EGGB CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)CCl 4219093 LSNFODHIEWKMLR-UHFFFAOYSA-N 336.741 3.120 50 40 EGGB CC(C)(C)OC(=O)N/N=C/c1cc2c(cc1Br)OCO2 184355 LSRKOTGFYABWEM-GIDUJCDVSA-N 343.177 3.036 50 40 EGGB CC1(C)C(=O)[C@]2(Br)CC[C@]1(CC#N)[C@H]2Br 109275393 OJTCQBIJBRMLII-GGVZMXCHSA-N 335.039 3.186 50 40 EGGB CCN(NC(=O)C1CCN(C(=O)C(C)(C)C)CC1)c1ccc(C)cc1 24480408 DIDBDRCERLZKER-UHFFFAOYSA-N 345.487 3.137 50 40 EGGB N#CC1=C(NC(=O)NCCCO)c2ccccc2CC12CCCCC2 27534295 KHLCYSKRGGUGCH-UHFFFAOYSA-N 339.439 3.109 50 40 EGGB O=C(COc1ccccc1)N/N=C/c1ccc2c3c(cccc13)CC2 408831767 PHGXCDIRQXCETE-LPYMAVHISA-N 330.387 3.468 50 40 EGGB CC1(C)COc2ccc(C(=O)N/N=C\c3ccccc3F)cc2OC1 225368282 AAFKPXKZGAIEQA-FBHDLOMBSA-N 342.370 3.387 50 40 EGGB O=C/C(=C\Nc1ccc([N+](=O)[O-])cc1O)c1nc2ccccc2o1 5337151 XVTFHRYSUJABAC-CSKARUKUSA-N 325.280 3.094 50 40 EGGB Cc1cc(C)nc(SCC(=O)NN=C2C3CC4CC(C3)CC2C4)n1 20986322 YVLASHBUZOZGKA-UHFFFAOYSA-N 344.484 3.114 50 40 EGGB COc1cc(/C(C)=N/NC(=O)NC2CCCCC2)cc(OC)c1OC 5445953 JEFCFQLMBUBPEA-UDWIEESQSA-N 349.431 3.068 50 40 EGGB CCOc1ccc2oc(C(=O)N/N=C\c3ccc([N+](=O)[O-])o3)cc2c1 409186637 FVGBGELVKCRSFT-MFOYZWKCSA-N 343.295 3.097 50 40 EGGB CCCC[C@H](C(=O)NN)N1c2c(OC)cccc2C(C)=CC1(C)C 223228958 ITHKWCQMBKWGJE-OAHLLOKOSA-N 331.460 3.246 50 40 EGGB O=C(CSc1ccc(Cl)cc1)N/N=C/c1ccccc1[N+](=O)[O-] 3067241 IUCMXTWGVHNRGK-RQZCQDPDSA-N 349.799 3.491 50 40 EGGB Cc1cccc(NC(=O)C(=O)N/N=C/c2ccc(C(C)(C)C)cc2)c1 6217029 VTIYKPOWZFPDNJ-FYJGNVAPSA-N 337.423 3.381 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@@H]2[C@H]3CCCC[C@]32C)cc1[N+](=O)[O-] 101357672 MSIQBURIIGTNAF-DSCXRQQCSA-N 345.399 3.270 50 40 EGGB O[C@H](COc1cccc2ccccc12)CN(CCCl)CCCl 1565776 URWCLWXLBSIIII-HNNXBMFYSA-N 342.266 3.359 50 40 EGGB C/C(=N/NC(=O)c1ccccc1F)c1ccc(NC(=O)C2CC2)cc1 17071081 PWYQPKYYHWSHFZ-UUYOSTAYSA-N 339.370 3.328 50 40 EGGB Cc1ccc(OCCCOc2cccc(/C=N/NC(N)=O)c2)cc1C 4672840 REUOIMCGYDSYQM-FYJGNVAPSA-N 341.411 3.154 50 40 EGGB O=C(NN[C@H]1c2ccccc2C(=O)N1C1CCCCC1)c1ccccc1 199417606 IHIMAAJZJZDFHF-LJQANCHMSA-N 349.434 3.408 50 40 EGGB C/C=C1\CC[N@+]2(C)CC[C@@]34C(=C(C=O)[C@H]1C[C@H]32)N(C)c1ccccc14 254478511 BAXHNXNALPIROW-OKCDQUQYSA-N 335.471 3.416 50 40 EGGB CCc1ccc(/C=N/NC(=O)Cc2ccc(OC)c(OC)c2)s1 15934502 GLTQUBAFNSSMOH-WOJGMQOQSA-N 332.425 3.021 50 40 EGGB N#C/C(=C\c1cnn(-c2ccccc2)c1)c1nnc2n1CCCCC2 8199159 KQDWZYVLFJDLHX-LFIBNONCSA-N 330.395 3.254 50 40 EGGB O=C(N/N=C\c1ccc(O)c(O)c1)c1ccc(Cl)cc1Cl 96569967 FNKHZHGIVFPXNC-IDUWFGFVSA-N 325.151 3.169 50 40 EGGB Cn1cc(Cl)c(C(=O)N/N=C/c2cccc(Cl)c2Cl)n1 482900 YOGUKYXXKUPNGS-FZSIALSZSA-N 331.590 3.144 50 40 EGGB Cc1nc(Cl)nc(/C(C#N)=C2\Nc3ccccc3N2C)c1[N+](=O)[O-] 4532319 BKDLWLRLYXXQOB-NTEUORMPSA-N 342.746 3.101 50 40 EGGB COc1ccc(OC)c(/C=N/NC(=O)Cc2ccc(C)c(C)c2)c1 107870109 JSISVOUSYBLELE-UDWIEESQSA-N 326.396 3.013 50 40 EGGB C[C@]12CCCC[C@@H]1[C@H]2C(=O)N/N=C/c1ccc(Br)o1 408720636 AWISFTCZTGEBNJ-NGXLKJSHSA-N 325.206 3.319 50 40 EGGB CN(C)c1ccc([C@H]2[C@H]3CCCC=C3C(C#N)=C(N)C2(C#N)C#N)cc1 20123568 GHOSEHVBNZLUNA-HKUYNNGSSA-N 343.434 3.346 50 40 EGGB O=C(N/N=C/c1cccc(OC(=O)c2ccccc2)c1)c1cccnc1 1472560 HLQMKDRGLKVEFK-LPYMAVHISA-N 345.358 3.065 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2cc(-c3cccs3)n[nH]2)cc1 17139055 VOBOOWCOHCYDRS-WOJGMQOQSA-N 340.408 3.301 50 40 EGGB CCCOc1ccccc1/C=N/NC(=O)COc1ccc(F)cc1 3174664 YFNMZFXLCWOJHD-UDWIEESQSA-N 330.359 3.144 50 40 EGGB C#C[C@]1(O)CC[C@@H]2[C@H]3[C@H](C)CC4=CC(=O)CC[C@]4(OO)[C@@H]3CC[C@@]21C 1569999101 RURMXFRHKGLDHX-QAMPPLLHSA-N 344.451 3.351 50 40 EGGB CCOc1ccc([C@H]2C(C#N)=C(N)Nc3oc(C)nc32)c(OCC)c1 125855 MUSYDJAEZUIXMA-HNNXBMFYSA-N 340.383 3.032 50 40 EGGB O=C(/C=C/c1ccc(Cl)cc1)NNC(=O)c1ccc(Cl)cc1 568876 SXPFYRMJGNBAIB-XCVCLJGOSA-N 335.190 3.468 50 40 EGGB Cc1cccc(C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c1 508831 AVGBTKNBHFVLKO-UHFFFAOYSA-N 340.423 3.267 50 40 EGGB COc1ccc2ccccc2c1/C=N\NC(=O)c1ccc2c(c1)OCO2 12463371 CUDLOGFIPKHESD-NHDPSOOVSA-N 348.358 3.341 50 40 EGGB C/C(=N/NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 34880104 FLTINMBELIQZKO-WQRHYEAKSA-N 331.759 3.331 50 40 EGGB CC(C)(C)OC(=O)N(C[C@@H]1CCCCN1C(=O)CCl)C1CC1 79408948 FMGSKADSXSAISE-ZDUSSCGKSA-N 330.856 3.006 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)cc1 7384190 ZLUKAZMHZYGING-RCCKNPSSSA-N 336.439 3.117 50 40 EGGB COc1cc(/C=N/NC(=O)c2ccc(Cl)cc2)ccc1OCC#N 6580948 NTSIIVCPINTSRC-RGVLZGJSSA-N 343.770 3.015 50 40 EGGB C[N+](C)(Cc1ccccc1)C[C@@H](Br)CBr 313499 DHTKGNSLXDMDAE-LBPRGKRZSA-N 336.091 3.421 50 40 EGGB CC(C)c1[nH]nc2c1[C@@H](c1ccc(N3CCCC3)cc1)C(C#N)=C(N)O2 8783465 ZRLWCPUJNUIIMM-INIZCTEOSA-N 349.438 3.351 50 40 EGGB Cc1ccccc1CSCC(=O)N/N=C/c1ccc(N(C)C)cc1 408774513 PBUMHYQERDCDOC-UDWIEESQSA-N 341.480 3.445 50 40 EGGB CCc1cc(Br)c2c(c1)N[C@@]1(C=C(C)OC(N)=C1C#N)O2 40545192 ONYRIIHGILJGMK-HNNXBMFYSA-N 348.200 3.140 50 40 EGGB CCc1ccc(/C(C)=N\NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 5341542 GINJQSCVDVFGMH-UYRXBGFRSA-N 325.368 3.240 50 40 EGGB O=[N+]([O-])c1ccc(CBr)cc1I 2379304 SETQWQQIMOUZRS-UHFFFAOYSA-N 341.930 3.094 50 40 EGGB COC(=O)c1c(NC(=O)/C(C#N)=C/c2ccco2)sc(C)c1C 544032 LLPSDOLTRBVGNJ-YRNVUSSQSA-N 330.365 3.290 50 40 EGGB COc1ccc(/C=C(\C#N)C(N)=O)c(OCc2ccc(Cl)cc2)c1 408867218 JMHIMJDYVXKZQC-RIYZIHGNSA-N 342.782 3.320 50 40 EGGB N#C/C(=C/c1cc(Br)cs1)C(=O)NC1CCCC1 15229295 CFUCTZIDHAZYCA-UITAMQMPSA-N 325.231 3.476 50 40 EGGB Cc1cc(C(=O)N/N=C/c2ccc(C(=O)O)cc2)c2ccccc2n1 40161311 PHWZNBBYYYNNDK-RGVLZGJSSA-N 333.347 3.005 50 40 EGGB COc1cc(Br)cc(/C=N/NC(=O)OC(C)(C)C)c1O 7853283 JEFYSWWTEPWCRT-VIZOYTHASA-N 345.193 3.022 50 40 EGGB O=C(c1ccccc1)[C@@H](Br)S(=O)(=O)c1ccccc1 34286121 XCTHPMPRRKCKCR-AWEZNQCLSA-N 339.210 3.064 50 40 EGGB COC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@@H]2c1ccc(C)cc1 1426960 UWEZYYBKBMYMBP-AWEZNQCLSA-N 340.404 3.370 50 40 EGGB COc1ccccc1S(=O)(=O)Sc1ccccc1[N+](=O)[O-] 1760520 FMOGWUHHZZBNMZ-UHFFFAOYSA-N 325.367 3.084 50 40 EGGB O=C(NNC(=O)c1cccc(Cl)c1)NC12CC3CC(CC(C3)C1)C2 6251124 PLCRJLYMTRRGTI-UHFFFAOYSA-N 347.846 3.253 50 40 EGGB N#C/C(=C/c1ccc(Cl)cc1Cl)C(=O)NC[C@@H]1CCCO1 16804887 KBTMNDJGNJJXSM-GXJZLWQJSA-N 325.195 3.196 50 40 EGGB Cc1n[nH]c(S[C@H](C)C(=O)/C(C#N)=C2/Nc3ccccc3S2)n1 97015996 FFCZGRYCRRZOFY-PQKXBCETSA-N 343.437 3.116 50 40 EGGB O=C(/C=C/c1ccc(Cl)cc1)N/N=C/c1ccc([N+](=O)[O-])cc1 409071380 RAFANUSQOWFAJX-KKJJYVQDSA-N 329.743 3.412 50 40 EGGB CC(C)(C)c1ccc(NC(=O)C(=O)N/N=C/c2cccs2)cc1 408997946 PIKRODKRQAGNQC-WOJGMQOQSA-N 329.425 3.134 50 40 EGGB CCOc1cc(/C=N\NC(=O)Cc2ccc(C)cc2C)ccc1O 216043480 YEOPVHKXODVZKD-NDENLUEZSA-N 326.396 3.101 50 40 EGGB COC(=O)COc1ccc(/C=C(/C#N)c2ccc([N+](=O)[O-])cc2)cc1 33899893 OZCKPYOITJQZCI-GDNBJRDFSA-N 338.319 3.211 50 40 EGGB O=C(Nc1ccc2c(c1)OCO2)[C@H](Br)c1ccccc1 162867 PECMYRCEBXUXOF-CQSZACIVSA-N 334.169 3.490 50 40 EGGB CC(C)=C[C@@H]1[C@@H](C(=O)NNC(=O)c2ccc3ccccc3n2)C1(C)C 31550346 ASSKLIRNSWATTK-PBHICJAKSA-N 337.423 3.234 50 40 EGGB O=C(CCN1CCN(c2ccccc2)CC1)NN=C1CCCCCC1 20756572 WODWGPQHHXYVAC-UHFFFAOYSA-N 342.487 3.025 50 40 EGGB CCCC[C@H](CC)CNC(=O)NNC(=O)c1cn(C)c2ccccc12 29336739 FNJJECQZPLJQSN-AWEZNQCLSA-N 344.459 3.339 50 40 EGGB N#CC(C#N)=Cc1c(Oc2ccc(F)cc2)nc2ccccn2c1=O 2217157 GXJPBKVSRMBHBB-UHFFFAOYSA-N 332.294 3.056 50 40 EGGB CCc1ccc(CC(=O)N/N=C/c2ccc(Br)o2)cc1 409363729 MUSRRCAPVWRSBL-LICLKQGHSA-N 335.201 3.297 50 40 EGGB C/C=C1\CC[N@+]2(C)CC[C@]34C(=C(C=O)[C@H]1C[C@H]32)N(C)c1ccccc14 254478513 BAXHNXNALPIROW-SWTFSYDTSA-N 335.471 3.416 50 40 EGGB CCCn1ncc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c1C 253398383 HDXIMKKNCUETNL-MRXNPFEDSA-N 340.427 3.052 50 40 EGGB COc1cc(/C=N/NC(=O)c2ccc(F)cc2)cc(Cl)c1OC 3572298 MRJPGGDYORJAKP-DJKKODMXSA-N 336.750 3.260 50 40 EGGB Cc1ccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)s1 59333396 RYAVYNSARFVTBR-SSZFMOIBSA-N 337.448 3.312 50 40 EGGB COc1ccc(/C=C(\C#N)C(N)=O)c(OCc2cccc(Cl)c2)c1 408877293 UKCLJAVOLYFEKB-RIYZIHGNSA-N 342.782 3.320 50 40 EGGB CCC[S@](CCCl)=NS(=O)(=O)c1ccc(Cl)cc1 5338868 JOEAYMBHKRDDOR-KRWDZBQOSA-N 328.286 3.479 50 40 EGGB C/C(=N/NC(=O)c1ccoc1C)c1cccc(NC(=O)C2CC2)c1 4646706 HMVBUDJBZGUYAO-JAIQZWGSSA-N 325.368 3.091 50 40 EGGB CCCCNC(=O)/C(C#N)=C/c1cc(Br)ccc1F 6605540 HBGTTYDLSODPKR-YRNVUSSQSA-N 325.181 3.411 50 40 EGGB CCCC(=O)Nc1ccc(Cl)c(NC(=O)CBr)c1 35605205 JVSPTSFRBUGGGJ-UHFFFAOYSA-N 333.613 3.412 50 40 EGGB Clc1ccc(-c2nnc3n2C[C@H](CBr)S3)cc1 109439 NOQFYRPCLHPOMR-VIFPVBQESA-N 330.638 3.468 50 40 EGGB O=C(NCCCl)N1CCn2cccc2[C@H]1c1ccc(F)c(F)c1 4854445 LAHRDCOYDZYPIH-OAHLLOKOSA-N 339.773 3.120 50 40 EGGB Cc1cccc(OCC(=O)N/N=C\c2c(C)n(C)c3ccccc23)c1 4950982 OBZWLCADQGQDTJ-MTJSOVHGSA-N 335.407 3.324 50 40 EGGB COC(=O)CCCOc1ccc(N(CCCl)CCCl)cc1 1558019 DBFRFFOLQXXWJW-UHFFFAOYSA-N 334.243 3.303 50 40 EGGB O=C(NNC(=O)c1ccccc1C(F)(F)F)c1ccccc1Cl 41779272 MGXMJKBIJJCBSI-UHFFFAOYSA-N 342.704 3.434 50 40 EGGB N#C/C(=C/c1cc2c(cc1[N+](=O)[O-])OCCO2)c1nc2ccccc2[nH]1 58185304 GVGZCWHYZSBSBH-GHXNOFRVSA-N 348.318 3.306 50 40 EGGB CCN(C(=O)COC(=O)/C(C#N)=C\c1ccccc1)c1ccccc1 6177368 DFYUSQGGPCBTDC-LGMDPLHJSA-N 334.375 3.190 50 40 EGGB O=C(CC(=O)Nc1cccc(C(F)(F)F)c1)NN=C1CCCC1 408972822 FYDJIGTZIRAAQL-UHFFFAOYSA-N 327.306 3.080 50 40 EGGB O=C(/C=C/c1ccc(Cl)cc1)N/N=C/c1ccc(C(=O)O)cc1 409060436 VDZLUDHMYKDMSC-TYMSIUDLSA-N 328.755 3.202 50 40 EGGB Cc1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)c(C)n1C1CCCC1 409207440 WZSHRKYHGNZEJB-GTENMVSRSA-N 341.455 3.422 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C\c2cccc(OC)c2OC)cc1 214173143 QLIKLSSLWMONEX-KAMYIIQDSA-N 338.363 3.258 50 40 EGGB CCOC(=O)C[C@@H](NC(=O)CCl)c1cc(Cl)cc(Cl)c1 1616032796 ICGRYYDVLLDWDM-LLVKDONJSA-N 338.618 3.343 50 40 EGGB CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)O)cc2)cc1 5872709 OBGVJQQOTAQHAY-RVDMUPIBSA-N 336.347 3.329 50 40 EGGB COc1cc(Cl)c(/C=N/NC(=O)c2ccccc2C)cc1OC 9201386 AJPPDTUKJQOWJM-VXLYETTFSA-N 332.787 3.430 50 40 EGGB O=C(N/N=C/c1ccccc1OCc1ccccc1)c1cccnc1 3097464 KIMXQYHKKVHUCM-HYARGMPZSA-N 331.375 3.425 50 40 EGGB COc1ccc(F)c([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c1 4454725 MVXWYIIUNPMPIT-MRXNPFEDSA-N 342.370 3.285 50 40 EGGB CC(C)Oc1ccc(-c2cc(C(=O)N/N=C/c3ccccn3)[nH]n2)cc1 8920048 LMRBUDVBQPJTQN-CIAFOILYSA-N 349.394 3.023 50 40 EGGB O=C(O)CC/C(=N\NC(=O)c1cc(Cl)ccc1O)c1ccccc1 33530214 MJQPLSJTUDWPBJ-XMHGGMMESA-N 346.770 3.045 50 40 EGGB C/C(=N\NC(=O)COc1ccc(Cl)cc1Cl)c1ccncc1 13958102 HUSAZIPHQOFMKL-VXLYETTFSA-N 338.194 3.308 50 40 EGGB COc1ccccc1C(=O)NNC(=O)c1ccc(C(C)(C)C)cc1 260796 NLEGIKLLQJMCLD-UHFFFAOYSA-N 326.396 3.068 50 40 EGGB CCn1cc(/C=N/NC(=O)Cc2ccc(OC)cc2)c2ccccc21 6948223 DZYGKEUSUAYOFR-FYJGNVAPSA-N 335.407 3.363 50 40 EGGB COc1cccc(/C=N/NC(=O)[C@H](C)Sc2ccccc2)c1O 20248810 BLPXXCUHOADHDB-HWQJWEFDSA-N 330.409 3.032 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@@H](c2ccc(Cl)cc2)[C@@H]2SCC=C12 1260710 CMNLBGZMBLGANO-LSDHHAIUSA-N 338.823 3.249 50 40 EGGB CCOC(=O)/C(C#N)=C/c1ccc(N(C)C)c2c(N(C)C)cccc12 3209715 JPWHYPNOCFPOAO-NTCAYCPXSA-N 337.423 3.442 50 40 EGGB O=C(CNc1ccc(Cl)cc1)N/N=C\c1c[nH]c2ccccc12 55183028 ICKRLTPJGCEWNO-FBHDLOMBSA-N 326.787 3.384 50 40 EGGB O=C(Cc1cccc2ccccc12)N/N=C\c1cccc([N+](=O)[O-])c1 31723614 IKNXAUNSDDFPJB-MOSHPQCFSA-N 333.347 3.441 50 40 EGGB Cc1ccc(/C=N/NC(=O)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] 6216069 ZYIBETFOHKFUJZ-VCHYOVAHSA-N 331.759 3.249 50 40 EGGB N#CC1=C(N)OC(c2ccccc2)=C(C#N)[C@H]1c1ccccc1[N+](=O)[O-] 5460816 LPFCLUAZZCGTGR-QGZVFWFLSA-N 344.330 3.337 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@@H](c2ccccc2[N+](=O)[O-])[C@H]2CCCC=C12 573505 NGPHAOADWCMDAH-SUMWQHHRSA-N 345.362 3.188 50 40 EGGB CC(=O)Nc1ccc(/C=N/NC(=O)c2cc3ccccc3nc2C)cc1 366261 KYTMWZINHYWMET-CIAFOILYSA-N 346.390 3.266 50 40 EGGB Cc1cc(-n2c(C)cc(/C=C(\C#N)C(=O)NC3CCCC3)c2C)no1 21957365 MVPADWJWYZXJAU-MHWRWJLKSA-N 338.411 3.356 50 40 EGGB COc1cc(OC)c(/C=C(/C#N)c2ccc(C(=O)O)cc2)c(OC)c1 408545452 YVYSRBJZVXHFFY-ZSOIEALJSA-N 339.347 3.475 50 40 EGGB CCc1ccc(NC(=O)/C(C#N)=C\c2ccc(O)c([N+](=O)[O-])c2)cc1 36137577 JCQWFQOXDKSALT-ZROIWOOFSA-N 337.335 3.408 50 40 EGGB O=C(N/N=C\c1ccc(Br)s1)C1[C@@H]2CCCC[C@@H]12 100050596 NQPYXXXQMQQTEN-MWGFANAFSA-N 327.247 3.397 50 40 EGGB Cc1ccc(/C=N/NC(=O)CSc2nc3ccccc3o2)s1 549187 UOHHVZRNRQYODV-LZYBPNLTSA-N 331.422 3.440 50 40 EGGB CC(C)(O)C(=O)NN(C(=O)c1ccccc1)c1ccc2ccccc2c1 510210 VDLJNNDLAOOMLZ-UHFFFAOYSA-N 348.402 3.289 50 40 EGGB C/C(=N\NC(=O)c1ccccc1-n1cccc1)c1cc(O)cc(O)c1 13322300 NZULLPKPOKNHOZ-DEDYPNTBSA-N 335.363 3.043 50 40 EGGB N#C/C(=C\c1cc(Cl)ccc1OCc1ccccc1F)C(N)=O 408881851 MKBSFHVUNGTLNN-NTUHNPAUSA-N 330.746 3.450 50 40 EGGB COc1ccc(C(=O)N/N=C(\C)c2ccc(C)c(C)c2)c(OC)c1 33525833 FWRZBRWOPMVPJM-XSFVSMFZSA-N 326.396 3.475 50 40 EGGB CC(=O)Nc1ccc(/C=C(/C#N)C(=O)c2ccc3c(c2)OCO3)cc1 48341767 KAXVGBVOMLEMMS-NVNXTCNLSA-N 334.331 3.164 50 40 EGGB CCn1nc(C)c(/C=N/NC(=O)c2csc3ccccc23)c1C 372592 CIGPDDZLSMKWBV-GIJQJNRQSA-N 326.425 3.498 50 40 EGGB C/C(=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 5288590 FLTINMBELIQZKO-WOJGMQOQSA-N 331.759 3.331 50 40 EGGB C=CCc1cc(/C=N/NC(=O)c2ccc(F)cc2)cc(OCC)c1O 59302374 STAVOPUQTYVNBV-CIAFOILYSA-N 342.370 3.422 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C\c2ccc(N3CCCC3)o2)cc1 59138389 QAXNPSIAKACVCW-OWBHPGMISA-N 337.379 3.434 50 40 EGGB COc1ccccc1C(=O)N/N=C/c1cc(C(C)(C)C)ccc1O 4544148 ZHKQZUNRMOLOHR-UDWIEESQSA-N 326.396 3.462 50 40 EGGB COc1ccc(OC)c(/C=N/NC(=O)CSc2ccc(C)cc2)c1 40961786 IYESEACVVWISNG-YBFXNURJSA-N 344.436 3.255 50 40 EGGB CCOC(=O)/C(C#N)=C\c1cn(CCC#N)nc1-c1ccc(C)cc1 6179680 WFJMPSGEBMQODJ-WJDWOHSUSA-N 334.379 3.242 50 40 EGGB CC1(C)CC(=O)[C@H](C(=O)/C=C/c2ccccc2)C(=O)[C@@H]1Br 104832352 FTZWJPQHMYAASF-IVFUDNFBSA-N 349.224 3.217 50 40 EGGB COc1ccc(CC(=O)N/N=C/c2ccccc2OC(C)C)cc1 4544305 HKHFMJLEZXKOBW-DEDYPNTBSA-N 326.396 3.175 50 40 EGGB C/C(=N\NC(=O)CNc1ccccc1)c1cccc(Br)c1 4711930 RMCYSJUSLQDSCN-XDHOZWIPSA-N 346.228 3.401 50 40 EGGB Cc1ccc(C)c(-n2c(=O)c3ccccc3n3c(CCl)nnc23)c1 408712870 YAZCDFDDKSTHLX-UHFFFAOYSA-N 338.798 3.389 50 40 EGGB Cc1cc(/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c(C)n1C 33304650 GQDMLEHRNMQYID-WQRHYEAKSA-N 346.434 3.389 50 40 EGGB COc1ccc(CC(=O)N/N=C(\C)c2ccc(C)cc2)cc1OC 5750652 YOUAAGVTJGAQKX-XSFVSMFZSA-N 326.396 3.095 50 40 EGGB COc1ccccc1/C=C/C=N\NC(=O)CCn1cnc2ccccc21 5124000 AQVHFSPFCZCWCN-PQHPWZNASA-N 348.406 3.250 50 40 EGGB Cc1cccc(C(=O)NNC(=O)COc2cc(C)c(Cl)c(C)c2)c1 146522 QIGLZODGVVBGEJ-UHFFFAOYSA-N 346.814 3.105 50 40 EGGB CC1(C)C(=O)C(=O)c2cnn(-c3ccccc3)c2[C@H]1Br 3172058 YCCJCHYJLVSDEO-CYBMUJFWSA-N 333.185 3.100 50 40 EGGB COc1cc(/C=N/NC(=O)C23CC4CC(CC(C4)C2)C3)ccc1O 3898771 QQLDUAREXRIMNR-RGVLZGJSSA-N 328.412 3.067 50 40 EGGB O=C(NN[C@@H](C(=O)Nc1ccccc1)c1ccccc1)c1ccccc1 32853648 PFVILBRBGZCRHI-LJQANCHMSA-N 345.402 3.301 50 40 EGGB N#C/C(=C/c1ccccc1)C(=O)N1CCN(c2ccccc2F)CC1 3256464 NAVOTRGVBMJACC-VKAVYKQESA-N 335.382 3.081 50 40 EGGB N#CC1=C(N)Oc2n[nH]c(-c3ccc(F)cc3)c2[C@@H]1c1cccc(O)c1 9353701 HCKBWEZRRBPMDR-OAHLLOKOSA-N 348.337 3.140 50 40 EGGB CCOc1ccccc1/C=N\NC(=O)COc1cccc2cccnc12 409022910 VTTTWHDVKQHGKE-XKZIYDEJSA-N 349.390 3.163 50 40 EGGB CC(C)N(CC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)CCl 79392563 AAWMFDMMGZRMNS-UHFFFAOYSA-N 332.872 3.109 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)c2ccccc2-n2cccc2)cc1 1398786 DDHOEJNPENANJB-RCCKNPSSSA-N 332.407 3.307 50 40 EGGB C/C(=N/NC(=O)c1ccc(C)nc1)c1ccc(Br)s1 12462458 XXYVAHLDLLPVNE-SXGWCWSVSA-N 338.230 3.368 50 40 EGGB C/C(CC(=O)Nc1cccc2ccccc12)=N\NC(=O)c1cccnc1 100527498 XWLMBWBGRNQFQQ-OEAKJJBVSA-N 346.390 3.369 50 40 EGGB CCn1c(NNC(=O)CCC2CCCCC2)nc2ccccc2c1=O 11158094 UQNCXPNCFZOWFO-UHFFFAOYSA-N 342.443 3.220 50 40 EGGB Cn1ncc2c1CCC/C2=N\NC(=O)c1cc2c(s1)CCCCC2 89745414 KFQGWWYWQIYSRE-XSFVSMFZSA-N 342.468 3.221 50 40 EGGB C/C(=N\NC(=O)CSc1nc(C)cc(C)n1)c1ccccc1Cl 36290037 LMZPBSAPSHZGQC-UDWIEESQSA-N 348.859 3.379 50 40 EGGB C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@H]1CC=CCC1 12754999 LYIUQXVDDRKCRI-HOCLYGCPSA-N 338.407 3.111 50 40 EGGB Cc1ccc(-c2ccsc2C(=O)NNC(=O)c2ccco2)cc1 14093544 VSBNERRBGNKXRL-UHFFFAOYSA-N 326.377 3.391 50 40 EGGB ClCCN(CCCl)c1ccc(/C=N/Nc2ncccn2)cc1 1690739 QRHJAHSNTXASJS-UDWIEESQSA-N 338.242 3.207 50 40 EGGB COc1cc(CN(CCCl)CCBr)cc(OC)c1 1713597 ZRIJURLWOQLIGL-UHFFFAOYSA-N 336.657 3.140 50 40 EGGB O=C(NCCc1ccco1)NNc1ccc(OC(F)(F)F)cc1 43474357 MFCKMHAXPHLCCC-UHFFFAOYSA-N 329.278 3.047 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)COc2cccc3ccccc23)cc1 257832 LMZMTMSSQUWBHP-HYARGMPZSA-N 347.418 3.435 50 40 EGGB COc1ccc(CCNC(=O)/C(C#N)=C/c2c[nH]c3ccccc23)cc1 2769318 MOQKLFDXNWMNRH-FOWTUZBSSA-N 345.402 3.442 50 40 EGGB COC(=O)N/N=C/c1ccc(OC(=O)c2ccccc2Cl)cc1 506857 RKACDRUNPONOCM-VCHYOVAHSA-N 332.743 3.249 50 40 EGGB CC(=O)[C@H]1C(=O)N(c2ccccc2)C(N)=C(C#N)[C@@H]1C1CCCCC1 108269200 WZPZOJIMSWGHME-MSOLQXFVSA-N 337.423 3.129 50 40 EGGB COc1ccc(/C=N\NC(=O)c2ccc(C)cc2Cl)cc1OC 33329182 FVXJJHSRLXJHKV-GRSHGNNSSA-N 332.787 3.430 50 40 EGGB CC(C)(C)OC(=O)N1CCCC[C@H]1CN(C(=O)CCl)C1CC1 79392591 SQUZCPJWFPUMOG-ZDUSSCGKSA-N 330.856 3.006 50 40 EGGB CCOC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc(C(=O)O)c2)c1C 4090307 SKVDXKXJMRUVIG-CXUHLZMHSA-N 338.363 3.262 50 40 EGGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccc(SC#N)o1 1276384 HKEDNZVLEHAOSA-CQSZACIVSA-N 341.392 3.304 50 40 EGGB CCOc1ccc(C(=O)NNC(=O)c2cccc(CSC)c2)cc1 8192703 OKQLAXNOTJYQDK-UHFFFAOYSA-N 344.436 3.023 50 40 EGGB COc1ccc([C@H]2NC(=S)NC(C(C)(C)C)=C2C#N)cc1OC 409368063 MKEKEPLZIKGCCC-CQSZACIVSA-N 331.441 3.046 50 40 EGGB Cc1noc(C)c1CC(=O)NN=C(c1ccccc1)c1ccccc1 10130143 PWYMHTXUFPLYHL-UHFFFAOYSA-N 333.391 3.403 50 40 EGGB COc1ccc(C)cc1NC(=O)C(=O)NN=C1CCCCCCC1 4499496 SXYWVTXZEBVXNF-UHFFFAOYSA-N 331.416 3.159 50 40 EGGB Cn1c(/C(C#N)=C\c2ccc(N3CCOCC3)cc2)nc2ccccc21 96663381 RGUHBGOBNZZRLZ-VKAVYKQESA-N 344.418 3.474 50 40 EGGB CCCC[C@H](C(=O)NN)N1c2cc(OC)ccc2[C@@H](C)CC1(C)C 223229924 ZITPAIWPMZMKLV-XJKSGUPXSA-N 333.476 3.336 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2c(F)cccc2Cl)cc1[N+](=O)[O-] 6278606 ZBDWELVZEXHYPZ-QGMBQPNBSA-N 335.722 3.460 50 40 EGGB O=C(N[C@H](Cl)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl 104809112 ADSUBPRLVSEEGW-SFOWXEAESA-N 328.237 3.408 50 40 EGGB C#CCOc1ccc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)cc1 408678388 YBHPTQZGJIBICE-CJLVFECKSA-N 347.418 3.063 50 40 EGGB C#CCOc1cccc(/C=N/NC(=O)Cc2ccc(Cl)cc2)c1 409368674 HFMATZNUZLZTIA-DEDYPNTBSA-N 326.783 3.045 50 40 EGGB CC(=O)N/N=C/c1cc(C)n(-c2ccccc2Br)c1C 566726 VAPLQRSOWWSACG-RQZCQDPDSA-N 334.217 3.327 50 40 EGGB OC[C@@H](Br)C[C@@](F)(Cl)C(F)(F)Br 2530830 ZXCKYRIOJOZVFC-IMJSIDKUSA-N 334.357 3.025 50 40 EGGB Cc1ccccc1N1C(S)=C(C#N)C(=O)N[C@H]1c1cccs1 4116946 WKKFXMPDENJIDJ-CQSZACIVSA-N 327.434 3.357 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2ccccc2OC)cc1OCC 5874138 JIYVARVJJINQTH-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB O=C(COc1ccc(-c2ccccc2)cc1)N/N=C\c1ccncc1 30840560 RJQYVKIQSARHCP-HMAPJEAMSA-N 331.375 3.278 50 40 EGGB COc1ccc(/C=C(\C#N)S(=O)(=O)c2ccccc2)cc1OC 1942891 BNFYLRSUNOSGKV-XNTDXEJSSA-N 329.377 3.042 50 40 EGGB N#C/C(=C\c1c[nH]nc1-c1ccccc1)c1nnc2n1CCCCC2 63276023 SXKSQFJUCMXXPI-RVDMUPIBSA-N 330.395 3.459 50 40 EGGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cc(SCC)oc1C 1421401 SHSJGSMFBFYJJT-HNNXBMFYSA-N 348.424 3.345 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/c2cc(Cl)ccc2O)cc1C 59150 ZFWCIYCEASFDNJ-DJKKODMXSA-N 332.787 3.192 50 40 EGGB N#CC(C#N)=C(N)/C(C#N)=C/c1ccc(OC(=O)c2cccs2)cc1 100634267 RAWJKSMGEWHMNI-MDWZMJQESA-N 346.371 3.134 50 40 EGGB O=C(CSc1ccccc1)N/N=C/c1ccc(Br)o1 409000247 XYYGGGHMZJQHKY-OVCLIPMQSA-N 339.214 3.285 50 40 EGGB Cn1cc([C@@H]2C[C@H]2C(=O)NN=C(c2ccccc2)c2ccccc2)cn1 68410935 RKKCMJFRLGYEEI-RBUKOAKNSA-N 344.418 3.092 50 40 EGGB Cc1cc(C)cc(O[C@H](C)C(=O)N/N=C\c2ccc(N(C)C)cc2)c1 31776128 PBMPMCKIGYVELX-RDPIHGLISA-N 339.439 3.287 50 40 EGGB O=C/C(=C(\Br)I)c1ccccc1 6514004 ZKOMDKWMXRQBGK-HJWRWDBZSA-N 336.954 3.384 50 40 EGGB O=C(CCl)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1 57211600 UVWFRHATMSUKBG-UHFFFAOYSA-N 343.858 3.186 50 40 EGGB in-vitro C/C(=C/C(=O)c1ccc(C)cc1)NNC(=O)c1ccc(N(C)C)cc1 408948739 DNAXCEBDDBBHGA-SQFISAMPSA-N 337.423 3.082 50 40 EGGB C[C@@H](O)C(=O)N/N=C\c1ccc(-c2ccc(Cl)c(Cl)c2)o1 83293723 OBJVOXVMOLZEDK-SOOKCDIPSA-N 327.167 3.084 50 40 EGGB C[C@H](Oc1cccc(Cl)c1)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 137749 LSENQVUCBMQKOM-HPAYWCODSA-N 347.758 3.166 50 40 EGGB C=CCOc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc1 35223719 ILTNGBSCMVBKQM-WJDWOHSUSA-N 348.358 3.495 50 40 EGGB C[C@]1(CI)CSc2sc3ccccc3[n+]21 82322 RCIIGDCYQGZBJI-NSHDSACASA-N 348.254 3.445 50 40 EGGB CC(C)/C(=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 59455963 CHPVNPFPFHCKQP-CZIZESTLSA-N 325.368 3.314 50 40 EGGB CN(C(=O)c1ccc(NC(=O)CBr)cc1)c1ccccc1 35605323 IDXPMUMTQFYFTC-UHFFFAOYSA-N 347.212 3.297 50 40 EGGB CCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)c1C 408542003 IWOHETRUKHCJGU-SXGWCWSVSA-N 337.379 3.369 50 40 EGGB Cc1ccc(C)c(NC(=O)CCC(=O)NN=C(C2CC2)C2CC2)c1 4141378 IKDVYIHKZGOCAB-UHFFFAOYSA-N 327.428 3.314 50 40 EGGB COc1ccc2ccccc2c1[C@@H]1C(C#N)=C(N)Oc2[nH]nc(C)c21 9329964 FKVPDQLJTKKVDJ-QGZVFWFLSA-N 332.363 3.098 50 40 EGGB O=C(N/N=C\C=C\c1ccco1)C(O)(c1ccccc1)c1ccccc1 33843646 PTLZQYOTDOLGLW-VEJJZHSVSA-N 346.386 3.331 50 40 EGGB CC(C)N(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)CCl 79392559 BPLYHMXPIWRCTB-ZDUSSCGKSA-N 332.872 3.109 50 40 EGGB N#C/C(=C/c1ccc(Br)s1)C(=O)NC1CCCC1 255519878 XRNGQGGGEPYEED-CLFYSBASSA-N 325.231 3.476 50 40 EGGB Cc1ccc(/C=N/NC(=O)CSc2nc3ccccc3o2)cc1 549647 JGXZAVWULGIUIY-VCHYOVAHSA-N 325.393 3.379 50 40 EGGB COc1ccccc1/C=N/NC(=O)COc1ccc(Cl)cc1C 259567 KDALDZRKOBJXIE-VXLYETTFSA-N 332.787 3.186 50 40 EGGB in-vitro COc1ccc(C(=O)NNc2nc3ccc(OC)cc3s2)cc1 246147 MWQWYUKMSLGLFF-UHFFFAOYSA-N 329.381 3.070 50 40 EGGB Cc1ccc(/C=N/NC(=O)c2ccccc2N)cc1Br 48486 VFBISEFQUNNVCU-GIJQJNRQSA-N 332.201 3.104 50 40 EGGB CCOC(=O)c1cccc(NC(C#N)=C2C(=O)c3ccccc3C2=O)c1 149273 MCFPGDUPVUCTOY-UHFFFAOYSA-N 346.342 3.132 50 40 EGGB Cc1ccc(N[C@@H](C)C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)c(C)c1 370262 DLTQPKQERBBAGV-YRIIZNAFSA-N 340.383 3.162 50 40 EGGB CCCOc1cccc(/C=N/NC(=O)c2cc(OC)cc(OC)c2)c1 8811113 UROHBQDETCLFFK-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB C/C(=N\NC(=O)CNc1ccccc1)c1ccccc1OC(F)F 6297620 ADPARKVWENXXFD-CIAFOILYSA-N 333.338 3.240 50 40 EGGB Cc1cc(C)nc(NNC(=O)c2ccccc2C(=O)c2ccccc2)n1 14514886 ORANKGXQUYSDTO-UHFFFAOYSA-N 346.390 3.081 50 40 EGGB C/C(=N\NC(=O)Cc1ccc2c(c1)OCCO2)c1ccc(C)cc1C 409366817 YUPJHEMHYRLPCC-RCCKNPSSSA-N 338.407 3.158 50 40 EGGB Cc1ccc(NC(=O)/C(C#N)=C\c2ccc(N3CCOCC3)cc2)cc1 33328156 OOAFYMQXYWVYAB-JXAWBTAJSA-N 347.418 3.377 50 40 EGGB C[C@@H](Br)C(=O)NC[C@@H](OCC1CC1)c1ccccc1F 95097947 GQXCQUKGJJGJFG-QMTHXVAHSA-N 344.224 3.193 50 40 EGGB CCCn1c(C)cc(/C=C(\C#N)C(=O)N2C[C@@H](C)OC(C)(C)C2)c1C 96298083 RJMCMBROSGWHQU-BFERYNQYSA-N 343.471 3.448 50 40 EGGB O=C(N/N=C(/c1ccccc1)c1ccncc1)c1ccc([N+](=O)[O-])cc1 334176 QYVALBGCSDBEIP-UZYVYHOESA-N 346.346 3.172 50 40 EGGB O=C(CCBr)CCCCC(=O)CCBr 2296236 KRHOPRMAYAMROF-UHFFFAOYSA-N 328.044 3.255 50 40 EGGB CC(C)(C)[C@H]1CCc2c(sc(NC(=O)CCl)c2C(N)=O)C1 2379743 FZKXCISDXTZGHZ-QMMMGPOBSA-N 328.865 3.175 50 40 EGGB COc1cccc(-c2cc(C(=O)N/N=C/c3ccc(C)cc3)[nH]n2)c1 9089520 RKCPJCNHKQHAAG-UDWIEESQSA-N 334.379 3.158 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2F)c(OC)c1 7156486 NDRQBNOOSSPSGG-UKTHLTGXSA-N 326.327 3.389 50 40 EGGB Cc1cc(C)nc(NNC(=O)CCCc2nc3ccccc3s2)n1 11334117 BXBHHFLOOQBVGN-UHFFFAOYSA-N 341.440 3.169 50 40 EGGB C/C(CC(=O)Nc1ccccc1Cl)=N\NC(=O)Cc1cccs1 101157985 IVQWRSJXXICDGZ-YBFXNURJSA-N 349.843 3.465 50 40 EGGB C/C(=N\NC(=O)CSCc1ccc([N+](=O)[O-])cc1)c1cccs1 12362356 JKPQAIHTCCLQKA-LFIBNONCSA-N 349.437 3.430 50 40 EGGB C/C(CCc1ccccc1)=N/NC(=O)C(=O)Nc1ccc(Cl)cc1 59515737 PYTMPHAFTOPMFR-BKUYFWCQSA-N 343.814 3.403 50 40 EGGB C=C1CC(C(=O)N/N=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 408974437 ZWTPGSTWDZVDIM-VCHYOVAHSA-N 325.324 3.271 50 40 EGGB C=CCN1C(=O)/C(=C(\C#N)C(=O)Nc2ccc(C)cc2)c2ccccc21 409390925 WIWVDEWBYBMORD-HTXNQAPBSA-N 343.386 3.444 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)c(F)c1 408967598 RECBXNDTPFJIPC-UFWORHAWSA-N 346.705 3.023 50 40 EGGB O=C1c2ccccc2C(=O)c2c(NC(=O)[C@H](Cl)CCl)cccc21 5934731 NMNHTHKXGSVAQT-GFCCVEGCSA-N 348.185 3.247 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@H]1c1ccccc1F 140821 STXWLFRYUMGSKK-ZDUSSCGKSA-N 338.367 3.495 50 40 EGGB N#C/C(=C\c1ccc(O)c(Br)c1)C(=O)NC1CCCC1 14178527 XJIWRJOSSPPENP-YRNVUSSQSA-N 335.201 3.120 50 40 EGGB CCOc1cc(/C=N\NC(=O)Cc2ccc(C)cc2)cc(Cl)c1O 409362763 STEDXQSKYCFSMO-JAIQZWGSSA-N 346.814 3.446 50 40 EGGB CCOc1ccc(/C=N/NC(=O)CNc2ccccc2)cc1OCC 65997179 IZBSZQOUCLFGGA-FYJGNVAPSA-N 341.411 3.046 50 40 EGGB O=C(N/N=C/c1ccc(O)c([N+](=O)[O-])c1)c1cccc2ccccc12 36184123 OWLPCXNLMLDBCT-YBFXNURJSA-N 335.319 3.218 50 40 EGGB O=C(N/N=C/c1ccc(O)c([N+](=O)[O-])c1)c1ccc2ccccc2c1 42645484 SYVYYYJEHARZBE-YBFXNURJSA-N 335.319 3.218 50 40 EGGB CC(=O)NNc1nc(C)c(C(=O)/C=C/C=C\c2ccccc2)s1 17216001 TTZULNFOELAVHR-NAKBGQTNSA-N 327.409 3.367 50 40 EGGB COc1cccc(NC(=O)C(=O)NN=C2CCC(C(C)(C)C)CC2)c1 59435599 QAWGMXDCHJDTQD-UHFFFAOYSA-N 345.443 3.342 50 40 EGGB COc1cccc(OCCCOc2ccccc2/C=N/NC(C)=O)c1 4545180 BUSCVZKFGMYCEQ-XSFVSMFZSA-N 342.395 3.013 50 40 EGGB NNC(=O)CCc1ccc(-c2ccc(Cl)cc2Br)o1 216924978 UXULEDUUCRSXIR-UHFFFAOYSA-N 343.608 3.285 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)cc1 58811 GITYJFSBRCUIRZ-GIJQJNRQSA-N 347.758 3.086 50 40 EGGB Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1ccsc1 12689533 VHBFGFXTZNLQON-UHFFFAOYSA-N 343.433 3.255 50 40 EGGB O=C(CSc1cc(Cl)ccc1Cl)NN=C1CCOCC1 70037823 GFRXQOFPHKCAGZ-UHFFFAOYSA-N 333.240 3.368 50 40 EGGB O=C(N/N=C/c1cc2c(cc1Cl)OCO2)c1ccccc1Cl 408589064 KNDSPHBEMNPZIO-CNHKJKLMSA-N 337.162 3.486 50 40 EGGB C/C(CC(=O)Nc1ccc(Cl)cc1C)=N\NC(=O)c1ccccn1 5379217 KKCONMIHOBVVGE-CIAFOILYSA-N 344.802 3.178 50 40 EGGB Cc1ccc2[nH]c(C(=O)NNC(=O)c3cn(C)c4ccccc34)cc2c1 29563876 MEHZDQFQTABNEW-UHFFFAOYSA-N 346.390 3.043 50 40 EGGB COc1cccc([C@H]2C(C#N)=C(N)N3C(=C2C#N)Nc2ccccc23)c1 494323 BOSOPCOGHIDIQR-SFHVURJKSA-N 341.374 3.154 50 40 EGGB COc1ccc(C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)cc1 69769483 ADNGWJSJEZNQDJ-UHFFFAOYSA-N 344.758 3.156 50 40 EGGB Cc1ccc(SCCC(=O)N/N=C/c2ccccc2C(=O)O)cc1 409141137 GZTZMOCOBWSNKQ-XDHOZWIPSA-N 342.420 3.326 50 40 EGGB C[C@]12C(=O)[C@@H](C(c3ccccc3)=C1c1ccccc1)[C@H]1C(=O)OC(=O)[C@H]12 104121297 HRWFTDUSOZZENY-UTAOTPEMSA-N 344.366 3.132 50 40 EGGB COc1ccccc1/C=N/NC(=O)COc1cc(C)c(Cl)c(C)c1 587231 XXNGLXBGZILQAI-KEBDBYFISA-N 346.814 3.495 50 40 EGGB Cc1cc(C)nc(SCC(=O)N/N=C/C2=CC[C@H]3C[C@@H]2C3(C)C)n1 20986462 HPLPZQOBHWAKRR-MLUPEHFWSA-N 344.484 3.280 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)C(=O)N[C@H](C)c2ccccc2)cc1 59386596 PFBKOZGBRSHQSJ-NWGMWSOJSA-N 337.423 3.138 50 40 EGGB O=C(Cn1c(C(F)(F)F)nc2ccccc21)N/N=C1/C[C@@H]2C=CC[C@@H]12 22287026 JRAAYNSTYLQGLF-YMFKCCLZSA-N 348.328 3.123 50 40 EGGB C#CCOc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2)cc1OC 409191741 MCFNERYOGQSGEA-UDWIEESQSA-N 342.782 3.125 50 40 EGGB COc1ccccc1NC(=O)COc1ccc(C=C(C#N)C#N)cc1 409007254 NGJMVMKXEAOWBY-UHFFFAOYSA-N 333.347 3.143 50 40 EGGB N#CCC(=O)N/N=C/c1ccc(-c2ccc(Br)cc2)o1 220915 AEAUIVUMQZTNOD-RQZCQDPDSA-N 332.157 3.073 50 40 EGGB N#Cc1ccc(OS(=O)(=O)c2ccc(C(Cl)Cl)o2)cc1 2148256 CRLFOLGUIVJMMG-UHFFFAOYSA-N 332.164 3.395 50 40 EGGB CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cccc(O)c2)cc1 7164931 XOBHEJPOKHCCJP-XNTDXEJSSA-N 336.347 3.115 50 40 EGGB Cc1noc(C)c1/C=C/C(=O)NNc1c(F)c(F)c(F)c(F)c1F 7980537 RCYVWBMRJNJKCM-ONEGZZNKSA-N 347.243 3.143 50 40 EGGB CC(=O)Oc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccccc2)cc1 408720210 VWDAHARETZLFSO-HCZVKUGISA-N 342.420 3.243 50 40 EGGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1cc2ccccc2o1 3547467 WKSCCQAVCBWWSC-UHFFFAOYSA-N 344.754 3.170 50 40 EGGB COc1cc(Cl)c(/C=N/NC(=O)c2ccc(C)cc2)cc1OC 66202155 USZJOBXGEHEPHR-VXLYETTFSA-N 332.787 3.430 50 40 EGGB Cc1cccc(C(=O)N/N=C\c2cccn2-c2ccc([N+](=O)[O-])cc2)c1 32107172 KSLRZOJEJSSTSW-MOSHPQCFSA-N 348.362 3.458 50 40 EGGB CCOC(=O)/C(C#N)=C1\C[C@@H](C)CC[C@H]1C(SC)=C(C#N)C#N 59662401 AEWZDTPSKXPNPT-NZSQWWTLSA-N 329.425 3.470 50 40 EGGB O=C(NNC(=O)c1ccccc1Nc1ccccc1)c1ccccc1O 12740583 NERGOAFMRDHDOF-UHFFFAOYSA-N 347.374 3.211 50 40 EGGB COc1cccc(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)c1O 20248807 BLPXXCUHOADHDB-MBNTZHJCSA-N 330.409 3.032 50 40 EGGB O=C(NNC(=O)c1cccc(O)c1)Nc1ccc(Cl)c(Cl)c1 8726242 YYXGLGXFOVAZRT-UHFFFAOYSA-N 340.166 3.166 50 40 EGGB Cc1cc(C)cc(NC(=O)C(=O)N/N=C/c2ccccc2Cl)c1 408974081 WYHOXJOAEJWFEA-VXLYETTFSA-N 329.787 3.046 50 40 EGGB Cc1ccc(NC(=O)/C(C#N)=C/c2ccc(O)c([N+](=O)[O-])c2)c(C)c1 36153464 FJCTURFOOXVAIU-RIYZIHGNSA-N 337.335 3.463 50 40 EGGB C#C[C@]1(O)CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(OO)[C@H]3CC[C@@]21C 256461453 UOTMWSQOLMXLKR-DWIKVQACSA-N 330.424 3.105 50 40 EGGB CCc1cccc2c(C=C(C#N)C#N)cn(CC(=O)N3CCCC3)c12 798077 GTOHIUWMGZMLPT-UHFFFAOYSA-N 332.407 3.257 50 40 EGGB O=C(Oc1ccc2ccc(=O)oc2c1)N(CCCl)CCCl 1768245 TUCDUWZVPCYWFQ-UHFFFAOYSA-N 330.167 3.071 50 40 EGGB N#C/C(=C\c1cnn(Cc2ccccc2)c1)c1nnc2n1CCCCC2 8944822 LYMZAGKHIFSBIO-WOJGMQOQSA-N 344.422 3.313 50 40 EGGB CCN1C(=O)/C(=C(\C#N)C(=O)Nc2ccc(C)cc2)c2ccccc21 409149920 VOXVOOTXYHLLHA-FBMGVBCBSA-N 331.375 3.277 50 40 EGGB C[C@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1ccccc1O 131756 VCSQOUNCWPRSJU-HADWXUJASA-N 333.391 3.496 50 40 EGGB O=C(NNC(=S)Nc1ccc(C(F)(F)F)cc1)c1cccs1 17071978 VAEYIMVOBBXECC-UHFFFAOYSA-N 345.371 3.398 50 40 EGGB COc1ccc(CCCC(=O)N/N=C/c2ccc(C)c(OC)c2)cc1 62331 GDWCJCRUKFRAHN-KGENOOAVSA-N 340.423 3.485 50 40 EGGB O=C(COc1ccc(Br)cc1)N/N=C/c1cccs1 491797 RTOBMUYRNINLBN-OVCLIPMQSA-N 339.214 3.040 50 40 EGGB Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)C3CCC3)cc2)cc1 23416700 OIWCMCQTHIQNKA-UHFFFAOYSA-N 344.436 3.071 50 40 EGGB C[C@H]1CCc2sc(C(=O)N/N=C/c3ccccc3C(=O)O)cc2C1 3554635 DOOHMPLQKPBTSZ-VSMYLPJWSA-N 342.420 3.335 50 40 EGGB Cc1ccc(NCC(=O)N/N=C/c2cccc(Br)c2)cc1 58855 NBXRQLGGGUMUHM-VXLYETTFSA-N 346.228 3.320 50 40 EGGB O=C(CBr)c1ccc(I)cc1F 115940309 AHJGRQGYQCPHPH-UHFFFAOYSA-N 342.933 3.008 50 40 EGGB N#CC1=C(N)N=C(S)[C@H](C(=O)Nc2ccccc2)C12CCCCC2 102413747 BTDQFLSOHQCDOH-AWEZNQCLSA-N 340.452 3.228 50 40 EGGB O=C(N/N=C/c1cc([N+](=O)[O-])c(Cl)cc1Cl)c1ccco1 409203145 VLIIKCVGCYIUNH-GIDUJCDVSA-N 328.111 3.259 50 40 EGGB CC(C)(C)OC(=O)N1CCCC[C@@H]1CN(C(=O)CCl)C1CC1 79392590 SQUZCPJWFPUMOG-CYBMUJFWSA-N 330.856 3.006 50 40 EGGB Brc1ccc2c(c1)C[C@@H](CI)O2 85539405 SBYZEICPPQPFLY-QMMMGPOBSA-N 338.970 3.188 50 40 EGGB COc1ccc(C(C)=NNC(=O)c2cccc(Cn3cccn3)c2)cc1 245238387 MOEXPLUTSZVCJG-UHFFFAOYSA-N 348.406 3.094 50 40 EGGB N#C/C(=C\c1cccc(Cl)c1Cl)C(=O)NC[C@@H]1CCCO1 4211313 QOEPMWFQTMPWII-VNKGSWCUSA-N 325.195 3.196 50 40 EGGB N#CC1=C(N)OC2=C(C(=O)CCC2)[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 58721 AJDZWYZDSZIHKL-AWEZNQCLSA-N 345.742 3.063 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@H]1c1ccc(F)cc1 90722 AQQNRCVQGZMFBK-ZDUSSCGKSA-N 338.367 3.495 50 40 EGGB COc1ccc(OC)c2sc(NNC(=O)c3ccc(F)cc3)nc12 251238 AITFVCSLUYHJIK-UHFFFAOYSA-N 347.371 3.210 50 40 EGGB N#CC1=C(N)N2C(=C(C#N)C13CCCCC3)S[C@@H]1CCCC[C@]12O 2620811 DSKJGGWWLWYRDX-KDOFPFPSSA-N 342.468 3.060 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccc2)cc1OC 1450850 UKNIMRUVDVOUHD-MPMPPSQCSA-N 336.391 3.488 50 40 EGGB O=c1c2ccccc2n2c(CCl)nnc2n1-c1ccccc1Cl 408712596 AANQWGKJCAMUKV-UHFFFAOYSA-N 345.189 3.426 50 40 EGGB COc1ccc(C)cc1NC(=O)C/C(C)=N/NC(=O)OC(C)(C)C 4600477 RPVFUSOKSGNOIS-XDHOZWIPSA-N 335.404 3.233 50 40 EGGB C=C(C)CSC1=C(C#N)[C@H](c2ccc3c(c2)OCO3)CC(=O)N1 9110940 QHJUTGWSZREWIP-LBPRGKRZSA-N 328.393 3.063 50 40 EGGB COc1ccc2ccccc2c1[S@@](=O)S(=O)(=O)c1ccccc1 71789056 JLLCOTGFJHYPRE-JOCHJYFZSA-N 346.429 3.345 50 40 EGGB CCOc1cc(/C=N/NC(=O)Cc2ccc(C)cc2)ccc1OC 512094 XFWIMUUDPVFWOL-DEDYPNTBSA-N 326.396 3.095 50 40 EGGB CCOc1ccccc1/C=N/NC(=O)c1ccc(Br)o1 482747 MZBWPSRXPFWPJQ-CXUHLZMHSA-N 337.173 3.205 50 40 EGGB CCc1ccccc1NC(=O)C/C(C)=N\NC(=O)c1cccc(O)c1 100034976 XTSOTAWCSOEQSF-BKUYFWCQSA-N 339.395 3.089 50 40 EGGB COc1ccc(O)c(/C=N/NC(=O)c2ccc(C(C)(C)C)cc2)c1 6597610 ZWUNVRHAKQEIRB-UDWIEESQSA-N 326.396 3.462 50 40 EGGB O=C(N/N=C/c1cc(Cl)c2cccnc2c1O)c1ccccc1 59459094 FHNSOLKSQQCFJT-KEBDBYFISA-N 325.755 3.358 50 40 EGGB CCCCOc1ccc(/C=C(\C#N)C(=O)NCc2cccnc2)cc1 27018398 BRPGJJDLRXIJLW-LDADJPATSA-N 335.407 3.484 50 40 EGGB O=C(C(Cl)Cl)N1Cc2cc3c(cc2[C@@H]2CC=CC[C@@H]21)OCO3 1711681 VQGNJGNSKWRJHO-JQWIXIFHSA-N 340.206 3.363 50 40 EGGB Cc1ccc(-n2nc(C)c(/C=N/NC(=O)c3ccco3)c2Cl)cc1 2745651 GIRLLTPDMSZKAL-VXLYETTFSA-N 342.786 3.499 50 40 EGGB N#C/C(=C\c1cc2c(cc1Cl)OCO2)C(=O)NCc1ccccc1 17071310 GKVAUABHKOJYBT-MKMNVTDBSA-N 340.766 3.292 50 40 EGGB C[C@@H](SCc1ccccc1)C(=O)N/N=C/c1ccccc1C(=O)O 20246301 VVQOEHQROGRULL-OTGIAGGSSA-N 342.420 3.157 50 40 EGGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1cccc(C(F)(F)F)c1 408966320 ZPPIQRYUJVCNRZ-DJKKODMXSA-N 337.257 3.378 50 40 EGGB COc1cc2c(cc1/C=N/NC(=O)[C@H](C#N)c1ccccc1)CCCC2 409196714 WILKDTAFKQZMII-IXOWOOARSA-N 347.418 3.331 50 40 EGGB COc1ccc(Br)cc1/C=N\NC(=O)c1ccccc1 33843594 CSNCTCLYZWDAIS-YVLHZVERSA-N 333.185 3.222 50 40 EGGB COc1cccc(-c2nnc(SCCCCl)n2C)c1[N+](=O)[O-] 228926089 FJCMRYHIOXQNHX-UHFFFAOYSA-N 342.808 3.120 50 40 EGGB COc1cc(/C=C(\C#N)c2nnc(-c3ccccc3)n2C)ccc1O 96133883 OFOVHGGYOCMXNI-XNTDXEJSSA-N 332.363 3.260 50 40 EGGB COc1cccc(/C=N/NC(=O)[C@H](C)SCc2ccccc2)c1 313906 YYXOZMDPKGEQBV-BXUJETTOSA-N 328.437 3.467 50 40 EGGB CC(C)COc1ccc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 169879831 XVESLIDHMXELKM-YBFXNURJSA-N 341.367 3.394 50 40 EGGB CC(C)c1cc(C(=O)NNC(=S)N[C@H]2C[C@H]3CC[C@H]2C3)cs1 102603417 WOLDFDYREUJZAJ-GVXVVHGQSA-N 337.514 3.169 50 40 EGGB COc1ccc(C(=O)NNC(=O)/C=C/c2cccc3ccccc23)cc1 587252 VXATVCRWBONPDJ-SDNWHVSQSA-N 346.386 3.323 50 40 EGGB Cc1cccn2c(=O)c(C=C(C#N)C#N)c(Oc3ccccc3F)nc12 5562571 PISATVIVMKGBND-UHFFFAOYSA-N 346.321 3.365 50 40 EGGB C=C1CC(C(=O)N/N=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 408729835 JMFSFNPDVVVXBX-VCHYOVAHSA-N 325.324 3.271 50 40 EGGB COC(=O)c1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)cc1 15226190 ADPIUNYBXALQCA-GBXVVTRASA-N 326.396 3.075 50 40 EGGB Cn1c(SCC(=O)NN=C2CCCCC2)nnc1-c1ccccc1 139158 PFEBTMBLBYJIHP-UHFFFAOYSA-N 343.456 3.011 50 40 EGGB O=C(N/N=C1/CCCc2nc(-c3ccccc3)sc21)[C@H]1CCCO1 57783484 OWTOGXKGOIKUGX-KWPCUBQOSA-N 341.436 3.146 50 40 EGGB CCCCNC(=O)[C@]12CC[C@](C)(C(=O)[C@@H]1Br)C2(C)C 4185853 LFKFOZVBTANXNZ-VQISRLSMSA-N 330.266 3.062 50 40 EGGB CCCOc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2)cc1 6265019 APCFKDBYZJNSCQ-UHFFFAOYSA-N 332.787 3.204 50 40 EGGB COc1cccc(C(=O)NNc2cccc(C(F)(F)F)c2)c1OC 57351611 MVGWMRUCHYNHML-UHFFFAOYSA-N 340.301 3.480 50 40 EGGB N#C/C(=C\c1ccc(OCc2ccc(F)cc2)c(Cl)c1)C(N)=O 408877357 VHWSFAJOUXAXPK-NTUHNPAUSA-N 330.746 3.450 50 40 EGGB Cc1cc(C)c(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])c(C)c1 33664280 YXZQCNLGDRFHPE-ODLFYWEKSA-N 325.368 3.213 50 40 EGGB O=C(N/N=C/[C@@]1(c2ccccc2)CC1(Cl)Cl)c1ccncc1 547873 RDXHINJFDIFCKG-PZUDMAOCSA-N 334.206 3.313 50 40 EGGB O=C(O)/C=C\[PH](c1ccccc1)(c1ccccc1)c1ccccc1 104086693 WDXCQTGETMJXKF-MSUUIHNZSA-N 334.355 3.311 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)OC(C)C)cc(Br)c1O 5118815 PGEHNSOQXOGUJN-ONNFQVAWSA-N 340.173 3.022 50 40 EGGB O=C(N/N=C/c1ccc(O)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 6225275 IGOKEBOZICTJMT-RQZCQDPDSA-N 341.348 3.279 50 40 EGGB O=C(N/N=C/C=C/c1ccccc1)C(=O)Nc1cccc(Cl)c1 2100964 DXWHAMFVQCCJOE-CEGJKDKLSA-N 327.771 3.094 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)CSc2ccccc2)o1 409000976 ZJTNAOYDZUOSAC-LDADJPATSA-N 331.441 3.368 50 40 EGGB C/C(CC(=O)N[C@@H](C)c1ccccc1)=N\NC(=O)Cc1cccs1 4523558 IZYSLNRHZXOVAN-ZXOFLVKFSA-N 343.452 3.050 50 40 EGGB O=C(COc1cccc2cccnc12)N/N=C\C=C\c1ccccc1 409016257 FUGFUWNCJWUDCZ-GUWYOKDBSA-N 331.375 3.429 50 40 EGGB COc1ccc(CC(=O)N/N=C\c2ccc(SC)cc2)cc1OC 36144882 WPRKRCWRWJNVRP-UNOMPAQXSA-N 344.436 3.119 50 40 EGGB C/C(=N\NC(=O)Cc1ccc(F)cc1)c1ccc(-n2ccnc2)cc1 8046415 YIXOXZAZKNXZDN-HYARGMPZSA-N 336.370 3.094 50 40 EGGB CC(C)(CCl)C(=O)OCC(=O)c1ccc(Br)cc1 3358819 PTSSLWODEMEDGZ-UHFFFAOYSA-N 333.609 3.440 50 40 EGGB CSc1ccc(C(=O)Oc2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] 6153302 PHTXOIYRNSQISM-UHFFFAOYSA-N 334.309 3.444 50 40 EGGB C/C(=N/NC(=O)c1ccccc1)c1ccc(NC(=O)C(F)(F)F)cc1 370937 OOZPCQHLDBMIFY-JJFYIABZSA-N 349.312 3.341 50 40 EGGB Cc1ccc(C(=O)/C(C#N)=C2\NC(=O)c3c(sc(C)c3C)N2)cc1 105965306 LGUHOYNJECVVAI-DTQAZKPQSA-N 337.404 3.447 50 40 EGGB CCOC(=O)C/C(C)=N/NC(=O)C(c1ccccc1)c1ccccc1 4507911 WCJCAOMRKZPHRB-RCCKNPSSSA-N 338.407 3.264 50 40 EGGB CC(=O)NC1=C(C#N)[C@H](c2ccccc2)C2=C(CC(C)(C)CC2=O)O1 72408120 DPVHQOWDXRLALW-KRWDZBQOSA-N 336.391 3.315 50 40 EGGB COc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1ccccc1Cl 6181585 LMYUUZZXWOEOFA-RIYZIHGNSA-N 342.782 3.320 50 40 EGGB CN(NC(=O)Cc1csc(Cc2ccccc2)n1)c1ccccc1 40088871 YBQWIAPJIKPLNZ-UHFFFAOYSA-N 337.448 3.444 50 40 EGGB Nc1c(Cl)c(Cl)nc(C(=O)N/N=C2/C[C@@H]3C=CC[C@H]23)c1Cl 36512077 BMGDJAKJQRFAJL-YAACTZOGSA-N 345.617 3.306 50 40 EGGB CCc1ccc(C(=O)N/N=C/c2cc(OC)c(OC)cc2OC)cc1 8407671 XEFCODVIINFMHA-UDWIEESQSA-N 342.395 3.039 50 40 EGGB O=C(CCCC[C@H]1CCSS1)Nc1ccc(-n2cnnn2)cc1 25358549 SKNGASZTBZDQBM-AWEZNQCLSA-N 349.485 3.315 50 40 EGGB biogenic COc1cc(C(=O)N/N=C(/C)c2ccc(F)cc2)cc(OC)c1OC 5282382 CFLZMLNEJWIGNT-JAIQZWGSSA-N 346.358 3.006 50 40 EGGB COc1cc(/C=C(\C#N)c2nc3ccccc3[nH]2)cc([N+](=O)[O-])c1O 36117886 SHKLVTQXVGLNBG-IZZDOVSWSA-N 336.307 3.249 50 40 EGGB COc1ccc(/C=N/NC(=O)c2cc3c(s2)CC[C@H](C)C3)cc1O 3396708 CFGPYFZUKSJERX-VSMYLPJWSA-N 344.436 3.351 50 40 EGGB Cc1ccc(OCCCOc2cccc(/C=N/NC(N)=O)c2)c(C)c1 4603756 SCKJCCRDJAECRQ-FYJGNVAPSA-N 341.411 3.154 50 40 EGGB N#C/C(=C/c1cccc([N+](=O)[O-])c1)C(=O)NCCCc1ccccc1 409246768 BAFKKKPWNYJLDI-ATVHPVEESA-N 335.363 3.251 50 40 EGGB CC(C)(C)OC(=O)N[C@H]1CCCC[C@H]1N(C(=O)CCl)C1CC1 79392604 GFWXAAPRUTZVMC-QWHCGFSZSA-N 330.856 3.052 50 40 EGGB CC(C)NC(=O)/C(C#N)=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1 215877315 SMAJMUCASIAICF-LCYFTJDESA-N 325.324 3.286 50 40 EGGB N#C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCCCc1ccccc1 221452922 UCZRZBCIMQPPLU-LGMDPLHJSA-N 335.363 3.251 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-] 15939008 DRSBDCSBOVBYDZ-ZROIWOOFSA-N 337.335 3.458 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1cc(Br)cs1 206783831 DKOASLXRDJFCEO-APSNUPSMSA-N 341.205 3.343 50 40 EGGB Cc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc(F)cc2)cc1C 6215644 CYGUENATIAZYCV-CIAFOILYSA-N 341.386 3.312 50 40 EGGB COc1ccc(CC(=O)N/N=C/c2cccc(Cl)c2)cc1OC 5514237 CEPVRAKWYBPYJM-YBFXNURJSA-N 332.787 3.050 50 40 EGGB COCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(C)cc2)c1C 4994046 JHMGNUKCJAFHQI-LDADJPATSA-N 337.423 3.072 50 40 EGGB CC1(C)CC(=O)C/C(=N\NC(=O)c2ccccc2Br)C1 105838816 FXAKRCXIUCGUTR-LICLKQGHSA-N 337.217 3.314 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)Nc2ccccc2F)cc(OC)c1O 3272371 QMIVPZLQONAYNL-KPKJPENVSA-N 342.326 3.094 50 40 EGGB O=C(/C=N/NC(=O)c1ccccc1Br)c1ccccc1 3229096 ZIJBWWFIQFPWTO-LICLKQGHSA-N 331.169 3.048 50 40 EGGB O=C(/C=C/c1cc(Cl)cc(Cl)c1)NNC(=O)c1ccco1 12680782 HMFAQJQHXBIGMU-ONEGZZNKSA-N 325.151 3.061 50 40 EGGB CC(C)CC(=O)Nc1ccc(C(=O)N/N=C/c2ccsc2)cc1 8560201 FCGNFVJKUOOZEK-VCHYOVAHSA-N 329.425 3.497 50 40 EGGB C/C(=N\NC(=O)c1ccncc1)c1ccc(NC(=O)c2ccco2)cc1 17072359 ISCRZLZEZBEDQY-LPYMAVHISA-N 348.362 3.081 50 40 EGGB COc1ccc(C(=O)N/N=C/c2cc(OC)c(OC)cc2Cl)cc1 66202156 XYQHYHKUEYFKQJ-VXLYETTFSA-N 348.786 3.130 50 40 EGGB CC1=C(C#N)C(=O)NC(=O)/C1=C\c1ccc(-c2ccc(Cl)cc2)o1 96193210 ILNBJEQZZYMFQI-ZSOIEALJSA-N 338.750 3.480 50 40 EGGB COc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1O 257134 WOIMNRLXNFHPCG-RGVLZGJSSA-N 336.347 3.024 50 40 EGGB CC(C)(C)OC(=O)N[C@H]1CC[C@H](N(C(=O)CCl)C2CC2)CC1 100178126 BCQCPAUHWOHKTO-TXEJJXNPSA-N 330.856 3.052 50 40 EGGB COc1ccc2[nH]cc(/C=C(\C#N)C(=O)NCc3ccccc3)c2c1 61719382 UORXRFVJOXPAMW-OQLLNIDSSA-N 331.375 3.400 50 40 EGGB CCOc1ccccc1/C=C(\C#N)C(=O)Nc1ccccc1C(=O)O 6880963 RXUYQAQJUJCDTN-SDNWHVSQSA-N 336.347 3.329 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)CNc2ccc3ccccc3c2)cc1 3091680 QQQYYLKPKPWOJY-OEAKJJBVSA-N 346.434 3.468 50 40 EGGB CN(C)c1nc(N)nc(/C(C#N)=C/c2ccc(-c3ccccc3)s2)n1 11298264 NKQVVYUAPPRKFQ-JLHYYAGUSA-N 348.435 3.312 50 40 EGGB C/C(=N\NC(=O)CSCc1ccc([N+](=O)[O-])cc1)c1ccccc1 13144863 MVYAHXRJPDKDMQ-QGOAFFKASA-N 343.408 3.368 50 40 EGGB Cc1scc(C(=O)NNC(=S)N[C@H](C)c2ccccc2)c1C 13554905 PVVIPBBIOQSCIW-LLVKDONJSA-N 333.482 3.235 50 40 EGGB Cc1c(C)n(Cc2ccccc2)c2ncnc(NC=C(C#N)C#N)c12 15242016 AYZROJNHLNTRII-UHFFFAOYSA-N 328.379 3.439 50 40 EGGB Cc1c(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c2ccccc2n1C 408599777 ZNIIHLXHUYFFOI-YBFXNURJSA-N 336.351 3.159 50 40 EGGB COc1ccc(C(=O)/C(C#N)=C\c2cc(-c3cccnc3)[nH]n2)cc1 75148492 XUHQLWVXWWGUJN-DHDCSXOGSA-N 330.347 3.270 50 40 EGGB O=C(CBr)Nc1ccc(C(=O)N2CCCCCC2)cc1 35605261 JPPPLBALTLXPAK-UHFFFAOYSA-N 339.233 3.036 50 40 EGGB O=C(CCCC[C@H]1CCSS1)Nc1cccc(-n2cnnn2)c1 42151132 YBCDMAYJOWNURR-AWEZNQCLSA-N 349.485 3.315 50 40 EGGB biogenic O=C(NCc1ccc(Cl)cc1Cl)NNC(=O)c1ccccc1 32795418 XCJZHPHJSJLYBS-UHFFFAOYSA-N 338.194 3.138 50 40 EGGB CC(=O)N/N=C/c1ccc(OCc2ccc(Br)cc2)cc1 409015101 YQEPQQKKJZDBMU-VCHYOVAHSA-N 347.212 3.498 50 40 EGGB COC(=O)COc1cccc(/C=C(\C#N)c2nc3ccccc3[nH]2)c1 408602076 AEZSURFEBPQXIT-NTEUORMPSA-N 333.347 3.179 50 40 EGGB O[C@@H]1Cc2ccccc2[C@@H]1NP(c1ccccc1)c1ccccc1 68569527 PXDHAXMBTGRJMA-RTWAWAEBSA-N 333.371 3.282 50 40 EGGB CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)N(C)C)o2)cc1 59333665 FVUFARMMGMMHMZ-PTNGSMBKSA-N 338.363 3.118 50 40 EGGB Cc1ccc2cc(/C=N/NC(=O)CCCCCN)c(Cl)nc2c1 1887711 BUVMEXOIVNNBHL-RGVLZGJSSA-N 332.835 3.166 50 40 EGGB O=C(N/N=C/c1ccc(N2CCOCC2)s1)c1ccccc1Cl 3236990 XPDCJRDVPVPHNT-WOJGMQOQSA-N 349.843 3.002 50 40 EGGB CCOc1ccc(NC(=O)/C(C#N)=C/c2ccc(OC)cc2O)cc1 408892079 ATKPDZLCSGZYBU-GXDHUFHOSA-N 338.363 3.345 50 40 EGGB CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2cccs2)cc1 5131284 XWIDRPIIKAIPRP-JLHYYAGUSA-N 326.377 3.470 50 40 EGGB CC1(C)Cc2ccccc2C(NNC(=O)c2ccc3ccccc3n2)=N1 5415304 GHPNYZDQQKDULO-UHFFFAOYSA-N 344.418 3.251 50 40 EGGB CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(O)ccc32)cc1OC 203813 NJVBRWZHIJFNCW-SFHVURJKSA-N 338.363 3.018 50 40 EGGB CC(=O)NCCSSCCSC(=S)N1CCCCC1 1579487 SCTFUVSGQYIGNR-UHFFFAOYSA-N 338.589 3.008 50 40 EGGB O=C(N/N=C/c1ccc2ccccc2c1O)c1cccc([N+](=O)[O-])c1 238983 GEDJDVCJBRNBIT-YBFXNURJSA-N 335.319 3.218 50 40 EGGB COc1cccc(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1 260813 JGJHJQIPQHNFTH-UHFFFAOYSA-N 326.396 3.068 50 40 EGGB CC(C)(C)C(=O)Nc1ccc(C(=O)N/N=C/c2cccs2)cc1 59514892 HWVBEVFPUGFCRU-WOJGMQOQSA-N 329.425 3.497 50 40 EGGB Cc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2cccnc2)cc1 492396 KZCPKLHLOOHYKK-GOSISDBHSA-N 343.390 3.102 50 40 EGGB CCCC(=O)Nc1ccc(C(=O)N/N=C2\CC(=O)CC(C)(C)C2)cc1 100007869 MPUQOORFGOVFEV-RCCKNPSSSA-N 343.427 3.290 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)NC2CC2)ccc1OCc1ccccc1 2768142 KIJSVUFHVQSAGA-GZTJUZNOSA-N 348.402 3.460 50 40 EGGB CC1(CC(=O)N/N=C/c2ccc(Br)o2)SCCS1 7003719 QHXIVFBNBCMGDQ-NTUHNPAUSA-N 349.275 3.079 50 40 EGGB CCOc1cc(/C=N\NC(=O)Cc2cc(C)ccc2C)ccc1OC 409366639 XLNDLMGJQZEPEO-BKUYFWCQSA-N 340.423 3.404 50 40 EGGB N#C/C(=C\c1ccccc1OCc1ccccc1)C(=O)N1CCOCC1 408760277 VWOUHDIQFXNLNS-XMHGGMMESA-N 348.402 3.031 50 40 EGGB COc1ccc(/C=C/C(=O)NN)cc1OCc1cccc2ccccc12 216897878 ZTRFVBNUCCAMTA-ZRDIBKRKSA-N 348.402 3.431 50 40 EGGB Cc1ccc(/C=N/NC(=O)CCCC(=O)NC2CCCCC2)cc1 3667081 XEVDHNPARWUNIL-XSFVSMFZSA-N 329.444 3.064 50 40 EGGB COc1cccc(/C=C2/C(C)=C(C#N)c3nc(N)c(C#N)c(C)c32)c1O 408743272 VOTVWWYROUYCDJ-QPEQYQDCSA-N 344.374 3.409 50 40 EGGB CSc1ccc(/C=N/NC(=O)c2c(C)nc3sccn23)cc1 409011952 PGTAPWILGDWGFI-CXUHLZMHSA-N 330.438 3.190 50 40 EGGB Cc1ccccc1NC(=O)/C(C#N)=C\c1ccccc1OCC(=O)O 44867243 ZZBYEVBITSKZEE-GDNBJRDFSA-N 336.347 3.004 50 40 EGGB O=C(Cl)[C@H]1CC(=O)N(c2ccc(Br)cc2Cl)C1 45953105 FHBHVBVCWGDRPU-LURJTMIESA-N 337.000 3.221 50 40 EGGB CCC[C@H](C)c1ccc(OCC(=O)N/N=C/c2cccn2C)cc1 137817 MZJYJDFDNXZLAN-NPRIEWAGSA-N 327.428 3.458 50 40 EGGB COc1ccccc1NCC(=O)N/N=C/c1c(O)ccc2ccccc12 60499 UUSJWLDMBJMRQS-WSDLNYQXSA-N 349.390 3.116 50 40 EGGB Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N/N=C/c1ccc(O)cc1 243900 XQVKBZXECVLGTP-NJDFMEINSA-N 332.787 3.272 50 40 EGGB COc1ccc(-c2cs/c(=N/NC(C)=O)n2-c2ccccc2)cc1 26507143 WIUMIEUTAABNCU-CZIZESTLSA-N 339.420 3.166 50 40 EGGB COc1ccc(/C=N/NC(=O)CCSc2ccccc2)c(OC)c1 59473364 YJFYUWFHDURNGU-CPNJWEJPSA-N 344.436 3.336 50 40 EGGB O=C(COc1ccccc1Cl)N/N=C/c1cc(Cl)ccc1O 567287 CIHZSBOBPVAZGZ-QGMBQPNBSA-N 339.178 3.228 50 40 EGGB N#CC1=C2S[C@@H]3CCCC[C@]3(O)N2C(=O)[C@H](C#N)C12CCCCC2 128368 WEZAFGUZTDLBAS-WPKBUWHJSA-N 343.452 3.032 50 40 EGGB O=C(COc1ccccc1)NNc1nc2c(F)cc(F)cc2s1 4121502 ANKFFECIHONJTH-UHFFFAOYSA-N 335.335 3.097 50 40 EGGB O=C(CSc1ccc2ccccc2n1)N/N=C\c1ccccc1O 12360348 IMOZBXHHKQONOA-ODLFYWEKSA-N 337.404 3.183 50 40 EGGB C/C(CCc1ccccc1)=N/NC(=O)c1c(C)nc2sccn12 59515957 ROVNWOMFZNUJHI-UNOMPAQXSA-N 326.425 3.443 50 40 EGGB COc1ccc(C(=O)NNc2ccc(C)c(Cl)c2)cc1[N+](=O)[O-] 9156175 YNJUWFRJHUAZGJ-UHFFFAOYSA-N 335.747 3.322 50 40 EGGB O=C(NNC(=O)c1cc2c(s1)CCC2)c1cc2ccccc2o1 17445396 OGIZRVNOKBQDBU-UHFFFAOYSA-N 326.377 3.058 50 40 EGGB COc1ccc(N2C(S)=C(C#N)C(=O)N[C@@H]2c2cccs2)cc1 4116942 QDXYWUYNJODACL-AWEZNQCLSA-N 343.433 3.057 50 40 EGGB N#C/C(=C\c1ccc2c(c1)CCO2)C(=O)c1cccc2c1OCCO2 92844448 ZJTHRWAQVWPMSN-RVDMUPIBSA-N 333.343 3.183 50 40 EGGB N#C/C(=C/c1ccc(O)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cl 213092342 LRHKGKKZFSUGHK-XFFZJAGNSA-N 343.726 3.499 50 40 EGGB CC12CC3C[C@]([C@H](Cl)C(=O)O)(C1)C[C@@]([C@H](Cl)C(=O)O)(C3)C2 5081136 ZUPVATIOXGRXBN-PFONWZRMSA-N 335.227 3.347 50 40 EGGB COc1ccc(C2=C(C#N)c3nc4ccccc4n3C(=O)[C@@H]2C#N)cc1 4342328 ULXJHZGLIABWNL-OAHLLOKOSA-N 340.342 3.273 50 40 EGGB O=C1CCC/C(=N/NC(=O)c2ccc(COc3ccccc3)cc2)C1 103451728 FAOWXJSHTGDVFW-FXBPSFAMSA-N 336.391 3.495 50 40 EGGB CCOC(=O)/C(C#N)=C/c1ccc(Sc2nc(C)cc(C)n2)o1 409145277 NYMRUYJPCRDCTJ-XYOKQWHBSA-N 329.381 3.308 50 40 EGGB C[C@]12[C@@H]3[C@H]4[C@H]5C[C@@H]([C@H]4[C@H]1Br)[C@@H]2[C@H]5[C@]3(O)c1ccccc1 195528700 SZCGKEUXKLALMI-WHLICGETSA-N 331.253 3.416 50 40 EGGB COc1ccc(/C=N\NC(=O)c2ccc(Cl)cc2)cc1[N+](=O)[O-] 100287357 HOQHAEVHQOVSBX-MFOYZWKCSA-N 333.731 3.021 50 40 EGGB COc1ccccc1NC(=O)N/N=C\c1ccc(Cl)c([N+](=O)[O-])c1 409098643 IZSSXWIIUVELCZ-MFOYZWKCSA-N 348.746 3.412 50 40 EGGB COc1ccc(/C(C#N)=C/c2cc(OC)c(O)c([N+](=O)[O-])c2)cc1 408580480 BXPLOOQWYPBVHJ-NTUHNPAUSA-N 326.308 3.382 50 40 EGGB CC(C)(C)OC(=O)N1CCC[C@@H](I)CC1 44682262 JQFSVNKXRCIGOH-SECBINFHSA-N 325.190 3.211 50 40 EGGB in-vitro N#CC(C#N)=C1/C(=C/c2ccc3c(c2)OCO3)C(=O)c2ccccc21 39379147 NPQNBANGMOQYGY-APSNUPSMSA-N 326.311 3.496 50 40 EGGB O=[P@]1(N(CCCl)C[C@@H](Cl)CCCCl)NCCCO1 1675013 CEWZNIGUQAHDRC-XTZNXHDOSA-N 337.615 3.272 50 40 EGGB O=C(N/N=C\c1ccccn1)C1c2ccccc2Oc2ccccc21 4867048 PVDXFRMPNZDGKC-XKZIYDEJSA-N 329.359 3.470 50 40 EGGB BrCCOc1ccc(I)cc1 2282310 WHZJAGORNSGMDU-UHFFFAOYSA-N 326.959 3.065 50 40 EGGB CC(C)(C)c1ccc(CC(=O)N/N=C/c2ccc(O)cc2O)cc1 408568906 XKMIDKDCFKITIG-UDWIEESQSA-N 326.396 3.088 50 40 EGGB COc1ccc(NC(=O)NCc2ccccc2NC(=O)CCl)cc1 6170493 KWAKCYOOEZWRKF-UHFFFAOYSA-N 347.802 3.194 50 40 EGGB C[C@]12[C@H]3[C@@H]4C[C@@H]5[C@@H]3[C@](O)(c3ccccc3)[C@@H]1[C@@H]5[C@@H]4[C@@H]2Br 100940622 SZCGKEUXKLALMI-WUAGPPQUSA-N 331.253 3.416 50 40 EGGB CCOc1ccc(/C=N/NC(=O)[C@@H]2[C@H]3CCCC[C@]32C)cc1OC 106068694 DZVFTTHPJVLOEH-GNRCFQDZSA-N 330.428 3.370 50 40 EGGB O=C(NNC(=O)c1ccc[nH]c1=S)c1cc2c(s1)CCCCC2 10470232 YXRSFJLWTJUOSN-UHFFFAOYSA-N 347.465 3.149 50 40 EGGB CCOC(=O)NNC(=O)[C@@H](Sc1ccccc1)c1ccccc1 12996251 VUCWDRGHJMIRPY-HNNXBMFYSA-N 330.409 3.297 50 40 EGGB COc1cc(/C=N/NC(=O)c2cccc(Cl)c2)ccc1OCC#N 8043207 JMKORKFBQIRCAY-RGVLZGJSSA-N 343.770 3.015 50 40 EGGB COC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1c(Cl)cccc1Cl 61418 BZSJEDZTEXTATA-GFCCVEGCSA-N 339.178 3.248 50 40 EGGB CCO/C=N/C1=C(C#N)[C@H](c2ccccc2)C(C(=O)OCC)=C(C)O1 101521567 GVEPBHXPLBXEQU-RHLNUJDMSA-N 340.379 3.437 50 40 EGGB COc1ccc(OC)c([C@H]2C(C#N)=C(N)OC(C(C)(C)C)=C2C#N)c1 547605 ZYLFNEDDQQSFPT-MRXNPFEDSA-N 339.395 3.335 50 40 EGGB COc1ccc(-n2cccc2/C=N/NC(=O)c2cccc(OC)c2)cc1 573060 RMQKAEFFAWKCNZ-KGENOOAVSA-N 349.390 3.258 50 40 EGGB C=CCc1cc(/C=C(/C#N)C(=O)NC2CCCC2)cc(OC)c1O 57770398 TWWISXJVZZTGGI-GDNBJRDFSA-N 326.396 3.095 50 40 EGGB O=C(N/N=C/c1ccccc1Cl)c1cn2cc(Cl)ccc2n1 575442381 GAUQQTQVDSDFJI-CNHKJKLMSA-N 333.178 3.405 50 40 EGGB CCc1ccc(NC(=O)CCC(=O)N/N=C/c2ccccc2F)cc1 3101378 VMKHITHHJNJCSI-FYJGNVAPSA-N 341.386 3.257 50 40 EGGB O=C(NNC(=O)c1ccccc1CCc1ccccc1)c1ccco1 12817025 QCSZVELMFGYJGQ-UHFFFAOYSA-N 334.375 3.140 50 40 EGGB O=C(COc1ccc(C2SCCS2)cc1)N/N=C/c1ccco1 408569297 MYPXLVSUMKEHGN-LICLKQGHSA-N 348.449 3.287 50 40 EGGB Cc1ccccc1OCC(=O)N/N=C/C=C/c1ccccc1[N+](=O)[O-] 4132015 VUHBTLLJFHEIKW-YKIVCEQRSA-N 339.351 3.097 50 40 EGGB N#CC1=C(N)Oc2n[nH]c(-c3ccc(F)cc3)c2[C@H]1c1cccc(O)c1 9353700 HCKBWEZRRBPMDR-HNNXBMFYSA-N 348.337 3.140 50 40 EGGB Cc1cc(/C=C(\C#N)C(=O)Nc2ccn(C)n2)c(C)n1CC(C)C 98054025 RQDDSTSGKMQDMZ-CXUHLZMHSA-N 325.416 3.040 50 40 EGGB CCCC1=C(C(=O)OCC)[C@H](c2cccc(OC)c2)C(C#N)=C(N)O1 71033 HZOGXMPEYFOJAK-MRXNPFEDSA-N 342.395 3.120 50 40 EGGB COc1ccc(OC)c(/C=N/NC(=O)c2ccc3ccccc3n2)c1 303397 IELFLENHKLEWHZ-UDWIEESQSA-N 335.363 3.016 50 40 EGGB CC(=O)Oc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1 59383052 PPKXRQZNMQGFTO-CIAFOILYSA-N 348.358 3.235 50 40 EGGB N#CC(C#N)=C(N)/C(C#N)=C\c1c(-c2ccccc2)nc2sccn12 102228173 BVBZZPCECUSLFS-JYRVWZFOSA-N 342.387 3.230 50 40 EGGB COc1cc(/C=N/NC(=O)CC2CCCCC2)cc(OC)c1OC 9679200 UXPCQPSEBOCCRV-XDHOZWIPSA-N 334.416 3.133 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)cc1[N+](=O)[O-] 23382603 QBWNWEOAPIWZBX-CBJRRHEPSA-N 343.383 3.205 50 40 EGGB C/C=C1\C[N+]2(C)CC[C@]34C(=C(C=O)[C@H]1C[C@@H]32)Nc1c(OC)cccc14 32116339 RYFUCGCTWTVHMS-OAHFFKDNSA-O 337.443 3.010 50 40 EGGB CCn1c(C)cc(/C=N\NC(=O)CSc2ccc(OC)cc2)c1C 409063969 ATCMWPOGXFBANU-ODLFYWEKSA-N 345.468 3.376 50 40 EGGB O=C(/C(=N/NC(=O)c1ccccc1O)c1ccccc1)c1ccccc1 408722874 HIBUJQQTPCIFHL-ZBJSNUHESA-N 344.370 3.409 50 40 EGGB CCOc1cccc2cc(/C(C)=N/NC(=O)NC[C@H]3CCCO3)oc12 64911536 VPGWXGZGLBEKQQ-MQMKENTISA-N 345.399 3.034 50 40 EGGB COc1cccc(OC)c1C(=O)NNc1nc2c(F)cccc2s1 4121348 KFLFNRGBLSTXPK-UHFFFAOYSA-N 347.371 3.210 50 40 EGGB COc1cc(C)ccc1C(=O)N/N=C/c1cc2c(cc1Cl)OCO2 478808 PUWWMQRRTWCFAZ-UFWORHAWSA-N 346.770 3.150 50 40 EGGB O=C(CCn1cnc2ccccc21)N/N=C\c1c[nH]c2ccccc12 54263652 AFYPDMSXAPSQHE-UUYOSTAYSA-N 331.379 3.058 50 40 EGGB CCOc1ccccc1OCC(=O)C(C#N)=C1Nc2ccccc2N1 6016502 YKLNBTZFTJDWMO-UHFFFAOYSA-N 335.363 3.306 50 40 EGGB N#CC1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@H]1c1ccc(Cl)cc1 13940443 WFGFZJMXQQSGJJ-HNNXBMFYSA-N 349.777 3.400 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)cc(OC)c1O 6586234 CNEHNLFALIFFQP-JOTCQTJXSA-N 344.411 3.011 50 40 EGGB O=C(N/N=C/c1ccco1)c1cc2cc(Br)ccc2[nH]1 18191504 XQEALYZPDGFRNW-LZYBPNLTSA-N 332.157 3.287 50 40 EGGB C#CCOc1ccc([N+](=O)[O-])cc1/C=C(/C#N)c1ccc2c(c1)OCO2 409366846 ZJCONUZHASMWRS-NVNXTCNLSA-N 348.314 3.400 50 40 EGGB O=C(N/N=C/c1cccc(OC2CSC2)c1)c1ccc(F)cc1 408863531 NFVNJYYIJQOGCU-DJKKODMXSA-N 330.384 3.084 50 40 EGGB O=C(N/N=C/c1ccc(Br)o1)c1cccc(Cl)c1 6220607 JCFKWKZALITFFJ-VIZOYTHASA-N 327.565 3.459 50 40 EGGB Cc1cccc(/C=N/NC(=O)COc2ccc(C(C)(C)C)cc2)n1 59484688 QQZCDYGMUMIHAW-UDWIEESQSA-N 325.412 3.217 50 40 EGGB O=C(O)CC1CCC2(CC1)OOC1(OO2)C2CC3CC(C2)CC1C3 59372761 KXOXRSVQUACCHR-UHFFFAOYSA-N 338.400 3.410 50 40 EGGB in-vitro Cc1cc(/C=N/NC(=O)COc2ccccc2F)c(C)n1CC(C)C 6280674 SSZHUUKPVULWQO-UFFVCSGVSA-N 345.418 3.429 50 40 EGGB O=C(N/N=C\c1ccc(O)c([N+](=O)[O-])c1)Nc1ccccc1Cl 408961506 CNWUTNVGWIVWFE-PXNMLYILSA-N 334.719 3.109 50 40 EGGB O=C(Cc1ccccc1)N/N=C/c1ccc(-c2cccc(C(=O)O)c2)o1 409040869 YYCGECRNRTXRMM-FYJGNVAPSA-N 348.358 3.338 50 40 EGGB O=C(COc1cccc2ccccc12)N/N=C\c1ccc(C(=O)O)cc1 33328614 PHENILCAVMKXDN-MTJSOVHGSA-N 348.358 3.067 50 40 EGGB COc1cc(/C=C(\C#N)C(N)=O)cc(Cl)c1Cc1ccccc1F 408870052 VEMXQEUGDUWWDH-AWNIVKPZSA-N 344.773 3.471 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)COc2ccc(OC)cc2)cc1 8182544 FZKHCSUURYNKDO-DEDYPNTBSA-N 342.395 3.013 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@H]2[C@@H]3CCCC[C@@]32C)cc1[N+](=O)[O-] 4526138 MSIQBURIIGTNAF-NAUUFFFRSA-N 345.399 3.270 50 40 EGGB C/C(CC(=O)Nc1cc(Cl)c(Cl)cc1Cl)=N/NC(N)=O 5503159 JRVHNCBSQRBWBM-ZWSORDCHSA-N 337.594 3.020 50 40 EGGB COc1cccc(/C=N/NC(=O)c2cc3ccccc3cc2O)c1O 257138 ZBOZQLLNEQZSAP-RGVLZGJSSA-N 336.347 3.024 50 40 EGGB FC(F)(F)C1(C(F)(F)F)N[C@@H]2[C@H](Br)C[C@H]1[C@H]2Cl 3141200 CQNJIVNXDXPYJU-NRXMZTRTSA-N 346.496 3.212 50 40 EGGB N#C/C(=C/c1ccc(N2CCOCC2)o1)c1nc2ccc(F)cc2[nH]1 408566610 HYLCEFSDDALNNR-XFXZXTDPSA-N 338.342 3.196 50 40 EGGB Cc1nc(-c2cccs2)sc1C(=O)NNC(=O)c1cccs1 14182423 QQYJOGLBGXOPPS-UHFFFAOYSA-N 349.462 3.316 50 40 EGGB C/C(CC(=O)Nc1cc(C)ccn1)=N\NC(=O)c1cccc(Cl)c1 4697907 QPAHDBUTJGHXQO-CIAFOILYSA-N 344.802 3.178 50 40 EGGB C[C@H](Br)C(=O)NC[C@@H](OCC1CC1)c1ccc(F)cc1 95097952 DNJXWELCUUGIDI-IINYFYTJSA-N 344.224 3.193 50 40 EGGB Cc1cc(C)n(Cc2cccc(C(=O)N/N=C/c3ccccc3O)c2)n1 130465 JQPKNUPSBMODHQ-CIAFOILYSA-N 348.406 3.018 50 40 EGGB Cc1cc2c(cc1C)CN(CC(=O)N/N=C/c1ccccc1Cl)C2 8336801 ZIGYOLFHKZMPNB-ZVBGSRNCSA-N 341.842 3.423 50 40 EGGB O=C(N/N=C/C=C/c1ccccc1)c1nn(-c2ccccc2)cc1O 8529552 OBAPJCLFDQKJBA-ADCWSOHQSA-N 332.363 3.007 50 40 EGGB COc1cc(/C=C(/C#N)c2ccc(C(=O)O)cc2)cc(OC)c1O 107849750 PKCWSQULARXHIP-AUWJEWJLSA-N 325.320 3.172 50 40 EGGB Cc1cc(C(=O)O)ccc1-c1ccc(/C=N\NC(=O)c2ccco2)o1 408959861 HDAZLXNYAAWWJH-GRSHGNNSSA-N 338.319 3.310 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/c2cccn2-c2ccccc2)c(F)c1 4106979 YSWSTTDNXPQQCD-LPYMAVHISA-N 332.338 3.252 50 40 EGGB COc1cccc(/C=C(\C#N)c2nc3ccccc3[nH]2)c1OCC(=O)O 4453823 DCFXJDUVTSWOLI-UKTHLTGXSA-N 349.346 3.099 50 40 EGGB Cc1cccc(NC(=O)NNC(=O)c2cc3c(s2)CCCC3)c1 6784427 ADWZEHDVLXHUCG-UHFFFAOYSA-N 329.425 3.402 50 40 EGGB CC(C)NC(=O)/C(C#N)=C\c1cc(Cl)c(O)c(Br)c1 33337500 OVDBWRLDTPTBOP-OQFOIZHKSA-N 343.608 3.240 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)c2ccc3c(c2)OCO3)c(OC)c1 96130171 NGXUXYGOMZCETD-VGOFMYFVSA-N 337.331 3.222 50 40 EGGB Cc1c(/C=N/NC(=O)CNc2ccc(F)cc2)c2ccccc2n1C 487160 UECWRTZCCVEMAN-SSDVNMTOSA-N 338.386 3.188 50 40 EGGB COc1cccc(/C=C(\C#N)C(=O)Nc2ccccc2F)c1OC 5129694 XKWFXFPNBPMDCR-JLHYYAGUSA-N 326.327 3.389 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/c2c[nH]nc2-c2ccccc2)cc1C 8462522 QOOHPQRNFKXSOT-SRZZPIQSSA-N 348.406 3.223 50 40 EGGB COc1ccc([C@H]2NC(N)=C(C#N)C3=C2[C@@H](C)CCC3)cc1OC 1652463 GUWTUEWWTLWBKU-BBATYDOGSA-N 325.412 3.159 50 40 EGGB CCOc1cc(/C=N/NC(=O)[C@H](C)Sc2ccccc2)ccc1O 313843 PMZSWXBRNRGYAQ-HCZVKUGISA-N 344.436 3.422 50 40 EGGB COc1ccc(C(=O)N/N=C/c2cccn2-c2ccc(OC)cc2)cc1 59104894 XDGGYAPENRRNEK-KGENOOAVSA-N 349.390 3.258 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)NC2CCCCC2)cc(Cl)c1O 14135852 HELNAYJVHCRETF-KPKJPENVSA-N 334.803 3.410 50 40 EGGB Cc1occc1C(=O)NNC(=O)Nc1cccc(C(F)(F)F)c1 17066928 GCSJBPBDTAMNET-UHFFFAOYSA-N 327.262 3.073 50 40 EGGB CCc1ccc(N2C[C@@H](C(=O)N/N=C\c3ccc(C)cc3)CC2=O)cc1 409159313 SNVHIKRUOIWDLG-FPJJECCMSA-N 349.434 3.061 50 40 EGGB Cc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)N2CCOCC2)c1C 24374681 ABOTZBVIERWXJI-CPNJWEJPSA-N 349.434 3.168 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@H]2C[C@H]2c2ccccc2)c(OC)c1 12362273 NPCYDLPFUVOBHH-PMOZRXSBSA-N 338.407 3.348 50 40 EGGB CCOC(=O)/C(C#N)=C/c1ccc(-c2ccc(C(=O)OC)cc2)o1 277015 JAJVAWVYULVHBH-GXDHUFHOSA-N 325.320 3.203 50 40 EGGB CCOC(=O)/C(C#N)=C1\C[C@H](C)CC[C@@H]1C(SC)=C(C#N)C#N 59662388 AEWZDTPSKXPNPT-CFWSOTIOSA-N 329.425 3.470 50 40 EGGB CCCCC(O)(CCCC)C(=O)NN(C(=O)OC)c1ccccc1 2274032 ZTTHCWMHGCGJEJ-UHFFFAOYSA-N 336.432 3.402 50 40 EGGB C[C@@]1(C(=O)Nc2c(F)c(F)c(F)c(F)c2F)C[C@@H]1Br 2311936 HQOLHAYYEOJGGN-AGPWLVQFSA-N 344.077 3.494 50 40 EGGB C=CCc1cccc(/C=N/NC(=O)Cc2c[nH]c3ccccc23)c1O 5480661 QMDTWZBHHWWEFA-LPYMAVHISA-N 333.391 3.295 50 40 EGGB C=CCOc1cccc(/C=N/NC(=O)CSc2ccccc2)c1 409185455 LPUAZAZTIFFHCS-CPNJWEJPSA-N 326.421 3.494 50 40 EGGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(C)c(C)c2C)n1 408829199 LAWRTJSVFJQOOJ-DJKKODMXSA-N 342.468 3.261 50 40 EGGB Cc1ccc(S[C@@H](C)C(=O)N/N=C/c2ccccc2C(=O)O)cc1 409117821 OIRLMUJGIORMAC-MDBUFAAASA-N 342.420 3.324 50 40 EGGB FC(F)(F)C1(C(F)(F)F)N[C@H]2[C@@H](Cl)[C@@H]1C[C@H]2Br 4580427 CQNJIVNXDXPYJU-SKNVOMKLSA-N 346.496 3.212 50 40 EGGB Cc1nc2ccc(Cl)cn2c1C(=O)N/N=C/c1ccc(F)cc1 32189132 QMBWJAQCLXFVEM-UFWORHAWSA-N 330.750 3.199 50 40 EGGB O=C(O)c1ccc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)cc1 2248605 KOHFUDXUOVQNQB-AWQFTUOYSA-N 336.269 3.168 50 40 EGGB CC(C)Oc1ccccc1/C=N\NC(=O)[C@@H](C)Oc1ccccc1 4544309 WFFUXHJZXROAIH-CTFRJJSNSA-N 326.396 3.391 50 40 EGGB N#C/C=C/c1ccc(NCc2ccc(-n3cccn3)nc2)c([N+](=O)[O-])c1 69702476 MUBUSVMYISGELS-HNQUOIGGSA-N 346.350 3.324 50 40 EGGB C/C(=N\NC(=O)Cn1ccc(C(F)(F)F)n1)c1ccc(Cl)cc1 5835865 FYZYOPPUXNJNSI-DJKKODMXSA-N 344.724 3.096 50 40 EGGB CCOc1ccc(/C=C(/C#N)C(=O)NCc2ccc(OC)cc2)cc1 255454719 AMSGNBPKBYKQDB-ATVHPVEESA-N 336.391 3.317 50 40 EGGB CCS[C@]1(c2ccc(Cl)cc2)OC(N)=C(C#N)C1=C(C#N)C#N 100249681 GOIZQWPXUDPYBW-INIZCTEOSA-N 342.811 3.314 50 40 EGGB CCOc1ccccc1/C=N/NC(=O)COc1cc(C)cc(C)c1 5466865 UJNQDEDHAJRTOI-UDWIEESQSA-N 326.396 3.231 50 40 EGGB C[C@H](/C=N/NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccccc1 5528655 XIJKTVAQJCLEIA-JDAJCMJVSA-N 342.311 3.022 50 40 EGGB N#CC1=C(N)C2=CCCC[C@H]2[C@H](c2cccc([N+](=O)[O-])c2)C1(C#N)C#N 4729166 FACHJCMCYXTZAF-PBHICJAKSA-N 345.362 3.188 50 40 EGGB Cc1cc(=O)oc2c(CN(CCCl)CCCl)c(O)ccc12 73257166 CNALNNVHNPSQEZ-UHFFFAOYSA-N 330.211 3.087 50 40 EGGB Cn1ccc(C(=O)N/N=C/c2c3ccccc3cc3ccccc23)n1 132298 MXOGVWWYBLMMIZ-FYJGNVAPSA-N 328.375 3.490 50 40 EGGB COC(=O)c1ccc(C(=O)NNc2nc3c(C)cccc3s2)cc1 429751 UJYRINUTCRFMKP-UHFFFAOYSA-N 341.392 3.148 50 40 EGGB C=CCOc1ccc(Br)cc1/C=C(\C#N)C(=O)OCC 408812947 CDSRDZJKTFCQNK-XYOKQWHBSA-N 336.185 3.484 50 40 EGGB COc1ccc([N+](=O)[O-])cc1/C=N\NC(=O)c1cc2ccccc2o1 408952788 VUUMLJXYYQQSRF-ZDLGFXPLSA-N 339.307 3.114 50 40 EGGB Br[C@@H]1CCC[C@H]2N=C(N/N=C/c3ccccc3)S[C@H]12 257346815 XGUGXCYNVHMVAJ-OIYSBPNRSA-N 338.274 3.398 50 40 EGGB Cc1cc(C)nc(SCC(=O)N/N=C\C2=CC[C@H]3C[C@H]2C3(C)C)n1 585139613 HPLPZQOBHWAKRR-CVKZBDHRSA-N 344.484 3.280 50 40 EGGB C[C@@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1ccccc1O 131763 VCSQOUNCWPRSJU-CNRHGSOZSA-N 333.391 3.496 50 40 EGGB N#CCOc1ccccc1/C=N/NC(=O)Cc1cccc2ccccc12 10848038 YHQWHSSXWQYRNC-HZHRSRAPSA-N 343.386 3.435 50 40 EGGB CCc1[nH]c(C(=O)NN(CC)c2ccc(C)cc2)c(C)c1C(=O)OC 24479961 LDRNDJBLFUIEAT-UHFFFAOYSA-N 343.427 3.152 50 40 EGGB O=C(NN=C1CCN(Cc2ccccc2)CC1)c1ccccc1F 55008639 VDWHHBOESMNOMP-UHFFFAOYSA-N 325.387 3.208 50 40 EGGB CC(=O)Oc1cccc(/C=N/NC(=O)c2ccccc2-n2cccc2)c1 408755485 VCVNIZNPLQYFIK-KGENOOAVSA-N 347.374 3.167 50 40 EGGB CCOc1cc(/C=N/NC(=O)CC#N)ccc1OCc1ccccc1 1021098 XMSXJYDPWPUMLX-FYJGNVAPSA-N 337.379 3.028 50 40 EGGB CC(C)(C)OC(=O)NNC(=O)Cc1ccc(-c2ccccc2)cc1 17398520 GKSGQZNXVUVJQX-UHFFFAOYSA-N 326.396 3.452 50 40 EGGB N#C/C(=C\c1cnc(N2CCCC2)nc1)C(=O)c1c[nH]c2ccccc12 44024201 QVCIVTKRPHDJTE-OQLLNIDSSA-N 343.390 3.348 50 40 EGGB O=C(CCCC[C@H]1CCSS1)NCc1nnc2ccccn12 27993529 JBABGVXNTYTMMN-LBPRGKRZSA-N 336.486 3.060 50 40 EGGB biogenic NC(=O)c1ccc(C(=O)NN=C(c2ccccc2)c2ccccc2)s1 58425070 JTRNJJHXIMYWJF-UHFFFAOYSA-N 349.415 3.029 50 40 EGGB CC1=C(C(=O)OCCCCl)[C@@H](c2ccccc2Cl)NC(=O)N1 4091273 BIZKUIXKMWFZST-CYBMUJFWSA-N 343.210 3.140 50 40 EGGB CC(C)(C)c1[nH]nc2c1[C@H](c1c(F)cccc1F)C(C#N)=C(N)O2 6781480 BLSGJBXBECWDMX-NSHDSACASA-N 330.338 3.204 50 40 EGGB Cc1ccccc1NC(=O)NNC(=O)c1ccc2ccccc2c1O 15934090 MBRLEALSVOWSEV-UHFFFAOYSA-N 335.363 3.320 50 40 EGGB Cc1ccc(/C=N/NC(=O)COc2ccccc2)cc1Br 408527987 GZIMGUOKCWZAAN-VCHYOVAHSA-N 347.212 3.287 50 40 EGGB N#C/C(=C\c1coc2ccccc2c1=O)C(=O)N1CCc2ccccc21 2436388 MKOQHUYATFYBRN-RVDMUPIBSA-N 342.354 3.289 50 40 EGGB O=C(CC12CC3CC(CC(C3)C1)C2)NNC(=O)c1ccc(F)cc1F 5578972 MOTSXVHJNWKMHH-UHFFFAOYSA-N 348.393 3.332 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(C(F)(F)F)c2[C@@H]1c1ccc(Cl)cc1 5819020 LUMGTSMHRUZMHY-SECBINFHSA-N 340.692 3.300 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)ccc1OCC#N 15012576 RLIPOHZGPJHJEN-WJDWOHSUSA-N 347.374 3.452 50 40 EGGB COc1cc(C=C(C#N)C#N)ccc1OCC(=O)Nc1ccc(C)cc1 278501 DKHGTDYILIBGLX-UHFFFAOYSA-N 347.374 3.452 50 40 EGGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1O)c1ccc2ccccc2c1 8520835 AJASSZKCDYGSFA-YBFXNURJSA-N 335.319 3.218 50 40 EGGB O=C(CCCc1nc2ccccc2s1)NNC(=O)c1ccccc1 13022565 ODDTWFNATBEDLU-UHFFFAOYSA-N 339.420 3.080 50 40 EGGB C/C(CC(=O)Nc1ccc(Cl)cc1C)=N\NC(=O)c1ccco1 4480635 UNUGXLYVAOYPHG-YBFXNURJSA-N 333.775 3.376 50 40 EGGB CC(C)(C)C(=O)OCN1N=CN(Cc2ccccc2)C=C1SC#N 5444931 JACRAPAASYOSDM-UHFFFAOYSA-N 344.440 3.307 50 40 EGGB O=C(Cc1ccc(Br)cc1)N/N=C/c1ccc(F)cc1 4735279 PLGBXJOYXXTPMC-VCHYOVAHSA-N 335.176 3.281 50 40 EGGB CNC(=O)/C(C#N)=C/c1c(-c2ccccc2)[nH]c2c(OC)cccc12 408847889 VRPGETCLMCBPLN-SDNWHVSQSA-N 331.375 3.496 50 40 EGGB COc1cc(/C=N/NC(=O)c2ccc(C)c(Cl)c2)cc(OC)c1O 6033591 GHXVOSAGJYGDSZ-DJKKODMXSA-N 348.786 3.135 50 40 EGGB O=C(CNc1cccc2ccccc12)N/N=C/c1ccc2c(c1)OCO2 60477 CEKIPELKBFZPKO-SSDVNMTOSA-N 347.374 3.131 50 40 EGGB Cc1ccc(N[C@H](C)C(=O)N/N=C/c2ccc(N(C)C)cc2)c(C)c1 370365 UZNJZXPQTBKQOC-WMRWHDLOSA-N 338.455 3.320 50 40 EGGB O=C(N/N=C/c1c(O)ccc2ccccc12)c1ccc2c(c1)OCCO2 507964 YBEZVRAAYZWBKS-CIAFOILYSA-N 348.358 3.081 50 40 EGGB CCOC(=O)[C@@H](CC)/C(C)=N/NC(=O)c1cc2ccccc2cc1O 101438709 MUBIXMUEGHYIFS-SLDJAQPHSA-N 342.395 3.240 50 40 EGGB C[C@]1(C(=O)Nc2c(F)c(F)c(F)c(F)c2F)C[C@@H]1Br 2311937 HQOLHAYYEOJGGN-ZWWCSAPESA-N 344.077 3.494 50 40 EGGB Cc1ccc(C(=O)NNC(=O)CCCc2c[nH]c3ccccc23)cc1 3404167 RGGFOBJLHUUXKM-UHFFFAOYSA-N 335.407 3.260 50 40 EGGB Cc1ccc(OCC(=O)N/N=C\c2cc3ccccc3nc2O)c(C)c1 13955443 BADUALPERVDTAR-NHDPSOOVSA-N 349.390 3.086 50 40 EGGB Cc1cc(N2CCCC2)c(F)cc1/C=N\NC(=O)c1cccc(O)c1 33392761 IGDCOWQACDHDOB-MTJSOVHGSA-N 341.386 3.204 50 40 EGGB COc1ccccc1/C=N/NC(=O)[C@H](C)SCc1ccccc1 313885 QWFNDTMVMSJIIP-BXUJETTOSA-N 328.437 3.467 50 40 EGGB COc1ccc(/C=N/NC(=O)CSCc2ccccc2C)cc1 59381 LONBTOQWDVNROI-YBFXNURJSA-N 328.437 3.387 50 40 EGGB O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)c1ccc(O)cc1 3153504 SWLYLLJILSVPRN-REZTVBANSA-N 325.151 3.169 50 40 EGGB CCOc1ccc(/C=C(/C#N)C(=O)NCc2ccco2)c(OCC)c1 4506735 DBKXPTJWFAKHGI-GDNBJRDFSA-N 340.379 3.300 50 40 EGGB CCc1ccc(OCCCOc2ccccc2/C=N/NC(N)=O)cc1 4677341 DXTKBRYIOGGTOB-KGENOOAVSA-N 341.411 3.099 50 40 EGGB COc1ccc2nc(Cl)c(/C=N/NC(=O)c3ccncc3)cc2c1 5576374 RUMXFNSENPCQIQ-KEBDBYFISA-N 340.770 3.056 50 40 EGGB CCCc1ccc(OCC(=O)NNC(=S)Nc2ccccc2)cc1 51519 IPGJTDSIERXNMR-UHFFFAOYSA-N 343.452 3.036 50 40 EGGB COc1ccc2ccc(OC)c(/C=N/NC(=O)c3ccncc3)c2c1 565905 APJBKTPYSCIHAN-CIAFOILYSA-N 335.363 3.016 50 40 EGGB C/C(=N\NC(=O)CNc1ccc(C)cc1C)c1nc2ccccc2n1C 105371913 UQIDCTTUEKNDRF-HZHRSRAPSA-N 349.438 3.142 50 40 EGGB CC(=O)N(c1ccc(C)c(C)c1)c1nc(/C=C(/C#N)C(=O)O)cs1 44867226 PIBAFKVVGZMLFO-QPEQYQDCSA-N 341.392 3.436 50 40 EGGB COc1cccc(OC)c1/C(C)=N/NC(=O)Cc1ccc(C)cc1C 20195532 DZKJHEIWOPKDKT-RCCKNPSSSA-N 340.423 3.404 50 40 EGGB Cc1ccc(SCCOc2ccccc2/C=N/NC(N)=O)cc1 4603558 JKGJVJRAEJJCLF-XDHOZWIPSA-N 329.425 3.168 50 40 EGGB C/C(=N\NC(=O)NC1CCCC1)c1c(C)nn(-c2ccccc2)c1C 98055565 NRMZYUPRVLVNHL-FYJGNVAPSA-N 339.443 3.455 50 40 EGGB COc1ccc(C(=O)NN)cc1COc1ccccc1C(C)(C)C 224165211 FXTMHJCBRYNNPD-UHFFFAOYSA-N 328.412 3.175 50 40 EGGB Cc1cccc(/C=C(\C#N)c2nc(=N)[nH]c(=Nc3ccccc3)[nH]2)c1C 584906783 HTUIBMWEOCQSGU-LFIBNONCSA-N 342.406 3.131 50 40 EGGB COc1cccc(/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)c1 15227077 FIYZDGPQZAYAOZ-BOPFTXTBSA-N 345.402 3.442 50 40 EGGB Cc1cc(=O)oc2cc(OC(=O)N(CCCl)CCCl)ccc12 1734896 NAFZWYVSUFHOHU-UHFFFAOYSA-N 344.194 3.380 50 40 EGGB COc1ccc(CCNC(=O)NNc2ccccc2Cl)cc1OC 12867936 SBADYILQJPIQSM-UHFFFAOYSA-N 349.818 3.226 50 40 EGGB CCc1ccc(-c2n[nH]cc2/C=C(/C#N)C(=O)NCc2ccco2)cc1 5526038 KOKLVRDRVIGRMJ-YBEGLDIGSA-N 346.390 3.455 50 40 EGGB C=CCc1cc(/C=C(/C#N)C(=O)NC(C)C)cc(OCC)c1OC 408771671 AFNHHGUDUPZZNR-YBEGLDIGSA-N 328.412 3.254 50 40 EGGB Cc1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)n(C2CCCC2)n1 253399141 IMIUQKKPRKORLR-KRWDZBQOSA-N 338.411 3.121 50 40 EGGB C[C@H](Oc1cccc(Cl)c1)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 3167217 FJJPNLVZUIQNBS-HPAYWCODSA-N 347.758 3.166 50 40 EGGB O=C(Cc1cccc2ccccc12)N/N=C/c1cccc([N+](=O)[O-])c1O 221060 YYMMKHOCXONRNK-UDWIEESQSA-N 349.346 3.146 50 40 EGGB O=C(N/N=C/c1ccc(Br)cc1)c1ccc([N+](=O)[O-])cc1 225877 LMSKQPRBDQAIRT-CXUHLZMHSA-N 348.156 3.121 50 40 EGGB COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](C)Cl 35186625 XDBJUXZFTMVWEX-MRVPVSSYSA-N 325.714 3.296 50 40 EGGB CCCN(CCC)C(=O)c1ccc(NC(=O)CBr)cc1 35605242 XVROIBAFOXPFQX-UHFFFAOYSA-N 341.249 3.282 50 40 EGGB Cc1cc([N+](=O)[O-])ccc1NC(C#N)=C1C(=O)c2ccccc2C1=O 4342376 HWTCMURDSKKCLB-UHFFFAOYSA-N 333.303 3.172 50 40 EGGB Cc1ccc(C)c(CC(=O)N/N=C/c2cc3c(cc2Cl)OCO3)c1 409365673 RKKOLHIFVATPJS-AWQFTUOYSA-N 344.798 3.378 50 40 EGGB COc1cc(/C=N\NC(=O)Cc2ccc(C)cc2C)cc(Cl)c1O 216041610 TWYFIWHNMSDJQI-JMIUGGIZSA-N 346.814 3.364 50 40 EGGB O=C(N/N=C1/CCc2ccccc2C1)N/N=C1\CCc2ccccc2C1 17224069 PQJQIEQYWXYVAC-XOODDYIFSA-N 346.434 3.375 50 40 EGGB Cc1nn(C)c(C)c1CC(=O)NN(Cc1ccccc1)c1ccccc1 32256262 SCLPUCYPNFSUBX-UHFFFAOYSA-N 348.450 3.317 50 40 EGGB CCCCCC(=O)N/N=C/c1cc(Br)c(O)c(OC)c1 2097870 NPMUVQSLTXRFKY-CXUHLZMHSA-N 343.221 3.194 50 40 EGGB COc1cccc(NC(=O)/C(C#N)=C\c2ccc(N3CCCC3)o2)c1 408851783 GCEBUSWCKWVVQS-KAMYIIQDSA-N 337.379 3.434 50 40 EGGB N#C/C(=C/c1ccc2c(c1)OCO2)C(=O)NCCCc1ccccc1 409242640 RXSNCWOPLABJGD-BOPFTXTBSA-N 334.375 3.071 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)Nc2ccc(C)cc2)cc(OC)c1O 6212638 GORVUATVEDZBPF-ZSOIEALJSA-N 338.363 3.264 50 40 EGGB C[C@H](SCc1ccccc1)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 5362355 BDZYQRXXSHWLFY-FHXOWUIVSA-N 343.408 3.367 50 40 EGGB O=C(C(Cl)Cl)N(CCO)CCc1ccc(Cl)cc1Cl 1614589 OZMOAFCMPMKVGI-UHFFFAOYSA-N 345.053 3.161 50 40 EGGB COc1ccc(/C=N/NC(=O)CSc2nc3ccccc3o2)cc1 552024 BDCOIUVITCPAGH-VCHYOVAHSA-N 341.392 3.079 50 40 EGGB C/C(N)=C(\C#N)C(=O)CSc1nnc(Nc2ccc(C)cc2)s1 104671686 ZEWBMUWFOVDSKF-BENRWUELSA-N 345.453 3.008 50 40 EGGB COc1ccc(/C=N/NC(=O)CSCc2ccccc2)c(OC)c1 20248930 BXRZBMMNVANBAO-YBFXNURJSA-N 344.436 3.087 50 40 EGGB CCn1c(C)cc2c(c1=O)[C@@H](c1ccccc1Cl)C(C#N)=C(N)O2 2204427 ICLKZKASWHEWMK-HNNXBMFYSA-N 341.798 3.048 50 40 EGGB CCn1c(C)nc2cc(C(=O)N/N=C/c3ccc(C#N)cc3)ccc21 3340909 CUPDLBYKDAVVJP-CIAFOILYSA-N 331.379 3.000 50 40 EGGB COC(=O)c1ccc(/C=C(/C#N)C(=O)NCCCc2ccccc2)cc1 409238789 BNOGQMANEAZYBX-RGEXLXHISA-N 348.402 3.129 50 40 EGGB Cc1cccc(NC(=O)COC(=O)/C(C#N)=C\c2ccccc2)c1C 6412805 YWNSDUQZPKDHLL-BOPFTXTBSA-N 334.375 3.392 50 40 EGGB N#C/C(=C/c1ccco1)c1nc2ccc(Br)cc2c(=O)[nH]1 5646696 POWICUAVEWMJLN-TWGQIWQCSA-N 342.152 3.343 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@@H]1c1cccc(F)c1 5095139 HZPWUIZLWHKKFS-OAHLLOKOSA-N 332.338 3.434 50 40 EGGB C#CCn1cc(/C=N/NC(=O)Cc2ccc(C)cc2)c2ccccc21 512018 LYLZJEFIEMWZNH-HYARGMPZSA-N 329.403 3.276 50 40 EGGB CN1C[C@@H](C(C)(C)C)CO[P@@]1(=O)N(CCCl)CCCl 5640550 QXKUWRBLVIWSBG-NSPYISDASA-N 331.224 3.498 50 40 EGGB O=C(N[C@H](CCl)C(=O)O)OCC1c2ccccc2-c2ccccc21 2386111 NICWPULFDZCIBU-MRXNPFEDSA-N 345.782 3.217 50 40 EGGB COc1ccc(Br)cc1/C=C(\C#N)C(=O)NC1CCCC1 2769085 XAGDURLPEXGSJO-XYOKQWHBSA-N 349.228 3.423 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)c2c(C)nc3ccc(C)cn23)cc1 2075829 HVNTZNXMVUPDAK-CIAFOILYSA-N 348.406 3.280 50 40 EGGB C#CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2)cc1OC 408740560 CDMIKCCIMKOUQW-VBKFSLOCSA-N 332.359 3.253 50 40 EGGB C/C(CC(=O)Nc1cc(C)cc(C)c1)=N\NC(=O)c1ccoc1C 4679505 MEFYYOSECNTGFB-DEDYPNTBSA-N 327.384 3.339 50 40 EGGB CC(=O)N/N=C/c1cn(CC(=O)Nc2cccc(C)c2)c2ccccc12 409008805 IPHGGNACMRVFMD-SRZZPIQSSA-N 348.406 3.058 50 40 EGGB CC/C(=N\NC(=O)COc1ccccc1)c1ccc(OC)c(OC)c1 408855299 CAHJKMVMKKMYBQ-CAPFRKAQSA-N 342.395 3.013 50 40 EGGB COC(=O)/C(C#N)=C1\CC[C@@H](Nc2cccc(C(F)(F)F)c2)N1C 5549844 MWUANIGCVSNLIN-FNDVETGQSA-N 339.317 3.120 50 40 EGGB CC(C)c1ccc(NC(=S)NNC(=O)c2ccccc2O)cc1 6514619 WDRWQQGHJQMBBW-UHFFFAOYSA-N 329.425 3.147 50 40 EGGB COc1ccc(C)cc1NC(=O)/C(C#N)=C/c1ccc2c(c1)OCO2 408801329 VGKCXKAVCBCWLY-RIYZIHGNSA-N 336.347 3.278 50 40 EGGB COc1ccc(/C=N/NC(N)=O)cc1OCc1cccc2ccccc12 408879161 CSAFCYJGJDSEDO-WSDLNYQXSA-N 349.390 3.430 50 40 EGGB N#C/C(=C\c1ccc(-c2ccccc2Cl)o1)C(=O)N1CCOCC1 134246 KPMUIRMEYRWHAM-ACCUITESSA-N 342.782 3.366 50 40 EGGB O=c1c2ccccc2nc(CBr)n1-c1ccccc1F 28443481 IXHZDHXTPVRHGB-UHFFFAOYSA-N 333.160 3.420 50 40 EGGB CC(C)N1C(=O)/C(=N\NC(=O)c2ccccc2Cl)c2ccccc21 102946508 UOBRQONTJMWVCW-SILNSSARSA-N 341.798 3.229 50 40 EGGB O=C(Cn1cnc2ccccc21)N/N=C/c1c(O)ccc2ccccc12 573943 SLQABMQYXZRVFI-SSDVNMTOSA-N 344.374 3.045 50 40 EGGB CC(=O)Nc1ccc(C2=NN(C(=O)CCl)[C@H](c3ccco3)C2)cc1 23175895 IMTVYULEFDSSKG-HNNXBMFYSA-N 345.786 3.155 50 40 EGGB CCCCCOc1ccc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc1 26688694 PVHAAQPKDLXVJE-XEYRCQSKSA-N 342.439 3.458 50 40 EGGB Cc1cc(/C=C/C(=O)NNc2ncccn2)c(C)n1-c1ccccc1 44716561 AXLSSLGAMMJHAN-MDZDMXLPSA-N 333.395 3.041 50 40 EGGB Cc1cc(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C)C3)c(C)o1 5272564 WPMDSXWOIONQMB-VIFPVBQESA-N 332.425 3.158 50 40 EGGB CC(C)(C)C1CCC(=NNC(=O)C(=O)NCCc2ccccc2)CC1 4699485 WJOJMDGRSCWVDG-UHFFFAOYSA-N 343.471 3.054 50 40 EGGB COc1ccc(OC)c(/C=N/NC(=O)c2ccc(C)cc2Cl)c1 4827494 IDQDJOSSJCSRJZ-VXLYETTFSA-N 332.787 3.430 50 40 EGGB CC(C)(C)OC(=O)N[C@@]12CC[C@@H]([C@@H](Br)C1=O)C2(C)C 256050125 CTXVRIFBVMUAMT-QIBSRJKCSA-N 332.238 3.032 50 40 EGGB COc1cccc(/C=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 486685 QVBGSQKIPDPVBQ-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB COc1c(F)cc(CBr)cc1I 575726984 VRFKFDRWVHALRU-UHFFFAOYSA-N 344.949 3.334 50 40 EGGB C/C(=N/NC(=O)C(=O)Nc1ccccc1Cl)c1ccc(C)cc1 7076917 BDGCKPOAIDQYIS-NDENLUEZSA-N 329.787 3.127 50 40 EGGB O=C(COc1ccc(Cl)cc1)N/N=C/c1ccc(N2CCCC2)o1 59138229 NUGOMXONCFXFRH-YBFXNURJSA-N 347.802 3.062 50 40 EGGB Cc1nn(C)c(C)c1/C(C#N)=C(/C(C#N)=C(C#N)C#N)c1ccccc1 100567909 NELQLPORNSAACF-CZIZESTLSA-N 338.374 3.339 50 40 EGGB O=C(N/N=C/c1ccc(O)c(Cl)c1)c1ccc(N2CCCC2)cc1 7385764 WAUSHBBHQNPGAN-UDWIEESQSA-N 343.814 3.410 50 40 EGGB O=C(NNc1ccc(F)cc1)C(O)(c1ccccc1)c1ccccc1 251367 PIPVOFMJJOGKIV-UHFFFAOYSA-N 336.366 3.205 50 40 EGGB COc1ccc(/C=N/NC(=O)CSc2ccc(C)cc2)c(OC)c1 8515494 KMLYXMJEGPFFOI-YBFXNURJSA-N 344.436 3.255 50 40 EGGB CC(=O)n1cc(/C=C/C=N/NC(=O)c2cccc(O)c2)c2ccccc21 1883937 RCFRVJPHSGENGR-LCISEVAWSA-N 347.374 3.436 50 40 EGGB Cc1cc2c(c(=O)n1CCc1ccccc1)[C@@H](C(C)C)C(C#N)=C(N)O2 2231087 KUPVBGDOEINQAG-SFHVURJKSA-N 349.434 3.225 50 40 EGGB O=C(NNC(=O)C1CC1)c1cc(-c2cccs2)nc2ccccc12 12863431 QDGRNBARKIBMIO-UHFFFAOYSA-N 337.404 3.134 50 40 EGGB COC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccncc1 6579098 BBIXSJLUSMGZGM-PTNGSMBKSA-N 330.347 3.014 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)CCc2ccccc2)cc1OC 409120199 YPTAGWBTZKDGIJ-RCCKNPSSSA-N 338.407 3.343 50 40 EGGB CC[C@@H](C)Oc1c(Br)cc(/C=N/NC(C)=O)cc1OC 409013360 URPBXBBXTAAPHT-PTPOTIKZSA-N 343.221 3.105 50 40 EGGB CCOc1ccc(C(=O)NN)cc1COc1ccc(Cl)c(C)c1 224539362 HZZQZASKBVMRFU-UHFFFAOYSA-N 334.803 3.230 50 40 EGGB Cn1cccc1/C=N\NC(=O)COc1ccc(-c2ccccc2)cc1 98035278 UXDAXOLPFCSDOO-STZFKDTASA-N 333.391 3.221 50 40 EGGB CCCCCCCCCCC(=O)NNC(=S)NC[C@@H]1CCCO1 97941868 PAKWXSNTQVNMAZ-HNNXBMFYSA-N 343.537 3.192 50 40 EGGB COc1cc(OC)cc(C(=O)N/N=C/c2ccccc2OC(C)C)c1 581158 NTZXMSNGUDDIOT-UDWIEESQSA-N 342.395 3.255 50 40 EGGB O=C(C(=O)c1ccc2c3c(cccc13)C(=O)OC2=O)c1ccccc1 98001334 WHEBEAWZUKSPQK-UHFFFAOYSA-N 330.295 3.216 50 40 EGGB CN1c2ccccc2N2C[C@](C)(CI)S[C@@H]12 4868293 IGTPWOWACKHSLZ-RYUDHWBXSA-N 346.237 3.167 50 40 EGGB CCOc1ccc([C@H]2C(C#N)=C(N)Nc3nc4ccccc4n32)cc1 55175186 BQBXPPRMJHGRGX-KRWDZBQOSA-N 331.379 3.144 50 40 EGGB C[C@H](NNC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccccc1 510049 YONWRNBFIOUGTM-KRWDZBQOSA-N 346.430 3.305 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)[C@@H](C)NC(=O)c2ccccc2)cc1 2711725 PHZRBIAPXLHJAL-NWGMWSOJSA-N 337.423 3.079 50 40 EGGB Cc1ccc(S(=O)(=O)C/N=C(/N=C=S)c2ccccc2)cc1 102623341 JUIKQMIQIYUPGM-FBMGVBCBSA-N 330.434 3.276 50 40 EGGB Cc1ccc(C)n1NC(=O)/C(C#N)=C\c1cc([N+](=O)[O-])ccc1Cl 409386308 MKZVXOXNPGDCQL-QPEQYQDCSA-N 344.758 3.344 50 40 EGGB COc1ccccc1OCC(=O)N/N=C(\C)c1ccc(Cl)cc1 5370086 DXHFENHXBWOQDK-XDHOZWIPSA-N 332.787 3.268 50 40 EGGB COc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccccc2)c(OC)c1 313746 DQAJRZCFRLPQGN-HCZVKUGISA-N 344.436 3.335 50 40 EGGB O=C(N/N=C/c1ccc(Br)cc1)c1ccccc1[N+](=O)[O-] 342599 DAHVXJRACJDXBM-CXUHLZMHSA-N 348.156 3.121 50 40 EGGB COc1ccc(CCCC(=O)NN=Cc2ccc(N(C)C)cc2)cc1 6272852 JXCBLTGXAVSAOQ-UHFFFAOYSA-N 339.439 3.234 50 40 EGGB C[C@H](Sc1ncccn1)C(=O)/C(C#N)=C1/Nc2ccccc2S1 102349532 IQBBAYNNODJIKQ-NVRAKJRWSA-N 340.433 3.479 50 40 EGGB CCOc1ccc(/C=N/NC(=O)COc2cc(C)cc(C)c2)cc1 3038584 HTXQLXPNRJGYIQ-UDWIEESQSA-N 326.396 3.231 50 40 EGGB O=C1C[C@]2(C[C@@H](Cl)N=N2)C(=O)N1c1cc(Cl)cc(Cl)c1 5150025 VKUPXVAZFTYJHJ-JOYOIKCWSA-N 332.574 3.416 50 40 EGGB CSc1ccc([C@H]2C(C#N)=C(N)N(C)C3=C2C(=O)CCC3)cc1 409129996 SXDLLCSSKDXTBW-INIZCTEOSA-N 325.437 3.138 50 40 EGGB Cc1ccc2nc(C)c(C(=O)N/N=C/c3ccccc3Cl)n2c1 408979611 NHCYHRYTCLDRAZ-DJKKODMXSA-N 326.787 3.368 50 40 EGGB C=CCc1ccccc1OCCOc1ccc(/C=C(\C#N)C(N)=O)cc1 41108877 BMBVLDQWXMPMPB-NBVRZTHBSA-N 348.402 3.265 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2ccc(F)cc2)cc1OCC 290372 MFDLTLREMIDDRW-UDWIEESQSA-N 330.359 3.387 50 40 EGGB CCOC(=O)/C(C#N)=C(\NCc1ccc(Cl)nc1)SC(C)C 20478076 SQWWUEVGGRYQNT-WYMLVPIESA-N 339.848 3.264 50 40 EGGB O=C(Cc1ccccc1)N/N=C/c1ccc(N2CCCC2)c(F)c1 409086792 HBJZZXVALFXXKU-KGENOOAVSA-N 325.387 3.119 50 40 EGGB CCc1ccc(/C=N\NC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3)C2)cc1 33896396 HEOORIMEZOPHAG-FPJJECCMSA-N 349.434 3.061 50 40 EGGB CCOc1cc(C(=O)NN)cc(Cl)c1OCc1ccc(C)cc1 216836300 YNJHNROIIQBNMR-UHFFFAOYSA-N 334.803 3.230 50 40 EGGB Cc1ccc(C(=O)N/N=C2\C(=O)N(CC(C)C)c3ccc(C)cc32)cc1 16035444 ZOIVWIFBSAHANK-QOCHGBHMSA-N 349.434 3.440 50 40 EGGB COc1ccc(OCC(=O)N/N=C(\C)CCc2ccccc2)cc1 8182484 RDMZEQQERCGUCA-HMMYKYKNSA-N 326.396 3.199 50 40 EGGB CCCSC1=C(C#N)[C@@H](c2ccc(O)c(OCC)c2)CC(=O)N1 4853349 MERBESJERSGMSD-GFCCVEGCSA-N 332.425 3.273 50 40 EGGB COc1ccc(N2C(S)=C(C#N)C(=O)N[C@H]2c2cccs2)cc1 352244 QDXYWUYNJODACL-CQSZACIVSA-N 343.433 3.057 50 40 EGGB O=C(N/N=C/c1cc(Cl)c2cccnc2c1O)c1cccc(F)c1 59459099 IWFGVFSBLGBXTP-ZVBGSRNCSA-N 343.745 3.497 50 40 EGGB CC1(C)C(C#N)=C(SCc2cccc(F)c2F)NC(=O)[C@H]1C#N 8543092 CMMWLZNDIWBRJF-SNVBAGLBSA-N 333.363 3.229 50 40 EGGB CC1(C)COc2ccc(C(=O)N/N=C\c3ccc(F)cc3)cc2OC1 225368335 MNOWUSTVFZVDIQ-FBHDLOMBSA-N 342.370 3.387 50 40 EGGB Cc1cc(C)n(Cc2cccc(C(=O)N/N=C/c3ccc(O)cc3)c2)n1 130563 LIAHXTIWGVSHOU-CIAFOILYSA-N 348.406 3.018 50 40 EGGB COc1c(I)cccc1CBr 238417878 MSMQSKLOMTYESW-UHFFFAOYSA-N 326.959 3.195 50 40 EGGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)c2cccc(Cl)c2)c1 8043135 XOJTYDNVEDZBAS-RGVLZGJSSA-N 329.787 3.452 50 40 EGGB O=C(CCC(=O)Nc1ccc(Cl)cc1)N/N=C/c1ccccc1 3149114 SZBINZLVMJKCMY-XDHOZWIPSA-N 329.787 3.209 50 40 EGGB COc1ccc(-n2nc3c(c2NC(=O)CCCl)CSC3)cc1 3892347 IGRRBPIFGDUXOY-UHFFFAOYSA-N 337.832 3.195 50 40 EGGB O=C(CSc1ccc(Cl)cc1)N/N=C/c1ccc([N+](=O)[O-])o1 2570968 OUVSQCKQHXQLBC-VIZOYTHASA-N 339.760 3.084 50 40 EGGB Cc1c2c([nH]c(=O)c1C)C=C[C@@H](Br)[C@@H]2Br 1700657 BZLNSIIGHANXHH-XCBNKYQSSA-N 333.023 3.218 50 40 EGGB Cc1ccc(-c2cc(C(=O)NNc3ncccn3)c3ccccc3n2)o1 44715805 XZCVWRBXNFQKRT-UHFFFAOYSA-N 345.362 3.350 50 40 EGGB N#CCC(=O)N/N=C\c1ccc2c(ccn2Cc2cccc(F)c2)c1 409239172 GUHFJTFPQPGZMJ-UUYOSTAYSA-N 334.354 3.192 50 40 EGGB CCn1c(C)nc2cc(C(=O)NNC(=O)CCC3CCCC3)ccc21 3337659 IMTBMHFCFPHBFM-UHFFFAOYSA-N 342.443 3.096 50 40 EGGB Cc1noc(C)c1CC(=O)NNc1ccnc2cc(Cl)ccc12 8721480 BSGXYZDKRMGGQN-UHFFFAOYSA-N 330.775 3.179 50 40 EGGB CSc1ccc(/C=N/NC(=O)c2c(C)nc3cc(C)ccn23)cc1 409008697 ACXNJRBFQAHNTP-YBFXNURJSA-N 338.436 3.437 50 40 EGGB COc1ccccc1N[C@@H](C)C(=O)N/N=C(\C)c1ccc(C)cc1 5798792 PPIIADHXFFOZDK-HBBMIWKISA-N 325.412 3.344 50 40 EGGB COc1cccc(/C=N/NC(=O)Cc2cccc3ccccc23)c1O 59704 ZVLZRQMEJUEBGG-FYJGNVAPSA-N 334.375 3.247 50 40 EGGB CC1=C(C(=O)OCc2ccccc2)[C@H](c2ccoc2)C(C#N)=C(N)O1 809311 VMZQTAYAGNYZQQ-QGZVFWFLSA-N 336.347 3.105 50 40 EGGB COc1ccc(/C=C(/C#N)C(N)=O)cc1OCc1ccccc1Cl 35019389 CLOYRYLFKPQIRW-ZSOIEALJSA-N 342.782 3.320 50 40 EGGB CN(C)c1cccc(C(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)c1 409073166 XVSBPRKQQZAUEO-VCHYOVAHSA-N 346.774 3.078 50 40 EGGB COc1cccc(/C=N/NC(=O)COc2ccccc2C(C)C)c1O 133672 XLMAVKMKZCIPNH-RGVLZGJSSA-N 342.395 3.053 50 40 EGGB COc1ccc(OCCN(CCCl)CCBr)cc1 1657376 FWBPMPFDEHINOM-UHFFFAOYSA-N 336.657 3.010 50 40 EGGB Cc1cccc(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)c1 107364187 NTSHMNJRUSYROB-WSDLNYQXSA-N 343.386 3.259 50 40 EGGB O=C(Cc1ccc2ccccc2c1)NNC(=O)c1ccc2c(c1)CCC2 10217285 HOXIDRHYZJWKAS-UHFFFAOYSA-N 344.414 3.332 50 40 EGGB O=C(N/N=c1/c(=O)c2cccc3cccc1c32)c1ccc(Cl)cc1 5163276 NFLMKMJDUCVJOE-HEHNFIMWSA-N 334.762 3.128 50 40 EGGB aggregator CC[C@H](C)NC(=O)/C(C#N)=C/c1ccc(OC)c(Br)c1 408812360 LQPBBWPUJGMBDA-QVIVLVACSA-N 337.217 3.279 50 40 EGGB CCCOc1ccc(C(=O)N/N=C(\C)c2c(O)cccc2O)cc1 216069770 HMFUWXBJVARYMC-XDHOZWIPSA-N 328.368 3.041 50 40 EGGB COC(=O)c1ccccc1-c1ccc(/C=N/NC(=O)c2ccco2)o1 563141 SHIMRXPKOFXYFM-YBFXNURJSA-N 338.319 3.090 50 40 EGGB COc1cc(/C=N/NC(=O)CSCc2ccc(C)cc2)ccc1O 59473261 NRLXFQHXEMCUMW-VXLYETTFSA-N 344.436 3.093 50 40 EGGB COCOc1ccccc1P(=O)(c1ccccc1)c1ccccc1 68592193 YLTFFLIKPWPQTG-UHFFFAOYSA-N 338.343 3.309 50 40 EGGB N#C/C(=C/c1ccc(-c2ccc(C(=O)O)c(Cl)c2)o1)C(N)=S 16385914 FNMVESQIGLRHIZ-UITAMQMPSA-N 332.768 3.491 50 40 EGGB Cc1ccc(C)n1-c1cccc(C(=O)NNC(=S)NC(C)(C)C)c1 408586675 POQZSZZTWUKZRR-UHFFFAOYSA-N 344.484 3.002 50 40 EGGB O=C(N/N=C/c1cccc2ccccc12)c1cccc([N+](=O)[O-])c1O 409092122 VIQVLWCCHHTYFH-YBFXNURJSA-N 335.319 3.218 50 40 EGGB CCOc1cc(/C=N/NC(=O)[C@H](C)Oc2ccc(C)cc2)ccc1O 93867 MVUBCCAFGLMMOL-PVGUKEHMSA-N 342.395 3.017 50 40 EGGB CCn1c(C)nc2cc(C(=O)N/N=C/c3ccc(OC)cc3)ccc21 3196475 VXSSQKBQBRYTID-UDWIEESQSA-N 336.395 3.137 50 40 EGGB O=C(N/N=C/c1ccc(Br)s1)c1cccc(F)c1 6331289 FZGSJEZTJULKQT-VIZOYTHASA-N 327.178 3.414 50 40 EGGB CCOC(=O)C1=C(C)OC(n2cccc2)=C(C#N)[C@@H]1c1cccnc1 4708331 AAHGSMVOKLFYEE-KRWDZBQOSA-N 335.363 3.226 50 40 EGGB COC(=O)/C(=N\Nc1ccc(-c2ccccc2)cc1)C(=O)CCl 5753134 IYUNDWNVLVWTEO-SILNSSARSA-N 330.771 3.102 50 40 EGGB COc1ccc(CSCC(=O)N/N=C(\C)c2ccccc2O)cc1 59473763 XHTCUTFFVBLUOJ-CPNJWEJPSA-N 344.436 3.174 50 40 EGGB Cc1cc(C)nc(NNC(=O)c2cccnc2SC2CCCC2)n1 54834651 YESNUYJJPRLXCD-UHFFFAOYSA-N 343.456 3.280 50 40 EGGB CCc1ccccc1NC(=O)/C(C#N)=C\c1ccc(O)c([N+](=O)[O-])c1 408904925 QMQRVCXUAQFGBC-ZROIWOOFSA-N 337.335 3.408 50 40 EGGB COc1cccc(C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)c1 69815691 DQNSYBHUVPIYCA-UHFFFAOYSA-N 344.758 3.156 50 40 EGGB CC(=O)N[C@@H](CC(=O)Oc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 11326940 GCIWGRXYYRYGQE-KRWDZBQOSA-N 342.351 3.076 50 40 EGGB OC[C@@H](Br)C[C@](F)(Cl)C(F)(F)Br 16159152 ZXCKYRIOJOZVFC-IUYQGCFVSA-N 334.357 3.025 50 40 EGGB O=C(NNC(=O)C(c1ccccc1)c1ccccc1)c1cccs1 320263 DTTHAFLWMONYSH-UHFFFAOYSA-N 336.416 3.341 50 40 EGGB Cc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2cccnc2)cc1 492395 KZCPKLHLOOHYKK-SFHVURJKSA-N 343.390 3.102 50 40 EGGB N#CC1=C(N)N=C(Sc2ccccc2)C2=C(N)Oc3ccccc3[C@H]12 20102571 RRWFLRIXBCTSKI-OAHLLOKOSA-N 346.415 3.231 50 40 EGGB O=C(N/N=C\C(Br)=C\c1ccccc1)c1ccccn1 5010086 SMEPYGYOHRXIGF-OPSIFPOWSA-N 330.185 3.233 50 40 EGGB COc1ccc(OCC(=O)N/N=C/c2ccc(C)c(C)c2C)cc1 408863130 LLCLRYKLXUJPAG-RGVLZGJSSA-N 326.396 3.150 50 40 EGGB Cc1ccc(-c2n[nH]cc2/C=C(/C#N)C(=O)NCc2ccco2)cc1 5728617 IKJDULOIJDKXEJ-DHDCSXOGSA-N 332.363 3.202 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@@H]2C[C@@H]2c2ccccc2)c(OC)c1 12362270 NPCYDLPFUVOBHH-QIBHQFNGSA-N 338.407 3.348 50 40 EGGB COc1ccc(Cl)cc1/C=N/NC(=O)COc1c(C)cccc1C 60100 YHFXOXPIPVLLKF-KEBDBYFISA-N 346.814 3.495 50 40 EGGB O=C(NNC(=S)NCCCc1ccccc1)c1cccc(Cl)c1 408585702 IKOKPRISDVCRMO-UHFFFAOYSA-N 347.871 3.082 50 40 EGGB BrCCCOc1cccc(I)c1 36904198 LZYAADAPQLXKRV-UHFFFAOYSA-N 340.986 3.455 50 40 EGGB CC(C)(C)OC(=O)N[C@H]1CCCC[C@@H]1N(C(=O)CCl)C1CC1 79392600 GFWXAAPRUTZVMC-STQMWFEESA-N 330.856 3.052 50 40 EGGB COc1ccc(C(=O)N/N=C/c2c(F)cccc2Cl)cc1OC 5361109 QZCXBHRIGGLFNS-DJKKODMXSA-N 336.750 3.260 50 40 EGGB O=C(CN1C(=O)c2cccc3cccc1c23)N/N=C/c1ccc(F)cc1 107920024 PZNBSGLAKGQSIQ-SSDVNMTOSA-N 347.349 3.089 50 40 EGGB C/C(N)=C(\C#N)C(=O)COC(=O)c1c2ccccc2cc2ccccc12 104578079 CXBZMTRJVRDYNE-AQTBWJFISA-N 344.370 3.475 50 40 EGGB COc1ccc(/C(C)=N\NC(=O)COc2cccc(C)c2C)cc1 14010360 TXVNNWGNYPOOHQ-HKWRFOASSA-N 326.396 3.231 50 40 EGGB COc1cccc(CC(=O)N/N=C\c2cccn2-c2ccccc2)c1 33328997 PNDZKIKLEGYAAS-QNGOZBTKSA-N 333.391 3.179 50 40 EGGB CCOc1ccc(C(=O)N/N=C/c2ccc(OCC)c(OC)c2)cc1 6048053 IWFTVVQDQMZKFB-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB CN(c1ccccc1)N(CCC[N+](C)(C)C)C(=O)c1ccccc1 5509968 DVXBNZKKRVCTPE-UHFFFAOYSA-N 326.464 3.277 50 40 EGGB COc1ccc(OC)c(/C=C/C(=O)Oc2ccc([N+](=O)[O-])cc2)c1 6641081 UAOFIWNWNGKSFH-XCVCLJGOSA-N 329.308 3.231 50 40 EGGB C[C@H](Sc1nccs1)C(=O)C(C#N)=C1Nc2ccccc2N1 102388518 MATUGZNBEFUMHV-VIFPVBQESA-N 328.422 3.466 50 40 EGGB O=C(N/N=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccncc1 497750 XLBYBCLYEHFMDM-YBFXNURJSA-N 336.307 3.014 50 40 EGGB C=CCc1cccc(/C=N/NC(=O)c2ccc(Br)o2)c1O 3175847 PBXPUGCFPYVLHE-RQZCQDPDSA-N 349.184 3.240 50 40 EGGB CC(=O)n1cc(/C=C/C=N/NC(=O)c2ccncc2)c2ccccc21 1881906 JUAPZVOUXMOMPJ-NUBCJFHVSA-N 332.363 3.125 50 40 EGGB CCc1[nH]nc2c1[C@@H](c1ccc(OC)c3ccccc13)C(C#N)=C(N)O2 8382690 HUXVNNSODJEMBU-KRWDZBQOSA-N 346.390 3.352 50 40 EGGB N#C/C(=C/c1c[nH]nc1-c1ccccc1)C(=O)Nc1ccccc1O 4113124 VEXKKYDLGZHPDY-UVTDQMKNSA-N 330.347 3.328 50 40 EGGB C[C@@H](Br)C(=O)NC[C@H](OCC1CC1)c1cccc(F)c1 95097939 MKRMIZKGIWOFKC-YGRLFVJLSA-N 344.224 3.193 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)CSc2ccccn2)cc1 195885 XYTSTFMMWIQRML-DEDYPNTBSA-N 342.468 3.170 50 40 EGGB COc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)cc1Cl 555587 SFNIEGIQQIPXNJ-OAHLLOKOSA-N 330.771 3.163 50 40 EGGB O=C(COc1cccc2cccnc12)N/N=C/c1ccc(Cl)cc1 59503456 GJUKTKWUCNZKDE-SRZZPIQSSA-N 339.782 3.417 50 40 EGGB N#C/C(=C\c1c[nH]c2ccccc12)C(=O)Nc1ccc2c(c1)OCCO2 3570761 OYQJBUIELLQCHJ-UKTHLTGXSA-N 345.358 3.485 50 40 EGGB C[C@@H](NC(=O)COC(=O)/C(C#N)=C\c1ccccc1)c1ccccc1 6383261 ZPQKYQBNBIVRAS-PWDRBQJJSA-N 334.375 3.014 50 40 EGGB COC(=O)c1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)cc1 4714621 KYZRNQHPVHSHJV-KZKLBEMASA-N 342.420 3.104 50 40 EGGB C/C(=N\NC(=O)Cc1c(O)n[nH]c1C)c1ccc(-c2ccccc2)cc1 56193 FRNICYGKVJXRNL-FYJGNVAPSA-N 348.406 3.174 50 40 EGGB Cc1c(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc2n1C 169880161 FCVYYSOGOWGGKN-YBFXNURJSA-N 336.351 3.159 50 40 EGGB CC1(C)[C@@H]2CC[C@](C(=O)O)(C2)[C@]1(Br)CBr 100319124 OSNJXUXPWZALOC-ONOSFVFSSA-N 340.055 3.426 50 40 EGGB Cc1cc(N(C)NC(=O)c2ccccc2Cl)nc(Cl)c1C#N 12446172 LRAKVSDJRNKBNC-UHFFFAOYSA-N 335.194 3.350 50 40 EGGB CCOc1ccc(/C=N/NC(=O)Cc2ccccc2)c(OCC)c1 562621 ILYWFXBPOXOLJR-XSFVSMFZSA-N 326.396 3.177 50 40 EGGB COCCOc1ccc2nc(NC(=O)CCCCl)sc2c1 20133631 DRRHAXMAGZMFIO-UHFFFAOYSA-N 328.821 3.279 50 40 EGGB CCOc1cc(C=C(C#N)C#N)cc(Br)c1OCC#N 2770730 WLFWEWZRXAQCOF-UHFFFAOYSA-N 332.157 3.181 50 40 EGGB O=c1nc2c3ccccc3nc(CCl)n2nc1-c1ccc(F)cc1 75093425 JQVXHGHHEUTZJZ-UHFFFAOYSA-N 340.745 3.183 50 40 EGGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)c1ccccc1-n1cccc1 137738 UBILPQVWDOUXCZ-CPNJWEJPSA-N 334.335 3.149 50 40 EGGB COc1ccc(Br)cc1/C=N/NC(=O)OC(C)(C)C 3574718 NTUPQPMRIFASLQ-OVCLIPMQSA-N 329.194 3.316 50 40 EGGB O=C(CCl)Nc1cc2c(cc1C(=O)c1ccccc1F)OCCO2 4723331 UAVUWCJKBWKPDJ-UHFFFAOYSA-N 349.745 3.005 50 40 EGGB CC1(C)CC(=O)[C@H](C(=O)/C=C/c2ccccc2)C(=O)[C@H]1Br 104832360 FTZWJPQHMYAASF-FNHJVCLDSA-N 349.224 3.217 50 40 EGGB COc1ccc(/C=N/NC(=O)Cc2ccc(C)c(C)c2)c(OC)c1 409181238 ABPAWJSPPSTEGE-UDWIEESQSA-N 326.396 3.013 50 40 EGGB C[C@@H](SCc1ccccc1)C(=O)N/N=C/c1ccc(N(C)C)o1 408995030 KVNLBKYAFQDPIO-VBEHJTROSA-N 331.441 3.118 50 40 EGGB COc1cccc(NC(=O)/C(C#N)=C/c2ccc(OC)c(OC)c2)c1 16409804 JAEUYDJNYVPHJP-NTEUORMPSA-N 338.363 3.258 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)Cc2ccc(OC)cc2)cc1 3086457 HIDDKZDUIWRIRR-XSFVSMFZSA-N 326.396 3.177 50 40 EGGB COc1cccc([C@@H]2C(C#N)=C(N)OC(C(C)(C)C)=C2C#N)c1OC 351746 GLTPNGXYNFBALE-HNNXBMFYSA-N 339.395 3.335 50 40 EGGB O=C(NNC1=C(C(=O)C(F)(F)F)CCC1)c1ccccc1Cl 4600451 YCHSQFRGXDZGCB-UHFFFAOYSA-N 332.709 3.144 50 40 EGGB O=C1C[C@@]2(C[C@@H](Cl)N=N2)C(=O)N1c1ccc(Cl)c(Cl)c1 5191203 VUUQJZSASNQOEH-CABZTGNLSA-N 332.574 3.416 50 40 EGGB COc1ccccc1C(=O)N/N=C/c1cccc(Br)c1 5527565 NNTRATOQIXMGRS-LICLKQGHSA-N 333.185 3.222 50 40 EGGB Cc1cccc(C(=O)OC[C@@H](Br)CBr)c1 1676101 KZAODDITVCXJAC-JTQLQIEISA-N 336.023 3.310 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)NCc2ccccc2)cc(Cl)c1O 2742961 NTIHBGKMYWXNAI-VGOFMYFVSA-N 342.782 3.278 50 40 EGGB O=C(NNC(=O)c1sc2ccccc2c1Cl)c1cccnc1 12989853 ZANLVRNOOFWFAF-UHFFFAOYSA-N 331.784 3.025 50 40 EGGB N#C/C(=C\c1cccc(OCc2ccc([N+](=O)[O-])cc2)c1)C(N)=S 408541607 CHRYDHXACYZAQW-RIYZIHGNSA-N 339.376 3.367 50 40 EGGB N#C/C(=C\c1ccc([N+](=O)[O-])o1)C(=O)Nc1nc2ccccc2s1 41078071 TTXRXJBVJDDRCO-VQHVLOKHSA-N 340.320 3.343 50 40 EGGB COc1cc(OC)cc(C(=O)N/N=C/c2ccc(OC(C)C)cc2)c1 582689 IRBRACFMGMLWNA-UDWIEESQSA-N 342.395 3.255 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)c2cc(OC)cc(OC)c2)cc1 8339708 QNFSOUKDNDCOKC-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB CCn1cc(/C=N\NC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21 208366541 SHFGAWRBDUOUPN-ODLFYWEKSA-N 336.351 3.333 50 40 EGGB O=C(N/N=C\c1ccc(N2CCOCC2)cc1)c1cc2ccccc2o1 30809289 DUDKANXJSAKTFE-STZFKDTASA-N 349.390 3.033 50 40 EGGB N#Cc1cccc([C@@H](Br)S(=O)(=O)c2ccccc2)c1 1733329 HTRHSHLIGDKBTK-AWEZNQCLSA-N 336.210 3.426 50 40 EGGB COc1ccc2c(CSCCBr)cc(=O)oc2c1 1872057 OYKGVZVMWHCQEL-UHFFFAOYSA-N 329.215 3.430 50 40 EGGB C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N/N=C/c1cccnc1 491863 YFBUYQFLDYVBQA-XPAGJJBOSA-N 338.194 3.306 50 40 EGGB CC(/C=N\NC(=O)COc1cccc2cccnc12)=C\c1ccco1 409022276 LUTRINSYUBSVEO-XZPMMGAVSA-N 335.363 3.412 50 40 EGGB Cc1ccc(-n2c(=O)c3ccccc3n3c(CCl)nnc23)c(C)c1 408712825 UYMVLJBAGNJNGY-UHFFFAOYSA-N 338.798 3.389 50 40 EGGB COc1ccc(OC)c(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)c1 408798010 DJORIJPPGCTRTO-RIYRZUHRSA-N 328.412 3.306 50 40 EGGB CC(C)COc1ccc(/C=N/NC(=O)[C@H](C#N)c2ccccc2)cc1 409194793 MJDUITCZEQYSMR-PPRFWAEMSA-N 335.407 3.479 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc(C)cc2)c(OC)c1 409366533 VPRCEIZOXXHMJA-XSFVSMFZSA-N 326.396 3.095 50 40 EGGB CC(C)N(C(=O)CCl)C1CCC(NC(=O)OC(C)(C)C)CC1 79392564 LUIXCSYCYVMOGU-UHFFFAOYSA-N 332.872 3.298 50 40 EGGB CC(C)(C)NCC(=O)N/N=C/c1ccc(OCc2ccccc2)cc1 3058176 NJHGUVUHFJNQAG-LPYMAVHISA-N 339.439 3.104 50 40 EGGB CCOC(=O)/C(C#N)=C/c1ccc(N(CCCl)CCCl)cc1 1677655 YLTGBFUWBSXITC-SDNWHVSQSA-N 341.238 3.441 50 40 EGGB Cc1cc(C)nc(NNC(=O)CSCc2ccc(Cl)s2)n1 22234759 GCGTZKOXSFJAEY-UHFFFAOYSA-N 342.877 3.185 50 40 EGGB O=C1c2ccccc2C(=O)N1Cc1ccc(CBr)s1 2525863 FHZITBUKQUYRFS-UHFFFAOYSA-N 336.210 3.439 50 40 EGGB in-vitro O=C(Cl)c1cc([N+](=O)[O-])c(NCc2ccccc2)c([N+](=O)[O-])c1 26508943 SITPTRTXMYEKCU-UHFFFAOYSA-N 335.703 3.494 50 40 EGGB COc1cccc(/C=N/NC(=O)c2c(C)nc3ccc(Cl)cn23)c1 409332605 LACACXQQAKERMD-DJKKODMXSA-N 342.786 3.069 50 40 EGGB CC/C(=N\NC(=O)c1ccc(F)cc1)c1ccc(OC)c(OC)c1 5499138 RPKJENSJCJLCCB-HMMYKYKNSA-N 330.359 3.387 50 40 EGGB O=C(CSc1nc2ccccc2o1)N/N=C/c1cccc(F)c1 535415 NHQJGWOAPNELAD-GIJQJNRQSA-N 329.356 3.209 50 40 EGGB Cc1ccc(C23C[C@H]4C[C@@H](CC(NC(=O)NN(C)C)(C4)C2)C3)cc1 100846202 HFELPSPVCLBGHH-JZFKGDSASA-N 327.472 3.361 50 40 EGGB CCC(=O)Nc1ccc(C(=O)N/N=C(\CC)c2ccc(O)cc2)cc1 4602751 OFOUOOHACYDRDP-HEHNFIMWSA-N 339.395 3.285 50 40 EGGB Cc1ccc(SCCC(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 409112679 FSLSIPXPHINFOL-YBFXNURJSA-N 342.420 3.356 50 40 EGGB CC(C)(C(=O)NNC(=O)c1ccccc1-n1cccc1)c1ccccc1 40049131 UGSUYIJENXAGHA-UHFFFAOYSA-N 347.418 3.216 50 40 EGGB Cc1ccc(-c2ccc(/C=N/NC(=O)CN3CCCC3)o2)cc1Cl 344938 YYQOAOIDYFOEGI-RGVLZGJSSA-N 345.830 3.454 50 40 EGGB Cc1nn(-c2ccccc2)c(Cl)c1/C=N/NC(=O)c1ccoc1C 3219022 BUOPRHPAMBMJDV-VXLYETTFSA-N 342.786 3.499 50 40 EGGB CCOC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccncc1 6401467 RDFIRBRKPFWUMI-VBKFSLOCSA-N 344.374 3.404 50 40 EGGB NC(=O)N/N=C(\C(=S)Nc1ccc(Cl)cc1)c1ccccc1 68572216 CQUFJIOGNVIMOS-UYRXBGFRSA-N 332.816 3.152 50 40 EGGB COc1ccc(-n2cccc2/C=N/NC(=O)c2ccccc2OC)cc1 408954730 UWHWRMPVIKKSIM-KGENOOAVSA-N 349.390 3.258 50 40 EGGB O=C(N/N=C/c1ccc(Cl)cc1)c1cccc(Cn2cccn2)c1 131569 QIFVIUYISAIABL-UDWIEESQSA-N 338.798 3.349 50 40 EGGB O=C1C[C@@]2(C[C@@H](Cl)N=N2)C(=O)N1c1cc(Cl)cc(Cl)c1 5150028 VKUPXVAZFTYJHJ-CABZTGNLSA-N 332.574 3.416 50 40 EGGB N#C/C(C1=N[C@H](c2ccccc2)CO1)=C1/N[C@H](c2ccccc2)CO1 16478436 QVVGSAYHUSBCQV-WPNKJJEUSA-N 331.375 3.253 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@H](c2cccc([N+](=O)[O-])c2)[C@H]2CCCC=C12 19907362 CFCRPALWGIWYGO-DOTOQJQBSA-N 345.362 3.188 50 40 EGGB CCCC1=C(C(=O)OCC)[C@@H](c2ccccc2OC)C(C#N)=C(N)O1 76497 WMHBSSALMXHBOA-INIZCTEOSA-N 342.395 3.120 50 40 EGGB COc1cc(/C=N/NC(C)=O)ccc1OCc1ccc(Cl)cc1 558948 LZUHTQICCTUKRS-VXLYETTFSA-N 332.787 3.398 50 40 EGGB O=C(CCCC[C@@H]1CCSS1)Nc1cccc(-n2cnnn2)c1 42151129 YBCDMAYJOWNURR-CQSZACIVSA-N 349.485 3.315 50 40 EGGB biogenic O=C(N/N=C\c1ccccc1Br)c1ccc([N+](=O)[O-])cc1 16771205 HTGGZRVJUPKXEO-SXGWCWSVSA-N 348.156 3.121 50 40 EGGB BrC[C@@H]1CCCN(c2cccc(Br)n2)C1 79440406 WQGVRSFFTWZNBZ-VIFPVBQESA-N 334.055 3.455 50 40 EGGB COc1ccccc1/C=N/NC(=O)[C@@H](C)SCc1ccccc1 313888 QWFNDTMVMSJIIP-ONDHQXCVSA-N 328.437 3.467 50 40 EGGB N#C/C(=C/c1c[nH]nc1-c1ccccc1)S(=O)(=O)c1ccccc1 29763508 INPBEHSPAQVCGH-BOPFTXTBSA-N 335.388 3.415 50 40 EGGB CC(=O)NN(C(=O)c1ccco1)c1nc2c(Cl)cccc2s1 36357621 GCEBDLPVJWRGHI-UHFFFAOYSA-N 335.772 3.241 50 40 EGGB CC(C)N(CC1CCN(C(=O)CCl)CC1)C(=O)OC(C)(C)C 79408881 CUTBCKOQBMPHGA-UHFFFAOYSA-N 332.872 3.109 50 40 EGGB CCOC(C)(C)C(=O)Nc1ccc(OCCBr)cc1 225647112 KMBYZMRYIHRPKK-UHFFFAOYSA-N 330.222 3.214 50 40 EGGB CCCOc1ccccc1/C=N/NC(=O)COc1ccc(C)cc1 3127230 UVBDTIBEBGLLKC-DEDYPNTBSA-N 326.396 3.313 50 40 EGGB O=C(N/N=C(\c1ccccc1)c1ccncc1)c1ccccc1[N+](=O)[O-] 5946167 MKBUHDVZKIGBCB-DYTRJAOYSA-N 346.346 3.172 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1 13425340 DJTDRRLTLJZTHN-ATVHPVEESA-N 345.402 3.442 50 40 EGGB CC1=C(C#N)[C@H](c2ccco2)C(C(=O)OCc2ccccc2)=C(N)O1 125373 XFWPJFOPBRKWQE-MRXNPFEDSA-N 336.347 3.105 50 40 EGGB O=C(CCc1c[nH]c2ccccc12)N/N=C/c1ccc([N+](=O)[O-])cc1 3110477 ZJKAZSRLFFRLNI-RGVLZGJSSA-N 336.351 3.159 50 40 EGGB C/C(=N\NC(=O)c1ccccc1N)c1ccc(Br)cc1 8572843 RPKNSNLRXCUPSL-VCHYOVAHSA-N 332.201 3.185 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)OCC(=O)c2ccc(F)cc2)cc1 3244266 IKSASXBEACKUEZ-XNTDXEJSSA-N 339.322 3.167 50 40 EGGB O=C(NNC(=O)c1cccc2cccnc12)c1cccc2ccccc12 64509339 GJHZINMPFUYVSP-UHFFFAOYSA-N 341.370 3.463 50 40 EGGB CCOc1ccc(/C=C(\C#N)c2nc3ccccc3c(=O)[nH]2)cc1OC 9359684 RGQGTOLEFZMZKW-GXDHUFHOSA-N 347.374 3.395 50 40 EGGB CN(C)c1ccc(/C=C(\C#N)C(=O)N2CCCC2)cc1Br 409369606 RBMDJVWHWKLPGB-UKTHLTGXSA-N 348.244 3.044 50 40 EGGB COc1cc(Cl)cc(/C=C(\C#N)C(N)=O)c1OCc1ccccc1 36612315 IVPQIEMYHOQQJN-VGOFMYFVSA-N 342.782 3.320 50 40 EGGB O=C(CCCCl)NCc1nn(C2CCCC2)c(=O)c2ccccc12 90531013 TUNRPJUCMYTAQP-UHFFFAOYSA-N 347.846 3.147 50 40 EGGB Cc1cc(SCC(=O)N/N=C/c2ccco2)nc2ccccc12 352342 KBIAAFSORHPISW-VCHYOVAHSA-N 325.393 3.379 50 40 EGGB CCc1ccc(/C(C)=N/NC(=O)c2ccc(OC)cc2OC)cc1 6225137 GASDMBURBPQOOD-DEDYPNTBSA-N 326.396 3.420 50 40 EGGB O=C1Oc2ccc([N+](=O)[O-])cc2N/C1=C/C(=O)c1ccc(Cl)cc1 100091172 OZGBGVNYMVKOCM-MDWZMJQESA-N 344.710 3.346 50 40 EGGB Cc1cc(/C=C(\C#N)C(=O)NCCc2ccccn2)c(C)n1C1CC1 32657365 VXCOCZMJVDEESX-SFQUDFHCSA-N 334.423 3.101 50 40 EGGB CC(C)c1cc(C(=O)NNC(=S)N[C@@H]2C[C@H]3CC[C@@H]2C3)cs1 6390040 WOLDFDYREUJZAJ-DMDPSCGWSA-N 337.514 3.169 50 40 EGGB C=CCSC1=C(C#N)[C@H](c2ccccc2)[C@H](C(=O)OC)C(O)=N1 9088421 KPVWIOKNPVWYNO-KBPBESRZSA-N 328.393 3.184 50 40 EGGB O=C(N/N=C/c1ccc(F)s1)c1cc(-c2ccc(F)cc2)[nH]n1 252504250 VITSNPGYRVWOGD-QGMBQPNBSA-N 332.335 3.180 50 40 EGGB CC[C@H](C)c1ccc(OCC(=O)N/N=C/c2ccccc2O)cc1 1319327 WUEVMJMZLPTARA-PVGUKEHMSA-N 326.396 3.435 50 40 EGGB CNC(=O)/C(C#N)=C/c1ccc(-c2ccc(Cl)c(C(=O)OC)c2)o1 6625918 RLJOSHNQSDKYPU-YRNVUSSQSA-N 344.754 3.040 50 40 EGGB CCOc1cccc(NC(=O)/C(C#N)=C/c2ccc(OC)c(O)c2)c1 408765616 ZAHQVVDOLJPZRA-NTEUORMPSA-N 338.363 3.345 50 40 EGGB O=C(N/N=C/c1ccccc1F)C(O)(c1ccccc1)c1ccccc1 115010 HZNMKQJMTZXVSO-HZHRSRAPSA-N 348.377 3.212 50 40 EGGB O=C1OCC[C@@]1(Br)[C@@H](Br)c1ccccc1 1602844 ROIKPDSNGKFMLY-GXSJLCMTSA-N 334.007 3.203 50 40 EGGB COc1cccc(/C=N/NC(=O)CCSc2ccccc2)c1O 59473322 CHPBICISPYIWLG-LDADJPATSA-N 330.409 3.033 50 40 EGGB Cc1ccc(CSCC(=O)N/N=C/c2ccc(C(=O)O)cc2)cc1 408779517 XNGZOYNAXYNPBX-VXLYETTFSA-N 342.420 3.077 50 40 EGGB COc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)cc1 485298 KUCONNHYRLQINL-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB N#C/C(=C/c1ccccc1)C(=O)Nc1ccc(N2CCOCC2)cc1 2886654 VIADKMSMDRWVEY-VKAVYKQESA-N 333.391 3.069 50 40 EGGB CCOc1ccc(C=NNC(=O)[C@@H](C)Oc2cccc(C)c2)cc1 12411792 FCBYQMIISKGABI-OAHLLOKOSA-N 326.396 3.311 50 40 EGGB CCCOc1ccc(CCC(=O)N/N=C/c2ccc([N+](=O)[O-])o2)cc1 4995615 FENGPQFBSMBXHE-LDADJPATSA-N 345.355 3.060 50 40 EGGB O=C(Cc1ccccc1F)NNC(=O)CC12CC3CC(CC(C3)C1)C2 7689112 JFXLSGPPJLSIBG-UHFFFAOYSA-N 344.430 3.122 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)c2ccccc2)cc1[N+](=O)[O-] 409160372 HJSYCEJMVQHDAO-LDADJPATSA-N 327.340 3.148 50 40 EGGB O=C1C=C(NNC(=O)CCc2ccccc2)C[C@@H](c2ccccc2)C1 408751384 JZQVLGHCPYFAGO-GOSISDBHSA-N 334.419 3.271 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)c2cccnc2)cc1OCC 43776579 UGSYNAIGBOPGSB-UDWIEESQSA-N 327.384 3.033 50 40 EGGB COc1ccc2ccccc2c1/C=N/NC(=O)c1ccc2c(c1)OCO2 3576523 CUDLOGFIPKHESD-SRZZPIQSSA-N 348.358 3.341 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccccc2-n2cccc2)c(OC)c1 7889907 XASNIPUOKSAAMQ-KGENOOAVSA-N 349.390 3.258 50 40 EGGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C(\C)c1ccc(C)c(C)c1 409260596 SPQFVLDPBSWFJY-CPNJWEJPSA-N 341.367 3.374 50 40 EGGB O=C(N/N=C/c1ccc(N2CCCC2)c(F)c1)c1cccc(F)c1 409065568 HPMNWKKSLYLVMA-CIAFOILYSA-N 329.350 3.329 50 40 EGGB COc1ccc(C)cc1NC(=O)/C(C#N)=C/c1ccccc1OCC#N 408813498 XTQPEVYEPHUECJ-FOWTUZBSSA-N 347.374 3.452 50 40 EGGB CCOc1ccc(NNC(=O)NNc2ccc(OCC)cc2)cc1 135925563 IUEYAFHNFZCWSR-UHFFFAOYSA-N 330.388 3.137 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])cc1 60289 UTAIAKBADQMAES-CPNJWEJPSA-N 340.383 3.205 50 40 EGGB COc1cccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1 7689093 AULXTGLLMMNWAR-UHFFFAOYSA-N 342.439 3.063 50 40 EGGB CN(C)c1cccc(C(=O)N/N=C/c2cccn2-c2ccccc2)c1 59249451 WPDZDAIVEKNIPH-RCCKNPSSSA-N 332.407 3.307 50 40 EGGB CCN(CC)C(=S)SCC(=O)C(C#N)=C1Nc2ccccc2N1 5690472 NDMYPWPKBWTVNC-UHFFFAOYSA-N 346.481 3.188 50 40 EGGB O=C1CCc2ccc(OCCCCI)cc2N1 77301270 FFXAPBRVNCEGQG-UHFFFAOYSA-N 345.180 3.165 50 40 EGGB in-vitro CC(C)(C)[Si](C)(C)OC[C@@H]1CC[C@H](n2cnc3c(N)ncnc32)O1 195516889 KGDNLTOAOQTVGA-NWDGAFQWSA-N 349.511 3.108 50 40 EGGB O=C(CCCc1ccccc1)NNC1=C(C(=O)C(F)(F)F)CCC1 5027598 JVQIMUKJHMFCCA-UHFFFAOYSA-N 340.345 3.200 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2)c(OC)c1C 8276437 RIZDFZAIWREOAK-VXLYETTFSA-N 332.787 3.430 50 40 EGGB O=C1Nc2ccccc2/C1=N\NC(=O)c1cc(Cl)sc1Cl 8306384 OOYIEWOPMQBDNF-UHFFFAOYSA-N 340.191 3.141 50 40 EGGB COc1cc(/C=C(/C#N)c2nc3ccccc3[nH]2)ccc1OCC(=O)O 12419283 XZMKDUUGQLLDMY-JYRVWZFOSA-N 349.346 3.099 50 40 EGGB O=C(CCC(=O)Nc1ccc(F)cc1)N/N=C/c1cccc(Cl)c1 3132083 JYAJEZIAOLFAMG-RGVLZGJSSA-N 347.777 3.348 50 40 EGGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@H]1Cc1ccccc1 52366 REJHAVZZXNQRJQ-AWEZNQCLSA-N 330.343 3.206 50 40 EGGB COc1ccc(C(=O)N/N=C/c2ccc(Br)s2)cc1 250944 LCRQDQDMCPFNOW-OVCLIPMQSA-N 339.214 3.283 50 40 EGGB Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CC(C)C 12785087 GULLWXDJBAKKLZ-UHFFFAOYSA-N 326.824 3.001 50 40 EGGB O=C(NNC(=O)c1ccccc1)Nc1cccc(N2CCCCC2)c1 92017645 IRNDCTAUFQTWST-UHFFFAOYSA-N 338.411 3.143 50 40 EGGB COc1cccc(/C=N/NC(=O)NC23CC4CC(CC(C4)C2)C3)c1O 4646770 VDWZQUWFAWLRFV-RGVLZGJSSA-N 343.427 3.003 50 40 EGGB C=C[Si]1(C)O[Si](C)(C)O[Si](C)(C=C)O[Si](C)(C=C)O1 196649322 FBXTUBNFTGCQPZ-UHFFFAOYSA-N 332.653 3.160 50 40 EGGB O=C(N/N=C1/C(=O)c2ccccc2-c2ccccc21)c1ccncc1 12360524 CAQSGNNBXBQORS-RELWKKBWSA-N 327.343 3.079 50 40 EGGB COC(=O)/C(C#N)=C1/CC[C@@H](Nc2cccc(C(F)(F)F)c2)N1C 16245293 MWUANIGCVSNLIN-DINCDJDBSA-N 339.317 3.120 50 40 EGGB CC(C)c1cc(C(=O)NNC(=S)N[C@@H]2C[C@H]3CC[C@H]2C3)cs1 102603415 WOLDFDYREUJZAJ-GMXVVIOVSA-N 337.514 3.169 50 40 EGGB COc1ccc(OCC(=O)NN=C2C3CC4CC(C3)CC2C4)cc1 8182492 JVNKPGXTHVPAMK-UHFFFAOYSA-N 328.412 3.002 50 40 EGGB O=C(N/N=C/c1cn(-c2ccccc2)nc1-c1cccs1)C1CC1 3239951 PIEZXQPMPFNLGT-YBFXNURJSA-N 336.420 3.461 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@H](C)c2ccccc2)c(OC)c1 28356017 WSGIKSUAZJSRCJ-SWEABUAFSA-N 336.391 3.488 50 40 EGGB O=C(N[C@@H](CCl)C(=O)OCc1ccccc1)OCc1ccccc1 38600560 JYSZSIWECWRSIF-INIZCTEOSA-N 347.798 3.264 50 40 EGGB in-vitro C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1I 95635355 NTYHXNBIVRLYHG-DTWKUNHWSA-N 325.190 3.067 50 40 EGGB in-vitro Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2cccc(Cl)c2)c1C 12778200 GSFYXQXYUHQOSU-CYBMUJFWSA-N 346.814 3.185 50 40 EGGB N#C/C(C(=O)COc1ccccc1)=C(/O)Nc1ccc(F)cc1F 100935898 RKUWSQZCYNMKAB-LGMDPLHJSA-N 330.290 3.318 50 40 EGGB O=C(NNC(=O)c1cccc(C(F)(F)F)c1)c1ccc(Cl)cc1 2628923 PTHJIDQJAAEDOR-UHFFFAOYSA-N 342.704 3.434 50 40 EGGB Cn1c(/C(C#N)=C/c2ccccc2OCC(=O)O)nc2ccccc21 12535804 MKCTYHXSQGAVRX-GXDHUFHOSA-N 333.347 3.101 50 40 EGGB Cc1ccc(Cn2nc(C)c(/C=N/NC(=O)c3cccnc3)c2C)cc1 3335189 UDPUNSQYCIUASR-WSDLNYQXSA-N 347.422 3.016 50 40 EGGB COc1ccc(/C=N/NC(=O)CCCc2ccc(OC)cc2C)cc1 408905750 DHIHFMPIYUEXPU-KGENOOAVSA-N 340.423 3.485 50 40 EGGB CC(C)(C)c1ccc(/C=N\NC(=O)CC(=O)NC2CCCCC2)cc1 83262268 CTFRGHQPYAJZIF-STZFKDTASA-N 343.471 3.273 50 40 EGGB Cn1nc(-c2ccccc2)nc1/C(C#N)=C/c1ccnn1CC1CC1 585135908 ICMMZYYBRUTYGH-LFIBNONCSA-N 330.395 3.153 50 40 EGGB CN(C)c1ccc([C@@H]2CC(=O)C(C#N)=C(c3ccccc3)NN2C)cc1 5549778 JHTSKPQOJQDZPZ-IBGZPJMESA-N 346.434 3.138 50 40 EGGB O=c1c2ccccc2n2c(CCl)nnc2n1-c1ccc(Cl)cc1 17043778 WCYZAIWUTANZLN-UHFFFAOYSA-N 345.189 3.426 50 40 EGGB CCN(CC)C(=O)C1(P(=O)(c2ccccc2)c2ccccc2)CC1 76578 VMHDOZRHLNVYEJ-UHFFFAOYSA-N 341.391 3.402 50 40 EGGB Cc1cc2c(cc1/C=C(\C#N)C(=O)N[C@H]1CCCC[C@H]1C)OCO2 5006604 FFTNFDAMRYEIRM-RQJQMCRZSA-N 326.396 3.326 50 40 EGGB COc1ccc(O)c(/C=N/NC(=O)CNc2cccc3ccccc23)c1 50602 BXRNDKSUQNCGKU-WSDLNYQXSA-N 349.390 3.116 50 40 EGGB Cc1nc(CC(=O)N/N=C/c2ccc(CSC(F)F)o2)cs1 7785897 DULIZPRWSHGGQK-FZSIALSZSA-N 345.396 3.193 50 40 EGGB C=CCOc1ccc(/C=C(/C#N)C(=O)N(C)C)cc1Br 59333558 IPOIBYMFEBDXRP-WQLSENKSSA-N 335.201 3.009 50 40 EGGB CC(=O)N/N=C/c1ccccc1OCCOc1ccc(C)c(C)c1 4510748 OPPRDRAUTCRFOH-DEDYPNTBSA-N 326.396 3.231 50 40 EGGB COC(=O)c1ccc(/C=C(/C#N)C(=O)Nc2ccc(N(C)C)cc2)cc1 408777783 IVFTZXPSAQJTRC-VBKFSLOCSA-N 349.390 3.085 50 40 EGGB CN(C)C(=O)/C(C#N)=C\c1ccc(-c2ccc(C(=O)O)c(Cl)c2)o1 408769261 QCQRWCPESZAYNT-XFFZJAGNSA-N 344.754 3.293 50 40 EGGB C[C@H](Br)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1 95097958 JHPMFIDEPHIQEL-JOYOIKCWSA-N 332.625 3.023 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 5593034 MSEULPRMDWBGBR-WOJGMQOQSA-N 327.340 3.066 50 40 EGGB CC1=C(/C=C/C(C)=N/NC(=O)CN2CCCC2=O)C(C)(C)CCC1 96297657 VTEURSYOZKGAIJ-IJUUUJHDSA-N 331.460 3.184 50 40 EGGB COc1cc(/C=N/NC(=O)CSCc2ccccc2)ccc1C 9483432 UFAOXOPQTSZJGH-YBFXNURJSA-N 328.437 3.387 50 40 EGGB CC[C@H](Br)C(=O)Nc1nc2ccc(N(C)C)cc2s1 20132470 HZOHPYFOZMQIKZ-VIFPVBQESA-N 342.262 3.474 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C/c2ccc(F)cc2)c([N+](=O)[O-])c1 408880559 IGQDLPXXRUNRPM-XYOKQWHBSA-N 341.298 3.288 50 40 EGGB C[C@H](Oc1ccc(/C=C(\C#N)c2nc3ccccc3[nH]2)cc1)C(=O)O 12548844 UJTQLOVNAOXUFE-LQELWAHVSA-N 333.347 3.479 50 40 EGGB CCCCc1ccc(NC(=O)C(=O)N/N=C/c2ccc(C)cc2)cc1 3009066 YEIVCYPJIHYYHK-KGENOOAVSA-N 337.423 3.426 50 40 EGGB COc1ccc(/C=N/NC(=O)CSCc2ccc(OC)cc2)cc1 59473545 BTCWMQCHIKTPLJ-YBFXNURJSA-N 344.436 3.087 50 40 EGGB C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 20249037 YTRIFOIWDXXWNA-PBSOMRJOSA-N 329.381 3.226 50 40 EGGB C=CCSC1=C(C#N)[C@H](c2ccccc2C)[C@@H](C(=O)OC)C(O)=N1 2296627 HXTRQANFUURSHF-LSDHHAIUSA-N 342.420 3.492 50 40 EGGB C/C(=N\NC(=O)c1ccc2c(c1)OCCO2)c1c[nH]c2ccccc12 71748250 ZQZKPFRDTZQULT-CIAFOILYSA-N 335.363 3.093 50 40 EGGB Cc1ccccc1/C=N/NC(=O)C(O)(c1ccccc1)c1ccccc1 115037 SYTDBBXYPMLDBJ-XQNSMLJCSA-N 344.414 3.381 50 40 EGGB O=C1OC(=O)c2ccccc2/C1=N/Nc1cccc(C(F)(F)F)c1 100922997 LVRLFNPANBVLIV-BKUYFWCQSA-N 334.253 3.219 50 40 EGGB C#CCn1c(C)c(/C=N/NC(=O)Cc2ccccc2)c2ccccc21 6959727 BVFGDIVRCCICDO-PXLXIMEGSA-N 329.403 3.276 50 40 EGGB COc1ccc(CSCC(=O)N/N=C/c2ccc(C)cc2)cc1 59473453 OUTVTJSWLKIHDU-YBFXNURJSA-N 328.437 3.387 50 40 EGGB CC(=O)N/N=C/c1c(Br)c(C)n(-c2ccccc2)c1C 58852309 TXSOHTGACZGLLU-RQZCQDPDSA-N 334.217 3.327 50 40 EGGB CC(C)(C)OC(=O)[C@@]12CC[C@@](CBr)(C(=O)C1)C2(C)C 85398659 IKCSFVXVONKHOK-HUUCEWRRSA-N 331.250 3.489 50 40 EGGB N#CC(C#N)=C(CCCNC(=O)c1ccccc1)NCc1ccccc1 6161313 VHVCUXOJDGEZBK-UHFFFAOYSA-N 344.418 3.288 50 40 EGGB COc1c(Cl)cc(Cl)cc1C(=O)NNC(=O)c1cccs1 569159 PCXTXVPCSUKCMU-UHFFFAOYSA-N 345.207 3.138 50 40 EGGB CC1=C(C#N)C(C(F)(F)F)(C(F)(F)F)N=C(c2ccncc2)N1 340583 CZSVYPRPHVJAKJ-UHFFFAOYSA-N 334.223 3.092 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)[C@H](C#N)c2ccccc2)cc1 6630016 GEAYDAVGZUKJFB-QTCOBDOFSA-N 334.423 3.290 50 40 EGGB COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2[nH]nc(-c3ccccc3)c21 9013614 CJUYLVDEBLBETR-MRXNPFEDSA-N 344.374 3.303 50 40 EGGB COc1cc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@@]32C)cc(Cl)c1O 408949478 FNVYQTQPIQZUTR-ILSDNQPNSA-N 336.819 3.331 50 40 EGGB CCn1c2ccccc2c2cc(/C=N/NC(=O)c3cnccn3)ccc21 351700 YFWALVYJXUEVKK-FSJBWODESA-N 343.390 3.368 50 40 EGGB Cc1nc2ccc(Br)cn2c1C(=O)NN=C1CCCCC1 59515960 XYFQZICBTYOLHE-UHFFFAOYSA-N 349.232 3.455 50 40 EGGB Cc1ccc(SCC(=O)N/N=C/c2ccccc2[N+](=O)[O-])cc1 8515404 LSAHEFCDULODHH-LICLKQGHSA-N 329.381 3.146 50 40 EGGB CCCC/C(C)=N\NC(=O)C(=O)Nc1cccc(Br)c1 59515752 CYSMBNKHXRMZRW-YVLHZVERSA-N 340.221 3.070 50 40 EGGB CCc1ccc(/C=N/NC(=O)Cc2ccc(Br)cc2)o1 9204084 AIINHVVBGDGIQV-LICLKQGHSA-N 335.201 3.297 50 40 EGGB O=C(Cl)c1cc([N+](=O)[O-])c(NCc2ccco2)c([N+](=O)[O-])c1 26508938 LFPNQEOUCJYXTP-UHFFFAOYSA-N 325.664 3.087 50 40 EGGB Cc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)c(C)n1C1CCCC1 409207441 WZSHRKYHGNZEJB-OXRZLYTFSA-N 341.455 3.422 50 40 EGGB O=C(N/N=C/c1ccc(N2CCCCC2)s1)c1ccccc1O 6560725 DVHWNAXCOLEBIC-LDADJPATSA-N 329.425 3.208 50 40 EGGB C[C@@H](/C=N/NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccccc1 5527705 XIJKTVAQJCLEIA-MUOOZZNISA-N 342.311 3.022 50 40 EGGB COc1ccccc1/C=C(\C#N)c1nc(N)nc(Nc2ccccc2)n1 8756336 ORZLFYMGAHWDSB-SDNWHVSQSA-N 344.378 3.270 50 40 EGGB COc1ccc(CC(=O)N/N=C/c2ccc(SC)cc2)cc1OC 4735428 WPRKRCWRWJNVRP-XDHOZWIPSA-N 344.436 3.119 50 40 EGGB C/C(=N\NC(=O)Cc1ccc2c(c1)OCCO2)c1ccc(C)c(C)c1 409365247 QKGCVIJCDJYQHW-RCCKNPSSSA-N 338.407 3.158 50 40 EGGB COC(=O)c1ccccc1N/C=C(\C#N)C(=O)Nc1ccc(F)cc1 9340893 LESXZCVLVFETMR-VAWYXSNFSA-N 339.326 3.070 50 40 EGGB Cc1cc(/C=N/NC(=O)CC#N)cc(C)c1OCc1ccc(F)cc1 408851762 FXSKCMJMVNJIKZ-SSDVNMTOSA-N 339.370 3.385 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)c2ccc(OC)c(OC)c2)cc1 44393697 HBHMLEFRBFUFTN-DEDYPNTBSA-N 340.379 3.033 50 40 EGGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)c2ccccc2Cl)cc1 13545752 MUZXIVMDDIOKKZ-RGVLZGJSSA-N 329.787 3.452 50 40 EGGB N#CC1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@H]1c1cccc(Cl)c1 4386419 BSTWTWKSHJILFJ-HNNXBMFYSA-N 349.777 3.400 50 40 EGGB FC(F)(F)C1(C(F)(F)F)N[C@@H]2[C@H](Cl)C[C@@H]1[C@H]2Br 100114798 JSDWVKURFFDIKI-TXICZTDVSA-N 346.496 3.212 50 40 EGGB COC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1c(Cl)cccc1Cl 61417 BZSJEDZTEXTATA-LBPRGKRZSA-N 339.178 3.248 50 40 EGGB Cc1cccc(NCC(=O)N/N=C/c2ccc(Br)cc2)c1 354809 MDCBAMZLTGAXDM-VXLYETTFSA-N 346.228 3.320 50 40 EGGB CCOc1cc(/C=N/NC(=O)c2cc3ccccc3nc2C)ccc1O 366244 OBOIREVBSIJJDL-CIAFOILYSA-N 349.390 3.411 50 40 EGGB O=C(C[C@H]1C[C@H]2CC[C@H]1C2)NNC(=O)c1cc2ccccc2cc1O 107326355 UITFGCDMTDQTLR-VBNZEHGJSA-N 338.407 3.133 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)Nc2nccs2)cc(Cl)c1O 3570698 SOIQTXQCWWTRPG-BJMVGYQFSA-N 349.799 3.446 50 40 EGGB O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccccc1F 20248383 KVHDBXRUCUZGNY-GIJQJNRQSA-N 347.371 3.117 50 40 EGGB Cc1cccc(NC(=S)NNC(=O)CSc2ccccc2)c1 4619320 WKHLXMCHYTXODG-UHFFFAOYSA-N 331.466 3.105 50 40 EGGB O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C/c1cccs1 408719285 BGGFUGADBGEVQY-OVCLIPMQSA-N 335.410 3.040 50 40 EGGB CCc1ccc(-c2cc(C(=O)N/N=C\c3ccccc3O)[nH]n2)cc1 54290553 QBVPRHTZUQRWJQ-NDENLUEZSA-N 334.379 3.109 50 40 EGGB N#C/C(=C\c1cc(Br)cs1)C(=O)NCc1ccco1 567480 GASLOHVGUFWNLW-RUDMXATFSA-N 337.198 3.327 50 40 EGGB CCC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1 12814381 VUKVEADMQLHYPO-UHFFFAOYSA-N 332.787 3.090 50 40 EGGB Cc1nn(-c2ccccn2)c2c1C(=O)[C@H](Br)C(C)(C)C2 5336673 SNNQZHUBLDTDBQ-AWEZNQCLSA-N 334.217 3.104 50 40 EGGB O=C(CCl)/N=c1/nc(-c2ccccc2)n(-c2ccccc2)s1 102431456 WCNUFIZUQOWQOT-VLGSPTGOSA-N 329.812 3.267 50 40 EGGB CC1=C(C#N)[C@](NC(=O)c2ccccc2Cl)(C(F)(F)F)C(O)=N1 5072022 HCOVOTDAKLSWFD-CYBMUJFWSA-N 343.692 3.139 50 40 EGGB CC(=O)Oc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2C(C)=O)cc1 408765852 QXJKPAPRTRMQCL-WJDWOHSUSA-N 348.358 3.360 50 40 EGGB COc1cccc([C@@H]2C(C#N)=C(N)Oc3cc(O)c(Cl)cc32)c1 5514812 HCBDBCVNRYPRGC-INIZCTEOSA-N 328.755 3.272 50 40 EGGB O=C(N/N=C/c1c(O)ccc2ccccc12)c1ccc2c(c1)OCO2 31280 XSVSVUSAFSGISL-KEBDBYFISA-N 334.331 3.038 50 40 EGGB C[C@@]12[C@@H](Br)[C@@H]3[C@H]4C[C@@H]5[C@@H]([C@@H]41)[C@](O)(c1ccccc1)[C@@H]2[C@@H]53 100940612 SZCGKEUXKLALMI-WXOSJNPNSA-N 331.253 3.416 50 40 EGGB CC/C(=N\NC(=O)COc1ccc(Cl)cc1)c1ccccc1O 15938564 YAARXRAMHYZSMS-XDJHFCHBSA-N 332.787 3.355 50 40 EGGB NNC(=O)c1cc(Cl)ccc1OCc1ccc(F)cc1Cl 226319332 HBPUZZWVDDMFMJ-UHFFFAOYSA-N 329.158 3.315 50 40 EGGB O=C(N/N=C/c1ccc(-c2ccc(F)cc2)o1)[C@@H](O)c1ccccc1 561521 NVASVYKTSHBQRF-IUOVYFEOSA-N 338.338 3.269 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2ccc(O)c([N+](=O)[O-])c2)cc1Cl 6033645 NWJYNGQZVOQFCU-CAOOACKPSA-N 333.731 3.026 50 40 EGGB Cc1nn(C)c2c1[C@H](c1cccc(Cl)c1Cl)C(C#N)=C(N)O2 5792680 UCVDVGIKSCGHRQ-GFCCVEGCSA-N 335.194 3.254 50 40 EGGB CCO[P@@](C)(=O)/C(C#N)=C(\O)c1cc(OC)c(OC)c(OC)c1 103998813 QPTYUTXPRWBFEN-OILJVOJPSA-N 341.300 3.407 50 40 EGGB C/C(=N\NC(=O)c1ccc(Br)cc1)c1ccc(N)cc1 13963788 CJXVUXARFPWNCI-VCHYOVAHSA-N 332.201 3.185 50 40 EGGB N#Cc1ccccc1-c1ccc(/C=N/NC(=O)COc2ccccc2)o1 408532918 RMQQUZOOXBFQSM-LPYMAVHISA-N 345.358 3.347 50 40 EGGB Cc1n[nH]c(Sc2c(Cl)cc(C(=O)Cl)cc2[N+](=O)[O-])n1 70462563 JEOXSEAFLFRNLZ-UHFFFAOYSA-N 333.156 3.205 50 40 EGGB Cn1cc(/C=N/NC(=O)COc2ccccc2Cl)c2ccccc21 567320 RZGINGDCJNUQAM-KEBDBYFISA-N 341.798 3.361 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)[C@@H](OC)c2ccccc2)cc1 567200 WPXCYCMTPAIVEB-QTKYHAHDSA-N 339.439 3.371 50 40 EGGB O=C(NNc1cccc(Cl)c1)[C@@H]1CCCN1Cc1ccccc1 57154256 WJLMQVMLECJBMW-KRWDZBQOSA-N 329.831 3.448 50 40 EGGB COc1cc(/C=N\NC(=O)Cc2ccc(C)cc2)cc(Cl)c1O 409363494 UATMWPBTKZTNLQ-GRSHGNNSSA-N 332.787 3.055 50 40 EGGB C[C@@H]1CCc2cc(C(=O)N/N=C/c3cccc(O)c3O)sc2C1 13322280 IGJUMVHHZJSVTP-SVXRXWARSA-N 330.409 3.048 50 40 EGGB CC1(C)[C@]2(C(=O)N3CCCCC3)CC[C@@]1(C)C(=O)[C@H]2Br 4184684 SPFWMAKXCTWFLU-XFBWCDHKSA-N 342.277 3.158 50 40 EGGB C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)Nc1ccccc1 7649862 DCFJKCDKEXSUSG-AWEZNQCLSA-N 349.390 3.460 50 40 EGGB C=CCc1cc(/C=C(\C#N)C(=O)N2CCCC2)cc(OCC)c1OC 409367897 JCTYLEUOPHJLLX-SFQUDFHCSA-N 340.423 3.352 50 40 EGGB CCOc1cc(C(=O)NN)cc(Cl)c1OCc1ccc(F)cc1 216836594 NIKFOIXZERCXRZ-UHFFFAOYSA-N 338.766 3.060 50 40 EGGB O=C(O)COc1ccc(/C=N/NC(=O)c2cccc3ccccc23)cc1 1098917 ZCRXBGMDFQORPD-CIAFOILYSA-N 348.358 3.067 50 40 EGGB CCOc1cc(NC(=O)CCl)c(OCC)cc1NC(=O)CC 419881 WPWFWJTVCUNRQB-UHFFFAOYSA-N 328.796 3.010 50 40 EGGB Cc1cc(N(CCBr)CCBr)ccc1N 4772090 HGUKBDXTPIPQNQ-UHFFFAOYSA-N 336.071 3.173 50 40 EGGB C[C@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(N(C)C)cc1 20248700 FOZGEOQZJMZULJ-ITRAFESCSA-N 327.453 3.384 50 40 EGGB CC[C@@H](C)[C@H](N)C(=O)N/N=C/c1cc2ccc(C)cc2nc1Cl 13757964 YETIBTUKPHFSCK-YPSCNYPQSA-N 332.835 3.020 50 40 EGGB COc1ccc(C)cc1NC(=O)/C(C#N)=C/c1ccc(C(=O)O)cc1 408799090 GTQVNWNTZAWHGM-XNTDXEJSSA-N 336.347 3.248 50 40 EGGB N#Cc1ccc(OCC(=O)N/N=C/c2c(Cl)cccc2Cl)cc1 3277543 QAQPRTOEEICCOX-AWQFTUOYSA-N 348.189 3.394 50 40 EGGB C/C(=N\NC(=O)CNc1ccccc1)c1ccc(Br)cc1 5249868 DBVMLECVFMDZKA-XDHOZWIPSA-N 346.228 3.401 50 40 EGGB CC/C(=N\NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(OC)cc1 370589 GJILUHUDBBGUQP-FBMGVBCBSA-N 327.340 3.148 50 40 EGGB Cc1ccc(/C=N/NC(=O)c2cc(-c3cccc(C)c3O)[nH]n2)cc1 11915349 VYPZRUXJJYGRKC-RGVLZGJSSA-N 334.379 3.163 50 40 EGGB COc1cc(OC)c(/C=C(\C#N)C(=O)n2nc(C)cc2C)cc1Cl 409381407 GRHYSOUZCXEYMM-AWNIVKPZSA-N 345.786 3.418 50 40 EGGB COc1cc(/C=C(\C#N)C(N)=O)cc(Cl)c1Cc1cccc(F)c1 408876911 RPNQPFQLMKZSGS-WLRTZDKTSA-N 344.773 3.471 50 40 EGGB O=C(CBr)c1ccc2c(c1)OC(F)(F)C(F)(F)O2 98210846 RRPCJKMDVPBWRA-UHFFFAOYSA-N 329.043 3.221 50 40 EGGB O=C(CSc1ccc(Cl)cc1)N/N=C/c1ccc(C(=O)O)cc1 7993701 IJOIFRNJEPDNAS-GIJQJNRQSA-N 348.811 3.281 50 40 EGGB COC(=O)/C(C#N)=C(/NCc1ccc(Cl)cc1Cl)SC 25608699 AQERPFKUMHHZGY-BENRWUELSA-N 331.224 3.354 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)C23CC4CC(CC(C4)C2)C3)cc1 3898772 XMJVGKGNHSWLKF-FYJGNVAPSA-N 325.456 3.419 50 40 EGGB C/C(=N\NC(=O)c1ccco1)c1cccc(NC(=O)c2ccco2)c1 5382134 BRLDSFLRMGYKKU-UDWIEESQSA-N 337.335 3.279 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)ccc1O 4979255 MZSOJRLAAQYJGW-KEMCMDKTSA-N 328.412 3.393 50 40 EGGB COc1ccc(/C=N\NC(=O)Cc2cc(C)ccc2C)cc1OC 409359264 AYOFUHMOKHFEDU-NDENLUEZSA-N 326.396 3.013 50 40 EGGB Cc1c(C(=O)NN)c2ccccc2n1Cc1c(F)cccc1Cl 216948544 UWNVPSFILGVFJA-UHFFFAOYSA-N 331.778 3.394 50 40 EGGB OC[C@H](Br)C[C@@](F)(Cl)C(F)(F)Br 16159150 ZXCKYRIOJOZVFC-DMTCNVIQSA-N 334.357 3.025 50 40 EGGB COc1cccc(/C=N/NC(=O)c2cc(C)nc3ccccc23)c1O 262944 VESJWWOMTZWLNN-RGVLZGJSSA-N 335.363 3.021 50 40 EGGB N#CC1=C(N)OC(c2ccccc2)=C(C#N)[C@H]1c1ccc2c(c1)OCO2 2218238 NKIMFXDEADKZNG-GOSISDBHSA-N 343.342 3.158 50 40 EGGB Cc1cccc(NC(=O)/C(C#N)=C/c2cnc3ccc(C#N)cn23)c1 96298488 TVLUPRFTDHOLEV-OVCLIPMQSA-N 327.347 3.060 50 40 EGGB COC(=O)c1cccc(-c2ccc(/C=C(/C#N)C(=O)N(C)C)o2)c1C 408854569 IOXNWVVRYWXMCF-RAXLEYEMSA-N 338.363 3.037 50 40 EGGB O=C(N/N=C1/CSC(=O)N1Cc1cccs1)c1cccs1 33313477 GNQPARVZYYRMJT-KAMYIIQDSA-N 337.451 3.222 50 40 EGGB N#C/C(=C/c1cc(C#N)cs1)C(=O)N(CC(F)(F)F)C1CC1 96450088 JWSQHYZROKRMFO-WMZJFQQLSA-N 325.315 3.080 50 40 EGGB COc1ccc(/C=C/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc1 6230290 UKFKSUJYPHOLNX-HYLYESJESA-N 348.358 3.495 50 40 EGGB O=C(Cn1cnc(Cl)c1Cl)N/N=C/c1c(F)cccc1Cl 160937 JSLLWIQBOAPSJL-JJPRUIFNSA-N 349.580 3.133 50 40 EGGB C=CCSC1=C(C#N)[C@H](c2ccccc2OCC)[C@H](C#N)C(=O)N1 9110438 IBUQJZKOGSOOCN-XJKSGUPXSA-N 339.420 3.093 50 40 EGGB Cc1ccc(/C=N/NC(=O)COc2ccc(Cl)c(C)c2)c(O)c1 3036964 ODUGPWOFCIRRDO-DJKKODMXSA-N 332.787 3.192 50 40 EGGB CN1C(=O)/C(=N/NC(=O)c2ccc(C(C)(C)C)cc2)c2ccccc21 100436189 RCKPJOAYBXETLJ-HEHNFIMWSA-N 335.407 3.095 50 40 EGGB C/C(=N/NC(=O)c1cc(O)c(O)c(O)c1)C12CC3CC(CC(C3)C1)C2 4646870 ZOTZUESCOSDDQS-JMIUGGIZSA-N 344.411 3.126 50 40 EGGB CCCn1nc(C)c(Cl)c1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2 253396295 DNQFPKMRFGRPDC-ZDUSSCGKSA-N 346.818 3.070 50 40 EGGB O=C(CSc1ccccn1)N/N=C/c1c(O)ccc2ccccc12 124342 OJJVXNIZNLYBEY-RGVLZGJSSA-N 337.404 3.183 50 40 EGGB N#C/C(=C\c1cccnc1)C(=O)Nc1cccc(Br)c1 448702 BWSMYRWYRWISKT-KPKJPENVSA-N 328.169 3.390 50 40 EGGB CC(C)Oc1cccc(C(=O)NNC(=O)c2ccc(Cl)cc2)c1 568835 UOXOAPJPKYVQBJ-UHFFFAOYSA-N 332.787 3.202 50 40 EGGB CCOC(=O)N/N=C/c1ccc(OC)c(OCc2ccccc2)c1 3254583 RDPOKNZTYWLKTB-XDHOZWIPSA-N 328.368 3.354 50 40 EGGB CCOC(=O)/C(C#N)=C/c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 409274263 OFHCCBLZFBSZQL-XNTDXEJSSA-N 343.383 3.301 50 40 EGGB CC(C)(C)c1ccc(C(=O)n2cc(C(=O)NN)c3ccccc32)cc1 216950531 CXLUHGUNHBLLKY-UHFFFAOYSA-N 335.407 3.231 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/c2cccc(Cl)c2)c([N+](=O)[O-])c1 220426 ZQDLWTQFNMWWJN-GIJQJNRQSA-N 347.758 3.086 50 40 EGGB CCCc1nn(C)c2c1[C@@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 535672 FDLKNIVOEUXVRR-CYBMUJFWSA-N 346.793 3.383 50 40 EGGB N#CC1=C2SC[C@](O)(c3ccccc3)N2C(=O)C[C@@H]1c1ccccc1 544541 UNAZSKRCBSOLLX-UZLBHIALSA-N 348.427 3.330 50 40 EGGB Cc1ccc(NCC(=O)N/N=C/c2ccc(OC(C)C)cc2O)cc1 408531336 NTNOPJWHNBCVEO-SRZZPIQSSA-N 341.411 3.050 50 40 EGGB CCOC(=O)/C(C#N)=C\c1ccc(-c2ccc(F)c([N+](=O)[O-])c2)o1 252492715 MTQNMZCTXBBOFH-XFFZJAGNSA-N 330.271 3.464 50 40 EGGB Cc1ccc(C)c(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)c1C 12843960 AMHVUUUNZVMCIH-VXLYETTFSA-N 341.367 3.049 50 40 EGGB CNC(=O)/C(C#N)=C\c1cn(CCOc2ccccc2)c2ccccc12 6949949 ORGLNQAAMUJCOB-SSZFMOIBSA-N 345.402 3.373 50 40 EGGB Cc1cc(C)c2cc(C(=O)NNC(=O)Cc3ccccc3)[nH]c2c1C 32899958 ZYDOIJFTJYRFKG-UHFFFAOYSA-N 335.407 3.097 50 40 EGGB [C-]#[N+][C@H](c1cccc(C(=O)OC)c1)S(=O)(=O)c1ccc(C)cc1 95686564 JIZSHSHFWZWRJN-INIZCTEOSA-N 329.377 3.173 50 40 EGGB Cc1cc(/C=N\NC(N)=O)c(C)n1-c1ccc(Cl)cc1Cl 13286315 DVSSFEVAJDJKKA-WSVATBPTSA-N 325.199 3.403 50 40 EGGB C=CCc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)cc(OC)c1O 57770088 DGGIFFHSAWNVGB-WQRHYEAKSA-N 348.402 3.353 50 40 EGGB CCC[C@H](C(=O)OCC)/C(C)=N\NC(=O)COc1ccc(C)c(C)c1 408952953 LBWGUMWGJUCJIJ-SWEXZPIWSA-N 348.443 3.154 50 40 EGGB CC1(C)Cc2cc(/C=C(\C#N)C(=O)Nc3nccs3)ccc2O1 98052716 OZPVGCXVSMCCFG-MDWZMJQESA-N 325.393 3.402 50 40 EGGB Cc1cccc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)c1 408772584 DDJZGXJHTVDSNI-VCHYOVAHSA-N 343.408 3.287 50 40 EGGB CC(=O)NNc1nc(C)c(C(=O)/C=C\C=C\c2ccccc2)s1 17216004 TTZULNFOELAVHR-QZTBCQRESA-N 327.409 3.367 50 40 EGGB CC(C)(C)C1CCC(=NNC(=O)CC(=O)NCc2ccccc2)CC1 241528 FLHTWBMIZZKIKE-UHFFFAOYSA-N 343.471 3.401 50 40 EGGB O=C(COc1cccc(Cl)c1)N/N=C/c1cc(Cl)ccc1O 3150835 YAYXFYJWSDBMPK-QGMBQPNBSA-N 339.178 3.228 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/c2ccc(Cl)cc2)c([N+](=O)[O-])c1 4775386 GLEJYIZEMNOPPN-GIJQJNRQSA-N 347.758 3.086 50 40 EGGB CCOc1ccccc1[C@@H]1C(C#N)=C(SC)N=C(O)[C@H]1C(=O)OC 8970584 XUHOQRJQLUCHQS-KGLIPLIRSA-N 346.408 3.026 50 40 EGGB COc1ccc([C@H]2C(C#N)=C(N)N(C)C3=C2C(=O)CCC3)cc1Cl 409137234 VZXJWPHGMHPFQI-INIZCTEOSA-N 343.814 3.079 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@H](c2ccc3c(c2)OCO3)[C@H]2CCCC=C12 35185235 LMOAEQHNEPYZAY-KBXCAEBGSA-N 344.374 3.009 50 40 EGGB Cc1cccc(NCC(=O)N/N=C\c2cccc(Br)c2)c1 33284720 FFRBDQWUCNLGLB-GRSHGNNSSA-N 346.228 3.320 50 40 EGGB CN(NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccccc1 333570 WLCAVZIUAKTJDH-UHFFFAOYSA-N 332.403 3.090 50 40 EGGB O=C(N/N=C1/CC(=O)c2ccccc21)c1ccccc1Br 103452653 VSVGHNGACFLZCP-JXAWBTAJSA-N 343.180 3.170 50 40 EGGB CCCCN(C)CC(=O)/C(C#N)=C1/NC(c2ccccc2)=CS1 13125446 GMWAEVDZCPXPIA-SDXDJHTJSA-N 327.453 3.358 50 40 EGGB C#CCOc1ccc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 408792290 AGMAKQWAEFDZAR-RVDMUPIBSA-N 347.330 3.152 50 40 EGGB COc1cccc(C(=O)N/N=C/c2cc(Cl)c(OC)cc2OC)c1 408590606 PVYWJYAOODKXKF-VXLYETTFSA-N 348.786 3.130 50 40 EGGB CCOc1ccc(/C=N\NC(=O)Cc2ccc(F)cc2)cc1OCC 409232729 PDAKIHVQAADAMC-BKUYFWCQSA-N 344.386 3.316 50 40 EGGB COc1cc([N+](=O)[O-])ccc1N/C=C(/C=O)c1nc2ccccc2o1 5335114 QVWSIXKITZOSSK-LUAWRHEFSA-N 339.307 3.397 50 40 EGGB O=C(CCCc1ccc(Cl)cc1)NNC(=O)c1ccccc1F 40140311 ARVJKCVTMKPPOC-UHFFFAOYSA-N 334.778 3.263 50 40 EGGB O=C(N/N=C\c1ccccc1C(=O)O)c1ccc(Cl)cc1Cl 58885271 ZPTIGFIJJINGQE-LSCVHKIXSA-N 337.162 3.456 50 40 EGGB O=C(CN1CCCCC1)N/N=C/c1ccc(Oc2ccccc2)cc1 20243982 MHUYPUUJJBAUCG-RCCKNPSSSA-N 337.423 3.415 50 40 EGGB CC(/C=C/c1ccccc1)=N\NC(=O)C(=O)Nc1ccc(C)cc1C 13882092 FCDDDGHTLGLVTL-YYMYKZPXSA-N 335.407 3.447 50 40 EGGB C/C(=N\NC(=O)COc1ccc2ccccc2c1)c1ccc(O)cc1 5381549 AHFWKFVCDDMCGE-KGENOOAVSA-N 334.375 3.465 50 40 EGGB Cc1[nH]nc2c1[C@@H](c1cccc(OCCC(C)C)c1)C(C#N)=C(N)O2 8845681 UHUXBGQREYHIJE-KRWDZBQOSA-N 338.411 3.361 50 40 EGGB O=C(NCc1cccc(C(F)(F)F)c1)N/N=C1/CCn2cccc21 89774535 HABGGQIWSDBAPD-BKUYFWCQSA-N 336.317 3.114 50 40 EGGB O=C(O)COc1cccc(/C=N/NC(=O)c2ccc3ccccc3c2)c1 408926216 WFFNMMIXZTVYDX-CIAFOILYSA-N 348.358 3.067 50 40 EGGB O=C(COc1ccc(F)cc1)N/N=C/c1c(O)ccc2ccccc12 3532472 CKFBTHLETXXACA-SRZZPIQSSA-N 338.338 3.214 50 40 EGGB CCOC(=O)c1c(NC(=O)CCCl)sc2c1CC(C)(C)OC2 2272471 XMXJCAZOVJDWJB-UHFFFAOYSA-N 345.848 3.344 50 40 EGGB CCc1ccccc1OCC(=O)N/N=C(/C)c1ccc([N+](=O)[O-])cc1 4014801 UEOBRXZXRUJWAI-UYRXBGFRSA-N 341.367 3.076 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(C)cc2Cl)c(OC)c1 13842595 FTEUPJJXWRAGNY-VXLYETTFSA-N 332.787 3.430 50 40 EGGB CCOc1ccccc1[C@H]1C(C#N)=C(N)Oc2cc3c(cc21)OCO3 409103613 CSIAOWLUJLWTAB-GOSISDBHSA-N 336.347 3.032 50 40 EGGB N#C/C(=C\c1cccc(OCc2ccc(C#N)cc2)c1)C(=O)NC1CC1 409196180 NTRQCRIDIIKLCN-VCHYOVAHSA-N 343.386 3.323 50 40 EGGB CCCn1nc(C)c(Cl)c1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2 253396290 DNQFPKMRFGRPDC-CYBMUJFWSA-N 346.818 3.070 50 40 EGGB O=C(NCC1(c2ccccc2)CCCC1)NNC(=O)c1ccccc1 12981619 SGNZEMGDRKEDQW-UHFFFAOYSA-N 337.423 3.143 50 40 EGGB Cc1ccnn1CC(=O)N/N=C/c1cccc(Oc2ccccc2)c1 138934 HKLKGHFAPVQJLM-DEDYPNTBSA-N 334.379 3.134 50 40 EGGB C[C@@H](Oc1ccc(/C=C(\C#N)c2nc3ccccc3[nH]2)cc1)C(=O)O 12548843 UJTQLOVNAOXUFE-HLVNSREUSA-N 333.347 3.479 50 40 EGGB C/C(=N/NC(=O)c1ccc(C)nc1)c1ccc(Br)cc1 13940102 JSVBPDPNBGPQSL-WQRHYEAKSA-N 332.201 3.307 50 40 EGGB C[C@@H](NC(=O)OCc1ccccc1)C(=O)NNc1ccccc1Cl 1721042 JUEDRCAMWYQAKS-GFCCVEGCSA-N 347.802 3.098 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C2\NC(C)(C)Cc3ccccc32)cc1 343615 ZDOBASAMTAMXFX-HNENSFHCSA-N 347.418 3.493 50 40 EGGB C[C@@H](Sc1nccn1C)C(=O)/C(C#N)=C1/Nc2ccccc2S1 102367061 NFDJPEOMANUMEO-BXSDCGNMSA-N 342.449 3.423 50 40 EGGB CSc1ccc(/C=N/NC(=O)C(=O)Nc2cc(C)cc(C)c2)cc1 59101400 FEIROKCQTXJQTM-YBFXNURJSA-N 341.436 3.114 50 40 EGGB N#C/C(=C\c1cccc2c1OCCCO2)C(=O)NCc1ccccc1 53102235 UVLAPKGREDQIBU-SFQUDFHCSA-N 334.375 3.071 50 40 EGGB N#C/C(=C\c1[nH]c2ccccc2c1Nc1ccc([N+](=O)[O-])cc1)C(N)=O 4815347 QHTCUOOYPIJMKF-PKNBQFBNSA-N 347.334 3.212 50 40 EGGB COc1ccc2ccccc2c1[S@](=O)S(=O)(=O)c1ccccc1 71789057 JLLCOTGFJHYPRE-QFIPXVFZSA-N 346.429 3.345 50 40 EGGB CCCn1ncc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c1C 253398381 HDXIMKKNCUETNL-INIZCTEOSA-N 340.427 3.052 50 40 EGGB CC(C)(C)[Si](C)(C)O[C@@H]1COc2c(Br)cnn2C1 2049305453 DHGLKPROYHHUMN-VIFPVBQESA-N 333.302 3.428 50 40 EGGB Cc1ccc(C)c(OCC(=O)NNC(=O)C[C@H](C)c2ccccc2)c1 8852956 YRRRXEKUIXTPPX-INIZCTEOSA-N 340.423 3.023 50 40 EGGB N#CC(C#N)=Cc1cc(Br)c(Sc2ncccn2)o1 1408106 HUCVEDJKHDBWOY-UHFFFAOYSA-N 333.170 3.414 50 40 EGGB C[C@]1(C(=O)Nc2c(F)c(F)c(F)c(F)c2F)C[C@H]1Br 2311935 HQOLHAYYEOJGGN-WQCBKAMWSA-N 344.077 3.494 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)c2cc3cc(OC)ccc3[nH]2)cc1 9614562 SFQKZYHSSRZDTL-CIAFOILYSA-N 337.379 3.339 50 40 EGGB O=C(CCl)Nc1cc(Br)ccc1Br 33560293 QAJQAXOTHSJAJS-UHFFFAOYSA-N 327.403 3.389 50 40 EGGB C[C@H](NC(=O)/C(C#N)=C\c1ccc(O)c([N+](=O)[O-])c1)c1ccccc1 206853782 UBSNTEHKDFQPJX-ZENNRRHLSA-N 337.335 3.085 50 40 EGGB CCC(=O)Nc1ccc(C(=O)N/N=C/c2c[nH]c3ccccc23)cc1 357449 BDYHKKOJHHCVRP-CIAFOILYSA-N 334.379 3.280 50 40 EGGB C/C(CC(=O)Nc1ccc(C)c(Cl)c1)=N\NC(=O)c1ccncc1 4610857 JSGCCUMAASJNJG-CIAFOILYSA-N 344.802 3.178 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)Nc2cccc(C)c2)cc(OC)c1O 59133252 WDTIQFVLLHZUNW-ZSOIEALJSA-N 338.363 3.264 50 40 EGGB CC(=O)[C@@H]1C(=O)N(c2ccccc2)C(N)=C(C#N)[C@H]1C1CCCCC1 108269196 WZPZOJIMSWGHME-ZWKOTPCHSA-N 337.423 3.129 50 40 EGGB CCc1ccc(NC(=O)C(=O)N/N=C/c2ccc(C(C)C)cc2)cc1 3085380 XIGRPLLSGLGZHD-FYJGNVAPSA-N 337.423 3.461 50 40 EGGB CC/C(=N\NC(=O)c1ccc(OC)cc1)c1ccc2c(c1)OCCO2 408719934 QBETZDUCDAJGTI-CAPFRKAQSA-N 340.379 3.011 50 40 EGGB CCc1ccc(CC(=O)N/N=C\c2ccc(C)c([N+](=O)[O-])c2)cc1 409366316 ZYVKIXRFFNNCRG-UNOMPAQXSA-N 325.368 3.158 50 40 EGGB C/C(CC(=O)N[C@H](C)c1ccccc1)=N\NC(=O)Cc1cccs1 4523559 IZYSLNRHZXOVAN-GNUZOCDUSA-N 343.452 3.050 50 40 EGGB O=C(CNc1cccc2ccccc12)N/N=C/c1ccc([N+](=O)[O-])cc1 50598 MOYSAQTUDFLQGG-CIAFOILYSA-N 348.362 3.310 50 40 EGGB Cc1ccc(N2C(S)=C(C#N)C(=O)N[C@H]2c2cccs2)cc1 352228 ZKGGZUXUYOGYSQ-CQSZACIVSA-N 327.434 3.357 50 40 EGGB C=CCOc1ccccc1/C=N/NC(=O)c1cc(OC)cc(OC)c1 6453614 OHQUNRBIHKMVTK-DEDYPNTBSA-N 340.379 3.033 50 40 EGGB Cc1cc(Cl)ccc1NC(=O)C(=O)N/N=C/c1sccc1C 59435551 KMIPLKYCOLLMIE-CAOOACKPSA-N 335.816 3.107 50 40 EGGB COc1ccc(/C=C(\C#N)c2nc(N)nc(Nc3ccccc3)n2)cc1 11296416 KVGMSRHIHSRMPP-SDNWHVSQSA-N 344.378 3.270 50 40 EGGB CCOC(=O)/C(C#N)=C/c1ccc(-c2cccc(C(=O)O)c2C)o1 408834350 XZOMFMBXOIHSHQ-FMIVXFBMSA-N 325.320 3.423 50 40 EGGB Cn1cc(/C=N/NC(=O)COc2ccc(Cl)cc2)c2ccccc21 239356 MAYOXAIRHAAEHS-KEBDBYFISA-N 341.798 3.361 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)COc2ccc3ccccc3c2)cc1 261360 USWZIABZDCGVDX-HYARGMPZSA-N 347.418 3.435 50 40 EGGB COc1ccccc1/C=N\NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 408903891 AXXHPZCYDKWMLE-ZDLGFXPLSA-N 339.307 3.114 50 40 EGGB Cc1cccc(C)c1NC(=O)C(=O)N/N=C/c1cccc(Cl)c1 408733622 MSJVUXGTJDDGTL-VXLYETTFSA-N 329.787 3.046 50 40 EGGB CCOc1cc(/C=C(\C#N)c2nnc3n2CCCCC3)ccc1OC 5069697 CJEDFKJPBRODRM-RVDMUPIBSA-N 338.411 3.476 50 40 EGGB C/C(CC(=O)Nc1c(C)cc(C)cc1C)=N\NC(=O)c1ccncc1 4402010 FSYHXRGTNHFVLF-PXLXIMEGSA-N 338.411 3.141 50 40 EGGB COC(=O)COc1ccccc1/C=C(/C#N)c1ccc([N+](=O)[O-])cc1 8092093 CUWFZMUYQPYUEU-GDNBJRDFSA-N 338.319 3.211 50 40 EGGB N#C/C(=C\c1ccc(OCc2ccccc2)cc1)C(=O)N1CCOCC1 5683260 VHEIJMNYSUPBCR-XMHGGMMESA-N 348.402 3.031 50 40 EGGB N#C/C(=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)N1CCCC1 16438048 LJRACEABPYNZSM-SDNWHVSQSA-N 337.335 3.384 50 40 EGGB O=C(CS[C@H]1CCc2ccccc21)N/N=C\c1ccccc1O 17126191 RCABVSNSNNHAIS-BEWREHSGSA-N 326.421 3.263 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)c(OC)c1 6586170 DUWMYYHVYABVNG-RIYRZUHRSA-N 328.412 3.306 50 40 EGGB Cc1cc(C(=O)OC(C)C)ccc1-c1ccc(/C=C(\C#N)C(N)=O)o1 409119944 REDRSZPYRLBAAX-NTEUORMPSA-N 338.363 3.213 50 40 EGGB Cc1cc(SCC(=O)N/N=C/c2ccco2)c2ccccc2n1 4091504 PIDJQMDYBUCTSY-VCHYOVAHSA-N 325.393 3.379 50 40 EGGB CCOc1ccc(NC(=O)/C(C#N)=C/c2ccc(C(=O)O)cc2)cc1 4705171 LJALXTXDAJZKLD-RVDMUPIBSA-N 336.347 3.329 50 40 EGGB COc1cccc(/C=N/NC(=O)/C=C/c2ccc(Cl)cc2)c1O 409057462 QKKDDQFUFCQEQU-JAXWBCMNSA-N 330.771 3.218 50 40 EGGB CC(C)N(C(=O)CCl)[C@@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C 79392566 VBTAOJBKULDHHG-QWHCGFSZSA-N 332.872 3.298 50 40 EGGB O=C(Cl)[C@@H]1CC(=O)N(c2ccc3oc(-c4cccnc4)nc3c2)C1 57327027 ADSQBILUMUTHHN-LLVKDONJSA-N 341.754 3.008 50 40 EGGB Cc1ccc(/C=N/NC(=O)C(=O)Nc2cc(Cl)ccc2C)cc1 59515532 XITMSENGAAUSNH-VXLYETTFSA-N 329.787 3.046 50 40 EGGB Cc1nc2ccccn2c1C(=O)N/N=C/c1ccc(OC(F)F)cc1 3222543 YBPFPUKVNQUULZ-KEBDBYFISA-N 344.321 3.008 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc(C)cc2C)cc1OC 216047890 HYTWSXZQVDMIJT-RCCKNPSSSA-N 340.423 3.404 50 40 EGGB O=C(Cl)[C@@H]1CC(=O)N(c2ccc(N3CCCC3)c(Cl)c2)C1 45958266 OKPMUTQLBDYEBP-SNVBAGLBSA-N 327.211 3.059 50 40 EGGB [C-]#[N+][C@@H](c1cccc(C(=O)OC)c1)S(=O)(=O)c1ccc(C)cc1 95686565 JIZSHSHFWZWRJN-MRXNPFEDSA-N 329.377 3.173 50 40 EGGB CC(C)(C)c1ccc(OCC(=O)NN=Cc2ccccc2O)cc1 245204336 XMYMLKHWDKQLQB-UHFFFAOYSA-N 326.396 3.219 50 40 EGGB CC(C)(C)C(=O)Nc1ccc(C(=O)N/N=C/c2ccccc2O)cc1 59359 WTNADFAMFDTRNI-UDWIEESQSA-N 339.395 3.141 50 40 EGGB C/C(=N\NC(=O)c1cc2ccccc2cc1O)c1ccc(O)cc1O 5370246 FXRUPPXGWDWQPN-RGVLZGJSSA-N 336.347 3.111 50 40 EGGB CCOc1ccc2ccccc2c1[C@H]1C(C#N)=C(N)Oc2[nH]nc(C)c21 8569349 HOUPGSFNPIHVAG-SFHVURJKSA-N 346.390 3.488 50 40 EGGB O=C(N/N=C(\c1ccccc1)c1ccncc1)c1ccc([N+](=O)[O-])cc1 5771985 QYVALBGCSDBEIP-DYTRJAOYSA-N 346.346 3.172 50 40 EGGB COc1ccc(C(=O)N/N=C(\C)c2ccc(C)cc2C)c(OC)c1 33721412 ATVVOIUGYCBSON-XSFVSMFZSA-N 326.396 3.475 50 40 EGGB Cc1cc(C(F)(F)F)nn1[C@@H](C)C(=O)N/N=C/c1ccc(F)s1 252484638 GCERTKVGXGCMFU-XXSJOENDSA-N 348.325 3.122 50 40 EGGB O=[N+]([O-])c1ccc([S@@](=O)[C@H]2CCCC[C@@H]2Cl)c([N+](=O)[O-])c1 5215356 OMSWTTLZLNVEJO-SISYYIAVSA-N 332.765 3.161 50 40 EGGB O=C(N/N=C\c1c[nH]c2ccccc12)N/N=C/c1c[nH]c2ccccc12 5328117 WVYYJCYHHYFLBV-NQRIEWMKSA-N 344.378 3.316 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)COc2ccccc2OC)cc1 8182389 ONMPWRAULZZVJB-XSFVSMFZSA-N 342.395 3.013 50 40 EGGB C/C(=N\NC(=O)c1cc(Br)ccc1O)c1cccs1 253331 PLAMTYWNVFFYPH-OVCLIPMQSA-N 339.214 3.370 50 40 EGGB Cc1[nH]c2ccccc2c1/C=N/NC(=O)CCC(=O)Nc1ccccc1 2132068 LTDDDBKOTWZJAO-FYJGNVAPSA-N 348.406 3.345 50 40 EGGB COc1ccc(CCC(=O)NNC(=O)Nc2ccccc2Cl)cc1 15934079 GFODVJKOKLHHFA-UHFFFAOYSA-N 347.802 3.134 50 40 EGGB Cc1ccc(C(=O)NNC(=O)CCC(=O)c2cc(C)sc2C)cc1 7653305 RPUHAGHLUCHAEU-UHFFFAOYSA-N 344.436 3.097 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@@H]2[C@H]3CCCC[C@]32C)c(OC)c1 408955183 OEOVXXUXGYQGDB-KFDYUPLTSA-N 330.428 3.370 50 40 EGGB Cc1cc(Cl)ccc1O[C@H](C)C(=O)N/N=C/c1ccc(O)cc1 243904 XQVKBZXECVLGTP-AINDZBIGSA-N 332.787 3.272 50 40 EGGB COc1cc(OC)cc(C(=O)N/N=C/c2c(C)[nH]c3ccccc23)c1 582460 IQXILLIWPOYNMF-RGVLZGJSSA-N 337.379 3.257 50 40 EGGB C/C(=N\NC(=O)Cc1nc2ccccc2n1C)c1cc(C)sc1C 46193069 PHFUGIOKHPBOAL-UDWIEESQSA-N 340.452 3.335 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)c2cccnc2)cc1Br 7931519 YSXURWQRQNDASR-VCHYOVAHSA-N 348.200 3.007 50 40 EGGB O=c1nc2n(nc1-c1ccc(F)cc1)[C@H](CCl)Nc1ccccc1-2 102112379 QQPQIYLHRHRGIY-CQSZACIVSA-N 342.761 3.274 50 40 EGGB CC(C)(C)C(=O)[C@H](Br)[C@H](O)C(Cl)(Cl)Cl 494574 FYTCKBXKBUXJLV-NJGYIYPDSA-N 326.445 3.096 50 40 EGGB CCOc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N(C)C)c2C)cc1 56487905 JUIGDEIBIVONFM-ATVHPVEESA-N 337.423 3.488 50 40 EGGB Cc1ccc(NC(=S)NNC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)cc1 8685949 LLWBZGOISSXWHX-DLBZAZTESA-N 339.464 3.425 50 40 EGGB COc1ccc(C)cc1-n1ccc(C(=O)N2CCSSCC2)n1 89626502 ANVYVKDEYLYTLP-UHFFFAOYSA-N 349.481 3.027 50 40 EGGB C[C@H](Br)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1 95097956 JHPMFIDEPHIQEL-CABZTGNLSA-N 332.625 3.023 50 40 EGGB C[C@@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1cccc(O)c1 31135 WJDUIBQQSQAMDJ-CNRHGSOZSA-N 333.391 3.496 50 40 EGGB O=C(N/N=C/c1ccc([N+](=O)[O-])o1)C(c1ccccc1)c1ccccc1 588239 VQKVJQKKAGSWJM-DEDYPNTBSA-N 349.346 3.470 50 40 EGGB COc1ccc(CC(=O)N/N=C/c2ccc(Br)cc2)cc1 585386 HGQIVOFWGBQLKD-WOJGMQOQSA-N 347.212 3.151 50 40 EGGB CCOC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1cccnc1 446154 ABRFOGTTZHADPY-LFIBNONCSA-N 344.374 3.404 50 40 EGGB COc1ccc(N(/N=C2\Sc3ccccc3C2=O)C(C)=O)cc1 12561900 CCNNPZAKZZUNBG-ZCXUNETKSA-N 326.377 3.350 50 40 EGGB O=C(N/N=C\c1c(O)ccc2ccccc12)c1ccc([N+](=O)[O-])cc1 13302988 NKZZPWSVRAPEDL-ODLFYWEKSA-N 335.319 3.218 50 40 EGGB O=C(NNC(=S)NCc1ccccc1)c1cccc2ccccc12 15873430 QJLWVVWCYHSTNI-UHFFFAOYSA-N 335.432 3.149 50 40 EGGB COc1ccc(C(=O)N/N=C(\C)CC(=O)Nc2ccc(C)cc2)cc1 5363188 TZTWKNSJEXEQAK-KGENOOAVSA-N 339.395 3.138 50 40 EGGB CC1(C)C(C#N)=C(SCc2cccc3cccnc23)NC(=O)[C@H]1C#N 8935376 ZUKXCFVKVYEIPB-CQSZACIVSA-N 348.431 3.499 50 40 EGGB C#CCOc1ccc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)cc1 408962602 IGYUFIJLAWTENY-WSDLNYQXSA-N 346.308 3.481 50 40 EGGB Cc1nc(-c2ncccn2)sc1C(=O)Oc1ccc([N+](=O)[O-])cc1 102141212 SNBKLQPOUFYWNO-UHFFFAOYSA-N 342.336 3.036 50 40 EGGB CCCOc1cccc(C(=O)NNC(=O)c2ccc(Cl)cc2)c1 6265131 LGNKSKINFOSUFO-UHFFFAOYSA-N 332.787 3.204 50 40 EGGB Cc1nn2c(nc(N3CCCC3)c3ccccc32)c1C=C(C#N)C#N 3178612 OJARAIGBBUTDFN-UHFFFAOYSA-N 328.379 3.222 50 40 EGGB CCOC(=O)c1ccc(NC(=O)/C(C#N)=C\c2ccc(O)cc2)cc1 5996568 AXOTZDCXWLUFON-PTNGSMBKSA-N 336.347 3.115 50 40 EGGB CNC(=O)/C(C#N)=C/c1ccc(-c2ccc(C(=O)OC)c(Cl)c2)o1 409000362 XXIMMISJPZIUDX-YRNVUSSQSA-N 344.754 3.040 50 40 EGGB N#CCOc1ccc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 408792329 ALTXWZBCCACAMQ-GXDHUFHOSA-N 348.318 3.043 50 40 EGGB Cc1cc2nc(/C(C#N)=C\c3ccc(OCC(N)=O)cc3)[nH]c2cc1C 73368688 IKHHFMPKXFNJTE-DHDCSXOGSA-N 346.390 3.108 50 40 EGGB CC(C)N(C(=O)OC(C)(C)C)[C@@H]1CCCC[C@H]1NC(=O)CCl 79408896 JLKNZCQOVZICNM-CHWSQXEVSA-N 332.872 3.298 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)cc1C 7384837 LQBJZQSHTXDKEL-KGENOOAVSA-N 337.423 3.368 50 40 EGGB CCOC(=O)/C(C#N)=C\c1ccc(-c2cc([N+](=O)[O-])ccc2OC)o1 4837349 NEDWARFZLOOGJU-FLIBITNWSA-N 342.307 3.333 50 40 EGGB N#C/C(=C\c1ccc([N+](=O)[O-])o1)C(=O)NCc1ccc(Cl)cc1 3246924 FWPCYXNBQCFLGR-YRNVUSSQSA-N 331.715 3.065 50 40 EGGB CCCCOc1ccc(/C=N/NC(=O)c2cc(C3CC3)n[nH]2)cc1 4135893 PAHKKBSLNILGFI-XDHOZWIPSA-N 326.400 3.230 50 40 EGGB CC(C)(C)c1[nH]nc2c1[C@@H](c1c(F)cccc1F)C(C#N)=C(N)O2 6781476 BLSGJBXBECWDMX-LLVKDONJSA-N 330.338 3.204 50 40 EGGB N#C/C(=C/c1ccc(O)c(O)c1)C(=O)NCCCCc1ccccc1 13822339 GWCNJMUSWLTSCW-ATVHPVEESA-N 336.391 3.144 50 40 EGGB COc1ccc(OC)c([C@@H]2C(C#N)=C(C)NC3=C2N2CCC3CC2)c1 100329792 BISTYISTQVTMFH-GOSISDBHSA-N 337.423 3.125 50 40 EGGB CCOC(=O)NNC(=O)c1sc2nc(C(F)(F)F)ccc2c1C 29760535 WHEMLXWQJNSIOR-UHFFFAOYSA-N 347.318 3.014 50 40 EGGB CN1C=C(C(F)(F)F)C=C/C1=C(\C#N)C(=O)Nc1ccccc1F 12559281 COCUYFUJVODFDK-KAMYIIQDSA-N 337.276 3.490 50 40 EGGB Cc1nnc(S[C@@H](C)C(=O)C(C#N)=C2Nc3ccccc3N2)s1 7776600 JTZVKEBXZMRGGC-QMMMGPOBSA-N 343.437 3.169 50 40 EGGB Cc1cc(/C=N\NC(=O)c2ccccc2F)ccc1N1CCCC1 408847337 UEBLTCPHYYONJT-BKUYFWCQSA-N 325.387 3.498 50 40 EGGB COC(=O)c1ccccc1-c1ccc(/C=N/NC(=O)c2ccccc2)o1 574766 RRVVYOGBBHCZSV-FYJGNVAPSA-N 348.358 3.497 50 40 EGGB Cc1nc2ccccc2cc1C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 366237 KDCISUOJYKQONI-YBFXNURJSA-N 334.335 3.215 50 40 EGGB COc1cccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)c1OC 5130772 CYSBBLVCWACWGZ-UDYJGSTKSA-N 328.412 3.306 50 40 EGGB O=[N+]([O-])c1ccc(/C(CBr)=N/N2CCCCC2)cc1 8628622 DWBNYSOJRAIKCJ-FYWRMAATSA-N 326.194 3.180 50 40 EGGB CCOc1ccc(/C=C(/C#N)C(=O)Nc2nccs2)cc1OC 13597995 WFNVYNHZFXLQAU-WQLSENKSSA-N 329.381 3.096 50 40 EGGB C[C@@H](Cc1ccccc1)N/C(N)=C(C#N)\C=C1\Nc2ccccc2C1=O 5073543 KSGHTUPMCHOWEM-UCOKGCTFSA-N 344.418 3.093 50 40 EGGB Cc1cccc(/C=N\NC(=O)C(O)(c2ccccc2)c2ccccc2)c1 32136041 GITUTQBZSRCQGE-KQWNVCNZSA-N 344.414 3.381 50 40 EGGB C[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1C(=O)N[C@@H]1OC(=O)c1ccccc1 196242104 YNVUWGMRTJMVRR-IVMMDQJWSA-N 349.503 3.326 50 40 EGGB COc1ccc(/C(C#N)=C/c2ccc(OCC(=O)O)cc2)cc1OC 144172748 UJRPUNRPBJDHBO-OQLLNIDSSA-N 339.347 3.231 50 40 EGGB O=C(CCl)N[C@@H](CC(=O)OC1CCCC1)c1ccc(F)cc1F 1615055521 BIXRBFIRTHLOTD-AWEZNQCLSA-N 345.773 3.237 50 40 EGGB CCOC(=O)/C(C#N)=C/c1c(C)cc(C)c(COC(=O)OC)c1C 43577 CRBFRHYKXSMOHH-RIYZIHGNSA-N 331.368 3.365 50 40 EGGB Cc1cc(SCC(=O)N/N=C/c2cccnc2)c2ccccc2n1 350944 LTMDTFOGGNFMQO-RGVLZGJSSA-N 336.420 3.181 50 40 EGGB N#CC1=C(N)Oc2c(ccc3cccnc23)[C@@H]1c1ccc2c(c1)OCO2 5338225 BRCQFBWKIOXEDA-KRWDZBQOSA-N 343.342 3.182 50 40 EGGB O=C(NNC(=O)c1ccc(-c2ccc(F)cc2)s1)c1ccoc1 16233616 MHACCKMMEHVWBO-UHFFFAOYSA-N 330.340 3.222 50 40 EGGB C=C[Si]1(C)O[Si@](C)(C=C)O[Si](C)(C)O[Si@@](C)(C=C)O1 2002125853 FBXTUBNFTGCQPZ-QZTJIDSGSA-N 332.653 3.160 50 40 EGGB O=C(COc1ccc(Cl)cc1Cl)NNc1ccc([N+](=O)[O-])o1 4805976 CIRVWCXLLRDTPJ-UHFFFAOYSA-N 346.126 3.017 50 40 EGGB N#C/C(=C\c1ccncc1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 408888459 ZZFXERRORVKUHK-YRNVUSSQSA-N 328.715 3.189 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)c(C)c1 33739445 NYFBLHQXBMHUJH-DHDCSXOGSA-N 336.347 3.248 50 40 EGGB O=C(N/N=C/c1ccccc1)c1ccc(NC(=O)c2ccco2)cc1 6337585 QABVAMSMKXCJBU-DEDYPNTBSA-N 333.347 3.296 50 40 EGGB CCCCNC(=O)[C@]12CC[C@@](C)(C(=O)[C@@H]1Br)C2(C)C 100920429 LFKFOZVBTANXNZ-LKTVYLICSA-N 330.266 3.062 50 40 EGGB C=CCOc1c(Cl)cc(/C=C(/C#N)C(=O)N(C)C)cc1OCC 59334658 VPLRBRPVUSQJRT-JYRVWZFOSA-N 334.803 3.299 50 40 EGGB N#C/C(=C\c1ccc(-c2cccc(C(=O)O)c2)o1)C(=O)N1CCCC1 13943574 WWMYILIIRGMLTQ-RVDMUPIBSA-N 336.347 3.174 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)[C@H](OC)c2ccccc2)cc1 4714645 JULIPSHVXUHMQO-SQVRNEIYSA-N 326.396 3.313 50 40 EGGB COc1ccccc1/C=N/NC(=O)NC12CC3CC(CC(C3)C1)C2 4871885 CACWLDGKXORDKR-UDWIEESQSA-N 327.428 3.297 50 40 EGGB Cn1cc([C@H]2C[C@H]2C(=O)NN=C(c2ccccc2)c2ccccc2)cn1 68410937 RKKCMJFRLGYEEI-RTBURBONSA-N 344.418 3.092 50 40 EGGB N#Cc1c(NC(=O)CCl)sc2c1CCN(Cc1ccccc1)C2 19899408 PCPBNFQVMNRWEY-UHFFFAOYSA-N 345.855 3.355 50 40 EGGB CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(CCC2)[C@H]1c1ccccc1 35193593 JPYJMELVGHVDJM-XLIONFOSSA-N 333.391 3.074 50 40 EGGB COc1ccc(C(=O)N/N=C/c2cc(C)n(-c3ccccn3)c2C)cc1 409248163 GLJGGHBLLRVPMK-LPYMAVHISA-N 348.406 3.262 50 40 EGGB CC(C)(C)OC(=O)N1CCC2(CC1)CO[C@@H](CBr)C2 40448097 MMYHBYDKBBFVKS-LLVKDONJSA-N 334.254 3.188 50 40 EGGB CN(C)c1c(Cl)cc(NC(=O)CBr)cc1Cl 96511756 ZWBGWIBZGDZTTL-UHFFFAOYSA-N 326.021 3.393 50 40 EGGB COc1cc(/C=N/NC(=O)[C@@H](C)SCc2ccccc2)ccc1O 313758 LSWHEJFFZJSHAK-OTGIAGGSSA-N 344.436 3.173 50 40 EGGB CCOc1ccc(/C=N/NC(=O)CCc2ccccc2)cc1OC 6048308 UHCZHAXTSLQEDL-XSFVSMFZSA-N 326.396 3.177 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)CCNC(=O)c2ccccc2)cc1 2675766 FDFMDLWIEHRHFZ-HYARGMPZSA-N 337.423 3.080 50 40 EGGB CNC(=O)/C(C#N)=C/c1ccc(-c2cc(C)c(C)c([N+](=O)[O-])c2)o1 565939 CCSQOZOIBDORLG-NTUHNPAUSA-N 325.324 3.125 50 40 EGGB CCOc1ccccc1/C=C(\C#N)C(=O)Nc1cccc(C(=O)O)c1 3255520 DIGUJGMHYHHYQF-XNTDXEJSSA-N 336.347 3.329 50 40 EGGB O=C(O)c1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1 6345395 DVZKFPDXXOYGFV-RGVLZGJSSA-N 334.331 3.008 50 40 EGGB CCC(=O)NNC(=O)c1cc2cc(Oc3ccccc3)ccc2n1C 4676564 ZIHCTOJICYBKMU-UHFFFAOYSA-N 337.379 3.142 50 40 EGGB COc1ccccc1[C@@H]1[C@@H]2CCCC=C2C(C#N)=C(N)C1(C#N)C#N 19818267 LPLWQZMMDQWUPY-KDOFPFPSSA-N 330.391 3.289 50 40 EGGB CC1(C)[C@H]2CC[C@](C(=O)O)(C2)[C@@]1(Br)CBr 4041263 OSNJXUXPWZALOC-WHGOUJPWSA-N 340.055 3.426 50 40 EGGB COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)CCl)CC2 3278158 UTYPGSLYQSEHGZ-IBGZPJMESA-N 345.826 3.417 50 40 EGGB COc1cccc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccc2)c1OC 3249159 QTCHMUBPVOFERY-IQGJIOQQSA-N 336.391 3.488 50 40 EGGB COc1cccc(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)c1OC 20248083 MLFBRPDQDOLYGX-KZKLBEMASA-N 344.436 3.335 50 40 EGGB Cc1oc(/C=N/NC(=O)CCc2ccccc2)cc1Br 409130714 XOWXIIVOTMZUSB-LICLKQGHSA-N 335.201 3.433 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)ccc1O 4979251 MZSOJRLAAQYJGW-RFQVVYOUSA-N 328.412 3.393 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1C 408796747 ZBHFRQXEBTVLGP-NTEUORMPSA-N 337.335 3.458 50 40 EGGB CCCCCN1C(=O)/C(=N\NC(=O)Cc2ccccc2)c2ccccc21 46084992 OORCMELYTMAHGT-ATJXCDBQSA-N 349.434 3.286 50 40 EGGB Cc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(Cl)cc2C)cc1C 3089136 ZNVOZIBWMVWAMA-KEBDBYFISA-N 343.814 3.354 50 40 EGGB Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=C(/C#N)C(=O)N(C)C)o1 408859350 WFSUTPUDJZQAEV-WQLSENKSSA-N 325.324 3.158 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)N2CCCC2)ccc1OC(C)C 409371695 JUEBZPQEKHAZOU-LFIBNONCSA-N 328.412 3.402 50 40 EGGB COc1ccc2[nH]cc(/C=C(\C#N)C(=O)Nc3ccc(O)cc3)c2c1 61720539 ISWKEXMSYJEOGU-XYOKQWHBSA-N 333.347 3.428 50 40 EGGB O=C(N/N=C\c1ccc(F)cc1)c1cc(Br)ccc1O 33775708 JXHWLIGREAFUQX-IUXPMGMMSA-N 337.148 3.058 50 40 EGGB O=C(N/N=C\c1cc([N+](=O)[O-])ccc1O)c1cccc2ccccc12 17428411 IXNWRKHHULCWKO-ODLFYWEKSA-N 335.319 3.218 50 40 EGGB CCOc1cc(/C=N/NC(=O)c2cccc(OC)c2)cc(Cl)c1O 169878612 GUJUBBDFKSXPLY-VXLYETTFSA-N 348.786 3.217 50 40 EGGB CCCC1=C(C(=O)OCC)[C@H](c2cccc(F)c2)C(C#N)=C(N)O1 71017 RRNUTTMVYJMSPT-OAHLLOKOSA-N 330.359 3.251 50 40 EGGB Cc1ccc(-c2ccc(/C=N\NC(=O)c3cnccn3)o2)cc1Cl 67194089 AZXPVCCVMXNDBB-NKVSQWTQSA-N 340.770 3.462 50 40 EGGB N#C/C(=C\c1ccc(C#N)o1)C(=O)Nc1nc(-c2ccncc2)cs1 95402931 WXVXUORXYSCQAQ-KPKJPENVSA-N 347.359 3.215 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)CC[C@@H](O)c2ccccc2)o1 83333626 NTXGFGUWCZDPIG-HDAKKWKLSA-N 343.427 3.090 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C\c2ccc(C)c([N+](=O)[O-])c2)cc1 43080170 KOZKXKBRXLJDFZ-ZROIWOOFSA-N 337.335 3.458 50 40 EGGB O=C(Nc1ccccc1C(=O)NNc1ccccc1)c1ccccc1O 5484255 BTWPPJGDZXEYSC-UHFFFAOYSA-N 347.374 3.401 50 40 EGGB O=C(N/N=C\c1ccc(O)c([N+](=O)[O-])c1)Nc1ccc(Cl)cc1 169961694 FAIAEGLTZFBKCP-PXNMLYILSA-N 334.719 3.109 50 40 EGGB COc1cccc(/C=N/NC(=O)c2c(-c3ccccc3)noc2C)c1 64072 WFCSDKNWLUOBNF-UDWIEESQSA-N 335.363 3.423 50 40 EGGB N#C/C(=C\c1ccc(-c2ccc(Cl)cc2)o1)C(=O)N1CCOCC1 494824 OEEQCFQVGXCLIL-SDNWHVSQSA-N 342.782 3.366 50 40 EGGB C[C@H](Br)C(=O)Nc1sc2c(c1C#N)CC(C)(C)OC2 545854 YZLUQKQFLQJIRE-ZETCQYMHSA-N 343.246 3.193 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)Cc2ccc(OCC)cc2)cc1 10475946 JAMMIALEJSGBNB-RCCKNPSSSA-N 338.407 3.343 50 40 EGGB O=C(CNc1ccc2ccccc2c1)N/N=C/c1ccc([N+](=O)[O-])cc1 31109 LNADUXVVJSQBAR-CIAFOILYSA-N 348.362 3.310 50 40 EGGB COc1ccc(OC)c(/C=N/NC(=O)c2ccccc2-n2cccc2)c1 4063031 LKTWXYLAMSWIIU-KGENOOAVSA-N 349.390 3.258 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)COc2ccccc2OC)cc1 8182392 JDVDHLMLGQIQCL-DEDYPNTBSA-N 342.395 3.013 50 40 EGGB COc1cc(/C=N/NC(=O)c2ccc(Cl)cc2Cl)ccc1O 112660 YORCXXJKHHIJRB-QGMBQPNBSA-N 339.178 3.472 50 40 EGGB O=C(CNc1cccc(Br)c1)N/N=C/c1cccs1 225089 CBEHQJCQAFQLKX-LZYBPNLTSA-N 338.230 3.073 50 40 EGGB O=C(Cc1ccccc1)N/N=C/c1cccn1-c1ccc([N+](=O)[O-])cc1 123563 FGPSHLQGBXAFHT-XSFVSMFZSA-N 348.362 3.078 50 40 EGGB Cc1ccc(C(=O)NNC(=O)[C@@H](C)Oc2ccc(Cl)cc2C)cc1 556449 XPPHXVKUWJOKNL-CYBMUJFWSA-N 346.814 3.185 50 40 EGGB CCOC(=O)c1nnc([C@@H](Br)c2ccc(Cl)cc2)o1 12411208 ZTGFEXFEMCPKQA-VIFPVBQESA-N 345.580 3.384 50 40 EGGB CCOc1cc(/C=N/NC(=O)c2cn(C)c3ccccc23)ccc1O 1855701 XSZIFHVXLFNKEI-RGVLZGJSSA-N 337.379 3.047 50 40 EGGB Cc1ccc(C)c(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])s2)c1C 12844040 GERUSFUFNHFOSQ-CAOOACKPSA-N 347.396 3.111 50 40 EGGB COc1cc(OC)c(/C=N/NC(=O)c2ccc(C)cc2)cc1Cl 408590206 OAUDOXZWCWZMHF-VXLYETTFSA-N 332.787 3.430 50 40 EGGB CC(=O)N/N=C1\C(c2ccc(Br)cc2)=Nc2ccccc21 5817073 BMDSEQZCSFYBHA-SILNSSARSA-N 342.196 3.424 50 40 EGGB COc1ccc(OC)c(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)c1 408798009 DJORIJPPGCTRTO-QAZQYGAVSA-N 328.412 3.306 50 40 EGGB CCOc1ccc(CC(=O)N/N=C\c2ccccc2OCC)cc1 408711946 RVJIXXZEAWWLAF-ZHZULCJRSA-N 326.396 3.177 50 40 EGGB O=C(N/N=C/c1ccc(-c2cccnc2Cl)o1)c1ccncc1 35315882 UGHYTEIQQAAHGO-KEBDBYFISA-N 326.743 3.154 50 40 EGGB C/C(=N/NC(=O)c1cccc(Br)c1)c1ccc(O)cc1O 95483002 CLHSUFOABNGYHU-MFOYZWKCSA-N 349.184 3.014 50 40 EGGB C#CCn1c(C)c(/C=N/NC(=O)c2ccccc2O)c2ccccc21 561513 IDFVGKXAXWAXFJ-FYJGNVAPSA-N 331.375 3.052 50 40 EGGB O=C(NNC(=O)C1CCC1)c1cc(-c2ccco2)nc2ccccc12 17408912 KXIFHWRZOZFAJJ-UHFFFAOYSA-N 335.363 3.056 50 40 EGGB C[C@@H]1CCc2nc3ccccc3c(C(=O)NNC(=O)c3ccoc3)c2C1 61499607 RWSLYODPKCEKGP-GFCCVEGCSA-N 349.390 3.027 50 40 EGGB Cc1cc(/C=C(\C#N)C(N)=O)c(C)n1-c1cccc(Br)c1 409062940 DFAPNNUIVCZTNU-NTUHNPAUSA-N 344.212 3.249 50 40 EGGB O=C(Cc1ccc([N+](=O)[O-])cc1)N/N=C\c1c(O)ccc2ccccc12 17072513 ZSWCNDIWZUXOFA-NDENLUEZSA-N 349.346 3.146 50 40 EGGB CC(=O)N(C)N(C)C(=O)Cc1cn(Cc2ccccc2)c2ccccc12 5478142 NUPHCDOVFUFJIM-UHFFFAOYSA-N 349.434 3.084 50 40 EGGB O=C(COc1cccc(Cl)c1)N/N=C\c1ccc(N2CCCC2)o1 408844620 ICPDKCZVJRSSBD-ODLFYWEKSA-N 347.802 3.062 50 40 EGGB O=C(COc1ccccc1Cl)N/N=C\c1ccc(N2CCCC2)o1 408847701 OCMZBRXOLXSQDW-ODLFYWEKSA-N 347.802 3.062 50 40 EGGB CC[C@H](C)n1nccc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253402321 OCRCDVGALNMZHM-ZBEGNZNMSA-N 340.427 3.305 50 40 EGGB C/C(=N/NC(=O)CSc1nc2ccccc2[nH]1)c1ccc(F)cc1 56097 AADNEIZXAQTHJS-NHDPSOOVSA-N 342.399 3.335 50 40 EGGB CCC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(Cl)cc2)cc1 59314 WHAPEYCLYXWFLZ-YBFXNURJSA-N 329.787 3.452 50 40 EGGB C/C(=N/NC(=O)c1cc(-c2ccc(C)cc2)n[nH]1)c1ccccc1O 101037568 NSGHYWPHWHUEOK-MOSHPQCFSA-N 334.379 3.245 50 40 EGGB CCSC1=C(C#N)[C@H](c2ccccc2C)[C@H](C(=O)OC)C(O)=N1 9089338 ORWUFEPZRFMXEQ-KBPBESRZSA-N 330.409 3.326 50 40 EGGB COC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c1ccc(Cl)cc1Cl 59406 KFRJRTRZOYKJJP-ZDUSSCGKSA-N 339.178 3.248 50 40 EGGB Cn1cc(/C=C(\C#N)C(=O)Nc2ccccc2F)c(-c2ccncc2)n1 63275700 DDQOFTWBHSXRMD-GXDHUFHOSA-N 347.353 3.167 50 40 EGGB CCc1cc(N2C[C@H](C(=O)Cl)CC2=O)cc(C)c1Br 45889634 RHQQJLCDHWSZNQ-SNVBAGLBSA-N 344.636 3.438 50 40 EGGB CN(C)/N=C(\SS/C(=N/N(C)C)C(F)(F)F)C(F)(F)F 17352622 TYPYVVAKBZVSBB-OPCYYNASSA-N 342.334 3.243 50 40 EGGB FC(F)(F)C1(C(F)(F)F)N[C@@H]2[C@H](OCCCl)C[C@H]1[C@H]2Cl 4580430 GCFPUWPAGCMEBN-BDVNFPICSA-N 346.098 3.073 50 40 EGGB CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc3c(c2)OCO3)cc1 5712874 DNFHVCXJNHMQFB-NTEUORMPSA-N 336.347 3.360 50 40 EGGB COC(=O)[C@@H]1C(O)=NC(SC)=C(C#N)[C@@H]1c1ccc(Cl)cc1 80957 LBDRRAQRHHONDC-RYUDHWBXSA-N 336.800 3.281 50 40 EGGB O=C(N/N=C/[C@@H]1C[C@H]2CC[C@@H]1C2)C(O)(c1ccccc1)c1ccccc1 4996868 AVOCCHZHHHQNLQ-WEQRKAIBSA-N 348.446 3.461 50 40 EGGB CCc1ccc(-c2cc(C(=O)N/N=C(/C)c3ccccc3O)[nH]n2)cc1 100847303 WFJZTUAIKWEIEJ-BKUYFWCQSA-N 348.406 3.499 50 40 EGGB O=C(N[C@@H](Cl)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl 104809109 ADSUBPRLVSEEGW-PVQJCKRUSA-N 328.237 3.408 50 40 EGGB CCOC(=O)/C(C#N)=C1\C(=O)N(Cc2ccccc2)c2ccccc21 13115170 ILSBZJQRTQRMSR-VLGSPTGOSA-N 332.359 3.074 50 40 EGGB CCOC(=O)[C@@H]1CCC/C1=N\NC(=O)[C@@H](C)SCc1ccccc1 408719098 DLUALPRVXCTUPB-AFOCRCJBSA-N 348.468 3.144 50 40 EGGB COc1cc(/C=C(/C#N)c2ccc([N+](=O)[O-])cc2)c(O)c([N+](=O)[O-])c1 409355182 CBXUVNXERWJOEM-SDQBBNPISA-N 341.279 3.281 50 40 EGGB CCOC(=O)/C(C#N)=C\c1ccc([C@@H](O)C(Cl)(Cl)Cl)o1 39377203 ZVOGNWSUCCGUKI-ONRRBMGISA-N 338.574 3.153 50 40 EGGB N#C/C(=C\c1cnn(-c2ccc(Cl)cc2)c1)C(=O)NC1CCCC1 40139831 HAYDGMWTCNHYNP-NTEUORMPSA-N 340.814 3.491 50 40 EGGB COc1ccccc1OCC(=O)NN=C1C2CC3CC(C2)CC1C3 351531 QFTYFFMHPRNHSF-UHFFFAOYSA-N 328.412 3.002 50 40 EGGB O=C(CC(=O)Nc1ccc(Cl)c(Cl)c1)NN=C1CCCC1 59501680 LKNZQXAHZVBBIZ-UHFFFAOYSA-N 328.199 3.368 50 40 EGGB COc1ccc(/C=C(\C#N)S(=O)(=O)c2ccc(C)cc2)cc1OC 1967091 UFGSEURPXNHNSH-MHWRWJLKSA-N 343.404 3.351 50 40 EGGB C/C(=N\NC(=O)c1cc2c(s1)C[C@H](C)CC2)c1cc(O)ccc1O 13321862 YAAKCZXFWBWONJ-CPWHCIOUSA-N 344.436 3.438 50 40 EGGB CCCC[C@@H](Br)C(=O)Nc1ccc2c(c1)OCCO2 5298601 IYXOIQQMTOHIGC-LLVKDONJSA-N 328.206 3.350 50 40 EGGB C/C(=N/NC(=O)COc1c(C)cccc1C)c1ccc([N+](=O)[O-])cc1 13847631 FZQVWVZBLYVRAE-RGEXLXHISA-N 341.367 3.131 50 40 EGGB C/C(CC(=O)Nc1ccc(C)cc1)=N\NC(=O)CCc1ccccc1 5363177 QTOHYSFIGBPVFT-CJLVFECKSA-N 337.423 3.449 50 40 EGGB N#CC1=C(N)OC(c2ccccc2)=C(C#N)[C@@H]1c1ccccc1[N+](=O)[O-] 1579667 LPFCLUAZZCGTGR-KRWDZBQOSA-N 344.330 3.337 50 40 EGGB C/C=C1\C[N+]2(CC)CC[C@]34C(=C(C=O)[C@H]1C[C@@H]32)Nc1c(O)cccc14 3999345 ATENPHFDKOJCEO-NLLIVTHGSA-O 337.443 3.097 50 40 EGGB CCCc1[nH]nc2c1[C@@H](c1ccc(N3CCCC3)cc1)C(C#N)=C(N)O2 8783191 COXBOMAFOJTSBE-KRWDZBQOSA-N 349.438 3.181 50 40 EGGB N#CCC(=O)N/N=C/c1ccccc1OCc1ccccc1Cl 3148495 VHLPBNWRPFWZMG-RGVLZGJSSA-N 327.771 3.283 50 40 EGGB O=C(CN1C(=O)c2cccc3cccc1c23)N/N=C/c1cccs1 108904767 KJPAWKLLDAZNPA-VXLYETTFSA-N 335.388 3.012 50 40 EGGB CCCCN1C(=O)C(C#N)=C(C)/C(=C/c2ccc(N(C)C)cc2)C1=O 16752931 BFIAYBLIRGCRPJ-ATVHPVEESA-N 337.423 3.145 50 40 EGGB Cc1ccc(NC(=O)N/N=C\c2ccc(O)c([N+](=O)[O-])c2)cc1C 408962824 JTHNGLWLFKVXLU-MFOYZWKCSA-N 328.328 3.073 50 40 EGGB N#C/C(=C\c1ccc(-c2cccc(Cl)c2)o1)C(=O)N1CCOCC1 134253 RXAURBVAUOFFLR-SDNWHVSQSA-N 342.782 3.366 50 40 EGGB Cc1cc(C)c2c(C)c(C(=O)NNC(=O)C3CCCC3)sc2n1 29153141 WRRKPYPBQXOKDI-UHFFFAOYSA-N 331.441 3.173 50 40 EGGB CCOC(=O)c1csc(/C(C#N)=C/c2cnc3c(C)cccn23)n1 76021664 ITHPPKMWWNEIKG-KPKJPENVSA-N 338.392 3.340 50 40 EGGB N#C/C(=C\c1ccc(OCc2cccc(F)c2)c(Cl)c1)C(N)=O 408887581 RYQITYFOMZGOCD-AWNIVKPZSA-N 330.746 3.450 50 40 EGGB CC[C@H](C)n1nccc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253402314 OCRCDVGALNMZHM-MEDUHNTESA-N 340.427 3.305 50 40 EGGB COC(=O)c1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)cc1 15226188 ADPIUNYBXALQCA-XUCOJJCUSA-N 326.396 3.075 50 40 EGGB C[C@@H](NC(=O)/C(C#N)=C\c1ccc(O)c([N+](=O)[O-])c1)c1ccccc1 206853824 UBSNTEHKDFQPJX-CDCQXCROSA-N 337.335 3.085 50 40 EGGB CC(C)(C)OC(=O)N1C[C@]2(C[C@H]1CBr)CC2(F)F 952958963 ONZBWGFCTFTPNC-KWQFWETISA-N 326.181 3.416 50 40 EGGB Cc1ccc(SCC(=O)NNC(=O)C[C@H]2C[C@@H]3CC[C@@H]2C3)cc1 103000271 IGFLUYOAORCNET-RBSFLKMASA-N 332.469 3.061 50 40 EGGB COc1cc(/C=C(\C#N)c2nc3ccccc3n2C)cc(OC)c1O 5590340 GSKKCIIGPUKZSB-MDWZMJQESA-N 335.363 3.360 50 40 EGGB O=C(N/N=C\C(Cl)=C\c1ccccc1)c1n[nH]c2c1CCCC2 31841376 LTRKIYVLKKRAIK-CGRBAXHDSA-N 328.803 3.284 50 40 EGGB CCOc1cccc(/C=C(\C#N)C(=O)Nc2ccc(C(=O)O)cc2)c1 44023866 OMYZJBXIQKVQNT-XNTDXEJSSA-N 336.347 3.329 50 40 EGGB O=C(N/N=C(\Cc1cccs1)C(F)(F)F)c1cccc(O)c1 97285 BILMIHMYMHYNCC-LDADJPATSA-N 328.315 3.345 50 40 EGGB COc1cc(OC)c(OC)cc1/C=C(\C#N)C(=O)Nc1ccccc1 16411109 SMCYFKRJRMWVEP-NTEUORMPSA-N 338.363 3.258 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 5475354 HIBLGPDFSREJQQ-LDADJPATSA-N 327.340 3.148 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/c2ccc(C(F)(F)F)cc2)c(F)c1 37460 OVIRSWFMLOFLQB-LSFURLLWSA-N 335.260 3.480 50 40 EGGB O=C(N/N=C/c1csc([N+](=O)[O-])c1)C12CC3CC(CC(C3)C1)C2 3898770 BCNJHHQYJPFMND-CAOOACKPSA-N 333.413 3.323 50 40 EGGB COc1cc(/C=N\NC(=O)c2ccccc2C(F)(F)F)ccc1O 408770668 ABFVOZBAGHRYFO-UKWGHVSLSA-N 338.285 3.184 50 40 EGGB Cc1scc(C(=O)NNC(=S)N[C@@H](C)c2ccccc2)c1C 8684272 PVVIPBBIOQSCIW-NSHDSACASA-N 333.482 3.235 50 40 EGGB O=C(CN1CCCCC1)NNc1c2ccccc2nc2ccccc12 5078318 WTYSUVAFGKUAFW-UHFFFAOYSA-N 334.423 3.317 50 40 EGGB COC(=O)COc1ccc(/C=C(/C#N)c2ccc3c(c2)OCO3)cc1 409366429 UZZMREHQFLLFEH-NVNXTCNLSA-N 337.331 3.031 50 40 EGGB COc1cc(/C=N\NC(=O)c2ccc(Cl)cc2)cc(Cl)c1O 30817713 ARLJEFQMPJKXNI-LSCVHKIXSA-N 339.178 3.472 50 40 EGGB CCOc1ccc(C(=O)NN)cc1COc1cccc2ccccc12 224627546 GZFWCDAAAYZTBS-UHFFFAOYSA-N 336.391 3.421 50 40 EGGB CCOc1ccc(/C=N/NC(=O)[C@H](C)Oc2cccc(C)c2)cc1 117846 FCBYQMIISKGABI-NPRIEWAGSA-N 326.396 3.311 50 40 EGGB COc1ccccc1N(/N=C1\Sc2ccccc2C1=O)C(C)=O 13113725 QYEYTJAHIFEBPH-ZCXUNETKSA-N 326.377 3.350 50 40 EGGB C/C(=N\NC(=O)COc1ccc(C)cc1Br)C1CC1 358441 ZWUPDYMEYSYMJZ-MHWRWJLKSA-N 325.206 3.038 50 40 EGGB CC1(C)[C@H]2CC[C@]1(C)/C(=N/NC(=O)COC(=O)c1ccccc1F)C2 102277018 VPMFEJBNHRVNMG-QDQKWQSMSA-N 346.402 3.301 50 40 EGGB N#C/C(=C\Nc1ccc(N2CCCC2)cc1)C(=O)NCc1ccco1 1911178 PVZVPAOWSAPWFV-FYWRMAATSA-N 336.395 3.016 50 40 EGGB C/C(=N/NC(=O)c1cc(-c2ccc(C)s2)n[nH]1)c1cccc(O)c1 4135660 REBQJSGIXPJPPI-WQRHYEAKSA-N 340.408 3.306 50 40 EGGB C/C(=N\NC(=O)c1cccc(Br)c1)c1cccc(N)c1 5260645 GSWFUWJLUGFEMU-VCHYOVAHSA-N 332.201 3.185 50 40 EGGB COc1cc(/C=C(\C#N)C(N)=O)cc(Cl)c1OCc1ccccc1 408870720 WOCRRZZCMZIIHZ-VGOFMYFVSA-N 342.782 3.320 50 40 EGGB O=C(CCc1ccc(-c2ccccc2)o1)NNC(=O)c1cccs1 8357557 XFQGJFGBBMKQFC-UHFFFAOYSA-N 340.404 3.402 50 40 EGGB C/C(=N\NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1O 512696 PMCKINRPBMYKPV-RQZCQDPDSA-N 333.731 3.108 50 40 EGGB CCOc1ccc(C(=O)N/N=C\c2ccccc2OC)cc1OCC 6355649 LROSUFIFHCFNOI-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB COC[C@H](C)Oc1ccc2nc(NC(=O)[C@@H](C)Cl)sc2c1 20132128 RUMHHPXTRVTUPD-DTWKUNHWSA-N 328.821 3.276 50 40 EGGB COc1ccc(/C=N/NC(=O)CNc2ccc3ccccc3c2)cc1 31057 WJLRHXRVWJWPAN-LPYMAVHISA-N 333.391 3.411 50 40 EGGB FC(F)(F)C(Br)(Br)CBr 2584321 YMHRWWVEJJQVIB-UHFFFAOYSA-N 334.755 3.430 50 40 EGGB O=C(Nc1ccccc1C(=O)N/N=C/c1cccs1)c1ccco1 59433461 NZJWHHIFLQMBAU-WOJGMQOQSA-N 339.376 3.357 50 40 EGGB CN(NC(=O)CCCNC(=O)c1ccc(Cl)cc1)c1ccccc1 10737560 IUBIKHSTEBORSX-UHFFFAOYSA-N 345.830 3.018 50 40 EGGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@@H]1C[C@@H]1c1ccccc1 4109643 PIPKSJQWWUXIRL-TXNUPDFCSA-N 338.451 3.154 50 40 EGGB O=C(O)CC/C(=N\NC(=O)[C@@H]1C[C@H]1c1ccccc1)c1ccccc1 4646819 XAVHBAQTZZUWSK-BQKUQICYSA-N 336.391 3.175 50 40 EGGB NNC(=O)Cc1csc(Nc2ccc(Oc3ccccc3)cc2)n1 223451309 NDNYNQQCPXGBNS-UHFFFAOYSA-N 340.408 3.211 50 40 EGGB NNC(=O)CCc1ccc(OCc2ccc(Cl)cc2Cl)cc1 226345229 SCPNBNUBKCLFKZ-UHFFFAOYSA-N 339.222 3.495 50 40 EGGB CCn1nc(C)c([C@@H]2[C@H]3CCCC=C3C(C#N)=C(N)C2(C#N)C#N)c1C 2769702 FCZZYPKTQOKKEW-YJBOKZPZSA-N 346.438 3.113 50 40 EGGB C/C(=N\NC(=O)CSc1nc2ccccc2[nH]1)c1cccs1 12362360 LVQQDRZDLSJXHR-VCHYOVAHSA-N 330.438 3.257 50 40 EGGB COc1cccc(/C=N/NC(=O)[C@H](C)Sc2ccccc2)c1OC 20248085 MLFBRPDQDOLYGX-HCZVKUGISA-N 344.436 3.335 50 40 EGGB Cc1ccc(S[C@H](C)C(=O)N/N=C/c2ccccc2C(=O)O)cc1 409117822 OIRLMUJGIORMAC-OTGIAGGSSA-N 342.420 3.324 50 40 EGGB C#CCn1c(C)c(/C=N/NC(=O)c2ccccc2OC)c2ccccc21 409264268 OFZSEXBECNYHBM-HYARGMPZSA-N 345.402 3.355 50 40 EGGB CCCCOC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(N)=O)o2)cc1 409062864 CBLRMMOXPUMJQT-RVDMUPIBSA-N 338.363 3.296 50 40 EGGB C/C(=N\NC(=O)c1ccc(Br)cc1)c1cccc(N)c1 13477449 QMFDVKRWJIVXAM-VCHYOVAHSA-N 332.201 3.185 50 40 EGGB CCc1ccc(-c2nn(-c3ccccc3)cc2/C=N\NC(N)=O)cc1 5471467 CDMGGQGQJNCXSW-MTJSOVHGSA-N 333.395 3.104 50 40 EGGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C2CCCCC2)c1 358639 VGHLWTYIEHKOBB-UHFFFAOYSA-N 332.444 3.225 50 40 EGGB COc1ccccc1N[C@@H](C)C(=O)N/N=C(/C)c1ccc(C)cc1 4619270 PPIIADHXFFOZDK-JTMDUIFQSA-N 325.412 3.344 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)c2ccccc2Cl)cc1[N+](=O)[O-] 408592064 XISWEWIUZHEXBG-VCHYOVAHSA-N 347.758 3.411 50 40 EGGB CC(C)N(C[C@H]1CCCN(C(=O)CCl)C1)C(=O)OC(C)(C)C 79408877 XSJFKVZKJCKELP-ZDUSSCGKSA-N 332.872 3.109 50 40 EGGB O=C(N/N=C/c1ccsc1)C(O)(c1ccccc1)c1ccccc1 567234 MAJUDQCUISMZAC-DEDYPNTBSA-N 336.416 3.134 50 40 EGGB COc1ccc(C(=O)NNC(=O)Nc2cccc3ccccc23)cc1 5526891 JSTFCSHBTRQJDN-UHFFFAOYSA-N 335.363 3.315 50 40 EGGB BrCC1(CBr)COc2cscc2OC1 100191071 JSDPDQPADLMIHM-UHFFFAOYSA-N 342.052 3.296 50 40 EGGB C[C@@H]1C[C@H]1C(=O)NNc1nnc(-c2ccccc2)n1-c1ccccc1 31670830 OPELCFXDNGDSMN-CZUORRHYSA-N 333.395 3.033 50 40 EGGB O=C(Nc1ccccc1C(=O)N/N=C/c1ccncc1)c1ccccc1 231360 YFDHVYHGPCYEBQ-HYARGMPZSA-N 344.374 3.098 50 40 EGGB CCCCCOc1ccc(/C=N/NC(=O)c2c(Cl)cnn2C)cc1 2747555 UPCRZARBSWBQGZ-YBFXNURJSA-N 348.834 3.406 50 40 EGGB C/C(=N/NC(=O)CSc1nc(C)cc(C)n1)c1ccccc1Cl 57415963 LMZPBSAPSHZGQC-NDENLUEZSA-N 348.859 3.379 50 40 EGGB CC(C)(C)c1ccc(OCC(=O)N/N=C/c2cccc(O)c2)cc1 509041 NWIHPERJMXCYQL-UDWIEESQSA-N 326.396 3.219 50 40 EGGB COC(=O)c1ccc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccc2)cc1 3322588 RUXHXCUDZVVGRO-QCUKBLKESA-N 334.375 3.258 50 40 EGGB COc1ccc2ccccc2c1/C=N/NC(=O)c1cc(O)cc(O)c1 13322284 OTGJPQPZRMLXPU-RGVLZGJSSA-N 336.347 3.024 50 40 EGGB Cc1ccc(Cl)c2c1NC(=O)/C2=N\NC(=O)c1ccccc1Cl 15015352 BEPPNZQRFCLESZ-UHFFFAOYSA-N 348.189 3.388 50 40 EGGB CNC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc3ncccc3c2)c1C 408965552 IRIVYNMDIHLGSC-YVLHZVERSA-N 330.391 3.295 50 40 EGGB COc1ccc(/C=N\NC(=O)c2cccc(NC(C)=O)c2)cc1Cl 33329398 FNAUJSYPKXTLTL-GRSHGNNSSA-N 345.786 3.071 50 40 EGGB CC1=C[C@]2(Nc3cc(C)c(C)c(Br)c3O2)C(C#N)=C(N)O1 40545227 NCANOAJYNGMYCX-OAHLLOKOSA-N 348.200 3.194 50 40 EGGB COc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2C)cc1 242713 INRHIJCXLMZYOB-VXLYETTFSA-N 332.787 3.186 50 40 EGGB O=[P@@]1(N(CCCl)C[C@H](Cl)CCCCl)NCCCO1 4794953 CEWZNIGUQAHDRC-MGNBDDOMSA-N 337.615 3.272 50 40 EGGB CCOC(=O)/C(C#N)=C/c1ccc(-c2cc([N+](=O)[O-])ccc2O)o1 59416962 PLICRVNRRIZYMH-JXMROGBWSA-N 328.280 3.030 50 40 EGGB Cc1ccccc1CSCC(=O)N/N=C/c1ccc(N(C)C)o1 408999512 WTZFFJFAYRGFQZ-VCHYOVAHSA-N 331.441 3.038 50 40 EGGB COc1ccccc1/C=C(\C#N)C(=O)Nc1cc([N+](=O)[O-])ccc1C 40865912 DDWNMHPQFUFMEU-NTEUORMPSA-N 337.335 3.458 50 40 EGGB Cc1ccc(CC(=O)N/N=C\c2ccc(Br)cc2)cc1 195751018 BSENJGBEGDJGMO-WQRHYEAKSA-N 331.213 3.450 50 40 EGGB COc1ccc([C@@H]2C(C#N)=C(N)S[C@H]2C(=O)c2ccccc2)cc1 49865 FTDZHPJQSQTBIO-SJLPKXTDSA-N 336.416 3.471 50 40 EGGB O=[N+]([O-])c1ccc(S(=O)(=O)C[C@H](Cl)c2ccccc2)cc1 126875 DOVCSFCXQWKXEM-AWEZNQCLSA-N 325.773 3.349 50 40 EGGB COc1ccc(SCC(=O)N/N=C\c2cc(C)c(O)c(C)c2)cc1 106644006 IJOXBNGOVYGUQB-GRSHGNNSSA-N 344.436 3.260 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 566164 DPCHHHLJRQOCOS-NTEUORMPSA-N 337.335 3.458 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2)ccc1OCC#N 2777464 RLIPOHZGPJHJEN-LFIBNONCSA-N 347.374 3.452 50 40 EGGB O=C(CN1C(=O)c2cccc3cccc1c23)N/N=C/c1ccccc1F 108188556 NJPXTZJNAPFBCH-SSDVNMTOSA-N 347.349 3.089 50 40 EGGB CN(C)c1ccc(-n2cccc2/C=N\NC(=O)c2cccs2)cc1 12630696 HJXHPNRBTUBHKY-UYRXBGFRSA-N 338.436 3.369 50 40 EGGB CCOC(=O)/C(C#N)=C/c1ccc(-c2ccc(C(=O)O)cc2C)o1 408829130 KOXSVFHUUOKHNK-UKTHLTGXSA-N 325.320 3.423 50 40 EGGB O=C(CCC1CCCC1)NNC(=O)c1cc2ccccc2cc1O 6602436 MLCCCPYDAHLOGB-UHFFFAOYSA-N 326.396 3.277 50 40 EGGB Cc1c(C(=O)NNC(=O)c2cc3c(s2)CCC3)oc2ccccc12 15856081 HOQHILGWJHFYQC-UHFFFAOYSA-N 340.404 3.366 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)CSc2ccccc2)cc1 408829797 MDEQIMQEBSNHEX-CPNJWEJPSA-N 326.421 3.494 50 40 EGGB O=C(Cl)c1ccc(-c2nn3c(C(F)(F)F)nnc3s2)cc1 73634512 CEUHHDVXGVEHDB-UHFFFAOYSA-N 332.694 3.251 50 40 EGGB COc1ccc([C@H]2C(C#N)=C(N)OC(C(C)(C)C)=C2C#N)cc1OC 547603 SQNZCRCCTAYPAX-MRXNPFEDSA-N 339.395 3.335 50 40 EGGB Cc1cc(C(=O)O)ccc1-c1ccc(/C=N/NC(=O)c2ccccn2)o1 9260298 APIZFGIHMMORIO-SRZZPIQSSA-N 349.346 3.112 50 40 EGGB COc1cccc(NC(=O)/C(C#N)=C/c2cc(OC)ccc2OC)c1 59133253 JXQXHYYKGXPKRR-NTEUORMPSA-N 338.363 3.258 50 40 EGGB C/C(=N/NC(=O)[C@@]1(C)CC1(Cl)Cl)c1cc(Cl)ccc1O 17070665 NYJADIOBPIIIGV-JGSGYBEMSA-N 335.618 3.470 50 40 EGGB O=C(N/N=C(\CC(=O)c1cccs1)C(F)(F)F)c1cccnc1 13142658 BBZOPDDWLKIKKE-XDHOZWIPSA-N 341.314 3.064 50 40 EGGB O=C(NNC(=O)c1ccc(Cl)cc1)NC12CC3CC(CC(C3)C1)C2 4576730 ACSFWQDVXJAPLT-UHFFFAOYSA-N 347.846 3.253 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)c2ccc(OC)cc2OC)cc1 33797536 DBELNGLFVVJMFT-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB CC(C)(C)OC(=O)N(C1CCC(NC(=O)CCl)CC1)C1CC1 83318749 VSXGVCAUDSLWGJ-UHFFFAOYSA-N 330.856 3.052 50 40 EGGB Cc1cc(C(F)F)nn1[C@@H](C)C(=O)N/N=C/c1ccc(F)s1 252485482 GWKIMRDKXIZATN-INAZWQERSA-N 330.335 3.041 50 40 EGGB Cc1cc(C)nc(NNC(=O)c2ccc(C3SCCS3)cc2)n1 14511537 CBNGWXPPLIOHAU-UHFFFAOYSA-N 346.481 3.329 50 40 EGGB O=C(CNc1ccc2ccccc2c1)N/N=C/c1ccc2c(c1)OCO2 131907 AKWFIPNGNLANKW-SSDVNMTOSA-N 347.374 3.131 50 40 EGGB CCC(=O)NNC(=O)CSc1nc2cc(C)c(C)cc2cc1CC 4849447 XNDADWDPYFVOIH-UHFFFAOYSA-N 345.468 3.064 50 40 EGGB COc1cccc(C(=O)N/N=C/c2cccc(OC)c2OC(C)C)c1 564201 WTKLEUPLJQPGAP-UDWIEESQSA-N 342.395 3.255 50 40 EGGB Cc1ccc(-c2cc(C(=O)N/N=C/c3c[nH]c4ccccc34)[nH]n2)o1 9274132 DAFUAQGQDIUPDM-KEBDBYFISA-N 333.351 3.223 50 40 EGGB O=C(N/N=C/c1ccc(O)c(Br)c1)c1ccccc1F 44393988 KBPIHXNCLTYWSD-CAOOACKPSA-N 337.148 3.058 50 40 EGGB Cc1cc(Br)cc(/C=N/NC(=O)c2cccs2)c1O 569167 IGXQRCPNJDENGZ-VIZOYTHASA-N 339.214 3.289 50 40 EGGB Cn1cc(/C=N/NC(=O)CC2(C)SCCS2)c2ccccc21 6348176 DAODDYNGXKXIMI-LICLKQGHSA-N 333.482 3.215 50 40 EGGB COc1ccc([C@@H]2NC(N)=C(C#N)C3=C2[C@@H](C)CCC3)cc1OC 1652465 GUWTUEWWTLWBKU-VOJFVSQTSA-N 325.412 3.159 50 40 EGGB C/C(=N\NC(=O)Cc1ccc(C)c(C)c1)c1cccc([N+](=O)[O-])c1 108156547 XGDYZKMRQVBSBK-XMHGGMMESA-N 325.368 3.295 50 40 EGGB O=C(Cc1ccc(Br)cc1)N/N=C\c1ccc(F)cc1 100062964 PLGBXJOYXXTPMC-ZDLGFXPLSA-N 335.176 3.281 50 40 EGGB CCCOC(=O)CSC1=C(C#N)[C@@H](c2ccc(C)cc2)CC(=O)N1 2475437 SRGRIAWHGUWYIQ-CQSZACIVSA-N 344.436 3.020 50 40 EGGB CCCOc1ccc(C(=O)N/N=C/c2cccc(OC)c2OC)cc1 20197512 LACCNXMDBNCQBL-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB Cc1cccc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)c1 37442 GITUTQBZSRCQGE-XQNSMLJCSA-N 344.414 3.381 50 40 EGGB CCc1sc(C(=O)NNC(=O)C(F)(F)c2ccccc2)cc1C 40144594 JSDCISIXWZLLHM-UHFFFAOYSA-N 338.379 3.172 50 40 EGGB O=C(O)/C=C/[PH](c1ccccc1)(c1ccccc1)c1ccccc1 104086697 WDXCQTGETMJXKF-WUKNDPDISA-N 334.355 3.311 50 40 EGGB COc1ccc2ccc(OC)c(/C=N\NC(=O)c3cccnc3)c2c1 409008356 WJXYQUKTXGIUKY-MTJSOVHGSA-N 335.363 3.016 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1ccccc1Br 83315149 CKGVHVMAUSFLPW-ZDLGFXPLSA-N 335.176 3.281 50 40 EGGB CCC(CC)=NNC(=O)[C@@H](NC(=O)c1ccccc1)c1ccccc1 4416304 SFIXPIMYZXRBOI-SFHVURJKSA-N 337.423 3.450 50 40 EGGB O=C(Cl)c1cccc2c1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1-2 1717035 ZTORFYXHWOFZQM-UHFFFAOYSA-N 332.655 3.093 50 40 EGGB CCCCc1ccc(NC(=O)C(=O)N/N=C/c2cccs2)cc1 3080074 PIVFFVVXWRFUPS-LDADJPATSA-N 329.425 3.180 50 40 EGGB Cc1nc2ccccc2cc1C(=O)N/N=C/c1ccc(C(=O)O)cc1 1008037 KNUVXKHBXUUDRA-RGVLZGJSSA-N 333.347 3.005 50 40 EGGB CCCCCCCCCCC(=O)NNC(=S)NC[C@H]1CCCO1 97941869 PAKWXSNTQVNMAZ-OAHLLOKOSA-N 343.537 3.192 50 40 EGGB CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1ccc(F)cc1 3254307 OJJOUNDEXRXQHO-OQLLNIDSSA-N 340.354 3.196 50 40 EGGB Cc1nn(-c2ccccc2)c(C)c1/C=C(\C#N)C(=O)Nc1nccs1 13137351 BXRRPAKBJNXFSY-GXDHUFHOSA-N 349.419 3.491 50 40 EGGB C/C(=N\NC(=O)COc1ccc(C(C)(C)C)cc1)c1cccnc1 5119660 XLWZLIIMCBOXMB-KGENOOAVSA-N 325.412 3.298 50 40 EGGB O=C(CSc1ccc2ccccc2c1)NNC(=O)c1cccs1 6507864 VIZIKRDSELJUMX-UHFFFAOYSA-N 342.445 3.455 50 40 EGGB CCOc1ccc(Cl)cc1/C=N/NC(=O)c1cccc([N+](=O)[O-])c1 382258 WIFIDSJLIVYBKT-VCHYOVAHSA-N 347.758 3.411 50 40 EGGB C/C(=N\NC(=O)Cn1cnc2ccccc21)[C@@H]1C[C@H]1c1ccccc1 585145954 HWZFXZGORJWZLJ-SLKXRBMJSA-N 332.407 3.332 50 40 EGGB CCOCCCNC(=O)/C(C#N)=C\c1cc2c(O)cccc2s1 585136280 ZNXVJMICDLTZEL-XFXZXTDPSA-N 330.409 3.057 50 40 EGGB O=C(CC12CC3CC(CC(C3)C1)C2)N/N=C/c1ccc(C(=O)O)cc1 6675415 YYMYRYFEFLGGSV-CIAFOILYSA-N 340.423 3.441 50 40 EGGB CN(C)c1ccc([C@@H]2[C@@H]3CCCC=C3C(C#N)=C(N)C2(C#N)C#N)cc1 20123562 GHOSEHVBNZLUNA-IEBWSBKVSA-N 343.434 3.346 50 40 EGGB CCn1c(C)cc2c(c1=O)[C@H](c1cccc(Cl)c1)C(C#N)=C(N)O2 2228858 DQTJRRSPVOPSQG-OAHLLOKOSA-N 341.798 3.048 50 40 EGGB C/C(CC(=O)Nc1ccc(F)cc1F)=N\NC(=O)c1cccs1 12629484 FDGWUSGQILJHOP-DJKKODMXSA-N 337.351 3.161 50 40 EGGB Cc1ccc(C(=O)NNC(=O)c2ccc(C(F)(F)F)cc2)c(C)c1 5271692 AFYCZQVGHSPJCT-UHFFFAOYSA-N 336.313 3.397 50 40 EGGB O=C(N/N=C/c1ccncc1)c1ccc(OCc2ccccc2)cc1 4889040 QCAZVQNBCACWFW-HYARGMPZSA-N 331.375 3.425 50 40 EGGB C[Si](CCCOC[C@]1(O[Si](C)(C)C)CO1)O[Si](C)(C)C 198364348 MWYAICWFDRATCU-ZDUSSCGKSA-N 335.645 3.444 50 40 EGGB N#C/C(=C\c1ccc(Cl)c(Cl)c1)C(=O)NC[C@@H]1CCCO1 289102 FKVZAUAAVXPLFO-BCMYLCSRSA-N 325.195 3.196 50 40 EGGB C/C(=N\NC(=O)COc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 12362329 VKIUSWRVULEHGV-WOJGMQOQSA-N 347.758 3.167 50 40 EGGB CCCCSC1=C(C#N)[C@H](c2ccccc2OC)[C@@H](C#N)C(=O)N1 16956853 DAXHIKRBUFIOKG-CZUORRHYSA-N 341.436 3.317 50 40 EGGB COc1ccccc1C(=O)N/N=C/c1ccc(N2CCCC2)cc1C 59158378 YILSGCVTQKRQHI-KGENOOAVSA-N 337.423 3.368 50 40 EGGB CCCCNC(=O)/C(C#N)=C\c1ccc(F)c(Br)c1 96021830 CWBOAOAFNFFDQU-XFFZJAGNSA-N 325.181 3.411 50 40 EGGB C=CCOc1cccc(/C=N/NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 408859657 OQIVXAUZXUAOJH-XDHOZWIPSA-N 339.351 3.232 50 40 EGGB C=CCn1c(C)c(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)c2ccccc21 408820194 UKZWDEIQCBDKKH-NWNNTGRJSA-N 349.434 3.338 50 40 EGGB Cc1ccc(CSCC(=O)N/N=C/c2ccc(N(C)C)o2)cc1 408988588 DYDCRWPRVUJUQY-VCHYOVAHSA-N 331.441 3.038 50 40 EGGB COc1ccc(CC(=O)N/N=C2/Nc3cccc4cccc2c34)cc1 1258087 ZKRUHLQNDKHOCC-UHFFFAOYSA-N 331.375 3.294 50 40 EGGB N#CC1=C(S)N(c2ccc(F)cc2)[C@H](c2cccs2)NC1=O 352254 UFUGIGWDNIDTBB-CYBMUJFWSA-N 331.397 3.187 50 40 EGGB CCOc1ccccc1[C@H]1C(C#N)=C(SC)N=C(O)[C@H]1C(=O)OC 8972793 XUHOQRJQLUCHQS-KBPBESRZSA-N 346.408 3.026 50 40 EGGB CCCOc1ccc(/C=N\NC(=O)c2ccc(NC(C)=O)cc2)cc1 107892282 LZWWSTXKPMZAGH-MOSHPQCFSA-N 339.395 3.198 50 40 EGGB CC(C)=C[C@@H]1[C@H](C(=O)NNC(=O)c2ccc(OC(C)C)cc2)C1(C)C 24714038 WKMRKWNACYZSRO-IAGOWNOFSA-N 344.455 3.473 50 40 EGGB CCCCc1[nH]nc2c1[C@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 5044856 OGPKALODHISOMU-INIZCTEOSA-N 333.395 3.452 50 40 EGGB CC1=C(C#N)[C@](NC(=O)c2ccc(Cl)cc2)(C(F)(F)F)C(O)=N1 4615322 LPUAUDYMPLRLLO-CYBMUJFWSA-N 343.692 3.139 50 40 EGGB Cc1ccc(C(=O)N/N=C2\C(=O)Nc3ccc(C)cc32)c(Cl)c1 9190649 URDJKNQZGWSWNG-UHFFFAOYSA-N 327.771 3.043 50 40 EGGB C/C(=N\NC(=O)COc1ccccc1Cl)c1cc(C)ccc1O 8181970 IORABIPMWQHDRX-XDHOZWIPSA-N 332.787 3.273 50 40 EGGB CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2)cc1C(=O)O 409173528 JIMZOLIHKQTCQH-GXDHUFHOSA-N 336.347 3.329 50 40 EGGB C[C@]12CC[C@H]3[C@@H](CC[C@@]45O[C@@H]4C(O)=C(C#N)C[C@@]35C)[C@@H]1CC[C@@H]2O 253476150 KVJXBPDAXMEYOA-PNQSEIDWSA-N 329.440 3.467 50 40 EGGB O=C(CCC(=O)Nc1ccccc1Cl)N/N=C/c1ccccc1 2133815 ZWKOMYUALCFNRT-XDHOZWIPSA-N 329.787 3.209 50 40 EGGB O=C(Cc1cc(O)n[nH]1)N/N=C/c1c2ccccc2cc2ccccc12 5349975 HKCZPTCUIWUGIT-CIAFOILYSA-N 344.374 3.115 50 40 EGGB CNc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2F)cc1[N+](=O)[O-] 14361371 FRITZEBKVXLIRT-XYOKQWHBSA-N 340.314 3.321 50 40 EGGB N#C/C(=C\[C@H]1C[C@H](Cl)C[C@H](Cl)[C@@H]1O)C1CCC([N+](=O)[O-])CC1 5328070 NUBBBMPTQGNFID-SPAMLPJRSA-N 347.242 3.258 50 40 EGGB N#CC1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@@H]1c1ccccc1Cl 18223106 JQLNGMAAHHDVCH-OAHLLOKOSA-N 349.777 3.400 50 40 EGGB Cc1cc2c(cc1/C=C(\C#N)C(=O)N[C@H]1CCCC[C@@H]1C)OCO2 5006602 FFTNFDAMRYEIRM-PGZALSFYSA-N 326.396 3.326 50 40 EGGB Cc1ccc(NCC(=O)N/N=C/c2c(O)ccc3ccccc23)cc1 251856 ZPASLNQVRHEQKI-WSDLNYQXSA-N 333.391 3.416 50 40 EGGB COCCNC(=O)/C(C#N)=C/c1ccc(-c2ccc(Cl)cc2)o1 4515090 GLLUEGWNZDRIFH-JLHYYAGUSA-N 330.771 3.270 50 40 EGGB CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)OC)o2)cc1 214066508 NVVVXPVNDYMPAH-UVTDQMKNSA-N 325.320 3.203 50 40 EGGB O=C(CBr)c1ccc(-n2cc(Br)cn2)cc1 44676325 VQWFXKXISNNHPS-UHFFFAOYSA-N 344.006 3.212 50 40 EGGB O=C1OC(=O)c2ccccc2/C1=N/Nc1ccc(C(F)(F)F)cc1 95671318 KTFOUSHEAURQBQ-BKUYFWCQSA-N 334.253 3.219 50 40 EGGB Cc1cc(C(=O)N/N=C2/C(=O)Nc3ccc(C(C)C)cc32)c(C)o1 6404243 WTWMGFLTPLFEHY-UHFFFAOYSA-N 325.368 3.106 50 40 EGGB CCCOc1ccc(C(=O)N/N=C\c2ccc([N+](=O)[O-])cc2)cc1 32202666 GUGCCVZICUQLBX-PDGQHHTCSA-N 327.340 3.148 50 40 EGGB O=C(N/N=C/c1ccncc1)c1ccccc1OCc1ccccc1 234659 NVYYCVCQVDJWTG-HYARGMPZSA-N 331.375 3.425 50 40 EGGB CCCOc1ccc(C(=O)N/N=C/c2ccc(N(C)C)cc2)cc1 20197501 ULNYZTWCDJLSFT-XSFVSMFZSA-N 325.412 3.305 50 40 EGGB COc1cccc(NC(=O)/C(C#N)=C/c2sccc2NC(C)=O)c1 96035068 FFIZEONXXQJIQE-XYOKQWHBSA-N 341.392 3.261 50 40 EGGB NNC(=O)c1ccc(OCc2ccc(F)cc2Cl)c(Cl)c1 216815435 TWRFMPDYQNPXDG-UHFFFAOYSA-N 329.158 3.315 50 40 EGGB O=S1(=O)OCc2cc(CBr)ccc2-c2ccccc21 224804582 ROPQBBFSSHVRFI-UHFFFAOYSA-N 339.210 3.467 50 40 EGGB CC(C)N1C(=O)/C(=C(\C#N)C(=O)NC2CCCCC2)c2ccccc21 145420391 NGPNSOZHJSUWSH-FBMGVBCBSA-N 337.423 3.168 50 40 EGGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccccc1OCC#N 9296399 FNLGCLKLIHPBFZ-KRWDZBQOSA-N 349.390 3.040 50 40 EGGB Cc1cc2occ(CC(=O)NNC(=O)C3CCCCC3)c2cc1C 9883150 OFIQGVUKRXIXQL-UHFFFAOYSA-N 328.412 3.320 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C/c2ccc(C)cc2)c([N+](=O)[O-])c1 408892553 CLKNSURKIWWEDE-NTEUORMPSA-N 337.335 3.458 50 40 EGGB O=C(Cc1cccc2ccccc12)N/N=C/c1ccc(O)c([N+](=O)[O-])c1 36034641 BUFWBWNUBNBTQI-UDWIEESQSA-N 349.346 3.146 50 40 EGGB N#C/C(=C/c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1ccc(O)cc1 33850239 OUNCYDVCMPNHGD-XFFZJAGNSA-N 343.726 3.499 50 40 EGGB CCOc1ccc(/C=N\NC(=O)[C@H](C)Oc2cccc(C)c2)cc1 31776187 FCBYQMIISKGABI-HYTQYMIGSA-N 326.396 3.311 50 40 EGGB N#C/C(=C/c1cccc(F)c1)C(=O)N1CCN(c2ccccc2)CC1 255916482 LYXLSJNGPYJTBI-LGMDPLHJSA-N 335.382 3.081 50 40 EGGB COc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2C)cc1 59152934 NSUVEKUKQMXDQY-KGENOOAVSA-N 337.423 3.368 50 40 EGGB Cc1cc(C)nc(NNC(=O)c2cc(-c3cccc(Cl)c3)on2)n1 48279888 IBUYRMJJFGCKQU-UHFFFAOYSA-N 343.774 3.159 50 40 EGGB CSc1nc2c(cc1C#N)C(=O)[C@@H](Br)C(C)(C)C2 4994275 IUXMYQSYAAGQIT-LLVKDONJSA-N 325.231 3.204 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2ccc(C#N)cc2)c(OCC)c1 408736953 FGCIDVAQWAHWGD-FYJGNVAPSA-N 337.379 3.120 50 40 EGGB CCn1c(C)cc(/C=N/NC(=O)CNc2ccc(C)c(C)c2)c1C 409104206 BUKJHJXVDGDONL-SRZZPIQSSA-N 326.444 3.304 50 40 EGGB CCC[C@@H](C)c1ccc(OCC(=O)N/N=C/c2cccn2C)cc1 137812 MZJYJDFDNXZLAN-OOWUWCJESA-N 327.428 3.458 50 40 EGGB Cc1cc(C)c(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)c(C)c1 356759 PMWPXMZPPAYIJK-VXLYETTFSA-N 341.367 3.049 50 40 EGGB COc1cc(/C=N/NC(=O)[C@H](C)SCc2ccccc2)ccc1O 313755 LSWHEJFFZJSHAK-MDBUFAAASA-N 344.436 3.173 50 40 EGGB O=C(N/N=C/c1ccccc1Cl)c1ccccc1NC(=O)C1CC1 1739579 JYQOIOVMLOCKME-RGVLZGJSSA-N 341.798 3.452 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2ccc(C)cc2OC)cc1OC 408750014 WFAGHDYPZOETLB-UDWIEESQSA-N 342.395 3.175 50 40 EGGB Cc1cccc[n+]1/C(C(=O)c1ccc(Cl)cc1)=C(\C#N)C(=C=N)C#N 409415779 AGWYWUMMUCNYLU-ISLYRVAYSA-N 347.785 3.252 50 40 EGGB Cc1ccc(C)c(NC(=O)/C(C#N)=C2\C(=O)Nc3ccc(C)cc32)c1 39556001 BGBFMXAURJLXEF-SDXDJHTJSA-N 331.375 3.480 50 40 EGGB NNC(=O)c1cn(C(=O)c2cccc3ccccc23)c2ccccc12 216950860 TYNCWVXGHBPBQV-UHFFFAOYSA-N 329.359 3.087 50 40 EGGB COc1ccc(/C=C2/C(C)=C(C#N)c3nc(N)c(C#N)c(C)c32)cc1O 100370827 VAUGOGVBYSZCJJ-MLPAPPSSSA-N 344.374 3.409 50 40 EGGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@H]1[C@@]12C=C[C@@H](CC1)C2 406835 LDIVSFFWSCEOTP-QUGJLEDBSA-N 332.359 3.319 50 40 EGGB Cc1ccc(NC(=O)NN(C)c2c(Cl)c(Cl)nn2C)cc1 1390834 DMRNBESWTDWXEC-UHFFFAOYSA-N 328.203 3.208 50 40 EGGB C/C(CC(=O)Nc1ccc(C(C)C)cc1)=N\NC(=O)c1cccnc1 10039105 VTERLCCRMOCHAY-HYARGMPZSA-N 338.411 3.340 50 40 EGGB CC(=O)N/N=C/c1ccc(OCCCOc2ccccc2C)cc1 27834888 RYIPCVDBVJTUSG-XSFVSMFZSA-N 326.396 3.313 50 40 EGGB CN(C)c1ccc(N2C=C(C#N)S(=O)(=O)c3ccc(F)cc32)cc1 65095944 SCZFZCLBBAMTED-UHFFFAOYSA-N 343.383 3.182 50 40 EGGB N#C/C(=C/c1ccc(C#N)cc1)c1nc(N)nc(Nc2ccccc2)n1 96931650 QJQYBQOYKIBBNZ-GDNBJRDFSA-N 339.362 3.133 50 40 EGGB Cc1cc(C)n(C(=O)/C(C#N)=C/c2ccc(Cl)c([N+](=O)[O-])c2)n1 409370265 NUMCOQYQWFUGRO-WUXMJOGZSA-N 330.731 3.309 50 40 EGGB N#C/C(=C\c1cc(Cl)ccc1O)C(=O)NCCc1ccccc1 408818216 XEJHKZFXARZXBK-XNTDXEJSSA-N 326.783 3.311 50 40 EGGB O=C(O)CC[PH](c1ccccc1)(c1ccccc1)c1ccccc1 72283136 ADLGMIFSXLCREI-UHFFFAOYSA-N 336.371 3.188 50 40 EGGB in-vitro CC(=O)Nc1ccsc1/C=C(\C#N)C(=O)Nc1ccc(F)cc1 96035067 XCAKNAGASUOGNO-DHZHZOJOSA-N 329.356 3.391 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2cc(C)nc3ccccc23)cc1O 4897974 FGHBZTUCAWVOCX-CIAFOILYSA-N 349.390 3.411 50 40 EGGB Cn1cc([C@H]2C[C@@H]2C(=O)NN=C(c2ccccc2)c2ccccc2)cn1 68410932 RKKCMJFRLGYEEI-MOPGFXCFSA-N 344.418 3.092 50 40 EGGB C/C(=N/NC(=O)c1cccc(F)c1)c1ccc(NC(=O)C2CC2)cc1 17071082 GTUPBTMFKMBSPO-UUYOSTAYSA-N 339.370 3.328 50 40 EGGB C[C@H](NC(=O)/C(C#N)=C\c1ccco1)c1cccc(-n2cccn2)c1 98056154 YJKBNEISEVERNW-QXPQOBGOSA-N 332.363 3.250 50 40 EGGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1 253408 HUVDEFRAACEDKJ-CXUHLZMHSA-N 348.156 3.121 50 40 EGGB Cc1cc(SC#N)cc(C)c1NC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 102634396 NINRBSUBDDSGPW-VIRABCJISA-N 342.420 3.338 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)[C@@H](OC)c2ccccc2)cc1 4714646 JULIPSHVXUHMQO-OFBHVFLISA-N 326.396 3.313 50 40 EGGB COc1cccc(C=NNC(=O)COc2ccccc2C(C)C)c1O 245242040 XLMAVKMKZCIPNH-UHFFFAOYSA-N 342.395 3.053 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)CNc2ccc(F)cc2)cc1 252165 ZZBUEBMHDFUJNO-LPYMAVHISA-N 342.418 3.234 50 40 EGGB O=C(N/N=C(\CC(=O)c1cccs1)C(F)(F)F)c1ccncc1 100405289 VTWSGHVANQNDPO-XDHOZWIPSA-N 341.314 3.064 50 40 EGGB Cc1ccc2occ(/C=N/NC(=O)c3ccc(C)c(C)c3)c(=O)c2c1 2754577 NJSWPLZOUGRSSX-UFFVCSGVSA-N 334.375 3.482 50 40 EGGB O=C(N/N=C\c1cc([N+](=O)[O-])c(Cl)cc1Cl)c1ccncc1 409214010 WPIRUBBDCFTYFU-IDUWFGFVSA-N 339.138 3.061 50 40 EGGB N#Cc1cc(C(=O)[C@H](Br)CBr)ccc1F 308799862 JXTHXDULQJQGCA-MRVPVSSYSA-N 334.970 3.038 50 40 EGGB CCOc1ccc(/C=N/NC(=O)[C@H]2[C@@H]3CCCC[C@@]32C)cc1OC 5654149 DZVFTTHPJVLOEH-GESKFVNJSA-N 330.428 3.370 50 40 EGGB O=C(Cn1c(C(F)(F)F)nc2ccccc21)N/N=C/c1ccccc1 3546841 NDFUSBDVNROOHE-UFFVCSGVSA-N 346.312 3.205 50 40 EGGB Cc1cccc(C)c1NC(=O)C(=O)N/N=C/c1c(F)cccc1Cl 3080373 ULSIJQZLFKQJNX-AWQFTUOYSA-N 347.777 3.185 50 40 EGGB C/C(CC(=O)Nc1c(C)cc(C)cc1C)=N\NC(=O)c1ccco1 4380385 RJTWAJLVIJNWSV-XSFVSMFZSA-N 327.384 3.339 50 40 EGGB O=C(CN1C(=O)c2cccc3cccc1c23)N/N=C/c1cccc(F)c1 108128065 KZYXROMYHAMNKW-SSDVNMTOSA-N 347.349 3.089 50 40 EGGB O=C(NNC(=O)c1cc(F)c(Cl)cc1Cl)c1ccccc1 12985531 JXRVCEDOMHIQEI-UHFFFAOYSA-N 327.142 3.207 50 40 EGGB Cc1cccc(/C=N/NC(=O)Cc2ccc(Br)cc2)c1O 4735292 DIIISLXGCJILTK-VCHYOVAHSA-N 347.212 3.156 50 40 EGGB CCOc1cc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@@]32C)ccc1OC 5652016 ZLIMSBWJFFCIJE-OGIZRACOSA-N 330.428 3.370 50 40 EGGB CN(C)c1ncccc1C(=O)NN=C(c1ccccc1)c1ccccc1 83852403 YLHOOGIQJRXZKX-UHFFFAOYSA-N 344.418 3.330 50 40 EGGB C[C@H](Br)C(=O)NC[C@@H](OCC1CC1)c1ccccc1F 95097946 GQXCQUKGJJGJFG-IINYFYTJSA-N 344.224 3.193 50 40 EGGB COc1ccc(C)cc1NC(=O)C/C(C)=N/NC(=O)c1cccs1 5538914 CUBVVXGLBCWSTF-XDHOZWIPSA-N 345.424 3.200 50 40 EGGB O=C(OCCCl)c1cccc(Cl)c1C(=O)OCCCl 1679899 DPHYHEAESGHRQP-UHFFFAOYSA-N 325.575 3.131 50 40 EGGB CCC[C@H](Br)C(=O)NCCC(=O)Nc1ccccc1C 8733129 RMKSQGJNMSJZQE-LBPRGKRZSA-N 341.249 3.003 50 40 EGGB O=C(C[C@@H]1C[C@H]2CC[C@H]1C2)NNC(=O)c1cc2ccccc2cc1O 107326353 UITFGCDMTDQTLR-RCBQFDQVSA-N 338.407 3.133 50 40 EGGB CCCOc1ccc(C(=O)N/N=C/c2ccccc2OCC#N)cc1 20197257 OPQWOIDYTSJUNC-KGENOOAVSA-N 337.379 3.142 50 40 EGGB O=C(CSc1nc2ccccc2[nH]1)N/N=C/C=C\c1ccco1 4746445 NMWGDEUXGXAXQG-KFIJFHHBSA-N 326.381 3.063 50 40 EGGB C/C(=N\NC(=O)c1ccc(COc2ccccc2)o1)c1ccncc1 6957258 FAEMSFYOVKAZAT-KGENOOAVSA-N 335.363 3.408 50 40 EGGB CSC1=C(C#N)[C@@H](c2ccccc2)C(C(=O)OCCC#N)=C(C)N1 19815902 FUSCYWQLPPRUJL-MRXNPFEDSA-N 339.420 3.202 50 40 EGGB CC[C@@H](C)NC(=O)/C(C#N)=C/c1ccc(-c2ccc(C(=O)O)cc2)o1 408806803 BUTUVQVUPZAWDC-JXCQQFQQSA-N 338.363 3.466 50 40 EGGB COc1ccc(/C=C(/C#N)c2nc(O)c3ccccc3n2)c(OC)c1 33377385 RMCFZDFTDXBYPW-LCYFTJDESA-N 333.347 3.417 50 40 EGGB Cc1cc(O[C@H](C)C(=O)NNC(=O)c2ccoc2C)ccc1C(C)C 40140399 DSSZAMYHGBNNOR-CQSZACIVSA-N 344.411 3.248 50 40 EGGB CCOc1ccc(NC(=O)/C(C#N)=C\c2ccccc2C(=O)O)cc1 223165740 KORRDGIGTXWGKU-KAMYIIQDSA-N 336.347 3.329 50 40 EGGB CCOC(=O)c1sc(-c2ccncc2)nc1CBr 95936118 VHVNFCZHFWGVJP-UHFFFAOYSA-N 327.203 3.277 50 40 EGGB Cc1cc(C(=O)N/N=C/c2ccc3c(c2)OCO3)c2ccccc2n1 547933 PKJQTUOSQCUABE-KEBDBYFISA-N 333.347 3.036 50 40 EGGB COc1ccc(C(=O)NNc2nc3ccc(F)cc3s2)c(OC)c1 251164 FETFXWXHANVSEL-UHFFFAOYSA-N 347.371 3.210 50 40 EGGB COc1cccc(/C=N/NC(=O)c2cc3c(s2)CCCC3)c1O 2661837 RGMKNCUXWKJAMM-VCHYOVAHSA-N 330.409 3.105 50 40 EGGB O=C(NN[C@H](C(=O)Nc1ccccc1)c1ccccc1)c1ccccc1 32853647 PFVILBRBGZCRHI-IBGZPJMESA-N 345.402 3.301 50 40 EGGB O=C(CSCc1ccc([N+](=O)[O-])cc1)N/N=C/c1ccc(F)cc1 20248449 MKHZVXLPQMIABG-GIJQJNRQSA-N 347.371 3.117 50 40 EGGB CCCN(CCC)c1ccc(/C=N/NC(=O)c2cc(C)n[nH]2)cc1 5250201 UEDHVAMXHAQQJV-CPNJWEJPSA-N 327.432 3.108 50 40 EGGB COc1ccc(CC(=O)N/N=C/c2cccc(OC(C)C)c2)cc1 4544313 SBTZRVMGZVJAML-DEDYPNTBSA-N 326.396 3.175 50 40 EGGB CC(C)Oc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1 43905544 GNIYNTVPOREFPA-WOJGMQOQSA-N 327.340 3.146 50 40 EGGB Cc1ccc(/C=N/NC(=O)CNc2cccc(C(F)(F)F)c2)o1 3577086 KWNMQFXPHMSOIO-DNTJNYDQSA-N 325.290 3.169 50 40 EGGB O=C(CSc1cccc2cccnc12)N/N=C/c1ccc(O)cc1 91876 MMNAGQSSFQKELZ-RGVLZGJSSA-N 337.404 3.183 50 40 EGGB COc1ccc([C@H]2C(C#N)=C(N)OC(C(C)(C)C)=C2C#N)c(OC)c1 4775493 AHDYAVRRQRTNOP-MRXNPFEDSA-N 339.395 3.335 50 40 EGGB CCc1cc(C)cc(OCC(=O)N/N=C\c2cc(C)n(C)c2C)c1 408778027 OUFCQUCSRBWPJL-JAIQZWGSSA-N 327.428 3.042 50 40 EGGB O=C(OCc1ccccc1)N1CC[C@H](CI)C1 79436617 OSVYLTGJLWNTOH-GFCCVEGCSA-N 345.180 3.080 50 40 EGGB CC(C)(C)OC(=O)NN[C@H](c1ccc(Cl)cc1)C1CCNCC1 228967156 BLOJTTCNWQSTQR-OAHLLOKOSA-N 339.867 3.410 50 40 EGGB O=C(CCl)Nc1cc(NC(=O)CCl)cc(C(F)(F)F)c1 159628 VISHKUDGGIBHNI-UHFFFAOYSA-N 329.105 3.060 50 40 EGGB O=C(N/N=C/c1cccc2ccccc12)C(=O)Nc1ccccc1F 5777280 OMFWNYRWODMWBH-CIAFOILYSA-N 335.338 3.068 50 40 EGGB CC(C)(C)C(=O)Nc1ccc(C(=O)N/N=C/c2ccc(O)cc2)cc1 5379532 UTLOZPBADVPPDN-UDWIEESQSA-N 339.395 3.141 50 40 EGGB O=C(/C(=N/NC(=O)c1ccccn1)c1ccccc1)c1ccccc1 101459751 OAPQFQIFWSHFKD-RELWKKBWSA-N 329.359 3.099 50 40 EGGB CC(C)(C)[C@]1(OCSC#N)C(=O)N=CN=CN1Cc1ccccc1 3214041 XUPPDGISSSYVIA-QGZVFWFLSA-N 344.440 3.016 50 40 EGGB Nc1ccccc1C(=O)NNC(=S)Nc1cccc2ccccc12 18194855 JQHPEEVQAATWJP-UHFFFAOYSA-N 336.420 3.053 50 40 EGGB CCOc1ccc(/C=N\NC(=O)[C@@H](C)Oc2cccc(C)c2)cc1 31776184 FCBYQMIISKGABI-CTFRJJSNSA-N 326.396 3.311 50 40 EGGB COC(=O)c1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)cc1 15226186 ADPIUNYBXALQCA-HNICHSMRSA-N 326.396 3.075 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2cccc(OC)c2)cc1OCC 169878481 BBGZFFUPFMQRBJ-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB N#C/C(=C\c1c[nH]c2ccccc12)C(=O)NCc1ccc2c(c1)OCO2 6283460 YTIFYUWSJPWZKT-RIYZIHGNSA-N 345.358 3.120 50 40 EGGB C/C(=N\NC(=O)COc1c(C)cccc1C)c1ccc([N+](=O)[O-])cc1 59089 FZQVWVZBLYVRAE-XMHGGMMESA-N 341.367 3.131 50 40 EGGB Cc1ccc(NCC(=O)N/N=C/c2ccc(Br)cc2)cc1 58880 AKZOJLONVVBQDL-VXLYETTFSA-N 346.228 3.320 50 40 EGGB COc1cccc(/C=C(\C#N)c2nc(N)nc(Nc3ccccc3)n2)c1 11296441 XAFXHNYDZOWRJC-GXDHUFHOSA-N 344.378 3.270 50 40 EGGB CCOc1cc(/C=N\NC(=O)Cc2ccc(CC)cc2)ccc1O 409363269 LCKSHEILLATDNK-MOSHPQCFSA-N 326.396 3.046 50 40 EGGB C[C@@H](NC(=O)/C(C#N)=C\c1cc([N+](=O)[O-])ccc1O)c1ccccc1 409241806 OVMGZRWKLGTNDV-CDCQXCROSA-N 337.335 3.085 50 40 EGGB Cc1ccccc1N1C(N)=C(C#N)C(C#N)(C#N)[C@@H]1c1ccccc1 5579783 CGLLDXPMBRKPBR-SFHVURJKSA-N 325.375 3.284 50 40 EGGB O=C(N/N=C/c1ccc(Cl)cc1)c1ccccc1NC(=O)C1CC1 1739594 XTRDBOLOXWWUHW-RGVLZGJSSA-N 341.798 3.452 50 40 EGGB COc1cc(Br)c([C@@H](Br)C#N)cc1OC 2042868 NYOJEBWUFDEKKX-QMMMGPOBSA-N 334.995 3.426 50 40 EGGB CN1C[C@@H](C(C)(C)C)CO[P@]1(=O)N(CCCl)CCCl 105383058 QXKUWRBLVIWSBG-WYRIXSBYSA-N 331.224 3.498 50 40 EGGB COc1ccc(-n2cccc2/C=N/NC(=O)c2ccc(F)cc2)cc1 408952960 NLCOXQJFZSWBOO-FYJGNVAPSA-N 337.354 3.389 50 40 EGGB C/C(=N/NC(=O)c1cc(C(C)C)n[nH]1)c1ccc(Br)cc1 4136075 UYASNHQOSVSWDZ-YVLHZVERSA-N 349.232 3.450 50 40 EGGB N#C/C(=C\Nc1ncccn1)C(=O)Nc1ccc(Cl)cc1Cl 6342898 NZVYTASHJIOLIB-CMDGGOBGSA-N 334.166 3.241 50 40 EGGB C[C@H](Sc1ccccc1)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 20247895 UNFOLCBFDGQOGB-OOIIIRTPSA-N 329.381 3.226 50 40 EGGB CC[C@@H](C)n1nccc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253402306 OCRCDVGALNMZHM-BDJLRTHQSA-N 340.427 3.305 50 40 EGGB CSc1sc(C)cc1/C=N/NC(=O)c1cccc([N+](=O)[O-])c1 260583 XLIUAFLOBWBSAR-OVCLIPMQSA-N 335.410 3.451 50 40 EGGB CCc1ccc(-c2n[nH]cc2/C=C(\C#N)C(=O)NCc2ccco2)cc1 20212509 KOKLVRDRVIGRMJ-MHWRWJLKSA-N 346.390 3.455 50 40 EGGB CCOC(=O)c1cc(C)n(CC(=O)NNc2cccc(Cl)c2)c1C 30613238 VJFXSMZOYYJJNU-UHFFFAOYSA-N 349.818 3.078 50 40 EGGB C/C(=N\NC(=O)c1cc(-c2ccc(F)cc2)n[nH]1)c1cccc(O)c1 12465304 GDCTXZYMMLYRIT-RGVLZGJSSA-N 338.342 3.075 50 40 EGGB CC(C)COc1ccc(/C=N/NC(=O)COc2ccccc2)cc1 408824922 BWMLXBXNKNDHFA-UDWIEESQSA-N 326.396 3.251 50 40 EGGB O=C(CCl)Nc1c(Br)cccc1Br 85210493 PVOGQWAYGUYXEU-UHFFFAOYSA-N 327.403 3.389 50 40 EGGB CC(C)(C)OC(=O)c1ccc(CNC(=O)OC(=O)C(C)(C)C)cc1 616581122 XGYGKIRURNTYLC-UHFFFAOYSA-N 335.400 3.441 50 40 EGGB Cc1ccsc1/C=N/NC(=O)COc1cccc2cccnc12 408994176 GXXVMLBQKJNULJ-VXLYETTFSA-N 325.393 3.134 50 40 EGGB Cc1nn(C)cc1/C=C(\C#N)C(=O)Nc1cccc(C(F)(F)F)c1 17068735 MERGQZLCFJIKAZ-IZZDOVSWSA-N 334.301 3.293 50 40 EGGB COc1cc(Cl)cc(/C=N\NC(=O)c2ccc(Cl)cc2)c1O 4775425 LGAMKMAYKQWXQN-LSCVHKIXSA-N 339.178 3.472 50 40 EGGB CCC/C(=N\NC(=O)Cc1cn2ccsc2n1)c1ccccc1 4864370 YRFQBDCRQVVJLK-XDJHFCHBSA-N 326.425 3.259 50 40 EGGB N#CC1=C(S)N(c2ccccc2)[C@@H](c2ccccc2F)NC1=O 9111270 BRCCDHNFDDOJBZ-HNNXBMFYSA-N 325.368 3.126 50 40 EGGB O=C(CCl)N(Cc1ccccc1I)C1CC1 79420799 LFYWVQNSPCYDSI-UHFFFAOYSA-N 349.599 3.021 50 40 EGGB Cc1cc(C)n(Cc2ccc(C(=O)N/N=C/c3ccccc3)cc2)n1 130598 RIUPMUPCDMOEMT-FYJGNVAPSA-N 332.407 3.312 50 40 EGGB C[C@@H]1CCCCN1c1c([N+](=O)[O-])cc(C(=O)Cl)cc1[N+](=O)[O-] 26508756 ABOMGKXEZHYVBC-MRVPVSSYSA-N 327.724 3.261 50 40 EGGB Cc1cccc(Cn2cc(/C=N/NC(=O)C(C)(C)O)c3ccccc32)c1 32578422 DFZJJDVBRWIEKZ-WSDLNYQXSA-N 349.434 3.219 50 40 EGGB Cc1cc(/C=N/NC(=O)COc2ccc(Cl)cc2)cc(C)c1O 8227215 QAYXFKKQKPSTGN-DJKKODMXSA-N 332.787 3.192 50 40 EGGB CCO[P@](C)(=O)/C(C#N)=C(\O)c1cc(OC)c(OC)c(OC)c1 103998809 QPTYUTXPRWBFEN-DSTYWPJMSA-N 341.300 3.407 50 40 EGGB N#C/C(=C\c1cc(Cl)ccc1OCc1ccc(F)cc1)C(N)=O 59133216 CYENVIWEDFCJAQ-NTUHNPAUSA-N 330.746 3.450 50 40 EGGB C/C(CC(=O)Nc1ccc(Cl)cc1)=N\NC(=O)Cc1ccccc1 100923041 IPQQVPOLGXBRTC-FYJGNVAPSA-N 343.814 3.403 50 40 EGGB Nc1c(Cl)c(Cl)nc(C(=O)N/N=C2/C[C@H]3C=CC[C@@H]23)c1Cl 36512076 BMGDJAKJQRFAJL-RCDULKCOSA-N 345.617 3.306 50 40 EGGB CC1(CC(=O)N/N=C/c2ccc(Oc3ccccc3)cc2)OCCO1 20243987 MRBDOZUFUFSBFE-XSFVSMFZSA-N 340.379 3.082 50 40 EGGB Cc1occc1C(=O)N/N=C/c1cccn1-c1ccc([N+](=O)[O-])cc1 435050 XRXRUMANFCGNEM-WOJGMQOQSA-N 338.323 3.051 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)CNc2ccc(Cl)cc2)cc1 5725254 XTYKDNSZYIYUBU-UDWIEESQSA-N 331.803 3.301 50 40 EGGB Cc1ccsc1[C@@H]1C(C#N)=C(N)Oc2c1c(=O)[nH]c1ccccc21 17070609 UVSHJMQLNIEFTD-CYBMUJFWSA-N 335.388 3.116 50 40 EGGB Cc1ccc(-c2nc(C(=O)NNc3nc(C)cc(C)n3)cs2)cc1 11334344 ZNTWHGTYXPVBQG-UHFFFAOYSA-N 339.424 3.282 50 40 EGGB Cc1ccc(SCCC(=O)N/N=C/c2ccc(C(=O)O)cc2)cc1 409123611 HBIROXVDKJQWKK-XDHOZWIPSA-N 342.420 3.326 50 40 EGGB O=C(N/N=C\c1ccc(OCc2ccccc2)cc1)c1ccccn1 32576988 PBJDPJXLYMDISU-HMAPJEAMSA-N 331.375 3.425 50 40 EGGB C[C@@H]1C[C@@H]1C(=O)NNc1nnc(-c2ccccc2)n1-c1ccccc1 31670828 OPELCFXDNGDSMN-CJNGLKHVSA-N 333.395 3.033 50 40 EGGB Cc1cccc(C)c1N[C@H](C)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 356669 PWCAJDKHFCNVCG-HIPSJFSSSA-N 340.383 3.162 50 40 EGGB COc1ccccc1/C=N/NC(=O)[C@H](C)Oc1cccc(Cl)c1 3162142 RZPSVCRAARGQPT-MKFNJMOCSA-N 332.787 3.266 50 40 EGGB N#CC(C#N)=C1c2cc([N+](=O)[O-])ccc2-c2c(O)cc([N+](=O)[O-])cc21 5582535 OWZNNOQUHCSSJJ-UHFFFAOYSA-N 334.247 3.038 50 40 EGGB O=C(NNC(=O)[C@H]1C[C@H]1c1ccccc1)Nc1ccc(Cl)cc1 3152289 ISHSUSGGZFMGTF-GJZGRUSLSA-N 329.787 3.296 50 40 EGGB O=C(NNC(=O)c1ccc(-c2ccc(F)cc2)s1)c1ccccn1 12910369 CBAYDOQYVOOQNE-UHFFFAOYSA-N 341.367 3.024 50 40 EGGB C=CCc1cc(/C=N\NC(=O)Nc2ccccc2)cc(OC)c1O 409202421 QKUUWPVRMRSZJJ-UNOMPAQXSA-N 325.368 3.285 50 40 EGGB C[C@H](NC(=O)/C(C#N)=C\c1ccc2c(c1)OCCO2)c1ccccc1 6522010 QAMDMVMVUMNVMI-FMNVXAMXSA-N 334.375 3.242 50 40 EGGB Cc1cc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)c(C)n1CC(C)C 6608117 JNPRSNBQHVVTAP-VXLYETTFSA-N 342.399 3.433 50 40 EGGB N#C/C(=C/c1ccc(O)c(Cl)c1)C(=O)Nc1cccc(C(=O)O)c1 408541894 GKOUWTVAGYERAF-SDQBBNPISA-N 342.738 3.289 50 40 EGGB O=C(N/N=C1\CCSc2ccc(F)cc21)c1ccc2c(c1)OCO2 33044047 OTCGQDRWLANWSI-CPNJWEJPSA-N 344.367 3.184 50 40 EGGB COc1cc2ccccc2cc1C(=O)N/N=C/c1ccc(C(=O)O)cc1 6646166 XMHBLFHHNVBBOH-CIAFOILYSA-N 348.358 3.311 50 40 EGGB Cc1ccc[n+](/C(C(=O)c2ccc(Cl)cc2)=C(\C#N)[C-](C#N)C#N)c1 104833385 HMGZCZBABCLEAK-ISLYRVAYSA-N 346.777 3.175 50 40 EGGB C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H]1CC=CCC1 12755009 LYIUQXVDDRKCRI-GOEBONIOSA-N 338.407 3.111 50 40 EGGB Cc1ccccc1OCC(=O)N/N=C/c1ccc2ccccc2c1O 408563889 RRBDSGWVPXDBCG-CIAFOILYSA-N 334.375 3.383 50 40 EGGB CC(C)(C)OC(=O)N1CCCC[C@@H]1CI 72194515 FLAFMLGPWINZEY-SECBINFHSA-N 325.190 3.211 50 40 EGGB CCOc1ccccc1/C=N/NC(=O)COc1cccc(Cl)c1 94157 SRVTUESULJWIEG-YBFXNURJSA-N 332.787 3.268 50 40 EGGB Cc1ccc(-c2n[nH]cc2/C=C(\C#N)C(=O)NCc2ccncc2)cc1 5728623 BUILWPHNCWVLRL-LICLKQGHSA-N 343.390 3.004 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccccn2)cc1 5130182 WNTKKWICZXUBDJ-ZXOFLVKFSA-N 341.436 3.277 50 40 EGGB C/C(=N/NC(=O)c1cc(-c2ccccc2Cl)n[nH]1)c1ccncc1 54056 HYWLDILXLDVAGM-JAIQZWGSSA-N 339.786 3.279 50 40 EGGB C[C@H](Oc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc(N(C)C)cc1 93722 JGVQGLKOEHARFQ-DZUMZMOTSA-N 345.830 3.324 50 40 EGGB O=C(Cc1ccccc1)N/N=C/c1cc(Cl)c2cccnc2c1O 59459104 FRZHUCZCDIJXAV-SRZZPIQSSA-N 339.782 3.287 50 40 EGGB CCOc1ncccc1C(=O)NNc1cccc(C(F)(F)F)c1 14907553 APBKNVYNNOUMSB-UHFFFAOYSA-N 325.290 3.256 50 40 EGGB CCCC(=O)Oc1ccc(/C=C(\C#N)C(=O)OCC)cc1OCC 132056 ZMZZIIQZLHLKFH-GXDHUFHOSA-N 331.368 3.261 50 40 EGGB O=C(COc1ccc(Br)cc1)NN=C(C1CC1)C1CC1 358467 UYHUKEFYGLVVQU-UHFFFAOYSA-N 337.217 3.120 50 40 EGGB O=C(N/N=C/c1cc(Cl)c(O)c2ncccc12)c1ccc(F)cc1 59459125 YUBHZBNIBREXIQ-ZVBGSRNCSA-N 343.745 3.497 50 40 EGGB CCCCCOc1ccc(/C=C(/C#N)C(=O)N2CCOCC2)cc1 27018894 ITEWGEPXPGXVTN-VKAVYKQESA-N 328.412 3.021 50 40 EGGB CN(C)/C=C(\C#N)C(=O)c1cccnc1Oc1ccc(F)cc1F 4105331 ZLSCRVKIRLVCNU-ZHACJKMWSA-N 329.306 3.304 50 40 EGGB CC[C@@H](C(=O)N/N=C/c1ccc(OC)c(OC)c1)c1ccccc1 5954086 KNPAESYCFPKZAX-RBYWHNRPSA-N 326.396 3.348 50 40 EGGB Cc1cc(C)n(C(=O)/C(C#N)=C/c2cc(Br)ccc2O)n1 408979825 SNYZHELVLIRUBM-WUXMJOGZSA-N 346.184 3.215 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 408827249 GLJNWBUBZCXWOZ-XDHOZWIPSA-N 339.351 3.232 50 40 EGGB COC(=O)/C(C#N)=C\c1ccc(OCc2cccc(F)c2)c(OC)c1 265931 WCLSDVBFWILIIZ-NVNXTCNLSA-N 341.338 3.493 50 40 EGGB Cc1ccc(/C=N/NC(=O)CCC(=O)Nc2cccc(Cl)c2C)o1 3084860 MOGHYNYLWZRHFL-VXLYETTFSA-N 347.802 3.419 50 40 EGGB Cc1ccc(C)c(S(=O)(=O)/C(C#N)=C/Nc2ccc(O)cc2)c1 5021845 IBBCIDKVYGVFMN-LFIBNONCSA-N 328.393 3.260 50 40 EGGB CC(=O)/C(C#N)=C1/NC(=O)[C@@H](Cc2cc(Cl)ccc2Cl)S1 16661274 PPMIGUPFYAKEII-XTCQQWIJSA-N 341.219 3.092 50 40 EGGB COc1cc2ccccc2cc1C(=O)N/N=C/c1ccc(C#N)cc1 6735990 JMEVRBZMMCAUJN-LPYMAVHISA-N 329.359 3.484 50 40 EGGB C[C@@]1(CI)CSc2nc3ccccc3n21 500814 WNZJPCNVAMGOTF-LLVKDONJSA-N 330.194 3.292 50 40 EGGB Cc1ccc(O)c(/C=N/NC(=O)COc2ccc(Cl)c(C)c2)c1 3022883 SILXQXNFZBHWQL-DJKKODMXSA-N 332.787 3.192 50 40 EGGB O=C(NNc1nc(-c2cccc(O)c2)cs1)NC1CCCCC1 5274681 UQXAQNHJSUQHPX-UHFFFAOYSA-N 332.429 3.475 50 40 EGGB C=CCc1cc(/C=C(\C#N)C(=O)NC2CCCC2)cc(OCC)c1O 4616754 XNMBOVJNUYJQBY-LFIBNONCSA-N 340.423 3.485 50 40 EGGB COc1ccc(C(=O)N/N=C/c2cc(Cl)c(OC)cc2OC)cc1 408589659 MMQCTVHXJKYKEB-VXLYETTFSA-N 348.786 3.130 50 40 EGGB CC(=O)Nc1cccc(C(=O)N/N=C/c2c(C)[nH]c3ccccc23)c1 582666 FJLNKFVTVHYZIQ-RGVLZGJSSA-N 334.379 3.199 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@H]1c1cccc(O)c1 91269 NIAPVJIOPFTASB-ZDUSSCGKSA-N 336.376 3.062 50 40 EGGB O=C(NNC(=S)Nc1ccc(Cl)cc1Cl)c1cccnc1 3360147 FJKDDWDORYMWNY-UHFFFAOYSA-N 341.223 3.020 50 40 EGGB O=C(CCCC(=O)N/N=C/[C@H]1CC=CCC1)N/N=C/[C@H]1CC=CCC1 4646999 GLFGNHUMMQQQNN-OXGSBQLJSA-N 344.459 3.073 50 40 EGGB Cc1cc(C)nc(NNC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)n1 14510382 RKMYNPBFVNXFPR-UHFFFAOYSA-N 335.411 3.210 50 40 EGGB CCOc1ccc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@@]32C)cc1OC 5654143 DZVFTTHPJVLOEH-OGIZRACOSA-N 330.428 3.370 50 40 EGGB C#CCOc1ccccc1/C=C(\C#N)C(=O)Nc1cccc([N+](=O)[O-])c1 408802932 JHLKAGCOLAKJJX-RVDMUPIBSA-N 347.330 3.152 50 40 EGGB CC(=O)Nc1cccc(C(=O)N/N=C/c2ccccc2OC(C)C)c1 582566 WXNFGTBPGXROQK-UDWIEESQSA-N 339.395 3.196 50 40 EGGB NC(=O)N/N=C/c1ccccc1OCc1ccc(Br)cc1 8380001 JGAPDNARNJXFNC-GIJQJNRQSA-N 348.200 3.030 50 40 EGGB Cc1cccc(/C=N/NC(=O)C(=O)Nc2cc(Cl)ccc2C)c1 3169010 XZXCALTUUFCBKR-VXLYETTFSA-N 329.787 3.046 50 40 EGGB CCOc1ccc(C(=O)N/N=C/c2cc(Cl)ccc2[N+](=O)[O-])cc1 2752224 FSEOZQMTYQTNMA-VCHYOVAHSA-N 347.758 3.411 50 40 EGGB O=C(N/N=C/c1ccc(F)cc1)c1cc(Br)ccc1O 19799581 JXHWLIGREAFUQX-CAOOACKPSA-N 337.148 3.058 50 40 EGGB Cc1cccc(OCC(=O)N/N=C/c2c(C)n(C)c3ccccc23)c1 1772302 OBZWLCADQGQDTJ-CIAFOILYSA-N 335.407 3.324 50 40 EGGB CN(C)c1ccc(/C=N\NC(=O)Cc2cccc(C(F)(F)F)c2)o1 208457503 QMWXPLADLPVHSE-JMIUGGIZSA-N 339.317 3.057 50 40 EGGB O=C(CCn1c2c(c3ccccc31)CCCC2)NN=Cc1cccnc1 12463587 ABVRUNQLPHWJNQ-UHFFFAOYSA-N 346.434 3.456 50 40 EGGB O=C(Oc1cccc(/C=N/NC(=O)c2cccs2)c1)c1ccco1 4132775 INEGDQHIEWJXIJ-WOJGMQOQSA-N 340.360 3.324 50 40 EGGB CCOc1ccc(/C=C(\C#N)C(=O)N2CCCC2)cc1Br 409372886 RWYYAEKIMDOGKH-UKTHLTGXSA-N 349.228 3.377 50 40 EGGB CC1=NN(c2ccccc2)C(=O)[C@@H]1/C=C(/C#N)C(=O)Nc1ccccc1 408741731 KUSCOODDFLMTLO-WTQUMQLASA-N 344.374 3.114 50 40 EGGB COc1cc(Cl)cc(/C=N/NC(=O)c2ccc(Cl)cc2)c1O 83316582 LGAMKMAYKQWXQN-QGMBQPNBSA-N 339.178 3.472 50 40 EGGB COc1ccc(/C=N/NC(=O)CNc2cccc3ccccc23)cc1 59294 NEBNOIDSPRBMCD-LPYMAVHISA-N 333.391 3.411 50 40 EGGB COC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@@H]2c1ccsc1 1427828 MDUWEXISNYPIIX-NSHDSACASA-N 332.406 3.123 50 40 EGGB Cc1nn(-c2ccccc2)c2c1[C@H](c1ccccc1O)C(C#N)=C(N)O2 546653 BBSSBCBJMNTVKF-GOSISDBHSA-N 344.374 3.105 50 40 EGGB COc1ccccc1NCC(=O)N/N=C(\C)c1ccc(C)c(C)c1 5119820 UGJMRIOLOJAKJN-RCCKNPSSSA-N 325.412 3.264 50 40 EGGB C=CCOc1cccc(/C=N/NC(=O)c2c(C)nc3ccc(C)cn23)c1 408980683 SGXICTAPXJDWQO-CIAFOILYSA-N 348.406 3.280 50 40 EGGB C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1ccc2c(c1)OCO2 313825 LUCYLOJJKLVYGL-SGEFVQMOSA-N 328.393 3.046 50 40 EGGB CCc1cc(C(=O)N/N=C/c2ccc(O)c(OC)c2)c2ccccc2n1 1458043 YCNLWTZBRRLCPR-CIAFOILYSA-N 349.390 3.275 50 40 EGGB Cc1nn(-c2ccccc2)c(C)c1/C=N/NC(=O)Cc1ccccc1 7779393 OAYWTJRMEUGERV-KGENOOAVSA-N 332.407 3.182 50 40 EGGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1c(F)cccc1Cl 108086965 XQYLZLXCWAVMRG-NVMNQCDNSA-N 335.722 3.080 50 40 EGGB O=C(N/N=C/[C@@H]1C[C@@H]2C=C[C@H]1C2)C(O)(c1ccccc1)c1ccccc1 4652104 MEIWVLWDWOXTGU-XFRYNIMZSA-N 346.430 3.237 50 40 EGGB CCOc1ccccc1/C=N/NC(=O)c1c(C)nc2cc(C)ccn12 408974748 DCYUXOLFQRMXSZ-UDWIEESQSA-N 336.395 3.114 50 40 EGGB O=c1nc2c3ccc(F)cc3nc(CCl)n2nc1-c1ccccc1 95944232 VESMMKVSHFBCAJ-UHFFFAOYSA-N 340.745 3.183 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@]32C)c(OC)c1 408955184 OEOVXXUXGYQGDB-YCOAYHBDSA-N 330.428 3.370 50 40 EGGB CCCC[C@@H](C(=O)NN)N1c2c(OC)cccc2[C@H](C)CC1(C)C 260619462 MLFKSAGBZBRVEV-HIFRSBDPSA-N 333.476 3.336 50 40 EGGB O=C(CN1CCCC1)N/N=C/c1ccc(-c2cccc(Cl)c2)o1 342576 DTCXHUIELAHBNI-YBFXNURJSA-N 331.803 3.146 50 40 EGGB C#CCn1cc(/C=N/NC(=O)c2ccc(OC)cc2)c2ccccc21 1103931 YECUQQUPYFRVFP-FYJGNVAPSA-N 331.375 3.047 50 40 EGGB COc1cccc([C@H]2C(C#N)=C(N)Oc3cc(O)c(Cl)cc32)c1 5514810 HCBDBCVNRYPRGC-MRXNPFEDSA-N 328.755 3.272 50 40 EGGB CCn1c(C)cc2c(c1=O)[C@H](c1ccccc1Cl)C(C#N)=C(N)O2 2204429 ICLKZKASWHEWMK-OAHLLOKOSA-N 341.798 3.048 50 40 EGGB O=C(/C=C/c1ccc(Cl)cc1)N/N=C/c1cccc([N+](=O)[O-])c1 409068465 RNUMQAYBGZSDMF-KCEJKJBJSA-N 329.743 3.412 50 40 EGGB Cc1cc(C)c2c3ccccc3n(CCNC(=O)NCCCl)c2n1 3765467 MSLXZQRRSQUAKY-UHFFFAOYSA-N 344.846 3.344 50 40 EGGB CSc1ccc(/C=N/NC(=O)c2c(C)nc3ccc(C)cn23)cc1 409008754 FQTMSAVGUQCUHC-VXLYETTFSA-N 338.436 3.437 50 40 EGGB O=C(COc1ccc(Br)cc1)N/N=C/c1ccsc1 8228176 VECGMGKLQZZFTP-VIZOYTHASA-N 339.214 3.040 50 40 EGGB O=C(N/N=C/c1c[nH]c2ccccc12)N/N=C/c1c[nH]c2ccccc12 1735440 WVYYJCYHHYFLBV-LCHFAGMQSA-N 344.378 3.316 50 40 EGGB COc1ccc(C(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)cc1 485300 QAGGMYABEMVWQY-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB C[C@]1(CO)CCC[C@]2(C)[C@@H]1CC[C@H]1C[C@@H]3C=C[C@]12[C@H]1C(=O)OC(=O)[C@@H]13 104073734 AWKLTAVAULXADV-VSIWRAFYSA-N 344.451 3.093 50 40 EGGB O=C(Cc1cccs1)NNc1nc(-c2ccc(Cl)cc2)no1 69815684 QGGPQAMUMCBKGR-UHFFFAOYSA-N 334.788 3.137 50 40 EGGB O=C(CNc1ccc(Br)cc1)N/N=C/c1cccs1 580486 KPTVYOXYWHGQGL-LZYBPNLTSA-N 338.230 3.073 50 40 EGGB C=CCc1cccc(/C=N/NC(=O)COc2ccc(CC)cc2)c1O 3162118 FLEZYPZGKSASDE-FYJGNVAPSA-N 338.407 3.212 50 40 EGGB CC(C)Oc1ccccc1/C=N\NC(=O)[C@H](C)Oc1ccccc1 4544311 WFFUXHJZXROAIH-HYTQYMIGSA-N 326.396 3.391 50 40 EGGB N#C/C(C(=O)CSc1nncs1)=C1\Nc2ccccc2S1 102776039 XHIINVNUQWVWTK-WQLSENKSSA-N 332.435 3.152 50 40 EGGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1ccc(Cl)s1 8350919 XDGILHVFXZRFGR-UHFFFAOYSA-N 345.207 3.138 50 40 EGGB CSc1ccc(/C=N/NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 5618274 QYDBOSREFGAODZ-LICLKQGHSA-N 329.381 3.389 50 40 EGGB COc1ccccc1C(=O)N/N=C\c1ccc(N2CCCC2)c(C)c1 408854785 BFPFXOHHFOLFBP-STZFKDTASA-N 337.423 3.368 50 40 EGGB CC1=C[C@@]2(Nc3cc(C)c(C)c(Br)c3O2)C(C#N)=C(N)O1 40545225 NCANOAJYNGMYCX-HNNXBMFYSA-N 348.200 3.194 50 40 EGGB C/C(=N\NC(=O)COc1cccc2ccccc12)c1ccc(O)cc1 12488706 BKKVEIPKCDIIKN-KGENOOAVSA-N 334.375 3.465 50 40 EGGB CCOc1cc(C(=O)NN)ccc1OCc1cccc2ccccc12 226325501 HINXNIDLSVBPKD-UHFFFAOYSA-N 336.391 3.421 50 40 EGGB Cc1ccccc1NCC(=O)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 60094 GGPUVYVGOAXYQN-DJKKODMXSA-N 346.774 3.119 50 40 EGGB FC(F)(F)C1=NC(C(F)(F)F)(C(F)(F)F)N=C(CCl)O1 100677701 WNSAVFJGNAEPEX-UHFFFAOYSA-N 336.541 3.436 50 40 EGGB CCOC(=O)NP(=O)(NNc1ccccc1)NNc1ccccc1 104081420 HOXXBKCSOGZTEI-UHFFFAOYSA-N 349.331 3.074 50 40 EGGB CCOc1cc(/C=N/NC(=O)CNc2ccc(Cl)cc2)ccc1O 409363570 MJGOYKLDMPLQQD-KEBDBYFISA-N 347.802 3.007 50 40 EGGB O=C(c1c(F)cccc1F)[C@H](Br)CBr 307532231 YWAVMLLFWYWYFP-RXMQYKEDSA-N 327.950 3.306 50 40 EGGB Cc1cc(C)cc(-n2c(=O)c3ccccc3n3c(CCl)nnc23)c1 15424613 SPPZKXAEHYZPKX-UHFFFAOYSA-N 338.798 3.389 50 40 EGGB O=C(Cc1c(F)cccc1Cl)NNC(=O)c1ccc(Cl)cc1 6372599 HTJNOBVJSZRBPB-UHFFFAOYSA-N 341.169 3.136 50 40 EGGB CC(C)c1cc(C(=O)NNC(=S)N[C@H]2C[C@H]3CC[C@@H]2C3)cs1 6390051 WOLDFDYREUJZAJ-LOWVWBTDSA-N 337.514 3.169 50 40 EGGB Cc1c(C(=O)N/N=C/c2ccc(C(F)(F)F)cc2)nc2ccccn12 12499612 YJJHWBQSEMISOH-UFFVCSGVSA-N 346.312 3.425 50 40 EGGB CCOc1ccc(C(=O)N/N=C/c2cc3c(cc2Cl)OCO3)cc1 20764243 LHPGHCVBVHPONI-DJKKODMXSA-N 346.770 3.231 50 40 EGGB Cc1cccc(N2C(S)=C(C#N)C(=O)N[C@@H]2c2cccs2)c1 4116940 VECVEWJXYSMHEQ-AWEZNQCLSA-N 327.434 3.357 50 40 EGGB Cc1ccc(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)cc1C 6944909 XTHMBCDKNLDPBL-UHFFFAOYSA-N 347.374 3.302 50 40 EGGB C[C@H](NC(=O)/C(C#N)=C\c1cc([N+](=O)[O-])ccc1O)c1ccccc1 409241808 OVMGZRWKLGTNDV-ZENNRRHLSA-N 337.335 3.085 50 40 EGGB N#C/C(=C\c1ccc(OCCC(=O)O)cc1)c1nc2ccccc2[nH]1 47202713 REPYDNFECUYLNU-SDNWHVSQSA-N 333.347 3.481 50 40 EGGB O=P(NCc1cn2ccccc2n1)(c1ccccc1)c1ccccc1 3214074 KOWFYGNPIZWPHW-UHFFFAOYSA-N 347.358 3.353 50 40 EGGB Cc1ccsc1C(=O)/C(C#N)=C/c1ccccc1OCC(=O)O 55040909 BKZKVKQQLWLABW-MDWZMJQESA-N 327.361 3.310 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)c2cccc(OC)c2)cc1 5393315 JYHDLNXLFFFEHW-XSFVSMFZSA-N 325.412 3.305 50 40 EGGB C#CCSC1=C(C(=O)OCC)[C@H](c2cccs2)C(C#N)=C(C)N1 23379248 WDHCRMBRRITNSS-AWEZNQCLSA-N 344.461 3.374 50 40 EGGB Nc1c(Cl)c(Cl)nc(C(=O)N/N=C2\C[C@H]3C=CC[C@@H]23)c1Cl 20885296 BMGDJAKJQRFAJL-ABZVZBBKSA-N 345.617 3.306 50 40 EGGB COc1ccccc1/C=N/NC(=O)Cc1ccc(Br)cc1 4735291 KXZYYUJMJNAFCQ-WOJGMQOQSA-N 347.212 3.151 50 40 EGGB COc1ccc(/C=N/NC(=O)Cc2cccc(C(F)(F)F)c2)cc1 408759215 ZVJLDYCDPGSHGN-SRZZPIQSSA-N 336.313 3.407 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/c2ccc(Br)cc2)c(F)c1 408968739 YMRXPSYXTVMOPE-DJKKODMXSA-N 346.159 3.224 50 40 EGGB CCc1cc(N2C[C@@H](C(=O)Cl)CC2=O)cc(C)c1Br 45889639 RHQQJLCDHWSZNQ-JTQLQIEISA-N 344.636 3.438 50 40 EGGB N#C/C(=C\c1ccc(C(=O)O)cc1)S(=O)(=O)c1ccc(Cl)cc1 111932 LLIDUTGPHCGJJX-OQLLNIDSSA-N 347.779 3.377 50 40 EGGB O=C(CCc1c[nH]c2ccccc12)NNC(=O)c1ccc(Cl)cc1 2626185 RYYJZSWOFMKSTC-UHFFFAOYSA-N 341.798 3.215 50 40 EGGB COc1cc(CN(C)C(=O)CCl)ccc1OCc1ccccc1 8264117 IBMMFVIWPCLLFP-UHFFFAOYSA-N 333.815 3.471 50 40 EGGB O=C(O)CC/C(=N/NC(=O)c1cc(Cl)ccc1O)c1ccccc1 6337251 MJQPLSJTUDWPBJ-RGEXLXHISA-N 346.770 3.045 50 40 EGGB COc1cc(/C=C(\C#N)c2ccc(Cl)cc2)ccc1OCC(N)=O 408580238 NFDVBQSUXJXZSU-RIYZIHGNSA-N 342.782 3.277 50 40 EGGB Cc1cccc(NC(=O)CCC(=O)N/N=C/c2c[nH]c3ccccc23)c1 1960227 HHVFGFJSGQDSJA-LPYMAVHISA-N 348.406 3.345 50 40 EGGB Cc1cccc(C)c1OCC(=O)NNC(=O)Nc1ccc(Cl)cc1 359134 VFXHTVLCTKWXKZ-UHFFFAOYSA-N 347.802 3.189 50 40 EGGB O=C(N/N=C/c1ccccc1Cl)c1ccc(Br)o1 525113 VQNGQAYMCNVEBB-VIZOYTHASA-N 327.565 3.459 50 40 EGGB O=C(CCCn1cccn1)NN=C(c1ccccc1)c1ccccc1 58357853 JAYCXBVXDNIZHS-UHFFFAOYSA-N 332.407 3.232 50 40 EGGB O=C(NNc1ncnc2ccccc12)c1ccccc1Br 12981346 LGWNWXKQLZROEB-UHFFFAOYSA-N 343.184 3.149 50 40 EGGB Cc1ccc(SCC(=O)N/N=C/c2ccc(N(C)C)cc2)cc1 8130307 INDWDLMIPWHCKH-XDHOZWIPSA-N 327.453 3.303 50 40 EGGB COc1cccc(C(=O)N/N=C/c2cccc(Br)c2)c1 5527431 BPHPDPGOOAAMQR-LICLKQGHSA-N 333.185 3.222 50 40 EGGB CC(C)(C)c1[nH]nc2c1[C@@H](c1ccc(F)c(F)c1)C(C#N)=C(N)O2 377299 TWNGTRRCVGQRNB-LBPRGKRZSA-N 330.338 3.204 50 40 EGGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(Cl)cc1 4738061 HNLUGZIIAOWLHC-UHFFFAOYSA-N 332.831 3.317 50 40 EGGB CCOc1ccc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@]32C)cc1OC 107903122 DZVFTTHPJVLOEH-QQSSKNFGSA-N 330.428 3.370 50 40 EGGB CCOc1cc(/C=N/NC(=O)CCc2ccccc2)ccc1OC 58871524 OYPKALNFERHEJM-XSFVSMFZSA-N 326.396 3.177 50 40 EGGB CCOc1ccccc1C=NNC(=O)COc1ccccc1Cl 23397216 RULUOSGEJSHGHT-UHFFFAOYSA-N 332.787 3.268 50 40 EGGB Cc1[nH]c2ccccc2c1/C=N/NC(=O)Cc1ccc([N+](=O)[O-])cc1 408866460 FXHJSCMGGDQLSY-YBFXNURJSA-N 336.351 3.077 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2ccc(-c3cccc(C(=O)O)c3)o2)o1 46928 LNGLDOVQAYITBS-VXLYETTFSA-N 338.319 3.310 50 40 EGGB Cc1ccc(/C=N/NC(=O)COc2cc(C)c(Cl)c(C)c2)c(O)c1 30937390 HCCAICOZRSUTKW-AWQFTUOYSA-N 346.814 3.500 50 40 EGGB C/C(=N\NC(=O)c1cncn1-c1ccc(F)cc1)c1ccc(C#N)cc1 36308930 KLPGSXBRAMCQMK-YDZHTSKRSA-N 347.353 3.037 50 40 EGGB Cc1cc(N(Cc2ccccc2)Cc2ccccc2)cc(C)c1B(O)O 169995260 UOILFPHQODZYGP-UHFFFAOYSA-N 345.251 3.190 50 40 EGGB in-vitro Cc1sc(-c2cccnc2)nc1C(=O)N/N=C/c1ccc(F)cc1 2049251896 GGLZLUVBHVQDLN-AWQFTUOYSA-N 340.383 3.417 50 40 EGGB O=C(N/N=C/c1ccc(O)c(O)c1)c1ccc(Cl)cc1Cl 3153394 FNKHZHGIVFPXNC-REZTVBANSA-N 325.151 3.169 50 40 EGGB O=c1nc2n(nc1-c1ccc(F)cc1)[C@@H](CCl)Nc1ccccc1-2 102112383 QQPQIYLHRHRGIY-AWEZNQCLSA-N 342.761 3.274 50 40 EGGB O=C(c1ccc(F)cc1F)[C@@H](Br)CBr 307673960 DICOBNUDFYNVID-ZETCQYMHSA-N 327.950 3.306 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(NC(C)=O)cc2)cc1 143966 HBKRQRZEUKKBOH-RVDMUPIBSA-N 335.363 3.199 50 40 EGGB N#C/C(=C/c1cc2c(cc1Cl)OCO2)C(=O)NCc1ccccc1 4470907 GKVAUABHKOJYBT-NSIKDUERSA-N 340.766 3.292 50 40 EGGB C[C@@]1(CI)CSc2sc3ccccc3[n+]21 82320 RCIIGDCYQGZBJI-LLVKDONJSA-N 348.254 3.445 50 40 EGGB Cc1cc(C(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2C)c(C)o1 135472 PPJJKOWAZTYUCE-RGVLZGJSSA-N 336.395 3.463 50 40 EGGB O=C(CCSc1ccccc1)N/N=C/c1ccc2c(c1)OCO2 59473095 OTKPDKPVQHMJMZ-WOJGMQOQSA-N 328.393 3.048 50 40 EGGB CN(C(=O)c1cccc(NC(=O)CBr)c1)c1ccccc1 35605317 URJBPVUGKYLWFM-UHFFFAOYSA-N 347.212 3.297 50 40 EGGB CCOc1cc(C(=O)NN)ccc1OCc1ccc(F)cc1Cl 216822814 GBPSTQHIXQDXLN-UHFFFAOYSA-N 338.766 3.060 50 40 EGGB O=C(N/N=C\c1cc(Br)ccc1O)c1ccc(F)cc1 30822054 KUTXNMVIGPLMLY-IUXPMGMMSA-N 337.148 3.058 50 40 EGGB N#Cc1cc(F)c(CBr)c(I)c1 169798105 AWUFFDKNDACHKH-UHFFFAOYSA-N 339.933 3.197 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 486662 YCFFEAOCRWHVBJ-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB CCCCNC(=O)[C@@]12CC[C@](C)(C(=O)[C@@H]1Br)C2(C)C 100920427 LFKFOZVBTANXNZ-COLVAYQJSA-N 330.266 3.062 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(C)c(C)c2)c(OC)c1OC 370091 ILXPRQZSDUYMAS-RGVLZGJSSA-N 342.395 3.093 50 40 EGGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1cc(F)ccc1F 8768168 DTSZQNMCXCZULL-OAHLLOKOSA-N 330.334 3.416 50 40 EGGB COc1cc(OC)cc(C(=O)N/N=C\c2ccc(OC)c(Cl)c2)c1 108317485 RJZKHCVFKOWNPM-GRSHGNNSSA-N 348.786 3.130 50 40 EGGB Cc1cccc[n+]1/C(C(=O)c1ccc(Cl)cc1)=C(\C#N)[C-](C#N)C#N 104833381 XCNQNFZZXMLRGL-ISLYRVAYSA-N 346.777 3.175 50 40 EGGB Cc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C(\C#N)C(=O)N(C)C)o1 4705372 JEBSJVVCZLUCNJ-FMIVXFBMSA-N 325.324 3.158 50 40 EGGB COc1ccc(/C=N/NC(=O)CSCCc2ccccc2)cc1 408725883 JDBPHNWOPMVHOC-CPNJWEJPSA-N 328.437 3.121 50 40 EGGB Cc1ccccc1NC(=O)/C(C#N)=C\c1ccc(N2CCOCC2)cc1 212117321 KJJNIDADMZCNHT-JXAWBTAJSA-N 347.418 3.377 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(C)c(Cl)c2)c(OC)c1 6033661 MZDSQSMGGHWNRI-VXLYETTFSA-N 332.787 3.430 50 40 EGGB O=C(CCn1c2c(c3ccccc31)CCCC2)N/N=C\c1ccccn1 12139966 VAGBEFJJOGALQA-HAHDFKILSA-N 346.434 3.456 50 40 EGGB O=C(O)/C(Cl)=C(Cl)\C=N\NC(=O)C12CC3CC(CC(C3)C1)C2 12436512 APUDXCJTZBUQJV-OOKHUODVSA-N 345.226 3.079 50 40 EGGB CC(=O)N/N=C/c1cc(C)n(-c2ccc(Br)cc2)c1C 368195 LPIGONNKOPFDJB-RQZCQDPDSA-N 334.217 3.327 50 40 EGGB COc1ccc(C(=O)CCN(CCCl)CCCl)c(OC)c1 1688915 QBNSUIBRYAEWHN-UHFFFAOYSA-N 334.243 3.056 50 40 EGGB C/C(CC(=O)NC1CCCCCCC1)=N\NC(=O)c1ccoc1C 4680238 XKOZZICYLMDGPQ-DEDYPNTBSA-N 333.432 3.313 50 40 EGGB CCOc1cc(/C=C(/C#N)C(=O)Nn2c(C)ccc2C)ccc1OC 409375102 FPIRMBFUEGTWHK-YBEGLDIGSA-N 339.395 3.190 50 40 EGGB N#C/C(=C/c1cn(CC(=O)O)c2ccccc12)C(=O)Nc1ccccc1 13124100 FNCNQQRAGRUAGW-UVTDQMKNSA-N 345.358 3.272 50 40 EGGB COc1ccc(/C=N/NC(=O)COc2ccc(Cl)c(C)c2)cc1 566235 YRNBILGZJIZGDM-VXLYETTFSA-N 332.787 3.186 50 40 EGGB CC(C)(C)C1CCC(=NNC(=O)C(=O)Nc2ccccc2F)CC1 59434114 UXHALOJXPVLIFB-UHFFFAOYSA-N 333.407 3.473 50 40 EGGB CC[C@H](C(=O)NNC(=O)c1cc(Cl)ccc1OC)c1ccccc1 12806886 MLBMKAVUQPSIAJ-AWEZNQCLSA-N 346.814 3.303 50 40 EGGB CCOC(=O)NNC(=O)CSCc1ccc(Cl)cc1Cl 49022992 IFQQDLVXVCRXQJ-UHFFFAOYSA-N 337.228 3.004 50 40 EGGB Cc1ccc(NC(=O)/C(C#N)=C/c2cccc(OCC(=O)O)c2)cc1 408923917 LFARTQJTZNLEAV-OQLLNIDSSA-N 336.347 3.004 50 40 EGGB COc1ccc([C@@H]2C(C#N)=C(N)N(C)C3=C2C(=O)CCC3)cc1Cl 409137235 VZXJWPHGMHPFQI-MRXNPFEDSA-N 343.814 3.079 50 40 EGGB COc1ccc(C(=O)NNc2nc3c(C)cccc3s2)cc1OC 4121299 HDGUZKSXPZZINP-UHFFFAOYSA-N 343.408 3.379 50 40 EGGB CC(C)(C)c1n[nH]c2c1[C@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 4312118 PIXSJUWTMYECOL-GFCCVEGCSA-N 330.338 3.204 50 40 EGGB C/C(=N\NC(=O)Cc1ccc(Br)cc1)c1ccc(C)o1 9204092 PFHPHDHKYMLWJN-GZTJUZNOSA-N 335.201 3.433 50 40 EGGB CCOc1ccccc1NC(=O)C(=O)NN=C1CCCCCCC1 58885849 GJFBNWYPPXMLMO-UHFFFAOYSA-N 331.416 3.240 50 40 EGGB C=CCn1cc(/C=N/NC(=O)CNc2ccccc2)c2ccccc21 409374999 CVDDMRAZYNCLAD-LPYMAVHISA-N 332.407 3.390 50 40 EGGB COc1cc(/C=N/NC(=O)COc2ccccc2Cl)ccc1C 408914266 NQHJTVSAWMBTLY-VXLYETTFSA-N 332.787 3.186 50 40 EGGB Cc1ccccc1/C=C(/C#N)C(=O)N1CCN(c2ccccc2)CC1 255585932 MEYKVVYYHUQFJY-CYVLTUHYSA-N 331.419 3.251 50 40 EGGB CCCC(=O)NNc1nc(-c2ccc(NC(=O)CC)cc2)cs1 5857968 JSOKQPWAWHNZDU-UHFFFAOYSA-N 332.429 3.402 50 40 EGGB Cc1ccc([C@@H](NC(=O)N2CCOCC2)C(Cl)Cl)cc1F 3205613 OQXDUDFMCOATCG-GFCCVEGCSA-N 335.206 3.021 50 40 EGGB CCOC(=O)[C@H](CC)/C(C)=N/NC(=O)c1cc2ccccc2cc1O 101438715 MUBIXMUEGHYIFS-RVZJCZPVSA-N 342.395 3.240 50 40 EGGB C/C(CC(=O)Nc1cc(C)ccn1)=N\NC(=O)c1ccc(Cl)cc1 4601708 LNGLJFKZOGUIRL-CIAFOILYSA-N 344.802 3.178 50 40 EGGB O=C(COc1ccc(Cl)cc1Cl)N/N=C1/C[C@@H]2C=CC[C@@H]12 5670679 UMUJMDVIMPFHEB-CGYHMVOKSA-N 325.195 3.440 50 40 EGGB Cc1ccc(CC(=O)N/N=C\c2cc(Br)ccc2O)cc1 409364534 XSKVKUCSDPARJI-ZDLGFXPLSA-N 347.212 3.156 50 40 EGGB COC(=O)/C(C#N)=C/c1cccc(NC(=O)c2ccc(OC)cc2)c1 3546967 WVPYPRSZEUTHFC-XNTDXEJSSA-N 336.347 3.027 50 40 EGGB CCc1ccc(Oc2nc3ccccn3c(=O)c2C=C(C#N)C#N)cc1 5532349 ILHIGASBIRDBIG-UHFFFAOYSA-N 342.358 3.480 50 40 EGGB C=CCOc1ccc(/C=C(\C#N)C(=O)N2CCCC2)cc1OCC 409373711 YENHEMRLEABTRF-FOWTUZBSSA-N 326.396 3.179 50 40 EGGB CCOc1ccc(Br)cc1/C=C(/C#N)C(=O)NC(C)C 5927614 QMOGFMQYDWFYEW-GHXNOFRVSA-N 337.217 3.279 50 40 EGGB O=C(N/N=C1\CCc2ccccc2C1)N/N=C1\CCc2ccccc2C1 5940135 PQJQIEQYWXYVAC-WDAKLKSISA-N 346.434 3.375 50 40 EGGB Cc1ccccc1[C@H]1C(C#N)=C(N)N2C(=C1C#N)Nc1ccccc12 492541 BJTZMBCUUHGMNF-SFHVURJKSA-N 325.375 3.453 50 40 EGGB Cc1ccc(SCC(=O)NNC(=O)C[C@@H]2C[C@@H]3CC[C@@H]2C3)cc1 103000270 IGFLUYOAORCNET-KFWWJZLASA-N 332.469 3.061 50 40 EGGB COc1cccc(NC(=O)NNc2ccc(C(F)(F)F)cn2)c1 11559180 GZLVDWXNBJHDJU-UHFFFAOYSA-N 326.278 3.258 50 40 EGGB COC(=O)CSC1=C(C#N)[C@@H](c2ccc(C(C)C)cc2)CC(=O)N1 9089145 VOQXMAJPETWBBZ-CQSZACIVSA-N 344.436 3.055 50 40 EGGB COc1ccc(OC)c(/C=C(\C#N)C(=O)N[C@H](C)c2ccccc2)c1 192545500 NJHUPGBVAZPDCU-SWEABUAFSA-N 336.391 3.488 50 40 EGGB C[C@H](Br)C(=O)NC[C@@H](OCC1CC1)c1cccc(F)c1 95097940 MKRMIZKGIWOFKC-IINYFYTJSA-N 344.224 3.193 50 40 EGGB COc1ccccc1NC(=O)N/N=C\c1ccc(N2CCCC2)cc1 408961085 QXPQVHXKOZDIDH-ZHZULCJRSA-N 338.411 3.451 50 40 EGGB COc1cc(/C=N/NC(C)=O)cc(Cl)c1OCc1ccccc1 58822557 AJRXJTFUPOTQMG-VXLYETTFSA-N 332.787 3.398 50 40 EGGB FC(F)(F)C1(C(F)(F)F)N[C@@H]2[C@H](Br)C[C@@H]1[C@H]2Cl 100121925 CQNJIVNXDXPYJU-TXICZTDVSA-N 346.496 3.212 50 40 EGGB CCCc1n[nH]c2c1[C@H](c1ccc(OC(C)C)cc1)C(C#N)=C(N)O2 806421 VRINMTRMLUQGPI-MRXNPFEDSA-N 338.411 3.368 50 40 EGGB Cc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@@H]3c2ccncc2)cc1 481927 GYFKSPFETMFMKC-SFHVURJKSA-N 343.390 3.102 50 40 EGGB N#C/C(=C\c1ccncc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 6633223 WIMXGNIZCHSQAO-YRNVUSSQSA-N 328.715 3.189 50 40 EGGB C/C(N)=C(\C#N)C(=O)CSc1nnc(Nc2ccccc2C)s1 104666465 RRJSVACCWXYLLG-KHPPLWFESA-N 345.453 3.008 50 40 EGGB C/C(N)=C(\C#N)C(=O)CSc1nnc(Nc2cccc(C)c2)s1 104720974 HXAVGTZKXUGZOQ-BENRWUELSA-N 345.453 3.008 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)COc2ccc(OC)cc2)cc1 45924566 WNLQYGWOSKFVBD-XSFVSMFZSA-N 342.395 3.013 50 40 EGGB CC(C)(C)OC(=O)N(C[C@H]1CCCCN1C(=O)CCl)C1CC1 83318738 FMGSKADSXSAISE-CYBMUJFWSA-N 330.856 3.006 50 40 EGGB Cc1ccc(N2C(N)=C(C#N)C(C#N)(C#N)[C@@H]2c2ccccc2)cc1 5553185 KDTSMCAADIFKJZ-SFHVURJKSA-N 325.375 3.284 50 40 EGGB Cc1[nH]nc2c1[C@@H](c1cccc(OC3CCCC3)c1)C(C#N)=C(N)O2 4631718 NGDXGDLWXPPGNT-KRWDZBQOSA-N 336.395 3.258 50 40 EGGB CCc1ccc(NC(=O)C(=O)N/N=C/c2ccc(SC)cc2)cc1 6543176 FNPIFRQDSQOVOD-XDHOZWIPSA-N 341.436 3.060 50 40 EGGB COc1cc(C(=O)N/N=C(\C)[C@H]2C[C@@H]3CC[C@@H]2C3)cc(OC)c1OC 102123340 AVTPWNSWYYPBDO-UGGNJSFXSA-N 346.427 3.254 50 40 EGGB CCOc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(C(=O)O)cc1 3357682 SIYXKWVPMZGVFH-RVDMUPIBSA-N 336.347 3.329 50 40 EGGB COc1cc(C)c(/C=N\NC(=O)CCc2ccccc2)cc1OC 408549473 UENRVAQCFJOOLC-MOSHPQCFSA-N 326.396 3.095 50 40 EGGB CCc1sc(C(=O)NNC(=O)CSc2ccccc2C)cc1C 7652481 CUMHESWKKAEUBX-UHFFFAOYSA-N 348.493 3.481 50 40 EGGB CCOC(=O)/C(C#N)=C/c1cc(Br)c(O)c(OCC)c1 2773256 HPFXLDJOFMZWPZ-BJMVGYQFSA-N 340.173 3.023 50 40 EGGB BrC[C@@H](Br)C[n+]1cccc2ccccc21 3168165 KSGPKXHGGYUKMP-LLVKDONJSA-N 330.043 3.286 50 40 EGGB COc1c(C=C(C#N)C#N)c(C[C@H](C)Cl)c(OC)c2c1OCO2 15085440 HDBTZGWLJJPTPE-VIFPVBQESA-N 334.759 3.033 50 40 EGGB CSC1=C(C#N)[C@H](c2ccccc2)C(C(=O)OCCC#N)=C(C)N1 19815904 FUSCYWQLPPRUJL-INIZCTEOSA-N 339.420 3.202 50 40 EGGB Cc1ccc(Cl)cc1-c1ccc(/C=C(/C#N)C(=O)NC(N)=O)o1 409231689 FNSLNKNCOIHKDW-POHAHGRESA-N 329.743 3.010 50 40 EGGB C/C(=N\NC(=O)COc1ccccc1)c1ccc(Br)cc1 5221954 WNKWMJYHOJEUPF-LDADJPATSA-N 347.212 3.368 50 40 EGGB C/C(CC(=O)NCc1ccco1)=N\NC(=O)c1ccc2ccccc2c1 100510208 BWINGRVYPDWKQP-HYARGMPZSA-N 349.390 3.245 50 40 EGGB N#C/C(=C\c1ccc(Br)cc1)C(=O)Nc1nccs1 3312733 JNQKAYVDHDWGHI-JXMROGBWSA-N 334.198 3.451 50 40 EGGB Cc1ccc(OCCOc2ccccc2/C=C(/C#N)C(N)=O)cc1C 4679121 OABSQIKZXOMSMS-ATVHPVEESA-N 336.391 3.154 50 40 EGGB Cc1ccc(S(=O)(=O)/C(C#N)=C/c2cnc3cc(C)ccn23)cc1 78876713 MBEVEBHBTFQXCT-LICLKQGHSA-N 337.404 3.290 50 40 EGGB C/C(=N\NC(=O)CC1(C)SCCS1)c1cccc([N+](=O)[O-])c1 409359933 CNDPNWBPQUOFKZ-XNTDXEJSSA-N 339.442 3.021 50 40 EGGB Cc1cc(C(=O)NN)cc(C)c1OC(=O)c1ccc(C(C)C)cc1 256055159 ZMIDOSIJKIZBKO-UHFFFAOYSA-N 326.396 3.250 50 40 EGGB O=C(N/N=C/[C@H]1C[C@H]2CC[C@@H]1C2)C(O)(c1ccccc1)c1ccccc1 1213891 AVOCCHZHHHQNLQ-SXOMGOENSA-N 348.446 3.461 50 40 EGGB O=C(Cc1ccccc1)NN1C(=O)[C@H](Cl)[C@H]1c1ccc(Cl)cc1 5838470 IDEHMCXAZMRSSG-HZPDHXFCSA-N 349.217 3.105 50 40 EGGB C[C@H](NC(=O)/C(C#N)=C/c1ccc(OCC#N)cc1)c1ccccc1 8220639 ILLDDZVIIWTAOT-VUODPORTSA-N 331.375 3.373 50 40 EGGB COc1ccc(Cl)cc1/C=N/NC(=O)CNc1ccccc1C 60152 ZXGCJWXMAZPILA-KEBDBYFISA-N 331.803 3.219 50 40 EGGB COc1ccc(CCCC(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1 59840 QSRAKLMGQJGKEM-CPNJWEJPSA-N 341.367 3.076 50 40 EGGB C[C@@H]1[C@@H](C)N(C(=O)CCCl)c2ccccc2N1C(=O)CCCl 1713561 JVSATVSUNHATHC-VXGBXAGGSA-N 343.254 3.401 50 40 EGGB Cn1c(-c2ccccc2)c(C(=O)NNc2ncccn2)c2ccccc21 44717174 YLJDWRHWIBISEL-UHFFFAOYSA-N 343.390 3.392 50 40 EGGB Cc1ccc(SCC(=O)NNC(=O)c2cc3ccccc3o2)cc1 6510435 CUQFPIIGUBAFKG-UHFFFAOYSA-N 340.404 3.295 50 40 EGGB CCOC(=O)/C(C#N)=C\c1ccc([C@H](O)C(Cl)(Cl)Cl)o1 39377201 ZVOGNWSUCCGUKI-BXKUYDPTSA-N 338.574 3.153 50 40 EGGB O=C(N/N=C/[C@H]1C[C@H]2C=C[C@@H]1C2)C(O)(c1ccccc1)c1ccccc1 225658741 MEIWVLWDWOXTGU-SXOMGOENSA-N 346.430 3.237 50 40 EGGB CCC(=NNC(=O)c1cccc(Cn2cccn2)c1)c1ccccc1 254844220 CKBDJGJGPAOKJC-UHFFFAOYSA-N 332.407 3.476 50 40 EGGB O=C(c1ccc(C(F)(F)F)nc1)C(Br)Br 584906744 QGPDTRYWPNCTHZ-UHFFFAOYSA-N 346.928 3.399 50 40 EGGB CC(=O)N[C@H](CC(=O)Oc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 11326939 GCIWGRXYYRYGQE-QGZVFWFLSA-N 342.351 3.076 50 40 EGGB CC(=O)N/N=C/c1ccc(OCc2ccccc2)c(Br)c1 566671 PBSSUPDDKPZIAC-VCHYOVAHSA-N 347.212 3.498 50 40 EGGB O=C(CC(=O)Nc1cccc(C(F)(F)F)c1)N/N=C/c1ccccc1 59308 SOKXJCKQYHXLNA-SRZZPIQSSA-N 349.312 3.184 50 40 EGGB CCCC(=O)Nc1ccc(O)c(/C(C)=N/NC(=O)OC(C)(C)C)c1 101158053 YSYGIXNVURTDMV-YBFXNURJSA-N 335.404 3.380 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@H]1c1ccc(O)cc1 806310 IIHRDBQOQYKAJF-ZDUSSCGKSA-N 336.376 3.062 50 40 EGGB Cc1cc(C(=O)NNC(=O)c2ccccc2Cl)c(C)n1C1CC1 60912358 ZYYBRPWJCUZWQK-UHFFFAOYSA-N 331.803 3.168 50 40 EGGB Cc1nc(-c2ccsc2)sc1C(=O)NNC(=O)c1ccoc1C 12614398 MZOOBHULMLHAHP-UHFFFAOYSA-N 347.421 3.156 50 40 EGGB N#CCOc1ccccc1/C=N/NC(=O)c1cccc(C(F)(F)F)c1 4544619 LXCUNFDHKCWRCS-SSDVNMTOSA-N 347.296 3.372 50 40 EGGB CN(C)c1ccc(/C=C(\C#N)C(=O)OC[C@@H]2CC2(Cl)Cl)cc1 14897463 BXFYAQADKRUPSE-WHGQRRHOSA-N 339.222 3.397 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)CSc2ccccc2)cc1OC 408778679 WIBWALQNWJCWHP-CPNJWEJPSA-N 344.436 3.336 50 40 EGGB CC(C)(C)OC(=O)N1C[C@@H](O[Si](C)(C)C(C)(C)C)C[C@H]1CN 199626372 DKCJFKXHBRAYKQ-STQMWFEESA-N 330.545 3.345 50 40 EGGB CC(C)(C)OC(=O)N1CCc2nc(CBr)sc2C1 1772715293 QDGSMIXRVVGMRY-UHFFFAOYSA-N 333.251 3.331 50 40 EGGB C[C@H](SCc1ccccc1)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 5362371 GAUVEZVYZFLOFK-FHXOWUIVSA-N 343.408 3.367 50 40 EGGB CC[C@@H](C)c1ccc(OCC(=O)NNC(=O)c2cccs2)cc1 505701 PVGDOJJHYQYMPP-GFCCVEGCSA-N 332.425 3.102 50 40 EGGB O=C(NNC(=O)[C@H]1C[C@@H]1c1ccccc1)Nc1ccc(Cl)cc1 3152288 ISHSUSGGZFMGTF-CABCVRRESA-N 329.787 3.296 50 40 EGGB COc1ccc(C(=O)N/N=C(/c2ccccc2)c2ccccn2)cc1 3270748 SPQRHCRLPACNPY-QOCHGBHMSA-N 331.375 3.273 50 40 EGGB C/C(=N/NC(=O)c1cccs1)c1cccc(NC(=O)C2CC2)c1 4646785 CHUOWAMSCIMRBK-ODLFYWEKSA-N 327.409 3.251 50 40 EGGB CCCCNC(=O)/C(C#N)=C/c1sc(N2CCCC2)nc1Cl 96035106 XWUDXCZFTBYQMH-PKNBQFBNSA-N 338.864 3.220 50 40 EGGB C#CCn1cc(/C=C(\C#N)C(=O)n2nc(C)cc2C)c2ccccc21 409369966 ILCPTTSOIWPSOS-LFIBNONCSA-N 328.375 3.335 50 40 EGGB O=C(CCl)N[C@H](CC(=O)OC1CCCC1)c1ccc(F)cc1F 1615055523 BIXRBFIRTHLOTD-CQSZACIVSA-N 345.773 3.237 50 40 EGGB Cc1[nH]c2ccccc2c1/C=N/NC(=O)CCn1cnc2ccccc21 45282 MPTVEPKEPKAUAZ-WSDLNYQXSA-N 345.406 3.366 50 40 EGGB C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 20248946 YEQTYEIDEXFRMM-PBSOMRJOSA-N 329.381 3.226 50 40 EGGB COc1cccc(-c2n[nH]c3c2[C@@H](c2ccccc2)C(C#N)=C(N)O3)c1 5911394 QAWZGBOFALNWAC-INIZCTEOSA-N 344.374 3.303 50 40 EGGB Cc1ccc(NC(=O)N/N=C\c2ccc(O)c([N+](=O)[O-])c2)c(C)c1 408964919 TYQZUKSIHLVULI-MFOYZWKCSA-N 328.328 3.073 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc(Cl)cc2)cc1OC 36316681 JDRNACYNUSRGSP-UDWIEESQSA-N 346.814 3.440 50 40 EGGB N#C/C(=C\c1cc(Br)cs1)C(=O)NC1CCCC1 558971 CFUCTZIDHAZYCA-WEVVVXLNSA-N 325.231 3.476 50 40 EGGB COc1ccc(C(=O)N/N=C/c2cc(Br)c(C)o2)cc1 233618 WNEOFNSSGFSOPJ-LZYBPNLTSA-N 337.173 3.123 50 40 EGGB CC[C@H](Nc1cccc(C)c1)C(=O)N/N=C/c1ccc2c(c1)OCO2 369845 GORLDIWBVGFBEX-YODDIOPGSA-N 339.395 3.065 50 40 EGGB Oc1ccc(Br)cc1CN(CCCl)CCCl 1675790 VMSDQLZMOHDSHJ-UHFFFAOYSA-N 327.049 3.434 50 40 EGGB CCOc1ccc(/C=C(\C#N)C(=O)NC2CCCC2)c(OCC)c1 2769230 AMMSWCVFYYOTMJ-RVDMUPIBSA-N 328.412 3.450 50 40 EGGB O=C(Cl)c1ccc(C(=O)Cl)c2c1C(=O)c1ccccc1C2=O 100350809 HXWZTRAPIUWIJL-UHFFFAOYSA-N 333.126 3.220 50 40 EGGB O=C(NNc1c(Cl)cc(Cl)cc1Cl)c1cccc[n+]1[O-] 44838323 BVHWFWYQFNPGDM-UHFFFAOYSA-N 332.574 3.037 50 40 EGGB C/C(=N\NC(=O)c1ccc(Br)cc1)c1ccccc1O 18106642 NGGXIZNEXMJVTO-LICLKQGHSA-N 333.185 3.309 50 40 EGGB COc1cccc(/C=N\NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 408903906 BBYSBCWZMJSIIN-ZDLGFXPLSA-N 339.307 3.114 50 40 EGGB Cc1cc(/C=C(/C#N)C(=O)OCC(=O)OC(C)C)c(C)n1CC(C)C 40040018 JLCISEYWOCTUIH-IUXPMGMMSA-N 346.427 3.163 50 40 EGGB CSc1ccc(/C=N/NC(=O)C(=O)Nc2cc(C)ccc2C)cc1 5744886 GGGOLSVGVABSIU-YBFXNURJSA-N 341.436 3.114 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2cccc(OC)c2)c(OCC)c1 169878583 KGSOVUNBEASVDF-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB Cc1cccc(/C=N/NC(=O)c2ccc(NC(=O)C(C)(C)C)cc2)n1 59514895 TVDQDNSALBIRBE-UDWIEESQSA-N 338.411 3.139 50 40 EGGB N#CCC(=O)N/N=C/c1ccc(OCc2ccccc2Cl)cc1 59447294 ZOFGBEMIVWYFBH-RGVLZGJSSA-N 327.771 3.283 50 40 EGGB O=C(NNC(=S)Nc1ccc(F)cc1)C12CC3CC(CC(C3)C1)C2 4599485 ZSSWQOLHXRCLIB-UHFFFAOYSA-N 347.459 3.360 50 40 EGGB C#CCOc1ccccc1/C=N/NC(=O)c1ccc(OCCC)cc1 20197788 CEANBDIUWJQQAE-RCCKNPSSSA-N 336.391 3.251 50 40 EGGB CCOc1cccc(/C=N\NC(=O)c2ccc(OCC)c(OC)c2)c1 409310226 SHZSPPRDIWDCMR-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB CC1(C)C(=O)[C@@]2(Br)CC[C@@]1(CC#N)[C@H]2Br 252486919 OJTCQBIJBRMLII-AVPPRXQKSA-N 335.039 3.186 50 40 EGGB Cc1ccccc1N1C(S)=C(C#N)C(=O)N[C@@H]1c1cccs1 352258 WKKFXMPDENJIDJ-AWEZNQCLSA-N 327.434 3.357 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2c[nH]c3ccccc23)cc1OC 2751838 UVLMKIOADWIXLL-SRZZPIQSSA-N 337.379 3.339 50 40 EGGB C#CCSC1=C(C(=O)OCC)[C@@H](c2cccs2)C(C#N)=C(C)N1 23379247 WDHCRMBRRITNSS-CQSZACIVSA-N 344.461 3.374 50 40 EGGB CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccccc2O)cc1 1453575 VVNUYRGSXMHWME-RVDMUPIBSA-N 336.347 3.115 50 40 EGGB C/C(=N/NC(=O)C1CCCCC1)c1cccc(NC(=O)C2CC2)c1 17067074 LIEIKDYPIMHJQD-BKUYFWCQSA-N 327.428 3.456 50 40 EGGB CSc1ccc(NNC(=O)/C=C/c2cnc(SC)nc2)cc1 408533740 RZUUHWXKWJAPMY-FPYGCLRLSA-N 332.454 3.077 50 40 EGGB CN(C)c1ccc([N+](=O)[O-])cc1/C=C(\C#N)C(=O)NC1CCCCC1 408995945 CCSAWMIEXWMVSY-GXDHUFHOSA-N 342.399 3.017 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2[N+](=O)[O-])cc1 4041151 QFCZEYAYDOISOH-GXDHUFHOSA-N 337.335 3.458 50 40 EGGB CCn1nc(C)c([C@H]2[C@@H]3CCCC=C3C(C#N)=C(N)C2(C#N)C#N)c1C 2769699 FCZZYPKTQOKKEW-CRAIPNDOSA-N 346.438 3.113 50 40 EGGB COc1ccc2[nH]cc(/C=C(\C#N)C(=O)Nc3cccc(O)c3)c2c1 61718815 DJQLUHYJDVFOQG-KPKJPENVSA-N 333.347 3.428 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccccc2-n2cccc2)cc1OC 408749667 RYHWXPRFQDBERV-KGENOOAVSA-N 349.390 3.258 50 40 EGGB C/C(=N\NC(=O)c1cc2c(s1)CCCC2)c1cc(O)cc(O)c1 13322023 UDHLGASPEFDYEQ-VCHYOVAHSA-N 330.409 3.192 50 40 EGGB C/C(=N\NC(=O)Cc1cn2ccsc2n1)c1ccccc1Cl 5070579 UWIGOQOPEKTLKP-VCHYOVAHSA-N 332.816 3.132 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@H]1Cc1ccccc1 16478911 KECFZEYHTDRLMI-HNNXBMFYSA-N 328.375 3.489 50 40 EGGB Cc1cc(C)cc(NC(=O)C(=O)N/N=C/c2cccc(Cl)c2)c1 408971034 GBGRCPCGMMEBDB-VXLYETTFSA-N 329.787 3.046 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 5384677 YPAIEJBKTVTMKH-XDHOZWIPSA-N 325.368 3.411 50 40 EGGB O=C(N/N=C/c1nc2ccccc2[nH]1)c1ccc(Br)cc1 4458734 XJHCFPFJGDCYCG-RQZCQDPDSA-N 343.184 3.089 50 40 EGGB Cc1cc(C(=O)N/N=C/c2ccccc2[N+](=O)[O-])c2ccccc2n1 217906 PEMGBNOCXKGNHM-YBFXNURJSA-N 334.335 3.215 50 40 EGGB O=C(CBr)Nc1ccc(NC(=O)c2ccccc2)cc1 35605379 PQSJTGMCJDDSAV-UHFFFAOYSA-N 333.185 3.272 50 40 EGGB CCOC(=O)[C@H]1CCC/C1=N\NC(=O)[C@H](C)SCc1ccccc1 408719100 DLUALPRVXCTUPB-BZVZBAJASA-N 348.468 3.144 50 40 EGGB O=C(N/N=C\c1ccc(Br)s1)C1[C@H]2CCCC[C@@H]12 12375007 NQPYXXXQMQQTEN-IZVYCPQXSA-N 327.247 3.397 50 40 EGGB Cc1ccc(/C=N\NC(=O)CC(=O)Nc2cccc(Cl)c2)cc1 32119736 ZMRGMHUQQAZMDI-ODLFYWEKSA-N 329.787 3.127 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2c(C)nc3ccc(C)cn23)cc1 59444031 OJQSGOSVXVCXJD-RGVLZGJSSA-N 336.395 3.114 50 40 EGGB CCN(CC)c1ccc(C(=O)N/N=C/c2ccc(OC)c(O)c2)cc1 3476419 ANZPWXBQSZXIFH-DEDYPNTBSA-N 341.411 3.011 50 40 EGGB COCc1nc(C(=O)NNc2ccccc2C(F)(F)F)cs1 65106374 UIHOIIRYJKLCFX-UHFFFAOYSA-N 331.319 3.065 50 40 EGGB CCOc1ccc(/C=N\NC(=O)Cc2ccc(C)cc2)cc1OC 409360703 MSRMBNLPFRKLBA-MOSHPQCFSA-N 326.396 3.095 50 40 EGGB C/C(=N\NC(=O)c1ccc(Cl)cc1O)c1cccc([N+](=O)[O-])c1 17068712 ZBNPUMOSICYRIL-RQZCQDPDSA-N 333.731 3.108 50 40 EGGB C/C(CC12CC3CC(CC(C3)C1)C2)=N\NC(=O)Cc1cc(C)n[nH]1 17691993 FVYLUDWIQQBVPH-FYJGNVAPSA-N 328.460 3.359 50 40 EGGB COc1cc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@]32C)cc(Cl)c1O 408949486 FNVYQTQPIQZUTR-RFFMAUGYSA-N 336.819 3.331 50 40 EGGB CCOC(=O)C/C(C)=N/NC(=O)[C@@H](C)Sc1ccc(Cl)cc1 408729008 AFCJKRKGFOYDLB-JDAJCMJVSA-N 342.848 3.266 50 40 EGGB CCOc1cc(/C=N\NC(=O)Cc2cc(C)ccc2C)ccc1O 409366524 VMUGWLHPBUFMLY-NDENLUEZSA-N 326.396 3.101 50 40 EGGB O=C(N/N=C/c1ccco1)C1CCN(Cc2ccc(Cl)cc2)CC1 31047 TUACQKIPDFFNBM-UDWIEESQSA-N 345.830 3.295 50 40 EGGB Cc1cc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)c(C)n1-c1ccccc1 7159840 ZDHNCLQVQLHLLN-VOMPUTFMSA-N 349.434 3.296 50 40 EGGB COc1cc(-c2ccc(F)cc2)nc(NC(=O)C(Cl)Cl)n1 159983 WLVMFRYAFGRDLB-UHFFFAOYSA-N 330.146 3.034 50 40 EGGB O=C(N[C@H](NC(=O)c1cccs1)C(Cl)Cl)c1ccccc1 101425591 AVLDHVSMEVJYGS-GFCCVEGCSA-N 343.235 3.038 50 40 EGGB CCCOc1ccc(NC(=O)NC(=O)CCl)cc1OCCC 2653943 UWXXXWGALLMAFN-UHFFFAOYSA-N 328.796 3.151 50 40 EGGB COc1ccc2cc([C@@H](C)C(=O)NNC(=O)CC(C)C)ccc2c1 12769686 FQFSYXPOGVTNGO-CYBMUJFWSA-N 328.412 3.145 50 40 EGGB CCNC(=O)N(C)NC(=O)Nc1sc2ccccc2c1Cl 95467242 LTRJTZOTEHMZEN-UHFFFAOYSA-N 326.809 3.253 50 40 EGGB CCOc1ccc(CC(=O)N/N=C(\C)c2ccc(OC)cc2)cc1 408711681 FMYVTZYNKJJWJM-XSFVSMFZSA-N 326.396 3.177 50 40 EGGB COc1cc(C)c(/C=C(/C#N)C(=O)NC[C@H]2CCCO2)cc1C(C)C 48493 NLYWXDVGIOEEEB-VHEJECIDSA-N 342.439 3.329 50 40 EGGB CC(=O)NNc1nc(C)c(C(=O)/C=C/c2ccccc2Cl)s1 16957629 SPDCZZMATIQLGL-BQYQJAHWSA-N 335.816 3.464 50 40 EGGB Cn1ccnc1SCC(=O)/C(C#N)=C1/Nc2ccccc2S1 102367124 VAZQSRRMELILHG-UVTDQMKNSA-N 328.422 3.034 50 40 EGGB CCCOc1ccc(C(=O)N/N=C/c2cc(OC)ccc2OC)cc1 20197520 XMNKSJIHGRUCBE-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB CC(=O)N/N=C/c1cc(C)n(-c2cccc(Br)c2)c1C 28216680 HKKCTGVQGAMCAW-RQZCQDPDSA-N 334.217 3.327 50 40 EGGB COC(=O)N/N=C/c1cc(Cl)ccc1OCCOc1ccccc1 4525971 BWONHPNYJSBPLB-XDHOZWIPSA-N 348.786 3.488 50 40 EGGB C#CCOc1c(Cl)cc(/C=C(/C#N)C(=O)NC(C)C)cc1Cl 408772641 DUHUKTKEWSCJAC-SDQBBNPISA-N 337.206 3.437 50 40 EGGB O=C(N/N=C\c1cc2c(cc1Cl)OCO2)c1ccc(Cl)cc1 4814101 XBNNHQMHAKXDFJ-WSVATBPTSA-N 337.162 3.486 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2ccco2)cc1Br 408757436 ZWCWFPKORGJIFM-CXUHLZMHSA-N 337.173 3.205 50 40 EGGB CC(C)N(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)CCl 79392555 YEDTYRBRFZVUIQ-CYBMUJFWSA-N 332.872 3.252 50 40 EGGB O=C(N/N=C\c1ccsc1)C(O)(c1ccccc1)c1ccccc1 33328640 MAJUDQCUISMZAC-MOSHPQCFSA-N 336.416 3.134 50 40 EGGB O=C(N/N=C/c1ccc(OCc2ccccc2)cc1)c1cccnc1 227592 KSZDTNOCFBMGSG-LPYMAVHISA-N 331.375 3.425 50 40 EGGB CCOP(=O)(OCC)C1=C(C)OC(N)=C(C#N)[C@@H]1c1cccnc1 6392879 LDMLGGXEUOODAX-AWEZNQCLSA-N 349.327 3.387 50 40 EGGB ICC1(CI)CCC1 100403734 LDIPTYNQUAFCAP-UHFFFAOYSA-N 335.954 3.027 50 40 EGGB Cc1ccc([C@H]2CC(=O)NC(SCC(=O)OC(C)C)=C2C#N)cc1 9109368 VKZDXGBBIDJYBF-CQSZACIVSA-N 344.436 3.019 50 40 EGGB Cc1cccc(/C=N/NC(=O)c2cccc(Cn3nc(C)cc3C)c2)n1 130490 JNLOQVCOSOINOI-CIAFOILYSA-N 347.422 3.016 50 40 EGGB COc1ccc2c(c1O)-c1cc(O)cc3c1[C@@H](C2)N(CCCl)CC3 6484944 VVQWGUWJTOACKC-OAHLLOKOSA-N 345.826 3.468 50 40 EGGB Cc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(=O)[nH]c1ccccc21 8017725 QCABAXQOPMDVRM-INIZCTEOSA-N 329.359 3.055 50 40 EGGB CCCCOc1ccc(C(=O)NNc2nc(C)cc(C)n2)cc1OC 22234332 GVAVHYXASRKPGC-UHFFFAOYSA-N 344.415 3.038 50 40 EGGB COc1ccc(-n2cccc2/C=N/NC(=O)c2ccccc2F)cc1 408951082 HVBJKOSGGDPCFE-FYJGNVAPSA-N 337.354 3.389 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1cc([N+](=O)[O-])ccc1Cl 409234977 AALHATIHMVPWAC-NVMNQCDNSA-N 335.722 3.080 50 40 EGGB O=C(N/N=C\c1ccccc1F)C(O)(c1ccccc1)c1ccccc1 33286551 HZNMKQJMTZXVSO-HAHDFKILSA-N 348.377 3.212 50 40 EGGB O=C(Cl)c1cccc(-c2nn3c(C(F)(F)F)nnc3s2)c1 73634535 VRUBPWCEXXWAPT-UHFFFAOYSA-N 332.694 3.251 50 40 EGGB Cn1c(SCCCCl)nnc1-c1cc([N+](=O)[O-])ccc1F 228922999 CJGLYAVRNMQSHB-UHFFFAOYSA-N 330.772 3.250 50 40 EGGB CC(C)c1ccc(/C=C(\C#N)C(=O)Nc2ccccc2C(N)=O)cc1 143469 USKFRIQIBDOICC-LFIBNONCSA-N 333.391 3.455 50 40 EGGB O=C(N/N=C/c1ccc(OC(=O)c2ccco2)cc1)c1ccccc1 342581 AXWSGPDHTWNZJN-DEDYPNTBSA-N 334.331 3.263 50 40 EGGB Cc1cc(Cl)ccc1NC(=S)NNC(=O)c1cccs1 1413017 WKEQUADGEIJJTM-UHFFFAOYSA-N 325.846 3.341 50 40 EGGB N#C/C(=C\c1ccc(OCc2ccc(C#N)cc2)cc1)C(=O)NC1CC1 409195215 GLEIDCCVDCXYNP-WOJGMQOQSA-N 343.386 3.323 50 40 EGGB O=C([C@@H](Cl)c1ccccc1)N1CCN(Cc2ccccc2)CC1 19680855 SEAFKIJBUJSUBY-SFHVURJKSA-N 328.843 3.311 50 40 EGGB CCN1/C(=C(\C#N)c2nc(C#N)c(C#N)nc2Cl)Nc2ccccc21 103603077 LICQEJRWSYVOFA-LICLKQGHSA-N 347.769 3.018 50 40 EGGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2cccc(F)c2)c1 3621597 OZZPGNHVSGMWFY-UHFFFAOYSA-N 344.386 3.098 50 40 EGGB C/C(=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1Cl 5381579 UCXBXEIAXSSAQJ-WOJGMQOQSA-N 331.759 3.331 50 40 EGGB N#CC(C(=O)COC(=O)CCc1ccccc1)=C1Nc2ccccc2N1 6537681 UMYPLIDCUVOOTJ-UHFFFAOYSA-N 347.374 3.004 50 40 EGGB COc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1ccc(F)cc1 408890210 PSFIRCGALIKKDP-XYOKQWHBSA-N 341.298 3.288 50 40 EGGB O=C(CC(c1ccccc1)c1ccccc1)NNC(=O)c1ccccn1 17328988 MORIGGWLVKWOCG-UHFFFAOYSA-N 345.402 3.065 50 40 EGGB CC1=CC(C)(C)N(C)c2ccc(/C=N/NC(=O)c3cccnc3)cc21 208440570 IQHZWSLLFYXSLZ-WSDLNYQXSA-N 334.423 3.477 50 40 EGGB O=[N+]([O-])c1ccc(S(=O)(=O)OC23CCC(CC2)C[C@H]3Cl)cc1 2558669 XXYHJSYTLRTUBD-IWXRYERYSA-N 345.804 3.240 50 40 EGGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1cc(Cl)ccc1O 4852611 SFIVMOQJAUMNSM-UHFFFAOYSA-N 348.830 3.023 50 40 EGGB CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)CCl 3336154 NCDHCHZSFDNSNC-UHFFFAOYSA-N 337.634 3.409 50 40 EGGB C/C(=N\NC(=O)[C@@H]1COc2ccccc2O1)c1cc2ccccc2o1 5164233 BDZMSYXILSVXJO-TYJAPOHBSA-N 336.347 3.113 50 40 EGGB N#CC(C(=O)CN1CC[C@H]2CCCC[C@@H]2C1)=C1Nc2ccccc2N1 7612864 WFRPBXVKZBFGCV-HUUCEWRRSA-N 336.439 3.340 50 40 EGGB O=C1C=C(NNC(=O)c2cccc(Cl)c2)C[C@H](c2ccco2)C1 408751557 XZUUGJUZUGPMPU-LBPRGKRZSA-N 330.771 3.198 50 40 EGGB Cc1cc2c(cc1/C=C(/C#N)C(=O)NCCCc1ccccc1)OCO2 409241783 UUHLMQSGDYCZGM-WQRHYEAKSA-N 348.402 3.380 50 40 EGGB CCCOc1ccc(Br)cc1/C=C(\C#N)C(N)=S 408542246 HYHOBJLZOSAARR-UXBLZVDNSA-N 325.231 3.431 50 40 EGGB O=C(CBr)c1cccc2c1OC(F)(F)C(F)(F)O2 98210845 PMTHQEXBINNQQW-UHFFFAOYSA-N 329.043 3.221 50 40 EGGB C[C@H](SCc1ccccc1)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 50172 DAHOJDPPEVWZNB-FHXOWUIVSA-N 343.408 3.367 50 40 EGGB Cc1ccc(SCC(=O)/C(C#N)=C2\NC(=O)c3ccccc3N2)cc1 103649039 QMAYKZLKPDKWKZ-SDXDJHTJSA-N 349.415 3.247 50 40 EGGB Cc1ccc(C(=O)NNC(=O)COc2cc(C)ccc2C(C)C)cc1 368037 CQPDHWPBUZYYPX-UHFFFAOYSA-N 340.423 3.267 50 40 EGGB COc1cccc(/C=N/NC(=O)c2ccc(C)cc2Cl)c1OC 4815557 XCWIHPMQORDQMX-VXLYETTFSA-N 332.787 3.430 50 40 EGGB Cn1c(/C(C#N)=C/c2cccc3cn[nH]c23)nnc1-c1ccccc1 78998980 YTNBLAYDKSYBNF-MHWRWJLKSA-N 326.363 3.423 50 40 EGGB Cc1ccc(C)n1NC(=O)/C(C#N)=C\c1ccc(Cl)c([N+](=O)[O-])c1 409382815 RGGVQXHBWJVVRP-QPEQYQDCSA-N 344.758 3.344 50 40 EGGB Cc1ccc(Cc2ccc(C(=O)NN)n2Cc2ccc(F)cc2)cc1 226029959 AXRLOCOCIIFNBV-UHFFFAOYSA-N 337.398 3.178 50 40 EGGB COc1cccc(/C=N\NC(=O)c2ccc(Cl)cc2Cl)c1O 95938411 WOQCJWKOZFPRCI-LSCVHKIXSA-N 339.178 3.472 50 40 EGGB COc1ccc2ccccc2c1/C=N/NC(=O)CNc1ccccc1 5335603 GFBRGKLIWXVGHW-LPYMAVHISA-N 333.391 3.411 50 40 EGGB Cc1cc(C)c(/C=N/NC(=O)CSc2nc(C)cc(C)n2)c(C)c1 8333262 CJCPGNQTKNNMDW-DJKKODMXSA-N 342.468 3.261 50 40 EGGB N/C(CCl)=N\OC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 4288517 DLYWEXYHFHDOLV-UHFFFAOYSA-N 348.630 3.392 50 40 EGGB O=C(N/N=C/c1ccc(F)cc1)C(=O)Nc1ccc2ccccc2c1 3101339 KWHVMOKHWULHDE-CIAFOILYSA-N 335.338 3.068 50 40 EGGB CCOC(=O)[C@@]1(C#N)C(=O)C(C#N)=C2CCCC[C@H]2[C@@H]1c1ccccc1 4557874 JPWFTLNBFYFNII-PLMTUMEDSA-N 348.402 3.436 50 40 EGGB CCOc1cc(/C=N/NC(=O)OC)ccc1OC(=O)c1cccs1 506364 QFSLKWZJXZDCPK-LICLKQGHSA-N 348.380 3.056 50 40 EGGB O=C(N/N=C\c1cccc(Cl)c1Cl)c1n[nH]c2c1CCCC2 12428397 NPMWMTSLYYOQBE-LSCVHKIXSA-N 337.210 3.359 50 40 EGGB Cc1cccc(/C=N/NC(=O)c2ccccc2Br)c1O 4735480 GYPOWCBDUHJGNN-RQZCQDPDSA-N 333.185 3.227 50 40 EGGB O=c1cc(CCl)c2ccc(NS(=O)(=O)c3ccccc3)cc2o1 62756616 QEQIKYIHYYWNGM-UHFFFAOYSA-N 349.795 3.333 50 40 EGGB O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)c1ccccc1O 257052 PMJGWWMIDKKJOA-REZTVBANSA-N 325.151 3.169 50 40 EGGB C[C@@H](Oc1ccc(Cl)cc1)C(=O)N/N=C/c1ccc(N(C)C)cc1 93727 JGVQGLKOEHARFQ-HMHKGCENSA-N 345.830 3.324 50 40 EGGB CO[C@@H](C(=O)N/N=C/c1ccc(OC(C)C)cc1)c1ccccc1 354324 AEFHGVFZGFJGNX-JZQBQCRLSA-N 326.396 3.312 50 40 EGGB COc1ccc(O)c(/C=N/NC(=O)Cc2ccc(C(C)(C)C)cc2)c1 107810761 LHSUJIHZYYXWBE-FYJGNVAPSA-N 340.423 3.391 50 40 EGGB C/C(CC(=O)Nc1c(C)cccc1C)=N\NC(=O)Cc1cccs1 4679864 YZCOXVKHMWPVNW-XSFVSMFZSA-N 343.452 3.428 50 40 EGGB Cc1cc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(C)n1C 4691361 WLVPXOSGZSUOHH-GIJQJNRQSA-N 340.339 3.060 50 40 EGGB Cc1ccsc1[C@@H]1C(C#N)=C(N)Oc2n[nH]c(C(F)(F)F)c21 5818648 OPAIFEZWBFLGTE-SSDOTTSWSA-N 326.303 3.017 50 40 EGGB C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1cccs1 7649857 WUYWRFQOSROIGL-GFCCVEGCSA-N 340.404 3.130 50 40 EGGB CCOc1cccc(/C=N/NC(=O)CNc2ccc(Cl)cc2)c1 408692518 OGLKCMMCQQOWEW-RGVLZGJSSA-N 331.803 3.301 50 40 EGGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1ccccc1Cl 408567999 RIPZCWJKNRVQQC-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB COc1ccccc1N[C@H](C)C(=O)N/N=C/c1c[nH]c2ccccc12 234471 GRQFPJOUJQDBNX-LNOXHEFASA-N 336.395 3.127 50 40 EGGB Cc1ccc([C@]23C=C[C@](c4ccccc4)(C2)[C@H]2C(=O)OC(=O)[C@@H]23)cc1 104258044 NGVNZZVUDLWVTA-YHBROIRLSA-N 330.383 3.460 50 40 EGGB O=C(N/N=C/c1cccn1-c1cccc(C(=O)O)c1)Nc1ccccc1 531399 FHFKVPIBQXEBBQ-DEDYPNTBSA-N 348.362 3.331 50 40 EGGB O=C(N/N=C1/CCCN1)c1cc(-c2ccc(F)cc2)nc2ccccc12 3189933 NZYZUYCOHFOTNO-UHFFFAOYSA-N 348.381 3.468 50 40 EGGB COc1ccc(OC)c(/C(C)=N/NC(=O)Cc2ccc(C)cc2C)c1 20195538 KMOPJSKWEIOADN-RCCKNPSSSA-N 340.423 3.404 50 40 EGGB Cc1cc(C)nc(NNC(=O)c2cc(F)c(Cl)cc2Cl)n1 11334328 TUALXZXROWTCLC-UHFFFAOYSA-N 329.162 3.296 50 40 EGGB O=C(N/N=C/c1ccc(N2CCOCC2)s1)c1ccc(Cl)cc1 3469527 COAOAKJROMXJEX-WOJGMQOQSA-N 349.843 3.002 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)Cc2cccc(C(F)(F)F)c2)cc1 408759657 IVFZXVLZALPYBY-WSDLNYQXSA-N 349.356 3.464 50 40 EGGB Cc1cc(/C=N/NC(N)=O)c(C)n1-c1ccc(Cl)c(Cl)c1 408899144 ZLFNZQHUPULSIX-CNHKJKLMSA-N 325.199 3.403 50 40 EGGB Cc1ccc(-n2c(=O)c3ccccc3n3c(CCl)nnc23)cc1C 15424615 GCQDKRGRMLJFTR-UHFFFAOYSA-N 338.798 3.389 50 40 EGGB O=C(CN1CCCc2ccccc21)N/N=C/c1ccc(Cl)cc1 4140077 HKUPRBBNLRYHQP-UDWIEESQSA-N 327.815 3.243 50 40 EGGB O=C(N/N=C/c1ccccc1)C(O)(c1ccccc1)c1ccccc1 115001 HTNLCXNSUZNZDD-CJLVFECKSA-N 330.387 3.073 50 40 EGGB C[C@]1(C(=O)OC[C@@H]2CCC[N+]3(C)CCCC[C@H]23)C[C@H]1Br 4028524 CIGRASSTVHFEOB-MHNNJBJPSA-N 345.301 3.112 50 40 EGGB CCCN1C(=O)/C(=N/NC(=O)c2cccc(Cl)c2)c2ccccc21 6879397 QDDGPLYMHGJKRS-CAPFRKAQSA-N 341.798 3.231 50 40 EGGB COc1ccccc1C(=O)N/N=C/c1ccc(N2CCCCC2)cc1 408960542 MORAWRUTWRVHME-RCCKNPSSSA-N 337.423 3.449 50 40 EGGB CC(C)COc1ccc(C(=O)NNC(=O)c2cccc(Cl)c2)cc1 3323855 UTUFPLJSFVKIRU-UHFFFAOYSA-N 346.814 3.450 50 40 EGGB C[C@@H](SCc1ccccc1)C(=O)N/N=C/c1ccc(C(=O)O)cc1 59166057 LTHFUBQSJRPRIA-OTGIAGGSSA-N 342.420 3.157 50 40 EGGB Cc1cc(C)nc(SCC(=O)N/N=C/C2=CC[C@@H]3C[C@@H]2C3(C)C)n1 102375223 HPLPZQOBHWAKRR-LQRPXCNGSA-N 344.484 3.280 50 40 EGGB N#CCOc1ccc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)cc1 4739033 VLSWUEOEROGOSB-SSDVNMTOSA-N 347.296 3.372 50 40 EGGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1cccs1)c1ccccc1 408978590 JHJWTNBJLPROJV-BRFSQIRFSA-N 345.424 3.076 50 40 EGGB COc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1ccc([N+](=O)[O-])o1 408860871 GZKOVJCRTNWKQZ-RMKNXTFCSA-N 347.714 3.395 50 40 EGGB CCOc1cc(C=NNC(=O)[C@H](C)Oc2ccc(C)cc2)ccc1O 245204285 MVUBCCAFGLMMOL-AWEZNQCLSA-N 342.395 3.017 50 40 EGGB COC(=O)/C(C#N)=C/c1ccc(OC(=O)C2CCCCC2)c(OC)c1 149083 WLFKHCIEYWCATC-XNTDXEJSSA-N 343.379 3.261 50 40 EGGB CCCc1ccc(OCC(=O)N/N=C/c2cc([N+](=O)[O-])cs2)cc1 60219 OHMHBDHOHHKTIV-RQZCQDPDSA-N 347.396 3.138 50 40 EGGB COc1ccc(-n2c(C)cc(/C=N\NC(=O)c3ccncc3)c2C)cc1 6961835 UOHRIXYYTJKXEN-XKZIYDEJSA-N 348.406 3.262 50 40 EGGB COc1cc(C)ccc1C(=O)N/N=C/c1cn(CC#N)c2ccccc12 108030408 AVXCUXIKUDNAJA-WSDLNYQXSA-N 346.390 3.246 50 40 EGGB O=C(Cn1c(C(F)(F)F)nc2ccccc21)N/N=C1/C[C@@H]2C=CC[C@H]12 22287023 JRAAYNSTYLQGLF-DFTGSABMSA-N 348.328 3.123 50 40 EGGB COc1ccc(/C=N/NC(=O)c2cc3ccccc3nc2C)c(OC)c1 4525846 IOFDRKJBAHOUBL-CIAFOILYSA-N 349.390 3.324 50 40 EGGB COc1cc(/C=N/NC(=O)c2cc(C)oc2C)ccc1OC(F)F 7422665 XCYCIHFIEFHTSI-UFWORHAWSA-N 338.310 3.270 50 40 EGGB CCOC(=O)N/N=C(\C)c1cccc(NC(=O)c2ccc(C)o2)c1 17067448 VRHMSKFTONHPTA-XDHOZWIPSA-N 329.356 3.310 50 40 EGGB Cc1cc([N+](=O)[O-])c(-c2ccc(/C=C(/C#N)C(N)=O)o2)cc1Cl 252480204 BXXMZCNVVDRAEA-UITAMQMPSA-N 331.715 3.209 50 40 EGGB CCc1ccccc1NC(=O)C/C(C)=N/NC(=O)c1ccccc1O 104040034 GCOLPMRWIZTCHW-FYJGNVAPSA-N 339.395 3.089 50 40 EGGB O=C(/C=C/c1c(Cl)nc2sccn12)NNc1ccc(F)cc1 45970167 SMVMQUPCYZOASH-AATRIKPKSA-N 336.779 3.345 50 40 EGGB CCCN1CCC(=NNC(=O)c2ccccc2Br)CC1 5509094 JDXRPYRJYANOMY-UHFFFAOYSA-N 338.249 3.041 50 40 EGGB COc1ccc(S(=O)(=O)/C(C#N)=C/Nc2ccccc2F)cc1 6662917 LQHMPOJDOSZSKO-SDNWHVSQSA-N 332.356 3.085 50 40 EGGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)c1csc2c1CCCC2 568087 POUUGQUTKDLJGS-RQZCQDPDSA-N 329.381 3.299 50 40 EGGB CCC(=O)NNC(=O)C12C[C@H]3C[C@H](C1)CC(c1ccc(C)cc1)(C3)C2 100846239 LPHGBLFYDJHJAF-RKAKKKFESA-N 340.467 3.390 50 40 EGGB CC(C)N1C(=O)/C(=C(/C#N)c2nnc3n2CCCCC3)c2ccccc21 5752033 HMHCYYLFDUMQCR-SDXDJHTJSA-N 347.422 3.194 50 40 EGGB CC/C(=N\NC(=O)c1cccc(OC)c1)c1ccc(OC)c(OC)c1 408869300 QSVBIFXYSINIFR-CAPFRKAQSA-N 342.395 3.257 50 40 EGGB CC(=O)Oc1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)cc1 408797723 GWYGVMLFIINUFI-YZQIXXFGSA-N 326.396 3.214 50 40 EGGB CCOC(=O)c1cc(-c2ccc(/C=C(/C#N)C(N)=O)o2)ccc1Cl 252488188 INBWFCZNSPHSOH-XFFZJAGNSA-N 344.754 3.169 50 40 EGGB Cc1cc2c(cc1/C=C(\C#N)C(=O)N[C@@H]1CCCC[C@@H]1C)OCO2 5006600 FFTNFDAMRYEIRM-HOKWPKGKSA-N 326.396 3.326 50 40 EGGB COc1ccc(OC)c([C@@H]2C(C#N)=C(N)OC(C(C)(C)C)=C2C#N)c1 547606 ZYLFNEDDQQSFPT-INIZCTEOSA-N 339.395 3.335 50 40 EGGB COc1cc(/C=N/NC(=O)c2cc3ccccc3cc2O)ccc1O 1497168 PQDFLIJQZDZDGA-RGVLZGJSSA-N 336.347 3.024 50 40 EGGB O=C(N/N=C/c1ccc(Br)s1)c1ccccc1F 5771573 CBRCAIPCGKGWOO-VIZOYTHASA-N 327.178 3.414 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)Cc2ccc(OC)cc2)cc1 585392 JWOBOHCCABVVRE-RCCKNPSSSA-N 339.439 3.234 50 40 EGGB O=C(N/N=C/c1ccc([N+](=O)[O-])s1)c1cc(Cl)nc(Cl)c1 162883 VQZRDOSQAZNPPO-LHHJGKSTSA-N 345.167 3.122 50 40 EGGB CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=C\c1ccc2c(c1)OCO2 100215945 DKJMVTYSIBVRQS-ACAGNQJTSA-N 342.358 3.424 50 40 EGGB COc1cc(C=C(C#N)C#N)ccc1OCC(=O)Nc1ccccc1C 267142 FPMQLIRFNOVYLG-UHFFFAOYSA-N 347.374 3.452 50 40 EGGB CCOc1cc([C@@H]2C(C#N)=C(N)OC(C(C)(C)C)=C2C#N)ccc1O 1004513 ALFQUVGWFGCQBU-INIZCTEOSA-N 339.395 3.422 50 40 EGGB CC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(N)=C(C#N)C#N)o2)cc1 100632902 BKWJGLVLXJTUSD-OVCLIPMQSA-N 328.331 3.316 50 40 EGGB Cn1c(SCC(=O)N/N=C/C=C\c2ccco2)nc2ccccc21 12428129 IHJRLNBTPLXJDI-KZZJTBKTSA-N 340.408 3.074 50 40 EGGB Cc1ccc(C23C[C@@H]4C[C@H](CC(NC(=O)NN(C)C)(C4)C2)C3)cc1 100846199 HFELPSPVCLBGHH-MVYVIFSASA-N 327.472 3.361 50 40 EGGB Cc1cccc(NNC(=O)CSCC(=O)Nc2cccc(C)c2)c1 65522085 XCBDTICQZZKGIP-UHFFFAOYSA-N 343.452 3.118 50 40 EGGB Cc1cccc(C)c1N[C@@H](C)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 356664 PWCAJDKHFCNVCG-YRIIZNAFSA-N 340.383 3.162 50 40 EGGB Cn1cc(Cl)c(C(=O)N/N=C/c2ccc3c4c(cccc24)CC3)n1 369967 GEYQJEDTCQZFOG-AWQFTUOYSA-N 338.798 3.089 50 40 EGGB C/C(CC(=O)Nc1cccc(Cl)c1C)=N/NC(=O)c1ccncc1 17211500 VVHPEDACSPTYLO-NHDPSOOVSA-N 344.802 3.178 50 40 EGGB COc1cc(Cl)cc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)c1O 4525120 WHMQJZOHXZRDQE-WDZFZDKYSA-N 344.754 3.305 50 40 EGGB O=C(NNc1ccc(Cl)nn1)Nc1cccc(C(F)(F)F)c1 480292 HQEFQTZROVNUIH-UHFFFAOYSA-N 331.685 3.297 50 40 EGGB CCOc1ccc(C(=O)N/N=C/c2cc(Cl)c(O)c(OC)c2)cc1 20763844 SDWZLNIGFRWVDA-VXLYETTFSA-N 348.786 3.217 50 40 EGGB COc1cccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)c1OC 5130768 CYSBBLVCWACWGZ-IMUHQLSFSA-N 328.412 3.306 50 40 EGGB N#CC(C#N)=Cc1ccc(-c2cnc(N3CCOCC3)s2)s1 16430802 LDKWNDSFWRMVAX-UHFFFAOYSA-N 328.422 3.139 50 40 EGGB O=C(N/N=C\c1c(O)ccc2ccccc12)c1cccc([N+](=O)[O-])c1 12360338 IGTUDPHMTXCFBF-ODLFYWEKSA-N 335.319 3.218 50 40 EGGB CC(C)N(C(=O)OC(C)(C)C)[C@H]1CC[C@H](NC(=O)CCl)CC1 100177894 GWTYPJIOEIGPDY-BETUJISGSA-N 332.872 3.298 50 40 EGGB Cc1ccc(SCC(=O)N/N=C/c2cccc3c2OCCO3)cc1 54871798 OZTJIPVTUFMMMN-YBFXNURJSA-N 342.420 3.009 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@H](C)c2ccccc2)cc1OC 1450852 UKNIMRUVDVOUHD-SWEABUAFSA-N 336.391 3.488 50 40 EGGB CC1=C(C)[C@H](OCCCl)N(c2cc(O)c(Cl)cc2F)C1=O 2299466 LAWHMBRQYRNJHZ-AWEZNQCLSA-N 334.174 3.449 50 40 EGGB Cc1ccccc1C(=O)NNC(=O)c1c(-c2ccccc2)noc1C 14235737 LFAUAXLQJXAZIZ-UHFFFAOYSA-N 335.363 3.033 50 40 EGGB COc1cc(Cl)c(/C=C(\C#N)C(=O)NCc2ccco2)cc1OC 408735033 MOMFKJZIHCCJGI-WUXMJOGZSA-N 346.770 3.174 50 40 EGGB CCOc1ccc(/C=N\NC(=O)Cc2ccc(CC)cc2)cc1OC 409362493 GQNAYEHUJYDYEE-STZFKDTASA-N 340.423 3.349 50 40 EGGB O=C1c2ccccc2C(=O)c2c(NC(=O)C(Cl)Cl)cccc21 5379222 OHTFFWWFJHHVKL-UHFFFAOYSA-N 334.158 3.204 50 40 EGGB Cc1cc2c(c(=O)o1)[C@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 61412 MYSIOPAOBNTDFR-LBPRGKRZSA-N 349.173 3.473 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)cc1[N+](=O)[O-] 23382599 QBWNWEOAPIWZBX-BZOBAROVSA-N 343.383 3.205 50 40 EGGB CC(C)c1cccc(C(C)C)c1NC(=S)NNC(=O)[C@@H]1CCCO1 44077029 KPBKSKDDDALTGX-HNNXBMFYSA-N 349.500 3.430 50 40 EGGB C=CCOC(=O)C1=C(C)N2CCSC2=C(C#N)[C@H]1c1ccco1 3342397 SHZATTGRCNSHFK-HNNXBMFYSA-N 328.393 3.164 50 40 EGGB O=C(NNC1=C(C(=O)C(F)(F)F)CCC1)c1ccc(Cl)cc1 4834156 KWYQMJJMKCEKEE-UHFFFAOYSA-N 332.709 3.144 50 40 EGGB CCOc1cc(/C=N/NC(=O)c2ccc(OC)cc2)cc(Cl)c1O 5711711 MWVNTKQAULQANP-VXLYETTFSA-N 348.786 3.217 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/C=C/c2ccccc2[N+](=O)[O-])c(F)c1 15224845 IZQMDNZVELXWMK-DZDNCDRKSA-N 338.298 3.035 50 40 EGGB CC(=O)NNc1nc(C)c(C(=O)/C=C/C=C/c2ccccc2)s1 1630972 TTZULNFOELAVHR-JMQWPVDRSA-N 327.409 3.367 50 40 EGGB CCOC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1cccs1 141812 NXCORYAOLLSZLY-ZRDIBKRKSA-N 326.377 3.470 50 40 EGGB N#C/C(=C\c1ccc(C#N)cc1)C(=O)NCCc1c[nH]c2ccccc12 566627 MKHSVZOZFWRXBA-WOJGMQOQSA-N 340.386 3.305 50 40 EGGB Cc1[nH]c2ccccc2c1/C=N\NC(=O)Cc1ccccc1[N+](=O)[O-] 108984862 YQJZICAITNYJMJ-ODLFYWEKSA-N 336.351 3.077 50 40 EGGB CCn1c(C)c(/C=N/NC(=O)CNC2CCCCC2)c2ccccc21 409382026 JZBFKTPNQAWABC-LPYMAVHISA-N 340.471 3.342 50 40 EGGB O=C(COc1ccc(F)cc1)N/N=C/c1ccc2ccccc2c1O 409358020 JSPVCLRQKNGIED-SRZZPIQSSA-N 338.338 3.214 50 40 EGGB COC(=O)c1ccc(C(Br)Br)c(F)c1 100165757 JCECBVKCKBNRSS-UHFFFAOYSA-N 325.959 3.401 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/c2cn(C)c3ccccc23)c(C)c1 3101560 JAFBLSGLGNROMT-SRZZPIQSSA-N 335.407 3.324 50 40 EGGB C/C(=N\NC(=O)c1ccccc1Cl)c1ccc2c(c1)OCCO2 5222756 FPOHZVAUVZIBKP-YBFXNURJSA-N 330.771 3.265 50 40 EGGB O=[N+]([O-])c1ccc([S@](=O)[C@@H]2CCCC[C@@H]2Cl)c([N+](=O)[O-])c1 5215355 OMSWTTLZLNVEJO-VUVYZSTRSA-N 332.765 3.161 50 40 EGGB O=C(Cn1cnc2ccccc21)N/N=C/C(Cl)=C/c1ccccc1 12375739 VHOMESNBCOQKNK-AWTHELJJSA-N 338.798 3.418 50 40 EGGB CN(C)C(=O)/C(C#N)=C\c1ccccc1OCc1ccccc1C#N 59334919 BHWKRUXWEXFTQD-WQRHYEAKSA-N 331.375 3.132 50 40 EGGB N#C[C@@H](C(=O)N/N=C/c1ccc(Br)cc1)c1ccccc1 409193437 CNJNNAZUVWEYMN-SKCQWOFPSA-N 342.196 3.207 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C/c2c(OC)cccc2OC)cc1 121790117 SOYPDAFOYIYWPE-ACCUITESSA-N 338.363 3.258 50 40 EGGB C=CCn1c(C)c(/C=N/NC(=O)[C@@H](O)c2ccccc2)c2ccccc21 561535 XIPOLFAFJJKADI-ISXGRJCASA-N 347.418 3.319 50 40 EGGB CC(C)Oc1ccc(C(=O)NNC(=O)C(F)(F)c2ccccc2)cc1 40115813 ALOROOGYHWECKA-UHFFFAOYSA-N 348.349 3.027 50 40 EGGB N#C/C(=C\c1ccc(Cl)c(Cl)c1)C(=O)NC[C@H]1CCCO1 289100 FKVZAUAAVXPLFO-IGEMTJHASA-N 325.195 3.196 50 40 EGGB O=C(N/N=C/c1ccccc1[N+](=O)[O-])c1ccccc1Br 1458002 UVVKZDPASNTWPO-CXUHLZMHSA-N 348.156 3.121 50 40 EGGB CCOc1ccccc1OCC(=O)N/N=C/c1ccc(SC)cc1 3266731 UVAMQLSEPYEVPD-XDHOZWIPSA-N 344.436 3.336 50 40 EGGB C/C(=N/NC(=O)c1ccco1)c1cccc(NC(=O)C(C)(C)C)c1 5620748 GWRWZNRPEIQQLU-NDENLUEZSA-N 327.384 3.418 50 40 EGGB Cc1cccc(C(=O)NNC(=O)CCSc2ccc(F)cc2)c1 12680687 NZJIIPHOSPYZDJ-UHFFFAOYSA-N 332.400 3.078 50 40 EGGB CC(=O)c1c(NNC(=O)c2ccc(C(C)(C)C)cc2)oc(C)cc1=O 4604679 ZVJNQUFIISZDSQ-UHFFFAOYSA-N 342.395 3.205 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2C)cc1[N+](=O)[O-] 106586529 VJHNDLATOJRSJW-ZROIWOOFSA-N 337.335 3.458 50 40 EGGB N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc2c(c1)OCO2 409361674 HTTQTJFUWVRAPR-KGVSQERTSA-N 338.275 3.116 50 40 EGGB O=C(N/N=C\c1cc(Br)ccc1O)Nc1ccccc1 73398867 DOAJNHUFWUGQRR-SXGWCWSVSA-N 334.173 3.310 50 40 EGGB O=C(O)CCCCCOCCOCCOCCCCCCCl 1592055954 SAHRDVGWXQSDAN-UHFFFAOYSA-N 338.872 3.480 50 40 EGGB CCOC(=O)c1c(C)[nH]c(C(=O)N/N=C\c2ccccc2Cl)c1C 6327397 BSQOSDQKTYDDFH-OCKHKDLRSA-N 347.802 3.226 50 40 EGGB Cc1cccc(/C=N/NC(=O)CNc2cccc3ccccc23)c1O 59049 QBHGKGOSPYINJS-WSDLNYQXSA-N 333.391 3.416 50 40 EGGB CC(=O)NNC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1 180446 YNPFIPPTVWPBNO-UHFFFAOYSA-N 334.460 3.087 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)c2cccc3c2OCCO3)cc1F 179706174 INNDIQWFRQFTIV-UKTHLTGXSA-N 339.322 3.395 50 40 EGGB COc1cc(I)c(CBr)cc1F 98210764 ZLCKFXDAYOTVRQ-UHFFFAOYSA-N 344.949 3.334 50 40 EGGB O=C(CSCc1ccc(Cl)cc1)N/N=C/c1ccccc1O 3079715 UZVWFHPAOUDOAV-GIJQJNRQSA-N 334.828 3.429 50 40 EGGB COc1ccc(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)cc1 260826 UBDHFQFZVLYFQL-UHFFFAOYSA-N 326.396 3.068 50 40 EGGB CCOc1ccc(/C=N/NC(=O)COc2ccc(C)c(C)c2)cc1 345605 IKQYFLQBUPAMML-UDWIEESQSA-N 326.396 3.231 50 40 EGGB COc1ccc(Br)cc1C(=O)N/N=C/c1cccs1 235172 HULMXZMOKQHRFP-OVCLIPMQSA-N 339.214 3.283 50 40 EGGB N#Cc1ccc(OCC(=O)N/N=C/c2ccccc2C(F)(F)F)cc1 3308677 IZFUOQJEJSUIHA-LSHDLFTRSA-N 347.296 3.106 50 40 EGGB Cc1ccc(CC(=O)N/N=C/c2ccc(OC(C)C)cc2O)cc1C 408591302 SSPWVMVVKMLFML-CIAFOILYSA-N 340.423 3.489 50 40 EGGB N#C/C(=C/c1ccc(C(=O)O)cc1)C(=O)NCCCc1ccccc1 409247123 BZLBBBGSZVUDCF-AQTBWJFISA-N 334.375 3.041 50 40 EGGB COc1cc(OC)cc(C(=O)N/N=C\c2ccc(SC)cc2)c1 33903367 PBSKGHKZMIBBNX-WQRHYEAKSA-N 330.409 3.190 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)c2ccc(C)cc2)cc1[N+](=O)[O-] 409322284 ITIFALJUFWOSNR-LDADJPATSA-N 327.340 3.066 50 40 EGGB FC(F)(F)C1(C(F)(F)F)N[C@H]2[C@@H](Cl)[C@H]1C[C@H]2Br 100121923 CQNJIVNXDXPYJU-SQOUGZDYSA-N 346.496 3.212 50 40 EGGB O=C(CSc1nc2ccccc2[nH]1)N/N=C/c1ccc(Cl)cc1 186354 OITORHOTAGBXIN-GIJQJNRQSA-N 344.827 3.459 50 40 EGGB Cc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2ccncc2)cc1 481928 GYFKSPFETMFMKC-GOSISDBHSA-N 343.390 3.102 50 40 EGGB CC(C)(C)C1CCC(=NNC(=O)C(=O)NCc2ccccc2)CC1 59435584 YIURVYNNJFAJBK-UHFFFAOYSA-N 329.444 3.011 50 40 EGGB Cc1ccc(/C=N/NC(=O)CNc2ccc(Br)cc2)cc1 59514216 RUBCGEIANQVZGK-VXLYETTFSA-N 346.228 3.320 50 40 EGGB CC1(C)CC(=O)C/C(=N\NC(=O)c2cccc(Br)c2)C1 100448668 PSXZIOZZIZEXOJ-SFQUDFHCSA-N 337.217 3.314 50 40 EGGB CCCCNC(=O)/C(C#N)=C/c1ccc(Br)cc1F 13135421 XYBNWMSNKYXVLJ-YRNVUSSQSA-N 325.181 3.411 50 40 EGGB CC(C)(C)c1ccc(O)c(/C=N/NC(=O)c2ccc3c(c2)OCO3)c1 6159362 JIUASYYPRSWCEJ-KEBDBYFISA-N 340.379 3.182 50 40 EGGB CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc(OC)c(O)c2)cc1 4722827 CNFWXDASUHJIDQ-UVTDQMKNSA-N 338.363 3.345 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 5942691 BPQWSIXFXHTMKK-LDADJPATSA-N 327.340 3.066 50 40 EGGB COc1cc(Cl)c(/C=N\NC(=O)CCc2ccccc2)cc1OC 209956367 FYGQYDOKNUAKBG-NDENLUEZSA-N 346.814 3.440 50 40 EGGB Cc1ccc(NC(=O)NNC(=O)c2sccc2-n2cccc2)cc1 1394318 SQUNYHWOVHZADC-UHFFFAOYSA-N 340.408 3.314 50 40 EGGB CCCCSCC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2 48331760 RVRQUGDJCYUVLJ-UHFFFAOYSA-N 338.517 3.274 50 40 EGGB NC(=O)NN(C(=O)CC12CC3CC(CC(C3)C1)C2)c1ccccc1 4387869 BNNIBXZZDRFYEA-UHFFFAOYSA-N 327.428 3.209 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)Cc2cc(C)ccc2C)cc1OC 409364984 PNFTYSNGADARTF-RCCKNPSSSA-N 340.423 3.404 50 40 EGGB C/C(CC(=O)NCc1ccc(Cl)cc1)=N\NC(=O)c1cccs1 101535504 MQRJCDMGHQTLSK-YBFXNURJSA-N 349.843 3.214 50 40 EGGB O=C1OCC[C@]1(Br)[C@H](Br)c1ccccc1 1602843 ROIKPDSNGKFMLY-KOLCDFICSA-N 334.007 3.203 50 40 EGGB O=C(CBr)Nc1ccc(C(=O)NC2CCCCC2)cc1 35605487 NAKLKQNDAKDOFH-UHFFFAOYSA-N 339.233 3.083 50 40 EGGB COc1ccc(OCC(=O)N/N=C/c2ccc(OC(C)C)cc2)cc1 43920946 VNWPGHKPVUYOQH-UDWIEESQSA-N 342.395 3.012 50 40 EGGB Cc1ccc(C)n1-c1ccc(C(=O)NNC(=S)NC(C)(C)C)cc1 14895242 DZLJOGUPRWSAHB-UHFFFAOYSA-N 344.484 3.002 50 40 EGGB O=C(CCC(=O)Nc1ccc(F)cc1)N/N=C/c1ccccc1Cl 1949177 WLYMVPIDGLRIRF-RGVLZGJSSA-N 347.777 3.348 50 40 EGGB CN(NC(=O)c1nn(-c2ccccc2)c2c1CCC2)c1ccccc1 12926829 BISHUQVSNUMLKA-UHFFFAOYSA-N 332.407 3.142 50 40 EGGB O=C(N/N=C/c1ccccc1F)c1cc2cc([N+](=O)[O-])ccc2o1 4743220 LAKSUMQQKSYPKW-GIJQJNRQSA-N 327.271 3.244 50 40 EGGB C=CCc1cc(/C=C(\C#N)C(=O)N[C@H](C)CC)cc(OCC)c1O 408811547 KKLGWMRJVSAIOP-BVTUPMQUSA-N 328.412 3.341 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)c(C)c1 7384458 BIFFUBIAUJASCF-KGENOOAVSA-N 337.423 3.368 50 40 EGGB CCOC(=O)[C@@H](Br)C(=O)c1ccc(C(F)(F)F)cc1 100032843 RRUJHLRWOPOKCV-VIFPVBQESA-N 339.107 3.215 50 40 EGGB COc1cc(/C=C(/C#N)c2nc3ccccc3[nH]2)c([N+](=O)[O-])cc1O 50567671 SUGMGRKCYZNAKF-WDZFZDKYSA-N 336.307 3.249 50 40 EGGB C[C@@H]1CCCC[C@@H]1NC(=O)/C(C#N)=C\c1ccc2c(c1)OCCO2 6201259 XVXURAGENAPLOT-HLVFHREBSA-N 326.396 3.060 50 40 EGGB C[C@@H](Oc1ccc(/C=C(/C#N)c2nc3ccccc3[nH]2)cc1)C(=O)O 4740730 UJTQLOVNAOXUFE-XTCQQWIJSA-N 333.347 3.479 50 40 EGGB CC(C)(C)OC(=O)NN=C(c1ccc(O)cc1)c1ccc(O)cc1 15952095 WLFDRLRTPBXDJK-UHFFFAOYSA-N 328.368 3.375 50 40 EGGB NNC(=O)c1ccc2nc(-c3ccc(Br)cc3)sc2c1 73635166 DNRVGSYMUKDBRV-UHFFFAOYSA-N 348.225 3.329 50 40 EGGB CN(C)c1ccc(/C=C(/C#N)C(=O)NCCc2c[nH]c3ccccc23)o1 33344358 FNOHXHXVVIDOJS-PTNGSMBKSA-N 348.406 3.093 50 40 EGGB CCOc1cccc(/C=C(/C#N)C(=O)Nc2cccc(OC)c2)c1O 223170535 ORISUNRELGTYGE-UVTDQMKNSA-N 338.363 3.345 50 40 EGGB C/C(=N\NC(=O)Cn1cnc2ccccc21)[C@H]1C[C@H]1c1ccccc1 585145953 HWZFXZGORJWZLJ-FOVGRPJISA-N 332.407 3.332 50 40 EGGB Cc1ccc(/C=N/NC(=O)COc2ccccc2Cl)cc1[N+](=O)[O-] 8112170 IFAHXPIILASLLD-GIJQJNRQSA-N 347.758 3.086 50 40 EGGB O=C(NCCCl)N1CCn2cccc2[C@H]1c1ccc(Cl)cc1 5256108 SZCONDAYPGDAOK-OAHLLOKOSA-N 338.238 3.495 50 40 EGGB COc1cc(OC)c(OC)cc1/C=N/NC(=O)c1ccccc1Cl 342544 ITIUNGGTRYIITI-VXLYETTFSA-N 348.786 3.130 50 40 EGGB N#C/C(=C\c1ccccc1OCC(=O)N1CCCC1)c1ccccn1 32751882 WLVAITXIYQGVKA-GHRIWEEISA-N 333.391 3.147 50 40 EGGB COc1ccccc1[C@H]1[C@H]2CCCC=C2C(C#N)=C(N)C1(C#N)C#N 19818270 LPLWQZMMDQWUPY-KBXCAEBGSA-N 330.391 3.289 50 40 EGGB COc1cccc(CC(=O)N/N=C/c2c(C)n(C)c3ccccc23)c1 59248340 LUPMDPCVUSOJHM-FYJGNVAPSA-N 335.407 3.188 50 40 EGGB O=C(COc1ccc2ccccc2c1)N/N=C/c1ccccc1C(=O)O 6890716 UOMIAFBBQZPEJR-CIAFOILYSA-N 348.358 3.067 50 40 EGGB CCCCN1C(=O)/C(=C(\C#N)C(=O)Nc2cccnc2)c2ccccc21 409390787 VTXDIOURAUJRSN-FBMGVBCBSA-N 346.390 3.144 50 40 EGGB FC(F)(F)C1(C(F)(F)F)N[C@H]2[C@@H](Br)[C@@H]1C[C@H]2Cl 4381091 JSDWVKURFFDIKI-SKNVOMKLSA-N 346.496 3.212 50 40 EGGB COC(=O)c1ccc(/C=N\NC(=O)c2ccccc2-n2cccc2)cc1 33291246 ZZEIQFQPDUUVNH-STZFKDTASA-N 347.374 3.028 50 40 EGGB Cc1ccc(S(=O)(=O)/N=C2\Nc3ccccc3C2=C(C#N)C#N)cc1 4673442 AAQOXZVZSZASKU-UHFFFAOYSA-N 348.387 3.009 50 40 EGGB Cc1cc(C)cc(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)c1 7440549 ZVHYTUUUNYCPFR-UHFFFAOYSA-N 347.374 3.302 50 40 EGGB CCOC(=O)N/N=C\c1ccccc1Oc1ccccc1[N+](=O)[O-] 68682459 HBKATTQEXVKNPH-BOPFTXTBSA-N 329.312 3.467 50 40 EGGB CN(C)c1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1ccc(Cl)cc1 408995356 BQTRWTOJAWXYEH-VCHYOVAHSA-N 346.774 3.078 50 40 EGGB C/C(=N\NC(=O)CNc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 409360333 DVJQBADXWINAIN-YBFXNURJSA-N 346.774 3.201 50 40 EGGB NNC(=O)c1cc(Cl)c(-c2cc3ccccc3oc2=O)c(Cl)c1 216935713 SDTIIXPIQFTYCU-UHFFFAOYSA-N 349.173 3.370 50 40 EGGB CC(C)(C)OC(=O)N[C@@]12CC[C@@](C)(C(=O)[C@H]1Br)C2(C)C 256049488 ADRKMYVTOLYUQX-NKZPBKNFSA-N 346.265 3.422 50 40 EGGB C[C@@H](NC(=O)/C(C#N)=C\c1cc(O)ccc1[N+](=O)[O-])c1ccccc1 98056362 DMCKESBFYYRPIS-CDCQXCROSA-N 337.335 3.085 50 40 EGGB C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1I 95635352 NTYHXNBIVRLYHG-BDAKNGLRSA-N 325.190 3.067 50 40 EGGB in-vitro COc1cccc(/C=N/NC(=O)CNc2ccc3ccccc3c2)c1O 131581 PMKXGUFITGBMHI-WSDLNYQXSA-N 349.390 3.116 50 40 EGGB Cn1cc(/C=C(\C#N)C(=O)NCCc2ccccc2)c2ccccc21 44889952 WOHROYQJBSFWRI-GHRIWEEISA-N 329.403 3.444 50 40 EGGB N#C/C(=C\c1ccc(O)c([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1 35238036 QJRYQBRQRGAIJB-YRNVUSSQSA-N 343.726 3.499 50 40 EGGB COc1cc(/C=C(/C#N)c2nc(C)cs2)c([N+](=O)[O-])cc1OC 57584260 KJZHDZZAECPUDQ-WCIBSUBMSA-N 331.353 3.441 50 40 EGGB CCC/C(=N\NC(=O)COc1ccc([N+](=O)[O-])cc1)c1ccccc1 4543513 QAKMOPOIVUGRQM-HTXNQAPBSA-N 341.367 3.294 50 40 EGGB CCC[C@@H](Br)C(=O)NCCC(=O)Nc1cccc(C)c1 8733108 REVQSQPUAKEZMY-CYBMUJFWSA-N 341.249 3.003 50 40 EGGB O=C(CBr)Nc1cccc(NC(=O)Cc2ccccc2)c1 35605382 ZBMCDPLWNYWGJQ-UHFFFAOYSA-N 347.212 3.201 50 40 EGGB O=C(CCl)N(Cc1cc(=O)[nH]c2ccccc12)c1ccccc1 9159904 NBVKEAHIQUXHNT-UHFFFAOYSA-N 326.783 3.300 50 40 EGGB O=C(NNC(=O)C1(c2ccccc2)CCCC1)c1ccccc1F 14187885 NHIYFRWURRIJOJ-UHFFFAOYSA-N 326.371 3.099 50 40 EGGB COc1ccc(CNC(=O)/C(C#N)=C\c2cc(Cl)ccc2O)cc1 408813014 CTBVJJJNJSTSIF-ZSOIEALJSA-N 342.782 3.278 50 40 EGGB CC(C)/C(=N/NC(=O)CNc1ccc2c(c1)OCO2)c1ccccc1 408590470 OZAWJYOKORSKEC-QOCHGBHMSA-N 339.395 3.004 50 40 EGGB COc1cccc(/C=N/NC(=O)Cc2cccc(C(F)(F)F)c2)c1 408765507 XZHFFYFSEURKQB-SRZZPIQSSA-N 336.313 3.407 50 40 EGGB C[C@@H](Oc1ccc(Cl)cc1)C(=O)N/N=C\c1ccc(N(C)C)cc1 32511857 JGVQGLKOEHARFQ-UAAGNOOKSA-N 345.830 3.324 50 40 EGGB CCCCc1ccc(NC(=O)C(=O)N/N=C/c2ccc(C)o2)cc1 3085854 NPDRSBXRONUJDD-XDHOZWIPSA-N 327.384 3.019 50 40 EGGB CCOC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(O)cc2)cc1 1453579 AXOTZDCXWLUFON-RVDMUPIBSA-N 336.347 3.115 50 40 EGGB CCCCNC(=O)/C(C#N)=C/c1cnn(-c2ccc(Cl)cc2)c1 40139637 FKBCTIPGXUEXDU-NTEUORMPSA-N 328.803 3.349 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1cccc(Br)c1 83315164 ODCFVIIVOAVRAW-ZDLGFXPLSA-N 335.176 3.281 50 40 EGGB O=C/C(=C\Nc1cc([N+](=O)[O-])ccc1O)c1nc2ccccc2o1 3021225 BAPXPHYKEVWSBK-CSKARUKUSA-N 325.280 3.094 50 40 EGGB Cc1ccc(C)c(NC(=O)/C(C#N)=C/c2cc([N+](=O)[O-])ccc2O)c1 5681961 KIRHSAQQYNQKNO-RIYZIHGNSA-N 337.335 3.463 50 40 EGGB O=C(NCCCl)N1CCn2cccc2[C@@H]1c1ccc(Cl)cc1 5256110 SZCONDAYPGDAOK-HNNXBMFYSA-N 338.238 3.495 50 40 EGGB COC(=O)N/N=C/c1cn(-c2ccccc2)nc1-c1cccs1 6674881 HXXPEWAQVWPREW-LICLKQGHSA-N 326.381 3.291 50 40 EGGB N#CC(C#N)=Cc1cc(Br)c(O)c(Br)c1 1410801 TZWVYXKBAATBPU-UHFFFAOYSA-N 327.963 3.348 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2Cl)c(O)c1 59503578 LUCHSAQQUZSGLV-QGMBQPNBSA-N 339.178 3.472 50 40 EGGB Cc1ccccc1C(=O)N/N=C/c1ccc(OC2CSC2)cc1 408831366 VIHKGBOHTFVQKZ-VXLYETTFSA-N 326.421 3.253 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1 5316759 OZVUHMCMSMRELF-LDADJPATSA-N 327.340 3.148 50 40 EGGB O=C(CCCc1nc2ccccc2s1)N/N=C/c1ccc(O)cc1 26770204 BSVLYPQUVUKUAR-XDHOZWIPSA-N 339.420 3.475 50 40 EGGB C/C(=N\NC(=O)c1cccnc1)c1cccc(NC(=O)C(C)(C)C)c1 17070999 GPKWHGFIPMGRSY-LPYMAVHISA-N 338.411 3.220 50 40 EGGB CC(C)(C)OC(=O)N1CCc2sc(CBr)nc2C1 1772715221 ADFWMXQMPKSZQC-UHFFFAOYSA-N 333.251 3.331 50 40 EGGB CCOc1cc(/C=N/NC(N)=O)cc(Cl)c1OCc1ccccc1 13747360 YQXOTUZCYAZSDW-KEBDBYFISA-N 347.802 3.320 50 40 EGGB COc1ccc(C(=O)N/N=C/c2cc(Cl)cc(Cl)c2O)cc1 150590 FHLGDBVCGVOHHZ-QGMBQPNBSA-N 339.178 3.472 50 40 EGGB O=C(COc1ccc(-c2ccccc2)cc1)N/N=C\c1ccccn1 4838659 CSNLELGAHVQXFW-HMAPJEAMSA-N 331.375 3.278 50 40 EGGB N#C/C(=C\c1cccnc1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 408883534 TXVHCLIBGNJIBH-IZZDOVSWSA-N 328.715 3.189 50 40 EGGB CC(C)(C)OC(=O)N1CCC[C@]1(C)CI 85345203 VPDQMPZSLBLEDT-LLVKDONJSA-N 325.190 3.211 50 40 EGGB COc1ccc2c(c1)c(C(=O)N/N=C\c1cccs1)c(C)n2C 15997627 SDFCFNZDJVCIDD-ZDLGFXPLSA-N 327.409 3.321 50 40 EGGB O=C(COc1ccc(Cl)cc1Cl)N/N=C/c1cccc(O)c1 58845 GAFQLIXZXYJHLH-QGMBQPNBSA-N 339.178 3.228 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/C=C/c2ccccc2)c([N+](=O)[O-])c1 3080451 QNZIRJLQLVDPLX-CEGJKDKLSA-N 339.351 3.097 50 40 EGGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1cc(C)cc(C)c1 3352123 VZQVDRHJCHWYIT-UHFFFAOYSA-N 332.787 3.040 50 40 EGGB Cc1cccc(NCC(=O)N/N=C/C=C/c2cccc([N+](=O)[O-])c2)c1 4779754 SOCASEAVUDEUCZ-KCHOUBKZSA-N 338.367 3.131 50 40 EGGB CC1(C)CC(=O)C2=C(C1)[C@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 4728982 CNFAIMXMKSCBKK-HNNXBMFYSA-N 339.351 3.046 50 40 EGGB COc1cc(/C=C(\C#N)c2nnc3n2CCCCC3)cc(Cl)c1O 9532640 ZHSNOGUIGGWONJ-KPKJPENVSA-N 344.802 3.436 50 40 EGGB Cc1ccc(C(=O)O)cc1-c1ccc(/C=C(/C#N)C(=O)NC(C)C)o1 408785639 XLWXDRLENMOIQE-ZSOIEALJSA-N 338.363 3.385 50 40 EGGB Clc1cc(-c2nn3cnnc3s2)ccc1CBr 41126799 DXNJBCUEYODEIZ-UHFFFAOYSA-N 329.610 3.401 50 40 EGGB O=C(COc1cccc2ccccc12)N/N=C/c1ccc(C(=O)O)cc1 566735 PHENILCAVMKXDN-CIAFOILYSA-N 348.358 3.067 50 40 EGGB C/C(=N/NC(=O)c1cc(-c2ccc(C)s2)n[nH]1)c1ccccc1O 100927757 NZOZVBZTCOGKFI-WQRHYEAKSA-N 340.408 3.306 50 40 EGGB C/C(=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)s1 5620918 DSZHJRXMGXBSOI-CXUHLZMHSA-N 337.788 3.393 50 40 EGGB O=C(CCCC[C@@H]1CCSS1)NCCc1ccc(O)c(O)c1 9909322 LSCVFMCTEXGPFX-CYBMUJFWSA-N 341.498 3.471 50 40 EGGB COc1ccc(Cl)cc1/C=N\NC(=O)COc1ccc(C)cc1C 34378415 LFFIALPLYDVEED-JMIUGGIZSA-N 346.814 3.495 50 40 EGGB O=C(N/N=C/c1ccc(Cl)s1)c1cncc(Br)c1 34058 BCDLYJULVNDQQI-GIDUJCDVSA-N 344.621 3.323 50 40 EGGB CCCCC(=O)NNC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 4852658 XMDCISGNLZGTEL-VIFPVBQESA-N 333.215 3.098 50 40 EGGB Cn1cccc1/C=C(\C#N)C(=O)Nc1sc2c(c1C#N)CCCC2 408554625 SILBRVXEINODOL-FMIVXFBMSA-N 336.420 3.383 50 40 EGGB CCCOc1cccc(/C=N\NC(=O)c2ccc(OC)c(OC)c2)c1 409312433 KXZYNIZTEWYAGV-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)c2cccc(C)c2)cc1[N+](=O)[O-] 409269480 JUEHVQBZZNIPCJ-CPNJWEJPSA-N 341.367 3.456 50 40 EGGB C#CCOc1ccc(/C=C(\C#N)C(=O)c2cccc3c2OCCO3)cc1 92844307 AAAHQZGABNDMKK-DTQAZKPQSA-N 345.354 3.260 50 40 EGGB CSc1ccc(/C=N/NC(=O)c2ccc(NC(C)=O)cc2)cc1 493375 ZJWBRGNZSLKLID-WOJGMQOQSA-N 327.409 3.131 50 40 EGGB Cc1cccc(C(=O)N/N=C/c2cc(Br)ccc2O)c1 498268 NZOGAINRHNNGAD-RQZCQDPDSA-N 333.185 3.227 50 40 EGGB O=C(CCCNc1ccc(Cl)cc1)N/N=C/c1cccc(O)c1 5007180 NFIKIWKFCXPLIG-UDWIEESQSA-N 331.803 3.388 50 40 EGGB COc1ccc(Cl)cc1C/C=N/NC(=O)c1cccc(C)c1O 16923179 RMJMHKHCQKAPMI-DJKKODMXSA-N 332.787 3.321 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)CNc2ccccc2Cl)cc1 12362319 UYFLQEARKFTHTO-UDWIEESQSA-N 331.803 3.301 50 40 EGGB CC(C)Oc1ccc(C(=O)NNC(=O)c2cccc(Cl)c2)cc1 3324240 CKHDEWPDYHERQR-UHFFFAOYSA-N 332.787 3.202 50 40 EGGB N#C/C(=C\c1ccc(O)c(Cl)c1)C(=O)Nc1cccc([N+](=O)[O-])c1 408791243 VFGKMYAAYPYVBH-IZZDOVSWSA-N 343.726 3.499 50 40 EGGB Cc1ccsc1/C=C(\C#N)C(=O)Nc1ccc2c(c1)OCCO2 6279748 LSQCPIMVPMSCDO-XYOKQWHBSA-N 326.377 3.373 50 40 EGGB O=C(N/N=C/c1cccc(C(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1 4705065 OHGNJWZXONKLMW-DJKKODMXSA-N 337.257 3.378 50 40 EGGB O=C(N/N=C/c1ccc(-c2ccc(F)cc2F)o1)c1cccnc1 408974727 CONYJRSPMCMULF-UFFVCSGVSA-N 327.290 3.384 50 40 EGGB O=C(O)[C@H](Br)[C@@H](Br)c1ccc(F)cc1 526059821 OVVPLFMUTUDGCL-JGVFFNPUSA-N 325.959 3.110 50 40 EGGB CC1(C)COc2ccc(C(=O)N/N=C\c3cccs3)cc2OC1 225368576 WUUDAQRJEAVLIP-NVMNQCDNSA-N 330.409 3.309 50 40 EGGB O=C(N/N=C/c1ccc(F)cc1)C(O)(c1ccccc1)c1ccccc1 115084 VADWLNCBNXLJPY-HZHRSRAPSA-N 348.377 3.212 50 40 EGGB Br[C@@H]1CCC[C@H]2N=C(N/N=C/c3ccccc3)S[C@@H]12 5899383 XGUGXCYNVHMVAJ-FZASFJNCSA-N 338.274 3.398 50 40 EGGB N#CC(C#N)=C/C=C(/c1ccc(Br)cc1)N1CCOCC1 2385033 MUTITDCVJRHIID-SOFYXZRVSA-N 344.212 3.096 50 40 EGGB CCOc1ccc(/C=C/C(=O)c2sc(NNC(C)=O)nc2C)cc1 5841675 KOBBJKFGDSBSLD-JXMROGBWSA-N 345.424 3.209 50 40 EGGB N#C/C(=C/c1ccc(O)c(Br)c1)C(=O)NC1CCCC1 4523564 XJIWRJOSSPPENP-XFFZJAGNSA-N 335.201 3.120 50 40 EGGB COc1cccc(/C=N/NC(=O)CNc2cccc3ccccc23)c1 60545 DYQFXSJLTGJSPK-LPYMAVHISA-N 333.391 3.411 50 40 EGGB CCOC(=O)/C(C#N)=C/c1ccc(OC(=O)C=C(C)C)c(OCC)c1 145713 FWKFZXXZDAYXTE-XNTDXEJSSA-N 343.379 3.427 50 40 EGGB CCOc1ccc(N[C@@H](CC)C(=O)N/N=C/c2cccc(O)c2)cc1 2742949 QLDFLYPSPDNJQE-ACRNLXFHSA-N 341.411 3.132 50 40 EGGB Cc1cc(OCC(=O)N/N=C/c2cccc([N+](=O)[O-])c2)ccc1Cl 566232 NZNCYFDBZWAXFN-GIJQJNRQSA-N 347.758 3.086 50 40 EGGB Cc1ccsc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)c1ccccc1C2=O 102090855 MJJRQMGBRLKOJP-ZDUSSCGKSA-N 348.383 3.198 50 40 EGGB C/C(=N\NC(=O)CSc1nc(C)cc(C)n1)c1cc(C)sc1C 58651863 BESJQVVJPMODGK-XDHOZWIPSA-N 348.497 3.404 50 40 EGGB CCNc1ccc(C(=O)N/N=C(\C)c2ccc(C)cc2)cc1[N+](=O)[O-] 4868824 OBLVRPLRGWRYRC-DEDYPNTBSA-N 340.383 3.489 50 40 EGGB N#C/C(=C\c1ccc(Br)o1)C(=O)Nc1ccc(O)cc1 408791923 FJAYFIDAOFDEJV-VQHVLOKHSA-N 333.141 3.293 50 40 EGGB CC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(OC(C)C)cc2)cc1 582668 MJOSTLSCZYKBEQ-UDWIEESQSA-N 339.395 3.196 50 40 EGGB CCn1cc(/C=N/NC(=O)c2ccc(C#N)cc2F)c2ccccc21 378525 LADPSIJUZUVXJS-SSDVNMTOSA-N 334.354 3.436 50 40 EGGB CCCC1=C(C(=O)OCC)[C@@H](c2ccccc2C)C(C#N)=C(N)O1 2697928 RRFONGNRAYDCMB-INIZCTEOSA-N 326.396 3.420 50 40 EGGB CN1c2ccccc2N2C[C@@](C)(CI)S[C@H]12 103490991 IGTPWOWACKHSLZ-VXGBXAGGSA-N 346.237 3.167 50 40 EGGB C=CCOc1cccc(/C=N/NC(=O)[C@H](C)Sc2ccccn2)c1 18195110 ZKDOLNOLXQEUCQ-ZXOFLVKFSA-N 341.436 3.277 50 40 EGGB COc1ccc(NC(=O)N/N=C/c2ccc(N3CCCC3)cc2)cc1 4677041 PKYNSIDCHYZZLY-XSFVSMFZSA-N 338.411 3.451 50 40 EGGB O=C(Cc1ccsc1)NNC(=O)CC12CC3CC(CC(C3)C1)C2 5578973 NWKBSEYEPDDDOI-UHFFFAOYSA-N 332.469 3.045 50 40 EGGB CCOc1ccc(/C=N/NC(=O)Cc2cccs2)cc1OCC 409198298 BWKJNWAZPBXZNF-LDADJPATSA-N 332.425 3.238 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@H](c2ccc3c(c2)OCO3)[C@@H]2CCCC=C12 35185231 LMOAEQHNEPYZAY-RDTXWAMCSA-N 344.374 3.009 50 40 EGGB NNC(=O)c1ccc(CCc2ccccc2)n1Cc1ccc(F)cc1 226029004 VDOUQSJVJJBOQH-UHFFFAOYSA-N 337.398 3.064 50 40 EGGB Cc1nn(C(C)C)cc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253406429 ULYRZAIEJGEKQE-MRXNPFEDSA-N 340.427 3.223 50 40 EGGB COc1ccc(Cl)cc1C(=O)NNC(=O)c1ccc(Cl)cc1 568797 PWAVKLROVNWOEY-UHFFFAOYSA-N 339.178 3.077 50 40 EGGB O=C(N/N=C/c1cccn1-c1ccc([N+](=O)[O-])cc1)c1ccccc1 484709 RCHPRTQTOMONJU-CPNJWEJPSA-N 334.335 3.149 50 40 EGGB CC1(C)Cc2c(ccc3ccccc23)C(NNC(=O)c2cccnc2)=N1 4655944 AFMIFJDVDVYEMN-UHFFFAOYSA-N 344.418 3.251 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)CCc2ccccc2)cc1[N+](=O)[O-] 408950049 GHLZKMINVPKAPW-CPNJWEJPSA-N 341.367 3.076 50 40 EGGB O=[N+]([O-])c1cc(CBr)ccc1I 15020895 JEGKXDOEPNYRPZ-UHFFFAOYSA-N 341.930 3.094 50 40 EGGB C=CCn1cc(/C=N/NC(=O)COc2ccccc2)c2ccccc21 408526402 BVOCXLGOJSENCR-FYJGNVAPSA-N 333.391 3.356 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1cccn1-c1ccccc1F 409246944 LMSTXMYCXPIMCG-XKZIYDEJSA-N 339.345 3.448 50 40 EGGB N#Cc1ccccc1-c1ccc(/C=N/NC(=O)[C@H](O)c2ccccc2)o1 14134673 BHFCRCGBQXPSSS-PPRFWAEMSA-N 345.358 3.002 50 40 EGGB CCC(=O)NNC(=O)CSc1nc2c(C)cc(C)cc2cc1CC 4849510 LINBNLWFAUQBKY-UHFFFAOYSA-N 345.468 3.064 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C)c2)cc1[N+](=O)[O-] 106586539 JVMUGRDABYOWRI-ZROIWOOFSA-N 337.335 3.458 50 40 EGGB Cc1nc(C)c(C(=O)NNc2nc(-c3ccc(Cl)cc3)no2)s1 69780362 WNMHKNXJBWTKPE-UHFFFAOYSA-N 349.803 3.220 50 40 EGGB CC(C)C(=O)Nc1ccc(C(=O)N/N=C/[C@H]2C[C@H]3C=C[C@H]2C3)cc1 101640812 WRZUEYJMJKCXGJ-CYAGJJHMSA-N 325.412 3.209 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc(Cl)cc2)c(O)c1 36316675 GIINUURSKREKGB-YBFXNURJSA-N 332.787 3.137 50 40 EGGB NNC(=O)c1ccc(Oc2ncc(C(F)(F)F)cc2Cl)cc1 2562138 YDSXQGMQSCWBLE-UHFFFAOYSA-N 331.681 3.150 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@H]1c1ccc(F)cc1 6681847 WLMMSPQFGSWFGJ-HNNXBMFYSA-N 332.338 3.434 50 40 EGGB O=C(Cn1c(C(F)(F)F)nc2ccccc21)N/N=C1/C[C@H]2C=CC[C@H]12 22287024 JRAAYNSTYLQGLF-KTWBLQKKSA-N 348.328 3.123 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)COc2c(C)cccc2C)cc1 408916353 WOEXZTADJBAFQY-FYJGNVAPSA-N 338.407 3.397 50 40 EGGB C#CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(OC)cc2)cc1 65999333 LSBPQNHLMVTOOB-SSZFMOIBSA-N 332.359 3.253 50 40 EGGB C#CCOc1ccc(/C=N\NC(=O)c2cc3ccccc3o2)cc1OC 34854770 NPZAQXCDJUYMJI-BKUYFWCQSA-N 348.358 3.217 50 40 EGGB O=C(CNc1ccc(Cl)cc1)N/N=C/c1c[nH]c2ccccc12 60529 ICKRLTPJGCEWNO-UFFVCSGVSA-N 326.787 3.384 50 40 EGGB CC(C)(C)C(=O)NNC(=O)[C@H]1CC1(c1ccccc1)c1ccccc1 501453 GOJQZMGZIHGDMV-QGZVFWFLSA-N 336.435 3.186 50 40 EGGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@H]2CC=CCC2)c1 24768299 VJUQHTZMLWPUDU-HNNXBMFYSA-N 330.428 3.001 50 40 EGGB CCOC(=O)/C(C#N)=C/c1cc(Br)c(Br)o1 23410773 JUAYWWPCMORHLA-ZZXKWVIFSA-N 348.978 3.275 50 40 EGGB O=C1COc2c(cc(OCc3ccccc3)cc2C(=O)CCl)N1 114091575 MNBYEYMYIRMHCK-UHFFFAOYSA-N 331.755 3.018 50 40 EGGB O=C(Cc1ccccc1)N/N=C/c1ccc(-c2ccc(C(=O)O)cc2)o1 14605379 NRMDZHQMRFWJOE-FYJGNVAPSA-N 348.358 3.338 50 40 EGGB Cc1ccc(CC(=O)N/N=C\c2cc([N+](=O)[O-])ccc2Cl)cc1 409362330 JAHMLFZCUDEHSB-ZDLGFXPLSA-N 331.759 3.249 50 40 EGGB CC(=O)Oc1ccc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccc2)cc1 408813680 QYIYIMFRTYHBDY-QCUKBLKESA-N 334.375 3.396 50 40 EGGB N#C/C(=C/c1ccccc1OCc1ccc([N+](=O)[O-])cc1)C(N)=S 408543868 SCVXIJOKOWBSCH-ZROIWOOFSA-N 339.376 3.367 50 40 EGGB CC1(CI)CCN(C(=O)OC(C)(C)C)CC1 85345254 UEKQYDXHXMIFHQ-UHFFFAOYSA-N 339.217 3.459 50 40 EGGB C#CCn1cc(/C=N/NC(=O)c2cccc(OC)c2)c2ccccc21 561479 YPMRWNDSTTYENH-FYJGNVAPSA-N 331.375 3.047 50 40 EGGB COC(=O)c1cccc(NC(=O)/C(C#N)=C/c2ccc(OC)cc2)c1 140255 FCRUSFDVHPMHLX-XNTDXEJSSA-N 336.347 3.027 50 40 EGGB O=C(CCc1ccccc1)NN=C1CCN(Cc2ccccc2)CC1 59406477 IKVZYCAMLLSUCM-UHFFFAOYSA-N 335.451 3.387 50 40 EGGB COc1cccc(/C=N/NC(=O)Cc2ccc(Br)cc2)c1 4735294 ABXZZQAPLJQDJM-WOJGMQOQSA-N 347.212 3.151 50 40 EGGB N#C/C(=C\c1cc([N+](=O)[O-])c(Cl)cc1Cl)C(=O)N1CCCC1 409369081 AXESDHGGJGQIIS-BJMVGYQFSA-N 340.166 3.431 50 40 EGGB COC1(C(=O)Nc2ccc(OCCBr)cc2)CCCC1 225625690 PPIHYWVFMZEYRW-UHFFFAOYSA-N 342.233 3.358 50 40 EGGB I[C@@H]1CC[C@@H]2CCN(Cc3ccccc3)[C@H]12 953065070 JHPRIOWQXAZKHT-MCIONIFRSA-N 327.209 3.475 50 40 EGGB Cc1ccccc1COc1c(Cl)cc(C(=O)NN)cc1Cl 226322113 BGCFXLVUEUDZTM-UHFFFAOYSA-N 325.195 3.484 50 40 EGGB Cc1ccccc1/C=N/NC(=O)CNc1ccc(Br)cc1 59514215 XQSSTYJRCOSZDL-VXLYETTFSA-N 346.228 3.320 50 40 EGGB CC(=O)c1ccc(C(=O)NNC(=O)c2oc3ccccc3c2C)s1 21900684 CAVOOLPGSADYCY-UHFFFAOYSA-N 342.376 3.080 50 40 EGGB O=C(Cc1ccc2c(c1)OCCO2)N/N=C/c1cccc2ccccc12 409359837 CCXDFPILDLEKEV-HYARGMPZSA-N 346.386 3.304 50 40 EGGB Cc1c(C(=O)N/N=C/C=C/c2ccccc2)sc2ncnc(N)c12 408973720 QACZIGKJKMAKBG-HWVLTCDVSA-N 337.408 3.011 50 40 EGGB O=C(N/N=C\c1cccn1-c1ccc(C(=O)O)cc1)Nc1ccccc1 33618318 NWWHFQLMKLRROX-MOSHPQCFSA-N 348.362 3.331 50 40 EGGB C/C(=N\NC(=O)Cc1ccc2c(c1)OCCO2)c1cc(C)ccc1C 409359206 ACMAPZYJSPXLAW-RCCKNPSSSA-N 338.407 3.158 50 40 EGGB N#Cc1ccc(-c2ccc(/C=N/NC(=O)c3ccc(O)cc3)o2)cc1 1104681 NOLAQRGVQMFRQO-CIAFOILYSA-N 331.331 3.288 50 40 EGGB O=C(NNC(=O)c1cc(F)c(F)cc1Cl)c1ccc(Cl)cc1 23074183 KZNICZOBXKVDOD-UHFFFAOYSA-N 345.132 3.346 50 40 EGGB CCCCc1[nH]nc2c1[C@@H](c1c[nH]c3ccccc13)C(C#N)=C(N)O2 5044855 OGPKALODHISOMU-MRXNPFEDSA-N 333.395 3.452 50 40 EGGB CCCOc1ccc(C(=O)N/N=C/c2ccccc2[N+](=O)[O-])cc1 20197491 PSGFZCAOMUBBEZ-LDADJPATSA-N 327.340 3.148 50 40 EGGB Cc1cc(/C=C(/C#N)C(N)=O)c(C)n1-c1ccccc1Br 408995943 CCKHCKBIXQCSIU-JYRVWZFOSA-N 344.212 3.249 50 40 EGGB Cc1ccc(C(=O)NNC(=O)N(C)Cc2ccc(Cl)cc2)cc1 9835578 VOMAWSVSNLVVHC-UHFFFAOYSA-N 331.803 3.135 50 40 EGGB CCOC(=O)C/C(C)=N/NC(=O)CSCc1ccc(Cl)cc1 408719108 DVSXQMDMIZIKNK-GZTJUZNOSA-N 342.848 3.019 50 40 EGGB COc1cc(OC)c(/C=N/NC(=O)c2ccccc2OC)cc1Cl 408591974 WVBLISBNBNMRIO-VXLYETTFSA-N 348.786 3.130 50 40 EGGB CN(C)C(=O)/C(C#N)=C\c1cccn1-c1cccc(C(F)(F)F)c1 408932922 FSNDMHVORCEGAO-XFXZXTDPSA-N 333.313 3.491 50 40 EGGB Cc1ccoc1C(=O)N/N=C/c1ccc2c(c1)OCC(C)(C)CO2 225370970 HVZRHVDGDIISAM-DJKKODMXSA-N 328.368 3.149 50 40 EGGB Cc1cc2c(cc1C)N(C(=O)CCCl)CCN2C(=O)CCCl 1724064 BLFWYZGKVLFLTE-UHFFFAOYSA-N 343.254 3.241 50 40 EGGB COc1ccc(OC)c2sc(NNC(=O)c3cccc(F)c3)nc12 251240 IELWVUVXZLEZHH-UHFFFAOYSA-N 347.371 3.210 50 40 EGGB CO[C@H](C(=O)N/N=C/c1ccc(OC(C)C)cc1)c1ccccc1 354326 AEFHGVFZGFJGNX-ACRNLXFHSA-N 326.396 3.312 50 40 EGGB CNC(=O)/C(C#N)=C/c1ccc(-c2cc(C(=O)OC)ccc2Cl)o1 408999276 ULQSZBYQXLLSCQ-YRNVUSSQSA-N 344.754 3.040 50 40 EGGB Nc1c(Cl)c(Cl)nc(C(=O)N/N=C2\C[C@@H]3C=CC[C@H]23)c1Cl 20885284 BMGDJAKJQRFAJL-SOYHWMAPSA-N 345.617 3.306 50 40 EGGB Cc1cccc(C(=O)N/N=C\c2ccc(O)c(Br)c2)c1 83327499 FBFDOYFVENKICE-MFOYZWKCSA-N 333.185 3.227 50 40 EGGB O=C(/C=C/c1ccccc1)NNC(=O)c1ccc(Cl)cc1Cl 45910 AVONGFNKGYRPLZ-RMKNXTFCSA-N 335.190 3.468 50 40 EGGB CC(C)Oc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2)cc1 568805 FZCZLAXALYWHEO-UHFFFAOYSA-N 332.787 3.202 50 40 EGGB COCc1n[nH]c2c1C1(CCC(C(C)(C)C)CC1)C(C#N)=C(N)O2 535233 WWXIPWIXJOJJBG-UHFFFAOYSA-N 330.432 3.116 50 40 EGGB C[C@@]12C(=O)[C@@H](C(c3ccccc3)=C1c1ccccc1)[C@H]1C(=O)OC(=O)[C@H]12 104121293 HRWFTDUSOZZENY-QCMGHPBJSA-N 344.366 3.132 50 40 EGGB CC(C)(C)c1ccc(C(=O)NNC(=S)NC2CCCCC2)cc1 6022971 GMSZKZIYZBGWBB-UHFFFAOYSA-N 333.501 3.426 50 40 EGGB CCc1ccc(NC(=O)Cc2nc(/C(C#N)=C(/C)N)cs2)cc1 24893461 NJXVBFYYCYSRKZ-KAMYIIQDSA-N 326.425 3.100 50 40 EGGB Cc1cccc(C(=O)N/N=C/c2cccc(OC3CSC3)c2)c1 567226 UFNGAKWXGQRYKA-VXLYETTFSA-N 326.421 3.253 50 40 EGGB CCOC(=O)[C@@]1(C#N)C(N)=C(C#N)C2=CCCC[C@H]2[C@H]1c1ccccc1 19855575 OLUGSZUWEAVXBJ-HGHGUNKESA-N 347.418 3.320 50 40 EGGB CCOc1cc(/C=N/NC(=O)Cc2ccc(Cl)cc2)ccc1OC 59419210 GJMVDWWASSMCEQ-UDWIEESQSA-N 346.814 3.440 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@H](c2ccc(Cl)cc2)[C@H]2SCC=C12 1260709 CMNLBGZMBLGANO-CABCVRRESA-N 338.823 3.249 50 40 EGGB O=C(Cl)[C@H]1CC(=O)N(c2ccc3oc(-c4cccnc4)nc3c2)C1 57327031 ADSQBILUMUTHHN-NSHDSACASA-N 341.754 3.008 50 40 EGGB O=C(CNc1ccc2c(c1)OCO2)N/N=C\c1cccc2ccccc12 83326516 GLLWFVOVQKYGKO-JJFYIABZSA-N 347.374 3.131 50 40 EGGB O=C(NNC(=S)NCCCc1ccccc1)c1ccccc1Cl 408585583 GMPYHVGZOOYZOP-UHFFFAOYSA-N 347.871 3.082 50 40 EGGB O=C(N/N=C/c1ccncc1)c1ccc(CNc2ccccc2)cc1 2763838 JGLZRWITGPRWIM-HZHRSRAPSA-N 330.391 3.458 50 40 EGGB COc1ccccc1NC(=O)C(=O)NN=C1CCC(C(C)(C)C)CC1 59435598 AAJCIMXTFKBJOT-UHFFFAOYSA-N 345.443 3.342 50 40 EGGB O=C(Cc1c[nH]c2ccccc12)NN=C1CCN(C2CCCC2)CC1 54871266 YBYIZBBZNQKPLP-UHFFFAOYSA-N 338.455 3.221 50 40 EGGB Cc1nc(-c2ccccc2)c(-c2nc3ccccc3[nH]2)cc1C(=O)NN 12535207 JYEPIQLIXZNHBO-UHFFFAOYSA-N 343.390 3.204 50 40 EGGB O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)c1ccc2ccccc2c1 67192354 DMNJLGILNSDDRT-YBFXNURJSA-N 335.319 3.218 50 40 EGGB CN1C(=O)/C(=N\NC(=O)c2ccc(C(C)(C)C)cc2)c2ccccc21 18265997 RCKPJOAYBXETLJ-FXBPSFAMSA-N 335.407 3.095 50 40 EGGB Cc1ccsc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)c1ccccc1C2=O 20086721 MJJRQMGBRLKOJP-CYBMUJFWSA-N 348.383 3.198 50 40 EGGB CC(C)(C)c1ccc(OCC(=O)NNC(=O)Nc2ccccc2)cc1 142599 FDEOCTKRDJEKCI-UHFFFAOYSA-N 341.411 3.216 50 40 EGGB O=C(NNc1ccc(Br)cc1Cl)Nc1nncs1 69561356 SRXCJHLWAOBTIG-UHFFFAOYSA-N 348.613 3.103 50 40 EGGB CCn1nc(C)c(/C=N/NC(=O)c2cc(C)nc3ccccc23)c1C 547486 MHDCNKWFKQDDOT-RGVLZGJSSA-N 335.411 3.140 50 40 EGGB O=C(NNC(=S)NCCCc1ccccc1)c1ccc(Cl)cc1 408586583 PBAGVRZOLTUYPU-UHFFFAOYSA-N 347.871 3.082 50 40 EGGB NNC(=O)c1cn(C(=O)c2ccc(Cl)c(Cl)c2)c2ccccc12 216954913 WJBQTMPKNJKCAR-UHFFFAOYSA-N 348.189 3.240 50 40 EGGB O=C(N/N=C/c1coc2ccccc2c1=O)c1cc2ccccc2o1 484182 ACEINHAVRVABLI-KEBDBYFISA-N 332.315 3.303 50 40 EGGB COc1c(C=C(C#N)C#N)c(C[C@@H](C)Cl)c(OC)c2c1OCO2 15085438 HDBTZGWLJJPTPE-SECBINFHSA-N 334.759 3.033 50 40 EGGB CC(=O)Nc1ccc(/C=N/NC(=O)C23CC4CC(CC(C4)C2)C3)cc1 4931546 LHMATNJDDYPMGW-CIAFOILYSA-N 339.439 3.312 50 40 EGGB O=C(N/N=C/c1cccnc1)C(Oc1ccccc1)Oc1ccccc1 55405 DUAWAKDCCGVWAN-PXLXIMEGSA-N 347.374 3.016 50 40 EGGB CCn1nc(C)c([C@@H]2[C@@H]3CCCC=C3C(C#N)=C(N)C2(C#N)C#N)c1C 2769700 FCZZYPKTQOKKEW-QAPCUYQASA-N 346.438 3.113 50 40 EGGB Cc1cc(C)cc(CSCC(=O)N/N=C/c2ccccc2O)c1 59473801 SQQDMSMMIDLLMN-VXLYETTFSA-N 328.437 3.393 50 40 EGGB CC(/C=C/c1ccccc1)=N/NC(=O)C(=O)Nc1ccc(C)cc1C 13882093 FCDDDGHTLGLVTL-QMLFAMFSSA-N 335.407 3.447 50 40 EGGB COc1ccc(/C=N\NC(=O)COc2cccc3cccnc23)c(C)c1 409022248 KSSFHJOCDYVEHA-UUYOSTAYSA-N 349.390 3.081 50 40 EGGB C#C[C@]1(O)CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(OO)[C@H]3CC[C@]21C 256461456 UOTMWSQOLMXLKR-HMGBVJPOSA-N 330.424 3.105 50 40 EGGB Cc1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)o1 6301812 LNKFZWNGFUATGR-LZYBPNLTSA-N 329.337 3.475 50 40 EGGB O=C(CCSc1ccc(Cl)cc1)NNC(=O)c1ccccc1 2621542 XXEGEFQKWUXRQY-UHFFFAOYSA-N 334.828 3.283 50 40 EGGB C[C@@H](Oc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2)cc1)C(=O)O 4723181 VBHXRASASJOPEN-WDGDVPDHSA-N 336.347 3.084 50 40 EGGB CC(C)=C[C@@H]1[C@@H](C(=O)NNC(=O)c2ccc(OC(C)C)cc2)C1(C)C 24714036 WKMRKWNACYZSRO-SJORKVTESA-N 344.455 3.473 50 40 EGGB COc1ccc(N/C=C(\C#N)C(=O)NCc2ccccc2)cc1Cl 5031155 FRGGQAADJYJNTR-WYMLVPIESA-N 341.798 3.484 50 40 EGGB COc1ccc(OCC(=O)N/N=C(\C)c2ccc(Cl)s2)cc1 5164379 FLABLGVTSIESMC-LICLKQGHSA-N 338.816 3.329 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)COc2ccccc2[N+](=O)[O-])cc1 4721084 MXECQLZFCYSZJT-YBFXNURJSA-N 341.367 3.247 50 40 EGGB CCCc1n[nH]c2c1[C@@H](c1ccnc3ccccc13)C(C#N)=C(N)O2 6783532 HXSUXGZFABCXPO-INIZCTEOSA-N 331.379 3.129 50 40 EGGB O=C(CSc1nc2ccccc2s1)N/N=C1/C[C@@H]2C=CC[C@H]12 96708542 WXDJVUBAJRYXDR-DWAGSSQZSA-N 329.450 3.457 50 40 EGGB Cc1cc(C)n(Cc2ccc(C(=O)N/N=C/c3cccc(O)c3)cc2)n1 130520 VDEZGNMUBFXKMI-CIAFOILYSA-N 348.406 3.018 50 40 EGGB COc1cccc(C(=O)N/N=C/c2ccccc2Br)c1 5720976 FFGXNOJGMVHWBF-LICLKQGHSA-N 333.185 3.222 50 40 EGGB CCOc1ccc(CC(=O)N/N=C/c2cc(Cl)ccc2OC)cc1 10475921 PPIVTHQYEQMALZ-UDWIEESQSA-N 346.814 3.440 50 40 EGGB O=C(N/N=C/c1ccccc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1 4506143 MRCABBWYVUVCCP-DJKKODMXSA-N 337.257 3.378 50 40 EGGB CCOc1cccc(/C=N/NC(=O)COc2c(C)cccc2C)c1 408915913 RTEMYGFMWRKXPF-UDWIEESQSA-N 326.396 3.231 50 40 EGGB COc1ccc(/C=N/NC(=O)[C@H](C)SCc2ccccc2)cc1 59369 FDLDGSUXMLEZQA-BXUJETTOSA-N 328.437 3.467 50 40 EGGB COc1ccc(NC(=O)[C@@H](Cl)C(=O)c2ccc([N+](=O)[O-])cc2)cc1 3267320 RAEYVOXNODOQDW-AWEZNQCLSA-N 348.742 3.032 50 40 EGGB N#C/C(=C\c1ccccc1Cl)C(=O)NCc1ccc2c(c1)OCO2 59133257 WXMJFTFOBXKWCP-RIYZIHGNSA-N 340.766 3.292 50 40 EGGB CNC(=O)/C(C#N)=C/c1cn(Cc2ccccc2C#N)c2ccccc12 18194615 GSSNMZSOYUNEBS-LICLKQGHSA-N 340.386 3.214 50 40 EGGB N#C/C(=C\C=C\c1ccccc1[N+](=O)[O-])C(=O)Nc1nccs1 6210137 OZTYYYVZUFJNRN-IBAXKFRNSA-N 326.337 3.153 50 40 EGGB Cc1ccccc1NC(=O)/C(C#N)=C\c1ccc(OCC(=O)O)cc1 408746290 YGDCNWXQQGEJPA-GDNBJRDFSA-N 336.347 3.004 50 40 EGGB CCOc1ccc(/C=N/NC(=O)[C@@H]2[C@H]3CCCC[C@@]32C)cc1OC 100216236 DZVFTTHPJVLOEH-FUIRCSSXSA-N 330.428 3.370 50 40 EGGB Cc1cc(/C=N/NC(=O)c2cccnc2)c(C)n1-c1ccc(F)cc1 58928347 NMEBQQMHDXFUFU-WSDLNYQXSA-N 336.370 3.392 50 40 EGGB Cc1ccc(/C=N/NC(=O)Cc2ccc(Br)cc2)cc1 4735281 YTUTWHPYPCHUCF-WOJGMQOQSA-N 331.213 3.450 50 40 EGGB CCCCCN1C(=O)/C(=N\NC(=O)c2ccoc2C)c2ccccc21 8229111 DYPXDNGKIYEUPS-JZJYNLBNSA-N 339.395 3.259 50 40 EGGB CCOc1ccc(/C=N\NC(=O)Cc2ccc(C)cc2)cc1OCC 409358291 DNSSAWVPMXPCDY-STZFKDTASA-N 340.423 3.485 50 40 EGGB COc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(=O)oc1ccccc21 517965 ISBLNJXMYQHIRW-MRXNPFEDSA-N 346.342 3.020 50 40 EGGB biogenic O=C(NNC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(F)cc1 4682606 LBEVPTUVAUBBHS-UHFFFAOYSA-N 331.734 3.035 50 40 EGGB CC[C@H](C)c1ccc(OCC(=O)N/N=C\c2ccc([N+](=O)[O-])o2)cc1 4778774 YTLXFSSNMYUILW-XACIZNRCSA-N 345.355 3.230 50 40 EGGB COc1cc(/C=N/NC(=O)c2ccc3ccccc3c2O)ccc1O 5720211 YZOFTQYLFCIPSX-RGVLZGJSSA-N 336.347 3.024 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)C(=O)Nc2ccc(F)cc2)cc1 3008869 QNNRHRPLASAWRB-RGVLZGJSSA-N 327.359 3.038 50 40 EGGB COc1ccc2nc(NNC(=O)c3c(F)cccc3F)sc2c1 4121401 RJTSWUWILQAZQQ-UHFFFAOYSA-N 335.335 3.340 50 40 EGGB Cc1ccc(S(=O)(=O)/C(C#N)=C/c2ccc3c(c2)OCO3)cc1 3199498 LJAVIXDFGROALG-OVCLIPMQSA-N 327.361 3.062 50 40 EGGB Cc1occc1C(=O)NNC(=O)/C=C/c1cc(Cl)cc(Cl)c1 12614475 RAVPFQOBFSGKII-NSCUHMNNSA-N 339.178 3.369 50 40 EGGB CCn1c(C)cc(/C=N\NC(=O)COc2cccc(Cl)c2)c1C 409063776 AALWPVSIZUCUHA-GRSHGNNSSA-N 333.819 3.307 50 40 EGGB O=C(COc1ccccc1)N/N=C/c1sc2ccccc2c1O 266439 IBDRTHCSVUFXGI-VCHYOVAHSA-N 326.377 3.136 50 40 EGGB CN1CCN(c2ccccc2NC(=O)[C@@H](Cl)c2ccccc2)CC1 1401294 IPCPEIMNVATWDY-SFHVURJKSA-N 343.858 3.357 50 40 EGGB CC(C)CC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1N1CCCCC1 408996506 PTMMEAHNEXMYRN-LDADJPATSA-N 332.404 3.081 50 40 EGGB CCc1cccc2c(/C=N/NC(=O)c3ccc4c(c3)OCO4)c[nH]c12 3609431 LRZZAUDWCSXVKW-UFFVCSGVSA-N 335.363 3.223 50 40 EGGB Nc1c(Cl)c(Cl)nc(C(=O)N/N=C2\C[C@H]3C=CC[C@H]23)c1Cl 20885287 BMGDJAKJQRFAJL-WVYWKVCQSA-N 345.617 3.306 50 40 EGGB N#C/C(=C\c1ccc(O)c([N+](=O)[O-])c1)C(=O)Nc1cccc(Cl)c1 36167284 GZVSGUWVQPEWRA-IZZDOVSWSA-N 343.726 3.499 50 40 EGGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccc([N+](=O)[O-])s1 354939 NPIYJAMJTRVSRS-CYBMUJFWSA-N 345.380 3.107 50 40 EGGB Cc1c([N+](=O)[O-])cc(C(C)(C)C)c(OC(=O)CCl)c1[N+](=O)[O-] 1733380 JRKZLGWGNZPRNC-UHFFFAOYSA-N 330.724 3.253 50 40 EGGB O=C(CCc1ccccc1)NNc1nc2ccc([N+](=O)[O-])cc2s1 59417527 ZDWBZCFLNTWGJW-UHFFFAOYSA-N 342.380 3.280 50 40 EGGB CCOc1ccc([C@H](O)CCC(=O)N/N=C/c2cccs2)cc1 58892603 TULMJBJWKIXDRF-YAJBTMAUSA-N 332.425 3.111 50 40 EGGB O=[P@]1(N(CCCl)C[C@H](Cl)CCCCl)NCCCO1 104361492 CEWZNIGUQAHDRC-MLCYQJTMSA-N 337.615 3.272 50 40 EGGB O=C(CSc1ccc(Cl)cc1)N/N=C/c1ccc([N+](=O)[O-])cc1 40961660 CUQWCQJEQBZPIP-RQZCQDPDSA-N 349.799 3.491 50 40 EGGB CCOc1ccc(N[C@H](CC)C(=O)N/N=C/c2cccc(O)c2)cc1 2742951 QLDFLYPSPDNJQE-JZQBQCRLSA-N 341.411 3.132 50 40 EGGB COc1ccc(/C=C(\C#N)S(=O)(=O)c2ccccc2)c(OC)c1 948036 MQDPPTYUDRLDCF-MHWRWJLKSA-N 329.377 3.042 50 40 EGGB C[C@@H](Sc1ccc(Cl)cc1)C(=O)NN=C1CCN(C)CC1 58189439 PVXULIXHNLBYFD-LLVKDONJSA-N 325.865 3.018 50 40 EGGB COc1ccc(/C=C(\C#N)S(=O)(=O)c2ccc(C)cc2)cc1O 1967402 WYUMTOUSVQIOQL-OQLLNIDSSA-N 329.377 3.048 50 40 EGGB N#CC1=C(S)N(c2ccc(Cl)cc2)[C@@H](c2ccco2)NC1=O 4514000 REZNOPAJZAEPQS-ZDUSSCGKSA-N 331.784 3.233 50 40 EGGB COc1ccc(OC)c(/C=N/NC(=O)[C@H](C)Sc2ccccc2)c1 20248280 QRUYUTYPZAUSKW-HCZVKUGISA-N 344.436 3.335 50 40 EGGB C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1ccccc1C(=O)O 20246285 TUKMUBCBFJPBEM-MBNTZHJCSA-N 328.393 3.016 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)CSCCc2ccccc2)cc1 408726309 LLGNRUVIGWCJTL-XSFVSMFZSA-N 341.480 3.179 50 40 EGGB COc1ccc(/C=N/NC(=O)COc2ccccc2Cl)cc1C 14014199 GOTCPNKSONNMHV-VXLYETTFSA-N 332.787 3.186 50 40 EGGB N#CS[C@@H](CS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1 126859 UTRXMFMXMUDCMV-AWEZNQCLSA-N 348.405 3.324 50 40 EGGB COc1cc(C=C(C#N)C#N)ccc1OCC(=O)Nc1cccc(C)c1 266039 GOGOWBXNOATSHD-UHFFFAOYSA-N 347.374 3.452 50 40 EGGB Cc1cccc(/C=N/NC(=O)c2c(-c3ccccc3)noc2C)c1O 482651 JJXLOARZADSUEB-RGVLZGJSSA-N 335.363 3.428 50 40 EGGB Cc1cc(/C=N\NC(=O)COc2ccccc2Cl)cc(C)c1O 106206082 TUODDRPALNNXQZ-OCKHKDLRSA-N 332.787 3.192 50 40 EGGB COc1ccc(C)cc1NC(=S)NNC(=O)c1ccc(Cl)cc1 5274164 URPPCBJMWFLUSG-UHFFFAOYSA-N 349.843 3.288 50 40 EGGB Cc1ccc(OCCCOc2ccc(/C=N/NC(N)=O)cc2)c(C)c1 4590505 FWCWRCFDPXEZQI-FYJGNVAPSA-N 341.411 3.154 50 40 EGGB N#C/C(=C\c1coc2ccccc2c1=O)C(=O)NCCc1ccccc1 7778677 UGGBHLLXCGXGCM-FOWTUZBSSA-N 344.370 3.059 50 40 EGGB Cc1cccc(/C=N/NC(=O)c2cccc(Br)c2)c1O 9668312 AEDZLNDNJQVIFX-RQZCQDPDSA-N 333.185 3.227 50 40 EGGB CCOc1cc(/C=N/NC(=O)c2ccccc2-n2cccc2)ccc1O 5610409 MINOETXQZJOBGH-KGENOOAVSA-N 349.390 3.346 50 40 EGGB O=C(CNc1ccccc1)N/N=C/c1cccc(Br)c1 58827 WAFUYASCDIBOPW-VCHYOVAHSA-N 332.201 3.011 50 40 EGGB O=C(NNc1ncnc2sc3c(c12)CCCC3)c1ccccc1F 348642 BNUIJIMFMAHLQR-UHFFFAOYSA-N 342.399 3.466 50 40 EGGB CCN(CC)[P@@](=O)(c1ccccc1)c1c(C)nc2ccccn12 3123919 WHFBPLQGQOGMCO-HSZRJFAPSA-N 327.368 3.213 50 40 EGGB Cc1c(/C=C(\C#N)C(=O)Nc2cnc3ccccc3c2)cc(C#N)n1C 25674975 ZHHFHCSOSLVCGU-FRKPEAEDSA-N 341.374 3.299 50 40 EGGB O=C(O)CC/C(=N\NC(=O)[C@@H]1C[C@@H]1c1ccccc1)c1ccccc1 4646820 XAVHBAQTZZUWSK-HSLLHTKSSA-N 336.391 3.175 50 40 EGGB COc1cc(/C=N/NC(=O)CC#N)ccc1OC/C=C/c1ccccc1 15934421 QTRCVUTUBXIBEW-BLHYSMSISA-N 349.390 3.151 50 40 EGGB COc1ccc2[nH]c(C(=O)N/N=C(\C)c3ccc(F)cc3)cc2c1 9614567 JHBJKPIAUQKPTE-SRZZPIQSSA-N 325.343 3.470 50 40 EGGB O=C(N/N=C/c1ccc(-c2ccc(F)cc2[N+](=O)[O-])o1)c1ccco1 409030449 DLRDAWLOKPXSTL-GIJQJNRQSA-N 343.270 3.351 50 40 EGGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/C=C/c1ccccc1 409271997 XGZVFRZLXYFKCU-OKSYWBHRSA-N 325.324 3.032 50 40 EGGB COc1cccc(/C=N/NC(=O)[C@@H](C)Sc2ccc(C)cc2)c1O 409125050 MHLGJEJEGMMOQG-OTGIAGGSSA-N 344.436 3.340 50 40 EGGB CC(C)Oc1ccc(CC(=O)NNC(=S)Nc2ccccc2)cc1 13655960 UKHUKDGETOQTNH-UHFFFAOYSA-N 343.452 3.034 50 40 EGGB Cc1c2c([nH]c(=O)c1C)C=C[C@H](Br)[C@H]2Br 1700658 BZLNSIIGHANXHH-OIBJUYFYSA-N 333.023 3.218 50 40 EGGB Cc1ccc(SCC(=O)NNC(=O)C[C@@H]2C[C@H]3CC[C@@H]2C3)cc1 6428912 IGFLUYOAORCNET-ZNMIVQPWSA-N 332.469 3.061 50 40 EGGB CC1=NOC(=O)/C1=C\c1ccc(N(CCCl)CCCl)cc1 108423709 ZJIWTQFNRNGSOW-UVTDQMKNSA-N 327.211 3.287 50 40 EGGB O=C(N/N=C\c1c(O)ccc2ccccc12)c1ccc2c(c1)OCO2 12360337 XSVSVUSAFSGISL-JMIUGGIZSA-N 334.331 3.038 50 40 EGGB O=C(Cc1c[nH]c2ccccc12)NNC(=O)Nc1ccc(Cl)cc1 2550034 INHIAAQQTVCDBG-UHFFFAOYSA-N 342.786 3.217 50 40 EGGB CCCCC1CCC(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1 3900780 XLWOCZTYSJIKFH-UHFFFAOYSA-N 347.415 3.352 50 40 EGGB O=C(c1cc(F)ccc1F)[C@H](Br)CBr 306535448 GDMUSTMSBLSIPZ-SSDOTTSWSA-N 327.950 3.306 50 40 EGGB COc1cc(/C=N/NC(=O)Cc2ccc3ccccc3c2)ccc1O 44002066 ZOQLCSSKIATZCR-FYJGNVAPSA-N 334.375 3.247 50 40 EGGB CCn1cc(/C=N/NC(=O)c2cccc(NC(C)=O)c2)c2ccccc21 582889 DTQVXNVVJAGLOF-CIAFOILYSA-N 348.406 3.384 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 5469356 WTGDBEUOKPDLPZ-LDADJPATSA-N 327.340 3.148 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@@H]1c1ccc(F)cc1 90715 AQQNRCVQGZMFBK-CYBMUJFWSA-N 338.367 3.495 50 40 EGGB O=[N+]([O-])c1cccc(S(=O)(=O)SC(Cl)(Cl)Cl)c1 1760568 PEDSOEPRNXFMAE-UHFFFAOYSA-N 336.605 3.344 50 40 EGGB Cc1ccccc1C(=O)OC[C@@H](Br)CBr 1676100 FAJWGNHSIXBHQI-VIFPVBQESA-N 336.023 3.310 50 40 EGGB C[C@H]1Oc2ccccc2C=C1/C=N/NC(=O)c1cccc([N+](=O)[O-])c1 501797 FBRNSPYWACXQHM-ZGXHQARYSA-N 337.335 3.175 50 40 EGGB CCOC(=O)c1cnc(Nc2nc3ccccc3o2)nc1CCl 9009637 NWQCBGBLNZFWJF-UHFFFAOYSA-N 332.747 3.277 50 40 EGGB N#C/C(=C/c1ccc(N2CCOCC2)cc1)c1nc2ccccc2[nH]1 33394386 XKHCCTUETHWQKI-SSZFMOIBSA-N 330.391 3.464 50 40 EGGB CCOc1cc(/C=N/NC(=O)c2cc3c(s2)CCCC3)ccc1O 2653697 VDXXKTWKIOGAHV-YBFXNURJSA-N 344.436 3.495 50 40 EGGB COc1cc(/C=N/NC(=O)CNc2ccc3ccccc3c2)ccc1O 31087 LSCZUTBWHXZUBG-WSDLNYQXSA-N 349.390 3.116 50 40 EGGB COc1ccccc1/C=N/NC(=O)c1ccc(Br)cc1 257103 XEORZAAZNMLCQY-LICLKQGHSA-N 333.185 3.222 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)Cc2ccc(Cl)c(Cl)c2)o1 2768224 IXRJLRDVNVBMEY-GIJQJNRQSA-N 340.210 3.345 50 40 EGGB Cc1ccc(-c2nc(C)c(C(=O)NNc3ncccn3)s2)c(C)c1 58426733 QCLXBENAYNJZCV-UHFFFAOYSA-N 339.424 3.282 50 40 EGGB COc1ccc(/C=N/NC(=O)Cc2ccc(Br)cc2)cc1 4735236 XOKWGHSEGGFCOO-WOJGMQOQSA-N 347.212 3.151 50 40 EGGB O=C(CBr)Nc1nnc(-c2ccc(Cl)cc2)s1 2451323 PWKXTRMWHMHZQP-UHFFFAOYSA-N 332.610 3.192 50 40 EGGB N#C/C(C(=O)Nc1cc(C(F)(F)F)ccc1Cl)=C1\CCCN1 23641541 LIDPSCMRNCJRCT-LUAWRHEFSA-N 329.709 3.458 50 40 EGGB CC(C)c1cccc(C(C)C)c1NC(=S)NNC(=O)[C@H]1CCCO1 44077031 KPBKSKDDDALTGX-OAHLLOKOSA-N 349.500 3.430 50 40 EGGB Cc1ccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)s1 12990081 OMWSFJCPYRXPQM-UHFFFAOYSA-N 332.469 3.424 50 40 EGGB Cc1csc(SCC(=O)/C(C#N)=C2\Nc3ccccc3N2C)n1 16865807 NTZDHMSDMAPORM-RVDMUPIBSA-N 342.449 3.410 50 40 EGGB N#C/C(=C\c1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1)C(N)=S 408544716 XAOYNCBUHOZPAQ-NTEUORMPSA-N 339.376 3.367 50 40 EGGB Cc1cc(C(=O)NN)c(C)n1-c1ccc(Br)c(Cl)c1 223705929 SGVFBBMVNYPSMA-UHFFFAOYSA-N 342.624 3.114 50 40 EGGB CN(C)c1nc2cc(NC(=O)N3CCSSCC3)ccc2o1 1614886520 HHYLVWNHRSECBB-UHFFFAOYSA-N 338.458 3.123 50 40 EGGB Fc1ccc(-n2c(CCl)cs/c2=N\C[C@@H]2CCCO2)cc1 5694704 JMUFTNSKAXPVBS-JZYMCLRRSA-N 326.824 3.496 50 40 EGGB C/C(=N\NC(=O)[C@]1(C)NC(C)(C)Cc2ccccc21)c1ccccc1 19534965 ADFBCJHCQBJMOE-ODAUKNCYSA-N 335.451 3.367 50 40 EGGB CC(C)CNC(=O)C(=O)N/N=C/c1c2ccccc2cc2ccccc12 5384284 ATANBXOLHGTEEC-YDZHTSKRSA-N 347.418 3.215 50 40 EGGB CCOC(=O)/C(C#N)=C\c1ccc(N(CCCl)CCCl)cc1 4523188 YLTGBFUWBSXITC-KAMYIIQDSA-N 341.238 3.441 50 40 EGGB CC(C)=C[C@H]1[C@@H](C(=O)NNC(=O)c2ccc(OC(C)C)cc2)C1(C)C 24714040 WKMRKWNACYZSRO-IRXDYDNUSA-N 344.455 3.473 50 40 EGGB COc1cc(OC)c(/C=N/NC(=O)CCc2ccccc2)cc1Cl 408588240 INDLVXIMXRQJPB-UDWIEESQSA-N 346.814 3.440 50 40 EGGB NNC(=O)c1cc(Cl)cc(Cl)c1-c1cc2ccccc2oc1=O 216936129 KDPYXIXHLCVQGV-UHFFFAOYSA-N 349.173 3.370 50 40 EGGB CCN(CC)c1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccc(O)cc1 5322025 PZOFBUVPLCOOTK-LJQANCHMSA-N 335.407 3.457 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc(Cl)cc2)c(OC)c1 6295498 RRXVZLIXZMBMOM-UDWIEESQSA-N 346.814 3.440 50 40 EGGB O=C(NNc1ccc(Cl)c(Cl)c1)c1ccc2c(c1)OCO2 32999499 UUYLANSYULNFEV-UHFFFAOYSA-N 325.151 3.479 50 40 EGGB CC(C)(C)c1ccc(OCC(=O)N/N=C/c2ccc(O)cc2)cc1 509115 JYTJDDYMIVFFGX-UDWIEESQSA-N 326.396 3.219 50 40 EGGB O=C(NNc1nc2ccc([N+](=O)[O-])cc2s1)c1ccccc1F 59417524 OEOUCNGDBLHZHM-UHFFFAOYSA-N 332.316 3.101 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)Nc2cccc(Cl)c2)cc(O)c1O 13095655 FLVUKQRNNZQUCA-VZUCSPMQSA-N 344.754 3.305 50 40 EGGB O=C(Oc1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)C2CC2)s1 8745318 CYSAHULUHRAEFO-UHFFFAOYSA-N 332.337 3.224 50 40 EGGB CCOC(=O)[C@]1(C#N)C(=O)[C@@H](c2ccccc2)[C@@H]2CCCCC2=C1C#N 4910843 UOSFJDGSTWTMSR-MMOPVJDHSA-N 348.402 3.436 50 40 EGGB Cc1ccnc(-n2c(SC/C=C/C#N)nc3ccccc3c2=O)c1 89701855 ZGSBWAXAKJHTSB-SNAWJCMRSA-N 334.404 3.261 50 40 EGGB Cc1ccc(C(=O)N/N=C\c2ccc(O)c(Br)c2)cc1 32138981 XRCCDGUDBFUELO-MFOYZWKCSA-N 333.185 3.227 50 40 EGGB Cc1cccc(C)c1N[C@@H](C)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 356640 CMKWHMYNEVNGTE-YRIIZNAFSA-N 340.383 3.162 50 40 EGGB CCOC(=O)c1cc(CC)sc1NC(=O)[C@@H](C)Br 152880 BIQDVJSJYVZXJI-SSDOTTSWSA-N 334.235 3.209 50 40 EGGB C[C@H]1CCCC[C@@H]1NC(=O)/C(C#N)=C\c1ccc2c(c1)OCCO2 33363718 XVXURAGENAPLOT-YZGOVMTRSA-N 326.396 3.060 50 40 EGGB CCC(=O)NNC(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12 12762862 CYRBRTKGMLBWOZ-UHFFFAOYSA-N 337.354 3.212 50 40 EGGB COc1ccc2ccccc2c1/C=N/NC(=O)CNC1CCCCC1 409384238 BOWGBEAFJNNMQC-LPYMAVHISA-N 339.439 3.221 50 40 EGGB Cc1cc(N2CCCC2)c(F)cc1/C=N/NC(=O)Cc1ccccc1 6043987 AIRWKAQCKYZFGH-HYARGMPZSA-N 339.414 3.427 50 40 EGGB COc1cc(C=C(C#N)C#N)ccc1OCc1ccc(C(=O)O)cc1 5661200 OFFDFPQFNJHZKO-UHFFFAOYSA-N 334.331 3.403 50 40 EGGB C[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1C(=O)N[C@@H]1OC(=O)c1ccccc1 204517275 YNVUWGMRTJMVRR-DUVNUKRYSA-N 349.503 3.326 50 40 EGGB COC(=O)[C@@H]1C(O)=NC(SC)=C(C#N)[C@H]1c1ccc(Cl)cc1 80966 LBDRRAQRHHONDC-NEPJUHHUSA-N 336.800 3.281 50 40 EGGB NCCCC[C@@H](Br)C(=O)c1cc(O)nc2ccccc12 8614835 WJZAKXPIWKWCMM-GFCCVEGCSA-N 337.217 3.016 50 40 EGGB C[C@@H](O)COc1ccccc1P(c1ccccc1)c1ccccc1 104225141 ZATSGOFXQDKSKL-QGZVFWFLSA-N 336.371 3.204 50 40 EGGB C/C(=N\NC(=O)CSc1nc2ccccc2o1)c1ccccc1 13598567 XBBSWYUUHZXAIX-XDHOZWIPSA-N 325.393 3.460 50 40 EGGB C=CCOc1ccc([C@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)cc1Cl 409135592 ZGPDPRDLDJTXLF-HNNXBMFYSA-N 342.786 3.155 50 40 EGGB CC1(C)Cc2cc(/C=N\NC(=O)c3cccc([N+](=O)[O-])c3)ccc2O1 408710881 UAVRRNFFYHALRR-ODLFYWEKSA-N 339.351 3.072 50 40 EGGB COc1ccccc1/C=N/NC(=O)CNc1ccc2ccccc2c1 31103 CCRUZRRWIYOMEC-LPYMAVHISA-N 333.391 3.411 50 40 EGGB Cc1ccsc1/C=C(/C#N)C(=O)N1CCN(c2ccccc2)CC1 15227438 NTEVCVSCTXGOLA-SSZFMOIBSA-N 337.448 3.312 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)Cc2ccccc2)cc1OCC 3084021 SYVSGJDSXYZTIK-RCCKNPSSSA-N 338.407 3.343 50 40 EGGB N#Cc1ccc(C(=O)[C@@H](Br)CBr)cc1F 308788548 BEVXHCVZWKTZIP-QMMMGPOBSA-N 334.970 3.038 50 40 EGGB CC(C)(C)OC(=O)N1CCC2(CC1)CO[C@H](CBr)C2 40448098 MMYHBYDKBBFVKS-NSHDSACASA-N 334.254 3.188 50 40 EGGB ClC[C@H]1Cc2cc(I)c(Cl)cc2O1 5444801 XNKZHMOWUFYQKA-ZCFIWIBFSA-N 328.964 3.487 50 40 EGGB CO[C@H](CNC(=O)/C(C#N)=C\c1ccco1)c1cccc(Cl)c1 81328066 ONUGRMVBECEQOG-RCBBPTIPSA-N 330.771 3.344 50 40 EGGB CC(=O)Oc1ccc(/C=N/NC(=O)CSc2ccc(C)cc2)cc1 408772380 LHNYJCAMHAVCCB-YBFXNURJSA-N 342.420 3.163 50 40 EGGB COc1cc(OC)cc(C(=O)N/N=C(/C)CCc2ccccc2)c1 38712739 CDAHDTNLTFXMHG-ZHZULCJRSA-N 326.396 3.442 50 40 EGGB C=CCn1cc(/C=N/NC(=O)[C@@H](O)c2ccccc2)c2ccccc21 487380 BUXRDLDGHUHSTA-IOVUBPJKSA-N 333.391 3.011 50 40 EGGB CCOc1cc(/C=N/NC(=O)Cc2ccc(C)c(C)c2)ccc1O 6350993 WSVBDMQEIXBMBT-UDWIEESQSA-N 326.396 3.101 50 40 EGGB Cc1ccc(C(=O)NNC(=O)COc2cc(C(C)C)ccc2C)cc1 267578 AGBHSSKSLDKRKG-UHFFFAOYSA-N 340.423 3.267 50 40 EGGB CCOC(=O)[C@@]1(C#N)C(=O)[C@@H](c2ccccc2)[C@H]2CCCCC2=C1C#N 1246627 UOSFJDGSTWTMSR-DJPFJPOOSA-N 348.402 3.436 50 40 EGGB Cc1ccsc1/C=N/NC(=O)CN1C(=O)c2cccc3cccc1c23 107433072 NWNZTCORLWALNY-KEBDBYFISA-N 349.415 3.320 50 40 EGGB Cc1cccc(Oc2nc3ccccn3c(=O)c2C=C(C#N)C#N)c1 5572944 RFVMWENRTAIMOS-UHFFFAOYSA-N 328.331 3.226 50 40 EGGB O=C(N/N=C(/Cc1ccccc1)c1ccccc1)c1cc(O)ccc1O 17072073 RNEPJYAWHPRPPW-QOCHGBHMSA-N 346.386 3.475 50 40 EGGB C/C(=N\NC(=O)Cc1ccc2c(c1)OCCO2)c1ccc(Cl)cc1 409359862 CFUZLAIPSXRIMM-UDWIEESQSA-N 344.798 3.194 50 40 EGGB Cc1ccccc1C(=O)N/N=C/c1cccc(OC2CSC2)c1 408863473 MVBBLPHLZLEWDE-VXLYETTFSA-N 326.421 3.253 50 40 EGGB Cc1cc(/C=N\NC(=O)COc2cccc3ccccc23)c(C)n1C 408778326 DNNMSVPMVPTDHN-MTJSOVHGSA-N 335.407 3.324 50 40 EGGB Cc1cc(Br)c(O)c(/C=N/NC(=O)c2cccs2)c1 569183 AIOKLKYOBUDQBD-VIZOYTHASA-N 339.214 3.289 50 40 EGGB C[C@@H](SCc1ccccc1)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 5370498 GAUVEZVYZFLOFK-VBEHJTROSA-N 343.408 3.367 50 40 EGGB O=C(COc1ccc(Cl)cc1Cl)OCCBr 1732201 QQSWOIPGEJTLRD-UHFFFAOYSA-N 327.989 3.310 50 40 EGGB CC1(C)C(=O)C(=O)c2cnn(-c3ccccc3)c2[C@@H]1Br 3172056 YCCJCHYJLVSDEO-ZDUSSCGKSA-N 333.185 3.100 50 40 EGGB CCOc1ccc(C=NNC(=O)[C@H](C)Oc2cccc(C)c2)cc1 12411794 FCBYQMIISKGABI-HNNXBMFYSA-N 326.396 3.311 50 40 EGGB CC(C)N1C(=O)/C(=N/NC(=O)c2ccc(Cl)cc2)c2ccccc21 15009142 QSKPKINAHHTOFZ-CAPFRKAQSA-N 341.798 3.229 50 40 EGGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C(\C)c1ccc(C)cc1 33491504 LYYXGKAHQQZCKN-LDADJPATSA-N 327.340 3.066 50 40 EGGB CCOC(=O)N1CCN(C(=O)CCCC[C@@H]2CCSS2)CC1 96115465 IVALGOWFKATNMI-CYBMUJFWSA-N 346.518 3.001 50 40 EGGB biogenic COc1ccc(/C(C)=N/NC(=O)[C@H]2C[C@@H]2c2ccccc2)c(OC)c1 12362271 NPCYDLPFUVOBHH-UGGMNAPNSA-N 338.407 3.348 50 40 EGGB CN(NC(=O)c1cc(Cl)c2c(c1)OCCCO2)c1ccccc1 32748172 SCKOSHXGGDZJSA-UHFFFAOYSA-N 332.787 3.283 50 40 EGGB COc1cccc(/C=N/NC(=O)CSc2ccc(C)cc2)c1OC 8515406 ZZYLPOZOLLVOCD-YBFXNURJSA-N 344.436 3.255 50 40 EGGB COc1cccc(C(=O)NNc2ccccc2C(F)(F)F)c1OC 45481011 SZNFESCKVBYOFT-UHFFFAOYSA-N 340.301 3.480 50 40 EGGB O=C(CCc1ccccc1)N/N=C/c1ccc(OC2CSC2)cc1 409109621 IGVCBWWTSMDDJB-UDWIEESQSA-N 340.448 3.264 50 40 EGGB O=C(NNC(=O)C1(c2ccc(F)cc2)CCCC1)c1cccs1 43702339 GEQQYTFPETVYAU-UHFFFAOYSA-N 332.400 3.160 50 40 EGGB C/C(=N\NC(=O)CN1CCCC1=O)c1cc2c(ccc3ccccc32)o1 46590444 FCHCCQSPINIROZ-FYJGNVAPSA-N 349.390 3.049 50 40 EGGB CC(C)Oc1ccc(C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1 4956060 VAOMZKVMUNKAGA-WOJGMQOQSA-N 327.340 3.146 50 40 EGGB CC[C@@H](Br)C(=O)Nc1nc2ccc(OC)cc2s1 20132387 UGIVWOXLUJVTOX-MRVPVSSYSA-N 329.219 3.417 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc(C)cc2C)c(OC)c1 216047563 VGRRJACOPHGHFX-RCCKNPSSSA-N 340.423 3.404 50 40 EGGB Cc1nn([C@@H](C)C(=O)N/N=C/c2ccc(F)s2)c(C)c1Cl 252478609 AQHTUSODXRYZTJ-SWEBQMAJSA-N 328.800 3.065 50 40 EGGB Cc1ccc2nc(NNC(=O)c3ccc4c(c3)OCCO4)sc2c1 246141 QYNNQUSNNYFZQC-UHFFFAOYSA-N 341.392 3.133 50 40 EGGB CCc1n[nH]c2c1C1(C(C#N)=C(N)O2)c2ccccc2-c2ccccc21 4150237 CBJRQEWZZKWRDD-UHFFFAOYSA-N 340.386 3.373 50 40 EGGB CN(C)c1ccc([C@H]2CC(=O)C(C#N)=C(c3ccccc3)NN2C)cc1 1620232 JHTSKPQOJQDZPZ-LJQANCHMSA-N 346.434 3.138 50 40 EGGB Cc1cc(C)nc(NNC(=O)C23C[C@H]4C[C@@H](CC(Cl)(C4)C2)C3)n1 102693845 ISDVRBMEMQDEHR-QJRTVWDNSA-N 334.851 3.114 50 40 EGGB N#C/C(=C\c1cc2c(cc1Cl)OCO2)C(=O)Nc1ccc(O)cc1 561567 VEATVVLSZGBXJD-VZUCSPMQSA-N 342.738 3.320 50 40 EGGB Cc1ccc(C)c(NC(=O)CCC(=O)N/N=C/c2ccc(C#N)cc2)c1 4523904 GBOHLANHYRGWBV-LPYMAVHISA-N 348.406 3.044 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)cc(OC)c1O 6586154 CNEHNLFALIFFQP-PUAODOJSSA-N 344.411 3.011 50 40 EGGB N#C[C@H](C(=O)N/N=C/c1cccc(Br)c1)c1ccccc1 409198443 ARQMAQNJEHARTM-BKQORJHRSA-N 342.196 3.207 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)C(C)C)c([N+](=O)[O-])cc1OC(F)F 44027112 QUWYVXKOKCFVDX-ONNFQVAWSA-N 340.282 3.337 50 40 EGGB CO[Si](CCCOC(F)(C(F)(F)F)C(F)(F)F)(OC)OC 195791530 TVBHYYFJOKDTPF-UHFFFAOYSA-N 348.287 3.062 50 40 EGGB O=C(N/N=C\c1ccc([N+](=O)[O-])o1)c1ccc(Cl)cc1Cl 16384904 IIKMLWNDOPTHOK-UUASQNMZSA-N 328.111 3.259 50 40 EGGB Cc1cc(C)c2nc(NNC(=O)COc3ccccc3)sc2c1 251212 HOGCXJFTDUFASN-UHFFFAOYSA-N 327.409 3.435 50 40 EGGB O=C(CCC(=O)Nc1cccc(Cl)c1)N/N=C/c1ccccc1F 3084084 QJMOMIHUJVSYQB-RGVLZGJSSA-N 347.777 3.348 50 40 EGGB CCCC1=C(C(=O)OCC)[C@H](c2ccccc2C)C(C#N)=C(N)O1 2697929 RRFONGNRAYDCMB-MRXNPFEDSA-N 326.396 3.420 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1ccc(N2CCCC2)cc1 409236782 HNHANEDYSHRETQ-STZFKDTASA-N 325.387 3.119 50 40 EGGB COc1ccc(CCC(=O)NNC(=O)Nc2cccc(Cl)c2)cc1 15933769 TUCSWOQVUJNROX-UHFFFAOYSA-N 347.802 3.134 50 40 EGGB C#CCn1c(C)c(/C=N/NC(=O)CNc2ccccc2)c2ccccc21 409383144 ZQCHINGYXWAGCM-OEAKJJBVSA-N 344.418 3.145 50 40 EGGB N#CC1=C(SCCOc2ccccc2)NC(=O)C[C@@H]1c1ccco1 409143997 OZALDJAITAIEOQ-AWEZNQCLSA-N 340.404 3.430 50 40 EGGB COc1cc(C=C(C#N)C#N)ccc1OCC(=O)Nc1ccccc1 289322 XESOJQCNWRNGLB-UHFFFAOYSA-N 333.347 3.143 50 40 EGGB Cc1ccc(C)c(NC(=O)C(=O)N/N=C/c2c(F)cccc2Cl)c1 3072703 MJZHIAVSRTUCCR-AWQFTUOYSA-N 347.777 3.185 50 40 EGGB CC1(C)[C@@]2(C)CC[C@@]1(C(=O)N1CCCCC1)[C@H](Br)C2=O 100834620 SPFWMAKXCTWFLU-RLCCDNCMSA-N 342.277 3.158 50 40 EGGB CCOc1cc(/C=N/NC(=O)OC)ccc1OCc1ccccc1 4616664 KZKARSVLVAXSLL-XDHOZWIPSA-N 328.368 3.354 50 40 EGGB CCOc1ccc(Cl)cc1/C=N/NC(=O)c1ccc([N+](=O)[O-])cc1 409102360 YZFILBVKHYUBOY-VCHYOVAHSA-N 347.758 3.411 50 40 EGGB COc1ccccc1NC(=O)N/N=C\c1cc([N+](=O)[O-])ccc1Cl 409095160 HQBWPCLIWNFXJG-MFOYZWKCSA-N 348.746 3.412 50 40 EGGB COc1ccc(OC)c([C@H]2C(C#N)=C(C)NC3=C2N2CCC3CC2)c1 100329788 BISTYISTQVTMFH-SFHVURJKSA-N 337.423 3.125 50 40 EGGB C=CCOc1ccc(Cl)cc1/C=C(/C#N)c1n[nH]c(N)c1C#N 4853189 PYJKJHASIUUJNV-WDZFZDKYSA-N 325.759 3.146 50 40 EGGB COc1ccccc1NCC(=O)N/N=C(/C)c1cc2ccccc2o1 6707349 DVLUYWLSFYJOKB-BKUYFWCQSA-N 337.379 3.394 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)N(C)C)ccc1OCc1ccccc1 59333495 AMUAAPOEHTXZKN-BOPFTXTBSA-N 336.391 3.269 50 40 EGGB CCN1CCC(=NNC(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1 58168392 PUZQUIPODLSCMX-UHFFFAOYSA-N 338.455 3.296 50 40 EGGB C[C@@H]1Cc2cc(/C=C(\C#N)S(=O)(=O)c3ccccc3)ccc2O1 2331638 JWSGXCUCAZLOAI-VVBXCHJUSA-N 325.389 3.348 50 40 EGGB C=CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(N)ccc32)cc1OC 8846192 HKBVGXBGXNHWJE-IBGZPJMESA-N 349.390 3.060 50 40 EGGB CC[C@@H](C)c1ccc(OCC(=O)N/N=C\c2ccc([N+](=O)[O-])o2)cc1 4778772 YTLXFSSNMYUILW-HIPMGEKLSA-N 345.355 3.230 50 40 EGGB COc1cccc2cc(C(=O)N/N=C/c3cccc([N+](=O)[O-])c3)oc12 408971892 LNKYWRIGDYMGAV-VCHYOVAHSA-N 339.307 3.114 50 40 EGGB N#CC1=C[C@@H](Br)[C@@H]2C[C@@H]1[C@H](Br)C=C2C#N 100020276 MEAIIRVSQNJTBF-LMLFDSFASA-N 328.007 3.063 50 40 EGGB O=C(Nc1ccccc1C(=O)N/N=C/c1ccccc1)c1ccco1 224967 NGESPNCMHAASPZ-DEDYPNTBSA-N 333.347 3.296 50 40 EGGB Cc1cccc(OCC(=O)N/N=C/c2ccc(Br)cc2)c1 260089 UXCAVYVCFAUETC-VCHYOVAHSA-N 347.212 3.287 50 40 EGGB Cc1cc(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)c(C)o1 5272591 LACYYDZJCQRVLG-UHFFFAOYSA-N 327.167 3.278 50 40 EGGB O=C(NNC(=O)c1ccccc1O)c1ccc(-c2ccccc2)cc1 12817818 ROQPEZOCEUADDS-UHFFFAOYSA-N 332.359 3.134 50 40 EGGB in-vitro CCCCC1CCC(C(=O)N/N=C2\N=C(N)c3ccccc32)CC1 12653407 SYWCEUYSCKPQEG-UHFFFAOYSA-N 326.444 3.180 50 40 EGGB CCc1nc(/C(C#N)=C/c2ccccc2OCC(=O)NC)sc1C 78702783 RMFRQPIDQOODKS-NTEUORMPSA-N 341.436 3.203 50 40 EGGB O=C(Oc1ccc([N+](=O)[O-])cc1)c1ccc(C[n+]2ccccc2)cc1 1678490 QYXPNZCQZKQIAO-UHFFFAOYSA-N 335.339 3.150 50 40 EGGB CC[C@H]1CCc2sc(C(=O)N/N=C/c3ccc(O)c(O)c3)cc2C1 8525879 LMWRZPDOEMJSSU-VSMYLPJWSA-N 344.436 3.438 50 40 EGGB CCCc1nn(C)c2c1[C@H](c1c(F)cccc1Cl)C(C#N)=C(N)O2 4914948 FDLKNIVOEUXVRR-ZDUSSCGKSA-N 346.793 3.383 50 40 EGGB CC[C@H](C)NC(=O)/C(C#N)=C/c1ccc(-c2ccc(C(=O)O)cc2)o1 408806806 BUTUVQVUPZAWDC-XBUHWIKASA-N 338.363 3.466 50 40 EGGB O=C(N/N=C/c1ccccc1C(F)(F)F)c1ccccc1[N+](=O)[O-] 5100450 UCTFPKXNXMPIQO-DJKKODMXSA-N 337.257 3.378 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2F)cc1[N+](=O)[O-] 106586523 UIQHPBPZWWWZQV-WQLSENKSSA-N 341.298 3.288 50 40 EGGB O=C(CCCC(=O)N/N=C/[C@@H]1CC=CCC1)N/N=C/[C@@H]1CC=CCC1 4647000 GLFGNHUMMQQQNN-BMYVLGGJSA-N 344.459 3.073 50 40 EGGB Cc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)sc2ccccc32)o1 71411458 SFVXYFPOILDKQZ-CQSZACIVSA-N 336.372 3.381 50 40 EGGB Cc1cc(C(=O)NN)c(C)n1-c1ccc(Br)cc1Cl 223706264 PDNVBVHBXCKANN-UHFFFAOYSA-N 342.624 3.114 50 40 EGGB COc1ccc(Cl)cc1/C=N/NC(=O)c1cccc(NC(C)=O)c1 5817109 VULYQIRTPPSOQW-VXLYETTFSA-N 345.786 3.071 50 40 EGGB C/C(CC(=O)NCc1ccco1)=N\NC(=O)c1cccc2ccccc12 100510179 LRVIZNGOWRYZTL-HYARGMPZSA-N 349.390 3.245 50 40 EGGB Cc1cc(OCC(=O)N/N=C/c2ccc(O)cc2)cc(C)c1Cl 504725 BCEVNJVQTZNICP-DJKKODMXSA-N 332.787 3.192 50 40 EGGB CC(/C=C/c1ccc2c(c1)OCO2)=N/NC(=O)Cc1cccs1 4504814 BDDLTJBJHUNVKV-WEQJRMIKSA-N 328.393 3.225 50 40 EGGB CC[C@H](Br)C(=O)Nc1sc(C(C)=O)c(C)c1C#N 74941522 KSHORDRHYLNBRZ-VIFPVBQESA-N 329.219 3.243 50 40 EGGB O=C(Cc1ccc([N+](=O)[O-])cc1)N/N=C/c1cccc2ccccc12 5949077 SAEGVUWSFRHNQC-DEDYPNTBSA-N 333.347 3.441 50 40 EGGB CCCC1CCC(=NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1 46193660 MQHWDCKXCBLZSA-UHFFFAOYSA-N 340.427 3.010 50 40 EGGB C=CCOc1cccc(/C=N\NC(=O)c2c(C)nc3cc(C)ccn23)c1 59435500 UHJFLLJOYLJLEY-BKUYFWCQSA-N 348.406 3.280 50 40 EGGB Cc1cc(/C=N/NC(=O)c2ccccn2)c(C)n1-c1ccc(F)cc1 408738277 UAFSOQPQLGEYFC-WSDLNYQXSA-N 336.370 3.392 50 40 EGGB CCOC(=O)C[C@H](NC(=O)CCl)c1cc(Cl)cc(Cl)c1 1616032797 ICGRYYDVLLDWDM-NSHDSACASA-N 338.618 3.343 50 40 EGGB C/C(=N/NC(=O)CSc1nc(C)cc(C)n1)c1ccc(C)cc1 5076593 KSCXTKSIDLWMMJ-ZHZULCJRSA-N 328.441 3.034 50 40 EGGB C/C(=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(C)c(C)c1 14407917 NXVDZOOKIPJWSG-XMHGGMMESA-N 325.368 3.295 50 40 EGGB O=C(CSc1nc2ccccc2[nH]1)N/N=C/c1c[nH]c2ccccc12 186323 RXTXSBKRENQZIV-KEBDBYFISA-N 349.419 3.287 50 40 EGGB CCOc1cc(/C=N/NC(=O)c2ccc(C)cc2OC)ccc1OC 408750251 YQDILROXEBMGBY-UDWIEESQSA-N 342.395 3.175 50 40 EGGB CCCOc1cccc(C(=O)NNC(=O)c2cc3c(s2)CCC3)c1 40144177 WPXFKGKEJYTXMY-UHFFFAOYSA-N 344.436 3.100 50 40 EGGB C/C(CC(=O)Nc1ccccn1)=N\NC(=O)c1ccc2ccccc2c1 100614062 NKNFZJQNUCPYEB-OEAKJJBVSA-N 346.390 3.369 50 40 EGGB Cc1cc(SC#N)cc(C)c1NC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 102634401 NINRBSUBDDSGPW-JURCDPSOSA-N 342.420 3.338 50 40 EGGB Cc1ccc(C(=O)N/N=C2\C(=O)N(CC(C)C)c3ccccc32)cc1 9871550 NAXJANDPATZVIA-UZYVYHOESA-N 335.407 3.132 50 40 EGGB Cn1cc(C(=O)NN=C2CCN(C3CCCC3)CC2)c2ccccc21 54873564 WCPXVOMPWSBHBU-UHFFFAOYSA-N 338.455 3.303 50 40 EGGB C[C@@H](NC(=O)/C(C#N)=C/c1ccco1)c1cccc(-n2ccnc2)c1 96432121 KUYDEQMHUNYEKE-DSQDWWTGSA-N 332.363 3.250 50 40 EGGB O=C(N/N=C/c1ccco1)[C@@H]1Oc2ccccc2O[C@H]1c1ccccc1 95532888 FCDVMPIMSLNVSI-RTNGMJPVSA-N 348.358 3.311 50 40 EGGB COc1cccc(/C=N/NC(=O)CSCc2ccccc2C)c1O 58669 FWMPENDAWNVADU-VXLYETTFSA-N 344.436 3.093 50 40 EGGB CCOc1ccc(/C=N/NC(=O)Cc2ccc(C)cc2)c(OCC)c1 512004 YTRUNJYJCFMOKY-KGENOOAVSA-N 340.423 3.485 50 40 EGGB O=C(CNc1ccc(F)cc1)N/N=C/c1c(O)ccc2ccccc12 252208 VSUOTFHTLRPIQO-SSDVNMTOSA-N 337.354 3.247 50 40 EGGB O=C(CSc1ccc(Cl)cc1)N/N=C/c1cccc([N+](=O)[O-])c1 343129 BRJMCBACIFIZND-RQZCQDPDSA-N 349.799 3.491 50 40 EGGB O=C(CSc1nc2ccccc2o1)N/N=C/c1ccc(F)cc1 197827 IYZNNLOIXSVDQT-GIJQJNRQSA-N 329.356 3.209 50 40 EGGB Cc1nc(N)sc1C(=O)N/N=C/c1c(Cl)cccc1Cl 139690 SSXKVBMDLXGISI-FZSIALSZSA-N 329.212 3.104 50 40 EGGB C=CCn1c(C)c(/C=C(\C#N)C(=O)NCCCOC)c2ccccc21 408862401 YLNKRQUASIGNKX-DTQAZKPQSA-N 337.423 3.195 50 40 EGGB CCOC(=O)/C(C#N)=C/c1cc([N+](=O)[O-])ccc1N1CCCCC1 9322551 USLVFGIDVITKTQ-GXDHUFHOSA-N 329.356 3.055 50 40 EGGB COc1cc(C)c(/C=N/NC(=O)c2ccc(C)cc2OC)cc1OC 408549557 UTFCKWOBRXFDFV-RGVLZGJSSA-N 342.395 3.093 50 40 EGGB CCCCNC(=O)C(=O)N/N=C/c1c2ccccc2cc2ccccc12 34872463 FGRWMKMBNXSQON-OEAKJJBVSA-N 347.418 3.359 50 40 EGGB O=C(O)[C@@H](Br)[C@@H](Br)c1ccc(F)cc1 526059823 OVVPLFMUTUDGCL-YUMQZZPRSA-N 325.959 3.110 50 40 EGGB NNC(=O)Cc1cccc(-c2nc3cc(Cl)cc(Cl)c3o2)c1 41127603 LICINEGMFYRDOU-UHFFFAOYSA-N 336.178 3.334 50 40 EGGB N#C/C(=C/c1ccccc1F)C(=O)N1CCN(c2ccccc2)CC1 255697747 YVERXOPVKPADGA-VKAVYKQESA-N 335.382 3.081 50 40 EGGB C/C(=N\NC(=O)COc1cc(C)ccc1C(C)C)c1ccncc1 5750576 ZXVPEIXOBQHEKU-RCCKNPSSSA-N 325.412 3.433 50 40 EGGB Cc1ccc2[nH]c(C(=O)N/N=C/c3ccc([N+](=O)[O-])cc3)c(C)c2c1 553215 NHULWFAIZSXIMX-VXLYETTFSA-N 336.351 3.457 50 40 EGGB COc1cc(/C=N/NC(=O)CCSc2ccccc2)ccc1O 59472997 YAPMWWYUDSJPSG-LDADJPATSA-N 330.409 3.033 50 40 EGGB C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)c1ccccc1 7517134 LAAGEQCIRPKRIA-AWEZNQCLSA-N 340.423 3.213 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2C)ccc1OCC#N 111677259 BXXSMDRZIHDSMQ-WJDWOHSUSA-N 347.374 3.452 50 40 EGGB N#C/C(=C/c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NCc1ccccc1 115834835 KXOMFBDXPLVIKF-ZSOIEALJSA-N 341.754 3.472 50 40 EGGB CC(C)=C[C@H]1[C@H](C(=O)NNC(=O)c2ccc(OC(C)C)cc2)C1(C)C 24714042 WKMRKWNACYZSRO-DLBZAZTESA-N 344.455 3.473 50 40 EGGB CC(C)Oc1ccc(/C=C(/C#N)C(N)=S)cc1Br 408542174 HIXBMCKTTMHWFV-YHYXMXQVSA-N 325.231 3.429 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(C#N)cc2F)cc1Cl 408967580 RCAUZYMJYYUOKC-AWQFTUOYSA-N 331.734 3.123 50 40 EGGB COc1ccc2nc(NNC(=O)c3ccccc3OC)sc2c1 4121400 HUIHLGCFIXAMBN-UHFFFAOYSA-N 329.381 3.070 50 40 EGGB COC(=O)/C(C#N)=C1\C=C(c2ccc(OC)cc2)Oc2ccc(O)cc21 31857592 BOSWNBDHVCTHIG-BMRADRMJSA-N 349.342 3.284 50 40 EGGB CC(C)=NNC(=O)c1sc(=S)n(CCc2ccccc2)c1N 425135 FQBVFAWYTVDRMT-UHFFFAOYSA-N 334.470 3.230 50 40 EGGB O=C1OCC[C@]1(Br)[C@@H](Br)c1ccccc1 1602842 ROIKPDSNGKFMLY-ONGXEEELSA-N 334.007 3.203 50 40 EGGB Cc1ccccc1[C@@H]1C(C#N)=C(N)N2C(=C1C#N)Nc1ccccc12 492542 BJTZMBCUUHGMNF-GOSISDBHSA-N 325.375 3.453 50 40 EGGB C[C@]1(CI)CSc2nc3ccccc3n21 500815 WNZJPCNVAMGOTF-NSHDSACASA-N 330.194 3.292 50 40 EGGB CCOC(=O)[C@H](CC)/C(C)=N\NC(=O)COc1c(C)cc(C)cc1C 408951508 JAHJHQOWBRVIPV-RUAUKMDKSA-N 348.443 3.072 50 40 EGGB O=C(CCl)Nc1ccc(I)cc1Cl 37014021 GVVRWKLTNHCFNY-UHFFFAOYSA-N 329.952 3.122 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1ccc(Br)cc1 36223927 HDMOZVPWMXENAA-ZDLGFXPLSA-N 335.176 3.281 50 40 EGGB Cc1cc(C)n(Cc2ccc(C(=O)N/N=C/c3ccc(C)o3)cc2)n1 130449 JFCWXEHJBFFGFU-RGVLZGJSSA-N 336.395 3.214 50 40 EGGB O=C(N/N=C/c1ccc(Br)s1)c1ccc(F)cc1 5672555 CPPHBGJAUWFOKM-VIZOYTHASA-N 327.178 3.414 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(C(C)(C)C)cc2)cc1O 512474 FDLNMOJZDDFSSB-UDWIEESQSA-N 326.396 3.462 50 40 EGGB COc1cc(/C=N/NC(=O)c2ccc(C(C)(C)C)cc2)ccc1O 512502 RMGSNSDUCKKNPB-UDWIEESQSA-N 326.396 3.462 50 40 EGGB C=CCSC1=C(C#N)[C@@H](c2ccc(O)c(OCC)c2)CC(=O)N1 9089115 KITQTGYIEJTTRH-GFCCVEGCSA-N 330.409 3.049 50 40 EGGB NNC(=O)c1cc2c([nH]c3ccccc32)c(CCc2ccccc2)n1 5999153 QUEAEDYFLQXWGT-UHFFFAOYSA-N 330.391 3.105 50 40 EGGB biogenic O=C(NNC(=O)c1sc2ccccc2c1Cl)c1ccncc1 347708 SJJAEXDQCSZMOJ-UHFFFAOYSA-N 331.784 3.025 50 40 EGGB CCOP(=O)(OCC)C1=C(C)OC(N)=C(C#N)[C@H]1c1cccnc1 6392889 LDMLGGXEUOODAX-CQSZACIVSA-N 349.327 3.387 50 40 EGGB Cc1nc2ccccc2n1CC(=O)NN=C1C2CC3CC(C2)CC1C3 7993523 XRNIWKMTHORZKQ-UHFFFAOYSA-N 336.439 3.273 50 40 EGGB COc1cccc(C(=O)NN=C2CCN(Cc3ccccc3)CC2)c1 59413170 FETPBZXVLOLZBO-UHFFFAOYSA-N 337.423 3.077 50 40 EGGB CC(C)(C)c1ccc(C(=O)N/N=C/c2ccc(O)c([N+](=O)[O-])c2)cc1 35409469 YPRCPBOGFULMHE-YBFXNURJSA-N 341.367 3.362 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2ccc(O)c(Br)c2)cc1 3217491 XRCCDGUDBFUELO-RQZCQDPDSA-N 333.185 3.227 50 40 EGGB Cc1ccc(CSCC(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1 59473662 LBXZITOIEJQEKJ-VCHYOVAHSA-N 343.408 3.287 50 40 EGGB CCOC(=O)C1=C(C)OC(n2cccc2)=C(C#N)[C@H]1c1cccnc1 4708332 AAHGSMVOKLFYEE-QGZVFWFLSA-N 335.363 3.226 50 40 EGGB O=C(NNC(=O)c1ccc2[nH]c3c(c2c1)CCCC3)c1ccccc1 17170361 IYDLKUQDUQLCBY-UHFFFAOYSA-N 333.391 3.122 50 40 EGGB Cc1ccc(C)n1-c1ccc(C(=O)N/N=C2/CCn3cccc32)cc1 84191433 DVHWDMAIDWDRIU-UZYVYHOESA-N 332.407 3.433 50 40 EGGB Cc1c(/C=N/NC(=O)c2cc(C(C)(C)C)n[nH]2)c2ccccc2n1C 5818111 VFVBAZHLUXJTOO-RGVLZGJSSA-N 337.427 3.271 50 40 EGGB COc1ccc2ccccc2c1/C=N/NC(=O)c1ccc(O)c(O)c1 74303 TVOPERZEGKBKAY-RGVLZGJSSA-N 336.347 3.024 50 40 EGGB in-vivo COC(=O)[C@H]1C(O)=NC(SC)=C(C#N)[C@H]1c1ccc(Cl)cc1 80970 LBDRRAQRHHONDC-VXGBXAGGSA-N 336.800 3.281 50 40 EGGB Cc1ccccc1C(=O)NNC(=O)COc1cc(C)c(Cl)c(C)c1 146462 HUXLKZLAPNXXAA-UHFFFAOYSA-N 346.814 3.105 50 40 EGGB O=C(Cc1ccccc1)NNc1ncnc2sc3c(c12)CCCC3 500813 RXVPPUHZPSHMJU-UHFFFAOYSA-N 338.436 3.256 50 40 EGGB CCOc1cc(/C=C(/C#N)c2ccccc2F)ccc1OCC(N)=O 107809958 HHVYBQZOJHHGFR-ZROIWOOFSA-N 340.354 3.153 50 40 EGGB C/C(=N\NC(=O)[C@H]1COc2ccccc2O1)c1cccc(Cl)c1 5164227 WFHKSPWGKSYUQO-YDDPGSGASA-N 330.771 3.020 50 40 EGGB COc1cccc(/C=N/NC(=O)CCCc2ccc(OC)cc2C)c1 408910092 WEAQDBICPHQPEC-KGENOOAVSA-N 340.423 3.485 50 40 EGGB Cc1cc(Cl)ccc1OCC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 242675 WIZOIKSKYYWWMB-GIJQJNRQSA-N 347.758 3.086 50 40 EGGB Cn1cccc1/C=N/NC(=O)c1ccc(OC(F)(F)C(F)F)cc1 370424 OCKOCMJVMORAPZ-AWQFTUOYSA-N 343.280 3.026 50 40 EGGB C[C@H](Oc1ccccc1)C(=O)N/N=C/c1c(O)ccc2ccccc12 93768 NNFYLENZBBRQJS-HADWXUJASA-N 334.375 3.463 50 40 EGGB CC1=C(C#N)[C@@H](c2ccco2)C(C(=O)OCc2ccccc2)=C(N)O1 125370 XFWPJFOPBRKWQE-INIZCTEOSA-N 336.347 3.105 50 40 EGGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@H]1C[C@@H]1c1ccccc1 4109641 PIPKSJQWWUXIRL-GLTYYMKBSA-N 338.451 3.154 50 40 EGGB CCCCNC(=O)C(=O)N/N=C\c1c2ccccc2cc2ccccc12 6998853 FGRWMKMBNXSQON-UCQKPKSFSA-N 347.418 3.359 50 40 EGGB C/C(=N\NC(=O)NCC1CC1)c1sc2nc(C)nc(C)c2c1C 96999480 JIENEEQEUJUZIR-KEBDBYFISA-N 331.445 3.050 50 40 EGGB CCOC(=O)[C@H]1CCC/C1=N\NC(=O)[C@@H](C)Sc1ccccc1 5332808 JFTJXEQGYCJKFG-TTZHPMMLSA-N 334.441 3.003 50 40 EGGB C/C(N)=C(\C#N)C(=O)CSc1ncc(C(F)(F)F)cc1Cl 104404776 ODHYJDMDKDLNQC-VURMDHGXSA-N 335.738 3.171 50 40 EGGB CC(C)(C)c1ccc(/C=N/NC(=O)COc2ccc(C#N)cc2)cc1 3277294 WCMLQZVMHQSGDU-LPYMAVHISA-N 335.407 3.385 50 40 EGGB C[C@H](Sc1ccc(Cl)cc1)C(=O)NN=C1CCN(C)CC1 58189438 PVXULIXHNLBYFD-NSHDSACASA-N 325.865 3.018 50 40 EGGB Cc1cccc(/C=N/NC(=O)c2ccc(Cn3nc(C)cc3C)cc2)n1 2102177 JHLUOFPQWVQRJH-CIAFOILYSA-N 347.422 3.016 50 40 EGGB C/C(CCc1cccc(C(F)(F)F)c1)=N\NC(=O)c1cnccn1 63382166 LBGMLTRJXDZANN-SSDVNMTOSA-N 336.317 3.234 50 40 EGGB Cc1ccc(-c2n[nH]c3c2[C@H](c2cccc(O)c2)C(C#N)=C(N)O3)cc1 4592496 XOBSXZKXGRADDF-MRXNPFEDSA-N 344.374 3.309 50 40 EGGB Cc1c(C(=O)N/N=C/c2ccc(OC(C)C)cc2)cccc1[N+](=O)[O-] 408865808 FUFHBAUXJZMXCK-YBFXNURJSA-N 341.367 3.454 50 40 EGGB O=C(CSCCc1ccccc1)N/N=C/c1ccccc1[N+](=O)[O-] 408726973 OCBVXSQXSWXNRV-LDADJPATSA-N 343.408 3.021 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2ccc(OC)cc2)c(OCC)c1 409142866 DQHYKIGUPHSSBA-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB COc1cc(/C=N\NC(=O)c2ccc(Cl)cc2)cc(OC)c1OC 33246207 BNWBWFSIYZNRSX-GRSHGNNSSA-N 348.786 3.130 50 40 EGGB CCOC(=O)c1cc(CC)sc1NC(=O)[C@H](C)Br 152882 BIQDVJSJYVZXJI-ZETCQYMHSA-N 334.235 3.209 50 40 EGGB N#CC1=C2S[C@@H]3CCCC[C@]3(O)N2C(=O)[C@@H](C#N)C12CCCCC2 4125514 WEZAFGUZTDLBAS-RVZJWNSFSA-N 343.452 3.032 50 40 EGGB COc1ccc(C(=O)NNc2nc3c(C)cccc3s2)c(OC)c1 4121293 BUCFXPGVALFHPH-UHFFFAOYSA-N 343.408 3.379 50 40 EGGB CCn1c(C)nc2cc(C(=O)N/N=C(\C)c3ccc(O)cc3)ccc21 20927120 JIHBMXLFHLQINS-CIAFOILYSA-N 336.395 3.224 50 40 EGGB Cc1c(-c2ccccc2)n[nH]c1C(=O)N/N=C/c1ccc(N(C)C)cc1 9041775 AAZBDYURUHPUGV-FYJGNVAPSA-N 347.422 3.215 50 40 EGGB COc1ccc2ccccc2c1[C@H]1C(C#N)=C(N)Oc2[nH]nc(C)c21 9329963 FKVPDQLJTKKVDJ-KRWDZBQOSA-N 332.363 3.098 50 40 EGGB CCOc1ccc(/C=N/NC(=O)COc2ccccc2)cc1OCC 40911362 HJVLXCVREDACBE-DEDYPNTBSA-N 342.395 3.013 50 40 EGGB O=C(NNc1ccc([N+](=O)[O-])cc1)Nc1cc(Cl)nc(Cl)c1 4280651 YMOGKPGDRNTKJI-UHFFFAOYSA-N 342.142 3.445 50 40 EGGB O=C(C(Cl)Cl)N1Cc2cc3c(cc2[C@H]2CC=CC[C@@H]21)OCO3 1711683 VQGNJGNSKWRJHO-PWSUYJOCSA-N 340.206 3.363 50 40 EGGB C#CCOc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1 4454768 BIKVYXUOLRBDQC-SFHVURJKSA-N 348.402 3.149 50 40 EGGB Cc1ccc2[nH]c(C(=O)N/N=C/c3cccc([N+](=O)[O-])c3)c(C)c2c1 1510916 WCHPXYHNLKRQJQ-VXLYETTFSA-N 336.351 3.457 50 40 EGGB CCOc1ccc(Cl)cc1/C=N/NC(=O)COc1ccccc1 408528244 UTCNPWHJJKEVTF-YBFXNURJSA-N 332.787 3.268 50 40 EGGB O=C(CCl)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 8231174 VONMDYFHNAVPTJ-UHFFFAOYSA-N 326.183 3.120 50 40 EGGB CCNC(=O)COc1ccc(/C=C(\C#N)c2nc3ccccc3[nH]2)cc1 96189822 YXKRYNNRJUAOLI-RVDMUPIBSA-N 346.390 3.142 50 40 EGGB CCn1ncc(/C=C(\C#N)C(=O)Nc2cc(Cl)ccc2OC)c1C 17071942 NUSXCIJUSGLPLA-KPKJPENVSA-N 344.802 3.419 50 40 EGGB CCn1cc(/C=C(\C#N)C(=O)Nc2cc(Cl)ccc2OC)c(C)n1 17071943 GVLHYLFWNALRFR-KPKJPENVSA-N 344.802 3.419 50 40 EGGB O=C(N/N=C/c1ccccc1N1CCOCC1)c1cc2ccccc2o1 408941141 JWJYHYODFODUOC-KGENOOAVSA-N 349.390 3.033 50 40 EGGB COC(=O)[C@@H](CO[Si](C)(C)C(C)(C)C)NC(=O)OC(C)(C)C 196007595 HKFBJRUJLJWAJR-LLVKDONJSA-N 333.501 3.075 50 40 EGGB O=C(Cn1nc(C(F)F)cc1C1CC1)N/N=C/c1ccc(F)s1 252498600 RFWCHFFJPYBJJO-NGYBGAFCSA-N 342.346 3.049 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2ccc(C)c(C)c2)cc1OC 370768 SAAVMZBVIZGVJG-UDWIEESQSA-N 326.396 3.475 50 40 EGGB O=C(N/N=C/[C@@H]1C[C@@H]2C=C[C@@H]1C2)C(O)(c1ccccc1)c1ccccc1 169620035 MEIWVLWDWOXTGU-SOEUKBEVSA-N 346.430 3.237 50 40 EGGB CCOC(=O)/C(C#N)=N/N(C(=O)c1ccccc1)c1ccc(C)cc1 5457112 YLVSQPYYJHNKKR-HEHNFIMWSA-N 335.363 3.085 50 40 EGGB Cc1ccc(C)c(OCC(=O)NNC(=O)Nc2ccc(Cl)cc2)c1 358648 CLJGKANLHZAAMX-UHFFFAOYSA-N 347.802 3.189 50 40 EGGB C=CCOc1ccc(Br)cc1/C=N/NC(=O)c1ccco1 59417854 PBIAVOOGZFIPMV-LICLKQGHSA-N 349.184 3.371 50 40 EGGB O=C(NNc1c(Cl)cc(Cl)cc1Cl)c1ccc(=O)[nH]c1 45051482 CZYYUABDGSSEMO-UHFFFAOYSA-N 332.574 3.092 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@@H]2[C@H]3CCCC[C@@]32C)c(OC)c1 408955180 OEOVXXUXGYQGDB-BDNFXNERSA-N 330.428 3.370 50 40 EGGB CC(C)COC(=O)NCC(=O)NN(c1ccccc1)c1ccccc1 408998142 AJXVOWMBZYYLAW-UHFFFAOYSA-N 341.411 3.238 50 40 EGGB COc1ccc(/C=N\NC(=O)Cc2ccc(C)cc2C)cc1OC 216041866 DGGNOSXCCZZOEE-NDENLUEZSA-N 326.396 3.013 50 40 EGGB C/C(=N\NC(=O)COc1ccc(C)c(C)c1)c1ccc([N+](=O)[O-])cc1 59195 PVIABDRYBBRKPI-XMHGGMMESA-N 341.367 3.131 50 40 EGGB Cc1cc(=O)c2c(o1)OC(N)=C(C#N)[C@@H]2c1c(Cl)cccc1Cl 125121 PENWFVIONMCANV-GFCCVEGCSA-N 349.173 3.473 50 40 EGGB CC[C@H](Br)C(=O)Nc1nc2ccc(OC)cc2s1 20132390 UGIVWOXLUJVTOX-QMMMGPOBSA-N 329.219 3.417 50 40 EGGB Cc1ccc(C(=O)N/N=C2/C(=O)N(CC(C)C)c3ccc(C)cc32)cc1 100870096 ZOIVWIFBSAHANK-ZBJSNUHESA-N 349.434 3.440 50 40 EGGB Cc1ccc(SCC(=O)NNC(=O)C[C@@H]2C[C@H]3CC[C@H]2C3)cc1 108924364 IGFLUYOAORCNET-KKUMJFAQSA-N 332.469 3.061 50 40 EGGB CCOc1ccc2ccccc2c1[C@@H]1C(C#N)=C(N)Oc2[nH]nc(C)c21 8569350 HOUPGSFNPIHVAG-GOSISDBHSA-N 346.390 3.488 50 40 EGGB Cc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N3CCOCC3)c2C)cc1 255386507 XVJLSYROUBMGQV-UYRXBGFRSA-N 349.434 3.168 50 40 EGGB Cc1ccsc1/C=N/NC(=O)c1c(C)nc2ccc(Cl)cn12 58883833 QELXXQXYJDDVSN-REZTVBANSA-N 332.816 3.430 50 40 EGGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1cc2ccccc2[nH]1 6885994 ICGDOEAOZBHGPI-UHFFFAOYSA-N 337.423 3.145 50 40 EGGB CCOC(=O)/C(C#N)=C\c1ccc(-c2ccc(OC)c([N+](=O)[O-])c2)o1 252501111 UCPGVTPYAYFRTK-WQLSENKSSA-N 342.307 3.333 50 40 EGGB O=C(CS[C@H]1CCc2ccccc21)N/N=C/c1ccccc1O 1574210 RCABVSNSNNHAIS-WAKXPGHKSA-N 326.421 3.263 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)NC2CCCCC2)c(O)c1 3232754 FPXSXTXPKPAIOR-CPNJWEJPSA-N 332.448 3.204 50 40 EGGB NNC(=O)/C=C/c1cccc(OCc2ccc(Br)cc2)c1 216896676 OGQTZCCNZZNUQZ-RMKNXTFCSA-N 347.212 3.031 50 40 EGGB C[C@@H](Nc1ccc2ccccc2c1)C(=O)N/N=C/c1ccc(O)cc1 31071 YQKCEONOBVXLBB-CNRHGSOZSA-N 333.391 3.496 50 40 EGGB O=C(N/N=C/c1cccc(Br)c1)c1ccc([N+](=O)[O-])cc1 3093558 WMTKMUATJLZKIV-CXUHLZMHSA-N 348.156 3.121 50 40 EGGB C#CCSC1=C(C#N)[C@@H](c2cccs2)C(C(=O)OCC)=C(C)N1 100855220 GDDBPZOTARKUGD-HNNXBMFYSA-N 344.461 3.374 50 40 EGGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1ccc([N+](=O)[O-])s1 354940 NPIYJAMJTRVSRS-ZDUSSCGKSA-N 345.380 3.107 50 40 EGGB COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)c1C 130902979 HPYAHHHGZWLWAR-WJDWOHSUSA-N 339.395 3.003 50 40 EGGB Cc1cc(C(=O)NNC(=O)[C@H]2C[C@H]3C=C[C@H]2C3)c(C)n1-c1ccccc1 102222632 MAUUEIYFIFXFPJ-BXWFABGCSA-N 349.434 3.067 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)c(OC)c1 6587592 DUWMYYHVYABVNG-MMVIWPHWSA-N 328.412 3.306 50 40 EGGB N#CC1=C(S)N(c2ccc(Cl)cc2)[C@H](c2ccco2)NC1=O 4513998 REZNOPAJZAEPQS-CYBMUJFWSA-N 331.784 3.233 50 40 EGGB O=C(/C=C/c1cccc(F)c1)NNC(=O)c1cc2c(s1)CCCC2 6944059 CNAHTHZTUZCJOZ-CMDGGOBGSA-N 344.411 3.240 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)ccc1O 4979253 MZSOJRLAAQYJGW-INLZJBIESA-N 328.412 3.393 50 40 EGGB COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCCCCCC2)c1C 98042512 FGUIQOFMFQYJKS-XMHGGMMESA-N 343.471 3.451 50 40 EGGB CC(C)(CCl)C(=O)N1CCC2(CC1)CC(=O)c1ccccc1O2 4505486 ONSMDGUUNJVTSX-UHFFFAOYSA-N 335.831 3.278 50 40 EGGB O=C(CCCl)N1CCN(c2nc(-c3ccccc3)cs2)CC1 4967049 GLNODJHVKLNMLU-UHFFFAOYSA-N 335.860 3.088 50 40 EGGB COS(=O)(=O)O[C@]1(SC)C=C(c2ccccc2)SS1 104139715 RTCCROIEELDMET-NSHDSACASA-N 336.481 3.347 50 40 EGGB C[C@H](Oc1ccc(/C=C(/C#N)c2nc3ccccc3[nH]2)cc1)C(=O)O 4740729 UJTQLOVNAOXUFE-GVIGZQTCSA-N 333.347 3.479 50 40 EGGB Cc1ccc(/C=N\NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)s1 408904934 QRTVKGWZZQRZKZ-PXNMLYILSA-N 329.337 3.475 50 40 EGGB O=C(N/N=C\c1ccc(F)cc1)c1cc2cc([N+](=O)[O-])ccc2o1 408904470 JZGRWYBOFOLMPI-NVMNQCDNSA-N 327.271 3.244 50 40 EGGB CN(C)c1ccc(/C=C(/C#N)C(=O)NCCCc2ccccc2)cc1 409231416 KAOCCOWRLDZYRV-CYVLTUHYSA-N 333.435 3.409 50 40 EGGB C/C(=N\NC(=O)c1ccccc1O)c1ccc(Br)cc1 4498795 VFCDBRHFTGLKDQ-LICLKQGHSA-N 333.185 3.309 50 40 EGGB C/C(N)=C(\C#N)C(=O)COC(=O)c1sc2ccccc2c1Cl 96477745 PMYHQESGGCZJGS-NTMALXAHSA-N 334.784 3.037 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C\c2ccc(OC)cc2OC)cc1 4722933 PCHVTIXBPSNUFD-UVTDQMKNSA-N 338.363 3.258 50 40 EGGB C[C@H]1CCc2sc(C(=O)N/N=C3/CCCc4c3cnn4C)cc2C1 84700197 JNLNFJDSMJSJSW-CJJSWDBDSA-N 342.468 3.077 50 40 EGGB COc1cc2c(cc1/C=N\NC(=O)c1ccc3ccccc3c1)OCO2 409103012 CKDKTZZWNOOWCU-NHDPSOOVSA-N 348.358 3.341 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)NC2CCCCC2)cc(OC)c1OC 368707 QNEOKGXLAJUZJP-NTEUORMPSA-N 344.411 3.068 50 40 EGGB Cc1cc(C(=O)O)ccc1-c1ccc(/C=C(\C#N)C(=O)NC(C)C)o1 5960737 MZWMMIJGPQLEKB-NTEUORMPSA-N 338.363 3.385 50 40 EGGB COC(=O)c1c(NC(=O)C(F)(F)F)sc(/C(C)=C\C#N)c1C 5536506 YUYIGSGZNJBLDR-XQRVVYSFSA-N 332.303 3.271 50 40 EGGB Cc1ccccc1CSCC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 59377 UBBLDHFBDMMNCY-VCHYOVAHSA-N 343.408 3.287 50 40 EGGB CCCCOC(=O)CSC1=C(C#N)[C@H](c2ccccc2)CC(=O)N1 2474156 XHTWWDXDQVSRLE-AWEZNQCLSA-N 344.436 3.102 50 40 EGGB COc1cccc(-c2n[nH]c3c2[C@H](c2ccccc2)C(C#N)=C(N)O3)c1 5911396 QAWZGBOFALNWAC-MRXNPFEDSA-N 344.374 3.303 50 40 EGGB CCOC(=O)N1CCN(C(=O)CCCC[C@H]2CCSS2)CC1 96115466 IVALGOWFKATNMI-ZDUSSCGKSA-N 346.518 3.001 50 40 EGGB biogenic N#C/C(=C\c1cn(CCOc2ccc(F)cc2)c2ccccc12)C(N)=O 348643 ZVXUVVCFKOMIQZ-SDNWHVSQSA-N 349.365 3.252 50 40 EGGB C/C(=N/NC(=O)CSc1nc2ccccc2n1C)c1cccs1 554399 QCKPIWLRGIYPHU-WQRHYEAKSA-N 344.465 3.267 50 40 EGGB CCCCN1C(=O)/C(=N\NC(=O)c2ccc(F)cc2)c2ccccc21 102949207 SKPOJBXCHKBJLW-FXBPSFAMSA-N 339.370 3.107 50 40 EGGB Cn1c(-c2ccccc2)nnc1P(c1ccccc1)c1ccccc1 102140276 XDINPWBBJAZJGJ-UHFFFAOYSA-N 343.370 3.240 50 40 EGGB CCOC(=O)[C@H]1C(O)=NC(SC)=C(C#N)[C@H]1c1ccccc1OC 9087730 LAIJDBBITHATCX-ZIAGYGMSSA-N 346.408 3.026 50 40 EGGB Cc1cc(SC#N)ccc1NS(=O)(=O)c1ccccc1C#N 9367490 OHBJLONREFQJIC-UHFFFAOYSA-N 329.406 3.241 50 40 EGGB CCOC(=O)C1=C(N)OC(c2ccccc2)=C(C#N)[C@H]1c1ccccc1 5457855 HBDFDBNLZKJQES-QGZVFWFLSA-N 346.386 3.469 50 40 EGGB O=C(NNC(=O)C1CC1)c1cc(-c2ccccc2)nc2ccccc12 15794213 LYBBAMDIMQRHJL-UHFFFAOYSA-N 331.375 3.073 50 40 EGGB COc1cc(OC)cc(C(=O)NNc2nc3ccc(C)cc3s2)c1 246139 YPAQQFYRAQPVNU-UHFFFAOYSA-N 343.408 3.379 50 40 EGGB Cc1ccc(C(=O)NNC(=O)c2cccnc2SC(C)C)c(C)c1 40120850 SPKFUFJXEXSFJO-UHFFFAOYSA-N 343.452 3.274 50 40 EGGB Cc1ccc([C@@]23C=C[C@](c4ccccc4)(C2)[C@H]2C(=O)OC(=O)[C@@H]23)cc1 104258051 NGVNZZVUDLWVTA-MCEIDBOGSA-N 330.383 3.460 50 40 EGGB CCOc1cc(/C=N\NC(=O)Cc2ccc(C)cc2C)ccc1OC 216043769 KFUJIVXUFARUBX-BKUYFWCQSA-N 340.423 3.404 50 40 EGGB COc1cccc2cc(C(=O)N/N=C/c3ccccc3OCC#N)oc12 15227551 ILITWXNRNOTNJY-CIAFOILYSA-N 349.346 3.108 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)c2ccc3c(c2)OCO3)cc1 3474771 GCNFCINQKNKFJB-UDWIEESQSA-N 339.395 3.025 50 40 EGGB COc1cccc(/C=N/NC(=O)CSCc2ccccc2)c1OC 5361698 CGICLWNKTLEKLD-YBFXNURJSA-N 344.436 3.087 50 40 EGGB O=C(CC(=O)NC1CCCCC1)N/N=C/c1cccc2ccccc12 335774 PUVDFSOBMUWYFR-KGENOOAVSA-N 337.423 3.129 50 40 EGGB O=C(NNC(=O)c1ccc(-c2cccc(Cl)c2)o1)c1ccncc1 569216 JUWYUVDPQNDZNZ-UHFFFAOYSA-N 341.754 3.070 50 40 EGGB CCCNC(=O)/C(C#N)=C/c1ccc(OC(=O)C(C)(C)C)c(OC)c1 1810813 OYEXDJOKMJJNIW-GXDHUFHOSA-N 344.411 3.080 50 40 EGGB O=C(NNC(=O)c1cc(Cl)nc2ccccc12)c1ccccc1F 12985289 WIOGTFBUACOWSE-UHFFFAOYSA-N 343.745 3.102 50 40 EGGB CC(=O)N(c1nc(/C=C(/C#N)C(=O)O)cs1)c1ccc(F)cc1F 70037677 KANFCBCSKWUSQB-WTKPLQERSA-N 349.318 3.097 50 40 EGGB COc1ccc(/C=N/NC(=O)COc2c(C)cccc2C)c(C)c1 408914292 NTGDSHIDRHKWEA-RGVLZGJSSA-N 326.396 3.150 50 40 EGGB COc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1Cl 408895600 NLUKNIKQSARYNJ-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C/c2cccc(OC(C)=O)c2)cc1 408754285 PTKSKQSKJOXACD-XNTDXEJSSA-N 336.347 3.166 50 40 EGGB COc1cccc(/C=N/NC(=O)c2ccc(Br)cc2)c1 3468809 UWMZZTJTQIITRL-LICLKQGHSA-N 333.185 3.222 50 40 EGGB C=C[Si]1(C)O[Si@@](C)(C=C)O[Si](C)(C)O[Si@](C)(C=C)O1 2002125854 FBXTUBNFTGCQPZ-ROUUACIJSA-N 332.653 3.160 50 40 EGGB COc1ccc(-c2ccc([C@@H]3C(C#N)=C(N)Oc4n[nH]c(C)c43)o2)cc1 9087844 JKTOYRRIZGTMHN-KRWDZBQOSA-N 348.362 3.205 50 40 EGGB CC1=CC(C)(C)N(C)c2ccc(/C=N/NC(=O)c3ccccn3)cc21 208440787 XOUVLMCMIOOVIE-LPYMAVHISA-N 334.423 3.477 50 40 EGGB CCn1c2ccccc2c2cc(/C=C(\C#N)C(=O)NCCOC)ccc21 5014903 UYTBXWDHKBZYKJ-FOWTUZBSSA-N 347.418 3.484 50 40 EGGB CCCOc1ccccc1/C=N/NC(=O)c1cc(OC)cc(OC)c1 8811093 NPCINMXBSUXVPM-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB CCOC(=O)/C(C#N)=C1\C[C@H](C)CC[C@H]1C(SC)=C(C#N)C#N 59662395 AEWZDTPSKXPNPT-GMDGFYHASA-N 329.425 3.470 50 40 EGGB Cc1nc(SCCS(=O)(=O)F)c2c3c(sc2n1)CCCC3 104838415 KQNYLXXVJRTNFQ-UHFFFAOYSA-N 346.474 3.270 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)C(C)C)cc(OC)c1OC(F)F 44027156 YWRGHXLGKJTDBU-VZUCSPMQSA-N 325.311 3.437 50 40 EGGB C/C(=N\NC(=O)c1ccccc1Br)c1ccc(O)cc1 14017987 CMONUNFQZRWLQD-LICLKQGHSA-N 333.185 3.309 50 40 EGGB N#C/C(=C/c1c[nH]nc1-c1ccc(F)cc1)C(=O)NCc1ccco1 5728935 GLDTYRIVWBUNIT-JYRVWZFOSA-N 336.326 3.032 50 40 EGGB CN(C)c1cccc(C(=O)N/N=C/c2cccn2-c2ccc(O)cc2)c1 409022132 FTVXETCHLABYJL-KGENOOAVSA-N 348.406 3.013 50 40 EGGB CCOc1ccc(Cl)cc1/C=N\NC(=O)Cc1cccc(OC)c1 409097562 OEVOVPKOCMQWNR-NDENLUEZSA-N 346.814 3.440 50 40 EGGB COc1cc(I)ccc1CBr 238364700 WUCUXLUUWBYZKE-UHFFFAOYSA-N 326.959 3.195 50 40 EGGB O=C(CBr)c1cc(F)c(F)c(Br)c1F 675050504 LQFJIXRRHRMJSH-UHFFFAOYSA-N 331.913 3.444 50 40 EGGB O=C(COc1ccc(Cl)cc1)N/N=C\c1c[nH]c2ccccc12 5776812 LYZSMACMAIGKOD-JMIUGGIZSA-N 327.771 3.350 50 40 EGGB Cc1ccc(NNC(=O)[C@@](O)(c2ccccc2)c2cccs2)cc1 175570 JVNDXVUXXODWBD-LJQANCHMSA-N 338.432 3.436 50 40 EGGB COc1ccc(/C=N/NC(=O)CSc2ccc(C)cc2)cc1OC 8515425 FRQVDEUXRROPAD-YBFXNURJSA-N 344.436 3.255 50 40 EGGB Cc1cc(/C=N/NC(=O)c2ccncc2)c(C)n1-c1ccc(F)cc1 58928355 DSXUIBLTVRCMIF-WSDLNYQXSA-N 336.370 3.392 50 40 EGGB Cc1cc(Br)cc(/C=N/NC(=O)c2ccccc2)c1O 4784664 UMKAEIZVBLGCCC-RQZCQDPDSA-N 333.185 3.227 50 40 EGGB Cc1ccc(NC(=O)N/N=C\c2ccc(O[C@@H](C)C(=O)O)cc2)cc1 408819314 PXKWYKBOKHIMLO-JFENUBAZSA-N 341.367 3.003 50 40 EGGB Cc1cc(/C=N/NC(=O)c2ccccc2N)c(C)n1-c1ccccc1 408587791 HIFDSYVPZMWAEO-LPYMAVHISA-N 332.407 3.440 50 40 EGGB CCCOc1ccc(C(=O)N/N=C\c2cccc(OC)c2)cc1OC 409335720 XENZSRSAPAHLMQ-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB O=C(NN=Cc1cccc(Cl)c1)C(=O)Nc1ccccc1Cl 252602444 FIINAEMLIMYSIW-UHFFFAOYSA-N 336.178 3.082 50 40 EGGB O=C(NNC(=S)NC1CCCCC1)C12CC3CC(CC(C3)C1)C2 5566719 ZOLMGNOMKCVWKK-UHFFFAOYSA-N 335.517 3.031 50 40 EGGB N#C/C(=C\c1cc(Br)cs1)C(=O)NCc1cccnc1 20479358 PGTHPHFOIQKLFN-NYYWCZLTSA-N 348.225 3.129 50 40 EGGB CN1CCC(=NNC(=O)c2ccc(COc3ccccc3)cc2)CC1 57945403 UHRRDSDVLWNKDM-UHFFFAOYSA-N 337.423 3.077 50 40 EGGB CC1(C)C(Br)=C(Br)C(=O)[C@H]1Br 159521 GDOWPVPCUGJNFA-ZCFIWIBFSA-N 346.844 3.360 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)COc2ccc(C)c(C)c2)cc1 50096 ZVHITTFFDXHSRI-HMMYKYKNSA-N 326.396 3.231 50 40 EGGB Cc1c(/C=N/NC(=O)[C@@H](C)Oc2ccccc2)c2ccccc2n1C 2072770 FXOYODJLLXBKGK-NWGMWSOJSA-N 335.407 3.404 50 40 EGGB Cc1cc(/C=N/NC(N)=O)c(C)n1-c1cc(Cl)ccc1Cl 3174989 JZMHYPUCIWUAKS-CNHKJKLMSA-N 325.199 3.403 50 40 EGGB Cc1ccc(C(=O)c2cc3c(cc2NC(=O)CCl)OCCO3)cc1 9584606 BLOIQKFAQHLUSP-UHFFFAOYSA-N 345.782 3.175 50 40 EGGB O=C(NNc1ccc([N+](=O)[O-])cn1)Nc1cc(Cl)ccc1Cl 20031211 FZGRDRCDVCRODC-UHFFFAOYSA-N 342.142 3.445 50 40 EGGB CC(C)c1cc(C(=O)NNC(=S)N[C@@H]2C[C@@H]3CC[C@@H]2C3)cs1 102242893 WOLDFDYREUJZAJ-NQBHXWOUSA-N 337.514 3.169 50 40 EGGB COc1ccccc1C(=O)NN=C1CCN(Cc2ccccc2)CC1 55074169 GNQMDGIZKSASCF-UHFFFAOYSA-N 337.423 3.077 50 40 EGGB O=C(N/N=C/c1ccc(Cl)cc1Cl)c1[nH]nc2c1CCCC2 8683413 MWUVIQSCMJOHJZ-QGMBQPNBSA-N 337.210 3.359 50 40 EGGB C/C(=N/NC(=O)c1ccco1)c1ccc(NC(=O)c2cccnc2)cc1 4179542 PFJRPJLYLPYCLS-XKZIYDEJSA-N 348.362 3.081 50 40 EGGB COCCOC(=O)/C(C#N)=C/c1cccn1-c1ccc(Cl)cc1 408936859 GGWIIGOQQRVQHJ-ACCUITESSA-N 330.771 3.227 50 40 EGGB C/C(=N\NC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc(Cl)cc1 409045674 GYXJXXMNEPCPOG-RQZCQDPDSA-N 333.731 3.108 50 40 EGGB CC(C)(C)OC(=O)NCC(=O)NN(c1ccccc1)c1ccccc1 47219368 WINUBJVJBXKHIQ-UHFFFAOYSA-N 341.411 3.381 50 40 EGGB CC(C)N(C(=O)OC(C)(C)C)[C@H]1CC[C@H](NC(=O)CCl)CC1 252517369 GWTYPJIOEIGPDY-JOCQHMNTSA-N 332.872 3.298 50 40 EGGB Cc1cc(C(=O)O)ccc1-c1ccc(/C=N\NC(=O)c2ccncc2)o1 6759258 SBKHRYBZFCFCNI-NHDPSOOVSA-N 349.346 3.112 50 40 EGGB O=P(CI)(c1ccccc1)c1ccccc1 522741 XLKNCVNSZRYDJA-UHFFFAOYSA-N 342.116 3.393 50 40 EGGB O=C(COc1ccc(Cl)cc1Cl)N/N=C1/C[C@H]2C=CC[C@@H]12 5670675 UMUJMDVIMPFHEB-XLZVPMNYSA-N 325.195 3.440 50 40 EGGB COc1ccccc1C(=O)N/N=C/c1ccc(N2CCCC2)c(F)c1 409104782 ICXXVZWQFCJVGS-FYJGNVAPSA-N 341.386 3.198 50 40 EGGB COc1ccccc1N1CCN(C(=O)[C@H](Cl)c2ccccc2)CC1 5611900 MAKRAEGABLJRAF-GOSISDBHSA-N 344.842 3.324 50 40 EGGB Cc1ccc(SCC(=O)NNC(=O)C[C@H]2C[C@H]3CC[C@@H]2C3)cc1 6428917 IGFLUYOAORCNET-RRFJBIMHSA-N 332.469 3.061 50 40 EGGB Cc1ccc(SCC(=O)NNC(=O)C[C@H]2C[C@H]3CC[C@H]2C3)cc1 108924367 IGFLUYOAORCNET-SOUVJXGZSA-N 332.469 3.061 50 40 EGGB O=C(CC(c1ccccc1)c1ccccc1)NNC(=O)c1ccncc1 12846732 NCPYFSMGRPARBG-UHFFFAOYSA-N 345.402 3.065 50 40 EGGB Clc1cc(I)cc2c1OC[C@H](Cl)C2 4183013 MAYBFARWZZSLDO-ZCFIWIBFSA-N 328.964 3.487 50 40 EGGB Cc1cc(/C=C(\C#N)C(=O)OCC(=O)OC(C)C)c(C)n1CC(C)C 14852693 JLCISEYWOCTUIH-CAOOACKPSA-N 346.427 3.163 50 40 EGGB N#C/C(=C\c1cc(Cl)ccc1O)C(=O)Nc1cccc([N+](=O)[O-])c1 408893809 FWINVZSMOFTZEY-IZZDOVSWSA-N 343.726 3.499 50 40 EGGB C=CCOc1ccc([C@@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)cc1Cl 409135603 ZGPDPRDLDJTXLF-OAHLLOKOSA-N 342.786 3.155 50 40 EGGB COc1ccc(C(=O)N/N=C/c2ccc(SC)cc2)cc1OC 3474702 CODCUSGLNVJFHX-WOJGMQOQSA-N 330.409 3.190 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@@H]2[C@H]3CCCC[C@@]32C)cc1[N+](=O)[O-] 100177037 MSIQBURIIGTNAF-PDDJDMFCSA-N 345.399 3.270 50 40 EGGB Cc1ccccc1OCC(=O)N/N=C/c1cccc(Br)c1 3152127 GXTCBARURQYLAS-VCHYOVAHSA-N 347.212 3.287 50 40 EGGB COc1cc(/C=N/NC(=O)c2ccccc2Cl)cc(Cl)c1O 7893815 VACVWXBCTULIHQ-QGMBQPNBSA-N 339.178 3.472 50 40 EGGB C/C(CC(=O)Nc1cccc(F)c1)=N\NC(=O)c1cccc(F)c1 101158789 WAVUAVYTQFEQHF-SRZZPIQSSA-N 331.322 3.099 50 40 EGGB O=C(NNc1ccc(F)cc1)[C@@H]1CC(c2ccc(Cl)s2)=NO1 56422206 AZCHYEWUMGOCHN-NSHDSACASA-N 339.779 3.177 50 40 EGGB O=C(N/N=C\c1ccc(O)cc1)[C@@H](c1ccccc1)N1CCCCC1 104083018 LOOMXCCCBNBOIO-CBAAQYGVSA-N 337.423 3.070 50 40 EGGB C=CCOc1ccc(Br)cc1/C=C(\C#N)C(=O)NCC 408818158 YBGVTDIVNFUHOZ-XYOKQWHBSA-N 335.201 3.057 50 40 EGGB CCn1c(C)c(/C=N/NC(=O)[C@H](O)c2ccccc2)c2ccccc21 409268055 XXVMWBPFZYFFAB-DBRLUCFCSA-N 335.407 3.153 50 40 EGGB CCOc1ccc(/C=N\NC(=O)Cc2ccc(F)cc2)c(OCC)c1 409236195 RYAPWHDIZRRLOO-BKUYFWCQSA-N 344.386 3.316 50 40 EGGB CCc1ccc(/C(C)=N/NC(=O)Cc2ccc(OC)c(OC)c2)cc1 5716660 SLWLTPRJWPVSPZ-KGENOOAVSA-N 340.423 3.349 50 40 EGGB Cc1cc(C)nc(SCC(=O)N/N=C\C=C\c2ccccc2)n1 12446247 VPZMWWQUWBBGKL-CVCOPPNTSA-N 326.425 3.001 50 40 EGGB CN1C[C@H](C(C)(C)C)CO[P@]1(=O)N(CCCl)CCCl 1568725 QXKUWRBLVIWSBG-WLRWDXFRSA-N 331.224 3.498 50 40 EGGB BrCC(Br)(Br)Br 8585893 RVHSTXJKKZWWDQ-UHFFFAOYSA-N 345.654 3.220 50 40 EGGB Cn1c(/C(C#N)=C\c2ccc([N+](=O)[O-])cc2)nnc1-c1ccccc1 60037073 JHAZDNAHOHZXLF-PTNGSMBKSA-N 331.335 3.454 50 40 EGGB C/C(=N\NC(=O)COc1ccc(C#N)cc1)c1cccc(Cl)c1 5164434 MBRFCUUCEYHKSP-UDWIEESQSA-N 327.771 3.131 50 40 EGGB COc1ccc(OCC(=O)N/N=C2/CCCCc3ccccc32)cc1 6470150 VXTQKDDVYKABOO-VZCXRCSSSA-N 338.407 3.321 50 40 EGGB COc1ccc([C@@H]2C(C#N)=C(N)OC(C(C)(C)C)=C2C#N)c(OC)c1 4775492 AHDYAVRRQRTNOP-INIZCTEOSA-N 339.395 3.335 50 40 EGGB COc1ccc(/C=N/NC(=O)c2cc(Cl)ccc2OC)cc1OC 6793866 OYHVHIUZDKKEDY-VXLYETTFSA-N 348.786 3.130 50 40 EGGB N#C/C(=C/c1ccc(OCc2c(F)cccc2Cl)cc1)C(N)=O 408600557 DGOWGTMUBGWOGZ-WQLSENKSSA-N 330.746 3.450 50 40 EGGB Cc1cc(/C=N/NC(=O)CC#N)c(C)n1-c1ccc2ncccc2c1 408968456 YZHULFZWJOBJBP-WSDLNYQXSA-N 331.379 3.006 50 40 EGGB CCOc1cc(/C=N\NC(=O)c2cn(C)c3ccccc23)ccc1O 33333473 XSZIFHVXLFNKEI-JAIQZWGSSA-N 337.379 3.047 50 40 EGGB COc1ccc(CC(=O)N/N=C/c2c(C)n(C)c3ccccc23)cc1 573192 GACWOVFCXBKJBR-FYJGNVAPSA-N 335.407 3.188 50 40 EGGB C[C@H]1[C@@H](C)N(C(=O)CCCl)c2ccccc2N1C(=O)CCCl 1713560 JVSATVSUNHATHC-TXEJJXNPSA-N 343.254 3.401 50 40 EGGB N#C/C(=C\c1ccc(-c2cccc(Cl)c2)o1)C(=O)Nc1nnc[nH]1 11692808 ZRPJVKVZKTVIQQ-YRNVUSSQSA-N 339.742 3.264 50 40 EGGB C/C(=N\NC(=O)Cc1ccc2c(c1)OCO2)c1ccc(Cl)cc1 409084892 YDOIGOIFIWEQGX-YBFXNURJSA-N 330.771 3.152 50 40 EGGB Cc1cccc(NC(=O)/C(C#N)=C\c2ccc(O)c([N+](=O)[O-])c2)c1C 211574465 IGEODRDYTQAAOX-ZSOIEALJSA-N 337.335 3.463 50 40 EGGB C[C@@H](Br)C(=O)NC[C@H](OCC1CC1)c1ccccc1F 95097945 GQXCQUKGJJGJFG-YGRLFVJLSA-N 344.224 3.193 50 40 EGGB O=C(COc1ccccc1)NNc1nc2c(Cl)cccc2s1 4121375 GCQCFPDUFDQILO-UHFFFAOYSA-N 333.800 3.472 50 40 EGGB O=C(N/N=C/c1ccccc1C(=O)O)c1ccc(Cl)cc1Cl 41213649 ZPTIGFIJJINGQE-QGMBQPNBSA-N 337.162 3.456 50 40 EGGB Cc1ccc(C(=O)NNC(=O)c2ccc(OCC(C)C)cc2)cc1 2629722 RRXLVNBCQWZLJG-UHFFFAOYSA-N 326.396 3.105 50 40 EGGB Cc1ccn2c(C(=O)N/N=C\c3ccccc3Cl)c(C)nc2c1 32125477 JXHFMMOQDWFYHR-GRSHGNNSSA-N 326.787 3.368 50 40 EGGB COC(=O)c1ccccc1NC(=O)/C(C#N)=C/c1ccc(OC)cc1 140260 SGOCKMDPCATYKC-SDNWHVSQSA-N 336.347 3.027 50 40 EGGB C[C@H](Oc1ccc(Cl)cc1)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 353695 LSCFRXVUDRXROT-HPAYWCODSA-N 347.758 3.166 50 40 EGGB CC[C@H](C)c1ccc(OCC(=O)N/N=C/c2cccc(O)c2)cc1 1320253 DFMOLUAOGVSRES-PVGUKEHMSA-N 326.396 3.435 50 40 EGGB Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N/N=C/c1ccc(N(C)C)o1 2768070 OAPFUNDCQZJTBJ-NJDFMEINSA-N 349.818 3.225 50 40 EGGB COc1ccc(/C=N/NC(=O)CSCc2ccc(C)cc2)cc1 59473363 JJVPHRJRKYEDLU-YBFXNURJSA-N 328.437 3.387 50 40 EGGB CC(C)C(=O)Nc1ccc(NC(=S)NC(=O)CCCCl)cc1 6238802 YCEMRFQQKBGAFD-UHFFFAOYSA-N 341.864 3.113 50 40 EGGB COc1ccc(CCCC(=O)N/N=C/c2ccccc2O)c(C)c1 408907384 MVGUSHZTHNLHRW-DEDYPNTBSA-N 326.396 3.182 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)COc2cc(C)cc(C)c2)cc1 345246 XBEYGLDRDDAVRX-HMMYKYKNSA-N 326.396 3.231 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)c2ccc(OC)cc2)cc1OC 8228904 KYYGHMRBSMFQLW-DEDYPNTBSA-N 340.379 3.033 50 40 EGGB O=C1OC(=O)[C@@H]2[C@@H]1C1(Cl)c3ccccc3C2(Cl)c2ccccc21 101660246 CTMYKTZXKOHVNC-DIOPXHOYSA-N 345.181 3.294 50 40 EGGB Cc1cc2c(c(=O)n1C)[C@@H](c1ccc(C(C)C)cc1)C(C#N)=C(N)O2 2219096 QXQJPEKXYAFSHT-KRWDZBQOSA-N 335.407 3.035 50 40 EGGB CCOc1ccc(N2C(=O)C[C@@]3(C[C@H](Cl)N=N3)C2=O)cc1Cl 4498636 OOFPJBMNIDQFGG-RISCZKNCSA-N 342.182 3.162 50 40 EGGB COC[C@@H](C)Oc1ccc2nc(NC(=O)[C@@H](C)Cl)sc2c1 20132125 RUMHHPXTRVTUPD-RKDXNWHRSA-N 328.821 3.276 50 40 EGGB C[C@@H]1CCc2sc(C(=O)N/N=C3/CCCc4c3cnn4C)cc2C1 84700195 JNLNFJDSMJSJSW-QTVDBSQPSA-N 342.468 3.077 50 40 EGGB CC(=O)Oc1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)cc1 408797704 GWYGVMLFIINUFI-IFHBQSJKSA-N 326.396 3.214 50 40 EGGB CCOc1cc(/C=N/NC(=O)Cc2ccc(Cl)cc2)ccc1O 45334172 HFBCEYKDHXIIJD-YBFXNURJSA-N 332.787 3.137 50 40 EGGB O=C(CBr)c1cc(F)c([N+](=O)[O-])cc1Br 258833887 NCTHIKYEQPKEGU-UHFFFAOYSA-N 340.930 3.074 50 40 EGGB Cc1[nH]c2ccccc2c1/C=N/NC(=O)c1cccc([N+](=O)[O-])c1C 370298 AOKGFSLJAPHQLI-VXLYETTFSA-N 336.351 3.457 50 40 EGGB COc1cccc(/C=N/NC(=O)CSCc2ccccc2C)c1 58915534 INASLWSXGWHTAY-YBFXNURJSA-N 328.437 3.387 50 40 EGGB CCOc1ccc(NC(=S)NNC(=O)c2ccccc2Cl)cc1 5274165 RECLXVVRYSOTRU-UHFFFAOYSA-N 349.843 3.370 50 40 EGGB Cc1cccc(/C=N/NC(=O)CNc2ccc3ccccc3c2)c1O 220732 XERHXWPBKUKISW-WSDLNYQXSA-N 333.391 3.416 50 40 EGGB CCCOc1ccc(C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1 2326309 GUGCCVZICUQLBX-LDADJPATSA-N 327.340 3.148 50 40 EGGB Cc1cccc(C)c1NC(=O)CCC(=O)N/N=C/c1cccs1 59483827 ZAXPZSWTHUHCDY-WOJGMQOQSA-N 329.425 3.234 50 40 EGGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)c2ccccc12 6812816 RYXHKRYVLWXRRF-QGZVFWFLSA-N 332.363 3.098 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)NCCCc2ccccc2)ccc1O 409234286 KGUKELSRNZCVDS-ATVHPVEESA-N 336.391 3.057 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2cccc(OC3CSC3)c2)cc1 408825744 FUPWPXBRRXNWFJ-VXLYETTFSA-N 326.421 3.253 50 40 EGGB COc1ccc(/C=N\NC(=O)c2cc3ccccc3o2)cc1[N+](=O)[O-] 408818077 XUGNQQHXUZZDEY-ZDLGFXPLSA-N 339.307 3.114 50 40 EGGB C=CCc1cc(/C=C(/C#N)C(=O)NC2CCCC2)cc(OCC)c1O 33721887 XNMBOVJNUYJQBY-WJDWOHSUSA-N 340.423 3.485 50 40 EGGB COc1ccc(CCNC(=O)c2ccc(CCl)cc2)cc1OC 98071656 NNWATHCNQIEIJW-UHFFFAOYSA-N 333.815 3.415 50 40 EGGB CCCn1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c(C)n1 253409222 ZUXIGYJEGNRHKD-MRXNPFEDSA-N 340.427 3.052 50 40 EGGB CCOC(=O)CCOc1ccccc1N(CCCl)CCCl 1675162 RDHGJYADXANUES-UHFFFAOYSA-N 334.243 3.303 50 40 EGGB C=CCN1C(=O)C(C#N)=C(C)/C(=C/Nc2cccc(Cl)c2)C1=O 102471811 LDKHUOLNRBVXDA-GDNBJRDFSA-N 327.771 3.031 50 40 EGGB CC(C)Oc1ccc(/C=N/NC(=O)CCc2ccccc2)c(O)c1 408590706 QJIUBXCCYKFONQ-DEDYPNTBSA-N 326.396 3.262 50 40 EGGB C[C@H]1CCc2nc3ccccc3c(C(=O)NNC(=O)c3ccoc3)c2C1 75126248 RWSLYODPKCEKGP-LBPRGKRZSA-N 349.390 3.027 50 40 EGGB CCn1cc(/C=N/NC(=O)c2ccc(OC)cc2O)c2ccccc21 409393448 XJHJLLONPLCHSR-RGVLZGJSSA-N 337.379 3.139 50 40 EGGB CC(C)N(C(=O)CCl)[C@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C 79392569 VBTAOJBKULDHHG-STQMWFEESA-N 332.872 3.298 50 40 EGGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3c2ccc2[nH]ccc32)cc1OC 79493558 PDVWBJWZSAOWFW-SFHVURJKSA-N 347.374 3.403 50 40 EGGB COc1cc(C)c(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc1C(C)C 33900072 NLYWXDVGIOEEEB-NDCSFFLDSA-N 342.439 3.329 50 40 EGGB CCC[C@@H](Br)C(=O)NCCC(=O)Nc1ccc(C)cc1 8733088 FGFSZYMNUVZQDO-CYBMUJFWSA-N 341.249 3.003 50 40 EGGB COc1ccc(NC(=O)C(=O)NN=C2CCC(C(C)(C)C)CC2)cc1 59435600 SJLARJLAFHGOQH-UHFFFAOYSA-N 345.443 3.342 50 40 EGGB C[C@H](Sc1ccccc1)C(=O)N/N=C/c1ccc2c(c1)OCO2 313819 LUCYLOJJKLVYGL-NNLQFVHNSA-N 328.393 3.046 50 40 EGGB CCOc1ccccc1/C=N/NC(=O)c1ccc(N2CCCC2)cc1 7385637 CAEXNSUOBURXSH-RCCKNPSSSA-N 337.423 3.449 50 40 EGGB C/C(CC(=O)Nc1ccc(F)cc1)=N\NC(=O)c1cccc(F)c1 14921455 CIDGCEYQNIZXGY-SRZZPIQSSA-N 331.322 3.099 50 40 EGGB C[C@H](SCc1ccccc1)C(=O)N/N=C/c1ccccc1C(=O)O 20246303 VVQOEHQROGRULL-MDBUFAAASA-N 342.420 3.157 50 40 EGGB Cc1cc(C(=O)NNC(=O)Cc2ccc(Cl)c(Cl)c2)c(C)o1 6789245 IGDLTVWKKWZWOE-UHFFFAOYSA-N 341.194 3.207 50 40 EGGB CCOC(=O)N[C@@H](CC(=O)N/N=C/c1ccccc1)c1ccccc1 408979984 PCHRRJXNMZLGFT-TYSUYXETSA-N 339.395 3.014 50 40 EGGB CCOC(=O)[C@@]1(C#N)C(N)=C(C#N)C2=C(CCC2)[C@@H]1c1ccccc1 35193595 JPYJMELVGHVDJM-FXAWDEMLSA-N 333.391 3.074 50 40 EGGB CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc(N(C)C)o2)cc1 39127473 YXDHVKBWCGCTHN-QBFSEMIESA-N 325.368 3.290 50 40 EGGB CCOc1ccc(/C(C)=N\NC(=O)c2ccccc2[N+](=O)[O-])cc1 32564179 QSRWYODOBSWATK-PDGQHHTCSA-N 327.340 3.148 50 40 EGGB COc1ccc(CBr)cc1I 169796339 UGGHGMVOEHPMRV-UHFFFAOYSA-N 326.959 3.195 50 40 EGGB COc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1cccc(Cl)c1 265919 CBNOPFCANHCPCF-VGOFMYFVSA-N 342.782 3.320 50 40 EGGB COCc1c(C(=O)NNc2ccccc2[N+](=O)[O-])oc2ccccc12 32780760 DAKJEABDXROLRK-UHFFFAOYSA-N 341.323 3.244 50 40 EGGB COc1cc(Br)c([C@H](Br)C#N)cc1OC 1706030 NYOJEBWUFDEKKX-MRVPVSSYSA-N 334.995 3.426 50 40 EGGB N#C/C(=C\c1ccccc1[N+](=O)[O-])S(=O)(=O)c1ccc(F)cc1 3588632 QSYARXVMDGSNDQ-NTEUORMPSA-N 332.312 3.072 50 40 EGGB CCN(CC)c1ccc(/C=N\NC(=O)c2ccc(F)cc2)c(O)c1 13838080 VUSKOYHTQMJAMU-NDENLUEZSA-N 329.375 3.141 50 40 EGGB CCOc1ccccc1/C=N/NC(=O)COc1c(C)cccc1C 516786 UNDIGLSHQWONQL-UDWIEESQSA-N 326.396 3.231 50 40 EGGB COc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)c2ccccc12 6812812 RYXHKRYVLWXRRF-KRWDZBQOSA-N 332.363 3.098 50 40 EGGB CC[C@H](C)NC(=O)/C(C#N)=C/c1ccc(-c2ccccc2C(=O)O)o1 408804890 ZWHNRTRGHITLPD-CVCOIXHCSA-N 338.363 3.466 50 40 EGGB Cn1cccc1CC(=O)N/N=C\C(Br)=C\c1ccccc1 33720997 BDZOKGJYYRAXML-WVOAVMQWSA-N 346.228 3.106 50 40 EGGB COc1ccc(CN2C(=O)C[C@H](O[Si](C)(C)C(C)(C)C)C2=O)cc1 196081117 KCRXJXBLIQRFQX-HNNXBMFYSA-N 349.503 3.345 50 40 EGGB N#CCOc1ccccc1P(=O)(c1ccccc1)c1ccccc1 38141385 QBZJODXUWKTSHW-UHFFFAOYSA-N 333.327 3.228 50 40 EGGB biogenic O=C(Cc1ccc(F)cc1)N/N=C\C=C\c1ccccc1[N+](=O)[O-] 208299466 VJEWAWZGLOINHS-QPZXCGJUSA-N 327.315 3.092 50 40 EGGB Cc1ccc(Cl)cc1-n1c(C)cc(/C=N/NC(=O)CC#N)c1C 573895 MZTZPMUGVZFUGE-KEBDBYFISA-N 328.803 3.420 50 40 EGGB CCCC(CCC)=NNC(=O)Cc1nc2sc(C)c(C)c2c(=O)[nH]1 8045571 OUXQWARKXABJOY-UHFFFAOYSA-N 348.472 3.216 50 40 EGGB O=C(N/N=C/C=C\c1ccc(Br)cc1)c1cccnc1 4671928 YYXNNEQQWAHYDZ-GXNHBYRYSA-N 330.185 3.273 50 40 EGGB CCc1cc(Br)c2c(c1)N[C@]1(C=C(C)OC(N)=C1C#N)O2 40545194 ONYRIIHGILJGMK-OAHLLOKOSA-N 348.200 3.140 50 40 EGGB C[C@@H](Br)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1 95097957 JHPMFIDEPHIQEL-SKDRFNHKSA-N 332.625 3.023 50 40 EGGB O=C(NNC(=O)c1sc2ccccc2c1Cl)c1ccccc1O 5392478 REZJPMZQHVGIBS-UHFFFAOYSA-N 346.795 3.335 50 40 EGGB COc1ccc(C(=O)NN)cc1OCc1ccc(Cl)cc1Cl 226318957 RNKQIXCAVVNPOY-UHFFFAOYSA-N 341.194 3.185 50 40 EGGB CC1(C)[C@@H]2CC[C@@](C(=O)O)(C2)[C@]1(Br)CBr 2137309 OSNJXUXPWZALOC-GGVZMXCHSA-N 340.055 3.426 50 40 EGGB O=C(N/N=C\c1cccc(F)c1)C(O)(c1ccccc1)c1ccccc1 38196351 WSFZCSDJQLHUDR-HAHDFKILSA-N 348.377 3.212 50 40 EGGB NC(=O)N/N=C/c1cccc(OCc2ccc(Br)cc2)c1 41213828 UWUQUPVZNJVOTH-GIJQJNRQSA-N 348.200 3.030 50 40 EGGB COc1cccc(-c2nnc(SCCCCl)n2C)c1OC 228926069 STFZKFKPTZFGMJ-UHFFFAOYSA-N 327.837 3.220 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)c2ccsc2)c([N+](=O)[O-])cc1OC 44028030 CZNJDDMSEGYMPY-XGICHPGQSA-N 344.348 3.463 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)C(=O)NC2CCCCCC2)cc1 6201341 RPWWTYBFRSKNFN-DEDYPNTBSA-N 329.444 3.099 50 40 EGGB O=C(N/N=C/c1cccc(O)c1O)c1ccc(Cl)cc1Cl 369799 MCCIKTDFOOHMEY-REZTVBANSA-N 325.151 3.169 50 40 EGGB C=CCOc1ccc(/C=C(\C#N)C(=O)NCc2ccco2)cc1OC 28495794 NRPLFKWEIZIDQW-XNTDXEJSSA-N 338.363 3.076 50 40 EGGB CCOc1ccc(/C=N/NC(=O)OCc2ccccc2OC)cc1 354655 IUYHCOWTSVYAJB-XDHOZWIPSA-N 328.368 3.354 50 40 EGGB O=C(N/N=C/c1ccccc1[N+](=O)[O-])c1ccccc1-n1cccc1 5899372 ARVSMCDMGNDMTP-CPNJWEJPSA-N 334.335 3.149 50 40 EGGB COc1cccc(/C=N/NC(=O)c2ccc(Cl)cc2Cl)c1O 5514865 WOQCJWKOZFPRCI-QGMBQPNBSA-N 339.178 3.472 50 40 EGGB COc1cccc(/C=N/NC(=O)c2cc3ccccc3nc2C)c1O 366251 CPKZLWJBVZWANR-RGVLZGJSSA-N 335.363 3.021 50 40 EGGB COc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)c1 59305 LDSUAIRLGVEHFA-INIZCTEOSA-N 346.342 3.020 50 40 EGGB COc1ccc(C)cc1[C@@H](C)NC(=O)NNC(=O)c1ccc(C)cc1 10225061 ZVZNPFBPAVSBAM-CQSZACIVSA-N 341.411 3.017 50 40 EGGB N#C/C(C(=O)Nc1ccccc1)=C1/SCC(=O)N1c1ccccc1 4523345 GWGFJPLAPIOFAA-SDXDJHTJSA-N 335.388 3.140 50 40 EGGB C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)c1cccs1 7649856 WUYWRFQOSROIGL-LBPRGKRZSA-N 340.404 3.130 50 40 EGGB Cc1ccc(NC(=O)C(=O)N/N=C\c2c(F)cccc2Cl)cc1C 408752401 GWPFFFFMGAFSKZ-UKWGHVSLSA-N 347.777 3.185 50 40 EGGB Cc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)cc1 8371673 ZNTIHNMMWYDKFN-FNLSEGDXSA-N 349.434 3.115 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@@H](C)Sc2ccccn2)cc1 188572 PYQHKIWEEFUPNR-KZKLBEMASA-N 329.425 3.111 50 40 EGGB CCOC(=O)/C(C#N)=C/Nc1nc2c(s1)COc1ccccc1-2 101018415 FLIQLXVUYDNYKF-CSKARUKUSA-N 327.365 3.085 50 40 EGGB Cc1ccc(/C=N/NC(=O)COc2ccc(Cl)cc2Cl)o1 493342 WXFFZEDUZCSULD-REZTVBANSA-N 327.167 3.424 50 40 EGGB CCOC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12 15590569 GHDWICLCYFSPIM-UHFFFAOYSA-N 335.363 3.293 50 40 EGGB C=CCn1cc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21 409184551 ZARARZMRUOFUQH-UDWIEESQSA-N 348.362 3.499 50 40 EGGB O=C(CN(Cc1ccccc1)Cc1ccccc1)N/N=C/c1ccco1 20522358 NSFSIPFOYFHJRJ-HYARGMPZSA-N 347.418 3.432 50 40 EGGB Cc1cccc(C(=O)OC[C@H](Br)CBr)c1 2045581 KZAODDITVCXJAC-SNVBAGLBSA-N 336.023 3.310 50 40 EGGB COc1ccc(C(=O)N/N=C/c2sc3ccccc3c2O)cc1 501726 UVKYTKNSZJEOEV-VCHYOVAHSA-N 326.377 3.379 50 40 EGGB Cc1ccc(NCC(=O)N/N=C/c2ccc(N3CCCC3)o2)cc1C 59138269 YIJYSMDPAALYKD-CIAFOILYSA-N 340.427 3.059 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/c2ccccc2Br)c(F)c1 408966402 LKEPQKRKXRPZKN-DJKKODMXSA-N 346.159 3.224 50 40 EGGB COc1ccc(-c2cc(C(=O)N/N=C/c3ccc(F)s3)no2)cc1 252484565 FZLCFFJQIBRZET-GIJQJNRQSA-N 345.355 3.315 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccc3c(c2)OCCO3)cc1 140239 PWNJVQJJDPSYQS-GXDHUFHOSA-N 336.347 3.012 50 40 EGGB CC(=O)Nc1ccc(C(=O)N/N=C/c2c(C)[nH]c3ccccc23)cc1 587932 JDXPPKUGUAYONX-RGVLZGJSSA-N 334.379 3.199 50 40 EGGB Cc1c(C(=O)O)cccc1-c1ccc(/C=C(\C#N)C(=O)NC(C)C)o1 4723479 DFUZXFVLFRPJNA-UKTHLTGXSA-N 338.363 3.385 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(OC)cc2O)cc1 409390592 FOCRVBVBBMZYFX-DEDYPNTBSA-N 341.411 3.011 50 40 EGGB O=C(COc1ccccc1-c1ccccc1)N/N=C/c1ccccn1 307909 OYVMVRLRUTXUKG-HYARGMPZSA-N 331.375 3.278 50 40 EGGB CCC(=O)NNC(=O)COc1ccc(C(C)(C)CC(C)(C)C)cc1 1750077 XUDNTLQQXYSDDK-UHFFFAOYSA-N 334.460 3.337 50 40 EGGB N#CC(C#N)=Cc1ccc(Sc2nc(=N)ss2)c([N+](=O)[O-])c1 59488820 HZWXWEONQADACO-UHFFFAOYSA-N 347.406 3.174 50 40 EGGB CCOc1cc(/C=N\NC(=O)Cc2ccc(CC)cc2)ccc1OC 409362097 FNCGTBWXOBJEPP-STZFKDTASA-N 340.423 3.349 50 40 EGGB Cc1occc1C(=O)NNC(=O)N(C)CC12CC3CC(CC(C3)C1)C2 89540653 CRQZMKGQFVHVNB-UHFFFAOYSA-N 345.443 3.091 50 40 EGGB CC(C)c1ccc(NC(=O)C(=O)N/N=C/c2ccc(F)cc2)cc1 5413635 FPHUHSFKEZOXLM-RGVLZGJSSA-N 327.359 3.038 50 40 EGGB CN(C)c1ccc([C@H]2[C@@H]3CCCC=C3C(C#N)=C(N)C2(C#N)C#N)cc1 20123564 GHOSEHVBNZLUNA-MJGOQNOKSA-N 343.434 3.346 50 40 EGGB O=C(NNc1cccc(F)c1)C(O)(c1ccccc1)c1ccccc1 275646 HBRMDDBDJRJZCF-UHFFFAOYSA-N 336.366 3.205 50 40 EGGB COc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1cc(C)cc(C)c1 408880527 KIMJXRYHZDQNAL-RQZCQDPDSA-N 336.391 3.283 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1ccc(N2CCCCCC2)o1 409240840 ILCVTWJKXLBGEX-STZFKDTASA-N 343.402 3.492 50 40 EGGB CN1c2ccccc2N2C[C@@](C)(CI)S[C@@H]12 4868296 IGTPWOWACKHSLZ-NWDGAFQWSA-N 346.237 3.167 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2ccc(O)c([N+](=O)[O-])c2)c(Cl)c1 36243498 OITZRQFMSQNYLS-CAOOACKPSA-N 333.731 3.026 50 40 EGGB C=CCOc1ccc(/C=N\NC(=O)Nc2ccccc2)cc1OC 136959518 KXVANIMZGVJZBZ-UYRXBGFRSA-N 325.368 3.416 50 40 EGGB C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1I 95635354 NTYHXNBIVRLYHG-RKDXNWHRSA-N 325.190 3.067 50 40 EGGB in-vitro COc1ccc(OCC(=O)N/N=C2/C[C@H]3CC[C@@]2(C)C3(C)C)cc1 102800841 AQGMHPFOQLEJNA-MLNVVSDNSA-N 330.428 3.392 50 40 EGGB O=C(NNC(=O)[C@@H]1C[C@H]1c1ccccc1)Nc1ccc(Cl)cc1 3152287 ISHSUSGGZFMGTF-LSDHHAIUSA-N 329.787 3.296 50 40 EGGB O=C(CCl)NCc1cn(Cc2ccccc2)nc1-c1ccccc1 62132645 MVSMIXJPFSPCMO-UHFFFAOYSA-N 339.826 3.453 50 40 EGGB CC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1ccc2c(c1)OCO2 408755467 QFINNAQOOBXEEE-ZSOIEALJSA-N 334.331 3.164 50 40 EGGB CCn1cc(Cl)c([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)n1 253402261 OCCHUZUDKQRABO-ZDUSSCGKSA-N 346.818 3.007 50 40 EGGB Cc1cc(/C=N/NC(=O)COc2cccc3cccnc23)cc(C)c1O 1106380 USVUYZUSQFBZAU-SSDVNMTOSA-N 349.390 3.086 50 40 EGGB CCOc1ccc(C(=O)N/N=C\c2cc(Cl)ccc2O)cc1OC 6355494 VVMZOGHJBYBKOQ-GRSHGNNSSA-N 348.786 3.217 50 40 EGGB O=C(NNC(=S)Nc1ccccc1)c1cc(F)c(F)cc1Cl 3075280 DQZBGKZDZFVBDW-UHFFFAOYSA-N 341.770 3.250 50 40 EGGB CN(CC(=O)N/N=C/c1ccc(Br)cc1)c1ccccc1 59786 GXNDPUWOVZKHAY-WOJGMQOQSA-N 346.228 3.036 50 40 EGGB Cc1cccc(NCC(=O)N/N=C/c2c(O)ccc3ccccc23)c1 251879 PPTJEELUSSOKJX-WSDLNYQXSA-N 333.391 3.416 50 40 EGGB Cn1cccc1/C=N/NC(=O)COc1ccc(-c2ccccc2)cc1 565780 UXDAXOLPFCSDOO-KGENOOAVSA-N 333.391 3.221 50 40 EGGB C/C(=N\NC(=O)c1ccccc1O)c1cccc(Br)c1 5282568 JUVKODXYMJEONV-LICLKQGHSA-N 333.185 3.309 50 40 EGGB COc1ccc(CC(=O)N/N=C(\C)c2ccc(C)cc2C)cc1OC 409363337 LGNMRKLPMOCCFU-RCCKNPSSSA-N 340.423 3.404 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2cccn2-c2cccc(C(=O)O)c2)cc1 409108427 TWMLAOQCOUJINB-FYJGNVAPSA-N 347.374 3.248 50 40 EGGB C/C(=N\NC(=O)c1ccccn1)c1ccc(N2CCCCC2)c(F)c1 57582359 YSRZEIYBKDHYRA-HYARGMPZSA-N 340.402 3.365 50 40 EGGB Cc1ccc(Sc2ccc(/C=N/NC(N)=O)cc2[N+](=O)[O-])cc1 6502246 ZZVIUOANZCHSJN-RQZCQDPDSA-N 330.369 3.057 50 40 EGGB NNC(=O)c1cc(Cl)c(OCc2cccc(F)c2)c(Cl)c1 226322154 FORSQWXPVRAXAC-UHFFFAOYSA-N 329.158 3.315 50 40 EGGB CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\c1ccc(-c2ccc(F)cc2)o1 16741509 BIEMCWPOWVGUSF-DHDCSXOGSA-N 336.322 3.308 50 40 EGGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(OC)cc2)cc1 140251 AHUIXHOCICCQGJ-RVDMUPIBSA-N 336.347 3.027 50 40 EGGB O=C(Cl)c1ccc(S(=O)(=O)c2ccc(C(=O)Cl)cc2)cc1 100258635 ACJYZTIHYXBBSN-UHFFFAOYSA-N 343.187 3.277 50 40 EGGB O=C(/C=C/c1ccccc1)NNC(=O)COc1cccc2ccccc12 6251940 NFMZDIGWJJCKSO-BUHFOSPRSA-N 346.386 3.079 50 40 EGGB CCOc1c(Br)cc(/C=C(\C#N)C(N)=S)cc1OC 408542198 HPSUFOANMZPVHH-RUDMXATFSA-N 341.230 3.049 50 40 EGGB CC[C@H](C)n1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cn1 253407278 VULZJESLZSJDKS-MEDUHNTESA-N 340.427 3.305 50 40 EGGB N#C/C(=C\C=C\c1ccccc1[N+](=O)[O-])C(=O)NCc1ccccc1 3233500 FNWRTFAVXNMUGW-ANKJDYFYSA-N 333.347 3.374 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)NCc2ccco2)c(Cl)c1OC 96404664 BRZKQONFCUXGQN-XYOKQWHBSA-N 346.770 3.174 50 40 EGGB O=C(CCl)Nc1sc2c(c1C(=O)Nc1cccnc1)CCCC2 409120299 VINQXYAUUBTCAZ-UHFFFAOYSA-N 349.843 3.452 50 40 EGGB C/C(=N\NC(=O)NC[C@@H]1CCCO1)c1cc(F)c(Cl)cc1Cl 98055372 DXNYKAZHEFNEFT-VFKKPVCESA-N 348.205 3.335 50 40 EGGB Cc1cccc(/C=N/NC(=O)[C@@H](C)Nc2ccc3ccccc3c2)n1 31097 WQNINVGIXOMABO-NWGMWSOJSA-N 332.407 3.494 50 40 EGGB CCOc1ccc(Cl)cc1/C=N/NC(=O)CNc1ccc(F)cc1 487146 IJBVNJONKRDUJH-UFFVCSGVSA-N 349.793 3.440 50 40 EGGB Cc1ccc2sc(NNC(=O)COc3ccccc3)nc2c1C 4121441 GKWWUJWBJGPJOA-UHFFFAOYSA-N 327.409 3.435 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)o1 97427 USEBCQLNSXYXCC-VXLYETTFSA-N 338.319 3.310 50 40 EGGB CC(C)(C)c1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2O)cc1 113663 CCPXVMOWXSPPCT-YBFXNURJSA-N 341.367 3.362 50 40 EGGB COc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c2ccccc2oc3=O)c1 288859 XQXNRCHVABRTTE-MRXNPFEDSA-N 346.342 3.020 50 40 EGGB O=C(NNc1ccccc1)c1ccc(C(=O)NNc2ccccc2)cc1 3082372 WBXIAVMKNBGPTJ-UHFFFAOYSA-N 346.390 3.200 50 40 EGGB CC[C@@H](C)c1ccccc1OCC(=O)NNc1nc(C)cc(C)n1 12849083 NOKQOYSCWXSSHC-GFCCVEGCSA-N 328.416 3.129 50 40 EGGB Cc1cc(C)cc(OCCCOc2ccccc2/C=N/NC(N)=O)c1 4616044 LGWVMPMHVUCYBX-FYJGNVAPSA-N 341.411 3.154 50 40 EGGB COc1ccccc1/C=N/NC(=O)CSCCc1ccccc1 408726402 MACHIZYFXPBGQE-CPNJWEJPSA-N 328.437 3.121 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(C)o2)cc1Br 48484 RKKCQXPSWZSJNU-LZYBPNLTSA-N 337.173 3.123 50 40 EGGB COc1ccc(-c2csc([C@@H](C#N)C(=O)CCl)n2)cc1OC 11765323 LYYSKRIKALCSIJ-JTQLQIEISA-N 336.800 3.242 50 40 EGGB Cc1ccc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)c(O)c1 18209550 NERHFOXQUFUWGI-KEBDBYFISA-N 326.396 3.155 50 40 EGGB CC(C)=C[C@@H]1[C@H](C(=O)NNC(=O)c2ccc3ccccc3n2)C1(C)C 31550350 ASSKLIRNSWATTK-RHSMWYFYSA-N 337.423 3.234 50 40 EGGB CCN(CC)c1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)cc1 483020 AEDQZFYIJOTDTG-GOSISDBHSA-N 337.423 3.348 50 40 EGGB NC(=O)N/N=C/c1cn(Cc2ccccc2Cl)c2ccccc12 4083299 XTRXRRLURLNVLT-AWQFTUOYSA-N 326.787 3.345 50 40 EGGB CC(/C=C/c1ccccc1F)=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1 13856347 CZSCMWUMBHVTOQ-PDVUDHOGSA-N 341.342 3.482 50 40 EGGB C/C(=N\NC(=O)NC[C@H]1CCCO1)c1cc(F)c(Cl)cc1Cl 98055373 DXNYKAZHEFNEFT-HURAESQDSA-N 348.205 3.335 50 40 EGGB N#Cc1ccccc1-c1ccc(/C=N/NC(=O)[C@@H](O)c2ccccc2)o1 14134675 BHFCRCGBQXPSSS-MEGCXXLRSA-N 345.358 3.002 50 40 EGGB COc1ccccc1N[C@@H](C)C(=O)N/N=C/c1c[nH]c2ccccc12 234468 GRQFPJOUJQDBNX-XMOVILSBSA-N 336.395 3.127 50 40 EGGB CC(C)C/C(=N/NC(=O)[C@H]1COc2ccccc2O1)c1ccccc1 5092230 UTQQYZKVDBTJDV-DSPRMBBKSA-N 338.407 3.393 50 40 EGGB Cc1c(Cl)cccc1-n1c(C)cc(/C=N/NC(=O)CC#N)c1C 573899 GUBQDMHEJVKGTI-KEBDBYFISA-N 328.803 3.420 50 40 EGGB C/C(=N\NC(=O)CSc1nnc(C)s1)c1ccc(Cl)cc1 548302 LRANYELTFDWZRR-OVCLIPMQSA-N 340.861 3.132 50 40 EGGB N#CC1=C[C@@H](Br)[C@@H]2C[C@H]1[C@H](Br)C=C2C#N 4280724 MEAIIRVSQNJTBF-GWOFURMSSA-N 328.007 3.063 50 40 EGGB O=C(COc1cccc2cccnc12)N/N=C/c1ccc(Cl)s1 408968397 YKHWOUYWBPVRKI-DJKKODMXSA-N 345.811 3.479 50 40 EGGB CCc1cc(C(=O)NNC(=O)c2cc3c(s2)CCC3)sc1C 14245493 BONIFHCXZKSHTH-UHFFFAOYSA-N 334.466 3.244 50 40 EGGB N#Cc1ccc(C(=O)[C@H](Br)CBr)cc1F 308788546 BEVXHCVZWKTZIP-MRVPVSSYSA-N 334.970 3.038 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@@H](c2cccc([N+](=O)[O-])c2)[C@@H]2CCCC=C12 19907368 CFCRPALWGIWYGO-WBVHZDCISA-N 345.362 3.188 50 40 EGGB Cc1nn(-c2ccccc2)c(C)c1/C=N/NC(=O)c1ccc(F)cc1 371297 HOZFVCCVQFBNRZ-CIAFOILYSA-N 336.370 3.392 50 40 EGGB C[C@@H](O)CC[PH](c1ccccc1)(c1ccccc1)c1ccccc1 104097327 MIGDNRRWAOAHCE-LJQANCHMSA-N 336.415 3.484 50 40 EGGB CCCOc1ccccc1/C=N/NC(=O)c1cccc([N+](=O)[O-])c1 1923328 VSHHJDXTLHVAMZ-LDADJPATSA-N 327.340 3.148 50 40 EGGB N#C/C(C(=O)NC1CCCCC1)=C1/C(=O)Nc2ccc(Cl)cc21 39556013 DKCUVXDIVMUKKQ-SQFISAMPSA-N 329.787 3.018 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)NC2CCCCC2)cc(OC)c1OC 33309502 QNEOKGXLAJUZJP-ZROIWOOFSA-N 344.411 3.068 50 40 EGGB O=C(N/N=C/c1cccc(Br)c1)c1ccccc1[N+](=O)[O-] 252735 SFLGLRDUDMEEPO-CXUHLZMHSA-N 348.156 3.121 50 40 EGGB O=C(COc1ccc(Cl)cc1Cl)N/N=C\c1ccccc1O 27232277 ZPCHVLOAXWMZPG-LSCVHKIXSA-N 339.178 3.228 50 40 EGGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1ccccc1)c1ccccc1 408979983 PCHRRJXNMZLGFT-HDAKKWKLSA-N 339.395 3.014 50 40 EGGB C=CCc1cc(/C=C(/C#N)C(=O)NC(C)C)cc(Br)c1O 408776853 ZXICQGDUKGDHFT-QPEQYQDCSA-N 349.228 3.315 50 40 EGGB COC(=O)c1cccc(-c2ccc(/C=N\NC(=O)c3ccccc3)o2)c1 408955916 PQHQTALVGXFNLY-BKUYFWCQSA-N 348.358 3.497 50 40 EGGB CSc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1 5746943 SDRRHNMXCZTKOL-YBFXNURJSA-N 341.436 3.114 50 40 EGGB Cc1cc(/C=N/NC(N)=O)c(C)n1-c1cccc(Cl)c1Cl 6329662 SQGFFMDFNDOXII-CNHKJKLMSA-N 325.199 3.403 50 40 EGGB COc1ccc(CCCC(=O)N/N=C/c2ccc(N(C)C)cc2)cc1 220338 JXCBLTGXAVSAOQ-RCCKNPSSSA-N 339.439 3.234 50 40 EGGB CC/C(=N\NC(=O)COc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 12401992 CYNYDOQHBUYFSO-XDJHFCHBSA-N 341.367 3.213 50 40 EGGB C[C@@H]1CCc2c(sc3ncnc(NNC(=O)c4ccco4)c23)C1 11903826 YXZRDZNAFZGAGL-SECBINFHSA-N 328.397 3.166 50 40 EGGB CNC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1cccs1 16387929 XMJWIVLYPWHMDQ-JLHYYAGUSA-N 334.404 3.254 50 40 EGGB Nc1c(Cl)c(Cl)nc(C(=O)N/N=C2\C[C@@H]3C=CC[C@@H]23)c1Cl 20885292 BMGDJAKJQRFAJL-VICDJGJMSA-N 345.617 3.306 50 40 EGGB CCOc1ccc(O)c(/C=N/NC(=O)Cc2ccc(C)cc2C)c1 20195380 PBEYVCRERATKSX-UDWIEESQSA-N 326.396 3.101 50 40 EGGB CSc1ccc(/C=N/NC(=O)C(=O)Nc2cccc(C)c2C)cc1 5815577 IIXYAOFDNKCMIL-YBFXNURJSA-N 341.436 3.114 50 40 EGGB C#CCOc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(OC)cc1 7168245 GQHILGXCGJQDFS-DTQAZKPQSA-N 332.359 3.253 50 40 EGGB COc1ccc(CSC2=C(C#N)C(C)(C)[C@@H](C#N)C(=O)N2)cc1F 9503713 LDIIYPRWDMFBPE-NSHDSACASA-N 345.399 3.098 50 40 EGGB C/C(=N\NC(=O)c1ccc2c(c1)OCO2)c1ccc2c(c1)CCCC2 4677044 DTVBJEPZPHGZRT-FYJGNVAPSA-N 336.391 3.448 50 40 EGGB CC(C)C(=O)Nc1ccc(C(=O)N/N=C/c2ccc(F)cc2)cc1 8558478 MHNXZIVOASIUAY-RGVLZGJSSA-N 327.359 3.184 50 40 EGGB C/C(=N\NC(=O)c1cc(C)nc2ccccc12)c1ccc2c(c1)OCO2 36289495 UWHWECVKKIWGDB-LPYMAVHISA-N 347.374 3.426 50 40 EGGB CC1(C)[C@]2(C)CC[C@@]1(C(=O)N1CCCCC1)[C@H](Br)C2=O 4184685 SPFWMAKXCTWFLU-LYRGGWFBSA-N 342.277 3.158 50 40 EGGB CC(C)N(C(=O)OC(C)(C)C)[C@@H]1CCCC[C@@H]1NC(=O)CCl 79408891 JLKNZCQOVZICNM-QWHCGFSZSA-N 332.872 3.298 50 40 EGGB O=C(N/N=C1\CSC(=O)N1Cc1ccco1)c1ccc(Cl)cc1 414710 OTVRDLKSDYOQJA-GHRIWEEISA-N 349.799 3.345 50 40 EGGB C=CCn1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 6295911 RQJQVBFMMZIUAI-UDWIEESQSA-N 348.362 3.499 50 40 EGGB N#CC1=C(N)OC2=C(C(=O)CCC2)[C@@H]1c1ccc(N2CCCC2)cc1 62514 CPVPZVIJNRXWGS-GOSISDBHSA-N 335.407 3.102 50 40 EGGB C[C@]12[C@@H](Br)[C@@H]3[C@H]4C[C@@H]5[C@@H]([C@@H]41)[C@](O)(c1ccccc1)[C@@H]2[C@@H]53 100940616 SZCGKEUXKLALMI-OTTJMADESA-N 331.253 3.416 50 40 EGGB CCn1c(C)cc2c(c1=O)[C@@H](c1cccc(Cl)c1)C(C#N)=C(N)O2 2228857 DQTJRRSPVOPSQG-HNNXBMFYSA-N 341.798 3.048 50 40 EGGB C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NNC(=O)c1ccccc1 7517154 LAAGEQCIRPKRIA-CQSZACIVSA-N 340.423 3.213 50 40 EGGB CCOC(=O)N/N=C/c1cccc(OC(=O)c2ccccc2F)c1 408958597 ZIUUEIBAHJEVAE-YBFXNURJSA-N 330.315 3.125 50 40 EGGB Cc1ccc(S[C@@H](C)C(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 409132900 KVBZDAPDZREACN-UZPSYVQNSA-N 342.420 3.355 50 40 EGGB CC(C)(C)OC(=O)N(C1CC1)[C@@H]1CCCC[C@H]1NC(=O)CCl 83318757 XHGHBHVVCBCTJG-CHWSQXEVSA-N 330.856 3.052 50 40 EGGB CC(=O)Nc1ccc(C(=O)N/N=C/c2ccccc2OC(C)C)cc1 582765 OSDVUEUUZLEJDA-UDWIEESQSA-N 339.395 3.196 50 40 EGGB O=C(CSc1cccc2cccnc12)N/N=C/c1cccc(O)c1 264199 KXPGQSLYZQLUPM-RGVLZGJSSA-N 337.404 3.183 50 40 EGGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1cccc(Cl)c1 8160261 MDTBKRPZXAMXMS-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB CCOC(=O)[C@H]1CCC/C1=N\NC(=O)[C@H](C)Sc1ccccc1 5332812 JFTJXEQGYCJKFG-TUNFKSRMSA-N 334.441 3.003 50 40 EGGB CCCOc1ccccc1/C=N/NC(=O)COc1ccccc1OC 2070020 SGTLQXFHSGTMOR-DEDYPNTBSA-N 342.395 3.013 50 40 EGGB O=C(O)[C@H](CCCCl)P(=O)(c1ccccc1)c1ccccc1 2309982 CDMHMQKREXVPPN-INIZCTEOSA-N 336.755 3.473 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 13847787 ZQHWTLGESSCGDC-HIPSJFSSSA-N 341.367 3.188 50 40 EGGB C[C@@H](Sc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccccc1 5824725 NUTXKZKGBNJIQI-LLVKDONJSA-N 334.828 3.282 50 40 EGGB COc1ccc(/C=N\NC(=O)Cc2cc(C)ccc2C)c(OC)c1 409362361 JDHDCXRVKZDBMI-NDENLUEZSA-N 326.396 3.013 50 40 EGGB O=C(CNC1CCCCC1)N/N=C/c1ccc(Cl)cc1Cl 409380764 AHRAQIYFOPOTRF-DJKKODMXSA-N 328.243 3.366 50 40 EGGB CC(C)(C)OC(=O)N(C1CC1)[C@@H]1CCCC[C@@H]1NC(=O)CCl 83318754 XHGHBHVVCBCTJG-QWHCGFSZSA-N 330.856 3.052 50 40 EGGB N#CCC(=O)N/N=C/c1ccc(OCc2cccc(Cl)c2)cc1 6240929 BMPOMQIRKFJSPH-RGVLZGJSSA-N 327.771 3.283 50 40 EGGB COc1ccc(O)c(/C=N/NC(=O)c2sc3ccccc3c2O)c1 266442 ZVEAJCIFHXSQLC-GIJQJNRQSA-N 342.376 3.085 50 40 EGGB O=C(CCn1cnc2ccccc21)N/N=C/c1ccc(Cl)cc1 544532 ACJUZWLINGMOSH-RGVLZGJSSA-N 326.787 3.230 50 40 EGGB O=C(N/N=C/[C@H]1C[C@H]2C=C[C@H]1C2)C(O)(c1ccccc1)c1ccccc1 102220289 MEIWVLWDWOXTGU-NWCOEHNKSA-N 346.430 3.237 50 40 EGGB Cc1ccc(NC(=O)CCC(=O)NN=C(C2CC2)C2CC2)cc1C 4525818 CHXDCVVYKKWQQN-UHFFFAOYSA-N 327.428 3.314 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1ccc(N2CCCC2)c(F)c1 409247631 DXSMNWYBDJTCLM-XKZIYDEJSA-N 343.377 3.258 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)c2ccc(Cl)c(Cl)c2)o1 408993106 CLMAUAUYUWPMKY-CAOOACKPSA-N 326.183 3.416 50 40 EGGB COc1ccc(-c2cc(C(=O)N/N=C(/C)c3ccccc3)[nH]n2)cc1 16789635 CRRJJVSTBPBUDP-MOSHPQCFSA-N 334.379 3.239 50 40 EGGB CCOc1cc(/C=N/NC(=O)CNc2ccccc2)cc(Cl)c1O 6297415 DWQRFCCFXVYIGD-KEBDBYFISA-N 347.802 3.007 50 40 EGGB COc1cccc(/C=N/NC(=O)c2ccc3ccccc3n2)c1OC 59018 BBYDLOYPHHZTPL-UDWIEESQSA-N 335.363 3.016 50 40 EGGB C[C@@H](Cl)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1 2650155 CUEWKBIHPPSWBE-SECBINFHSA-N 336.741 3.108 50 40 EGGB CCOc1ccc(Cl)cc1/C=N\NC(=O)Cc1ccc(OC)cc1 409105917 PFJGXZAQRVLUTE-NDENLUEZSA-N 346.814 3.440 50 40 EGGB CCOC(=O)N/N=C/c1ccc(OC(=O)c2ccc(C)cc2)cc1 38823116 PSALVBAVWKBZGF-XDHOZWIPSA-N 326.352 3.294 50 40 EGGB COc1ccccc1/C=N/NC(=O)CSc1nc2ccccc2o1 197831 GZLCZKVKDFVHJK-VCHYOVAHSA-N 341.392 3.079 50 40 EGGB COc1ccc(/C=N/N(C)C(=O)OCc2ccccc2)cc1[N+](=O)[O-] 8091054 IDELLHFLYWDKET-WOJGMQOQSA-N 343.339 3.206 50 40 EGGB CC(/C=C/c1ccc2c(c1)OCO2)=N\NC(=O)c1ccccc1F 12362533 LSGCSFKEPLDROJ-SACOBIQUSA-N 326.327 3.374 50 40 EGGB COc1ccc(/C=N/NC(=O)c2cccc(Cl)c2)cc1[N+](=O)[O-] 6182335 ZNUHMRLXIJSIOR-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB CCOC(=O)c1nnc([C@H](Br)c2ccc(Cl)cc2)o1 12411206 ZTGFEXFEMCPKQA-SECBINFHSA-N 345.580 3.384 50 40 EGGB CCCOc1ccccc1/C=N/NC(=O)c1ccc([N+](=O)[O-])cc1 59417809 XAEXFTSKDTYDNL-LDADJPATSA-N 327.340 3.148 50 40 EGGB COc1ccc(Br)cc1C(=O)N/N=C(\C)c1ccco1 408710851 PUHUVQSUKQKPOW-CXUHLZMHSA-N 337.173 3.205 50 40 EGGB COc1ccc(Br)cc1C(=O)N/N=C/c1ccsc1 409003290 ZFXCIJLVOKYLOP-VIZOYTHASA-N 339.214 3.283 50 40 EGGB COc1ccccc1OCC(=O)N/N=C/c1ccc(OC(C)C)cc1 43920750 DLCPKOCMADGDNA-UDWIEESQSA-N 342.395 3.012 50 40 EGGB Cc1ccc(CC(=O)N/N=C\c2cccc(Br)c2)cc1 195751019 SISIINAIOWVJFA-WQRHYEAKSA-N 331.213 3.450 50 40 EGGB CN(C)c1ccc(-n2cccc2/C=N/NC(=O)c2cccs2)cc1 559081 HJXHPNRBTUBHKY-CPNJWEJPSA-N 338.436 3.369 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)COc2c(C)cccc2C)cc1 59193 IRMNGXHCMLCDRN-HMMYKYKNSA-N 326.396 3.231 50 40 EGGB N#C/C(=C\c1ccc(-c2ccc(F)cc2)o1)C(=O)NC[C@@H]1CCCO1 48575 ZKSVTMHCALUBJN-SHRNQRGKSA-N 340.354 3.288 50 40 EGGB COC(=O)c1ccc(/C=C(\C#N)C(=O)N[C@H](C)c2ccccc2)cc1 3322591 RUXHXCUDZVVGRO-CRRKTRLDSA-N 334.375 3.258 50 40 EGGB COc1ccc(C(=O)N/N=C/c2c(O)ccc3ccccc23)c(O)c1 409390986 GNDGXUWDPBIODO-RGVLZGJSSA-N 336.347 3.024 50 40 EGGB Cn1c(=O)c(/C=C(\C#N)c2nc3ccccc3[nH]2)cc2ccccc21 36625728 OIVOFHHUQPZNHW-RVDMUPIBSA-N 326.359 3.479 50 40 EGGB O=C(Cn1c(-c2ccccc2)cc2ccccc21)NNc1ncccn1 44716310 SJXOKZQDJGPYAJ-UHFFFAOYSA-N 343.390 3.242 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(C(F)(F)F)c2[C@H]1c1ccc(Cl)cc1 5819004 LUMGTSMHRUZMHY-VIFPVBQESA-N 340.692 3.300 50 40 EGGB Cn1c(/C=N/NC(=O)CC#N)ccc1-c1cccc(C(F)(F)F)c1 67300006 IZQXIRPETZUGAP-UFFVCSGVSA-N 334.301 3.075 50 40 EGGB COc1ccc(/C=N\NC(=O)Cc2ccc(Br)cc2)cc1 36144781 XOKWGHSEGGFCOO-WQRHYEAKSA-N 347.212 3.151 50 40 EGGB N#C/C(=C/c1cccnc1)C(=O)Nc1ccc(Br)cc1 408744611 MGZBSSVESBLJIA-WQLSENKSSA-N 328.169 3.390 50 40 EGGB COc1cc(/C=C(\C#N)C(N)=O)ccc1Cc1ccccc1Cl 408876594 PFCSKLAPDLPXIY-OVCLIPMQSA-N 326.783 3.332 50 40 EGGB CCOc1ccc(/C(C)=N\NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 34871274 BKARXDJPWKVLQM-UYRXBGFRSA-N 341.367 3.076 50 40 EGGB Cc1c(C(=O)NN)c2ccccc2n1C(=O)c1cccc2ccccc12 216950882 PRXNDSCIYZQICG-UHFFFAOYSA-N 343.386 3.395 50 40 EGGB CCOC(=O)OC(=O)C[C@H](CC(=O)OC)O[Si](C)(C)C(C)(C)C 196826183 BEVABXNTHJECLR-NSHDSACASA-N 348.468 3.030 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)cc(Cl)c1O 15930441 NTIHBGKMYWXNAI-AUWJEWJLSA-N 342.782 3.278 50 40 EGGB C#CCOc1ccccc1/C=N/NC(=O)c1ccc(OCC=C)cc1 3088048 FKXPZRGEUIKSOY-RCCKNPSSSA-N 334.375 3.027 50 40 EGGB O=C(CCc1ccccc1O)N/N=C/c1c(O)ccc2ccccc12 59167039 ZMYFDUIRODIGDD-FYJGNVAPSA-N 334.375 3.334 50 40 EGGB O=C(NC(OCCCl)(C(F)(F)F)C(F)(F)F)c1ccccc1 2273778 BYORGXKULTUHBP-UHFFFAOYSA-N 349.658 3.493 50 40 EGGB Cc1nn(C)c(C)c1[C@@H](C)C(=O)NNc1ccccc1C(F)(F)F 58792156 ZGKKUOUCGUTJAI-SECBINFHSA-N 340.349 3.303 50 40 EGGB N#CC1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@@H]1c1ccc(Cl)cc1 13940442 WFGFZJMXQQSGJJ-OAHLLOKOSA-N 349.777 3.400 50 40 EGGB C/C(=N\NC(=O)c1ccccc1O)c1nc2ccccc2n1C(F)F 83813173 BBMOSOASHUTPSG-UFFVCSGVSA-N 344.321 3.291 50 40 EGGB C=CCc1cc(/C=C/C(=O)NN)cc(OC)c1OCc1ccccc1 216884400 PQDKLGNCOAYCSK-ZHACJKMWSA-N 338.407 3.006 50 40 EGGB COC(=O)c1cc(Br)c(Cl)nc1CBr 95098053 FMVMOXURAZQEMJ-UHFFFAOYSA-N 343.402 3.179 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2cccc(Cn3cccn3)c2)cc1 132030 YZBMHOZYZIHFMY-KGENOOAVSA-N 348.406 3.094 50 40 EGGB COC(=O)c1ccc(/C=C(/C#N)C(=O)Nc2ccc(OC)cc2)cc1 15219448 WVESZPHGVYNUMW-PTNGSMBKSA-N 336.347 3.027 50 40 EGGB C/C(CC(=O)Nc1cccc(Cl)c1)=N\NC(=O)c1ccccc1O 100090129 UCSAUHKMKBVORC-RGVLZGJSSA-N 345.786 3.180 50 40 EGGB CC1(C)C(C#N)=C(SCc2nccn2C(F)F)N=C(O)[C@@H]1C#N 8725223 FQBNIMKRXAZINK-QMMMGPOBSA-N 337.355 3.383 50 40 EGGB Cc1ccc2c(c1)/C(=N\NC(=O)CCc1ccccc1)C(=O)N2C(C)C 95346315 HIDLVXHLPKKUGE-BSYVCWPDSA-N 349.434 3.203 50 40 EGGB Cc1occc1C(=O)NNC(=O)[C@H](c1ccc(Cl)cc1)C(C)C 5823775 GZLPAMLOUHDERV-HNNXBMFYSA-N 334.803 3.442 50 40 EGGB C/C(=N\NC(=O)Cc1ccc(Br)cc1)c1ccc(O)cc1 13595718 FJWOZNYQQWUKID-WOJGMQOQSA-N 347.212 3.238 50 40 EGGB COc1cc(C(=O)N/N=C(\C)[C@H]2C[C@H]3CC[C@H]2C3)cc(OC)c1OC 102407786 AVTPWNSWYYPBDO-QYWJXTSOSA-N 346.427 3.254 50 40 EGGB C=CCSC1=C(C#N)[C@@H](c2ccccc2C)[C@@H](C(=O)OC)C(O)=N1 2296626 HXTRQANFUURSHF-HUUCEWRRSA-N 342.420 3.492 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1ccc(N2CCCCC2)o1 409241940 PJSHCGSQYXLXIW-MOSHPQCFSA-N 329.375 3.102 50 40 EGGB NNC(=O)c1cn(Cc2ccc(Br)cc2)c2ccccc12 216947356 MDXJOAJQDVDZSX-UHFFFAOYSA-N 344.212 3.056 50 40 EGGB O=C(Cl)c1ccc(S(=O)(=O)N2CCCc3ccccc32)cc1 96025085 IOCAYRPRDSQMNK-UHFFFAOYSA-N 335.812 3.207 50 40 EGGB CC(C)OC(=O)c1ccc(Cl)cc1-c1ccc(/C=N/NC(N)=O)o1 574682 DBLJGQPCGAXLAB-UFWORHAWSA-N 349.774 3.167 50 40 EGGB O=C(CCCCl)NC(=S)Nc1ccccc1N1CCCC1 6615688 YFBNZKOAAYCOHV-UHFFFAOYSA-N 325.865 3.119 50 40 EGGB COc1cccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2C)c1 59167391 JJIUYQFOQXPNKT-KGENOOAVSA-N 337.423 3.368 50 40 EGGB C[C@]12CC[C@H]3[C@@H](CC[C@@]45O[C@H]4C(O)=C(C#N)C[C@]35C)[C@@H]1CC[C@H]2O 118916773 KVJXBPDAXMEYOA-CPRALFAPSA-N 329.440 3.467 50 40 EGGB Cc1cc(C)nc(NNC(=O)c2ccc(OC3CCCC3)cc2)n1 46331406 QPMQVSNPDGOESD-UHFFFAOYSA-N 326.400 3.172 50 40 EGGB Cc1ccc(/C=N/NC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)o1 19328007 IWXLMXAUAWVYMW-HAVNEIBRSA-N 347.589 3.289 50 40 EGGB C=CCc1cc(/C=C(/C#N)C(=O)NC(C)C)cc(OC)c1OCC 408775826 SIZCJPLXKYDCLS-YBEGLDIGSA-N 328.412 3.254 50 40 EGGB COc1ccc([C@@H]2NC(=S)NC(C(C)(C)C)=C2C#N)cc1OC 409368061 MKEKEPLZIKGCCC-AWEZNQCLSA-N 331.441 3.046 50 40 EGGB O=C(N/N=C\c1cccn1-c1cccc(C(=O)O)c1)Nc1ccccc1 33323660 FHFKVPIBQXEBBQ-MOSHPQCFSA-N 348.362 3.331 50 40 EGGB CC(C)N1C(=O)/C(=N\NC(=O)c2cccc(Cl)c2)c2ccccc21 8043155 NOOGUGRRNBOGTC-SILNSSARSA-N 341.798 3.229 50 40 EGGB CCOC(=O)c1c(NC(=O)C(Cl)Cl)sc(C(C)=O)c1C 3194960 QDPGMGYOACFYJV-UHFFFAOYSA-N 338.212 3.178 50 40 EGGB CC(C)(C)OC(=O)N[C@@]12CC[C@@H]([C@H](Br)C1=O)C2(C)C 256050124 CTXVRIFBVMUAMT-FZNYLWTLSA-N 332.238 3.032 50 40 EGGB Cc1noc(COC(=O)/C(C#N)=C/c2cc(C)n(CC(C)C)c2C)n1 23382391 GXVDDNSAGFPMPE-FRKPEAEDSA-N 342.399 3.103 50 40 EGGB CC(C)(C)c1ccc(C(=O)NNC(=S)NCc2ccccc2)cc1 411158 OPNSGPRGXMNMGV-UHFFFAOYSA-N 341.480 3.293 50 40 EGGB N#CCn1cc(/C=C(/C#N)C(=O)NCc2ccccc2)c2ccccc21 408747604 QEOUQZHVXKOJJR-ATVHPVEESA-N 340.386 3.388 50 40 EGGB C#CSC1=C(C#N)[C@@H](c2ccccc2[N+](=O)[O-])C(C(C)=O)=C(C)N1 4629140 ZSHMWZFCULPYBC-MRXNPFEDSA-N 339.376 3.204 50 40 EGGB Cc1cc(/C=N/NC(N)=O)c(C)n1-c1ccc(Cl)cc1Cl 4782793 DVSSFEVAJDJKKA-CNHKJKLMSA-N 325.199 3.403 50 40 EGGB O=C(N/N=C/c1ccc(Br)c([N+](=O)[O-])c1)c1ccccc1 4814077 GHSYNBWXZICVAL-CXUHLZMHSA-N 348.156 3.121 50 40 EGGB Cc1ccccc1NNC(=O)c1cnc(-c2cccc([N+](=O)[O-])c2)nc1 408527873 CVUFYQZFCDYMJT-UHFFFAOYSA-N 349.350 3.117 50 40 EGGB CC(C)(C)[Si](C)(C)OC[C@@H]1CC[C@@H](n2cnc3c(N)ncnc32)O1 195516885 KGDNLTOAOQTVGA-RYUDHWBXSA-N 349.511 3.108 50 40 EGGB C/C(=N/NC(=O)CSc1nc2ccccc2s1)c1ccncc1 13113834 FQZAFUVFOTXXNQ-ODLFYWEKSA-N 342.449 3.324 50 40 EGGB CCOc1cc(/C=C(/C#N)C(N)=O)ccc1OCc1ccc(C)cc1 33410038 YYJNMWSJRCATFN-YVLHZVERSA-N 336.391 3.365 50 40 EGGB N#C/C(=C\c1c[nH]nc1-c1cc2ccccc2o1)C(=O)N1CCCC1 63276200 KYPPWLIEEJVNFP-NTEUORMPSA-N 332.363 3.352 50 40 EGGB N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)c1nc2ccccc2[nH]1 3900789 UBPJTQFRPVOWPZ-VZUCSPMQSA-N 334.291 3.264 50 40 EGGB COc1ccccc1N[C@H](C)C(=O)N/N=C(\C)c1ccc(C)cc1 5798791 PPIIADHXFFOZDK-HFITWMCCSA-N 325.412 3.344 50 40 EGGB N#C/C(=C/c1ccc(N2CCOCC2)cc1)c1ccc(C(=O)O)cc1 408541300 FVAZGFLJFAUNCI-AQTBWJFISA-N 334.375 3.286 50 40 EGGB CCOc1ccc(/C=N\NC(=O)COc2cccc(Cl)c2)cc1 30802367 AIPURGGFHJGPQN-ODLFYWEKSA-N 332.787 3.268 50 40 EGGB Cc1cccc(NCC(=O)N/N=C\c2c(C)n(C)c3ccccc23)c1 4888872 OBSAHNDIHJISNJ-UUYOSTAYSA-N 334.423 3.357 50 40 EGGB CCN(CC)c1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)cc1 483019 AEDQZFYIJOTDTG-SFHVURJKSA-N 337.423 3.348 50 40 EGGB Cc1cc(/C=N/NC(=O)CN2CCCCC2)c(C)n1-c1ccccc1 28216566 QTDBZKDZMWGRGN-KGENOOAVSA-N 338.455 3.030 50 40 EGGB N#C/C(=C\C=C\c1ccccc1[N+](=O)[O-])C(=O)NCCc1ccccc1 3525960 MJPPAIPVQHDDKK-RAMZCSBVSA-N 347.374 3.417 50 40 EGGB CCOc1ccccc1/C=N/NC(=O)COc1ccc(C)cc1C 6554621 BURZRYCDMDDTHB-UDWIEESQSA-N 326.396 3.231 50 40 EGGB O=C(N/N=C/c1cccnc1)c1cc2cc(Br)ccc2[nH]1 18191502 ONXZFCRYVHWJSF-GIJQJNRQSA-N 343.184 3.089 50 40 EGGB CC(C)(C)C1CCC(=NNC(=O)C(=O)Nc2ccc(F)cc2)CC1 4867103 MFPPRDHCCJOABV-UHFFFAOYSA-N 333.407 3.473 50 40 EGGB CCn1c(C)cc2c(c1=O)[C@@H](c1ccc(Cl)cc1)C(C#N)=C(N)O2 2334541 ABONZUVKEHVMFO-HNNXBMFYSA-N 341.798 3.048 50 40 EGGB Cc1ccc(CC[C@H]2NC(=O)C(C#N)=C(S)N2c2ccccc2)o1 11615969 AZYMSMPSQBBXEU-INIZCTEOSA-N 339.420 3.148 50 40 EGGB Cn1cccc1/C=N\NC(=O)c1cc2cc(Br)ccc2o1 409092441 YFRVBVDEJOCTJO-MFOYZWKCSA-N 346.184 3.298 50 40 EGGB COc1cccc(C(=O)N/N=C/c2cc(Br)c(C)o2)c1 408837604 JPUNYLSJFWBHLD-LZYBPNLTSA-N 337.173 3.123 50 40 EGGB O=C(O)c1cccc(S(=O)(=O)SC(Cl)(Cl)Cl)c1 1760570 RPONFCGGIBYXOF-UHFFFAOYSA-N 335.617 3.134 50 40 EGGB N#CC1=C(N)N=C(S)[C@@H](C(=O)Nc2ccccc2)C12CCCCC2 102413744 BTDQFLSOHQCDOH-CQSZACIVSA-N 340.452 3.228 50 40 EGGB COc1cccc(/C=N/NC(=O)Cc2ccc(C)c(C)c2)c1OC 408569256 ZUALRKFIZZGFFH-UDWIEESQSA-N 326.396 3.013 50 40 EGGB N#CC(C#N)=Cc1cn(CCC(=O)O)nc1-c1ccc(Cl)cc1 3273746 LLAPRRPSFLUVNA-UHFFFAOYSA-N 326.743 3.109 50 40 EGGB CCCCSC1=C(C#N)[C@@H](c2ccccc2OC)[C@@H](C#N)C(=O)N1 9331398 DAXHIKRBUFIOKG-CJNGLKHVSA-N 341.436 3.317 50 40 EGGB Cc1cc(C(=O)COC(=O)/C(C#N)=C\c2ccco2)c(C)n1C1CC1 96801601 WCLFTKZDTWGVLB-ZROIWOOFSA-N 338.363 3.366 50 40 EGGB CCOc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccccc1)OCO2 409102220 VITDDGFXRUQPBW-RIYZIHGNSA-N 336.347 3.360 50 40 EGGB O=C(N/N=C/c1ccco1)[C@H]1Oc2ccccc2O[C@H]1c1ccccc1 95532891 FCDVMPIMSLNVSI-GCOJUMRASA-N 348.358 3.311 50 40 EGGB N#C/C(=C/c1ccc(F)cc1)C(=O)N1CCN(c2ccccc2)CC1 255492934 MFZHFZZZCYLCFC-VKAVYKQESA-N 335.382 3.081 50 40 EGGB Cc1ccc(-c2n[nH]c3c2[C@@H](c2ccccc2O)C(C#N)=C(N)O3)cc1 5941561 ZJSOUHCWFAXYAH-INIZCTEOSA-N 344.374 3.309 50 40 EGGB Cc1cc(I)ccc1NC(=O)C(Cl)Cl 129214 VSEVVMKQLAMWLJ-UHFFFAOYSA-N 343.979 3.342 50 40 EGGB CCN1CCC(=NNC(=O)C(c2ccccc2)c2ccccc2)CC1 55079137 OSWCTLVOSJMDAL-UHFFFAOYSA-N 335.451 3.406 50 40 EGGB O=C(O)c1ccc(/C=N\NC(=O)c2ccc(Cl)cc2Cl)cc1 408760720 QINWVFPKNIQMIS-LSCVHKIXSA-N 337.162 3.456 50 40 EGGB COC(=O)c1cc(/C=C(\C#N)c2nnc(-c3ccccc3)n2C)oc1C 98052601 MNTJGSZDZJPBMD-NTEUORMPSA-N 348.362 3.234 50 40 EGGB CCO[Si](OCC)(OCC)c1cccc(C#C[Si](C)(C)C)c1 575182220 HWOHBJVEELXISP-UHFFFAOYSA-N 336.580 3.171 50 40 EGGB CC(=O)Nc1cccc(C(=O)N/N=C/c2c(C)n(C)c3ccccc23)c1 582063 CVEHSEWKUYXQBV-CIAFOILYSA-N 348.406 3.209 50 40 EGGB COc1cccc(C(=O)NNc2nc3c(OC)cccc3s2)c1 4121309 KHJYVJPZGBVTSW-UHFFFAOYSA-N 329.381 3.070 50 40 EGGB COc1cc(C(=O)N/N=C(\C)[C@@H]2C[C@@H]3CC[C@@H]2C3)cc(OC)c1OC 102123331 AVTPWNSWYYPBDO-LABPWGGASA-N 346.427 3.254 50 40 EGGB C/C(=N\NC(=O)c1csc2ccccc12)c1cc(O)cc(O)c1 13322276 NSHULVXFBFCKTN-VCHYOVAHSA-N 326.377 3.467 50 40 EGGB CCc1cccc2c(/C=N/NC(=O)c3c(C)nc4ccccn34)c[nH]c12 6210535 GXAUKFRLPZXHLV-WSDLNYQXSA-N 345.406 3.450 50 40 EGGB COc1ccc(/C=N/NC(=O)COc2ccc(C)c(C)c2)cc1Cl 4694158 HPFBSJHOYIYNSN-KEBDBYFISA-N 346.814 3.495 50 40 EGGB CCC(=O)c1ccc(Br)cc1NC(=O)CBr 9425698 XEANPFWPZVXDJV-UHFFFAOYSA-N 349.022 3.375 50 40 EGGB O=C(N/N=C/c1cccc(OCCBr)c1)c1ccccc1 41078012 OYCGLWFPVQVPSS-LDADJPATSA-N 347.212 3.224 50 40 EGGB Cc1cc(/C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)c(C)n1C 309054 GQDMLEHRNMQYID-WOJGMQOQSA-N 346.434 3.389 50 40 EGGB CC1(C)[C@@H]2CC[C@](C(=O)O)(C2)[C@@]1(Br)CBr 100749282 OSNJXUXPWZALOC-AVPPRXQKSA-N 340.055 3.426 50 40 EGGB CCOc1ccc(N2C(=O)C[C@@]3(C[C@@H](Cl)N=N3)C2=O)cc1Cl 4498639 OOFPJBMNIDQFGG-FZMZJTMJSA-N 342.182 3.162 50 40 EGGB CCOC(=O)/C(C#N)=C\C=C(\c1ccc(Cl)cc1)N1CCOCC1 5795441 WZICQINJSZMXTB-IGZCTHCLSA-N 346.814 3.026 50 40 EGGB COC(=O)C1=C(C)OC(n2cccc2)=C(C#N)[C@H]1c1ccc(O)cc1 4751945 IHLZXERAPQZXSO-QGZVFWFLSA-N 336.347 3.147 50 40 EGGB O=C(CCc1c[nH]c2ccccc12)N/N=C/c1cccc([N+](=O)[O-])c1 259992 DBKHRBMIMDLIRA-RGVLZGJSSA-N 336.351 3.159 50 40 EGGB Cc1ccc(C)c(NC(=O)/C(C#N)=C2\C(=O)N(C)c3ccccc32)c1 59145936 UKBFWBYBDNHDBY-SDXDJHTJSA-N 331.375 3.196 50 40 EGGB CC1(C)CC(=O)[C@@H](C(=O)/C=C/c2ccccc2)C(=O)[C@@H]1Br 104832357 FTZWJPQHMYAASF-RIEFBQKVSA-N 349.224 3.217 50 40 EGGB CN1CCN(c2ccc(NC(=O)[C@H](Cl)c3ccccc3)cc2)CC1 4040299 WHXXJPWKKBOYRW-GOSISDBHSA-N 343.858 3.357 50 40 EGGB C/C(=N\NC(=O)CCCNc1ccc(Cl)cc1)c1ccccn1 5369995 AEFNQDJOBAHEKV-FYJGNVAPSA-N 330.819 3.468 50 40 EGGB COC(=O)c1cc(Br)c(/C=C(\C#N)c2ccccn2)n1C 98055953 HTDQVMYUGWFTDS-JXMROGBWSA-N 346.184 3.033 50 40 EGGB O=C(N/N=C/c1ccc2cccc(O)c2n1)c1cccc(Cl)c1 241098 FNFYBASMAMQYLV-VXLYETTFSA-N 325.755 3.358 50 40 EGGB O=C(NNC(=O)c1cc2ccccc2cc1O)Nc1ccccc1F 15934081 OOOPJBGWVZLURR-UHFFFAOYSA-N 339.326 3.151 50 40 EGGB CN(C)c1ccc([C@@H]2[C@H]3CCCC=C3C(C#N)=C(N)C2(C#N)C#N)cc1 20123566 GHOSEHVBNZLUNA-PKOBYXMFSA-N 343.434 3.346 50 40 EGGB Clc1cc(I)cc2c1OC[C@@H](Cl)C2 4183012 MAYBFARWZZSLDO-LURJTMIESA-N 328.964 3.487 50 40 EGGB COc1cccc(/C=C(/C#N)C(N)=O)c1OCc1ccc(Cl)cc1 409083554 LAAZFBDDBVZMOC-ZROIWOOFSA-N 342.782 3.320 50 40 EGGB COc1ccc2ccc(OC)c(/C=N\NC(=O)c3ccncc3)c2c1 15018605 APJBKTPYSCIHAN-MTJSOVHGSA-N 335.363 3.016 50 40 EGGB O=C(NNc1ccccc1)c1ccccc1I 16490266 ICALCEMFMIMOHH-UHFFFAOYSA-N 338.148 3.048 50 40 EGGB COc1cc(/C=C(/C#N)c2cccc([N+](=O)[O-])c2)cc(OC)c1O 6145543 WNXDUJJPKKGCFN-MLPAPPSSSA-N 326.308 3.382 50 40 EGGB CO[C@H](C(=O)N/N=C/c1c(O)ccc2ccccc12)c1ccccc1 59366780 GQVJJPAYDSEIMX-IOVUBPJKSA-N 334.375 3.383 50 40 EGGB O=C(NNC(=O)C1(c2ccccc2)CCC1)c1ccccc1Cl 25524721 ILSKUNBABMZQPG-UHFFFAOYSA-N 328.799 3.223 50 40 EGGB N#C/C(=C\c1cc(Cl)ccc1OCc1cccc(F)c1)C(N)=O 59133217 CJGIYVRGTCILFK-NTUHNPAUSA-N 330.746 3.450 50 40 EGGB O=C(NNC(=O)C1(c2ccc(Cl)cc2)CCCC1)c1ccncc1 6083725 FQRNRDMFOMJRSH-UHFFFAOYSA-N 343.814 3.008 50 40 EGGB CCOc1nc2c([nH]1)OC(N)=C(C#N)[C@H]2c1ccccc1C(C)(C)C 5817626 PNMLFEJQEUKYRJ-CQSZACIVSA-N 338.411 3.324 50 40 EGGB CS(=O)(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccccc1 96765717 CHLUEWIUWZERHQ-PDGQHHTCSA-N 349.415 3.448 50 40 EGGB Cn1cc([C@@H]2C[C@@H]2C(=O)NN(Cc2ccccc2)c2ccccc2)cn1 68237379 MHZOEFGKLVGQHP-PMACEKPBSA-N 346.434 3.262 50 40 EGGB CC1CCN(c2ccc(/C=C(\C#N)C(=O)Nc3cccnc3)o2)CC1 409273898 MSPMBYAJLQQZDA-RVDMUPIBSA-N 336.395 3.457 50 40 EGGB O=C(CN1Cc2ccccc2C1)N/N=C/c1c(O)ccc2ccccc12 409199552 OXGWQMOWAOZCAU-SSDVNMTOSA-N 345.402 3.011 50 40 EGGB COc1cccc(-c2n[nH]c3c2[C@H](c2ccc(C)o2)C(C#N)=C(N)O3)c1 5818374 XDXFDTWRMBZNAH-HNNXBMFYSA-N 348.362 3.205 50 40 EGGB CCOc1ccc(N[C@H](CC)C(=O)N/N=C/c2ccc(O)cc2)cc1 370280 XDORCZRYXWMATO-JZQBQCRLSA-N 341.411 3.132 50 40 EGGB CCCCSC1=C(C#N)[C@@H](c2ccccc2OC)[C@H](C#N)C(=O)N1 9374649 DAXHIKRBUFIOKG-BBRMVZONSA-N 341.436 3.317 50 40 EGGB COc1cc(/C=C(\C#N)S(=O)(=O)c2ccc(F)cc2)cc(OC)c1 7062854 VABFOHFPBOODII-RQZCQDPDSA-N 347.367 3.181 50 40 EGGB O=C(NNc1ncnc2cc(F)ccc12)C1C2CC3CC(C2)CC1C3 97105471 WMORHTMPTORITP-UHFFFAOYSA-N 340.402 3.284 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/c2cccc(C(F)(F)F)c2)c(F)c1 408967274 PSGJXDHLWURBCM-LSFURLLWSA-N 335.260 3.480 50 40 EGGB CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1ccc(O)cc1 408802723 GNJKUDBPAYYNRM-GXDHUFHOSA-N 338.363 3.345 50 40 EGGB Cc1cc(C)n(Cc2ccc(C(=O)N/N=C/c3cccs3)cc2)n1 130479 NMCBSJFGMKLFQG-YBFXNURJSA-N 338.436 3.374 50 40 EGGB N#CC1=C(S)NC(=S)[C@H]([n+]2ccccc2)[C@H]1c1ccc(F)cc1 5583152 TZQOMGDUKXLKSP-LSDHHAIUSA-O 342.444 3.034 50 40 EGGB COc1ccc(/C=N/NC(=O)COc2ccccc2Cl)c(C)c1 408916022 SZFACKLXZWVONY-VXLYETTFSA-N 332.787 3.186 50 40 EGGB O=C(NNC(=O)c1cccc(C(F)(F)F)c1)c1cccc(Cl)c1 5861294 ICKFJTMDNBJPRR-UHFFFAOYSA-N 342.704 3.434 50 40 EGGB CCCCOc1ccc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc1 2697173 VUVWKXITOVSGSH-QIPRVMPFSA-N 328.412 3.068 50 40 EGGB O=C(CSCc1ccc(Cl)cc1)N/N=C/c1ccc(O)cc1 59147653 NEBYAWXWNTVIEK-GIJQJNRQSA-N 334.828 3.429 50 40 EGGB NC(=O)N/N=C/c1cccc(OC(=O)c2cccc3ccccc23)c1 408897587 YPVOQMAAEWTMEB-CIAFOILYSA-N 333.347 3.061 50 40 EGGB Cc1nnc(SCC(=O)/C(C#N)=C2/Nc3ccccc3S2)s1 6534269 VDQOEHKWBVLPDJ-LCYFTJDESA-N 346.462 3.461 50 40 EGGB C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)Nc1ccccc1 7649863 DCFJKCDKEXSUSG-CQSZACIVSA-N 349.390 3.460 50 40 EGGB COc1ccccc1NC(=O)N/N=C\c1cn(CC#N)c2ccccc12 409369513 CFUXFUIUPODQHB-MTJSOVHGSA-N 347.378 3.329 50 40 EGGB CNC(=O)/C(C#N)=C/c1ccc(OCC(C)C)c(Br)c1 408605678 YMQZFTQGXUPDNO-WUXMJOGZSA-N 337.217 3.137 50 40 EGGB C[C@H](NC(=O)/C(C#N)=C/c1ccco1)c1cccc(-n2ccnc2)c1 96432120 KUYDEQMHUNYEKE-LUYJPIOASA-N 332.363 3.250 50 40 EGGB CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc3c(c2)OCO3)cc1 5907204 NSCYFIGXOCPTLD-ZROIWOOFSA-N 336.347 3.360 50 40 EGGB N#C/C(=C/c1cn(CCOc2ccccc2)c2ccccc12)C(N)=O 1896586 CDGPWNMUZPRTAL-QINSGFPZSA-N 331.375 3.113 50 40 EGGB O=[P@](NO)(OCc1ccccc1)N(CCCl)CCCl 6575124 WNLFPUFBGUDCBF-LJQANCHMSA-N 327.148 3.070 50 40 EGGB COc1ccnc(NNC(=O)c2oc3c(ccc4ccccc43)c2C)n1 46364199 ICEMWHSAIDSSFG-UHFFFAOYSA-N 348.362 3.450 50 40 EGGB CCOC(=O)c1sc2nc(C)cc(C)c2c1NC(=O)CCl 3888743 UQNQPTLBUPYUBL-UHFFFAOYSA-N 326.805 3.267 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)c2cc(C(C)(C)C)n[nH]2)cc1 5686332 FFCZTVFCHSBPNQ-DEDYPNTBSA-N 341.459 3.317 50 40 EGGB O=C(N/N=C/c1ccco1)c1ccc(NC(=O)c2ccccc2)cc1 5601740 SXGJBTLWSMFRRY-DEDYPNTBSA-N 333.347 3.296 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/c2cc(Cl)cc(Cl)c2O)cc1 60809885 WQDMIDLFYLPVQW-UFWORHAWSA-N 334.162 3.335 50 40 EGGB Cn1cccc1/C=C(/C#N)C(=O)Nc1cccc(Br)c1 409108172 VJUHJFOWYNYVHW-FLIBITNWSA-N 330.185 3.333 50 40 EGGB CCOC(OCC)C(C)(C)OC(=O)Oc1ccc([N+](=O)[O-])cc1 72399699 RJQOVDVGEWOCIA-UHFFFAOYSA-N 327.333 3.288 50 40 EGGB in-vitro CCOc1cc(C=NNC(=O)[C@@H](C)Oc2ccc(C)cc2)ccc1O 245204286 MVUBCCAFGLMMOL-CQSZACIVSA-N 342.395 3.017 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)c2ccc(C)o2)cc1[N+](=O)[O-] 573551 AFVORVHCQMFBPJ-GZTJUZNOSA-N 331.328 3.049 50 40 EGGB CSC1=NC=C(C#N)C2=N[C@@H](c3c(Cl)cccc3Cl)NN12 5662855 ZHLCCABHBFMOQP-LLVKDONJSA-N 338.223 3.351 50 40 EGGB N#CC1=C(N)N=C(Sc2ccccc2)C2=C(N)Oc3ccccc3[C@@H]12 20102574 RRWFLRIXBCTSKI-HNNXBMFYSA-N 346.415 3.231 50 40 EGGB O=C(/C=C/c1cccc(Cl)c1Cl)NNC(=O)c1ccccc1 6649791 BRXQMPBBCWNLRY-MDZDMXLPSA-N 335.190 3.468 50 40 EGGB C=CCOc1ccc(C(=O)N/N=C/c2cccc(OC)c2OC)cc1 3174982 ORKACUYXHCTCKJ-DEDYPNTBSA-N 340.379 3.033 50 40 EGGB COc1ccc(C(=O)C(Br)Br)cc1OC 1764117 HLUJMWHWLACQJS-UHFFFAOYSA-N 337.995 3.002 50 40 EGGB Cc1cc(C)nc(NNC(=O)c2ccc(Oc3cccnc3)cc2)n1 63268006 RFPDGVPFKXXLAV-UHFFFAOYSA-N 335.367 3.038 50 40 EGGB CC1=CC(C)(C)N(C)c2cc(Cl)c(/C=N/NC(=O)CC#N)cc21 208466269 FHZADTAPVRPULI-KEBDBYFISA-N 330.819 3.335 50 40 EGGB CCCOc1ccc(/C=C/C(=O)NNC(=O)c2ccccc2F)cc1 40140321 YQXTYOKTPAFJGN-FMIVXFBMSA-N 342.370 3.089 50 40 EGGB O=C(NNC(=S)Nc1ccccc1Cl)[C@H]1C[C@@H]1c1ccccc1 5111393 AMMRIWACJYJSSI-OLZOCXBDSA-N 345.855 3.461 50 40 EGGB CC(C)(C)c1ccc(NC(=O)C(=O)N/N=C/c2ccc(F)cc2)cc1 408995887 FMTDTHJHNBVQKY-CIAFOILYSA-N 341.386 3.212 50 40 EGGB CC(=O)NNc1nc(C)c(C(=O)/C=C/c2ccc(Cl)cc2)s1 16957609 OAUVXOFAFALBGK-VMPITWQZSA-N 335.816 3.464 50 40 EGGB CCOc1ccccc1NC(=O)/C(C#N)=C\c1ccc(C(=O)O)cc1 44867263 YNCWLJQWQJLWMD-PTNGSMBKSA-N 336.347 3.329 50 40 EGGB CCCc1ccc(C(=O)/C(C#N)=C/c2c(C)nn(CCO)c2C)cc1 96310789 DBQFBQRKUMDFHN-LDADJPATSA-N 337.423 3.235 50 40 EGGB O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(Cl)cc1Cl 344975 IIKMLWNDOPTHOK-GIDUJCDVSA-N 328.111 3.259 50 40 EGGB O=C(Cc1csc(-c2ccccn2)n1)NNc1ccc(F)cc1 61038476 XMRWTNDCLKVKPV-UHFFFAOYSA-N 328.372 3.030 50 40 EGGB COc1ccc(Cl)cc1/C=N/NC(=O)COc1ccc(C)cc1C 3136606 LFFIALPLYDVEED-KEBDBYFISA-N 346.814 3.495 50 40 EGGB C=CCSC1=C(C#N)[C@@H](c2ccccc2C)[C@H](C(=O)OC)C(O)=N1 2296628 HXTRQANFUURSHF-CABCVRRESA-N 342.420 3.492 50 40 EGGB C/C(=N\NC(=O)C(=O)Nc1cc(Cl)ccc1Cl)c1ccco1 5194448 UHOSNWSCQYZAOQ-QGMBQPNBSA-N 340.166 3.065 50 40 EGGB C/C(=N\NC(=O)CCC(=O)Nc1ccc(C)c(C)c1)c1ccco1 4525814 ITKRZUCVBKTSGI-XSFVSMFZSA-N 327.384 3.156 50 40 EGGB CC[C@@H](c1c(F)c(F)c(F)c(F)c1F)[Si](OC)(OC)OC 170014114 LPIFBANUODTLGU-LURJTMIESA-N 330.325 3.293 50 40 EGGB Cc1ccn2c(/C=C(\C#N)C(=O)N(CC(F)(F)F)C3CC3)cnc2c1 98013317 SYMMCXCVWCCXJK-KPKJPENVSA-N 348.328 3.103 50 40 EGGB N#C/C(=C/c1c[nH]c2ccccc12)C(=O)Nc1cccc(C(=O)O)c1 408543615 PIUWQFXMZUDJEE-JYRVWZFOSA-N 331.331 3.412 50 40 EGGB O=C(CBr)Nc1ccccc1C(=O)N1CCCCCC1 35604999 SPSOUILUDJIOBK-UHFFFAOYSA-N 339.233 3.036 50 40 EGGB CC1(C)COc2ccc(/C=C(\C#N)C(=O)N3CCCC3)cc2OC1 225369867 TWEQTKANLKCTST-OQLLNIDSSA-N 326.396 3.013 50 40 EGGB Cc1cc(C(=O)N/N=C\c2ccc(-c3ccc(Cl)cc3)o2)[nH]n1 8556209 OGEFGZVUNNDSHL-NVMNQCDNSA-N 328.759 3.395 50 40 EGGB Cc1ccccc1NC(=O)/C(C#N)=C/c1ccccc1OCC(=O)O 7156953 ZZBYEVBITSKZEE-XNTDXEJSSA-N 336.347 3.004 50 40 EGGB N#C/C(=C/c1ccc(Br)s1)C(=O)NCc1ccco1 33476732 SIXOYLQUOJXMSY-TWGQIWQCSA-N 337.198 3.327 50 40 EGGB O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccn1 548835 UOLLJBZNSRVIIU-YBFXNURJSA-N 336.307 3.014 50 40 EGGB O=C(N/N=C/c1ccc2c(c1)OCO2)c1ccc(Cl)cc1Cl 256355 CEJGAPVUFBAQMD-CNHKJKLMSA-N 337.162 3.486 50 40 EGGB C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(OCC#N)cc1 8223074 YWBVRUUKUBOVPY-GNUZOCDUSA-N 339.420 3.220 50 40 EGGB O=C1C[C@]2(C[C@H](Cl)N=N2)C(=O)N1c1cc(Cl)cc(Cl)c1 5150020 VKUPXVAZFTYJHJ-BXKDBHETSA-N 332.574 3.416 50 40 EGGB O=C1C[C@]2(C[C@H](Cl)N=N2)C(=O)N1c1ccc(Cl)c(Cl)c1 5191166 VUUQJZSASNQOEH-BXKDBHETSA-N 332.574 3.416 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(C(C)(C)C)cc2)c(O)c1 4150764 DURRROBDHOJTDV-UDWIEESQSA-N 326.396 3.462 50 40 EGGB C/C(=N\NC(=O)Cc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 14003075 XQRDWSKRXRWBTO-WOJGMQOQSA-N 331.759 3.331 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)Nc2ccccc2)cc(OC)c1OC 16411083 XYRLDCZNXGHTLZ-NTEUORMPSA-N 338.363 3.258 50 40 EGGB N#CC1=C(N)n2c(nc3ccccc32)N[C@@H]1c1ccnc2ccccc12 20086197 YSIMYVHONCOKHW-GOSISDBHSA-N 338.374 3.402 50 40 EGGB Cc1ccccc1C(=O)OC[C@H](Br)CBr 2045582 FAJWGNHSIXBHQI-SECBINFHSA-N 336.023 3.310 50 40 EGGB Cc1nn(-c2ccccc2)c2c1C(=O)C(=O)C(C)(C)[C@H]2Br 3172017 QTJQTHNFBQBFJU-AWEZNQCLSA-N 347.212 3.408 50 40 EGGB CC1=C(C(=O)OCc2ccccc2)[C@@H](c2ccoc2)C(C#N)=C(N)O1 809310 VMZQTAYAGNYZQQ-KRWDZBQOSA-N 336.347 3.105 50 40 EGGB Cc1ccc(/C(N=C=S)=N/CS(=O)(=O)c2ccccc2)cc1 101973393 MDLNGQYVDRTMFI-VLGSPTGOSA-N 330.434 3.276 50 40 EGGB CCOC(=O)c1ccc(N/C=C(\C#N)C(=O)Nc2ccccc2)cc1 57413983 CQESYRAFJZNIDG-FYWRMAATSA-N 335.363 3.321 50 40 EGGB N#C/C(=C\c1ccc(O)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 4339571 LFCNGBLSNDQZGR-YRNVUSSQSA-N 343.726 3.499 50 40 EGGB CN(C)c1ccc([N+](=O)[O-])cc1/C=C(\C#N)C(=O)Nc1ccccc1 408997864 OMMITVNMRMHGGK-GXDHUFHOSA-N 336.351 3.206 50 40 EGGB CCOC(=O)/C(C#N)=C\c1cc(C)n(-c2ccc([N+](=O)[O-])cc2)c1C 4711199 WFDFHXXVOAAXQT-GDNBJRDFSA-N 339.351 3.472 50 40 EGGB CCOc1cc(/C=C(/C#N)c2cccc(F)c2)ccc1OCC(N)=O 409391591 IWELRAMSIQEYEM-NVNXTCNLSA-N 340.354 3.153 50 40 EGGB COc1ccc(-c2nnc(SCCCCl)n2C)cc1OC 228979305 HXFIJBRIWLKCRJ-UHFFFAOYSA-N 327.837 3.220 50 40 EGGB CC(C)(C(=O)/C(C#N)=C/c1cccc(C(F)(F)F)c1)n1cncn1 1391430 IMOLNJSKPVPTFV-WUXMJOGZSA-N 334.301 3.208 50 40 EGGB COc1cc(NC(=O)c2cccc(CCl)c2)c(C(=O)O)cc1OC 160088 CXUAIFGPRAMBQV-UHFFFAOYSA-N 349.770 3.393 50 40 EGGB Cc1cc(/C=N/NC(N)=O)c(C)n1-c1cc(Cl)cc(Cl)c1 7895031 ZXLQZIMTJZCTET-CNHKJKLMSA-N 325.199 3.403 50 40 EGGB CN1/C(=C\C=N\NC(=O)c2ccc(N)cc2)C(C)(C)c2ccccc21 13116944 MEORQELNTDOASE-MYECPZRPSA-N 334.423 3.296 50 40 EGGB C/C(=N\NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccco1 5288021 BOCSTLASWNDUKR-RCCKNPSSSA-N 334.375 3.056 50 40 EGGB CC(C)COc1ccc(/C=N/NC(=O)[C@@H](C#N)c2ccccc2)cc1 409194792 MJDUITCZEQYSMR-MEGCXXLRSA-N 335.407 3.479 50 40 EGGB CC(C)(C)c1ccc(/C=N/NC(=O)C(=O)NC2CCCCCC2)cc1 409006077 LRIVNXTYYTUPLF-KGENOOAVSA-N 343.471 3.273 50 40 EGGB C/C(=N\NC(=O)Cc1cc(C)ccc1C)c1cccc([N+](=O)[O-])c1 409361450 HHTPYSSBRIESGX-XMHGGMMESA-N 325.368 3.295 50 40 EGGB Cc1ccc(SCCNC(=O)NNC(=O)c2ccccc2)cc1C 45127769 UTDFQXQJNKBPGH-UHFFFAOYSA-N 343.452 3.040 50 40 EGGB COc1cc(C(=O)N/N=C/c2ccc(F)s2)ccc1OC(F)F 252499086 RVHDFDUUPZQZEW-CNHKJKLMSA-N 344.314 3.261 50 40 EGGB O=C(Cc1cn2ccsc2n1)N/N=C1\CCCCc2ccccc21 6210264 JLZJRHWXPUFJMJ-CAPFRKAQSA-N 338.436 3.185 50 40 EGGB CCOC(=O)CC(=O)N/N=C/c1c2ccccc2cc2ccccc12 6077655 JMKOPSXLVGLIBL-FYJGNVAPSA-N 334.375 3.396 50 40 EGGB O=C(Cc1c[nH]c2ccccc12)N/N=C/c1ccc(-n2ccnc2)cc1 19636819 JYHLEJJYXVEXEV-FSJBWODESA-N 343.390 3.046 50 40 EGGB Cc1ccsc1/C=N/NC(=O)CSc1nc2ccccc2o1 523514 AGWVZRMOSRFNPS-LZYBPNLTSA-N 331.422 3.440 50 40 EGGB CCCOc1ccc(C(=O)N/N=C/c2ccc(OC)c(OC)c2)cc1 20197323 RQESZACFHQRJHV-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB Cc1nn(-c2ccccc2)c(Cl)c1/C=C(\C#N)C(=O)NC(C)C 2622669 HWGKZECAADYFIB-UKTHLTGXSA-N 328.803 3.266 50 40 EGGB CC(C)C(=O)/C(C#N)=C1/NC(=O)[C@H](Cc2ccc(Cl)cc2)S1 4540085 JCBLYOYUOZSFDB-WIOAZZGGSA-N 334.828 3.074 50 40 EGGB C/C(=N\NC(=O)[C@H]1COc2ccccc2O1)c1ccc(C(C)C)cc1 4694088 PPAXDKZRSDFDIE-KNGGAZFVSA-N 338.407 3.490 50 40 EGGB O=C(CCc1ccccc1)NNC(=O)Nc1ccc(F)c(Cl)c1 15933704 ZVWGCHDQFODROQ-UHFFFAOYSA-N 335.766 3.265 50 40 EGGB Cc1cc(/C=N/NC(=O)[C@H](O)c2ccccc2)c(C)n1-c1ccccc1 408586861 CRJKAEPIJLPJGF-YRXLECQKSA-N 347.418 3.278 50 40 EGGB O=C(N/N=C/c1cc(Br)ccc1O)c1ccc(F)cc1 254362 KUTXNMVIGPLMLY-CAOOACKPSA-N 337.148 3.058 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(Cl)c(Cl)c2)cc1O 6170680 UUKZTLHWDYPYSA-QGMBQPNBSA-N 339.178 3.472 50 40 EGGB CCOC(=O)[C@H](Br)C(=O)c1ccc(C(F)(F)F)cc1 100032841 RRUJHLRWOPOKCV-SECBINFHSA-N 339.107 3.215 50 40 EGGB Cc1nc(-c2ccccc2)ccc1C(=O)NNC(=O)c1cccs1 17260487 QQHRRRCNTNXTNX-UHFFFAOYSA-N 337.404 3.193 50 40 EGGB COc1ccc(/C(C#N)=C/c2ccc(OC)c(C(=O)O)c2)cc1OC 408580321 OIIIGUKSMXNCIG-RIYZIHGNSA-N 339.347 3.475 50 40 EGGB CC(C)(C)OC(=O)N1C[C@@]2(C[C@H]1CBr)CC2(F)F 952958962 ONZBWGFCTFTPNC-GZMMTYOYSA-N 326.181 3.416 50 40 EGGB Cc1cccc(NCC(=O)N/N=C/c2c(C)n(C)c3ccccc23)c1 546387 OBSAHNDIHJISNJ-WSDLNYQXSA-N 334.423 3.357 50 40 EGGB C/C(=N\NC(=O)c1cc(C)nc2ccccc12)c1ccc(O)cc1O 105502179 HCCFKRKOOCYINT-CIAFOILYSA-N 335.363 3.108 50 40 EGGB C=CCOc1ccc(C(=O)N/N=C\c2cccc(OC)c2)cc1OC 409318171 UBOJJOGFPBRLPA-MOSHPQCFSA-N 340.379 3.033 50 40 EGGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C/c1ccc(Cl)cc1 408566513 HDMIDUIGERPOIJ-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB COc1cc2c(cc1/C=C(\C#N)C(=O)Nc1cccc(C)c1)OCO2 409064728 FPLSWCVOHFLLJE-VGOFMYFVSA-N 336.347 3.278 50 40 EGGB CCOc1ccc(/C=N/NC(=O)Cc2ccc(Cl)cc2)cc1OC 46589839 ZHFAFXUUZFVDEK-UDWIEESQSA-N 346.814 3.440 50 40 EGGB COCCn1c(C)cc(/C=N/NC(=O)c2ccc(Cl)cc2)c1C 3573182 RYQOVFXIBCMLGU-YBFXNURJSA-N 333.819 3.169 50 40 EGGB CCOc1ccc(/C=N/NC(=O)CNc2ccc(Cl)cc2)cc1 223418 QNDWOBMIYHBPJK-RGVLZGJSSA-N 331.803 3.301 50 40 EGGB N#Cc1ccc(/C=N/NC(=O)c2ccc(Br)cc2)cc1 221025 ZAKMBONSCUHOOP-VCHYOVAHSA-N 328.169 3.085 50 40 EGGB CC1(C)[C@@H]2C[C@@H]1CC=C2/C=N/NC(=O)c1nnc(-c2ccccc2)o1 103793685 NJOKGBBVKSPALN-ZHLFYBBGSA-N 336.395 3.445 50 40 EGGB CCOc1cccc(-c2cc(C(=O)N/N=C(\C)c3ccco3)[nH]n2)c1 9324620 SCVNHVDZEQQBEY-XDHOZWIPSA-N 338.367 3.222 50 40 EGGB N#C/C(=C\c1cccc(OCc2ccccc2)c1)C(=O)N1CCOCC1 40006739 YWAFWQRNMHLGGK-CPNJWEJPSA-N 348.402 3.031 50 40 EGGB CCCOc1ccc([C@H]2C(C#N)=C(N)Oc3[nH]nc(CCC)c32)cc1 5051882 HMKDRPAEAOLHAM-INIZCTEOSA-N 338.411 3.369 50 40 EGGB O=C(NNC(=O)C1[C@H]2CCCC[C@@H]12)Nc1cccc(C(F)(F)F)c1 18068272 REVQHYWESAEDKU-FUNVUKJBSA-N 341.333 3.294 50 40 EGGB Cc1cc(C)nc(NNC(=O)c2ccc(SC(F)(F)F)cc2)n1 11334562 NLRHACDTAIQLOR-UHFFFAOYSA-N 342.346 3.462 50 40 EGGB COC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1OCc1ccc(F)cc1 510098 WPDKDNNQRZTOIU-GIJQJNRQSA-N 347.302 3.003 50 40 EGGB Cc1ccccc1NCC(=O)N/N=C/c1c(C)n(C)c2ccccc12 548082 XAGOQCJLEKXNQS-WSDLNYQXSA-N 334.423 3.357 50 40 EGGB C/C(=N\NC(=O)CN1C(=O)c2cccc3cccc1c23)c1ccccc1 106824810 YJBZLZVTLNLDAN-HYARGMPZSA-N 343.386 3.340 50 40 EGGB COC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@@H]2c1ccccc1C 1426966 WGFGHLLWRDDUSR-AWEZNQCLSA-N 340.404 3.370 50 40 EGGB CCc1ccc(/C(C)=N/NC(=O)c2ccc(OC)c(OC)c2)s1 4155430 HDMCLKWYCFBYQQ-WOJGMQOQSA-N 332.425 3.482 50 40 EGGB CCc1sc(C(=O)NNC(=O)c2ccc3ccccc3n2)cc1C 6929360 NXMDPXRRGCAJNT-UHFFFAOYSA-N 339.420 3.242 50 40 EGGB N#C/C(=C/c1ccc[nH]1)c1nc(-c2ccc(O)c(C(N)=O)c2)cs1 96931092 OTUWPBFFGFJPTH-WDZFZDKYSA-N 336.376 3.007 50 40 EGGB COc1cc(C)ccc1C(=O)N/N=C/c1cccn1-c1ccc(O)cc1 409021962 GKMCNBGGOPOPQL-FYJGNVAPSA-N 349.390 3.264 50 40 EGGB CCOc1ccc(/C=C(/C#N)C(=O)NC2CCCC2)c(OCC)c1 33562102 AMMSWCVFYYOTMJ-PTNGSMBKSA-N 328.412 3.450 50 40 EGGB COc1ccc(/C=N/NC(=O)CSCc2ccccc2)cc1OC 5361085 BTBAECUIMSAMAZ-YBFXNURJSA-N 344.436 3.087 50 40 EGGB CC1=C(C#N)[C@](NC(=O)c2cccc(Cl)c2)(C(F)(F)F)C(O)=N1 4581099 XGNPIYQRDQJJRF-CYBMUJFWSA-N 343.692 3.139 50 40 EGGB O=C(N/N=C\c1ccccn1)c1cc(C23CC4CC(CC(C4)C2)C3)n[nH]1 4994253 LTKYQQYWFUMQEJ-UUYOSTAYSA-N 349.438 3.036 50 40 EGGB CC(C)(C)c1[nH]nc2c1[C@H](c1ccc(F)c(F)c1)C(C#N)=C(N)O2 377296 TWNGTRRCVGQRNB-GFCCVEGCSA-N 330.338 3.204 50 40 EGGB Cc1cccc(C)c1OCC(=O)N/N=C/c1cc(Cl)ccc1O 59146 JMVMVJPRGHBPKQ-DJKKODMXSA-N 332.787 3.192 50 40 EGGB C/C(CC(=O)Nc1ccccn1)=N\NC(=O)c1cccc2ccccc12 100510127 HUNPTKACKRGNMI-OEAKJJBVSA-N 346.390 3.369 50 40 EGGB COc1ccccc1C(=O)N/N=C/C=C/c1ccc([N+](=O)[O-])cc1 4544141 RXJNMCOOYXRNOC-ZLFBLCKNSA-N 325.324 3.032 50 40 EGGB C/C(=N\NC(=O)CNc1cccc2ccccc12)c1ccc(O)cc1 409392791 RYNWERWGZVSPFS-HYARGMPZSA-N 333.391 3.498 50 40 EGGB C#CCOc1ccc(/C=C(/C#N)C(=O)N[C@H](C)c2ccccc2)cc1 65999227 DGVILGQSRVNSIF-BAACNHRGSA-N 330.387 3.483 50 40 EGGB C/C(=N\NC(=O)Cc1ccc(Cl)cc1)c1ccc2c(c1)OCCO2 45334182 KXCYLYWVHJTQNK-UDWIEESQSA-N 344.798 3.194 50 40 EGGB C[C@H]1CCCC[C@H]1NC(=O)/C(C#N)=C\c1ccc2c(c1)OCCO2 585145706 XVXURAGENAPLOT-FVKRGRGRSA-N 326.396 3.060 50 40 EGGB Cc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)c1 17067453 HNFHMJNGAMEDFH-MRXNPFEDSA-N 329.359 3.055 50 40 EGGB COc1cc(/C=N/NC(=O)c2ccc(Cl)c(Cl)c2)ccc1O 5526645 IBBAYZHSKJHFRN-QGMBQPNBSA-N 339.178 3.472 50 40 EGGB N#C/C(=C\c1cccnc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 6633407 LGEBIENQXXKERY-IZZDOVSWSA-N 328.715 3.189 50 40 EGGB N#CC1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@H]1c1ccccc1Cl 18223107 JQLNGMAAHHDVCH-HNNXBMFYSA-N 349.777 3.400 50 40 EGGB COc1ccc(CNC(=O)/C(C#N)=C/c2ccc(C)s2)c(OC)c1 408883089 TXLZPIABNSIYBP-RIYZIHGNSA-N 342.420 3.297 50 40 EGGB C[C@H]1C[C@@H]1C(=O)NNc1nnc(-c2ccccc2)n1-c1ccccc1 31670829 OPELCFXDNGDSMN-BBRMVZONSA-N 333.395 3.033 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@H](c2ccc(Cl)cc2)[C@@H]2SCC=C12 1260711 CMNLBGZMBLGANO-HUUCEWRRSA-N 338.823 3.249 50 40 EGGB N#C/C(=C\c1cn(CC(=O)O)c2ccccc12)C(=O)Nc1ccccc1 4711215 FNCNQQRAGRUAGW-GXDHUFHOSA-N 345.358 3.272 50 40 EGGB N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc(C(=O)O)cc1 408544875 YFIFWFJHRDXJNH-WLRTZDKTSA-N 338.275 3.086 50 40 EGGB COc1ccc(-c2cc(C(=O)N/N=C/c3ccc(F)s3)n[nH]2)cc1 252496285 PFSSRFBLVAAWNS-GIJQJNRQSA-N 344.371 3.050 50 40 EGGB O=C(Nc1ccccc1C(=O)N/N=C/c1ccc(O)cc1)c1ccco1 58895662 BIERYJJHYWPDHD-UDWIEESQSA-N 349.346 3.001 50 40 EGGB O=C(N/N=C\c1cccnc1)C1c2ccccc2Oc2ccccc21 30743200 WMJNNMJUBBQVLD-XKZIYDEJSA-N 329.359 3.470 50 40 EGGB O=[N+]([O-])c1cccc(S(=O)(=O)C[C@H](Cl)c2ccccc2)c1 360794 MKWHHDBUTVJAAV-AWEZNQCLSA-N 325.773 3.349 50 40 EGGB COc1cc(OC)c(/C=N/NC(=O)c2ccc(F)cc2)cc1Cl 8812232 WWMOVXWQWLKTGW-DJKKODMXSA-N 336.750 3.260 50 40 EGGB CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C(/C#N)C(=O)O)cs1 55036904 ZCIMSYYHTMWCSE-POHAHGRESA-N 347.783 3.473 50 40 EGGB Cc1ccsc1C(=O)OCC(=O)C(C#N)=C1Nc2ccccc2N1 2658597 XNTFXKDTEYWYAU-UHFFFAOYSA-N 339.376 3.055 50 40 EGGB CCOc1ccc(Cl)cc1/C=N/NC(=O)c1ccccc1[N+](=O)[O-] 408599678 YIZQDAPRVJAWHW-VCHYOVAHSA-N 347.758 3.411 50 40 EGGB CCOc1cc(/C=C(\C#N)C(N)=S)cc(Br)c1OC 408543759 QAHCCIKWAOUDMQ-RUDMXATFSA-N 341.230 3.049 50 40 EGGB COc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccc(F)cc1)OCO2 409066768 NXALCYIIKRTXSE-WUXMJOGZSA-N 340.310 3.109 50 40 EGGB COc1cc(/C=N/NC(=O)Cc2ccc(C)c(C)c2)cc(Cl)c1O 6205611 WDHZDPKIFLVSSN-KEBDBYFISA-N 346.814 3.364 50 40 EGGB O=C(CCl)Nc1ccc(Cl)cc1/C(=N/O)c1cccc(O)c1 4695239 HZCSFISMICPXHL-XDJHFCHBSA-N 339.178 3.450 50 40 EGGB Cc1ccc([C@@H]2CC(=O)NC(SCC(=O)OC(C)C)=C2C#N)cc1 9109367 VKZDXGBBIDJYBF-AWEZNQCLSA-N 344.436 3.019 50 40 EGGB N#CC1=C(N)N2C(=C(C#N)[C@H]1c1ccccc1F)Nc1ccccc12 495073 UFKXIRLBYIOVFG-KRWDZBQOSA-N 329.338 3.284 50 40 EGGB CN1CCN(c2ccc(NC(=O)[C@@H](Cl)c3ccccc3)cc2)CC1 4040307 WHXXJPWKKBOYRW-SFHVURJKSA-N 343.858 3.357 50 40 EGGB CC1=C(C(=O)OC(C)C)[C@@H](c2ccc(Cl)cc2)C(C#N)=C(N)O1 4476288 PGIZZYVYUWRXEZ-HNNXBMFYSA-N 332.787 3.373 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)COc2ccc(Cl)cc2)cc1 4694197 INUUMEGNXSQQNB-XDHOZWIPSA-N 332.787 3.268 50 40 EGGB C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](O)CC[C@@]43C)[C@@H]1CC/C2=N\NC(N)=O 118918562 AIMQMSBWBNRJGW-IGTZSECBSA-N 347.503 3.414 50 40 EGGB C=CCOc1c(Cl)cc(/C=C(/C#N)C(=O)NC(C)C)cc1OC 408775446 HFKPGDFBJQJGIT-QPEQYQDCSA-N 334.803 3.345 50 40 EGGB O=C(N[C@@H](NC(=O)c1cccs1)C(Cl)Cl)c1ccccc1 101425594 AVLDHVSMEVJYGS-LBPRGKRZSA-N 343.235 3.038 50 40 EGGB O=C(Nc1ncccn1)c1ccc(N(CCCl)CCCl)cc1 1760771 VCDNFXSPZHWRAA-UHFFFAOYSA-N 339.226 3.013 50 40 EGGB C=CCSC1=C(C#N)[C@H](c2ccccc2)[C@@H](C(=O)OC)C(O)=N1 9088420 KPVWIOKNPVWYNO-UONOGXRCSA-N 328.393 3.184 50 40 EGGB O=C(CSc1nc2ccccc2s1)N/N=C1\C[C@H]2C=CC[C@@H]12 20932099 WXDJVUBAJRYXDR-YMGHBHBLSA-N 329.450 3.457 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)c2ccc3c(c2)OCO3)c(OC)c1 44028907 NGXUXYGOMZCETD-AUWJEWJLSA-N 337.331 3.222 50 40 EGGB CCOC(=O)/C(C#N)=C1/C(=O)N(Cc2ccccc2)c2ccccc21 44917 ILSBZJQRTQRMSR-FBMGVBCBSA-N 332.359 3.074 50 40 EGGB COC[C@@H](C)Oc1ccc2nc(NC(=O)[C@H](C)Cl)sc2c1 20132132 RUMHHPXTRVTUPD-BDAKNGLRSA-N 328.821 3.276 50 40 EGGB CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@H]1c1ccccc1 293761 LJDWOPPGIKRIIK-QGZVFWFLSA-N 346.386 3.469 50 40 EGGB C[N+](C)(Cc1ccccc1)C[C@H](Br)CBr 313498 DHTKGNSLXDMDAE-GFCCVEGCSA-N 336.091 3.421 50 40 EGGB CN(C)C(=O)CCCc1ccc(N(CCCl)CCCl)cc1 1700839 VMNREVRYMQLWCL-UHFFFAOYSA-N 331.287 3.382 50 40 EGGB CC(C)C/C=N/NC(=O)c1cccc(C(=O)N/N=C/CC(C)C)c1 4855146 IBTJJXSBJNYTMG-ROUMAOROSA-N 330.432 3.210 50 40 EGGB O=C(CSCc1ccccc1Cl)N/N=C/c1ccccc1O 20248680 QQWPMYUZBXSBAN-GIJQJNRQSA-N 334.828 3.429 50 40 EGGB C=CCOc1ccc(/C=C(\C#N)C(=O)n2nc(C)cc2C)cc1OC 408979751 SALCNGAJDVWGNO-MHWRWJLKSA-N 337.379 3.321 50 40 EGGB O=C(CBr)c1ccc(OC(F)(F)F)c([N+](=O)[O-])c1 258830431 GMNTZCSHQKZZJR-UHFFFAOYSA-N 328.040 3.071 50 40 EGGB CN1CCN(C/C(C#N)=C\c2cc(-c3ccccc3Cl)on2)CC1 96316086 AONNQGOPAACQCO-UVTDQMKNSA-N 342.830 3.149 50 40 EGGB COc1ccccc1/C=C/C=C(\C#N)C(=O)Nc1ccc(C(=O)O)cc1 20922480 QTYPCRMLQWEWSX-ANSBUGDOSA-N 348.358 3.495 50 40 EGGB O=C(NNC(=O)c1cccc2c3c([nH]c12)CCCCC3)c1ccco1 32779759 JFIKVEVBFZJALN-UHFFFAOYSA-N 337.379 3.105 50 40 EGGB N#Cc1ccc(/C=N/NC(=O)c2ccccc2Br)cc1 6672744 CTKHTCAUCBOGHZ-VCHYOVAHSA-N 328.169 3.085 50 40 EGGB CC(=O)NNC(=O)c1[nH]c2ccc(Cl)cc2c1-c1ccccc1 3149147 UZNDFGQRLICKFG-UHFFFAOYSA-N 327.771 3.269 50 40 EGGB C[C@H](Oc1ccc(Cl)cc1)C(=O)NN=Cc1ccc(N(C)C)cc1 23397233 JGVQGLKOEHARFQ-ZDUSSCGKSA-N 345.830 3.324 50 40 EGGB CC/C(=N\NC(=O)c1cc(O)c(O)c(O)c1)c1cccc(Cl)c1 5727606 VSUOQCDNAJNWHX-LDADJPATSA-N 334.759 3.001 50 40 EGGB CNC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccccc1 7209803 PUXRBJSZVBEPCP-FOWTUZBSSA-N 328.375 3.192 50 40 EGGB CN(C)c1ccc(/C=C(/C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 5585690 ORKHPAYPIZAZKR-UVTDQMKNSA-N 336.351 3.206 50 40 EGGB COc1cccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)oc2ccccc32)c1 59304 LDSUAIRLGVEHFA-MRXNPFEDSA-N 346.342 3.020 50 40 EGGB O=C1OCC[C@@]1(Br)[C@H](Br)c1ccccc1 1602845 ROIKPDSNGKFMLY-MWLCHTKSSA-N 334.007 3.203 50 40 EGGB O=C(N/N=C/c1ccccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 59920875 QSFMSFCEBJGULM-DJKKODMXSA-N 337.257 3.378 50 40 EGGB CN1C[C@H](C(C)(C)C)CO[P@@]1(=O)N(CCCl)CCCl 5640551 QXKUWRBLVIWSBG-JEOXALJRSA-N 331.224 3.498 50 40 EGGB Cc1ccccc1C(=O)NNC(=O)C1(c2cccc(Cl)c2)CC1 44670285 YFJCPFWMWCSMRM-UHFFFAOYSA-N 328.799 3.141 50 40 EGGB CCOc1ccc(C(=O)N/N=C\c2ccc(OC)cc2)cc1OCC 409322082 WGZCJJPOQOHCIK-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB CCOc1ccc(/C(CCC(=O)O)=N/NC(=O)c2ccccc2)cc1 6595665 VQPXKBSVZWSXBL-LVZFUZTISA-N 340.379 3.084 50 40 EGGB C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)OC(C)(C)C 17398488 PDPJSYLFFRSPNH-QMMMGPOBSA-N 349.214 3.317 50 40 EGGB C=CCn1cc(/C=N/NC(=O)CNC2CCCCC2)c2ccccc21 409378532 PSIIPSAXFDSUBX-LPYMAVHISA-N 338.455 3.200 50 40 EGGB O=C(CCCC(=O)N/N=C\[C@H]1CC=CCC1)N/N=C\[C@@H]1CC=CCC1 36118572 GLFGNHUMMQQQNN-XUQIVBOJSA-N 344.459 3.073 50 40 EGGB COc1cccc(/C=N/NC(=O)[C@@H](C)SCc2ccccc2)c1 313910 YYXOZMDPKGEQBV-ONDHQXCVSA-N 328.437 3.467 50 40 EGGB CC(C)Oc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccccn2)cc1 188545 KLCPDNRZTGEADW-MQMKENTISA-N 343.452 3.500 50 40 EGGB Cc1nn(-c2ccccn2)c2c1C(=O)[C@@H](Br)C(C)(C)C2 5336671 SNNQZHUBLDTDBQ-CQSZACIVSA-N 334.217 3.104 50 40 EGGB COc1ccc(-n2c(C)cc(/C=N\NC(=O)c3cccnc3)c2C)cc1 19720273 KVCYBADTGDZKKL-XKZIYDEJSA-N 348.406 3.262 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)c2ccccc2Br)cc1 231882 JDPGEFYLVGBVLM-WOJGMQOQSA-N 346.228 3.279 50 40 EGGB CCOc1ccccc1/C=N\NC(=O)COc1ccccc1Cl 32675368 RULUOSGEJSHGHT-ODLFYWEKSA-N 332.787 3.268 50 40 EGGB CC(C)(C)OC(=O)[C@]12CC[C@](CBr)(C(=O)C1)C2(C)C 85398657 IKCSFVXVONKHOK-GJZGRUSLSA-N 331.250 3.489 50 40 EGGB CCOc1cc(/C=N/NC(=O)[C@@H](C)Oc2ccc(C)cc2)ccc1O 93859 MVUBCCAFGLMMOL-MQMKENTISA-N 342.395 3.017 50 40 EGGB N#C/C(=C/c1ccc(-c2ccccc2Cl)o1)C(=O)N1CCOCC1 17177997 KPMUIRMEYRWHAM-QBFSEMIESA-N 342.782 3.366 50 40 EGGB COc1ccc(CC(=O)N/N=C\c2ccc(Cl)cc2)cc1OC 59515918 WAPKMFOQMVDJCS-ODLFYWEKSA-N 332.787 3.050 50 40 EGGB O=C(CCC(=O)N1Nc2ccccc2S1)OC(CCl)CCl 59192883 XAAPDHKEYOWPDC-UHFFFAOYSA-N 349.239 3.032 50 40 EGGB CN1/C(=C\C=N\NC(=O)NCc2ccco2)C(C)(C)c2ccccc21 64912826 UEJTXRQPGDVZJI-JWEJLUPDSA-N 338.411 3.376 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)c2ccc3c(c2)OCO3)cc1OC 44028901 HXRGSICZLRTDDB-VGOFMYFVSA-N 337.331 3.222 50 40 EGGB CC(C)Oc1ccc(/C=N/NC(=O)c2cccnc2)c(OC(C)C)c1 6049753 JJEHCIJRTGRSDN-CIAFOILYSA-N 341.411 3.420 50 40 EGGB O=C(N/N=C/c1ccccc1C(=O)O)c1cc(Cl)ccc1Cl 13342936 CTQDCCOWRQXVAZ-QGMBQPNBSA-N 337.162 3.456 50 40 EGGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2ccccc2C)c1 258437 GDGDMHIBEZCBSE-UHFFFAOYSA-N 340.423 3.267 50 40 EGGB CCc1cccc2c(/C=N/NC(=O)[C@H]3COc4ccccc4O3)c[nH]c12 3609458 MHKDUBAQLNTMFM-NMONLQQWSA-N 349.390 3.020 50 40 EGGB Cc1nn(-c2ccccc2)c(C)c1/C=N\NC(=O)Cc1cccs1 16719624 OYPNNJYCJPCPSX-UNOMPAQXSA-N 338.436 3.243 50 40 EGGB C[C@@H](Br)C(=O)NC[C@@H](OCC1CC1)c1ccc(F)cc1 95097953 DNJXWELCUUGIDI-QMTHXVAHSA-N 344.224 3.193 50 40 EGGB C[C@@H](Oc1cccc2ccccc12)C(=O)N/N=C/c1ccccc1O 5531666 XAPPZEQREOWOGC-CNRHGSOZSA-N 334.375 3.463 50 40 EGGB N#C/C(=C/[C@@H]1C[C@H](Cl)C[C@H](Cl)[C@@H]1O)C1CCC([N+](=O)[O-])CC1 104159184 NUBBBMPTQGNFID-WWEKSLTDSA-N 347.242 3.258 50 40 EGGB Cc1cc(/C=C(/C#N)C(=O)N(C)C)c(C)n1-c1ccc(N(C)C)cc1 59333696 TYJUMRJAYQHZGD-ATVHPVEESA-N 336.439 3.155 50 40 EGGB CC(C)c1cc(C(=O)NNC(=S)N[C@H]2C[C@@H]3CC[C@@H]2C3)cs1 102242899 WOLDFDYREUJZAJ-WZRBSPASSA-N 337.514 3.169 50 40 EGGB CCOc1ccccc1[C@H]1C(C#N)=C(SC)N=C(O)[C@@H]1C(=O)OC 8970586 XUHOQRJQLUCHQS-UONOGXRCSA-N 346.408 3.026 50 40 EGGB Cc1oc(/C=N/NC(=O)c2ccc(F)cc2)cc1Br 408869213 RSCOQUAHJDJIQG-FRKPEAEDSA-N 325.137 3.254 50 40 EGGB O=C(N/N=C\c1ccc(Cl)cc1)c1ccccc1NC(=O)C1CC1 31723671 XTRDBOLOXWWUHW-JAIQZWGSSA-N 341.798 3.452 50 40 EGGB O=C1S[C@@H](Nc2ccc(Br)cc2)C(=O)N1CCCl 36626579 NYGKQCNXDRWSAH-SECBINFHSA-N 349.637 3.121 50 40 EGGB Cc1cc(C)n(Cc2cccc(C(=O)N/N=C/c3ccccc3)c2)n1 130528 PXVWZSNBWWAICV-FYJGNVAPSA-N 332.407 3.312 50 40 EGGB C/C(=N\NC(=O)COc1ccccc1)c1cccc(Br)c1 13954498 GROWVCYBCOEFIZ-LDADJPATSA-N 347.212 3.368 50 40 EGGB Cc1cccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1 5578977 LBJHXAAIDUGENX-UHFFFAOYSA-N 326.440 3.363 50 40 EGGB C[C@]12CCCC[C@@H]1[C@@H]2C(=O)N/N=C/c1cc2c(cc1Cl)OCO2 100230879 MXYMIHPOASHEIG-BLKWPSGESA-N 334.803 3.345 50 40 EGGB CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)cc1OC 434658 VXHZQEXLKFMJES-GXDHUFHOSA-N 338.363 3.345 50 40 EGGB Cc1occc1C(=O)NNC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 8718319 PHHIOZZLJDUJSD-UHFFFAOYSA-N 337.379 3.023 50 40 EGGB O=C(N/N=C/c1c[nH]c2ccc(Br)cc12)c1ccccn1 3351104 XNDSOINKFDFFCO-DJKKODMXSA-N 343.184 3.089 50 40 EGGB Cc1cccc(C)c1OCC(=O)N/N=C/c1cc2ccccc2nc1O 9614427 DTRHIKHROINEGT-SRZZPIQSSA-N 349.390 3.086 50 40 EGGB CC(C)(C)OC(=O)N1CC(CCCI)C1 71864472 GRBFCIUGZBUBFW-UHFFFAOYSA-N 325.190 3.069 50 40 EGGB Cc1cc(C)cc(NC(=O)N/N=C\c2ccc(O)c([N+](=O)[O-])c2)c1 408962651 IXPABZBELSTYOR-MFOYZWKCSA-N 328.328 3.073 50 40 EGGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccccc2OC)cc1 40865789 DJADMKIMYNAMRT-RVDMUPIBSA-N 336.347 3.027 50 40 EGGB Cc1cc(C(=O)N/N=C/c2ccc(OCc3ccccc3)cc2)[nH]n1 510513 ZNRZOIPDVLLDRB-UDWIEESQSA-N 334.379 3.061 50 40 EGGB COc1cccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)c1OC 5130763 CYSBBLVCWACWGZ-QLILSWMVSA-N 328.412 3.306 50 40 EGGB COc1ccc(C)cc1NC(=O)C/C(C)=N\NC(=O)c1cccs1 14922742 CUBVVXGLBCWSTF-UNOMPAQXSA-N 345.424 3.200 50 40 EGGB COc1ccc(/C=N\NC(=O)COc2cccc(C)c2C)cc1Cl 30838796 CCAAMJBPGWCIKS-JMIUGGIZSA-N 346.814 3.495 50 40 EGGB COc1ccc(/C=C(\C#N)S(=O)(=O)c2ccc(C)cc2)cc1F 7908548 QWPVEMRDBLHUMG-OQLLNIDSSA-N 331.368 3.481 50 40 EGGB Cc1ccsc1/C=C(/C#N)C1=NN(c2ccccc2)[C@H](N)[C@H]1C#N 409001200 VIIBHVFJMSKKHC-YIYRURMPSA-N 333.420 3.264 50 40 EGGB O=C(CCc1ccccc1)N/N=C/c1cc2c(cc1Cl)OCO2 408867256 KZNLHXJGJWNMKC-VXLYETTFSA-N 330.771 3.152 50 40 EGGB O=C(N/N=C\c1cccc(OCc2ccccc2)c1)c1ccccn1 33326129 YUMMSTFCMYUQHQ-HMAPJEAMSA-N 331.375 3.425 50 40 EGGB COc1ccccc1N1CCN(C(=O)[C@@H](Cl)c2ccccc2)CC1 5611906 MAKRAEGABLJRAF-SFHVURJKSA-N 344.842 3.324 50 40 EGGB CCCOc1ccc(C(=O)N/N=C/c2ccc(C)c([N+](=O)[O-])c2)cc1 20197495 WSQIDQOCDARYFU-XDHOZWIPSA-N 341.367 3.456 50 40 EGGB C=CCSC1=C(C#N)[C@@H](c2ccc(C)cc2)[C@H](C(=O)OC)C(O)=N1 8973460 LPPNOYWIDPVYKN-CABCVRRESA-N 342.420 3.492 50 40 EGGB CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1cccc(C)c1 408869625 STLLMDFBIVESKJ-LICLKQGHSA-N 336.391 3.365 50 40 EGGB Cc1cc(/C=N/NC(=O)c2cccc(Br)c2)c(C)n1C 408773755 XDKCQNKOXUWEFO-RQZCQDPDSA-N 334.217 3.168 50 40 EGGB COc1cc(Cl)c(/C=N/NC(=O)c2cccc(C)c2)cc1OC 66202147 PWWUREAXHBOHKN-VXLYETTFSA-N 332.787 3.430 50 40 EGGB Cc1c2c([nH]c(=O)c1C)C=C[C@H](Br)[C@@H]2Br 1700656 BZLNSIIGHANXHH-XVKPBYJWSA-N 333.023 3.218 50 40 EGGB N#CCn1cc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)c2ccccc21 6548893 YJLINQDOKUIYAF-KAMYIIQDSA-N 342.358 3.416 50 40 EGGB O=C(COc1ccc(F)cc1)N/N=C1/CCSc2ccc(F)cc21 34876586 VUDVDTPCTOXJAS-HKWRFOASSA-N 348.374 3.360 50 40 EGGB CC1(C)C(=O)[C@@]2(Br)CC[C@@]1(CC#N)[C@@H]2Br 103708646 OJTCQBIJBRMLII-WHGOUJPWSA-N 335.039 3.186 50 40 EGGB C/C(=N/NC(=O)c1ccoc1C)c1ccc(NC(=O)C2CC2)cc1 5532867 GKWVQDRYILJXBM-JAIQZWGSSA-N 325.368 3.091 50 40 EGGB CO[C@H](C(=O)N/N=C/c1ccc(N2CCCCC2)o1)c1ccccc1 408997651 SFKBYBQNHGYESA-OFBHVFLISA-N 341.411 3.108 50 40 EGGB C[C@@H](Br)C(=O)NC[C@@H](OCC1CC1)c1cccc(F)c1 95097941 MKRMIZKGIWOFKC-QMTHXVAHSA-N 344.224 3.193 50 40 EGGB N#C/C(=C\c1c[nH]c2ccc(Br)cc12)C(=O)NC1CC1 555734 SPNPBRFKSOLAPS-WEVVVXLNSA-N 330.185 3.116 50 40 EGGB COc1ccc(/C=C(\C#N)c2nc(O)c3ccccc3n2)c(OC)c1 3899764 RMCFZDFTDXBYPW-UKTHLTGXSA-N 333.347 3.417 50 40 EGGB Cc1ccc(-c2n[nH]cc2/C=C(\C#N)C(=O)NCc2cccnc2)cc1 5728622 PIMYEVDNQZEWPL-RQZCQDPDSA-N 343.390 3.004 50 40 EGGB C/C(CC(=O)NC12CC3CC(CC(C3)C1)C2)=N\NC(=O)OC(C)(C)C 17206596 JWVMWDZYFNUPMO-CIAFOILYSA-N 349.475 3.362 50 40 EGGB COc1cc(C)ccc1C(=O)N/N=C/c1ccc(Br)o1 408998074 HXHRTYYOWMZNOW-LZYBPNLTSA-N 337.173 3.123 50 40 EGGB NNC(=O)c1cn(C(=O)c2ccc3ccccc3c2)c2ccccc12 216951089 FYBUORGKJDOEOS-UHFFFAOYSA-N 329.359 3.087 50 40 EGGB NNC(=O)c1cc(Cl)c(Cl)c(-c2cc3ccccc3oc2=O)c1 225689095 FBDXWDJWACTFQB-UHFFFAOYSA-N 349.173 3.370 50 40 EGGB CCn1cc(/C=N/NC(=O)c2ccc(NC(C)=O)cc2)c2ccccc21 581190 SHXDPVDYHMTGSR-CIAFOILYSA-N 348.406 3.384 50 40 EGGB Cc1nn(-c2ccccc2)c(C)c1[P@](=O)(c1ccccc1)N(C)C 3206465 UWUWIGCMENGUDZ-XMMPIXPASA-N 339.379 3.280 50 40 EGGB CCCCCCCCNC(=S)NNC(=O)c1ccc(OC)cc1 100980442 TUVLSABLCQVCLE-UHFFFAOYSA-N 337.489 3.165 50 40 EGGB CCOc1ccc(/C=C(/C#N)C(=O)Nn2c(C)ccc2C)cc1OC 409388341 UCTCZUOFSCWZES-YBEGLDIGSA-N 339.395 3.190 50 40 EGGB O=C(O)CC/C(=N\NC(=O)[C@H]1C[C@@H]1c1ccccc1)c1ccccc1 4646818 XAVHBAQTZZUWSK-FBCYZVNJSA-N 336.391 3.175 50 40 EGGB Cc1cc(N2C[C@H](C(=O)Cl)CC2=O)cc(C)c1Br 45889608 VVUAPWYYNKKJPZ-SECBINFHSA-N 330.609 3.184 50 40 EGGB C/C=C1\CC[N@@+]2(C)CC[C@@]34C(=C(C=O)[C@H]1C[C@H]32)N(C)c1ccccc14 585176246 BAXHNXNALPIROW-DRNCFLGPSA-N 335.471 3.416 50 40 EGGB Cc1ccc2c(c1)/C(=N/NC(=O)CCc1ccccc1)C(=O)N2C(C)C 17373708 HIDLVXHLPKKUGE-ATJXCDBQSA-N 349.434 3.203 50 40 EGGB FC(F)(F)C1(C(F)(F)F)N[C@H]2[C@@H](Br)[C@H]1C[C@H]2Cl 100114794 JSDWVKURFFDIKI-SQOUGZDYSA-N 346.496 3.212 50 40 EGGB O=C(N/N=C/c1ccc(O)cc1O)c1cc(C2CC2)nc2ccccc12 184255 VVKMROKOCZXTML-SRZZPIQSSA-N 347.374 3.287 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C/c2cnc3c(C)cccn23)cc1 78870089 WVYYUHQSPQDUAY-GXDHUFHOSA-N 332.363 3.197 50 40 EGGB CC(C)(C)c1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2F)cc1 59472225 PPFVVLIMKLPJHG-CIAFOILYSA-N 341.386 3.212 50 40 EGGB CN1C(=O)/C(=N/NC(=O)c2ccc(Cl)cc2Cl)c2ccccc21 100260165 DTGPJONADNJFQO-XMHGGMMESA-N 348.189 3.104 50 40 EGGB CC(C)C(=O)NNC(=O)c1ccc(-c2nc3ccccc3s2)s1 9378045 IXKSBLWWSBQTSZ-UHFFFAOYSA-N 345.449 3.442 50 40 EGGB COc1ccc(C(=O)N/N=C/c2ccc(N3CCCCC3)o2)cc1 408727010 PHFRBKYJOAEMIH-CPNJWEJPSA-N 327.384 3.042 50 40 EGGB CCn1ncc(/C=N/NC(=O)CC23CC4CC(CC(C4)C2)C3)c1F 252508196 XFYLJIBSQWQSHJ-KEBDBYFISA-N 332.423 3.099 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)c2cc(OC)cc(OC)c2)cc1 5512199 QYDZJAXTMHIKPW-DEDYPNTBSA-N 340.379 3.033 50 40 EGGB O=C(CC12CC3CC(CC(C3)C1)C2)N/N=C/c1ccccc1C(=O)O 40161297 QFDNFGSHUWHVGE-CIAFOILYSA-N 340.423 3.441 50 40 EGGB Cc1ccccc1CSCC(=O)N/N=C/c1ccccc1[N+](=O)[O-] 59375 LMLMYPQRYULUDN-VCHYOVAHSA-N 343.408 3.287 50 40 EGGB COC(=O)c1cccc(-c2ccc(/C=N/NC(=O)c3ccco3)o2)c1 408876436 PDDJNJOGZDOMPT-YBFXNURJSA-N 338.319 3.090 50 40 EGGB Cc1cccc(OCC(=O)N/N=C\c2cc3ccccc3nc2O)c1C 13945635 RMBIGBZVEKMRDG-NHDPSOOVSA-N 349.390 3.086 50 40 EGGB Cc1n[nH]c(S[C@@H](C)C(=O)/C(C#N)=C2/Nc3ccccc3S2)n1 97015991 FFCZGRYCRRZOFY-JMULNHFYSA-N 343.437 3.116 50 40 EGGB CCCC[C@@H](C(=O)NN)N1c2cc(OC)ccc2[C@@H](C)CC1(C)C 223229866 ZITPAIWPMZMKLV-BBRMVZONSA-N 333.476 3.336 50 40 EGGB O=C(N/N=C/c1ccc(F)cc1)C(F)(F)C(F)(F)C(F)(F)F 97947526 IPIWVHFJIXVGLA-DENHBWNVSA-N 334.166 3.109 50 40 EGGB O=C(N/N=C/c1ccccc1Cl)c1cccc(Cn2cccn2)c1 6222250 BMYMASWRWMBAGH-UDWIEESQSA-N 338.798 3.349 50 40 EGGB N#C/C(=C/c1ccc(N2CCOCC2)cc1)C(=O)Nc1ccccc1 209995660 QRHGHXXUFRJSOW-VKAVYKQESA-N 333.391 3.069 50 40 EGGB COc1ccc(NC(=S)NNC(=O)c2cc3ccccc3o2)cc1 59449428 UYIWPMNDASSCKA-UHFFFAOYSA-N 341.392 3.073 50 40 EGGB CCOC(=O)c1ccc(NC(=O)/C(C#N)=C\c2ccc(C#N)cc2)cc1 96663334 XPIFRRRGUNHREO-BOPFTXTBSA-N 345.358 3.281 50 40 EGGB O=C(Cl)[C@@H]1CC(=O)N(c2cc(C(F)(F)F)ccc2Cl)C1 45953415 NEGWLWHTQKHUHG-ZCFIWIBFSA-N 326.101 3.477 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)CNc2cccc3ccccc23)cc1 60481 NLGGPKCAVYAJDT-OEAKJJBVSA-N 346.434 3.468 50 40 EGGB COc1ccc(C2C(C#N)=C(N)SC(N)=C2C#N)c2ccccc12 808898 JMZQNQYTQVPJHQ-UHFFFAOYSA-N 334.404 3.067 50 40 EGGB N#C/C(=C\Nc1cccc(C(F)(F)F)c1)C(=O)NCc1ccco1 1911157 XXDDFXKRLWYIDD-PKNBQFBNSA-N 335.285 3.434 50 40 EGGB C/C(=N\NC(=O)CNc1cccc(C(F)(F)F)c1)c1ccccn1 6286685 WHARODOQCQJWKR-SSDVNMTOSA-N 336.317 3.053 50 40 EGGB COc1cc(/C=C(/C#N)c2cccc(F)c2)ccc1OCC(=O)O 409393041 OTCHCMGKOMRGCK-AUWJEWJLSA-N 327.311 3.362 50 40 EGGB C=CCOc1cccc(/C=N/NC(=O)CNc2ccc(Cl)cc2)c1 408692160 FUQDEUMNBRFHIY-CIAFOILYSA-N 343.814 3.467 50 40 EGGB COc1ccc(Cl)cc1C/C=N\NC(=O)c1cccc(C)c1O 5048577 RMJMHKHCQKAPMI-OCKHKDLRSA-N 332.787 3.321 50 40 EGGB CCOC(=O)/C(=N/Nc1ccc(-c2ccccc2)cc1)C(=O)CCl 16756612 GVKDGTBYFWXMJE-HEHNFIMWSA-N 344.798 3.493 50 40 EGGB CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\c1ccc(-c2ccccc2F)o1 101651843 KXARUBXOHYNCDM-ZROIWOOFSA-N 336.322 3.308 50 40 EGGB COc1ccc(/C=N\NC(=O)c2ccc(NC(C)=O)cc2)cc1Cl 33329439 HEYRWILSOMCUBK-GRSHGNNSSA-N 345.786 3.071 50 40 EGGB CCOc1ccccc1OCC(=O)N/N=C/c1cccc(Cl)c1 3039998 RPZGBBPYTFQEKR-YBFXNURJSA-N 332.787 3.268 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)NCc2cccs2)ccc1OC 409197350 CJXJDWYIDYNXBI-NTEUORMPSA-N 342.420 3.379 50 40 EGGB CCCc1n[nH]c2c1[C@H](c1ccnc3ccccc13)C(C#N)=C(N)O2 8568290 HXSUXGZFABCXPO-MRXNPFEDSA-N 331.379 3.129 50 40 EGGB CCn1c(C)cc(/C=N/NC(=O)COc2ccc(Cl)cc2)c1C 409097726 NKCRVSKEEIZJRD-VXLYETTFSA-N 333.819 3.307 50 40 EGGB CCCOc1ccc(C(=O)N/N=C\c2ccc(O)cc2)cc1OCC 409310029 PICLLPYBKUMYSQ-MOSHPQCFSA-N 342.395 3.344 50 40 EGGB C#CCOc1ccc2ccccc2c1/C=N\NC(=O)c1ccccc1O 38376991 XXEFPJFPYXNLQV-HMAPJEAMSA-N 344.370 3.321 50 40 EGGB O=C(CNc1ccc(Br)cc1)N/N=C/c1ccccc1 580613 FMPMXFSEEJDPCB-VCHYOVAHSA-N 332.201 3.011 50 40 EGGB Cc1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)cc1 8371696 ZNTIHNMMWYDKFN-YPKZHZFPSA-N 349.434 3.115 50 40 EGGB Cc1ccc(NCC(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)cc1 60096 GBNODWMULVBFPD-DJKKODMXSA-N 346.774 3.119 50 40 EGGB CCC(=O)NNC(=O)CSc1nc2c(C)ccc(C)c2cc1CC 4849488 IWSXLSAVDGANPP-UHFFFAOYSA-N 345.468 3.064 50 40 EGGB CCOc1ccc2oc(C(=O)N/N=C\c3ccc(O)c(O)c3)cc2c1 409190798 WHURUHRLBULCLB-GRSHGNNSSA-N 340.335 3.007 50 40 EGGB N#C/C(=C/c1ccc(Sc2ccccc2)o1)C(=O)N1CCOCC1 408751876 DGFULTKKHLLILA-OWBHPGMISA-N 340.404 3.197 50 40 EGGB Cc1ccc(C)c(OCC(=O)N/N=C/c2cc(Cl)ccc2O)c1C 12859077 ZGPOOUBIKQNANV-AWQFTUOYSA-N 346.814 3.500 50 40 EGGB CC(C)COc1ccc(C(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1 536058 ZPERYWQTWBMJBN-YBFXNURJSA-N 341.367 3.394 50 40 EGGB CC1=C(C(=O)OC(C)C)[C@@H](c2ccccc2Cl)C(C#N)=C(N)O1 4966777 QXNJRRHLURSGKA-HNNXBMFYSA-N 332.787 3.373 50 40 EGGB O=C(CCCC(=O)N/N=C/[C@H]1CC=CCC1)N/N=C/[C@@H]1CC=CCC1 18059826 GLFGNHUMMQQQNN-MDPAKKPYSA-N 344.459 3.073 50 40 EGGB N#C/C(=C\c1cccc(O)c1)c1nc2ncc(Br)cc2[nH]1 4676302 SGUBZQWJSXPHCJ-ONNFQVAWSA-N 341.168 3.490 50 40 EGGB CCOc1ccc(/C=C(/C#N)C(=O)NCc2ccccc2)cc1OC 4723684 TVRRCKXDHHVDJG-BOPFTXTBSA-N 336.391 3.317 50 40 EGGB CO[C@@H](CNC(=O)/C(C#N)=C\c1ccco1)c1cccc(Cl)c1 81328065 ONUGRMVBECEQOG-OVHOFWQVSA-N 330.771 3.344 50 40 EGGB COc1ccccc1/C=N/NC(=O)Cc1cccc(C(F)(F)F)c1 408760540 AKMXHIQWSGBWOL-SRZZPIQSSA-N 336.313 3.407 50 40 EGGB C[C@]12CC[C@H]3[C@@H](CC[C@@]45O[C@H]4C(O)=C(C#N)C[C@]35C)[C@@H]1CC[C@@H]2O 118916772 KVJXBPDAXMEYOA-ZUEUNHLDSA-N 329.440 3.467 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@@H]1c1cccc(F)c1 140045 ADTGQYDUFYTNEA-CYBMUJFWSA-N 338.367 3.495 50 40 EGGB COCc1nnc(NC(=O)CCCC[C@H]2CCSS2)s1 72325898 PHMOGRSDAJNIGB-VIFPVBQESA-N 333.504 3.337 50 40 EGGB biogenic CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\Nc1ccc(Cl)cc1Cl 16693924 UALIESIBMADPLU-XFFZJAGNSA-N 336.178 3.128 50 40 EGGB CCOc1cc(C(=O)N/N=C\c2cc(Cl)ccc2O)ccc1OC 6354981 DDMRQWNXXMXOLR-GRSHGNNSSA-N 348.786 3.217 50 40 EGGB Cc1ccsc1/C=C(\C#N)C(=O)N1CCN(c2ccccc2)CC1 566619 NTEVCVSCTXGOLA-DTQAZKPQSA-N 337.448 3.312 50 40 EGGB NCCCC[C@H](Br)C(=O)c1cc(O)nc2ccccc12 8614836 WJZAKXPIWKWCMM-LBPRGKRZSA-N 337.217 3.016 50 40 EGGB CC1(C)C(CBr)=C(CBr)C(C)(C)N1[O] 100191129 ARHJCGXCRJZAHY-UHFFFAOYSA-N 326.052 3.291 50 40 EGGB in-vitro Cc1ccsc1/C=C(/C#N)C1=NN(c2ccccc2)[C@@H](N)[C@H]1C#N 409001199 VIIBHVFJMSKKHC-XGZAABKCSA-N 333.420 3.264 50 40 EGGB COc1cc(C)c(/C=C(/C#N)C(=O)NC[C@@H]2CCCO2)cc1C(C)C 48495 NLYWXDVGIOEEEB-STKCSNAVSA-N 342.439 3.329 50 40 EGGB CCOc1ccc(NC(=O)C(=O)NN=C2CCCCCCC2)cc1 5465662 KFDHCJAOTBQNRB-UHFFFAOYSA-N 331.416 3.240 50 40 EGGB NNC(=O)c1cc(-c2cccs2)nc2onc(-c3ccccc3)c12 12394828 PDJGLWJHDJGIRC-UHFFFAOYSA-N 336.376 3.222 50 40 EGGB O=C(c1cc(F)cc(F)c1)[C@@H](Br)CBr 307254457 XWOKIOVIXJEXQN-QMMMGPOBSA-N 327.950 3.306 50 40 EGGB O=C(N/N=C/c1c[nH]c2ccccc12)c1cc(-c2ccccc2)n[nH]1 8683438 NLHDKZVAHFTNKC-CIAFOILYSA-N 329.363 3.322 50 40 EGGB CC(=O)N/N=C(\C)c1cccc(NC(=O)c2cccc(Cl)c2)c1 408719578 GNYHEZJTXYSJBZ-RGVLZGJSSA-N 329.787 3.452 50 40 EGGB NNC(=O)CCc1ccc(-c2ccc(Br)cc2Cl)o1 216924810 VZHCRFAWCGRGAU-UHFFFAOYSA-N 343.608 3.285 50 40 EGGB Cc1ccc(CC(=O)N/N=C/c2cc3c(cc2Cl)OCO3)cc1C 561539 GWOWZVZTZZYEMC-AWQFTUOYSA-N 344.798 3.378 50 40 EGGB N#CC1=C(S)N(c2ccccc2)[C@H](c2ccccc2F)NC1=O 9111269 BRCCDHNFDDOJBZ-OAHLLOKOSA-N 325.368 3.126 50 40 EGGB C/C(=N\NC(=O)[C@H]1COc2ccccc2O1)c1ccc(Cl)s1 5164210 FFMYEPDTPWQSSE-UDPFGDFPSA-N 336.800 3.082 50 40 EGGB C/C(=N\NC(=O)c1ccco1)c1ccc(NC(=O)c2ccco2)cc1 17070847 FMLGTSWOYWZTEC-UDWIEESQSA-N 337.335 3.279 50 40 EGGB COc1cc(Br)c(Br)c(/C=C/C=O)c1O 216764313 JVIJMSCECCMNMX-NSCUHMNNSA-N 335.979 3.138 50 40 EGGB CC1(C)CC(=O)C/C(=N/NC(=O)c2cccc(Br)c2)C1 100003578 PSXZIOZZIZEXOJ-ATVHPVEESA-N 337.217 3.314 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2F)cc1 3085349 CEJCJHWKFQZLKH-RGVLZGJSSA-N 327.359 3.038 50 40 EGGB CC(C)(C(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccccc1 12944166 QGKZKTYZFPSOAV-UHFFFAOYSA-N 340.467 3.328 50 40 EGGB C/C(=N\NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccccc1 13764882 LAOBAVUXMORFHS-HAVVHWLPSA-N 344.414 3.463 50 40 EGGB Cc1c(C(=O)NN)c2ccccc2n1C(=O)c1ccc2ccccc2c1 216951067 WXFCHKVFMZQUNM-UHFFFAOYSA-N 343.386 3.395 50 40 EGGB CCC(=O)C1=NN(c2ccccc2)[C@@H](N)C(C#N)=C1c1ccccc1 96318821 HOZAYRBJYKAEIZ-HXUWFJFHSA-N 330.391 3.104 50 40 EGGB NNC(=O)c1cc(Cl)c(OCc2ccc(F)cc2)c(Cl)c1 226322139 YFVWZFCESLLXDI-UHFFFAOYSA-N 329.158 3.315 50 40 EGGB CCCc1[nH]nc2c1[C@H](c1ccc(N3CCCC3)cc1)C(C#N)=C(N)O2 8783192 COXBOMAFOJTSBE-QGZVFWFLSA-N 349.438 3.181 50 40 EGGB CN(C)c1ccc(/C=C(\C#N)C(=O)Nc2ccc3c(c2)OCCO3)cc1 3570755 ACLVUQLCHVDNCI-RVDMUPIBSA-N 349.390 3.069 50 40 EGGB CCOc1ccc(/C=C(/C#N)C(=O)NC2CCCC2)cc1OCC 65999544 OSQZJCHGEDUMMC-PTNGSMBKSA-N 328.412 3.450 50 40 EGGB COc1cccc(C(=O)N/N=C/c2ccc(N3CCCC3)c(F)c2)c1 409105815 KTYYLMNESDSPQM-FYJGNVAPSA-N 341.386 3.198 50 40 EGGB CCOc1ccc(/C=N\NC(=O)Cc2ccc(C)cc2C)cc1OC 216041817 SLNMOSYZSXCSPG-BKUYFWCQSA-N 340.423 3.404 50 40 EGGB Cc1ccc(C)c(CC(=O)N/N=C\c2ccc(C)c([N+](=O)[O-])c2)c1 409363036 KSIUUTPCFQASPJ-ODLFYWEKSA-N 325.368 3.213 50 40 EGGB CCCn1nc(C)cc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253404860 RLJVGMGPUGMYJH-INIZCTEOSA-N 340.427 3.052 50 40 EGGB COc1cc(C(=O)N/N=C(\C)[C@H]2C[C@H]3CC[C@@H]2C3)cc(OC)c1OC 15938570 AVTPWNSWYYPBDO-OFCHDXQOSA-N 346.427 3.254 50 40 EGGB C#CCOc1c(Cl)cc(/C=N/NC(=O)c2ccccc2)cc1OC 5743705 ZWWXQVWAQNZPDN-UDWIEESQSA-N 342.782 3.125 50 40 EGGB O=C(Cc1cccc2ccccc12)N/N=C\c1ccc2c(c1)OCO2 30809070 ZBINFPUNIFYTRQ-MTJSOVHGSA-N 332.359 3.261 50 40 EGGB N#CC1=C(N)N2C(=C(C#N)[C@@H]1c1ccc(F)cc1)Nc1ccccc12 267258 OOEQGSDFYWSPPI-QGZVFWFLSA-N 329.338 3.284 50 40 EGGB CCOc1ccc(CN(CCCl)CCCl)cc1C(=O)OC 59781834 KGCUCBMHEBZAAR-UHFFFAOYSA-N 334.243 3.152 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)n2nc(C)cc2C)ccc1OC 408980107 UXOWHJSLMPGBPF-OQLLNIDSSA-N 325.368 3.155 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2ccc(-c3ccccc3C(=O)O)o2)o1 408727619 FSKKXKDPHJVRMC-VXLYETTFSA-N 338.319 3.310 50 40 EGGB C[C@@H](Oc1ccccc1)C(=O)NN=Cc1c(O)ccc2ccccc12 245238416 NNFYLENZBBRQJS-CQSZACIVSA-N 334.375 3.463 50 40 EGGB COc1ccc([C@@H]2C(C#N)=C(N)OC(C(C)(C)C)=C2C#N)cc1OC 547604 SQNZCRCCTAYPAX-INIZCTEOSA-N 339.395 3.335 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)c2ccsc2)cc2c1OCCO2 44027881 KQTMFCDMJNERMS-AWNIVKPZSA-N 327.361 3.318 50 40 EGGB O=C(NNc1ncccn1)c1ccc2noc(-c3ccccc3)c2c1 44716286 VCTYBRVBLHHPAB-UHFFFAOYSA-N 331.335 3.042 50 40 EGGB CC(=O)Nc1ccc(/C=C(\C#N)S(=O)(=O)c2ccc(C)cc2)cc1 2562133 IYIRQOTXCCWTCV-WOJGMQOQSA-N 340.404 3.292 50 40 EGGB CCSC1=C(C#N)[C@@H](c2ccccc2C)[C@H](C(=O)OC)C(O)=N1 9089339 ORWUFEPZRFMXEQ-KGLIPLIRSA-N 330.409 3.326 50 40 EGGB C/C(CC(=O)Nc1ccc(Cl)cc1C)=N/NC(=O)c1ccncc1 17206724 WRTNODQGYPXULB-MTJSOVHGSA-N 344.802 3.178 50 40 EGGB COc1ccc(Br)cc1/C=N\NC(=O)Cc1ccccc1 33399645 KURFZJVAGXTTQP-WQRHYEAKSA-N 347.212 3.151 50 40 EGGB O=C(NNc1nc2ccccc2s1)Nc1ccc([N+](=O)[O-])cc1 71812099 IUJOYVFIELMFTB-UHFFFAOYSA-N 329.341 3.353 50 40 EGGB O=C(COc1cccc2cccnc12)N/N=C/c1c[nH]c2ccccc12 40571100 YPPWTRPFDWIYBF-FSJBWODESA-N 344.374 3.245 50 40 EGGB O=C(COc1ccc(Cl)cc1Cl)NNC(=O)CC1CCCC1 15512347 MWUOKLNVDYVANK-UHFFFAOYSA-N 345.226 3.100 50 40 EGGB CCCCNC(=O)[C@@]12CC[C@@](C)(C(=O)[C@H]1Br)C2(C)C 2172595 LFKFOZVBTANXNZ-WKPIXPDZSA-N 330.266 3.062 50 40 EGGB Cc1ccc(CSCC(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 59473383 DWLZFRPLYPJDGK-DJKKODMXSA-N 342.420 3.107 50 40 EGGB CN(C)C(=O)/C(C#N)=C\c1ccc(Sc2nc3ccccc3[nH]2)o1 59334969 IJUFVFQIQRIXFK-LUAWRHEFSA-N 338.392 3.302 50 40 EGGB Cn1ccc(C(=O)NNc2c(Cl)cc(Cl)cc2Cl)cc1=O 28269809 WXNLKTSGVAMFOB-UHFFFAOYSA-N 346.601 3.102 50 40 EGGB COc1cc([N+](=O)[O-])cc(/C=C(/C#N)c2ccc([N+](=O)[O-])cc2)c1O 35190969 VVWFBOXLDCHJMZ-SDQBBNPISA-N 341.279 3.281 50 40 EGGB Cn1cccc1/C=N/NC(=O)C1c2ccccc2Oc2ccccc21 267807 YBBRBQGKPTXAGP-FYJGNVAPSA-N 331.375 3.413 50 40 EGGB CC(C)Oc1ccc(C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)cc1 546648 ZXWVZJFVICPGIT-WOJGMQOQSA-N 327.340 3.146 50 40 EGGB CCCCOc1ccc(/C=N/NC(=O)c2ccccn2)cc1OCC 2759630 NUSWXNOUCCEVCW-KGENOOAVSA-N 341.411 3.423 50 40 EGGB COc1cc(/C=N/NC(=O)Cc2ccc(C(C)(C)C)cc2)ccc1O 106360087 SVDZXKRAGDIUGK-FYJGNVAPSA-N 340.423 3.391 50 40 EGGB Cc1ccc(SCC(=O)NNC(=O)C(C)(C)c2ccccc2)cc1 40049124 WUHQYIWOHLHGNB-UHFFFAOYSA-N 342.464 3.212 50 40 EGGB Fc1cccc(NC2=NC[C@H](CI)S2)c1 5749893 VIHJPPUTUITVIQ-VIFPVBQESA-N 336.173 3.144 50 40 EGGB NNC(=O)/C=C/c1ccc(OCc2cccc(Br)c2)cc1 226332714 SCXKYFYVLLGQIX-RMKNXTFCSA-N 347.212 3.031 50 40 EGGB CCOC(=O)/C(C#N)=C/NCc1ccc(-n2cnc3ccccc32)cc1 60789842 MBVJESWDGRLUOE-DTQAZKPQSA-N 346.390 3.086 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c(F)c1 977461 LTEIOLVKVYPTPS-LPYMAVHISA-N 336.370 3.061 50 40 EGGB COC(=O)N/N=C/c1c(C)nn(Cc2ccc(Cl)cc2)c1Cl 3538348 QTDIJZIPKXYSOG-REZTVBANSA-N 341.198 3.237 50 40 EGGB C[C@]1(C(=O)NNc2ccccc2)CC1(Br)Br 3669133 AZKRBANDACSQGU-SNVBAGLBSA-N 348.038 3.026 50 40 EGGB C[C@H](Sc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccccc1 5824724 NUTXKZKGBNJIQI-NSHDSACASA-N 334.828 3.282 50 40 EGGB COc1cc(Cl)cc(/C=C(/C#N)C(=O)NCc2ccccc2)c1O 408748177 ZNVICBMDSAFVIO-AUWJEWJLSA-N 342.782 3.278 50 40 EGGB O=C(c1ccccc1)c1c2nc(CCl)[nH]c(=O)c2c2ccccn12 32603858 YRBFWZOOFVVNIV-UHFFFAOYSA-N 337.766 3.146 50 40 EGGB COc1ccccc1/C=N/NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 5275085 NAAJNRKGAZOJGJ-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB COc1ccc(/C=N/NC(=O)CNc2cccc(C)c2)cc1Cl 223278 YCVOXKCSAFETBP-KEBDBYFISA-N 331.803 3.219 50 40 EGGB N#C/C(=C/c1cccn1-c1ccc(O)cc1)C(=O)Nc1ccc(O)cc1 107606640 BTXYQMRXMHRDRF-OWBHPGMISA-N 345.358 3.434 50 40 EGGB Cc1cccc(C(=O)N/N=C/c2cccn2-c2ccc([N+](=O)[O-])cc2)c1 4357503 KSLRZOJEJSSTSW-DEDYPNTBSA-N 348.362 3.458 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)c2ccc3ccccc3n2)c(OC)c1 4616269 GHCSSYGRVGRZGG-LPYMAVHISA-N 349.390 3.406 50 40 EGGB C=CCOc1ccc(/C=C(\C#N)C(=O)OCC)cc1Br 408726301 MWYQJQBUCUHEMY-XYOKQWHBSA-N 336.185 3.484 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2ccc(OC(C)C)cc2)cc1[N+](=O)[O-] 409185838 RDWVPFZFGCBGBV-YBFXNURJSA-N 341.367 3.454 50 40 EGGB CSc1ccc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc1 33718128 UKJQSZGCCLFYAZ-BOPFTXTBSA-N 329.381 3.010 50 40 EGGB COc1c(F)cc(C(=O)CBr)cc1Br 675050498 LMBWKUWBQQYKHB-UHFFFAOYSA-N 325.959 3.174 50 40 EGGB COc1ccc(C(=O)N/N=C/c2cccc(Br)c2)cc1 3100617 YXTRNOXBHPJDRJ-LICLKQGHSA-N 333.185 3.222 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@@H](c2cccc([N+](=O)[O-])c2)[C@H]2CCCC=C12 19907366 CFCRPALWGIWYGO-RDJZCZTQSA-N 345.362 3.188 50 40 EGGB C/C(=N\NC(=O)COc1ccc(C)c(C)c1)c1cccc([N+](=O)[O-])c1 221237 XWCVGVRBKYBZOE-XMHGGMMESA-N 341.367 3.131 50 40 EGGB COC[C@H](C)Oc1ccc2nc(NC(=O)[C@H](C)Cl)sc2c1 20132136 RUMHHPXTRVTUPD-IUCAKERBSA-N 328.821 3.276 50 40 EGGB CC1(C)[C@H]2CC[C@]1(C)/C(=N/NC(=O)COc1cccc([N+](=O)[O-])c1)C2 102446706 WYBGVSXEAIDIRR-HPCBPRIFSA-N 345.399 3.292 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2OC)c(OC)c1 7066368 NWRXOCWWJBSFMP-GXDHUFHOSA-N 338.363 3.258 50 40 EGGB N#C/C(=C\c1ccc(OCCOc2ccccc2)cc1)C(=O)NC1CC1 409206553 PJGUJRRKFPBFDA-SAPNQHFASA-N 348.402 3.330 50 40 EGGB COc1cc(N2CCCCC2)ccc1/C=N/NC(=O)c1ccccc1 409243226 QSWCJSCTDBNWGW-RCCKNPSSSA-N 337.423 3.449 50 40 EGGB CCN1c2cc(C)c(/C=N/NC(=O)CC#N)cc2[C@@H](C)CC1(C)C 223572647 YIDYEJXWTOPZTA-OMBDHMDGSA-N 326.444 3.471 50 40 EGGB O=C(N/N=C/c1ccc(F)s1)c1ccccc1Br 252495619 OUOMWWWCVQCPAY-VIZOYTHASA-N 327.178 3.414 50 40 EGGB O=C(CCSc1ccc(F)cc1)NNc1ccc(C(=O)O)cc1 3412904 FWOQRGQPZNBVTI-UHFFFAOYSA-N 334.372 3.149 50 40 EGGB CCOc1cccc(Oc2ncccc2C(=O)/C(C#N)=C/N(C)C)c1 4105337 ZQGPJNGWDWULOP-BUHFOSPRSA-N 337.379 3.424 50 40 EGGB CCOC(=O)[C@@]1(C#N)C(=O)C(C#N)=C2CCCC[C@H]2[C@H]1c1ccccc1 4557871 JPWFTLNBFYFNII-HGHGUNKESA-N 348.402 3.436 50 40 EGGB N#C/C(=C/c1ccc(Sc2ccc(Cl)cc2)o1)C(=O)NC(N)=O 409231970 MDXSDWSJGZDZTK-CLFYSBASSA-N 347.783 3.186 50 40 EGGB Cc1ccc(C(=O)n2c(C)c(C(=O)NN)c3ccccc32)c(Cl)c1 216955579 MYKZPEGKYTVXSO-UHFFFAOYSA-N 341.798 3.204 50 40 EGGB N#C/C(=C\c1cccc(Br)c1)C(=O)NCc1ccco1 5069136 CIDAOZGQCOINBO-KPKJPENVSA-N 331.169 3.265 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccccn2)cc1 5130193 WNTKKWICZXUBDJ-GNUZOCDUSA-N 341.436 3.277 50 40 EGGB Cc1ccc(NC(=O)NNC(=O)c2ccccc2-n2cccc2)cc1 5687964 SXXCQMSYTAHVGE-UHFFFAOYSA-N 334.379 3.252 50 40 EGGB CCn1c(C)cc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)c1C 7386621 HPZLQYVKZJBWMX-KGENOOAVSA-N 338.455 3.489 50 40 EGGB O=C(N[C@H](Cl)C(Cl)(Cl)Cl)c1ccc([N+](=O)[O-])cc1 1462736 IEHUSKIQMWHWKL-QMMMGPOBSA-N 331.970 3.260 50 40 EGGB COC(=O)c1ccc(N/C=C(\C#N)C(=O)Nc2cccc(C)c2)cc1 5021754 GCXSAUVWVLCTHA-NTCAYCPXSA-N 335.363 3.240 50 40 EGGB Cc1nnc(Sc2ccc(C=C(C#N)C#N)cc2[N+](=O)[O-])s1 408992920 UDSNYMDUOKGYCH-UHFFFAOYSA-N 329.366 3.336 50 40 EGGB COc1cccc(/C=N/NC(=O)[C@H](C)SCc2ccccc2)c1O 313807 YNVCTPFOBGAOGI-MDBUFAAASA-N 344.436 3.173 50 40 EGGB COc1cccc(/C=N/NC(=O)c2ccccc2F)c1OC(C)C 8105733 HIPSKOSBGMDVCQ-RGVLZGJSSA-N 330.359 3.385 50 40 EGGB Cc1cc(OCC(=O)N/N=C/c2ccccc2[N+](=O)[O-])ccc1Cl 566297 PAVRBKKZVHCMTL-GIJQJNRQSA-N 347.758 3.086 50 40 EGGB CCOc1ccc(CC(=O)N/N=C/c2cn(C)c3ccccc23)cc1 9879441 MEAQLYSPXGXMOX-FYJGNVAPSA-N 335.407 3.270 50 40 EGGB N#CC1=C(SCc2ccc(C#N)cc2)NC(=O)C[C@H]1c1ccco1 3407035 SJLQNUOGTNUGMC-CQSZACIVSA-N 335.388 3.423 50 40 EGGB C[C@H](NC(=O)/C(C#N)=C\c1cccc([N+](=O)[O-])c1O)c1ccccc1 409235218 ATODFQGCHBRBRJ-GQVHDAKQSA-N 337.335 3.085 50 40 EGGB O=C(N/N=C(/CC(=O)c1cccs1)C(F)(F)F)c1cccnc1 4380699 BBZOPDDWLKIKKE-UNOMPAQXSA-N 341.314 3.064 50 40 EGGB COc1ccc(Cl)cc1C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 5527182 INDYAJIIIQVFKZ-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(F)cc2)cc1OC 19877570 GOIJSLZYKDOICR-LCYFTJDESA-N 326.327 3.389 50 40 EGGB CCCOc1ccc(C(=O)N/N=C\c2ccc(OC)cc2)cc1OC 409321378 GGFWTZBSBGDXSL-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB Cc1cc(Br)ccc1-c1ccc(/C=C(/C#N)C(N)=O)o1 252492744 MUXREMCEGRYDHH-YFHOEESVSA-N 331.169 3.410 50 40 EGGB COc1ccc2ccccc2c1/C=N/NC(=O)[C@@H](O)c1ccccc1 5514564 SQOPAIYYSUZDBO-IOVUBPJKSA-N 334.375 3.032 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2ccc(F)cc2)c(OCC)c1 61707 BDNITDQNDWNEOG-UDWIEESQSA-N 330.359 3.387 50 40 EGGB C[C@@]1(C(=O)NNc2ccccc2)CC1(Br)Br 3669132 AZKRBANDACSQGU-JTQLQIEISA-N 348.038 3.026 50 40 EGGB C/C(CC(=O)Nc1ccc(F)cc1)=N\NC(=O)c1ccccc1C 4600283 PLXFJERQJNPSNG-FYJGNVAPSA-N 327.359 3.269 50 40 EGGB C=CCSC1=C(C#N)[C@@H](c2ccccc2)[C@H](C(=O)OC)C(O)=N1 9088419 KPVWIOKNPVWYNO-KGLIPLIRSA-N 328.393 3.184 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)Nc2cccnc2)ccc1OC(F)F 409157516 JJWCUJABVZYZFM-KPKJPENVSA-N 345.305 3.237 50 40 EGGB Cc1cc(/C=N/NC(=O)[C@@H](O)c2ccccc2)c(C)n1-c1ccccc1 408586860 CRJKAEPIJLPJGF-ISXGRJCASA-N 347.418 3.278 50 40 EGGB N#C/C(=C\c1ccc(Sc2ncccn2)o1)C(=O)Nc1cccnc1 409096532 DPACDYOLINMSAD-FMIVXFBMSA-N 349.375 3.161 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2c(C)nc3cc(C)ccn23)cc1 313355 HTBPCKRRQMXMNX-UDWIEESQSA-N 336.395 3.114 50 40 EGGB CC(=O)N/N=C(\C)CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 4904579 HRMZKMSTOZBWNJ-FBCYGCLPSA-N 335.713 3.199 50 40 EGGB O=C(CCl)c1cn(S(=O)(=O)c2ccccc2)c2ccccc12 35605861 HLJHNJQICSDMIT-UHFFFAOYSA-N 333.796 3.300 50 40 EGGB COc1ccc([C@H]2C(C#N)=C(N)Oc3n[nH]c(-c4ccccc4)c32)cc1 4891234 WRINBBKPZKSBMR-INIZCTEOSA-N 344.374 3.303 50 40 EGGB C/C(=N\NC(=O)C1CC1)c1ccc(OC(F)F)cc1OC(F)F 5862936 PCSIFGVIKOUROJ-FBCYGCLPSA-N 334.269 3.140 50 40 EGGB CC(C)(C)OC(=O)N/N=C/c1cccn1-c1ccc([N+](=O)[O-])cc1 507139 VIVICQWLQLCDFR-GZTJUZNOSA-N 330.344 3.244 50 40 EGGB Clc1ccc(-c2nnc3n2C[C@@H](CBr)S3)cc1 109438 NOQFYRPCLHPOMR-SECBINFHSA-N 330.638 3.468 50 40 EGGB Cc1nn(C)c(C)c1CC(=O)NN(c1ccccc1)c1ccccc1 32865568 AXWGOAUMBFEYRJ-UHFFFAOYSA-N 334.423 3.449 50 40 EGGB C/C=C1\C[N+]2(C)CC[C@@]34C(=C(C=O)[C@H]1C[C@@H]32)Nc1c(OC)cccc14 9411275 RYFUCGCTWTVHMS-HDKSMTHLSA-O 337.443 3.010 50 40 EGGB CCn1cc(/C=N/NC(=O)Cc2ccc3c(c2)OCO3)c2ccccc21 409257424 SNLSQSXKLYHSHG-SRZZPIQSSA-N 349.390 3.083 50 40 EGGB CCc1ccc(/C=N\NC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3)C2)cc1 33896397 HEOORIMEZOPHAG-QLTNSANVSA-N 349.434 3.061 50 40 EGGB N#C/C(=C\c1ccc(-c2ccc(Cl)c(C(=O)O)c2)o1)C(N)=S 16385917 XPFKMGZUYITWDG-WEVVVXLNSA-N 332.768 3.491 50 40 EGGB COc1ccc(C(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2C)cc1 5234644 FCPPXJXJZIFRCO-FYJGNVAPSA-N 348.406 3.262 50 40 EGGB COc1cccc(OC)c1C(=O)NNc1nc2c(C)cccc2s1 429755 NFHNYUSQYKENPW-UHFFFAOYSA-N 343.408 3.379 50 40 EGGB CSCc1c(C(=O)NNC(=O)OC(C)(C)C)oc2ccccc12 6551663 KOEMUPJMTIYNTR-UHFFFAOYSA-N 336.413 3.465 50 40 EGGB N#Cc1c(F)cccc1C(=O)[C@@H](Br)CBr 308793957 JKMLKHKTLZKZGJ-QMMMGPOBSA-N 334.970 3.038 50 40 EGGB CCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)S(C)(=O)=O)o2)cc1 96765723 QSYSFCOVXZMXTF-GDNBJRDFSA-N 345.376 3.032 50 40 EGGB COc1ccc(OCC(=O)N/N=C(\C)c2ccc(Cl)cc2)cc1 5282449 BGCOGITVCLWYIV-XDHOZWIPSA-N 332.787 3.268 50 40 EGGB C[C@H]1CC(C)(C)N(C)c2cc(Cl)c(/C=N/NC(=O)CC#N)cc21 208248264 LOCXJYSSWPXWHQ-KKBVUKDESA-N 332.835 3.426 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(OC)cc2)cc1 59905 ZKQTXHSDUJHVOH-XSFVSMFZSA-N 325.412 3.305 50 40 EGGB N#CC(C#N)=Cc1ccc(OCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 294762 AHUJYWQBZNKPNU-UHFFFAOYSA-N 348.318 3.043 50 40 EGGB CC(C)NC(=O)/C(C#N)=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 3308637 OKOLSLFFFXCMKE-UKTHLTGXSA-N 325.324 3.286 50 40 EGGB O=C(CSc1ccccc1F)NNC(=O)c1cc2ccccc2o1 6559953 ZYOBTSZGKWBDOK-UHFFFAOYSA-N 344.367 3.125 50 40 EGGB CN(C)c1ccc(-n2cccc2/C=N\NC(=O)c2cccc(O)c2)cc1 408854238 APUJCMLVFLBCNU-STZFKDTASA-N 348.406 3.013 50 40 EGGB N#C/C(=C\Nc1ccc(N2CCOCC2)cc1)c1nc2ccccc2[nH]1 144205 WCCVMTJTOSWXKX-CCEZHUSRSA-N 345.406 3.376 50 40 EGGB C[C@@H](NNC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccccc1 510050 YONWRNBFIOUGTM-QGZVFWFLSA-N 346.430 3.305 50 40 EGGB CO[C@H](C(=O)N/N=C/c1ccc(Br)cc1)c1ccccc1 59366766 CBUDKAFNTIWISG-LZNAANCOSA-N 347.212 3.287 50 40 EGGB C[C@H]1Cc2cc(/C=C(\C#N)C(=O)NCCc3ccccc3)ccc2O1 2443834 KVRDSAKAGBCXNQ-SJPXOZHESA-N 332.403 3.276 50 40 EGGB CCOC(=O)[C@H]1CCC/C1=N\NC(=O)[C@@H](C)SCc1ccccc1 408719102 DLUALPRVXCTUPB-HDNZXOQESA-N 348.468 3.144 50 40 EGGB Cc1nn(-c2ccccc2)c(C)c1/C=N/NC(=O)Cc1cccs1 136879 OYPNNJYCJPCPSX-XDHOZWIPSA-N 338.436 3.243 50 40 EGGB O=C(N/N=C/c1ccc2c(c1)OCO2)c1ccc(Cl)c(Cl)c1 5677859 OUCAUYSCHMNVRT-CNHKJKLMSA-N 337.162 3.486 50 40 EGGB Cc1cccc(C(=O)NNC2=C(C(=O)C(F)(F)F)CCCC2)c1 5619469 QFIBWCMVGFNURF-UHFFFAOYSA-N 326.318 3.189 50 40 EGGB COc1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1ccc(Cl)cc1 8160038 OOFFQJFSXKCIRL-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1 5431682 AMSKERSOANIPGT-LDADJPATSA-N 327.340 3.148 50 40 EGGB COCCCOc1ccc2nc(NC(=O)[C@@H](C)Cl)sc2c1 20132112 HPVZUPBUGWZYRQ-SECBINFHSA-N 328.821 3.277 50 40 EGGB CCC(=O)Nc1ccc(C(=O)N/N=C/c2ccccc2Cl)cc1 112852 QPEOGDFLFKNLAM-YBFXNURJSA-N 329.787 3.452 50 40 EGGB CCCCC(=O)NNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 4852657 XMDCISGNLZGTEL-SECBINFHSA-N 333.215 3.098 50 40 EGGB Cc1cccn2c(=O)c(C=C(C#N)C#N)c(Oc3ccccc3)nc12 2426782 DBGSVQGHZAOHMV-UHFFFAOYSA-N 328.331 3.226 50 40 EGGB O=C(N/N=C/C(Cl)=C\c1ccccc1)c1ccc2c(c1)OCO2 3527039 FITKIYNOJBCGBQ-PCQBTJQKSA-N 328.755 3.411 50 40 EGGB C/C(=N\NC(=O)[C@@H]1COc2ccccc2O1)c1ccc(C(C)C)cc1 4694086 PPAXDKZRSDFDIE-ORTNRGLGSA-N 338.407 3.490 50 40 EGGB Cc1cc(C)cc(O[C@H](C)C(=O)NN=Cc2ccc(N(C)C)cc2)c1 8700774 PBMPMCKIGYVELX-MRXNPFEDSA-N 339.439 3.287 50 40 EGGB Cc1ccc(/C=N\NC(=O)c2cc(Br)ccc2O)cc1 33313786 OAGRZZZGFBDNTI-MFOYZWKCSA-N 333.185 3.227 50 40 EGGB C/C(=N\NC(=O)CNC(=O)c1ccccc1)c1ccc2ccccc2c1 17041661 AETOVAMXVOMBEQ-HZHRSRAPSA-N 345.402 3.110 50 40 EGGB C[C@@]12CC(C#N)=C(O)[C@@H]3O[C@@]31CC[C@H]1[C@H]2CC[C@@]2(C)[C@H](O)CC[C@H]12 584577926 KVJXBPDAXMEYOA-RSCNPSKGSA-N 329.440 3.467 50 40 EGGB Cc1nn(-c2ccccc2)c2c1C(=O)C(=O)C(C)(C)[C@@H]2Br 3172016 QTJQTHNFBQBFJU-CQSZACIVSA-N 347.212 3.408 50 40 EGGB Cc1occc1C(=O)NNC(=O)[C@@H](c1ccc(Cl)cc1)C(C)C 5823773 GZLPAMLOUHDERV-OAHLLOKOSA-N 334.803 3.442 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@@H](c2ccc3c(c2)OCO3)[C@@H]2CCCC=C12 35185233 LMOAEQHNEPYZAY-KDOFPFPSSA-N 344.374 3.009 50 40 EGGB Cc1cc(C(F)(F)F)nn1[C@H](C)C(=O)N/N=C/c1ccc(F)s1 252484637 GCERTKVGXGCMFU-NCYOTZSRSA-N 348.325 3.122 50 40 EGGB CCS[C@@]1(c2ccc(Cl)cc2)OC(N)=C(C#N)C1=C(C#N)C#N 100249678 GOIZQWPXUDPYBW-MRXNPFEDSA-N 342.811 3.314 50 40 EGGB O=C(/C=C/c1ccco1)NNC(=O)c1ccc(-c2ccccc2)cc1 572039 LVHLNMUPOHNHCH-OUKQBFOZSA-N 332.359 3.421 50 40 EGGB Cc1ccc(/C=N/NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1 2751437 BXKGSWVPPPPTKC-XQNSMLJCSA-N 344.414 3.381 50 40 EGGB CCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)OC(C)(C)C)c1C 8881471 DSUKSWOJJSGTMX-MHWRWJLKSA-N 346.427 3.307 50 40 EGGB O=C(CCc1ccccc1)N/N=C/c1ccc(O)c(Br)c1 4545671 TWCYMUYBDUMHPN-WOJGMQOQSA-N 347.212 3.238 50 40 EGGB O=C(CN1Cc2ccccc2C1)N/N=C/c1ccc(Cl)cc1Cl 409193478 DOCZJBJLIWTUIV-DNTJNYDQSA-N 348.233 3.459 50 40 EGGB CCOc1cc(C(=O)NN)cc(Cl)c1OCc1ccccc1F 216836500 OZZZKZGCXSQFDO-UHFFFAOYSA-N 338.766 3.060 50 40 EGGB O=C(Cl)[C@H]1CC(=O)N(c2ccc(N3CCCC3)c(Cl)c2)C1 45958269 OKPMUTQLBDYEBP-JTQLQIEISA-N 327.211 3.059 50 40 EGGB COc1cc(C(=O)NN)ccc1OCc1ccc(Cl)c(Cl)c1 226326894 MDENMWZOXGCBCE-UHFFFAOYSA-N 341.194 3.185 50 40 EGGB C=C[Si@@]1(C)O[Si](C)(C)O[Si@@](C)(C=C)O[Si@](C)(C=C)O1 2002125852 FBXTUBNFTGCQPZ-BWTSREIZSA-N 332.653 3.160 50 40 EGGB O=C(COc1ccccc1[N+](=O)[O-])N/N=C/c1ccc2ccccc2c1 59764 DFUWKKPANOTAQU-UDWIEESQSA-N 349.346 3.277 50 40 EGGB COc1cc(C)c(/C=N/NC(=O)c2ccc(Cl)cc2)cc1OC 408548206 DWBIGTZBJAYOAP-VXLYETTFSA-N 332.787 3.430 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)Cc2nc3ccccc3[nH]2)cc1 5579824 AIYNLROETOHDOG-DEDYPNTBSA-N 336.395 3.045 50 40 EGGB Cc1c([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cnn1C(C)C 253407985 WZGLHBTZJFMXKE-MRXNPFEDSA-N 340.427 3.223 50 40 EGGB COc1ccc(CCCC(=O)N/N=C/c2ccccc2OC)cc1 221442 LSXYAGUSDHNGEN-XSFVSMFZSA-N 326.396 3.177 50 40 EGGB C#CCn1cc(/C=C(\C#N)C(=O)Nn2c(C)ccc2C)c2ccccc21 409383519 ZJGQGJVUFYLYNG-SFQUDFHCSA-N 342.402 3.370 50 40 EGGB CC[C@@H](C)Oc1ccc(/C=C(\C#N)C(=O)N2CCCC2)cc1OC 409368566 CDPKZCGVQOCODS-DSQDWWTGSA-N 328.412 3.402 50 40 EGGB Cc1ccc(CC(=O)N/N=C/c2ccc(C)c([N+](=O)[O-])c2)cc1C 408568637 VPZXPJJAJBWKHD-YBFXNURJSA-N 325.368 3.213 50 40 EGGB COc1cccc(/C=N\NC(=O)Cc2cc(C)ccc2C)c1OC 409361028 GJZHQUGOTRHLRT-NDENLUEZSA-N 326.396 3.013 50 40 EGGB CC(C)(C)[Si](C)(C)OC[C@H]1CC[C@@H](n2cnc3c(N)ncnc32)O1 195516887 KGDNLTOAOQTVGA-NEPJUHHUSA-N 349.511 3.108 50 40 EGGB O=c1[nH]c(CCl)nc2sc3c(c12)CCN(Cc1ccccc1)C3 35572272 XWJRDKHTXCEQGN-UHFFFAOYSA-N 345.855 3.282 50 40 EGGB CO[Si](c1ccccc1)(c1ccccc1)c1cccc2ccccc12 195767823 BUBGLNIPLQIXEA-UHFFFAOYSA-N 340.498 3.453 50 40 EGGB Cc1cc(C(=O)N/N=C2/CCCC(=O)C2)c(C)n1-c1ccc(F)cc1 103453710 OKGJNKXDCFNTMX-QNGOZBTKSA-N 341.386 3.462 50 40 EGGB N#C/C(=C\c1ccc(N2CCOCC2)o1)c1ccc([N+](=O)[O-])cc1 571760 YCLODXGWWLZAPV-SDNWHVSQSA-N 325.324 3.089 50 40 EGGB O=C(NN=Cc1cccs1)C(O)(c1ccccc1)c1ccccc1 11613918 XPSMCLHLXHOBGX-UHFFFAOYSA-N 336.416 3.134 50 40 EGGB O=[N+]([O-])c1ccc(S(=O)(=O)OC23CCC(CC2)C[C@@H]3Cl)cc1 3128030 XXYHJSYTLRTUBD-AWAWDMARSA-N 345.804 3.240 50 40 EGGB Cc1cc(Cl)ccc1OCC(=O)N/N=C/c1cccc([N+](=O)[O-])c1 249344 GNFLGPKULPTPRY-GIJQJNRQSA-N 347.758 3.086 50 40 EGGB CCC(=O)NNC(=O)C12C[C@H]3C[C@@H](C1)CC(c1ccc(C)cc1)(C3)C2 1467715 LPHGBLFYDJHJAF-XBLGPDGASA-N 340.467 3.390 50 40 EGGB COc1ccc(/C=C(\C#N)C(N)=O)c(OCc2cc(C)cc(C)c2)c1 408899119 ZECJHSLJTOWTFR-RQZCQDPDSA-N 336.391 3.283 50 40 EGGB Cc1c(/C=N\NC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2n1C 33367780 GBPBGSDGEGGZCT-ODLFYWEKSA-N 336.351 3.159 50 40 EGGB COC(=O)/C(C#N)=C/c1cccc(OC(=O)c2ccccc2F)c1 1791148 FXZHLSPGVXJEDO-UKTHLTGXSA-N 325.295 3.125 50 40 EGGB BrC[C@H](Br)C[n+]1cccc2ccccc21 3168166 KSGPKXHGGYUKMP-NSHDSACASA-N 330.043 3.286 50 40 EGGB CCOc1cc(/C=N/NC(=O)CSc2ccc(C)cc2)ccc1O 8515686 STIKZUSRCAEAPS-YBFXNURJSA-N 344.436 3.342 50 40 EGGB CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=C/c1ccc2c(c1)OCO2 18142622 DKJMVTYSIBVRQS-WLRTZDKTSA-N 342.358 3.424 50 40 EGGB Cc1ccsc1/C=C(/C#N)C1=NN(c2ccccc2)[C@@H](N)[C@@H]1C#N 409001198 VIIBHVFJMSKKHC-UESTVXAJSA-N 333.420 3.264 50 40 EGGB Cc1cc(C)cc(O[C@@H](C)C(=O)N/N=C\c2ccc(N(C)C)cc2)c1 31776131 PBMPMCKIGYVELX-JHDSZEHQSA-N 339.439 3.287 50 40 EGGB O=C(N/N=C/C=C/c1ccco1)C(O)(c1ccccc1)c1ccccc1 3087164 PTLZQYOTDOLGLW-KPLVBVSQSA-N 346.386 3.331 50 40 EGGB COc1cc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)ccc1O 4739632 QUMCCKRCZLSYAO-AWQFTUOYSA-N 338.285 3.184 50 40 EGGB COc1ccc([C@@H]2C(C#N)=C(C(C)(C)C)OC(N)=C2C=N)c(OC)c1 536460 KYVKSKHFWZSWCK-MRXNPFEDSA-N 341.411 3.461 50 40 EGGB COc1cccc([C@@H]2C(C#N)=C(N)Oc3oc4ccccc4c(=O)c32)c1 125708 VDPSMWGIWNQYJT-MRXNPFEDSA-N 346.342 3.020 50 40 EGGB CCOC(=O)/C(C#N)=C/c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1 409202606 SAHZEWIYXMFXOQ-UKTHLTGXSA-N 339.307 3.252 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@H](C)Sc2ccccn2)cc1 188568 PYQHKIWEEFUPNR-HCZVKUGISA-N 329.425 3.111 50 40 EGGB Cc1cc(C)n(CCC(=O)N/N=C/c2ccc(Cl)cc2Cl)n1 553105 WGTYJETYIMWRIV-GIJQJNRQSA-N 339.226 3.347 50 40 EGGB C/C(=N/NC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccccc1 62705 LAOBAVUXMORFHS-QJOMJCCJSA-N 344.414 3.463 50 40 EGGB C/C(CC(=O)Nc1ccc(F)cc1F)=N\NC(=O)c1ccccc1F 104813381 RFTRBXHACKBWGG-LSHDLFTRSA-N 349.312 3.238 50 40 EGGB O=C(CBr)c1ccc(OC(F)F)cc1OC(F)F 3885306 COUGOBYBAZSYAM-UHFFFAOYSA-N 331.059 3.467 50 40 EGGB COc1ccccc1/C=N/NC(=O)[C@@H](C)Oc1cccc(Cl)c1 3162144 RZPSVCRAARGQPT-ZGXHQARYSA-N 332.787 3.266 50 40 EGGB O=[N+]([O-])c1ccc(/C(CBr)=N\N2CCCCC2)cc1 5052767 DWBNYSOJRAIKCJ-SQFISAMPSA-N 326.194 3.180 50 40 EGGB N#CC1=C(N)OC2=C(C(=O)CCC2)[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 58722 AJDZWYZDSZIHKL-CQSZACIVSA-N 345.742 3.063 50 40 EGGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@@H]1C[C@H]1c1ccccc1 4109642 PIPKSJQWWUXIRL-DGSGAQMOSA-N 338.451 3.154 50 40 EGGB COc1cc(OC)c(OC)cc1/C=C(/C#N)c1ccc(C(=O)O)cc1 33528740 MVJHIALPFJWSBX-NVNXTCNLSA-N 339.347 3.475 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1 337277 INQNXQUZYOTIFN-XYOKQWHBSA-N 341.298 3.288 50 40 EGGB COCCCOc1ccc2nc(NC(=O)[C@H](C)Cl)sc2c1 20132116 HPVZUPBUGWZYRQ-VIFPVBQESA-N 328.821 3.277 50 40 EGGB C[C@@H](Oc1ccccc1)C(=O)N/N=C/c1c(O)ccc2ccccc12 93776 NNFYLENZBBRQJS-CNRHGSOZSA-N 334.375 3.463 50 40 EGGB COc1cc2ccccc2cc1[C@H]1C(C#N)=C(N)Oc2n[nH]c(C)c21 141958 PJZMEOCALZKGAP-KRWDZBQOSA-N 332.363 3.098 50 40 EGGB CCOc1ccc(N2C(=O)C[C@]3(C[C@@H](Cl)N=N3)C2=O)cc1Cl 4498637 OOFPJBMNIDQFGG-SMDDNHRTSA-N 342.182 3.162 50 40 EGGB N#CCCN(C(=O)/C(C#N)=C/c1ccc([N+](=O)[O-])cc1)c1ccccc1 2290512 XTYYRKVMPPBDCQ-DTQAZKPQSA-N 346.346 3.449 50 40 EGGB CCOC(=O)[C@@H]1C(O)=NC(SC)=C(C#N)[C@H]1c1ccccc1OC 9087731 LAIJDBBITHATCX-KGLIPLIRSA-N 346.408 3.026 50 40 EGGB CC(C)CSC1=C(C#N)[C@@H](c2ccc3c(c2)OCO3)CC(=O)N1 9110074 ZOCKCFQDCMOABT-GFCCVEGCSA-N 330.409 3.143 50 40 EGGB C/C(=N/NC(=O)c1cc(-c2cccs2)n[nH]1)c1ccc(F)cc1 8564861 PDOWAZGNWAUQAE-ZDLGFXPLSA-N 328.372 3.431 50 40 EGGB C/C(=N\NC(=O)CNc1ccc(C)cc1C)c1ccc(C(=O)O)s1 7054969 UMAMYZCRMRNMPH-XDHOZWIPSA-N 345.424 3.015 50 40 EGGB C=CCSC1=C(C#N)[C@H](c2ccc(O)c(OCC)c2)CC(=O)N1 9089114 KITQTGYIEJTTRH-LBPRGKRZSA-N 330.409 3.049 50 40 EGGB CC(=O)N/N=C(/C)c1ccc(NC(=O)c2csc(C)c2C)cc1 15934521 RYKJAFFXSFBGRR-ODLFYWEKSA-N 329.425 3.477 50 40 EGGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C(\C)c1cc(C)ccc1C 408591485 UJBVEZZLHHKKQV-CPNJWEJPSA-N 341.367 3.374 50 40 EGGB Cc1nc2ccccn2c1C(=O)N/N=C\c1c(F)cccc1Cl 408896257 XBWRPVMFSICGPT-OCKHKDLRSA-N 330.750 3.199 50 40 EGGB C/C(=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1cc(C)ccc1C 408591186 RVQTUJPAUZZVKR-XMHGGMMESA-N 325.368 3.295 50 40 EGGB BrCC1CCN(c2cccc(Br)n2)CC1 79440400 HIPMGQHYEVRPPO-UHFFFAOYSA-N 334.055 3.455 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)c(OC)c1 6587681 DUWMYYHVYABVNG-QAZQYGAVSA-N 328.412 3.306 50 40 EGGB O=C(COc1ccc(Cl)cc1Cl)NN=C(CCl)CCl 100244346 UGMDCOFMQQXNNS-UHFFFAOYSA-N 344.025 3.322 50 40 EGGB O=C(O)c1cccc(-c2ccc(/C=N/NC(=O)c3cccs3)o2)c1 59418990 VPISIDNXOSTVCQ-VCHYOVAHSA-N 340.360 3.470 50 40 EGGB CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1cccc(F)c1 408878349 AUWBWRMZMJTKAD-OVCLIPMQSA-N 340.354 3.196 50 40 EGGB CC(=O)Nc1ccc(/C(C)=N/NC(=O)CSc2ccccc2)cc1 408860830 GADQIWJEWDJXSQ-DEDYPNTBSA-N 341.436 3.278 50 40 EGGB N#C/C(=C/c1ccc(-c2ccc(Br)cc2F)o1)C(N)=O 252486124 HHNKGLHOFZDHBV-YVMONPNESA-N 335.132 3.240 50 40 EGGB O=C(N/N=C/c1cccc(OCc2ccccc2)c1)c1ccccn1 553751 YUMMSTFCMYUQHQ-HYARGMPZSA-N 331.375 3.425 50 40 EGGB CNC(=O)/C(C#N)=C/c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1 277069 SAWLPJARSBXWLA-RMKNXTFCSA-N 331.715 3.161 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/c2ccccc2Cl)c([N+](=O)[O-])c1 220435 XDEVKRNBOIPLGK-GIJQJNRQSA-N 347.758 3.086 50 40 EGGB O=C1OC(=O)[C@H]2[C@@H]1C1(Cl)c3ccccc3C2(Cl)c2ccccc21 101660240 CTMYKTZXKOHVNC-MWABVPJASA-N 345.181 3.294 50 40 EGGB COc1ccc(Cl)cc1NC(=O)/C(C#N)=C/c1c(C)nn(C)c1C 373891 OYCWRCVUUUTKFE-KPKJPENVSA-N 344.802 3.245 50 40 EGGB CC[C@H](Nc1ccc(OC)cc1)C(=O)N/N=C/c1ccccc1F 369863 OCJNPJKIZJLNML-RONKMWSCSA-N 329.375 3.175 50 40 EGGB Cc1nn(-c2ccccc2)c2c1[C@@H](c1cccs1)C(C#N)=C(N)O2 495444 GXBJEUPMVNNELF-MRXNPFEDSA-N 334.404 3.460 50 40 EGGB CC/C(=N\NC(=O)c1ccc(F)cc1)c1ccc(OC)cc1OC 8812500 BZYRVAPVYUQKLQ-CAPFRKAQSA-N 330.359 3.387 50 40 EGGB Cc1ccc(/C=N/NC(=O)CSCc2ccc([N+](=O)[O-])cc2)cc1 20247926 PLSJARAXNOSKTQ-VCHYOVAHSA-N 343.408 3.287 50 40 EGGB O=C(NNc1ccccc1[N+](=O)[O-])C1=Cc2cc(Cl)ccc2OC1 14157703 VZQWBKRWSUBUBS-UHFFFAOYSA-N 345.742 3.167 50 40 EGGB CCCN1CCC(=NNC(=O)COc2ccc3ccccc3c2)CC1 5468380 FXXPYPANBARDHS-UHFFFAOYSA-N 339.439 3.197 50 40 EGGB C/C(=N\NC(=O)COc1cc(C)ccc1C(C)C)c1cccnc1 4860349 JQNHREPTMSPJJO-RCCKNPSSSA-N 325.412 3.433 50 40 EGGB O=C(NNC(=O)c1ccc(SC(F)(F)F)cc1)c1ccccc1 7239585 ZEBBDLNFSUFIRI-UHFFFAOYSA-N 340.326 3.373 50 40 EGGB COc1cc(OC)c(/C=N\NC(=O)Cc2ccc(C)cc2)cc1Cl 409363341 LHDPHSZGPCDIKM-JAIQZWGSSA-N 346.814 3.358 50 40 EGGB COc1ccc(C(=O)N/N=C/c2ccccc2OCC(C)C)cc1 408600775 GAUPNSZXSSIJGY-UDWIEESQSA-N 326.396 3.494 50 40 EGGB N#Cc1ccc(/C=N\NC(=O)Cc2ccc(Br)cc2)cc1 35494398 XJKASKYCOBXZBO-ODLFYWEKSA-N 342.196 3.014 50 40 EGGB CC(C)(C)OC(=O)N(C1CC1)[C@H]1CCCC[C@H]1NC(=O)CCl 83318760 XHGHBHVVCBCTJG-OLZOCXBDSA-N 330.856 3.052 50 40 EGGB CCOc1ccc(CCCC(=O)N/N=C/c2ccccc2O)cc1 5873018 WWBMXIBGJTXLDT-XSFVSMFZSA-N 326.396 3.264 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)c2ccc(OC)c(OC)c2)cc1 5469343 PQMDOGSIGQFHCA-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB Cc1cc(C(=O)N/N=C/c2ccccc2OC(C)C)ccc1[N+](=O)[O-] 370765 KZJFJGFZFMOUQB-YBFXNURJSA-N 341.367 3.454 50 40 EGGB CC1=C(C(=O)OC(C)C)[C@H](c2ccccc2Cl)C(C#N)=C(N)O1 4966775 QXNJRRHLURSGKA-OAHLLOKOSA-N 332.787 3.373 50 40 EGGB Cc1ccc(-c2nn3c(nc2=O)-c2ccccc2N[C@H]3CCl)cc1 101459280 ZNXHRTXFQCMGNC-OAHLLOKOSA-N 338.798 3.444 50 40 EGGB Cc1ccc([C@]23C=C[C@@](c4ccccc4)(C2)[C@H]2C(=O)OC(=O)[C@@H]23)cc1 104258059 NGVNZZVUDLWVTA-UBBRYJJRSA-N 330.383 3.460 50 40 EGGB C[C@]12CC[C@H]3[C@@H](CC[C@]45O[C@H]4C(O)=C(C#N)C[C@]35C)[C@@H]1CC[C@H]2O 118916771 KVJXBPDAXMEYOA-LWRIFRTESA-N 329.440 3.467 50 40 EGGB O=C(NNc1ccc(F)cc1)[C@@H](c1ccccc1)N1CCSCC1 58792216 WRLSYOPPOBGRTR-QGZVFWFLSA-N 345.443 3.059 50 40 EGGB CO[C@@H](C(=O)N/N=C/c1ccc(Br)cc1)c1ccccc1 59366767 CBUDKAFNTIWISG-CLXYIWAZSA-N 347.212 3.287 50 40 EGGB C/C(=N\NC(=O)c1ccc2c(c1)OCO2)c1nc2ccccc2s1 7279007 RCFXALOTDQAGAF-VXLYETTFSA-N 339.376 3.179 50 40 EGGB CCOc1cc(/C=C(/C#N)C(=O)NC2CCCC2)cc(Cl)c1O 33721665 WYVLGMATAAUFBH-GHXNOFRVSA-N 334.803 3.410 50 40 EGGB O=[P@@]1(N(CCCl)C[C@@H](Cl)CCCCl)NCCCO1 301054391 CEWZNIGUQAHDRC-YPMLDQLKSA-N 337.615 3.272 50 40 EGGB Cc1n[nH]c(C)c1CCC(=O)N/N=C\c1ccc(C(C)(C)C)cc1 31841386 SFAPPWOPVJMYQD-NDENLUEZSA-N 326.444 3.407 50 40 EGGB CCOc1ccc(C(=O)NN)cc1COc1ccc2ccccc2c1 224637609 XASXGIQKSHEPRR-UHFFFAOYSA-N 336.391 3.421 50 40 EGGB O=C(N/N=C/c1cccc(Cl)c1)c1cccc(Cn2cccn2)c1 12428640 VIZXFUUPEHSMOE-UDWIEESQSA-N 338.798 3.349 50 40 EGGB C/C=C/C=N/NC(=O)C[C@H](NC(=O)c1ccccc1)c1ccccc1 6293023 SFCDGZJWBVJJSX-PGKCBTMLSA-N 335.407 3.226 50 40 EGGB COc1cccc(/C=C(\C#N)c2nc(O)c3ccccc3n2)c1OC 3899763 BFXUFVGKUWYEJK-JLHYYAGUSA-N 333.347 3.417 50 40 EGGB COc1cccc2cc(/C(C)=N/NC(=O)Cc3nc(C)cs3)oc12 7906888 XCOLLLDEACDKTF-YBFXNURJSA-N 343.408 3.289 50 40 EGGB Cc1cc(C)cc(CSCC(=O)N/N=C/c2ccc(N(C)C)o2)c1 408989375 HPJXWEQRFHBPIO-VXLYETTFSA-N 345.468 3.346 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2cccn2-c2ccc(C(=O)O)cc2)cc1 409241782 YOWLFABXXRDAAO-FYJGNVAPSA-N 347.374 3.248 50 40 EGGB Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)NNC(=O)c1ccoc1C 40140395 JGMKRKHUADJDPH-CQSZACIVSA-N 344.411 3.248 50 40 EGGB C=CCNC(=O)/C(C#N)=C/c1cn(C)nc1-c1cc2ccccc2o1 96291574 XATOHQPONXXYAG-NTEUORMPSA-N 332.363 3.042 50 40 EGGB O=C(CCCCl)Nc1nnc(-c2cccc([N+](=O)[O-])c2)s1 4072451 POQPEYFJJKOERU-UHFFFAOYSA-N 326.765 3.071 50 40 EGGB COc1ccc(OC)c(/C=C(\C#N)S(=O)(=O)c2ccccc2)c1 148313 PHQPDQDVMCZLHT-LFIBNONCSA-N 329.377 3.042 50 40 EGGB CSc1ncc(Cl)c(C(=O)C(C#N)=C2Nc3ccccc3N2)n1 6694085 IUXAJBWOUSFAJX-UHFFFAOYSA-N 343.799 3.307 50 40 EGGB CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)Oc1ccc([N+](=O)[O-])cc1 103663480 ALJZEMRUAOJSPP-CYBMUJFWSA-N 338.360 3.050 50 40 EGGB O=C(N/N=C/c1ccc(N2CCCCC2)s1)c1ccc(O)cc1 6674633 GIWIROGCSVUKDC-LDADJPATSA-N 329.425 3.208 50 40 EGGB CN(C)CCSc1ccc(NC(=O)/C(C#N)=C\c2ccco2)cc1 98052744 JXCDDKMQKSCTRG-OWBHPGMISA-N 341.436 3.479 50 40 EGGB O=Cc1cc(F)c(CBr)c(I)c1 169796420 PWJASYIDYHDZQP-UHFFFAOYSA-N 342.933 3.138 50 40 EGGB CCOC(=O)/C(C#N)=C/Nc1sc2c(c1C(=O)OCC)CCCC2 358127 FKQCHUASAJQYHS-ZHACJKMWSA-N 348.424 3.186 50 40 EGGB CN1C=C(C(F)(F)F)C=C/C1=C(/C#N)c1nnc2n1CCCCC2 3191903 AKYAYDIZTPXJEZ-OUKQBFOZSA-N 335.333 3.187 50 40 EGGB O=C(COc1ccccc1)N/N=C/c1ccc(Br)s1 62480 QICUSYMYGJLBHJ-OVCLIPMQSA-N 339.214 3.040 50 40 EGGB COc1cccc(/C=N/NC(=O)CCSc2ccccc2)c1OC 59473546 GMYXJIJHXQNCHH-CPNJWEJPSA-N 344.436 3.336 50 40 EGGB C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@H]1CC=CCC1 12754990 LYIUQXVDDRKCRI-ZBFHGGJFSA-N 338.407 3.111 50 40 EGGB CCCC[C@H](C(=O)NN)N1c2cc(OC)ccc2[C@H](C)CC1(C)C 260625106 ZITPAIWPMZMKLV-CZUORRHYSA-N 333.476 3.336 50 40 EGGB CCCC[C@@H](C(=O)NN)N1c2cc(OC)ccc2[C@H](C)CC1(C)C 260625102 ZITPAIWPMZMKLV-CJNGLKHVSA-N 333.476 3.336 50 40 EGGB C/C(=N\NC(=O)c1ccccc1Br)c1ccc(O)cc1O 5370430 AXRJAMFJQDFVCH-RQZCQDPDSA-N 349.184 3.014 50 40 EGGB C[C@H]1CCc2c(sc3ncnc(NNC(=O)c4ccco4)c23)C1 11903828 YXZRDZNAFZGAGL-VIFPVBQESA-N 328.397 3.166 50 40 EGGB CCn1c(C)nc2cc(C(=O)N/N=C(\C)c3ccccc3O)ccc21 13122156 XRKPKUBQPYIRRP-CIAFOILYSA-N 336.395 3.224 50 40 EGGB CCOC(=O)/C(C#N)=C1/C(=O)N2c3c1cc(C)cc3[C@@H](C)CC2(C)C 544242 NRYGQUMWIKAUDL-VVLLMFOMSA-N 338.407 3.468 50 40 EGGB CC(C)N1CCC2(CC1)C(C#N)=C(O)NC1=C2C(=O)CC(C)(C)C1 31208 HHKVUUFBYWBLFB-UHFFFAOYSA-N 329.444 3.017 50 40 EGGB O=C(N/N=C\c1cccc([N+](=O)[O-])c1)c1ccccc1C(F)(F)F 408781636 DGNWDDPTRLEVCS-OCKHKDLRSA-N 337.257 3.378 50 40 EGGB CC(C)(C)OC(=O)N1CC[C@@H](CCI)C1 95083237 WAZXDTKITHEPAQ-SECBINFHSA-N 325.190 3.069 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)c2cccc(Br)c2)cc1 260138 HBARLBFHAKKQOU-WOJGMQOQSA-N 346.228 3.279 50 40 EGGB COc1ccc(/C=N/NC(=O)COc2c(C)cccc2C)cc1C 14014109 DRZDYQZBHCPOFF-RGVLZGJSSA-N 326.396 3.150 50 40 EGGB COc1cn(-c2ccccc2)nc1C(=O)NNc1cccc(Cl)c1 30612605 CJIHCBGULIIHRT-UHFFFAOYSA-N 342.786 3.291 50 40 EGGB Cc1cc(C)nc(NNC(=O)c2cc3cc(Cl)ccc3nc2C)n1 11334775 FUDNQMRUICQHFY-UHFFFAOYSA-N 341.802 3.360 50 40 EGGB O=C(NNc1ncccn1)c1cn(Cc2ccccc2)c2ccccc12 46577229 DVNRUYCHOCEJPW-UHFFFAOYSA-N 343.390 3.237 50 40 EGGB Cc1ccc(C(C)C)c(OCC(=O)NNC2=CC(=O)CC(C)(C)C2)c1 18093945 OUJMYCWUCYSPJE-UHFFFAOYSA-N 344.455 3.391 50 40 EGGB O=C(N/N=C/c1ccc(N2CCOCC2)o1)c1ccc2ccccc2c1 409015593 OJICKEPIJLFSNV-KGENOOAVSA-N 349.390 3.033 50 40 EGGB CCCN(CCC)C(=O)c1cccc(NC(=O)CBr)c1 35605421 VTIHCZBVLJQLIA-UHFFFAOYSA-N 341.249 3.282 50 40 EGGB CC(=O)Nc1cccc(C(=O)N/N=C/c2ccc(OC(C)C)cc2)c1 582421 SDCHUSRXHYTUHR-UDWIEESQSA-N 339.395 3.196 50 40 EGGB O=C(F)[C@@](F)(OC(F)(F)C(F)(F)Br)C(F)(F)F 103540909 COIQPZUVUUGETI-UWTATZPHSA-N 342.939 3.308 50 40 EGGB O=C(N/N=C/c1ccccc1O)c1ccc(NC(=O)c2ccco2)cc1 6335660 MDZUVAMABMEIJV-UDWIEESQSA-N 349.346 3.001 50 40 EGGB COc1ccc(/C=C(\C#N)c2nc(O)c3ccccc3n2)cc1OC 3899765 VVOFKYNQZAOBSB-UKTHLTGXSA-N 333.347 3.417 50 40 EGGB C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)N/N=C/c1cccnc1 491865 YFBUYQFLDYVBQA-XTTRTJGBSA-N 338.194 3.306 50 40 EGGB Cc1nc(C)c(Cl)c(OS(=O)(=O)CCCCl)c1Cl 1561388 ATYIANHSZHIILE-UHFFFAOYSA-N 332.636 3.343 50 40 EGGB O=C(Cc1ccc(C(F)(F)F)cc1)NNc1ccccc1[N+](=O)[O-] 12605635 FXTGYXDQNPLCMJ-UHFFFAOYSA-N 339.273 3.299 50 40 EGGB O=C(O)CC/C(=N\NC(=O)[C@H]1C[C@H]1c1ccccc1)c1ccccc1 4646817 XAVHBAQTZZUWSK-IJUQLDHVSA-N 336.391 3.175 50 40 EGGB O=C(Oc1ccc(/C=N/NC(=O)c2ccco2)cc1)c1ccccc1 1458016 DVMCEAISASACHT-DEDYPNTBSA-N 334.331 3.263 50 40 EGGB CCOC(=O)C1=COC(N)=C(C#N)[C@@H]1c1ccc(Cl)cc1Cl 5458030 IUVKPMOOVPXVQB-ZDUSSCGKSA-N 339.178 3.248 50 40 EGGB Cc1nc2ccc(Cl)cn2c1C(=O)N/N=C/c1ccccc1F 524611 RNFLPNCEMPRGJE-UFWORHAWSA-N 330.750 3.199 50 40 EGGB O=C(N/N=C/[C@H]1C[C@@H]2CC[C@@H]1C2)C(O)(c1ccccc1)c1ccccc1 100453555 AVOCCHZHHHQNLQ-BEUKICCHSA-N 348.446 3.461 50 40 EGGB C/C(=N\NC(=O)Cc1c[nH]c2ccccc12)c1nc2ccccc2[nH]1 17419927 YGCZOUYDWHQPMF-FSJBWODESA-N 331.379 3.127 50 40 EGGB CCc1cc(NNC(=O)c2ccc(C)s2)nc(-c2ccccn2)n1 69737871 LUNWFBVAJLIYLD-UHFFFAOYSA-N 339.424 3.228 50 40 EGGB COc1cccc2cc(C(=O)N/N=C/c3ccc(N(C)C)cc3)oc12 408972418 TUAFAKUUOQQCFK-UDWIEESQSA-N 337.379 3.271 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)CSCc2ccccc2)cc1 20248718 PGZLWWFUGORXQO-XMHGGMMESA-N 328.437 3.469 50 40 EGGB CCOc1ccc(C(=O)O)cc1/C=C(\C#N)C(=O)Nc1ccccc1 408823508 DROVYCMTNJKBOO-RVDMUPIBSA-N 336.347 3.329 50 40 EGGB CCc1ccc(CC(=O)N/N=C(\C)c2cccc([N+](=O)[O-])c2)cc1 409364425 PMNWPNFOTOPAJD-CPNJWEJPSA-N 325.368 3.240 50 40 EGGB NNC(=O)c1cn(C(=O)c2ccc(Cl)cc2Cl)c2ccccc12 216954798 JRBBCQZLPLBZPS-UHFFFAOYSA-N 348.189 3.240 50 40 EGGB CCn1ncc(Cl)c1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253401066 MKOGKAIDGXIFMV-ZDUSSCGKSA-N 346.818 3.007 50 40 EGGB CC(C)(O)C(=O)N/N=C/c1ccccc1OCc1cccc(Cl)c1 32578391 GENUTMMUABQMGQ-RGVLZGJSSA-N 346.814 3.140 50 40 EGGB Cc1cccc(/C=N/NC(=O)CSc2nc3ccccc3o2)c1 523309 HWGGPIMVACMTTP-VCHYOVAHSA-N 325.393 3.379 50 40 EGGB CC(C)COc1cccc(C(=O)NNC(=O)c2ccc(Cl)cc2)c1 568836 BCMMPRBMPQBPKV-UHFFFAOYSA-N 346.814 3.450 50 40 EGGB CC(C)(/C=N/NC(=O)CSCc1ccc([N+](=O)[O-])cc1)CCC#N 20248521 VFZHJNBWTVLRML-LDADJPATSA-N 348.428 3.260 50 40 EGGB COc1cc(C(=O)N/N=C/C(C)=C/c2ccco2)cc(OC)c1OC 4646963 NIACWHCHZYUMTO-PDOLUSSCSA-N 344.367 3.125 50 40 EGGB CN(C)C(=O)/C(C#N)=C\c1ccc(-c2cc(C(=O)O)ccc2Cl)o1 408753196 FCZZEBPKESQFHT-XFFZJAGNSA-N 344.754 3.293 50 40 EGGB Cc1cc(C)n(C(=O)/C(C#N)=C/c2cc3c(cc2Cl)OCO3)n1 408979766 SDKSJRJOCFJDHK-UUILKARUSA-N 329.743 3.129 50 40 EGGB CCn1c(C)cc(/C=N\NC(=O)COc2ccccc2Cl)c1C 409070684 OMBNNVUIWXIGGH-GRSHGNNSSA-N 333.819 3.307 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/c2cn(C)c3ccccc23)cc1C 219879 LVLLXMWJSUZMOE-SRZZPIQSSA-N 335.407 3.324 50 40 EGGB COc1ccc2ccc(OC)c(/C=N\NC(=O)c3ccccc3N)c2c1 409007877 RBLJPLCRGLNUAS-UUYOSTAYSA-N 349.390 3.203 50 40 EGGB C/C(=N\NC(=O)CSCCc1ccccc1)c1ccccc1O 408727143 OSUHJLITTXCTJL-XMHGGMMESA-N 328.437 3.208 50 40 EGGB COc1cc2ccccc2cc1C(=O)N/N=C/c1ccc([N+](=O)[O-])o1 33647917 INJLGNDGWNRSIC-VCHYOVAHSA-N 339.307 3.114 50 40 EGGB NNC(=O)c1ccc(-c2cc(C(F)(F)F)ccc2Br)o1 226359368 UHGJUEVNRAOUJA-UHFFFAOYSA-N 349.106 3.331 50 40 EGGB C/C(=N\NC(=O)c1nc2ccccn2c1C)c1cccc(Cl)c1 4863951 BKYIZNCVVFOPAW-RGVLZGJSSA-N 326.787 3.450 50 40 EGGB O=C(N/N=C/c1nc(-c2ccccc2)oc1Cl)c1cccc(O)c1 20530489 UMTSIWOUFSOHMN-VXLYETTFSA-N 341.754 3.465 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C\c2ccc(OC)c(OC)c2)cc1 15219797 WCFUIRDHTPSRQJ-UVTDQMKNSA-N 338.363 3.258 50 40 EGGB COc1ccccc1/C=N/NC(=O)COc1ccc(Cl)c(C)c1 566295 QDNGHVUTFZGKTO-VXLYETTFSA-N 332.787 3.186 50 40 EGGB Cc1ccccc1NNC(=O)[C@@](O)(c1ccccc1)c1cccs1 1412638 XAYATFTYXOVQOP-LJQANCHMSA-N 338.432 3.436 50 40 EGGB Cc1ccc(N2C(N)=C(C#N)C(C#N)(C#N)[C@H]2c2ccccc2)cc1 1647949 KDTSMCAADIFKJZ-GOSISDBHSA-N 325.375 3.284 50 40 EGGB CC1(C)CC(=O)C(SSC2C(=O)CC(C)(C)CC2=O)C(=O)C1 102448991 JAAUCRJDDXCGKZ-UHFFFAOYSA-N 342.482 3.021 50 40 EGGB COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)CCl)CC2 3278157 UTYPGSLYQSEHGZ-LJQANCHMSA-N 345.826 3.417 50 40 EGGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)c1nccc2ccccc12 58163246 NUWWMMWYTPPJMA-UHFFFAOYSA-N 349.434 3.212 50 40 EGGB O=C(NNc1ncccn1)c1cc(-c2ccco2)nc2ccccc12 45362050 ZBHCSTIHSBFPHD-UHFFFAOYSA-N 331.335 3.042 50 40 EGGB Cc1nc(C)c(C(=O)N/N=C/c2ccc(Br)cc2)s1 3219089 JKAYEOCUSVWZES-VIZOYTHASA-N 338.230 3.286 50 40 EGGB C/C(=N\NC(=O)COc1ccccc1C#N)c1ccc2c(c1)CCCC2 5288499 ZBOQZPWGZUNXRE-HZHRSRAPSA-N 347.418 3.356 50 40 EGGB Cc1ccc(C)c(OCC(=O)N/N=C/c2ccc(N(C)C)cc2)c1C 12843982 CAKAXZCHRUDFRG-CIAFOILYSA-N 339.439 3.207 50 40 EGGB COc1ccc(CC(=O)N/N=C(\C)c2ccc(Cl)cc2)cc1OC 5480012 KQWOZXGABJNAGW-UDWIEESQSA-N 346.814 3.440 50 40 EGGB O=C(N/N=C\c1ccccc1Cl)c1ccccc1NC(=O)C1CC1 17024082 JYQOIOVMLOCKME-JAIQZWGSSA-N 341.798 3.452 50 40 EGGB O=C(CSc1ccccc1Cl)NNC(=O)c1ccccc1F 5637868 URJXRHLJIBQSQO-UHFFFAOYSA-N 338.791 3.032 50 40 EGGB O=C(N/N=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccncc1 62941 USSPHYLTCGQQGO-YBFXNURJSA-N 336.307 3.014 50 40 EGGB CCc1sc(C(=O)NNC(=O)CCOc2ccccc2C)cc1C 7000794 ZNQVXGLYQHUMAH-UHFFFAOYSA-N 346.452 3.157 50 40 EGGB N#Cc1cc(C(=O)[C@@H](Br)CBr)ccc1F 308799864 JXTHXDULQJQGCA-QMMMGPOBSA-N 334.970 3.038 50 40 EGGB O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccncc1 258072 ALEOLYWRPWRDKG-YBFXNURJSA-N 336.307 3.014 50 40 EGGB Cc1cc(C)n(Cc2ccc(C(=O)N/N=C/c3ccc(O)cc3)cc2)n1 5730366 PNXJQIRAIFGZNB-CIAFOILYSA-N 348.406 3.018 50 40 EGGB O=C(NC[C@H]1c2ccccc2CCN1C(=O)CCl)C1CCCCC1 61836 UCJWLIDMRLKKDY-KRWDZBQOSA-N 348.874 3.048 50 40 EGGB Cc1ccc(NC(=S)NNC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)cc1 8685951 LLWBZGOISSXWHX-IAGOWNOFSA-N 339.464 3.425 50 40 EGGB O=C(CSc1nc2ccccc2s1)N/N=C1\C[C@@H]2C=CC[C@H]12 20932083 WXDJVUBAJRYXDR-CCGRPZKVSA-N 329.450 3.457 50 40 EGGB CCCCc1[nH]nc2c1[C@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 5045031 IRBZQGSJHXDDJA-MRXNPFEDSA-N 337.427 3.036 50 40 EGGB O=C(N/N=C\c1c(Cl)cccc1Cl)c1ccc2c(c1)OCO2 13897393 NPSYDVOXICYSIV-WSVATBPTSA-N 337.162 3.486 50 40 EGGB CCOc1ccc(C(=O)NNC(=O)CCc2ccccc2Cl)cc1 6602975 UCUOIDZUUIXTRX-UHFFFAOYSA-N 346.814 3.133 50 40 EGGB COc1ccc(OC(F)F)c(/C=C(\C#N)C(=O)NCc2ccco2)c1 96298449 RLBMUIZPOSQUMD-KPKJPENVSA-N 348.305 3.113 50 40 EGGB CC(C)Oc1ccc(CNC(=O)/C(C#N)=C\c2ccco2)cc1F 71879553 CUPMEGBGKPWNHL-ZROIWOOFSA-N 328.343 3.429 50 40 EGGB O=C(c1cc(F)cc(F)c1)[C@H](Br)CBr 307254456 XWOKIOVIXJEXQN-MRVPVSSYSA-N 327.950 3.306 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)Nc2cc(C)ccc2OC)ccc1O 408819954 ZPEBDGUXEMADCZ-NTEUORMPSA-N 338.363 3.264 50 40 EGGB C=CCc1cc(/C=C(/C#N)C(=O)NC2CCCCC2)cc(OC)c1O 33540301 LCNNFANRUFUOBL-WJDWOHSUSA-N 340.423 3.485 50 40 EGGB O=C(N/N=C/[C@H]1C[C@@H]2C=C[C@@H]1C2)C(O)(c1ccccc1)c1ccccc1 169620037 MEIWVLWDWOXTGU-BEUKICCHSA-N 346.430 3.237 50 40 EGGB Cc1ccccc1NNC(=O)[C@](O)(c1ccccc1)c1cccs1 1412639 XAYATFTYXOVQOP-IBGZPJMESA-N 338.432 3.436 50 40 EGGB CCCC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(F)cc2)cc1 60276 HEJMSWVNCNUPRU-UDWIEESQSA-N 327.359 3.328 50 40 EGGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2cccs2)c1 571983 MVOGOPRHVUXOOF-UHFFFAOYSA-N 332.425 3.020 50 40 EGGB C/C(N)=C(/C#N)C(=O)COC(=O)CC(c1ccccc1)c1ccccc1 4828888 MPIRHVVCUSOGLI-XDJHFCHBSA-N 348.402 3.077 50 40 EGGB Cc1cccc(/C=N/NC(=O)[C@H](C)Nc2ccc3ccccc3c2)n1 31100 WQNINVGIXOMABO-PCXKXAPESA-N 332.407 3.494 50 40 EGGB COc1ccc(/C=N/NC(=O)CCCNc2ccc(OC)cc2)cc1 3107213 SFSIKTIMOQEONY-KGENOOAVSA-N 341.411 3.046 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)CSCc2ccccc2)cc1 5328471 YZEWNORWWPBFQR-XDHOZWIPSA-N 327.453 3.136 50 40 EGGB COc1ccc([C@H]2C(C#N)=C(N)Oc3c2ccc2[nH]ccc32)cc1OC 79493555 PDVWBJWZSAOWFW-GOSISDBHSA-N 347.374 3.403 50 40 EGGB O=C(CCl)N1CCN(C(c2ccccc2)c2ccccc2)CC1 19597047 LJSDPVAMDBJJSB-UHFFFAOYSA-N 328.843 3.159 50 40 EGGB C#CSC1=C(C#N)[C@H](c2ccccc2[N+](=O)[O-])C(C(C)=O)=C(C)N1 4730786 ZSHMWZFCULPYBC-INIZCTEOSA-N 339.376 3.204 50 40 EGGB Cc1ccc(NC(=O)N/N=C\c2ccc(O[C@H](C)C(=O)O)cc2)cc1 408819315 PXKWYKBOKHIMLO-LPXFMOJISA-N 341.367 3.003 50 40 EGGB C=CCOc1cccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2C)c1 408860601 ZTPFGTRWBCBJOY-XDHOZWIPSA-N 339.351 3.232 50 40 EGGB C#CCOc1ccc(/C=N/NC(=O)c2ccc(C)c(Cl)c2)cc1 409051764 GDCQTXZQIBMQMR-UDWIEESQSA-N 326.783 3.424 50 40 EGGB CC(=O)NNc1nc(C)c(C(=O)/C=C\c2ccccc2Cl)s1 5808958 SPDCZZMATIQLGL-FPLPWBNLSA-N 335.816 3.464 50 40 EGGB Cc1ccc(C)c(NC(=O)C(=O)N/N=C/c2cccc(Cl)c2)c1 59516008 SCYBPERSAFUHTI-VXLYETTFSA-N 329.787 3.046 50 40 EGGB Cc1ccccc1OCC(=O)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 59051 NWMBRNKLLJEXAU-GIJQJNRQSA-N 347.758 3.086 50 40 EGGB N#CC1=C2SC[C@](O)(c3ccccc3)N2C(=O)C[C@H]1c1ccccc1 544542 UNAZSKRCBSOLLX-JXFKEZNVSA-N 348.427 3.330 50 40 EGGB CCCC1=C(C(=O)OCC)[C@@H](c2ccc(OC)cc2)C(C#N)=C(N)O1 71039 NNUVQEQMXDTDPP-INIZCTEOSA-N 342.395 3.120 50 40 EGGB CCOc1cc(Br)c(/C=C(/C#N)C(N)=S)cc1OC 6844655 FVTSEBARUBJUJP-WTKPLQERSA-N 341.230 3.049 50 40 EGGB C#CCOc1ccc(Cl)cc1/C=N/NC(=O)c1ccc(F)cc1 8812294 ATBVEAPEPKQXGE-RGVLZGJSSA-N 330.746 3.255 50 40 EGGB O=C(N/N=C\c1ccc(-c2ccc(Cl)cc2)o1)c1cnccn1 15930558 PNIODXPEYWHSHG-UKWGHVSLSA-N 326.743 3.154 50 40 EGGB CCCOc1ccc(/C=N\NC(=O)c2cc(OC)cc(OC)c2)cc1 38199766 RBJHCXSUEBVOAS-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB CCOc1ccccc1/C=N\NC(=O)COc1cccc(Cl)c1 32511861 SRVTUESULJWIEG-ODLFYWEKSA-N 332.787 3.268 50 40 EGGB CC1(C)C(=O)[C@@]2(Br)CC[C@]1(CC#N)[C@@H]2Br 85398911 OJTCQBIJBRMLII-BKDNQFJXSA-N 335.039 3.186 50 40 EGGB Cc1nn(C(C)C)cc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253406424 ULYRZAIEJGEKQE-INIZCTEOSA-N 340.427 3.223 50 40 EGGB C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1I 95635353 NTYHXNBIVRLYHG-IUCAKERBSA-N 325.190 3.067 50 40 EGGB in-vitro Cc1nc2sccn2c1/C=N/NC(=O)C12CC3CC(CC(C3)C1)C2 5071893 UNYWEVZQHJNHDX-VXLYETTFSA-N 342.468 3.371 50 40 EGGB CC(C)(C)c1ccc(OCC(=O)N/N=C/c2ccccc2O)cc1 101162 XMYMLKHWDKQLQB-UDWIEESQSA-N 326.396 3.219 50 40 EGGB Cc1cccc(N2C(S)=C(C#N)C(=O)N[C@H]2c2cccs2)c1 352236 VECVEWJXYSMHEQ-CQSZACIVSA-N 327.434 3.357 50 40 EGGB CC(C)(C)OC(=O)N(C1CC1)[C@H]1CC[C@H](NC(=O)CCl)CC1 100177884 VSXGVCAUDSLWGJ-TXEJJXNPSA-N 330.856 3.052 50 40 EGGB Cc1cc([N+](=O)[O-])cc(/C=N\NC(=O)c2ccc(Cl)cc2)c1O 36233000 IEIQXBVQABBING-IUXPMGMMSA-N 333.731 3.026 50 40 EGGB CCN(CC)c1ccc(C(=O)NNC(=O)c2cccc(C)c2C)cc1 3303037 SQJVAQSSPPJURC-UHFFFAOYSA-N 339.439 3.224 50 40 EGGB O=C(c1ccc(F)c(F)c1)[C@@H](Br)CBr 306907511 DGRXQJXTDXNJGZ-LURJTMIESA-N 327.950 3.306 50 40 EGGB COc1ccc(NCCCC(=O)N/N=C(\C)c2ccccc2)cc1 5249864 ZGPCADNQVUVHLE-RCCKNPSSSA-N 325.412 3.428 50 40 EGGB COc1ccc(-c2n[nH]cc2/C=C(\C#N)C(=O)NC2CCCC2)cc1 6627992 OXGDFFWZMPBLIQ-GXDHUFHOSA-N 336.395 3.051 50 40 EGGB Cc1ccc(N[C@@H](C)C(=O)N/N=C/c2ccc(N(C)C)cc2)c(C)c1 370363 UZNJZXPQTBKQOC-REIAIGDLSA-N 338.455 3.320 50 40 EGGB Cc1cc(C(=O)NNc2c(Cl)cc(Cl)cc2Cl)nn1C 115506 JBVPSFZFSPRGPF-UHFFFAOYSA-N 333.606 3.446 50 40 EGGB C/C(=N\NC(=O)c1cnccn1)c1ccc(N2CCCCCC2)cc1 55356135 JJGIEQVGEHAVIM-PXLXIMEGSA-N 337.427 3.011 50 40 EGGB C=CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccccn2)cc1OC 5938837 WYRLWHCNSQSKBI-RVDMUPIBSA-N 335.363 3.201 50 40 EGGB COc1cc(OC)cc(C(=O)N/N=C(/c2ccccc2)C(C)C)c1 408710598 PERVAYXHGJWYTO-CZIZESTLSA-N 326.396 3.494 50 40 EGGB CC(C)c1ccccc1OCC(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 511331 QZUBUHXWZOSXSP-YBFXNURJSA-N 341.367 3.247 50 40 EGGB CC(C)COc1ccccc1/C=N/NC(=O)c1ccc([N+](=O)[O-])cc1 169879693 OGKHOKOQELZZHS-YBFXNURJSA-N 341.367 3.394 50 40 EGGB CCOC(=O)CSC1=C(C#N)C(O)=NC2(CCCCC2)S1 547015 PDLJYQTTWXXLFM-UHFFFAOYSA-N 326.443 3.382 50 40 EGGB O=[P@@](NO)(OCc1ccccc1)N(CCCl)CCCl 1566172 WNLFPUFBGUDCBF-IBGZPJMESA-N 327.148 3.070 50 40 EGGB C[C@]1(C(=O)OC[C@@H]2CCC[N+]3(C)CCCC[C@H]23)C[C@@H]1Br 4028522 CIGRASSTVHFEOB-JWLANPSESA-N 345.301 3.112 50 40 EGGB C=CCOc1ccc(C(=O)N/N=C\c2ccccc2OC)cc1OC 6452744 AEZYTVHMQDOTFA-MOSHPQCFSA-N 340.379 3.033 50 40 EGGB CN(C)/N=C(\SS/C(=N\N(C)C)C(F)(F)F)C(F)(F)F 8616258 TYPYVVAKBZVSBB-KNBRTIFXSA-N 342.334 3.243 50 40 EGGB COc1ccc2nc(/C(C#N)=C\c3ccc(OCC(=O)O)cc3)[nH]c2c1 409391218 IAHWGGCEDOAQOJ-JYRVWZFOSA-N 349.346 3.099 50 40 EGGB COc1ccc(Cl)cc1/C=N\NC(=O)c1ccc(OC)c(OC)c1 409322986 MGZPYLDWYPXDAY-GRSHGNNSSA-N 348.786 3.130 50 40 EGGB Cc1ccc(/C=N/NC(=O)COc2ccc3ccccc3c2)c(O)c1 346865 NCTHGACWEFWWKU-CIAFOILYSA-N 334.375 3.383 50 40 EGGB O=C(Cc1ccccc1)NN1C(=O)[C@H](Cl)[C@@H]1c1ccc(Cl)cc1 5838474 IDEHMCXAZMRSSG-CVEARBPZSA-N 349.217 3.105 50 40 EGGB CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc(C(=O)O)cc2)cc1 5873125 LJALXTXDAJZKLD-PTNGSMBKSA-N 336.347 3.329 50 40 EGGB COc1ccccc1OCC(=O)N/N=C/c1c(F)cccc1Cl 6182637 GZZKVWYUHJYXAT-DJKKODMXSA-N 336.750 3.017 50 40 EGGB C/C(N)=C(\C#N)C(=O)COC(=O)CC(c1ccccc1)c1ccccc1 103100565 MPIRHVVCUSOGLI-CYVLTUHYSA-N 348.402 3.077 50 40 EGGB Cc1cc(Cl)ccc1OCC(=O)N/N=C1/CC(=O)CC(C)(C)C1 100860052 RLADEAUZNLGRJK-UYRXBGFRSA-N 336.819 3.279 50 40 EGGB C/C(=N\NC(=O)c1cc2c(s1)C[C@@H](C)CC2)c1cc(O)ccc1O 13321864 YAAKCZXFWBWONJ-KNFNVKMYSA-N 344.436 3.438 50 40 EGGB COc1cc(C)c(/C=N/NC(=O)c2cccc(Cl)c2)cc1OC 408549800 ZGGMDFWTLDJQFQ-VXLYETTFSA-N 332.787 3.430 50 40 EGGB Cc1cc(C)cc(NC(=O)C(=O)N/N=C/c2c(F)cccc2Cl)c1 408971660 LDHPPFYDDILLMX-AWQFTUOYSA-N 347.777 3.185 50 40 EGGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)c2ccc(Cl)cc2)c1 6312396 XGACTNPZDBPIGK-RGVLZGJSSA-N 329.787 3.452 50 40 EGGB COc1ccc2ccccc2c1/C=N/NC(=O)[C@H](O)c1ccccc1 5514561 SQOPAIYYSUZDBO-DBRLUCFCSA-N 334.375 3.032 50 40 EGGB Cc1ccc(O)c(/C=N/NC(=O)CNc2cccc3ccccc23)c1 59038 BNWKLRXSIRKEBM-WSDLNYQXSA-N 333.391 3.416 50 40 EGGB CCN(NC(=O)/C=C/c1c(C)nn(C)c1Cl)c1ccc(C)cc1 12785967 MWZRSDOBTJULTF-ZHACJKMWSA-N 332.835 3.261 50 40 EGGB O=C1C[C@]2(C[C@@H](Cl)N=N2)C(=O)N1c1ccc(Cl)c(Cl)c1 5191191 VUUQJZSASNQOEH-JOYOIKCWSA-N 332.574 3.416 50 40 EGGB COc1cc2c(cc1/C=N/NC(=O)c1ccc(C)cc1Cl)OCO2 409052484 HZROPZTTZUPNJD-UFWORHAWSA-N 346.770 3.150 50 40 EGGB COc1cc(C)ccc1C(=O)N/N=C\c1ccc(N2CCCC2)cc1 408852375 SXJMXCROZHDWKF-STZFKDTASA-N 337.423 3.368 50 40 EGGB O=C(N/N=C/c1cccn1-c1ccccc1)c1cccc([N+](=O)[O-])c1 408852369 JZZPCXQRWKODPP-CPNJWEJPSA-N 334.335 3.149 50 40 EGGB CC[C@@H](Br)C(=O)Nc1sc(C(C)=O)c(C)c1C#N 74941524 KSHORDRHYLNBRZ-SECBINFHSA-N 329.219 3.243 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C\c2ccc(OCC#N)cc2)cc1 195381123 KCAAPQFEDLQVPU-QINSGFPZSA-N 333.347 3.143 50 40 EGGB CN(C)c1ccc(N2C=C(C#N)S(=O)(=O)c3c(F)cccc32)cc1 44167936 NJEXZMDSUCMFQL-UHFFFAOYSA-N 343.383 3.182 50 40 EGGB CC1(C)[C@H]2CC=C(/C=N/NC(=O)Cc3cn4ccsc4n3)[C@@H]1C2 7982234 FDVMBSPLULNHSQ-XDTOLHLPSA-N 328.441 3.033 50 40 EGGB Cc1ccsc1/C=C(/C#N)C1=NN(c2ccccc2)[C@H](N)[C@@H]1C#N 409001197 VIIBHVFJMSKKHC-TTZJCWDPSA-N 333.420 3.264 50 40 EGGB COC(=O)c1cc(Br)c(CBr)cc1F 169796753 OEZJLPRXYNPFHE-UHFFFAOYSA-N 325.959 3.270 50 40 EGGB CCc1ccccc1NC(=O)C/C(C)=N\NC(=O)c1ccccc1O 14923329 GCOLPMRWIZTCHW-BKUYFWCQSA-N 339.395 3.089 50 40 EGGB Cc1cccc(CNC(=O)NNC(=O)c2oc3ccccc3c2C)c1 32795231 QGROQPGMRHKQNU-UHFFFAOYSA-N 337.379 3.194 50 40 EGGB O=C(NCCI)c1ccc(Cl)c(Cl)c1 1621649 CTUFEZOFYNYLAA-UHFFFAOYSA-N 343.979 3.158 50 40 EGGB CC(C)N1CCC(=NNC(=O)c2ccccc2Br)CC1 55008640 KNKNRSVVWCGAIP-UHFFFAOYSA-N 338.249 3.039 50 40 EGGB CC(C)Oc1ccc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc1Cl 1462392 UYJQZVNKWIUZOU-UJMHRVFCSA-N 348.830 3.329 50 40 EGGB O=C(NN=C1CCCCCC1)C(=O)Nc1cccc(C(F)(F)F)c1 59515838 MHCPTVYUVVMUMY-UHFFFAOYSA-N 341.333 3.470 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)Nc2cccc3ncccc23)ccc1O 3264194 ZQSFYABSIFBWFG-GXDHUFHOSA-N 345.358 3.495 50 40 EGGB CCOC(=O)[C@H]1C(O)=NC(SC)=C(C#N)[C@@H]1c1ccccc1OC 9088753 LAIJDBBITHATCX-UONOGXRCSA-N 346.408 3.026 50 40 EGGB COc1ccc(N2C=C(C#N)S(=O)(=O)c3ccc(F)cc32)c(C)c1 38654539 OWAKZYNHQTWHEH-UHFFFAOYSA-N 344.367 3.433 50 40 EGGB COc1ccc(OC)c(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccc2)c1 192545487 NJHUPGBVAZPDCU-MPMPPSQCSA-N 336.391 3.488 50 40 EGGB COc1cc(/C=C(\C#N)c2nc3ccccc3[nH]2)ccc1OCCO 16196225 XXSGMOKVQYNOOM-GXDHUFHOSA-N 335.363 3.007 50 40 EGGB C/C(=N\OC(=O)NN=C1CC(C)(C)NC(C)(C)C1)c1ccccc1 5517058 SWFWXWJCSXBTSE-FYJGNVAPSA-N 330.432 3.433 50 40 EGGB Cc1ccc(S(=O)(=O)/C(C#N)=C\NCc2ccc(F)cc2F)cc1 35622966 GTQXCIPJENAICN-WJDWOHSUSA-N 348.374 3.202 50 40 EGGB Cc1ccc(CSCC(=O)N/N=C/c2ccccc2C(=O)O)cc1 20246272 BTJSXAMZTOQHGK-VXLYETTFSA-N 342.420 3.077 50 40 EGGB N#CCOc1ccccc1/C=C(\C#N)C(=O)Nc1cccc([N+](=O)[O-])c1 408794900 JNCAMMQGJGIOJK-GXDHUFHOSA-N 348.318 3.043 50 40 EGGB O=C(N/N=C\c1ccc([N+](=O)[O-])cc1)c1ccccc1C(F)(F)F 408772229 CULJAAIYKOOGAJ-OCKHKDLRSA-N 337.257 3.378 50 40 EGGB C/C(=N\NC(=O)c1cc([N+](=O)[O-])ccc1O)c1ccc(C)c(C)c1 409143629 GEMZUMMMXQLXOA-LDADJPATSA-N 327.340 3.071 50 40 EGGB CCN(CC)c1ccc(/C=N\NC(=O)Cc2ccc(F)cc2)cc1 36223926 AEAWUGGRSHWJIA-STZFKDTASA-N 327.403 3.365 50 40 EGGB COC(=O)c1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)cc1 15226192 ADPIUNYBXALQCA-KLZLZNSSSA-N 326.396 3.075 50 40 EGGB Cc1ccc(NNC(=O)COc2ccc([N+](=O)[O-])cc2)cc1Cl 12816373 LYWRIAJMCBGJPQ-UHFFFAOYSA-N 335.747 3.079 50 40 EGGB Cc1ccc(NCC(=O)N/N=C/C=C/c2ccccc2[N+](=O)[O-])cc1 4739467 PHYLYGXIXKWLMY-FKTOWYLZSA-N 338.367 3.131 50 40 EGGB N#Cc1ccc(/C=N/NC(=O)CNc2cccc3ccccc23)cc1 409392533 QEYOUICJRADPGM-YDZHTSKRSA-N 328.375 3.274 50 40 EGGB O=C(OCc1ccccc1)N1CCC[C@H]1CI 39159288 RKUASCJHUMQZEQ-LBPRGKRZSA-N 345.180 3.223 50 40 EGGB CCn1c(SCC(=O)N/N=C(/C)c2ccco2)nc2ccccc21 55583 NSNDOZRMVOHJHJ-UNOMPAQXSA-N 342.424 3.282 50 40 EGGB CC1(C)C(C#N)=C(SCc2cccc(F)c2F)NC(=O)[C@@H]1C#N 8543090 CMMWLZNDIWBRJF-JTQLQIEISA-N 333.363 3.229 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)COc2ccccc2)cc1 580626 HGRUKSFRORKZGF-XSFVSMFZSA-N 325.412 3.062 50 40 EGGB COc1cccc(NC(=O)/C(C#N)=C/c2ccc(OC)cc2OC)c1 16409805 UJZAFMUTDOZJPC-NTEUORMPSA-N 338.363 3.258 50 40 EGGB Cc1cc(Cl)ccc1O[C@H](C)C(=O)N/N=C/c1ccc(N(C)C)o1 2768072 OAPFUNDCQZJTBJ-AINDZBIGSA-N 349.818 3.225 50 40 EGGB O=C(CCCCBr)c1ccc(N2CCOCC2)cc1 575358658 LZBWDGBZWPRZNM-UHFFFAOYSA-N 326.234 3.271 50 40 EGGB COC(=O)CSC1=C(C#N)[C@H](c2ccc(C(C)C)cc2)CC(=O)N1 9089144 VOQXMAJPETWBBZ-AWEZNQCLSA-N 344.436 3.055 50 40 EGGB Cc1ccccc1/C=N/NC(=O)Cc1ccc(Br)cc1 4735261 IJVXMTFZOUSFGE-WOJGMQOQSA-N 331.213 3.450 50 40 EGGB CCCOc1ccc(C(=O)N/N=C/c2cc(OCC)ccc2O)cc1 20198132 CTSRQCFYGGRASQ-DEDYPNTBSA-N 342.395 3.344 50 40 EGGB COc1ccccc1OCC(=O)N/N=C\c1cccn1-c1ccccc1 408851316 XPEUOBGLCLYENN-STZFKDTASA-N 349.390 3.015 50 40 EGGB CC(C)(C)OC(=O)N1CCC[C@@H](CCI)C1 95085115 ZCEOHFLQAXHPEA-JTQLQIEISA-N 339.217 3.459 50 40 EGGB COc1ccc(CCCC(=O)N/N=C/c2ccc(O)cc2)c(C)c1 5960251 CQSRLUZNUJHLPV-DEDYPNTBSA-N 326.396 3.182 50 40 EGGB CC(C)(C)C(=O)NNC(=O)[C@@H]1CC1(c1ccccc1)c1ccccc1 501454 GOJQZMGZIHGDMV-KRWDZBQOSA-N 336.435 3.186 50 40 EGGB Cc1cccc(C)c1NCC(=O)N/N=C/c1cn(C)c2ccccc12 4077222 OSGIIZRDLYGZSY-SSDVNMTOSA-N 334.423 3.357 50 40 EGGB N#CC(C#N)=Cc1cccc(OCCOc2ccc([N+](=O)[O-])cc2)c1 4182042 UGLNMCXXRUMOIB-UHFFFAOYSA-N 335.319 3.483 50 40 EGGB CCOC(=O)NNC(=O)Cn1c(-c2ccccc2)cc2ccccc21 39984840 OZXATTNRXBXUNC-UHFFFAOYSA-N 337.379 3.086 50 40 EGGB C/C(=N\NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(OC(F)F)cc1 5782380 JOAULGXVEHIWMR-VXLYETTFSA-N 349.293 3.350 50 40 EGGB O=C(Cc1ccc2c(c1)OCO2)N/N=C/c1cccc2ccccc12 409150061 ZHSGTZJYRBWDQZ-CIAFOILYSA-N 332.359 3.261 50 40 EGGB CC(C)(C)c1ccc(C(=O)N/N=C/c2ccc([N+](=O)[O-])c(O)c2)cc1 36665013 JDRWJWAMBGTLCE-YBFXNURJSA-N 341.367 3.362 50 40 EGGB CC(C)c1ccc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc1 33768595 TVRCKHKAOODYJP-UNOMPAQXSA-N 325.368 3.411 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)CNc2ccc(F)cc2)cc1 487200 JFWLTYSKWNILMP-FYJGNVAPSA-N 329.375 3.177 50 40 EGGB CCOc1cc(/C=C(\C#N)C(N)=O)ccc1OCc1ccc(C)cc1 3254348 YYJNMWSJRCATFN-LICLKQGHSA-N 336.391 3.365 50 40 EGGB O=C(CSc1ccc(Cl)cc1)N/N=C/c1ccccc1C(=O)O 13352448 DXOYCIKMKYGAAL-GIJQJNRQSA-N 348.811 3.281 50 40 EGGB Cc1cc(Cl)ccc1O[C@H](C)C(=O)N/N=C/c1ccccc1O 243888 JKIVNUHKXOHSIA-AINDZBIGSA-N 332.787 3.272 50 40 EGGB CCOc1ccc([C@@H]2C(C#N)=C(N)Nc3oc(C)nc32)c(OCC)c1 125853 MUSYDJAEZUIXMA-OAHLLOKOSA-N 340.383 3.032 50 40 EGGB CC1(C)CC(=O)C=C(NNC(=O)CC23CC4CC(CC(C4)C2)C3)C1 95465968 ZNGGIGYGSXJZAQ-UHFFFAOYSA-N 330.472 3.487 50 40 EGGB CCCCC(=O)N/N=C(/C)c1ccc(NC(=O)C(F)(F)F)cc1 4646813 ONNXAZPRHBPWFM-JMIUGGIZSA-N 329.322 3.218 50 40 EGGB N#Cc1c(N)c2c(c(-c3ccccc3)c1-c1ccco1)C(=O)OC2=O 408974890 IANULKIEFGPJMQ-UHFFFAOYSA-N 330.299 3.378 50 40 EGGB O=C(CCCC[C@@H]1CCSS1)N1CC(Oc2cccnc2)C1 238866360 LWAMRBZMJWWUNX-OAHLLOKOSA-N 338.498 3.385 50 40 EGGB C=CCc1ccccc1OCC(=O)N/N=C/c1c[nH]c2ccccc12 64224 HNDBQWFUFSXFIJ-LPYMAVHISA-N 333.391 3.426 50 40 EGGB CN1CCN(c2ccccc2/C=C(\C#N)c2nc3ccccc3[nH]2)CC1 26841684 SRBRMXGHHHZOMG-SAPNQHFASA-N 343.434 3.379 50 40 EGGB CC(C)(C)OC(=O)N[C@@H](CCBr)C(=O)OC(C)(C)C 36056184 KAHXNHVFTFWYDP-VIFPVBQESA-N 338.242 3.006 50 40 EGGB O=C(CSc1nc2ccccc2o1)N/N=C/C=C/c1ccco1 2194315 JVYSCIKVYPLEGA-AHEHSYJASA-N 327.365 3.328 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc(C)c(C)c2)cc1OC 408587464 GCIRQAOHKLEGSH-RCCKNPSSSA-N 340.423 3.404 50 40 EGGB Cc1ccc(/C=N/NC(=O)CNc2cccc3ccccc23)c(O)c1 60539 KIXZEJKXBSBDQJ-WSDLNYQXSA-N 333.391 3.416 50 40 EGGB CC1(C)[C@H]2CC[C@]1(C)/C(=N/NC(=O)COc1ccc([N+](=O)[O-])cc1)C2 102446661 CHVGAIWSASKAGW-HPCBPRIFSA-N 345.399 3.292 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)Cc2cccs2)c(OC)c1 6629975 CVNRIFJQSOITJX-CPNJWEJPSA-N 345.468 3.296 50 40 EGGB O=C(Cl)c1cc(C(=O)Cl)c(C(=O)Cl)cc1C(=O)Cl 100350683 FNGBYWBFWZVPPV-UHFFFAOYSA-N 327.934 3.203 50 40 EGGB O=C(NN=C(c1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])o1 65567115 BWZLQEVWMRAQQB-UHFFFAOYSA-N 335.319 3.370 50 40 EGGB CCCCn1c2ccccc2n2c(C(=O)NN)c(-c3ccccc3)nc12 8469207 MKOCHLOURLLWBM-UHFFFAOYSA-N 347.422 3.360 50 40 EGGB Cc1nc2sccn2c1C(=O)N/N=C\c1c(F)cccc1Cl 408896274 XFPXOVXLXRREBB-IDUWFGFVSA-N 336.779 3.261 50 40 EGGB CCOc1ccc(/C=N\NC(=O)Cc2cc(C)ccc2C)cc1OC 409366611 XBGVMRBITHOHBJ-BKUYFWCQSA-N 340.423 3.404 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)Cc2ccc(C)c(C)c2)c(OC)c1 409178010 FWLHVOPAWLJRJI-RCCKNPSSSA-N 340.423 3.404 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C/c2cc(C(=O)O)ccc2C)cc1 566305 YYCKGODTPUFSFF-XNTDXEJSSA-N 336.347 3.248 50 40 EGGB N#C/C(=C\c1cc(F)ccc1F)C(=O)Nc1ccc2c(c1)OCCO2 40139709 BVUBQMCQLSJBDI-KPKJPENVSA-N 342.301 3.282 50 40 EGGB COc1ccc(C(=O)N/N=C/c2c(C)[nH]c3ccccc23)c(OC)c1 6825057 FRQIGBOKGXLJLT-RGVLZGJSSA-N 337.379 3.257 50 40 EGGB O=C(CN1Cc2ccccc2C1)N/N=C/c1ccc(Cl)c(Cl)c1 409204815 JTXVHQWNROKYKE-DNTJNYDQSA-N 348.233 3.459 50 40 EGGB CC(C)(C)OC(=O)NN[C@@H](c1ccc(Cl)cc1)C1CCNCC1 228967167 BLOJTTCNWQSTQR-HNNXBMFYSA-N 339.867 3.410 50 40 EGGB COc1ccc(CC(=O)N/N=C/c2cccc(Br)c2)cc1 5513674 LOLNVXWNGXJTIA-WOJGMQOQSA-N 347.212 3.151 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccccc2Br)cc1 253387 GMJVSDLUEHREAZ-LICLKQGHSA-N 333.185 3.222 50 40 EGGB COc1ccccc1NC(=O)/C(C#N)=C/c1ccc(OC(C)=O)cc1 6822206 OOMJXMZYBRUMNM-RVDMUPIBSA-N 336.347 3.166 50 40 EGGB C#CCn1c(C)c(/C=N/NC(=O)c2ccc(F)cc2)c2ccccc21 8812186 GMOZKCOPCUMONN-LPYMAVHISA-N 333.366 3.486 50 40 EGGB N#C/C(=C/c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc([N+](=O)[O-])c1 108210502 RQJXSSBTGOALOZ-GHXNOFRVSA-N 338.279 3.049 50 40 EGGB O=C(N/N=C/c1ccc(N2CCOCC2)o1)c1cccc2ccccc12 409009589 GNVVRVGMOSQKAM-KGENOOAVSA-N 349.390 3.033 50 40 EGGB CCOc1cccc(/C=C(/C#N)C(=O)Nc2ccc(OC)cc2)c1O 223165093 HHPRVRIXBGKVGT-KAMYIIQDSA-N 338.363 3.345 50 40 EGGB COC(=O)CCn1nc(C)c(/C=C(\C#N)c2nc3ccccc3[nH]2)c1C 96257423 WCZJLJQTGPSJEB-GXDHUFHOSA-N 349.394 3.004 50 40 EGGB Cc1ccccc1NC(=O)NNC(=O)c1cc2ccccc2cc1O 20418855 WEONHQUFYRYMQM-UHFFFAOYSA-N 335.363 3.320 50 40 EGGB CCOc1cccc(NC(=O)/C(C#N)=C/c2ccc(C(=O)O)cc2)c1 6499774 FNMKCUMKRDGCDN-XNTDXEJSSA-N 336.347 3.329 50 40 EGGB CC(=O)n1cc(/C=N/NC(=O)c2sc(C)nc2C)c2ccccc21 3219081 SENCRTQZPSCASX-QGMBQPNBSA-N 340.408 3.139 50 40 EGGB C=CCOc1cccc(/C=N/NC(=O)Cc2ccc(OCC)cc2)c1 10475902 UFCNMPHKEJTWHY-RCCKNPSSSA-N 338.407 3.343 50 40 EGGB Cc1nn(Cc2ccccc2)c(C)c1/C=N/NC(=O)c1ccccc1O 2430012 WEUHPHFRRFPPON-CIAFOILYSA-N 348.406 3.018 50 40 EGGB CCOc1ccc(/C=N/NC(=O)CSCc2ccccc2)cc1 20248184 QORFUQIZRVTFOX-XDHOZWIPSA-N 328.437 3.469 50 40 EGGB C[C@]12[C@@H](Br)[C@@H]3[C@@H]4C[C@H]5[C@@H]([C@@H]41)[C@](O)(c1ccccc1)[C@H]2[C@@H]53 195528698 SZCGKEUXKLALMI-AVJJKLIVSA-N 331.253 3.416 50 40 EGGB NNC(=O)/C=C/c1ccc(OCc2ccc(Br)cc2)cc1 226332775 UZERRZQTLSRJDF-BJMVGYQFSA-N 347.212 3.031 50 40 EGGB CC(C)(C)OC(=O)N[C@H]1CC[C@H](N(C(=O)CCl)C2CC2)CC1 252517158 BCQCPAUHWOHKTO-HAQNSBGRSA-N 330.856 3.052 50 40 EGGB CCOc1ccc(N[C@@H](CC)C(=O)N/N=C/c2ccc(O)cc2)cc1 370276 XDORCZRYXWMATO-ACRNLXFHSA-N 341.411 3.132 50 40 EGGB CC(=O)Nc1ccc(/C=N/NC(=O)c2ccccc2-n2cccc2)cc1 3226496 XDPBWMZFRVSNPY-KGENOOAVSA-N 346.390 3.200 50 40 EGGB COc1ccc(F)c([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c1 4454726 MVXWYIIUNPMPIT-INIZCTEOSA-N 342.370 3.285 50 40 EGGB CCCCc1ccc(CC(=O)NNC(=O)c2ccc(OC)cc2)cc1 16510052 PFLWOLSAWRAOLC-UHFFFAOYSA-N 340.423 3.042 50 40 EGGB O=C(N/N=C/c1cccc(Cl)c1)c1ccc(Br)o1 525116 HKERUNLSGBJZPX-VIZOYTHASA-N 327.565 3.459 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)cc1OC 7158002 PAQUYLBHAIVTAD-INLZJBIESA-N 328.412 3.306 50 40 EGGB Cc1ccc(NC(=O)/C(C#N)=C/c2ccc(OCC(=O)O)cc2)cc1 6209532 XRTVZEOEXQSCST-XNTDXEJSSA-N 336.347 3.004 50 40 EGGB COc1cccc(CC(=O)N/N=C/c2cccn2-c2ccccc2)c1 573121 PNDZKIKLEGYAAS-RCCKNPSSSA-N 333.391 3.179 50 40 EGGB COc1cccc(/C=N/NC(=O)c2ccccc2Br)c1 3251337 IARZBLBEGDZESU-LICLKQGHSA-N 333.185 3.222 50 40 EGGB O=C(CCSc1ccccc1)N/N=C/c1ccccc1C(=O)O 20246313 ROVNHUIDJUWDIP-LDADJPATSA-N 328.393 3.017 50 40 EGGB CCCCOc1ccc(/C=N/NC(=O)c2ccncc2)cc1OCC 2759645 CSSYIRGPPMSPJJ-KGENOOAVSA-N 341.411 3.423 50 40 EGGB CCc1cccc2c(/C=N/NC(=O)[C@@H]3COc4ccccc4O3)c[nH]c12 3609462 MHKDUBAQLNTMFM-QPHXDFOYSA-N 349.390 3.020 50 40 EGGB COc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccc(C)cc1)OCO2 409104038 IGGANOUDLSJOAF-VGOFMYFVSA-N 336.347 3.278 50 40 EGGB Cc1ccc(C(=O)O)cc1-c1ccc(/C=N\NC(=O)c2ccncc2)o1 4524315 GOSCJQYACKFHHG-NHDPSOOVSA-N 349.346 3.112 50 40 EGGB Cn1cc([C@H]2C[C@@H]2C(=O)NN(Cc2ccccc2)c2ccccc2)cn1 68237381 MHZOEFGKLVGQHP-UXHICEINSA-N 346.434 3.262 50 40 EGGB O=C(CBr)c1cc(Cl)c(Br)cc1O 575432192 NSHPYUGOFWZFHY-UHFFFAOYSA-N 328.387 3.386 50 40 EGGB CN(C)/N=C(/SS/C(=N/N(C)C)C(F)(F)F)C(F)(F)F 1702714 TYPYVVAKBZVSBB-IAGONARPSA-N 342.334 3.243 50 40 EGGB Cc1ccccc1NC(=O)N/N=C\c1ccc(O[C@H](C)C(=O)O)cc1 208350749 AVLMJLUIONKRKX-LPXFMOJISA-N 341.367 3.003 50 40 EGGB CC(=C/c1ccccc1)/C=N/NC(=O)CSc1nc(C)cc(C)n1 13496672 XJVDIZQVCKOAJP-FKDPSPLQSA-N 340.452 3.391 50 40 EGGB O=C(N/N=C\c1ccc(Br)s1)C1[C@H]2CCCC[C@H]12 100050591 NQPYXXXQMQQTEN-XUDHKLPYSA-N 327.247 3.397 50 40 EGGB COc1ccc([C@@H]2C(C#N)=C(N)N3C(=C2C#N)Nc2ccccc23)cc1 493939 VOANLWNNBSSQGH-GOSISDBHSA-N 341.374 3.154 50 40 EGGB Cc1ccc(C)c(OCC(=O)N/N=C/c2cccc(C)c2O)c1C 3033719 HNCBZOPAKJJJJW-KEBDBYFISA-N 326.396 3.155 50 40 EGGB CC(C)(C)OC(=O)N/N=C/c1ccccc1I 3255137 GVLQYTYJWWIFSK-RIYZIHGNSA-N 346.168 3.150 50 40 EGGB Cc1ccc(-c2ccc(/C=C(/C#N)C(=O)N(C)C)o2)cc1[N+](=O)[O-] 59334585 GOTNPQGBSPNGFL-JYRVWZFOSA-N 325.324 3.158 50 40 EGGB C/C(=N\NC(=O)CSCc1ccc(C#N)cc1)c1ccccc1O 408721512 IVQIROAJWCKBHK-DEDYPNTBSA-N 339.420 3.037 50 40 EGGB Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=C(\C#N)C(=O)NC2CC2)o1 409198362 DRBSYTDTPUWEOL-XYOKQWHBSA-N 337.335 3.349 50 40 EGGB CCOC(=O)Oc1ccc(/C=C(\C#N)C(=O)N[C@H](C)CC)cc1OC 408803689 SDUZABPYAORRFY-ZMTLZGASSA-N 346.383 3.052 50 40 EGGB O=C(N/N=C\c1ccc(O)c(O)c1)c1cc2cc(Cl)ccc2o1 409021424 GORSXOOIHKKWTJ-LSCVHKIXSA-N 330.727 3.261 50 40 EGGB CO[C@H]1CCCN(C(=O)/C(C#N)=C/C(C)C)[C@H]1Cc1ccccc1 585289808 NYTNHGAICBEGRK-JQTTXECVSA-N 326.440 3.341 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)c2ccccc2OC)cc1 381394 VQYITAWYDYOUOY-XSFVSMFZSA-N 325.412 3.305 50 40 EGGB COc1cccc(NC(=O)[C@H](Cl)C(=O)c2ccc([N+](=O)[O-])cc2)c1 8494724 TXCBTIRCQWTUKW-CQSZACIVSA-N 348.742 3.032 50 40 EGGB CN(C)C(=O)/C(C#N)=C/c1ccc(-c2ccc(Cl)c(C(=O)O)c2)o1 59333552 DMTQBJQGBGQYFS-YRNVUSSQSA-N 344.754 3.293 50 40 EGGB CC(C)(C)OC(=O)[C@@]12CC[C@](CBr)(C(=O)C1)C2(C)C 103707850 IKCSFVXVONKHOK-CABCVRRESA-N 331.250 3.489 50 40 EGGB NC(=O)N/N=C(\c1ccccc1)c1ncc(C(F)(F)F)cc1Cl 5515149 HCMZEAIMLAJJPB-SRZZPIQSSA-N 342.708 3.175 50 40 EGGB CCCOc1ccc(C(=O)N/N=C/c2ccc(OC)cc2OC)cc1 20197514 FYFIQMOYPMSKBA-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)COc2ccccc2C)cc1 408782934 IWQTYGMJFZFHPJ-HMMYKYKNSA-N 326.396 3.313 50 40 EGGB C=CCc1cccc(/C=N/NC(=O)CCc2ccc(OC)cc2)c1O 3096800 NQPSUEWLRAYFNH-KGENOOAVSA-N 338.407 3.212 50 40 EGGB C#CCOc1ccc(/C=N/NC(=O)c2ccccc2C)cc1OCC 6959576 JDDKEMUIVQAIHH-KGENOOAVSA-N 336.391 3.170 50 40 EGGB O=C(N/N=C/c1coc2ccccc2c1=O)c1ccc(Cl)cc1 15934294 JQBBHOFNHIBNIZ-DJKKODMXSA-N 326.739 3.210 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)c2ccc(Br)o2)cc1 17070823 AKUFGHQVOMTVHK-CXUHLZMHSA-N 337.173 3.205 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)c2ccc(C#N)cc2F)cc1 408964640 DAEJSRGBBVMMDO-LPYMAVHISA-N 338.386 3.307 50 40 EGGB CCOc1cccc(NC(=O)/C(C#N)=C/c2ccc(O)c(OC)c2)c1 445951 LMCZWVUSOYPMJA-NTEUORMPSA-N 338.363 3.345 50 40 EGGB C/C(=N\NC(=O)c1ccc2c(c1)OCO2)c1ccccc1OC(F)F 6051729 LKQXTIUNGJAPMP-KEBDBYFISA-N 348.305 3.171 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)Nc2ccccc2OC)ccc1O 6614247 YLAYWJCMHVCLLI-GXDHUFHOSA-N 338.363 3.345 50 40 EGGB CCOC(=O)c1ccccc1NC(C#N)=C1C(=O)c2ccccc2C1=O 1238631 MYTJUDRIPSMYNK-UHFFFAOYSA-N 346.342 3.132 50 40 EGGB CCOC(=O)/C(C#N)=C1/S[C@@H](CC)C(=O)N1c1ccc(C)cc1 2329355 DTQPZMQMENZSNJ-BXWAGETQSA-N 330.409 3.152 50 40 EGGB O=C(O)[C@@H](CCCCl)P(=O)(c1ccccc1)c1ccccc1 2309983 CDMHMQKREXVPPN-MRXNPFEDSA-N 336.755 3.473 50 40 EGGB O=C(CCCC1CCCCC1)NNC(=O)c1ccc([N+](=O)[O-])cc1 3506494 GDTXSRJIUCFRSX-UHFFFAOYSA-N 333.388 3.106 50 40 EGGB N#CCOc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1 5740166 ZECDAPIMGSRHBO-LPYMAVHISA-N 345.358 3.212 50 40 EGGB COc1ccccc1COC(=O)/C(C#N)=C\c1ccc(N(C)C)cc1 96892667 IQHFNRXQCIYGKI-ATVHPVEESA-N 336.391 3.412 50 40 EGGB CCc1ccc(/C(C)=N/NC(=O)c2cc([N+](=O)[O-])ccc2OC)cc1 408586422 BVILQYXPHCIKJO-XDHOZWIPSA-N 341.367 3.320 50 40 EGGB O=C(NNC(=S)Nc1ccc(C(F)(F)F)cc1)c1ccccc1 17071077 QRFRATQUHRNNPM-UHFFFAOYSA-N 339.342 3.337 50 40 EGGB Cc1ccc(/C=N/NC(=O)CNc2ccc3ccccc3c2)c(O)c1 50600 QEZJYCJDNMGGLA-WSDLNYQXSA-N 333.391 3.416 50 40 EGGB CCOc1cc(/C=N/NC(C)=O)ccc1OCc1cccc(C)c1 409015119 YRRHLURCMLJHPP-UDWIEESQSA-N 326.396 3.443 50 40 EGGB CN(C)C(=O)/C(C#N)=C\c1cccn1-c1ccc(Br)cc1 408853466 UAVVDLPTZXQSBC-BENRWUELSA-N 344.212 3.235 50 40 EGGB CCCOc1ccc(C(=O)N/N=C(\C)c2ccc(OC)cc2O)cc1 216067997 WTKAAVUGWRFICI-DEDYPNTBSA-N 342.395 3.344 50 40 EGGB CC(C)N(C(=O)OC(C)(C)C)[C@H]1CCCC[C@@H]1NC(=O)CCl 79408894 JLKNZCQOVZICNM-STQMWFEESA-N 332.872 3.298 50 40 EGGB COc1ccc(C(=O)N/N=C\c2c(C)nn(-c3ccccc3)c2C)cc1 35606780 FCPPXJXJZIFRCO-BKUYFWCQSA-N 348.406 3.262 50 40 EGGB O=C(N/N=C\c1ccc(Br)o1)c1ccccc1Cl 96836428 LRLAWCNXTWYADX-CHHVJCJISA-N 327.565 3.459 50 40 EGGB CC(C)c1ccc(OCC(=O)N/N=C/c2ccccc2[N+](=O)[O-])cc1 580229 YAOSTJOIMUMCSG-YBFXNURJSA-N 341.367 3.247 50 40 EGGB CCOC(=O)[C@@H](/C(C)=N/NC(=O)[C@H]1C[C@@H]1c1ccccc1)C(C)C 4587774 CHCWYMNYPFSZEB-CWFPGYMASA-N 330.428 3.118 50 40 EGGB O=C(NCCC(c1ccccc1)c1ccccc1)NNc1cnccn1 40070110 NNWRWDXTBRAMQA-UHFFFAOYSA-N 347.422 3.325 50 40 EGGB CC(C)CC(=O)NNC(=O)c1cccc2c3c([nH]c12)CCCCC3 30602905 GXQWIFKVSIZDPJ-UHFFFAOYSA-N 327.428 3.244 50 40 EGGB O=C(CCc1ccccc1)N/N=C/c1cc([N+](=O)[O-])ccc1Cl 2131620 GEWHKHJINBWVSN-WOJGMQOQSA-N 331.759 3.331 50 40 EGGB COc1ccc(-n2cccc2/C=N/NC(=O)c2cccc(F)c2)cc1 408955762 ZBFIZRUAHFFEMH-FYJGNVAPSA-N 337.354 3.389 50 40 EGGB O=C(COc1cccc2cccnc12)N/N=C/c1cccc(Cl)c1 408752578 BYQSHRRUCLFWOX-SRZZPIQSSA-N 339.782 3.417 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@@H]1Cc1ccccc1 16478908 KECFZEYHTDRLMI-OAHLLOKOSA-N 328.375 3.489 50 40 EGGB C#CCOc1ccc(/C=N/NC(=O)c2ccc(C)cc2Cl)cc1 409053844 RAAGEHZNIOOJFG-UDWIEESQSA-N 326.783 3.424 50 40 EGGB COc1cccc(/C=N\NC(=O)c2cccc(C(F)(F)F)c2)c1O 408962851 KHBZHGLJKFMJEV-UKWGHVSLSA-N 338.285 3.184 50 40 EGGB COc1cccc(C(=O)NNC(=O)Nc2cccc3ccccc23)c1 5918577 FHRYYKRFGVXNMG-UHFFFAOYSA-N 335.363 3.315 50 40 EGGB Cc1ccc(C)c(OCC(=O)NNC(=O)C[C@@H](C)c2ccccc2)c1 8852954 YRRRXEKUIXTPPX-MRXNPFEDSA-N 340.423 3.023 50 40 EGGB C=CCOc1c(CC=C)cc(/C=C(/C#N)C(=O)NC(C)C)cc1OC 408779214 BUSXNSHNWBWDLU-BOPFTXTBSA-N 340.423 3.420 50 40 EGGB CCOc1ccc(/C(C)=N\NC(=O)c2ccc(C)cc2)cc1[N+](=O)[O-] 195752246 RJWOFHPQRRGDLM-UYRXBGFRSA-N 341.367 3.456 50 40 EGGB O=C(Cl)OC[C@@H]1c2ccccc2-c2ccc(S(=O)(=O)O)cc21 5493875 RDNRMPYXJPJOLS-CQSZACIVSA-N 338.768 3.421 50 40 EGGB Cc1cc(N(CCCl)CCCl)ccc1/C=N/C(C)(C)CO 1674395 DXXXXIKWSFPEEU-YBFXNURJSA-N 331.287 3.469 50 40 EGGB CCOC(=O)c1ccc(NC(C#N)=C2C(=O)c3ccccc3C2=O)cc1 149272 JZCUPMHTAVSKJV-UHFFFAOYSA-N 346.342 3.132 50 40 EGGB C[C@H](SCc1ccccc1)C(=O)N/N=C/c1ccc2c(c1)OCO2 313765 FXADSQLHWMYJFX-UZPSYVQNSA-N 342.420 3.187 50 40 EGGB O=C(CCCOc1ccc(Cl)cc1Cl)NNC(=O)C1CCC1 3317209 STUVJOFEKZROQD-UHFFFAOYSA-N 345.226 3.100 50 40 EGGB C=CCOc1ccc(C(=O)N/N=C/c2cc(Cl)ccc2O)cc1 2756928 MFSPMXPTKXWTIO-YBFXNURJSA-N 330.771 3.374 50 40 EGGB CC(C)CSC1=C(C#N)[C@H](c2ccc3c(c2)OCO3)CC(=O)N1 9110073 ZOCKCFQDCMOABT-LBPRGKRZSA-N 330.409 3.143 50 40 EGGB COc1cc(C=C(C#N)C#N)ccc1OCc1cccc(C(=O)O)c1 408814858 HXFUDKXKGIQQDR-UHFFFAOYSA-N 334.331 3.403 50 40 EGGB CC(=O)N/N=C/c1c(C)n(Cc2ccccc2C#N)c2ccccc12 409018970 ZRICSIHRPNOCJV-WSDLNYQXSA-N 330.391 3.340 50 40 EGGB N#C/C(=C\c1ccc(Br)cc1)C(=O)NCc1ccco1 1090966 ZLVYTVXJUSIRPD-XYOKQWHBSA-N 331.169 3.265 50 40 EGGB CCOC(=O)/C(C#N)=C\c1ccc(-c2cccc(C(=O)OC)c2)o1 4905289 ROYFMJDXZFMIKW-UVTDQMKNSA-N 325.320 3.203 50 40 EGGB CCC[C@H](Br)C(=O)NCCC(=O)Nc1ccc(C)cc1 8733087 FGFSZYMNUVZQDO-ZDUSSCGKSA-N 341.249 3.003 50 40 EGGB CO[C@@H](C(=O)N/N=C/c1c(O)ccc2ccccc12)c1ccccc1 59366781 GQVJJPAYDSEIMX-DBRLUCFCSA-N 334.375 3.383 50 40 EGGB O=C(CSc1ccc(F)cc1)NNC(=O)c1ccc(Cl)cc1 2618697 FOFLZWUMBXEITG-UHFFFAOYSA-N 338.791 3.032 50 40 EGGB CCCC[C@H](Br)C(=O)Nc1ccc2c(c1)OCCO2 5298537 IYXOIQQMTOHIGC-NSHDSACASA-N 328.206 3.350 50 40 EGGB Cc1cc(C(=O)N/N=C/c2ccccc2C(=O)O)c2ccccc2n1 13352264 FRHNAQHMPMZBTE-RGVLZGJSSA-N 333.347 3.005 50 40 EGGB Cc1nn(-c2ccccc2)c2c1[C@H](c1cccs1)C(C#N)=C(N)O2 495443 GXBJEUPMVNNELF-INIZCTEOSA-N 334.404 3.460 50 40 EGGB CCN(CC)c1ccc(C(=O)N/N=C(\C)c2ccc(O)cc2)cc1 5119569 HFECGJUKVOVOJL-XSFVSMFZSA-N 325.412 3.392 50 40 EGGB CCOC(=O)c1sc(-c2cccnc2)nc1CBr 95936117 NYHKYZCOMICSGN-UHFFFAOYSA-N 327.203 3.277 50 40 EGGB CCOC(=O)/C(C#N)=C\c1ccc(-c2cc([N+](=O)[O-])ccc2F)o1 252485591 GZNFSOHGQUBRSO-YFHOEESVSA-N 330.271 3.464 50 40 EGGB Cc1ccc(NC(=O)CCC(=O)N/N=C/c2ccccc2C)c(C)c1 6189656 HCVADLXSILHMMZ-FYJGNVAPSA-N 337.423 3.481 50 40 EGGB O=C(NNC(=O)c1ccc(-c2ccc(F)cc2)s1)c1ccncc1 10735516 SGXKHNXBTGGYKM-UHFFFAOYSA-N 341.367 3.024 50 40 EGGB COc1cc([C@H]2C(C#N)=C(N)Oc3c2ccc2[nH]ccc32)ccc1O 79475576 JCHZGXYNKFGNBP-QGZVFWFLSA-N 333.347 3.100 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2)ccc1OC(C)=O 59116730 LUGOHZQJQNZATJ-GDNBJRDFSA-N 336.347 3.166 50 40 EGGB O=C(CSc1ccc(Cl)cc1)NNC(=O)NC1CCCCC1 2534511 RLMLCJVEEUIOBO-UHFFFAOYSA-N 341.864 3.095 50 40 EGGB Cc1nn(-c2ccccc2)c(C)c1/C=N\NC(=O)Cc1ccccc1 38330708 OAYWTJRMEUGERV-STZFKDTASA-N 332.407 3.182 50 40 EGGB CC(C)N1C(=O)/C(=C(\C#N)C(=O)NCc2ccccc2)c2ccccc21 197574682 ZMHNDLGQIQYTCD-HTXNQAPBSA-N 345.402 3.035 50 40 EGGB N#C/C(=C/c1ccc(C#N)cc1)C(=O)NCCc1c[nH]c2ccccc12 4851153 MKHSVZOZFWRXBA-WQRHYEAKSA-N 340.386 3.305 50 40 EGGB CC(C)(C)c1ccc(O)c(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c1 32047 DTQLWHKUGOLQPR-YBFXNURJSA-N 341.367 3.362 50 40 EGGB O=C(N/N=C/C#Cc1ccccc1)c1ccc(Br)cc1 3155509 VREJEGMXICQIBL-LDADJPATSA-N 327.181 3.216 50 40 EGGB Cc1cc(OCC(=O)N/N=C/c2cccc(C)c2O)ccc1Cl 5548806 GZGNYFFGPVSJAV-DJKKODMXSA-N 332.787 3.192 50 40 EGGB COc1ccc(C(=O)N/N=C/c2ccc(OC(C)C)c(OC)c2)cc1 5633333 HCXGCFPRVBGPBW-UDWIEESQSA-N 342.395 3.255 50 40 EGGB C/C(=N\NC(=O)c1ccncc1)c1cccc(NC(=O)C(C)(C)C)c1 17070996 CFFQQYSQEGLKQQ-LPYMAVHISA-N 338.411 3.220 50 40 EGGB CCOc1cccc2sc(NNC(=O)c3ccc(OC)cc3)nc12 246131 LDBDUTWPGPAOCD-UHFFFAOYSA-N 343.408 3.461 50 40 EGGB C/C(CC(=O)Nc1cc(C)ccn1)=N\NC(=O)c1ccccc1Cl 4697906 QRJOMBBFLJDXGY-CIAFOILYSA-N 344.802 3.178 50 40 EGGB C[C@@H]1CCC[C@H](NC(=O)COC(=O)/C(C#N)=C\c2ccccc2)[C@@H]1C 6794996 ZQMCPBJDTVYHKU-YCFWZHODSA-N 340.423 3.078 50 40 EGGB CCCOc1ccc(/C=C(/C#N)C(N)=S)cc1Br 408543510 POMDHUMOGRRYPI-POHAHGRESA-N 325.231 3.431 50 40 EGGB COC(=O)c1c(F)cc(Br)cc1CBr 299890165 VENBTJVAHMHJJX-UHFFFAOYSA-N 325.959 3.270 50 40 EGGB COc1ccc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)cc1 12843972 NGDRDPPSZWFSKX-RGVLZGJSSA-N 326.396 3.150 50 40 EGGB C#CCOc1ccc2ccccc2c1/C=N/NC(=O)c1cccnc1 6292451 JJQFXWPPBPIZKK-HYARGMPZSA-N 329.359 3.011 50 40 EGGB N#CC(C#N)=Cc1cn(CCC(=O)O)nc1-c1cccc(Cl)c1 804869 VUBKCSKLIGXUMR-UHFFFAOYSA-N 326.743 3.109 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)c2ccncc2)cc1OCC 7892857 ZPNYKGYGRGQSBR-DEDYPNTBSA-N 327.384 3.033 50 40 EGGB CCOC(=O)c1ccccc1N/C=C(\C#N)C(=O)Nc1ccccc1 57413970 MOPWWWBSKRABPN-BUHFOSPRSA-N 335.363 3.321 50 40 EGGB CN(NC(=O)COc1ccc(Cl)c2cccnc12)c1ccccc1 48342563 KJXYPKRPQRXGER-UHFFFAOYSA-N 341.798 3.435 50 40 EGGB Cc1ccc(Cn2cc(/C=N/NC(=O)CC#N)c3ccccc32)cc1 4739380 GGEJVJZSWIUQNC-WSDLNYQXSA-N 330.391 3.362 50 40 EGGB COc1ccc(/C=N/NC(=O)c2cc(Cl)cc(Cl)c2O)cc1 4705053 IICLTNOYGSBWNA-QGMBQPNBSA-N 339.178 3.472 50 40 EGGB N#CCOc1ccccc1/C=C(\C#N)C(=O)c1ccc2c(c1)OCO2 44028694 VCAPJPXKAPLKGJ-OQLLNIDSSA-N 332.315 3.108 50 40 EGGB Cc1ccc(S(=O)(=O)OC[C@H](Br)C(F)(F)F)cc1 1083812532 PDOYUYFFZRAZDL-VIFPVBQESA-N 347.152 3.026 50 40 EGGB C[C@@H](SCc1ccccc1)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 5370481 BDZYQRXXSHWLFY-VBEHJTROSA-N 343.408 3.367 50 40 EGGB CCOC(=O)c1ccc(/C=N/NC(=O)/C=C/c2ccc(C)cc2)cc1 9095702 WZGGSVKCSXMILP-XFSMVHDFSA-N 336.391 3.335 50 40 EGGB COc1cc(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)ccc1O 313814 FABYGPDKXVGULB-MBNTZHJCSA-N 330.409 3.032 50 40 EGGB COc1cccc(/C=N/NC(=O)COc2c(C)ccc(C)c2C)c1 12844067 HZCZSSQWPSWGOV-RGVLZGJSSA-N 326.396 3.150 50 40 EGGB C/C(=N\NC(=O)[C@H](O)c1ccccc1)c1ccc(Br)cc1 5288709 DIRCDVYWZCHSQU-CLXYIWAZSA-N 347.212 3.023 50 40 EGGB CC(C)(C)OC(=O)NC1CCC(N(C(=O)CCl)C2CC2)CC1 79392597 BCQCPAUHWOHKTO-UHFFFAOYSA-N 330.856 3.052 50 40 EGGB CN(C)c1ccc(C(=O)N/N=C/c2ccc3ccccc3c2O)cc1 370008 SXZSLZWMDYSWNR-FYJGNVAPSA-N 333.391 3.375 50 40 EGGB C/C(CC(=O)Nc1ccc(F)cc1)=N\NC(=O)CCc1ccccc1 5288140 OKVKBPGOSWLHPC-HYARGMPZSA-N 341.386 3.279 50 40 EGGB CCOC(=O)[C@]1(C#N)C(=O)C(C#N)=C2CCCC[C@H]2[C@@H]1c1ccccc1 28091 JPWFTLNBFYFNII-MMOPVJDHSA-N 348.402 3.436 50 40 EGGB CC[C@H](Nc1ccc(C)cc1C)C(=O)N/N=C/c1ccc(O)cc1 370660 POCPDLQGNPIOKW-RONKMWSCSA-N 325.412 3.350 50 40 EGGB O=C(/C=C/c1cccs1)NNC(=O)Cc1cccc2ccccc12 511693 AMCRHRGKCPPXFG-ZHACJKMWSA-N 336.416 3.305 50 40 EGGB CCn1nc(C)c(/C=N/NC(=O)NC23CC4CC(CC(C4)C2)C3)c1C 4897867 GBYRUGAVSRKEJW-RGVLZGJSSA-N 343.475 3.122 50 40 EGGB Cc1ccc(S[C@H](C)C(=O)N/N=C/c2ccc(C(=O)O)cc2)cc1 409135010 PIADOPYXLIZGAM-OTGIAGGSSA-N 342.420 3.324 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc1C 408540826 BYGRLMGLODVTHE-DHDCSXOGSA-N 336.347 3.248 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)NC2CC2)cc1OCc1ccccc1 7164009 ICLUXUCGZHTAGX-GZTJUZNOSA-N 348.402 3.460 50 40 EGGB NNC(=O)c1sc2ccc(C(F)(F)F)cc2c1-n1cccc1 44676335 YAGZUTBHGDOZJO-UHFFFAOYSA-N 325.315 3.314 50 40 EGGB CCOC(=O)c1c(NC(=O)CC)sc2c1CCC(C=O)=C2Cl 365809 PXQNQZWXQMUWPM-UHFFFAOYSA-N 341.816 3.368 50 40 EGGB COc1cc(OC)c(OC)cc1/C=C(\C#N)C(=O)NC1CCCCC1 5130691 CIDSOMXTGUCZPY-NTEUORMPSA-N 344.411 3.068 50 40 EGGB Cn1cc([C@@H]2C[C@@H]2C(=O)NN=C(c2ccccc2)c2ccccc2)cn1 66042343 RKKCMJFRLGYEEI-OALUTQOASA-N 344.418 3.092 50 40 EGGB C#CCOc1cc(OC)ccc1/C=C(\C#N)C(=O)Nc1ccccc1 408818562 VZWMMMPMLUWRBF-FOWTUZBSSA-N 332.359 3.253 50 40 EGGB O=C(NNc1ccc([N+](=O)[O-])cn1)Nc1ccc(Cl)c(Cl)c1 20031215 GXKMZTMTYLBZNC-UHFFFAOYSA-N 342.142 3.445 50 40 EGGB CCCN1C(=O)/C(=N\NC(=O)c2ccccc2Cl)c2ccccc21 46084766 OMKFJQLRWKPIQT-SILNSSARSA-N 341.798 3.231 50 40 EGGB Cc1nn(CC(=O)NN=C2CCCCCC2)c(C)c1Br 534087 QEWGZWUSJZWEJX-UHFFFAOYSA-N 341.253 3.089 50 40 EGGB COc1cccc(NC(=O)[C@@H](Cl)C(=O)c2ccc([N+](=O)[O-])cc2)c1 8494741 TXCBTIRCQWTUKW-AWEZNQCLSA-N 348.742 3.032 50 40 EGGB CCOC(=O)N(Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1 3845355 OHQDCQOJASGQGY-UHFFFAOYSA-N 346.299 3.493 50 40 EGGB biogenic C[C@H](O)C(=O)N/N=C\c1ccc(-c2ccc(Cl)c(Cl)c2)o1 83293722 OBJVOXVMOLZEDK-FBSVSCPKSA-N 327.167 3.084 50 40 EGGB CCCOc1ccccc1/C=N/NC(=O)COc1ccccc1C 2055705 KSHLIVDESAPXKE-DEDYPNTBSA-N 326.396 3.313 50 40 EGGB CCOC(=O)/C=C(/C)N(C(=O)N(CCCl)N=O)c1ccccc1 5049343 JHFWJDZFORRELS-QXMHVHEDSA-N 339.779 3.302 50 40 EGGB COc1ccc(O)c(/C=N/NC(=O)CNc2ccc3ccccc3c2)c1 31101 MVJRERXHUOWVPU-WSDLNYQXSA-N 349.390 3.116 50 40 EGGB Cc1nn(-c2ccccc2)c(C)c1[P@@](=O)(c1ccccc1)N(C)C 3206464 UWUWIGCMENGUDZ-DEOSSOPVSA-N 339.379 3.280 50 40 EGGB Cc1ccc(/C=N/NC(=O)c2cccc(Br)c2)c(O)c1 13844413 VIBDSSJMLVUHQR-RQZCQDPDSA-N 333.185 3.227 50 40 EGGB CN(C)c1ccc(/C=C(\C#N)C(=O)OC[C@H]2CC2(Cl)Cl)cc1 14897464 BXFYAQADKRUPSE-BWODNOAJSA-N 339.222 3.397 50 40 EGGB Cc1ccc(S(=O)(=O)/C(C#N)=C\c2ccccc2[N+](=O)[O-])cc1 96669442 DDQLCGHZYXBZML-GDNBJRDFSA-N 328.349 3.242 50 40 EGGB COc1cccc([C@H]2C(C#N)=C(N)Oc3c2c2ccccc2oc3=O)c1 288861 XQXNRCHVABRTTE-INIZCTEOSA-N 346.342 3.020 50 40 EGGB COC(=O)c1ccc(/C=C(\C#N)c2nc(N)c3ccccc3n2)cc1 24567097 HGMMPEXQULYHHN-GXDHUFHOSA-N 330.347 3.063 50 40 EGGB COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC=C(C#N)C#N 3367954 TXBBSKNEJYLACZ-UHFFFAOYSA-N 348.362 3.299 50 40 EGGB CC1(C)CC(=O)C=C(NNC(=O)C(=O)c2ccc(C(C)(C)C)cc2)C1 4590887 MNUCFOQRBNOFND-UHFFFAOYSA-N 342.439 3.061 50 40 EGGB Cc1cc(C)cc(NC(=O)/C(C#N)=C\c2ccc(O)c([N+](=O)[O-])c2)c1 408904371 ILAJJVXYKYNAHU-ZSOIEALJSA-N 337.335 3.463 50 40 EGGB CCOc1ccc(/C=C(\C#N)C(=O)NC2CCCCC2)cc1OC 5718808 GKCRJBFETJPTOS-RVDMUPIBSA-N 328.412 3.450 50 40 EGGB Cc1ccc(O)c(/C=N/NC(=O)c2cccc(Br)c2)c1 362281 UETXLHXQMQRPGT-RQZCQDPDSA-N 333.185 3.227 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)COc2ccccc2C)cc1 354441 HZWRRIDLSUFZPW-KGENOOAVSA-N 339.439 3.370 50 40 EGGB C[C@]1(CO)CCC[C@@]2(C)[C@@H]1CC[C@H]1C[C@@H]3C=C[C@]12[C@H]1C(=O)OC(=O)[C@@H]13 104073743 AWKLTAVAULXADV-RWZSFXNCSA-N 344.451 3.093 50 40 EGGB COc1ccc(/C=C/c2ccc(N)cc2S(=O)(=O)CCl)cc1 255188652 KPTWWTLTIAMGTD-GORDUTHDSA-N 337.828 3.418 50 40 EGGB O=C(NNC(=O)C(F)(F)c1ccccc1)C12CC3CC(CC(C3)C1)C2 32933162 FLSHAHATIGTUMT-UHFFFAOYSA-N 348.393 3.142 50 40 EGGB CC(C)Oc1ccc(/C=N/NC(=O)c2ccc(C#N)cc2F)cc1 564277 PGPJXXFLWYQTCK-SRZZPIQSSA-N 325.343 3.248 50 40 EGGB N#CC1=C[C@@H](Br)[C@H]2C[C@@H]1[C@H](Br)C=C2C#N 4280725 MEAIIRVSQNJTBF-UKKRHICBSA-N 328.007 3.063 50 40 EGGB Cc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)cc1 6908808 UGSPHLPCTORPBB-INIZCTEOSA-N 329.359 3.055 50 40 EGGB Cc1ccc(/C=N/NC(=O)CN2C(=O)c3cccc4cccc2c34)cc1 107089265 RGSMIZKSBRPLJE-WSDLNYQXSA-N 343.386 3.259 50 40 EGGB C/C(CCc1ccccc1)=N\NC(=O)C(=O)Nc1ccccc1Cl 59434384 LLDBXZIJXJDYPI-FYJGNVAPSA-N 343.814 3.403 50 40 EGGB Cc1cc(O[C@@H](C)C(=O)NNC(=O)c2ccoc2C)ccc1C(C)C 40140398 DSSZAMYHGBNNOR-AWEZNQCLSA-N 344.411 3.248 50 40 EGGB CC(C)(C)c1ccc(OCC(=O)NNC(=O)C2CCCCC2)cc1 357400 KSQNTQJCYBVAFM-UHFFFAOYSA-N 332.444 3.091 50 40 EGGB O=C(Cc1ccccc1)NN1C(=O)[C@@H](Cl)[C@@H]1c1ccc(Cl)cc1 1632072 IDEHMCXAZMRSSG-HOTGVXAUSA-N 349.217 3.105 50 40 EGGB CC(C)OCCCNC(=O)/C(C#N)=C\c1cc2c(O)cccc2s1 585135931 JDJQWMALTOYYNB-LCYFTJDESA-N 344.436 3.445 50 40 EGGB Cc1ccccc1OCCn1cc(/C=C(\C#N)C(N)=O)c2ccccc21 348630 CSZPGUZCCCFIPR-FOWTUZBSSA-N 345.402 3.421 50 40 EGGB ClC[C@@H]1Cc2cc(I)c(Cl)cc2O1 5444798 XNKZHMOWUFYQKA-LURJTMIESA-N 328.964 3.487 50 40 EGGB CC(=O)[C@H]1C(=O)N(c2ccccc2)C(N)=C(C#N)[C@H]1C1CCCCC1 108269194 WZPZOJIMSWGHME-QZTJIDSGSA-N 337.423 3.129 50 40 EGGB COc1cccc(/C=C(\C#N)C(=O)N[C@H](C)c2ccccc2)c1OC 3249163 QTCHMUBPVOFERY-RFRKOGIWSA-N 336.391 3.488 50 40 EGGB C/C(=N\NC(=O)CSCc1ccc(C)cc1)c1ccccc1O 59473128 XZQJBIPIVUUCMF-XMHGGMMESA-N 328.437 3.474 50 40 EGGB CCOc1ccccc1-c1cc(C(=O)NN(C)c2ccccc2)n[nH]1 45007364 KIGUOHQOZBIJIP-UHFFFAOYSA-N 336.395 3.257 50 40 EGGB Cc1ccc(-c2n[nH]c3c2[C@@H](c2cccc(O)c2)C(C#N)=C(N)O3)cc1 4592495 XOBSXZKXGRADDF-INIZCTEOSA-N 344.374 3.309 50 40 EGGB N#C/C(=C\c1c(Cl)nc2sccn12)c1nnc2n1CCCCC2 7748314 JRNIHGVQYRKZNN-CSKARUKUSA-N 344.831 3.431 50 40 EGGB COc1ccc(OC)c(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)c1 20248278 QRUYUTYPZAUSKW-KZKLBEMASA-N 344.436 3.335 50 40 EGGB Cc1ccccc1NCC(=O)N/N=C/c1c(O)ccc2ccccc12 261619 YWPNBNMEGRRCBO-WSDLNYQXSA-N 333.391 3.416 50 40 EGGB CN(C)c1ccc(C(=O)NNc2nc3c(F)cc(F)cc3s2)cc1 4061277 NOZORKOZTRRZTD-UHFFFAOYSA-N 348.378 3.397 50 40 EGGB CN(C)c1ccc(C(=O)N/N=C/c2c(O)ccc3ccccc23)cc1 2790433 ZRUUZZGCRUYKMP-FYJGNVAPSA-N 333.391 3.375 50 40 EGGB COC(=O)N/N=C/c1cccc(OC(=O)c2ccccc2Cl)c1 4551070 YJZNBVLCSUMTGL-VCHYOVAHSA-N 332.743 3.249 50 40 EGGB CC1(C)CC(=O)C2=C(C1)O[C@H](c1ccccc1[N+](=O)[O-])C(C#N)=C2N 4565649 PXDSGRQJMWMHOZ-QGZVFWFLSA-N 339.351 3.046 50 40 EGGB COc1cc(/C=C(/C#N)C(N)=S)ccc1OCc1ccccc1C#N 408544333 VPDRGENRNPDAIW-PXNMLYILSA-N 349.415 3.339 50 40 EGGB CCn1cc(Cl)c([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)n1 253402257 OCCHUZUDKQRABO-CYBMUJFWSA-N 346.818 3.007 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@H]1c1cccc(F)c1 5095138 HZPWUIZLWHKKFS-HNNXBMFYSA-N 332.338 3.434 50 40 EGGB COc1cc2c(cc1NC(=O)C/C(C)=N/NC=O)oc1ccccc12 100613969 HNUMONYVAKYFLS-SRZZPIQSSA-N 339.351 3.045 50 40 EGGB biogenic C[C@@]12CCCC[C@H]1[C@@H]2C(=O)N/N=C/c1cc2c(cc1Cl)OCO2 100230882 MXYMIHPOASHEIG-KUMYUHASSA-N 334.803 3.345 50 40 EGGB COc1ccc(/C=N/NC(=O)c2cc3c(s2)CC[C@@H](C)C3)cc1O 3396714 CFGPYFZUKSJERX-VURRPDKYSA-N 344.436 3.351 50 40 EGGB N#C/C(=C/c1cccc(F)c1)c1nc(N)nc(Nc2ccccc2)n1 96931642 SGJXMKAYDFKSJB-LCYFTJDESA-N 332.342 3.401 50 40 EGGB CC[C@H](C)Oc1ccc(/C=C(\C#N)C(=O)N2CCCC2)cc1OC 409368567 CDPKZCGVQOCODS-LUYJPIOASA-N 328.412 3.402 50 40 EGGB CC(=O)Nc1ccc(C(=O)N/N=C/c2c(C)n(C)c3ccccc23)cc1 582062 CDKILMCRELTQTK-CIAFOILYSA-N 348.406 3.209 50 40 EGGB COc1cc(OC)c(OC)cc1/C=N/NC(=O)c1ccc(Cl)cc1 3573723 OARFZXHXJQULIX-VXLYETTFSA-N 348.786 3.130 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@@]32C)cc1[N+](=O)[O-] 4526137 MSIQBURIIGTNAF-PNCSPWPDSA-N 345.399 3.270 50 40 EGGB N#CC1=C2S[C@@H]3CCCC[C@@]3(O)N2C(=O)[C@H](C#N)C12CCCCC2 15218977 WEZAFGUZTDLBAS-WRSAYESZSA-N 343.452 3.032 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)c2cccc([N+](=O)[O-])c2C)cc1 408790028 QLAMUUCJGCIEOL-CPNJWEJPSA-N 341.367 3.456 50 40 EGGB Cc1nc(-c2ccc(C(=O)NNC(=S)NC(C)(C)C)cc2)cs1 585125948 JHKWBZOEDUTPSW-UHFFFAOYSA-N 348.497 3.026 50 40 EGGB Cc1ccc(CC(=O)N/N=C/c2ccc(Br)cc2)cc1 512103 BSENJGBEGDJGMO-WOJGMQOQSA-N 331.213 3.450 50 40 EGGB O=C(CCl)Nc1nnc(C(F)(F)C(F)(F)C(F)(F)F)s1 59387022 YRCPSUVPEPLWHD-UHFFFAOYSA-N 345.627 3.005 50 40 EGGB Cc1cccn2c(=O)c(C=C(C#N)C#N)c(Oc3ccc(F)cc3)nc12 2344322 FSRLMRKIKHPPIH-UHFFFAOYSA-N 346.321 3.365 50 40 EGGB O=C(c1c(F)cccc1F)[C@@H](Br)CBr 307532232 YWAVMLLFWYWYFP-YFKPBYRVSA-N 327.950 3.306 50 40 EGGB COc1ccc(/C=N/NC(=O)c2c(C)nc3ccc(Cl)cn23)cc1 409016143 USLOUVQCKZFBMV-DJKKODMXSA-N 342.786 3.069 50 40 EGGB COc1cc(C)ccc1C(=O)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 409074772 RJYQXCSKNCMVDT-GIJQJNRQSA-N 347.758 3.329 50 40 EGGB CCCC[C@@H](C(=O)NN)N1c2c(OC)cccc2[C@@H](C)CC1(C)C 223230162 MLFKSAGBZBRVEV-ZFWWWQNUSA-N 333.476 3.336 50 40 EGGB COc1ccccc1/C=C(\C#N)C(=O)Nc1ccc(C)cc1[N+](=O)[O-] 40865914 ZVYUMIWINRGZGG-GXDHUFHOSA-N 337.335 3.458 50 40 EGGB O=C(NN=Cc1ccccc1Cl)c1cn2cc(Cl)ccc2n1 725239924 GAUQQTQVDSDFJI-UHFFFAOYSA-N 333.178 3.405 50 40 EGGB Cc1ccc(CC[C@@H]2NC(=O)C(C#N)=C(S)N2c2ccccc2)o1 11615967 AZYMSMPSQBBXEU-MRXNPFEDSA-N 339.420 3.148 50 40 EGGB COCCCNC(=O)/C(C#N)=C/c1cc(C)n(-c2ccccc2)c1C 4994056 YAGFKUYNBYFGBR-QGOAFFKASA-N 337.423 3.154 50 40 EGGB Cn1c2ccccc2c2cc(C(=O)NNC(=O)c3ccccc3)sc21 1386895 FNYUNBWFUMNDND-UHFFFAOYSA-N 349.415 3.468 50 40 EGGB COc1ccc(/C(C)=N\NC(=O)c2cccc(C)c2)cc1[N+](=O)[O-] 408970317 FXKCUCPTLZKJEG-PDGQHHTCSA-N 327.340 3.066 50 40 EGGB CCOc1ccccc1[C@@H]1C(C#N)=C(N)Oc2cc3c(cc21)OCO3 409103618 CSIAOWLUJLWTAB-SFHVURJKSA-N 336.347 3.032 50 40 EGGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C(\C)c1ccc(C)cc1C 408589060 KMVYBVLFCMSFEV-CPNJWEJPSA-N 341.367 3.374 50 40 EGGB COc1cccc(C(=O)N/N=C/c2ccc(Br)cc2)c1 5527428 HPSHPLWWPSOPMH-LICLKQGHSA-N 333.185 3.222 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@@H]1c1cccc(O)c1 4312114 QMZZODRESWLZCW-OAHLLOKOSA-N 330.347 3.000 50 40 EGGB Cc1ccc(NNC(=O)c2cc(Br)c[nH]2)cc1Cl 30553709 GTEAZIARTBKBCR-UHFFFAOYSA-N 328.597 3.496 50 40 EGGB O=C(N/N=C/c1cc(Br)ccc1O)NC1CCCCC1 3221953 LICVJKCGHUVKMB-CXUHLZMHSA-N 340.221 3.121 50 40 EGGB Cc1ccc(O)c(/C=N/NC(=O)c2ccccc2Br)c1 3156509 NZUBCJYCHCITCA-RQZCQDPDSA-N 333.185 3.227 50 40 EGGB O=C(N/N=C1/CCCc2nc(-c3ccccc3)sc21)[C@@H]1CCCO1 57783480 OWTOGXKGOIKUGX-CPOQMQJTSA-N 341.436 3.146 50 40 EGGB Cc1ccc(C)c(OCC(=O)N/N=C/c2cccc([N+](=O)[O-])c2)c1C 12843958 ACNYFMZHSASLOM-VXLYETTFSA-N 341.367 3.049 50 40 EGGB Cc1sc2nc(-c3cccc(NC(=O)CCl)c3)[nH]c(=O)c2c1C 3426366 ZTSIIDSSRFPHES-UHFFFAOYSA-N 347.827 3.446 50 40 EGGB O=C(CC1CCCCC1)NNC(=O)c1ccc2[nH]c(=S)oc2c1 73309595 YZWDCWXHQJMNNZ-UHFFFAOYSA-N 333.413 3.222 50 40 EGGB N#C/C(=C/c1ccc(-c2cccc(C(F)(F)F)c2)o1)C(=O)NC(N)=O 409235567 CDWKDXWOTONLAS-YFHOEESVSA-N 349.268 3.067 50 40 EGGB CC(C)Oc1ccc(/C=N/NC(=O)c2ccncc2)c(OC(C)C)c1 409141554 ADAUTEQEXVXTRS-CIAFOILYSA-N 341.411 3.420 50 40 EGGB C[C@@]12[C@@H](Br)[C@@H]3[C@@H]4C[C@H]5[C@@H]([C@@H]41)[C@](O)(c1ccccc1)[C@H]2[C@@H]53 195528699 SZCGKEUXKLALMI-VORMIAKWSA-N 331.253 3.416 50 40 EGGB CCOc1ccc(C(=O)N/N=C/c2ccc(C)c([N+](=O)[O-])c2)cc1 8081954 OCYJAEKETUZYQP-WOJGMQOQSA-N 327.340 3.066 50 40 EGGB O=C(N/N=C\c1cc([N+](=O)[O-])c(Cl)cc1Cl)c1cccnc1 19720274 BVRDBZFDHXITOC-IDUWFGFVSA-N 339.138 3.061 50 40 EGGB CC[C@@H](Br)C(=O)Nc1nc2ccc(N(C)C)cc2s1 20132467 HZOHPYFOZMQIKZ-SECBINFHSA-N 342.262 3.474 50 40 EGGB N#C/C(=C\n1ccc(=O)[nH]c1=S)C(=O)c1ccc2ccccc2c1 6576601 FWIHLTNOIRCSRX-RVDMUPIBSA-N 333.372 3.306 50 40 EGGB COCCCNC(=O)/C(C#N)=C/c1ccc(-c2ccc(F)cc2)o1 23724282 SKZATWLXQRWUNY-SDNWHVSQSA-N 328.343 3.145 50 40 EGGB COc1cc2c(cc1/C=N\NC(=O)c1cccc3ccccc13)OCO2 409094912 GRGNJKVULGRKPR-NHDPSOOVSA-N 348.358 3.341 50 40 EGGB CNC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(OC)c(Cl)c2)c1C 409063443 KVNGTFVIGDZSEG-RIYZIHGNSA-N 343.814 3.409 50 40 EGGB O=C(c1cc(F)ccc1F)[C@@H](Br)CBr 306535449 GDMUSTMSBLSIPZ-ZETCQYMHSA-N 327.950 3.306 50 40 EGGB Cc1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)n(C2CCCC2)n1 253399142 IMIUQKKPRKORLR-QGZVFWFLSA-N 338.411 3.121 50 40 EGGB C#CCn1cc(/C=N/NC(=O)CCc2ccccc2)c2ccccc21 561424 KHDZHGHKEINUDY-PXLXIMEGSA-N 329.403 3.357 50 40 EGGB COc1cc(/C=N/NC(=O)Cc2cccc3ccccc23)ccc1O 61781 WXPWYIWISXEQIU-FYJGNVAPSA-N 334.375 3.247 50 40 EGGB O=C(N/N=C/c1ccc2c(c1)OCO2)c1cc2ccccc2cc1O 485354 XIIBMWJBJNWGHD-KEBDBYFISA-N 334.331 3.038 50 40 EGGB N#CC1=C2SC[C@@](O)(c3ccccc3)N2C(=O)C[C@@H]1c1ccccc1 544539 UNAZSKRCBSOLLX-OXQOHEQNSA-N 348.427 3.330 50 40 EGGB CCCSC1=C(C#N)[C@H](c2ccc(O)c(OCC)c2)CC(=O)N1 4853347 MERBESJERSGMSD-LBPRGKRZSA-N 332.425 3.273 50 40 EGGB CCOc1ccc(C(=O)CCC(=O)NN(C)c2ccccc2)cc1 15133493 UZEWLCSBNBRFKH-UHFFFAOYSA-N 326.396 3.216 50 40 EGGB COc1cc(/C=N/NC(=O)[C@@H]2[C@H]3CCCC[C@]32C)cc(Cl)c1O 408949484 FNVYQTQPIQZUTR-NEAUJJJSSA-N 336.819 3.331 50 40 EGGB COc1ccc(CNC(=O)/C(C#N)=C/c2ccccc2C)c(OC)c1 408882703 NOVAZMJHLPXPDR-LICLKQGHSA-N 336.391 3.236 50 40 EGGB C=CCOc1ccc(C(=O)N/N=C\c2cccc(O)c2)cc1OCC 409317786 VTEMNLXJPZBBRV-MOSHPQCFSA-N 340.379 3.120 50 40 EGGB CCCn1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)c(C)n1 253409219 ZUXIGYJEGNRHKD-INIZCTEOSA-N 340.427 3.052 50 40 EGGB CCc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(C)c(Cl)c2)cc1 3072825 AEUQVGXLXGFBHN-RGVLZGJSSA-N 343.814 3.300 50 40 EGGB O=C(NNC(=O)c1ccc(Cl)cc1Cl)c1ccccc1F 5867401 MEESANFGWXGWKP-UHFFFAOYSA-N 327.142 3.207 50 40 EGGB C=CCOc1cccc(/C=N/NC(=O)c2cc(OC)cc(OC)c2)c1 5512219 DTFOESYMVGQQSV-DEDYPNTBSA-N 340.379 3.033 50 40 EGGB COc1cc(C(=O)N/N=C2\C=C(O)CC(C)(C)C2)cc(OC)c1OC 100507248 NUUFWBOHOSLHGB-XDHOZWIPSA-N 348.399 3.060 50 40 EGGB C#C[C@]1(O)CC[C@@H]2[C@@H]3[C@H](C)CC4=CC(=O)CC[C@]4(OO)[C@@H]3CC[C@@]21C 504280253 RURMXFRHKGLDHX-FDEHSYFASA-N 344.451 3.351 50 40 EGGB N#CC(C#N)=C(N)/C(C#N)=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 100918078 IWIIUIFMARKIEK-KPKJPENVSA-N 331.291 3.022 50 40 EGGB CCCc1cc(C(=O)NNC(=S)NC2CCCCC2)cs1 373557 SQKSMEFYWHDKEV-UHFFFAOYSA-N 325.503 3.142 50 40 EGGB O=C(NNC(=O)[C@@H]1C[C@@H]1c1ccccc1)Nc1ccc(Cl)cc1 3152286 ISHSUSGGZFMGTF-HUUCEWRRSA-N 329.787 3.296 50 40 EGGB O=C(NNc1ccccc1[N+](=O)[O-])c1ccccc1Br 4600185 CGQCUAYHPHPFMZ-UHFFFAOYSA-N 336.145 3.114 50 40 EGGB O=C(N/N=C/c1cccn1-c1ccc(C(=O)O)cc1)Nc1ccccc1 4675666 NWWHFQLMKLRROX-DEDYPNTBSA-N 348.362 3.331 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)c2ccc(F)cc2)cc1[N+](=O)[O-] 408710894 VIDRWGDJZBYTTG-YBFXNURJSA-N 345.330 3.287 50 40 EGGB O=C(N/N=C/c1ccc(OC2CSC2)cc1)c1ccc(F)cc1 408856121 AZINDMWAOSZOLB-DJKKODMXSA-N 330.384 3.084 50 40 EGGB COc1cccc(/C=N/NC(=O)CSCCc2ccccc2)c1 408727972 UEMSZRUHZMXZPK-CPNJWEJPSA-N 328.437 3.121 50 40 EGGB CC1=C[C@@H](Cl)[C@H]2C[C@]1(C)CN2S(=O)(=O)c1ccc(C)cc1 43761564 WIWVYAQQQPZHHB-BZUAXINKSA-N 325.861 3.332 50 40 EGGB C#CCSC1=C(C#N)[C@H](c2cccs2)C(C(=O)OCC)=C(C)N1 100855216 GDDBPZOTARKUGD-OAHLLOKOSA-N 344.461 3.374 50 40 EGGB COc1ccc(O)c(/C=N/NC(=O)c2ccc(Cl)cc2Cl)c1 59417835 LFKCSCLQXHRCGZ-QGMBQPNBSA-N 339.178 3.472 50 40 EGGB Cc1cc(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C)C3)c(C)o1 5272571 WPMDSXWOIONQMB-SECBINFHSA-N 332.425 3.158 50 40 EGGB Cc1ccc(OCC(=O)NNC(=O)c2ccc3ccccc3c2)cc1C 15886673 YGBFKUHPKSXIFV-UHFFFAOYSA-N 348.402 3.297 50 40 EGGB O=C(NN=C1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1 57211637 XQVWBSWXBURHNN-UHFFFAOYSA-N 325.387 3.208 50 40 EGGB CCOc1cc(/C=C(\C#N)S(=O)(=O)c2ccc(C)cc2)ccc1O 1967160 PINUWOKJCHQIEE-MHWRWJLKSA-N 343.404 3.438 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)c2cccnc2)c(OCCC)c1 3335260 OILGLBVMXDZAPP-KGENOOAVSA-N 341.411 3.423 50 40 EGGB Cc1c(Cl)cccc1NC(=S)NNC(=O)c1cccs1 2784680 AUSZBKFDKSEVQS-UHFFFAOYSA-N 325.846 3.341 50 40 EGGB CCc1ccc(/C(C)=N/NC(=O)Cc2ccc3c(c2)OCCO3)cc1 409365763 RWBXURUEMCPDST-KGENOOAVSA-N 338.407 3.103 50 40 EGGB CC(/C=N/NC(=O)COc1ccccc1[N+](=O)[O-])=C\c1ccccc1 4720983 KBABIYLLUOZGGN-UFTLPMNOSA-N 339.351 3.179 50 40 EGGB CCCCOC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(N)=O)o2)cc1 252480623 CBLRMMOXPUMJQT-PTNGSMBKSA-N 338.363 3.296 50 40 EGGB O=C(N/N=C/c1ccc(F)c(Br)c1)c1ccccc1O 5771534 NIXKTTQDJZJPDD-CAOOACKPSA-N 337.148 3.058 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@@H]2C[C@H]2c2ccccc2)c(OC)c1 12362272 NPCYDLPFUVOBHH-JUPCWZCXSA-N 338.407 3.348 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2Cl)cc1O 112651 HJFKROAFMPPKSL-QGMBQPNBSA-N 339.178 3.472 50 40 EGGB COc1ccc(OC)c(/C=N/NC(=O)Cc2ccc(Cl)cc2)c1 223691 YPKKPEPLPXLDMA-YBFXNURJSA-N 332.787 3.050 50 40 EGGB NC(=O)c1sc(=S)n(-c2ccccc2)c1/N=C(\O)CCl 53944177 JCAVSVRFKQAAON-UHFFFAOYSA-N 327.818 3.194 50 40 EGGB CCOc1ccc(Br)cc1/C=C(\C#N)C(=O)N1CCCC1 409372957 TWRMJJMLYWFEGP-UKTHLTGXSA-N 349.228 3.377 50 40 EGGB CCN(CC)c1ccc(-n2c(C)cc(/C=N/NC(C)=O)c2C)cc1 32109710 LSELLTDCKMEVPT-DEDYPNTBSA-N 326.444 3.410 50 40 EGGB C[C@@H](Br)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1 95097959 JHPMFIDEPHIQEL-BXKDBHETSA-N 332.625 3.023 50 40 EGGB CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H](O[Si](C)(C)C(C)(C)C)C1 205284821 PUEAOZNPUCMJCE-QWHCGFSZSA-N 331.529 3.379 50 40 EGGB C=CCc1cccc(/C=N/NC(=O)[C@@H](C)Nc2ccc(C)cc2)c1O 234197 BONVMFZFFLQWCC-NWGMWSOJSA-N 337.423 3.380 50 40 EGGB CCOc1ccccc1/C=N/NC(=O)CNc1ccc(Cl)cc1 409365764 RXAKOLBJTFATNM-RGVLZGJSSA-N 331.803 3.301 50 40 EGGB C#CCn1c(C)c(/C=N/NC(=O)c2cccc(OC)c2)c2ccccc21 561497 KNDTWGYVUOCWBR-HYARGMPZSA-N 345.402 3.355 50 40 EGGB COc1ccc(C(=O)N/N=C(\C)CCc2ccccc2)cc1OC 8102752 ZTFXGJSYWXHUFD-XSFVSMFZSA-N 326.396 3.442 50 40 EGGB N#C/C(=C/C=C/c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(O)cc1 8379973 IAYRVKBOJNHEBU-YTHZFBKKSA-N 335.319 3.402 50 40 EGGB CCOc1ccc(Br)cc1/C=N/NC(=O)c1ccco1 59417856 NZVLEFPPOIWSGO-CXUHLZMHSA-N 337.173 3.205 50 40 EGGB Cc1ccc(C(=O)NNC(=O)NCC2(c3ccccc3)CCC2)cc1 10206714 XLSYHYJLFFFPJO-UHFFFAOYSA-N 337.423 3.061 50 40 EGGB Cc1ccc(O)c(/C=N/NC(=O)COc2c(C)ccc(C)c2C)c1 12843970 VSFAQEQXJLDYDC-KEBDBYFISA-N 326.396 3.155 50 40 EGGB CCOc1cc(/C=N/NC(=O)c2cccc(C)c2)ccc1OCC#N 4544379 RCQQZSSRMQMQMB-FYJGNVAPSA-N 337.379 3.060 50 40 EGGB CCCn1c(C)cc(/C=C(\C#N)C(=O)N2C[C@H](C)OC(C)(C)C2)c1C 96298082 RJMCMBROSGWHQU-ZNBBLSJYSA-N 343.471 3.448 50 40 EGGB N#CC1(NP(=O)(OCCCl)OCCCl)CCCCC1 2344731 DBJKUURLKUXGLT-UHFFFAOYSA-N 329.164 3.421 50 40 EGGB O=C(O)c1ccc(-n2cccc2/C=N\NC(=O)c2cccs2)cc1 28615459 ZRQUHXJVMGNBCC-WQRHYEAKSA-N 339.376 3.001 50 40 EGGB O=C(NNC(=O)c1cc(C2CC2)nc2ccccc12)c1ccccc1F 8141732 UXNKOGVEAPOPLZ-UHFFFAOYSA-N 349.365 3.326 50 40 EGGB Cc1ccc(/C=N/NC(=O)CNc2ccccc2)cc1Br 409375072 FEVNPDFCLHPKOZ-VXLYETTFSA-N 346.228 3.320 50 40 EGGB COc1cccc(C(=O)Cl)c1OS(=O)(=O)c1ccc(C)cc1 218718843 ZOZQWKOYZLBXFP-UHFFFAOYSA-N 340.784 3.150 50 40 EGGB CC[C@@](C)(OC)C(=O)Nc1ccc(OCCBr)cc1 225601608 UHEMOJPVWVNZFN-CQSZACIVSA-N 330.222 3.214 50 40 EGGB C[Si](C)(c1ccc(C(=O)Cl)cc1)c1ccc(C(=O)Cl)cc1 195774359 HPZPUUUCFWBCFF-UHFFFAOYSA-N 337.278 3.267 50 40 EGGB CCOc1cc(/C=C/C(=O)NN)ccc1OCc1ccccc1Cl 226361178 YIDCVFCPJRUCJS-CSKARUKUSA-N 346.814 3.321 50 40 EGGB COc1cccc([C@H]2C(C#N)=C(N)OC(C(C)(C)C)=C2C#N)c1OC 351745 GLTPNGXYNFBALE-OAHLLOKOSA-N 339.395 3.335 50 40 EGGB O=C(N/N=C/c1ccccc1Br)c1cccc([N+](=O)[O-])c1 3093534 YMNGHCSLGKOTLD-CXUHLZMHSA-N 348.156 3.121 50 40 EGGB COc1cc(/C=N/NC(=O)c2cccnc2)ccc1OCCC(C)C 3335159 NKHRKKASBBACFK-CIAFOILYSA-N 341.411 3.279 50 40 EGGB CCc1ccc(N2C[C@H](C(=O)N/N=C\c3ccc(C)cc3)CC2=O)cc1 409159314 SNVHIKRUOIWDLG-QLTNSANVSA-N 349.434 3.061 50 40 EGGB CC(=O)Oc1cccc(/C=C(/C#N)C(=O)Nc2ccccc2C(C)=O)c1 408763086 NLCHKNIROBNTQL-YBEGLDIGSA-N 348.358 3.360 50 40 EGGB CC(C)c1ccc(/C=N\NC(=O)C(=O)Nc2ccc(F)cc2)cc1 38194898 QNNRHRPLASAWRB-JAIQZWGSSA-N 327.359 3.038 50 40 EGGB COc1cccc(C(=O)N/N=C(\c2ccccc2)c2ccccn2)c1 369581 MDECPEJRIVFAAD-ZBJSNUHESA-N 331.375 3.273 50 40 EGGB CCOC(=O)/C(C#N)=C\c1cc(Br)c(Br)o1 4520381 JUAYWWPCMORHLA-UTCJRWHESA-N 348.978 3.275 50 40 EGGB N#C/C(=C\c1ccc(Br)o1)C(=O)NCc1ccccc1 6223126 SLGWPIZZDDJOSE-XYOKQWHBSA-N 331.169 3.265 50 40 EGGB C/C(=N\NC(=O)[C@@H]1COc2ccccc2O1)c1cccc(Cl)c1 5164224 WFHKSPWGKSYUQO-ZVCOJXFSSA-N 330.771 3.020 50 40 EGGB N#CC1=C(S)NC(=S)[C@@H]([n+]2ccccc2)[C@H]1c1ccc(F)cc1 101361789 TZQOMGDUKXLKSP-GJZGRUSLSA-O 342.444 3.034 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc3ccccc3n2)cc1OC 48252466 BIWZFJUSWVKBKC-UDWIEESQSA-N 335.363 3.016 50 40 EGGB O=C(CCCl)O/N=C1\C(=O)N(c2ccccc2)c2ccccc21 5483727 GQDUZDMEEWZPII-MNDPQUGUSA-N 328.755 3.241 50 40 EGGB O=C(N/N=C\c1cccc2ccccc12)c1cc([N+](=O)[O-])ccc1O 408884545 YGBTUDPQZPWNKZ-ODLFYWEKSA-N 335.319 3.218 50 40 EGGB O=C(Nc1ccccc1C(=O)N/N=C/c1ccco1)c1cccs1 5678965 YPVIRQRGDJNGCW-WOJGMQOQSA-N 339.376 3.357 50 40 EGGB C/C(=N\NC(=O)CNc1ccc(Br)cc1)c1ccccc1 8564933 GFVIVPBQQQMQLL-XDHOZWIPSA-N 346.228 3.401 50 40 EGGB O=C(Cl)[C@@H]1CC(=O)N(c2ccc(N3CCCCC3)c(Cl)c2)C1 45958283 RDTCYLSFPHJHIK-LLVKDONJSA-N 341.238 3.449 50 40 EGGB Cc1ccc(NNC(=O)[C@](O)(c2ccccc2)c2cccs2)cc1 175574 JVNDXVUXXODWBD-IBGZPJMESA-N 338.432 3.436 50 40 EGGB COc1cc(C)c(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc1C(C)C 33900074 NLYWXDVGIOEEEB-JDZKTDJGSA-N 342.439 3.329 50 40 EGGB O=C(NNC1=C(C(=O)C(F)(F)F)CCCCC1)c1ccccc1F 59489006 KERQMRQREJWQEX-UHFFFAOYSA-N 344.308 3.410 50 40 EGGB COC(=O)c1ccc(NC(=O)/C(C#N)=C/c2ccc(C)s2)cc1 408788219 JFECGYZVAHNZDY-UKTHLTGXSA-N 326.377 3.389 50 40 EGGB Cc1noc(C)c1COc1ccc(/C=C(/C#N)C(=O)NC2CC2)cc1 48230860 KNQFIRGPDWABOL-DHDCSXOGSA-N 337.379 3.056 50 40 EGGB CCCOc1ccc(/C=N\NC(=O)c2cccc(NC(C)=O)c2)cc1 33695121 ISFCLAMXIPTIJA-MOSHPQCFSA-N 339.395 3.198 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)Nc2ccccc2F)ccc1O 7156505 VNQKNVLHAXZGDH-UKTHLTGXSA-N 326.327 3.476 50 40 EGGB CCSC1=C(C#N)[C@H](c2ccc(C)cc2)[C@H](C(=O)OC)C(O)=N1 189685 MDCHVJODMWTRQK-KBPBESRZSA-N 330.409 3.326 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2cc3c(OC)cccc3[nH]2)cc1 2208760 CUIURBWCRSELQX-UDWIEESQSA-N 337.379 3.339 50 40 EGGB Cc1cc2c(c(=O)[nH]1)[C@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 9065513 IWPZVQYNWSOADD-CYBMUJFWSA-N 348.189 3.208 50 40 EGGB CC1=C(C(=O)OC(C)C)[C@H](c2ccc(Cl)cc2)C(C#N)=C(N)O1 4476286 PGIZZYVYUWRXEZ-OAHLLOKOSA-N 332.787 3.373 50 40 EGGB N#C/C(C(=O)CN1CCCC1)=C1/NC(c2ccc(Cl)cc2)=CS1 97819742 MFRGXIAMPQHOCF-SAPNQHFASA-N 345.855 3.375 50 40 EGGB O=C(N/N=C/c1ccccc1C(=O)O)c1ccc(Cl)c(Cl)c1 408925831 UDHUVJQKUWCVJD-QGMBQPNBSA-N 337.162 3.456 50 40 EGGB COc1cccc(I)c1CBr 38243562 QJYBXWDZGDSHRU-UHFFFAOYSA-N 326.959 3.195 50 40 EGGB Cc1ccc(F)c(NC(=O)/C(C#N)=C(\O)c2ccccc2[N+](=O)[O-])c1 100935785 URHAUGNYSRRTRU-VBKFSLOCSA-N 341.298 3.474 50 40 EGGB N#CC1=C(N)OC2=C(C(=O)CCC2)[C@@H]1c1cc([N+](=O)[O-])ccc1Cl 62506 NCROOISRKDCTFQ-CQSZACIVSA-N 345.742 3.063 50 40 EGGB COc1ccc(CSCC(=O)N/N=C(\C)c2ccccc2)cc1 59503546 VTJZJACJMNVTTD-XMHGGMMESA-N 328.437 3.469 50 40 EGGB C/C(=N\NC(=O)NC1CCCCC1)c1ccc(-n2ccnc2)cc1 5560156 ZEMRYQCHCJGQQS-KGENOOAVSA-N 325.416 3.228 50 40 EGGB O=C(CCCC[C@@H]1CCSS1)NCc1nnc2ccccn12 27993523 JBABGVXNTYTMMN-GFCCVEGCSA-N 336.486 3.060 50 40 EGGB biogenic C=CCOc1cccc(/C=N/NC(=O)CC2(C)SCCS2)c1 408590884 RCFWHEYXTAQVBI-SFQUDFHCSA-N 336.482 3.288 50 40 EGGB C/C(=N\NC(=O)Cc1cc(C)ccc1C)c1ccc2c(c1)OCCO2 409366522 VMOXJDCGFYKNNQ-RCCKNPSSSA-N 338.407 3.158 50 40 EGGB CC(C)(C)[Si](C)(C)OC[C@H]1CC[C@H](n2cnc3c(N)ncnc32)O1 195516891 KGDNLTOAOQTVGA-VXGBXAGGSA-N 349.511 3.108 50 40 EGGB Cc1noc2nc(C3CC3)cc(C(=O)N/N=C/c3ccc(F)s3)c12 252509201 YFRYLBIMMQNVBS-CNHKJKLMSA-N 344.371 3.373 50 40 EGGB C=CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c2ccccc21 487230 YUTSVGADHYZTKY-SRZZPIQSSA-N 347.374 3.320 50 40 EGGB N#C/C(=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(=O)N1CCCC1 16438051 LCFBWQSASPFSQP-SDNWHVSQSA-N 337.335 3.384 50 40 EGGB CCC(O)(CC)C(=O)NN(C(=O)c1csc(C)c1)c1ccccc1 2424973 QJJQZXGCXPOQJU-UHFFFAOYSA-N 346.452 3.286 50 40 EGGB COc1ccc(CSCC(=O)N/N=C/c2sccc2C)cc1 237655 GKGCHSCZKHCHKC-RQZCQDPDSA-N 334.466 3.449 50 40 EGGB COc1cc(/C=N\NC(=O)c2cccc(Cl)c2)ccc1OC(C)=O 33286497 CADYFQRETOZGPE-GRSHGNNSSA-N 346.770 3.038 50 40 EGGB Cc1cccc(NC(=O)N/N=C\c2ccc(O[C@H](C)C(=O)O)cc2)c1 408850236 IZOCTLKOSSAZJT-LPXFMOJISA-N 341.367 3.003 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2F)cc(OC)c1O 33410753 QMIVPZLQONAYNL-GHXNOFRVSA-N 342.326 3.094 50 40 EGGB CC(C)COc1ccccc1/C=N/NC(=O)c1cccc([N+](=O)[O-])c1 169879981 MATTVDXJAGVNSY-YBFXNURJSA-N 341.367 3.394 50 40 EGGB C/C(=N\NC(=O)c1ccc(C)nc1)c1ccc(Br)cc1 261497 JSVBPDPNBGPQSL-WOJGMQOQSA-N 332.201 3.307 50 40 EGGB Cc1c(C(=O)OC(C)C)sc(NC(=O)C(Cl)Cl)c1C#N 369601 WAHCWIFVLBPILH-UHFFFAOYSA-N 335.212 3.236 50 40 EGGB Cc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)cc1 96563336 CLYFIKGBPQXGNN-INIZCTEOSA-N 342.354 3.136 50 40 EGGB CC1=C(C#N)C(c2cc([N+](=O)[O-])ccc2OC(F)F)C(C#N)=C(C)N1 25328983 WWHPBNUNBDFIIF-UHFFFAOYSA-N 346.293 3.478 50 40 EGGB N#C/C(=C/c1ccco1)C(=O)NCc1nc(-c2ccncc2)cs1 68346691 ZDAGHSXPNOCRMG-JYRVWZFOSA-N 336.376 3.021 50 40 EGGB CC1=C(C#N)C(=O)N(C)C(=O)/C1=C\Nc1cccc(Cl)c1Cl 13615697 PERBACYSHDGYIC-YFHOEESVSA-N 336.178 3.128 50 40 EGGB N#C/C(=C1/C(=O)N2CCCc3cccc1c32)c1nc2ccccc2[nH]1 12407196 LXGSENHLMOLDGT-VKAVYKQESA-N 326.359 3.290 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2ccccc2OCC#N)cc1Cl 59152620 VWDVVBUREKAFJZ-RGVLZGJSSA-N 327.771 3.315 50 40 EGGB CCCCc1[nH]nc2c1[C@@H](c1ccc(N(C)C)cc1)C(C#N)=C(N)O2 5045030 IRBZQGSJHXDDJA-INIZCTEOSA-N 337.427 3.036 50 40 EGGB Cc1cc(SC#N)ccc1NC(=O)COC(=O)c1cccc(O)c1 5755540 OIHDHMMSGWZVOK-UHFFFAOYSA-N 342.376 3.069 50 40 EGGB C/C(=N\NC(=O)CC(=O)Nc1ccccc1Cl)c1ccccc1 16136843 WFVQLHBYMSLTKK-UDWIEESQSA-N 329.787 3.209 50 40 EGGB C=CCNC(=O)/C(C#N)=C/c1c(C)nn(-c2ccc(F)cc2)c1Cl 6588444 ZYSKOWMOAPBLAK-FMIVXFBMSA-N 344.777 3.182 50 40 EGGB CC(C)N(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)CCl 79392553 YEDTYRBRFZVUIQ-ZDUSSCGKSA-N 332.872 3.252 50 40 EGGB C[C@H]1[C@H](C)CCC[C@H]1NC(=O)COC(=O)/C(C#N)=C\c1ccccc1 585145852 ZQMCPBJDTVYHKU-JMSQUANUSA-N 340.423 3.078 50 40 EGGB COc1ccc(/C=C(\C#N)c2nnc(-c3ccccc3)n2C)cc1O 96310752 NOWIZXHNWWVTDQ-XNTDXEJSSA-N 332.363 3.260 50 40 EGGB O=C(CSc1ncccn1)N/N=C/c1ccc(Cl)c(Cl)c1 408831600 RGANOFZWOMLUNP-CNHKJKLMSA-N 341.223 3.026 50 40 EGGB COc1ccc(/C(C#N)=C/c2ccc(O)c([N+](=O)[O-])c2)cc1OC 136366494 XVJMMGRXCOZXER-NTUHNPAUSA-N 326.308 3.382 50 40 EGGB O=C(C/C(CCl)=N/NC(=O)c1ccccc1)Nc1ccccc1 6222735 HSBKPEXIXLOTND-HKWRFOASSA-N 329.787 3.040 50 40 EGGB O=C(N/N=C/c1cccnc1)c1ccc(OCc2ccccc2)cc1 222295 NDISKWLQMDSRON-HYARGMPZSA-N 331.375 3.425 50 40 EGGB C=CCc1cccc(/C=N/NC(=O)[C@H](C)Nc2ccc(C)cc2)c1O 234194 BONVMFZFFLQWCC-PCXKXAPESA-N 337.423 3.380 50 40 EGGB COc1ccccc1NNC(=O)C(O)(c1ccccc1)c1ccccc1 237652 KPVLEOSCPGDCDF-UHFFFAOYSA-N 348.402 3.074 50 40 EGGB Cc1ccccc1N1C(N)=C(C#N)C(C#N)(C#N)[C@H]1c1ccccc1 1647948 CGLLDXPMBRKPBR-GOSISDBHSA-N 325.375 3.284 50 40 EGGB CC1(C)[C@H]2CC[C@](C(=O)O)(C2)[C@]1(Br)CBr 2451988 OSNJXUXPWZALOC-XROYCOCOSA-N 340.055 3.426 50 40 EGGB C/C(=N/NC(=O)c1cccc(F)c1)c1cccc(NC(=O)C2CC2)c1 5381305 IPNVEUXQEHPSRZ-UUYOSTAYSA-N 339.370 3.328 50 40 EGGB CCOc1cc(/C=C(/C#N)C(=O)NC(C)C)cc(Cl)c1OCC#N 408766215 AEXHGHGNQAFHQB-QPEQYQDCSA-N 347.802 3.073 50 40 EGGB N#C/C(=C\c1ccc(C(F)(F)F)cc1)C(=O)NCc1ccccn1 6644609 BAGZMYCQXPPTLI-UKTHLTGXSA-N 331.297 3.324 50 40 EGGB N#Cc1ccc(-c2ccc(/C=N\NC(=O)c3cccc(O)c3)o2)cc1 409022073 DKSIVRCZCYCJQO-MTJSOVHGSA-N 331.331 3.288 50 40 EGGB COc1ccc(OCC(=O)N/N=C/c2cccc3ccccc23)cc1 499062 RASJLXJFRDXVEV-FYJGNVAPSA-N 334.375 3.378 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/c2ccccc2Br)cc1 60200 HHBAWGYKOHABFL-VCHYOVAHSA-N 347.212 3.287 50 40 EGGB COc1ccc(/C=C/C(=O)Oc2ccc([N+](=O)[O-])cc2)c(OC)c1 101730741 ANZUAWHZKDAOHW-ONNFQVAWSA-N 329.308 3.231 50 40 EGGB CC(=O)Nc1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1 3575093 IGNLTIPUTSLUBO-CIAFOILYSA-N 347.374 3.268 50 40 EGGB CCC(/C=C1\Sc2ccc(OC)cc2N1CC)=C(\C#N)C(N)=O 4048110 COFUHDQLGYMCSK-ODDSNLQUSA-N 329.425 3.184 50 40 EGGB C[C@H](Cc1ccccc1)N/C(N)=C(C#N)\C=C1\Nc2ccccc2C1=O 5073545 KSGHTUPMCHOWEM-ZBQHGHGSSA-N 344.418 3.093 50 40 EGGB COc1ccc(F)c([C@@H]2C(C#N)=C(N)Oc3n[nH]c(C(C)(C)C)c32)c1 6507131 FQKJPBSMRQGUQJ-CYBMUJFWSA-N 342.374 3.073 50 40 EGGB Cc1ccccc1NCC(=O)N/N=C/C=C/c1ccccc1[N+](=O)[O-] 4608482 JWKSNVHCWRFSKQ-XCHVBMRISA-N 338.367 3.131 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(C)c(Cl)c2)cc1OC 6033639 DBWMFCCLLJNPFB-VXLYETTFSA-N 332.787 3.430 50 40 EGGB CCOc1ccc(/C=C\C(=O)c2sc(NNC(C)=O)nc2C)cc1 5808921 KOBBJKFGDSBSLD-YFHOEESVSA-N 345.424 3.209 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(NC(=O)C(C)C)cc2)cc1 8558483 RYGNDYNIOZAZST-UDWIEESQSA-N 339.395 3.054 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1cccn1-c1ccc(O)cc1 409247076 GDMXKEVRLDHGSY-BKUYFWCQSA-N 337.354 3.015 50 40 EGGB N#C/C(=C/c1ccc(-n2cncn2)c(F)c1)C(=O)c1ccc(F)cc1 98042540 ALERSVOTURJXIP-AUWJEWJLSA-N 336.301 3.335 50 40 EGGB COc1ccc(/C(C)=N\NC(=O)Cc2ccc(C)cc2)cc1OC 408736892 BSDBBWFHAXBMOP-ZHZULCJRSA-N 326.396 3.095 50 40 EGGB CCOc1ccccc1/C=N\NC(=O)c1ccc(OC)c(OCC)c1 6355784 YXCSQBNBFDHZQS-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB CC(C)CC(=O)NNC(=O)c1cc(-c2ccncc2)nc2ccccc12 15790186 HRCXYGXZWYLYLP-UHFFFAOYSA-N 348.406 3.104 50 40 EGGB Cc1cc(C)nc(NNC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)n1 29066181 PTQUPJWAOVKGSP-AWEZNQCLSA-N 342.443 3.302 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)cc(OC)c1O 6587662 CNEHNLFALIFFQP-TYEFIXRYSA-N 344.411 3.011 50 40 EGGB Cc1ccccc1Oc1nc2ccccn2c(=O)c1C=C(C#N)C#N 5531929 DZXRYWUHWFEUHF-UHFFFAOYSA-N 328.331 3.226 50 40 EGGB COc1cccc(/C=N/NC(=O)CC23CC4CC(CC(C4)C2)C3)c1O 7238904 BWPABECGXAJDJJ-CIAFOILYSA-N 342.439 3.457 50 40 EGGB ClCCN(/C=C/c1nnnn1-c1ccc(Cl)cc1)CCCl 95676282 LUDRYDBKICJHDC-VMPITWQZSA-N 346.649 3.066 50 40 EGGB O=C(N/N=C\c1ccc(O)c([N+](=O)[O-])c1)Nc1cccc(Cl)c1 169961692 YXIZIADRYXUUFX-PXNMLYILSA-N 334.719 3.109 50 40 EGGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1ccc(SC#N)o1 1276385 HKEDNZVLEHAOSA-AWEZNQCLSA-N 341.392 3.304 50 40 EGGB COc1ccc(NC(=O)C(C)(C)CCl)cc1N1CCCCC1=O 5441973 WBVBKDBGPJYQKO-UHFFFAOYSA-N 338.835 3.416 50 40 EGGB N#CCC(=O)N/N=C\c1ccccc1OCc1ccc(Cl)cc1 32152647 QMGYYWPOUHRGPI-JAIQZWGSSA-N 327.771 3.283 50 40 EGGB COc1ccc(/C=N/NC(=O)c2cc3ccccc3nc2C)cc1O 366258 CGYQGWJOGUTKRY-RGVLZGJSSA-N 335.363 3.021 50 40 EGGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1cccc(Br)c1 363952 USOAVVLUGCTYNN-CXUHLZMHSA-N 348.156 3.121 50 40 EGGB Cc1cc2occ(CC(=O)NNC(=O)c3ccccc3F)c2cc1C 9951194 DDMOXNHATZYRPJ-UHFFFAOYSA-N 340.354 3.192 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2cc3ccc(OC)cc3[nH]2)cc1 2323841 YIQPVYPYVSGXFR-UDWIEESQSA-N 337.379 3.339 50 40 EGGB COc1ccc(/C(C#N)=C/c2ccccc2OCC(=O)O)cc1OC 408581241 HVOZLNHJXOOZSY-OQLLNIDSSA-N 339.347 3.231 50 40 EGGB O=C(N/N=C/c1cc2c(cc1Cl)OCO2)c1cccc(Cl)c1 408885448 ACPKGLDOHVPXSL-CNHKJKLMSA-N 337.162 3.486 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)NC2CCCC2)ccc1OC(C)C 255622392 JCGYHCKPYNNIES-GDNBJRDFSA-N 328.412 3.448 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)c2ccccc2)cc1Br 59426158 QUOSHALDVDTBEV-WOJGMQOQSA-N 346.228 3.279 50 40 EGGB Cc1cc(C)cc(OCC(=O)N/N=C\c2cn(C)c3ccccc23)c1 57476855 HBIRUJCZGFWWDD-NHDPSOOVSA-N 335.407 3.324 50 40 EGGB O=C(CSc1nc2ccccc2[nH]1)N/N=C/C=C/c1ccccc1 2185044 CXNBNCCMDHOYEN-YKIVCEQRSA-N 336.420 3.470 50 40 EGGB CCOC(=O)[C@@H](CC)/C(C)=N\NC(=O)c1cc2ccccc2cc1O 4508722 MUBIXMUEGHYIFS-DKNZLLBESA-N 342.395 3.240 50 40 EGGB O=C(N/N=C/c1ccc(C(F)(F)F)cc1)c1ccc([N+](=O)[O-])cc1 4704008 ZXICRKRXBZUEND-DJKKODMXSA-N 337.257 3.378 50 40 EGGB O=C(N/N=C\c1cccc(F)c1)c1cc2cc([N+](=O)[O-])ccc2o1 408904676 MXPMRYXYDVEEOG-NVMNQCDNSA-N 327.271 3.244 50 40 EGGB Cn1c(SCCCCl)nnc1-c1ccc(F)c([N+](=O)[O-])c1 228980001 NEJHZUHVIWSYNV-UHFFFAOYSA-N 330.772 3.250 50 40 EGGB Cc1cc(C)n(Cc2cccc(C(=O)N/N=C/c3ccc(C)o3)c2)n1 130536 AALMTNBEPGGWKX-RGVLZGJSSA-N 336.395 3.214 50 40 EGGB C/C(=N\NC(=O)c1ccccn1)c1cccc(NC(=O)c2ccco2)c1 5895713 XMRIILMLJGINNN-LPYMAVHISA-N 348.362 3.081 50 40 EGGB C/C(=N\NC(=O)[C@@]1(C)NC(C)(C)Cc2ccccc21)c1ccccc1 19534961 ADFBCJHCQBJMOE-FNNTWHHHSA-N 335.451 3.367 50 40 EGGB O=C(N/N=C/c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccccc1 5603938 FACIQVSZXDMJLT-GIJQJNRQSA-N 336.178 3.082 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)COc2ccc(F)cc2)cc1 34181 SCXNMFLHPZPYCM-FYJGNVAPSA-N 343.402 3.201 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)NC(C)C)ccc1OC(=O)C(C)(C)C 27563378 GGUYQJYWJPKVTM-NTEUORMPSA-N 344.411 3.078 50 40 EGGB COc1ccc(-n2cccc2/C=N\NC(=O)c2cccs2)cc1 408851845 GQEFYFZWUQTHTL-PDGQHHTCSA-N 325.393 3.311 50 40 EGGB O=C(C(Cl)Cl)N1Cc2cc3c(cc2[C@@H]2CC=CC[C@H]21)OCO3 1711680 VQGNJGNSKWRJHO-CMPLNLGQSA-N 340.206 3.363 50 40 EGGB CC(=O)N(c1ccc(C)cc1)c1nc(/C=C(/C#N)C(=O)O)cs1 55036900 MYZWRVDBRBFSLG-GHXNOFRVSA-N 327.365 3.128 50 40 EGGB CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1cc(SCC)oc1C 1421400 SHSJGSMFBFYJJT-OAHLLOKOSA-N 348.424 3.345 50 40 EGGB CCOc1cc(/C=N/NC(C)=O)ccc1OCc1ccccc1F 58822525 WSLRWONGXLWRLD-RGVLZGJSSA-N 330.359 3.273 50 40 EGGB C[C@H](Sc1ccccc1)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 20248949 YEQTYEIDEXFRMM-OOIIIRTPSA-N 329.381 3.226 50 40 EGGB N#C/C(=C\c1cc2c(cc1Cl)OCO2)C(=O)NC1CCCCC1 2759336 QZJRUFDCBYOFNU-WUXMJOGZSA-N 332.787 3.425 50 40 EGGB CCOC(=O)/C(C#N)=C/Nc1c(C#N)c(C)c(C)n1Cc1ccco1 15575498 DONWCSHPIUOWRC-GXDHUFHOSA-N 338.367 3.000 50 40 EGGB COc1ccc(/C=N/NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 408967151 SPLMTTRUZLDWAE-VCHYOVAHSA-N 339.307 3.114 50 40 EGGB Cc1cc(C(=O)NN)cc(C)c1OC(=O)c1ccc(C(C)(C)C)cc1 256050502 FGRAHQUOXCROMZ-UHFFFAOYSA-N 340.423 3.424 50 40 EGGB NNC(=O)c1cc(Cl)c(OCc2ccccc2F)c(Cl)c1 226322121 WNBDUMSHVXEHFF-UHFFFAOYSA-N 329.158 3.315 50 40 EGGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)C2CCCCC2)cc1 100923016 SUYBSRATGBZHRF-DEDYPNTBSA-N 331.416 3.096 50 40 EGGB N#C/C(=C\c1ccc(N2CCCCC2)o1)C(=O)Nc1nccs1 60694082 VGEJEYCQPNDRDN-ZRDIBKRKSA-N 328.397 3.272 50 40 EGGB COc1cccc(/C=C(\C#N)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 408888940 CXWKGLKFCMHNDT-RIYZIHGNSA-N 337.335 3.458 50 40 EGGB COc1ccc(CNC(=O)/C(C#N)=C\c2cn(C)c3ccccc23)cc1 408807450 CJLOZOJEFLNMMF-WJDWOHSUSA-N 345.402 3.410 50 40 EGGB N#CC1=C(N)N2C(=C(C#N)[C@H]1c1ccc(F)cc1)Nc1ccccc12 267253 OOEQGSDFYWSPPI-KRWDZBQOSA-N 329.338 3.284 50 40 EGGB CCOc1ccc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)cc1 108063494 DHYNABGSLHHMBU-GDNBJRDFSA-N 336.347 3.329 50 40 EGGB COc1ccc(OC)c(/C=N/NC(=O)c2ccc(C)c(Cl)c2)c1 59151349 WLGUUJSNNVJEQT-VXLYETTFSA-N 332.787 3.430 50 40 EGGB N#C/C(=C\c1c[nH]c2ccc(Br)cc12)C(=O)N1CCCC1 409372124 OVAJCVYGQVIPJJ-YRNVUSSQSA-N 344.212 3.460 50 40 EGGB O=C(N/N=C\c1ccc(Br)o1)c1ccc(Cl)cc1 4814097 TXIKCHVGXMVIHR-CHHVJCJISA-N 327.565 3.459 50 40 EGGB Cc1cccc(/C=C(/C#N)C(=O)N2CCN(c3ccccc3)CC2)c1 255335600 QWUJKQAJSWIRMF-CYVLTUHYSA-N 331.419 3.251 50 40 EGGB CCOc1ccc(Cl)cc1/C=N/NC(=O)c1ccc2c(c1)OCO2 487270 HMQXPZMKLBXJRD-DJKKODMXSA-N 346.770 3.231 50 40 EGGB O=C(N/N=C/c1ccccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 6251727 KQDKTYVSMYAAEF-DJKKODMXSA-N 337.257 3.378 50 40 EGGB CCOC(=O)[C@@]1(C#N)C(N)=C(C#N)C2=CCCC[C@H]2[C@@H]1c1ccccc1 1065684 OLUGSZUWEAVXBJ-PLMTUMEDSA-N 347.418 3.320 50 40 EGGB Cc1cc(SC#N)ccc1NC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 102633171 DCJUMWRASSMCSD-AZHAFVHUSA-N 328.393 3.030 50 40 EGGB CCC[C@H](Br)C(=O)NCCC(=O)Nc1cccc(C)c1 8733107 REVQSQPUAKEZMY-ZDUSSCGKSA-N 341.249 3.003 50 40 EGGB Cc1nccn1Cc1ccc(NC(=O)/C(C#N)=C\c2ccco2)cc1 68354611 IAXACWYGJQMTBH-WJDWOHSUSA-N 332.363 3.379 50 40 EGGB COc1cccc([C@@H]2NC(=S)NC(C(C)(C)C)=C2C#N)c1OC 409370844 BSFQGYPZRPJQQS-ZDUSSCGKSA-N 331.441 3.046 50 40 EGGB Cc1cc(/C=C(\C#N)C(=O)NC2CCCC2)c(C)n1C[C@@H]1CCCO1 24600697 ZRSFIVZSLRPAQJ-OXRZLYTFSA-N 341.455 3.250 50 40 EGGB COc1ccc(/C=N/NC(=O)c2cccc(C(F)(F)F)c2)cc1O 408964916 TYGIUTKWRDODOG-AWQFTUOYSA-N 338.285 3.184 50 40 EGGB O=C1S[C@H](Nc2ccc(Br)cc2)C(=O)N1CCCl 36626578 NYGKQCNXDRWSAH-VIFPVBQESA-N 349.637 3.121 50 40 EGGB C[C@H](Br)C(=O)NC[C@H](OCC1CC1)c1ccc(F)cc1 95097950 DNJXWELCUUGIDI-HZMBPMFUSA-N 344.224 3.193 50 40 EGGB CCc1cccc2c(/C=N/NC(=O)[C@@H](C#N)c3ccccc3)c[nH]c12 8088014 BXCFEBVOQZEFBC-XNQWGTPPSA-N 330.391 3.488 50 40 EGGB CC(=O)Nc1ccc(S(=O)(=O)SC(Cl)(Cl)Cl)cc1 1760566 KJEADIPMVDZRPF-UHFFFAOYSA-N 348.660 3.395 50 40 EGGB COc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2)cc1Cl 568799 QNLQEQMZMLOVDK-UHFFFAOYSA-N 339.178 3.077 50 40 EGGB C[C@@]1(C(=O)OC[C@@H]2CCC[N+]3(C)CCCC[C@H]23)C[C@@H]1Br 4028523 CIGRASSTVHFEOB-DGPCZIFMSA-N 345.301 3.112 50 40 EGGB C/C(N)=C(\C#N)C(=O)CSc1nc2ccccc2n1-c1ccccc1 104654404 SQUFDSHADJSHCG-SQFISAMPSA-N 348.431 3.443 50 40 EGGB CCOc1ccc(Br)cc1/C=C(\C#N)C(=O)NC(C)C 17070827 QMOGFMQYDWFYEW-KPKJPENVSA-N 337.217 3.279 50 40 EGGB CC/C(=N\NC(=O)c1ccccc1[N+](=O)[O-])c1ccc(OC)cc1 17066959 SVVOCFPYPNYDSN-OBGWFSINSA-N 327.340 3.148 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1ccc(Br)s1 409237168 HWZLJIZORNVRHF-PXNMLYILSA-N 341.205 3.343 50 40 EGGB CCOc1ccc(/C=N/NC(=O)COc2ccccc2)c(OCC)c1 408527724 GGNJWFHPXPWZNI-DEDYPNTBSA-N 342.395 3.013 50 40 EGGB Cc1cc(C(=O)N/N=C2\CCc3c(O)cccc32)c2ccccc2n1 98054212 OJWMGMHJGMASNE-RELWKKBWSA-N 331.375 3.329 50 40 EGGB Cc1ccc(/C=N/NC(=O)c2c(-c3ccccc3)noc2C)c(O)c1 66616 BBDHEHVDSCDJAO-RGVLZGJSSA-N 335.363 3.428 50 40 EGGB C/C(=N\NC(=O)COc1ccc(Cl)cc1)c1ccc(N(C)C)cc1 5221741 WZVGYMFRTKGXBK-DEDYPNTBSA-N 345.830 3.325 50 40 EGGB Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=C(\C#N)C(N)=C(C#N)C#N)o1 101958939 UGPYWLHVUNCIMS-WUXMJOGZSA-N 345.318 3.330 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)[C@H](OC)c2ccccc2)cc1 567198 WPXCYCMTPAIVEB-DDNKWHRWSA-N 339.439 3.371 50 40 EGGB Cc1c(NC(=O)CCCl)c(=O)oc2c(C)c3occc(=O)c3cc12 1612544 SYNQZTVZCIEMKE-UHFFFAOYSA-N 347.754 3.084 50 40 EGGB C/C(CCc1ccccc1)=N\NC(=O)C(=O)Nc1cccc(Cl)c1 4611319 FZUBPXBVUFERKC-FYJGNVAPSA-N 343.814 3.403 50 40 EGGB COC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)N(C)C)o2)c(C)c1 408854202 ZOLCYQSADCZCOE-UVTDQMKNSA-N 338.363 3.037 50 40 EGGB CN(C)c1cccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)c1 409105117 GKRUZMAZPLZYJZ-VCHYOVAHSA-N 346.774 3.078 50 40 EGGB Cc1ccc(S(=O)(=O)OC[C@@H](Br)C(F)(F)F)cc1 1083812531 PDOYUYFFZRAZDL-SECBINFHSA-N 347.152 3.026 50 40 EGGB COC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(=O)NC(C)C)o2)cc1 5845397 QHBQDKMZJLZVAO-XNTDXEJSSA-N 338.363 3.165 50 40 EGGB CCn1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 169879849 OBWYJMZPRZQBMV-YBFXNURJSA-N 336.351 3.333 50 40 EGGB Cc1cc(O)cc(O)c1/C=N/NC(=O)CNc1ccc2ccccc2c1 50061 UUMDZOBLCAUUPK-SSDVNMTOSA-N 349.390 3.122 50 40 EGGB O=C(Cc1cccc2ccccc12)N/N=C/c1cc([N+](=O)[O-])ccc1O 59097 CKLGVSOWMUBBPH-UDWIEESQSA-N 349.346 3.146 50 40 EGGB COc1ccc2c(c1)c(C(=O)N/N=C/c1cccs1)c(C)n2C 493548 SDFCFNZDJVCIDD-VCHYOVAHSA-N 327.409 3.321 50 40 EGGB COc1cccc(/C=N/NC(=O)CSCc2ccc(C)cc2)c1O 59473136 AVIXUVSCFBIQHM-VXLYETTFSA-N 344.436 3.093 50 40 EGGB CCCOC(=O)/C(C#N)=C(\NCc1ccc(Cl)nc1)SCC 20478074 DVKJYUCUPWELBZ-WYMLVPIESA-N 339.848 3.266 50 40 EGGB COc1ccc(/C=C(\C#N)S(=O)(=O)c2ccc(Cl)cc2)cc1O 1968066 PXOOOOCFSSLYRI-RIYZIHGNSA-N 349.795 3.393 50 40 EGGB O=C(CCc1c[nH]c2ccccc12)NNC(=O)c1cccc(Cl)c1 3398973 DWFOGZSKJTXCHM-UHFFFAOYSA-N 341.798 3.215 50 40 EGGB Cc1ccc(NC(=S)NNC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)cc1 8685945 LLWBZGOISSXWHX-IRXDYDNUSA-N 339.464 3.425 50 40 EGGB COc1ccc(OC)c(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)c1 408798008 DJORIJPPGCTRTO-MMVIWPHWSA-N 328.412 3.306 50 40 EGGB CCCc1ccc(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])s2)cc1 219605 MIQUGHATYZIGIY-LICLKQGHSA-N 347.396 3.138 50 40 EGGB C=CCc1cccc(/C=N/NC(=O)CNc2ccc(Cl)cc2)c1O 223197 CAPYMPLIUAQLBG-SRZZPIQSSA-N 343.814 3.336 50 40 EGGB Cc1ccc(CSCC(=O)N/N=C/c2cccc([N+](=O)[O-])c2)cc1 59473184 HPIWHLACUFANMR-VCHYOVAHSA-N 343.408 3.287 50 40 EGGB C[C@H]1Cc2cc(/C=C(\C#N)S(=O)(=O)c3ccccc3)ccc2O1 2331635 JWSGXCUCAZLOAI-HNEYUBDGSA-N 325.389 3.348 50 40 EGGB COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2cccc(OC)c2)cc1 16409845 XLZURMAEGSBAFD-XNTDXEJSSA-N 336.347 3.027 50 40 EGGB Cc1nc(Cc2ccccc2)sc1C(=O)N/N=C\c1cccnc1 31798549 QRHCUCMUKSPPIZ-NDENLUEZSA-N 336.420 3.201 50 40 EGGB O=C([C@H](Cl)c1ccccc1)N1CCN(Cc2ccccc2)CC1 19680852 SEAFKIJBUJSUBY-GOSISDBHSA-N 328.843 3.311 50 40 EGGB O=C(CS[C@@H]1CCc2ccccc21)N/N=C/c1ccccc1O 1574208 RCABVSNSNNHAIS-HDZGYNCQSA-N 326.421 3.263 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)Cc2ccc(OC)cc2)cc1 5475309 YTIHHEUCVVBSNA-XSFVSMFZSA-N 326.396 3.177 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(C)cc2Cl)cc1[N+](=O)[O-] 13842654 PBFODVIUMLWQGQ-GIJQJNRQSA-N 347.758 3.329 50 40 EGGB Cc1ccc(C)c(NC(=O)C(=O)N/N=C\c2c(F)cccc2Cl)c1 34707150 MJZHIAVSRTUCCR-UKWGHVSLSA-N 347.777 3.185 50 40 EGGB CCOC(=O)[C@@H](C)Oc1ccc(C=C(C#N)C#N)cc1Br 36612551 WEPLBFALEXNZPI-SNVBAGLBSA-N 349.184 3.210 50 40 EGGB CCOc1cccc(NC(=O)/C(C#N)=C\c2cccc(OC)c2O)c1 408740619 HMAMOBHXIQTCQU-UVTDQMKNSA-N 338.363 3.345 50 40 EGGB CCOc1ccc(C(=O)NN)cc1COc1cc(C)cc(C)c1C 224605627 MHISLQVKBSBNPO-UHFFFAOYSA-N 328.412 3.193 50 40 EGGB Cc1cc(C(=O)N/N=C/c2ccc(Br)s2)c(C)o1 1476730 ARCFVQVDDRAZOD-MKMNVTDBSA-N 327.203 3.484 50 40 EGGB CCCOC(=O)CSC1=C(C#N)[C@H](c2ccc(C)cc2)CC(=O)N1 2475438 SRGRIAWHGUWYIQ-AWEZNQCLSA-N 344.436 3.020 50 40 EGGB CCC/[S@@](CCCl)=N/S(=O)(=O)c1ccc(Cl)cc1 5338871 JOEAYMBHKRDDOR-QGZVFWFLSA-N 328.286 3.479 50 40 EGGB N#C/C(=C/c1ccncc1)C(=O)Nc1ccc(Br)cc1 408745600 UARLQAXEVQUBKW-XFXZXTDPSA-N 328.169 3.390 50 40 EGGB CC(C)Oc1ccc(-c2cc(C(=O)N/N=C\c3cccnc3)[nH]n2)cc1 30742716 INJSWKGYHUPQSN-MTJSOVHGSA-N 349.394 3.023 50 40 EGGB CCOc1ccc(/C=N\NC(=O)COc2cccc(C)c2C)cc1 30838756 NUOQNNLPSGSNFK-NDENLUEZSA-N 326.396 3.231 50 40 EGGB Cc1ccc(-c2ccc(/C=N/NC(=O)CC#N)o2)c(Br)c1 567416 VKTSGZZIGHDQQU-GIJQJNRQSA-N 346.184 3.381 50 40 EGGB CCN(CC)[P@](=O)(c1ccccc1)c1c(C)nc2ccccn12 3123920 WHFBPLQGQOGMCO-QHCPKHFHSA-N 327.368 3.213 50 40 EGGB CCO[Si](OCC)(OC(F)(F)C(F)(F)F)c1ccccc1 198493776 WKHHNUXTTZQGDL-UHFFFAOYSA-N 330.325 3.077 50 40 EGGB CC/C(=N\NC(=O)c1ccncc1)c1ccc(Br)cc1 17005173 CQJGCSWNJXIVET-NBVRZTHBSA-N 332.201 3.388 50 40 EGGB Cn1/c(=N\NC(=O)C23CC4CC(CC(C4)C2)C3)sc2ccccc21 4748424 OFDGGCKSLTYWDO-DYTRJAOYSA-N 341.480 3.388 50 40 EGGB N#C/C(=C/[C@H]1C[C@H](Cl)C[C@H](Cl)[C@@H]1O)C1CCC([N+](=O)[O-])CC1 104159190 NUBBBMPTQGNFID-STMSDVMYSA-N 347.242 3.258 50 40 EGGB O=C(CSc1nc2ccccc2s1)N/N=C1\C[C@@H]2C=CC[C@@H]12 20932093 WXDJVUBAJRYXDR-WNYFIRAASA-N 329.450 3.457 50 40 EGGB CCOC(=O)Oc1ccc(/C=C(\C#N)C(=O)N[C@@H](C)CC)cc1OC 408803688 SDUZABPYAORRFY-IGVUGNCQSA-N 346.383 3.052 50 40 EGGB CC(C)c1ccc(OCC(=O)N/N=C/c2ccc(N(C)C)cc2)cc1 3174548 FCBQBMZFZNRGBK-FYJGNVAPSA-N 339.439 3.405 50 40 EGGB NC(=O)N/N=C(\C=C\c1ccccc1)C[C@H]1OC(=O)c2ccccc21 5899192 GATAKOZDABKIEB-LFILYQMNSA-N 335.363 3.026 50 40 EGGB Cc1cc(OCC(=O)N/N=C/c2ccc(N(C)C)cc2)ccc1Cl 587130 BOLCJBGTAPJZCD-RGVLZGJSSA-N 345.830 3.244 50 40 EGGB O=C(CCSc1ccccc1)N/N=C/c1cccc2c1OCCO2 58916037 ZZRXQQTVRWUKMZ-CPNJWEJPSA-N 342.420 3.090 50 40 EGGB N#CCCn1cc(/C=C(/C#N)C(=O)O)c(-c2cccc(Cl)c2)n1 3393991 OAEUHOCCXNIWDR-GHXNOFRVSA-N 326.743 3.109 50 40 EGGB N#C/C(=C/c1ccc2c(c1)OCCO2)C(=O)NCCCc1ccccc1 409244702 HMLMTCAQTQUARD-AQTBWJFISA-N 348.402 3.114 50 40 EGGB COc1ccc(OCC(=O)N/N=C(\C)c2cc3ccccc3o2)cc1 5164388 NKWIRYBAKJXECR-DEDYPNTBSA-N 338.363 3.361 50 40 EGGB O=C(CC1CCCCC1)NNC(=O)c1ccc(C(F)(F)F)cc1 4681311 NOPASOAUTLKFSZ-UHFFFAOYSA-N 328.334 3.437 50 40 EGGB COc1cccc(/C(C)=N/NC(=O)c2cc3cc(OC)ccc3[nH]2)c1 9614564 YDKSGOXFZANAKZ-CIAFOILYSA-N 337.379 3.339 50 40 EGGB C=CCOc1ccc(/C=C(/C#N)C(=O)NCc2ccccc2)cc1OC 215237316 YHYRWDMQLAMKMS-PDGQHHTCSA-N 348.402 3.483 50 40 EGGB CCCn1nc(C)cc1[C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253404869 RLJVGMGPUGMYJH-MRXNPFEDSA-N 340.427 3.052 50 40 EGGB CC(C)c1ccsc1C(=O)NNC(=O)c1cn(C)c2ccccc12 53130320 JVRGHSXEQVPRLC-UHFFFAOYSA-N 341.436 3.438 50 40 EGGB C/C(=N\NC(=O)c1ccc(Cl)cc1)c1ccc2c(c1)OCCO2 6512703 HGAHJNBBZSQAAU-YBFXNURJSA-N 330.771 3.265 50 40 EGGB C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@@H](O)CC[C@@]43C)[C@@H]1CC/C2=N\NC(N)=O 118918561 AIMQMSBWBNRJGW-XMYTWABPSA-N 347.503 3.414 50 40 EGGB C=CCc1ccccc1OCCOc1ccccc1/C=C(/C#N)C(N)=O 4546117 CYWHTYZVCZZYGU-JXAWBTAJSA-N 348.402 3.265 50 40 EGGB CCOc1ccccc1NC(=O)/C(C#N)=C\c1ccc2c(c1)OCO2 6914016 RMVPCWUOBDLRLA-ZROIWOOFSA-N 336.347 3.360 50 40 EGGB CC(C)c1cc(C(=O)N/N=C/c2ccc(Br)cc2)[nH]n1 8567050 SKHLYWVRUHTHGA-LZYBPNLTSA-N 335.205 3.060 50 40 EGGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1Br)c1ccccc1 408591228 SEJWHNLZGTUNRC-CXUHLZMHSA-N 348.156 3.121 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)c2ccc3c(c2)OCO3)cc1OC 44028903 HXRGSICZLRTDDB-AUWJEWJLSA-N 337.331 3.222 50 40 EGGB CC(C)(C)c1ccc(OCC(=O)N/N=C/c2ccc([N+](=O)[O-])o2)cc1 359362 WDJRNBVUHMNTOA-VCHYOVAHSA-N 345.355 3.014 50 40 EGGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3cc(O)ccc32)cc1Cl 203822 AQWVLDZLMLGJHI-INIZCTEOSA-N 328.755 3.272 50 40 EGGB C/C(=N\NC(=O)CSCc1ccccc1)c1cccc([N+](=O)[O-])c1 20248405 WGIHNCSVAXEVNL-QGOAFFKASA-N 343.408 3.368 50 40 EGGB CCOC(=O)N/N=C/c1ccc(OCc2ccccc2)c(OC)c1 3243861 FSRLFENXEGBYNI-XDHOZWIPSA-N 328.368 3.354 50 40 EGGB CC(C)C/C(=N/NC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1 5092227 UTQQYZKVDBTJDV-JIVYGXRASA-N 338.407 3.393 50 40 EGGB O=C(N[C@@H](Cl)C(Cl)(Cl)Cl)c1ccc([N+](=O)[O-])cc1 1462737 IEHUSKIQMWHWKL-MRVPVSSYSA-N 331.970 3.260 50 40 EGGB Cc1ccc(C(=O)N/N=C\c2ccc(-c3cccc(C(=O)O)c3)o2)o1 28617340 LNGLDOVQAYITBS-GRSHGNNSSA-N 338.319 3.310 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@]32C)cc1[N+](=O)[O-] 101357677 MSIQBURIIGTNAF-RBKNPADFSA-N 345.399 3.270 50 40 EGGB O=C(/C=C/c1ccc(Cl)cc1)N/N=C/c1ccccc1[N+](=O)[O-] 409072128 IKTQATFOCNDZJD-PFMZDYLOSA-N 329.743 3.412 50 40 EGGB CN(NC(=O)c1ccco1)c1nc2ccccc2nc1C(F)(F)F 5342991 UUWPGMASXPURLD-UHFFFAOYSA-N 336.273 3.023 50 40 EGGB COC(=O)c1ccc(/C=N/NC(=O)/C=C/c2ccc(Cl)cc2)cc1 409063699 BCXASAOOBUOJMV-SUECVYDCSA-N 342.782 3.290 50 40 EGGB O=C(N/N=C\c1ccc(Cl)c(Cl)c1)c1n[nH]c2c1CCCC2 31841373 VOBLSHJWIWOGJT-LSCVHKIXSA-N 337.210 3.359 50 40 EGGB CN(C)c1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1c(F)cccc1F 12414056 AFOUFJKEDQQTOG-INIZCTEOSA-N 327.334 3.249 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)c2ccncc2)cc1Br 7892774 JESYQEWABQQXKG-VCHYOVAHSA-N 348.200 3.007 50 40 EGGB Clc1cc(I)cc2c1C[C@@H](Cl)CO2 4159448 XDWQKKZZJJRVOC-RXMQYKEDSA-N 328.964 3.487 50 40 EGGB CCCCNC(=O)[C@@]12CC[C@@](C)(C(=O)[C@@H]1Br)C2(C)C 4185854 LFKFOZVBTANXNZ-NZVBXONLSA-N 330.266 3.062 50 40 EGGB COc1ccc(CCCC(=O)N/N=C/c2cccc(O)c2)c(C)c1 408906058 GYFDMEKUQJRGBU-DEDYPNTBSA-N 326.396 3.182 50 40 EGGB C=CCOc1ccc(/C=N\NC(=O)c2c(C)nc3cc(C)ccn23)cc1 408894530 RBCLDZPWFKGVIK-BKUYFWCQSA-N 348.406 3.280 50 40 EGGB C=CCn1cc(/C=N/NC(=O)[C@H](O)c2ccccc2)c2ccccc21 487378 BUXRDLDGHUHSTA-DBRLUCFCSA-N 333.391 3.011 50 40 EGGB CC(C)c1ccccc1OCC(=O)NNC(=O)c1ccc(Cl)cc1 578907 IITWQQGDDFDNAE-UHFFFAOYSA-N 346.814 3.303 50 40 EGGB CC(C)N(C(=O)OC(C)(C)C)C1CCC(NC(=O)CCl)CC1 79408887 GWTYPJIOEIGPDY-UHFFFAOYSA-N 332.872 3.298 50 40 EGGB COc1ccc(-c2nc3ncccc3o2)cc1NC(=O)CSC#N 216857956 AGFMZERKPNRVNX-UHFFFAOYSA-N 340.364 3.051 50 40 EGGB COc1ccc(/C=N\NC(=O)Cc2ccc(C)cc2C)c(OC)c1 216046380 MVYHVPLDPWVKFW-NDENLUEZSA-N 326.396 3.013 50 40 EGGB CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=CCCC[C@H]2[C@H]1c1ccccc1 19855573 OLUGSZUWEAVXBJ-BLIXFSHQSA-N 347.418 3.320 50 40 EGGB CCOc1ccccc1OCC(=O)N/N=C(\CC)c1ccc(O)cc1 57618717 UUBRVWOPCIWIGL-CAPFRKAQSA-N 342.395 3.100 50 40 EGGB C#CCOc1ccc(/C=N/NC(=O)c2ccc(OCCC)cc2)cc1 20197852 HQZSNWVFPWLPOL-RCCKNPSSSA-N 336.391 3.251 50 40 EGGB CCCOc1ccc(C(=O)N/N=C(\C)c2cc(O)ccc2O)cc1 216069721 GRWWYAZFORKUGO-XDHOZWIPSA-N 328.368 3.041 50 40 EGGB O=C(N/N=C\c1c[nH]c2ccccc12)N/N=C\c1c[nH]c2ccccc12 84567424 WVYYJCYHHYFLBV-IHKZTNIUSA-N 344.378 3.316 50 40 EGGB O=C(N/N=C\c1ccc(F)cc1)C(O)(c1ccccc1)c1ccccc1 33286555 VADWLNCBNXLJPY-HAHDFKILSA-N 348.377 3.212 50 40 EGGB COc1ccccc1NC(=O)/C(C#N)=C/c1cccc(OC(C)=O)c1 408757823 CSEGKJCZXGDXHL-XNTDXEJSSA-N 336.347 3.166 50 40 EGGB CCc1n[nH]c(Sc2c(Cl)cc(C(=O)Cl)cc2[N+](=O)[O-])n1 70462564 PAPQIEZWTVGAFF-UHFFFAOYSA-N 347.183 3.459 50 40 EGGB C[C@H](O[Si](C)(C)C(C)(C)C)C(C)(C)C(=O)ON1C(=O)CCC1=O 198122442 ZSJZQTOBJOVMEI-NSHDSACASA-N 343.496 3.030 50 40 EGGB in-vitro O=C(N/N=C/c1ccccc1[N+](=O)[O-])c1cccc(Br)c1 301093 ZTIRRTQVEDLIAQ-CXUHLZMHSA-N 348.156 3.121 50 40 EGGB COc1cccc(/C=N/NC(=O)c2ccc(OC(C)C)cc2)c1OC 536244 DNRMXIAJBVGHFS-UDWIEESQSA-N 342.395 3.255 50 40 EGGB Cc1ccc(S[C@@H](C)C(=O)N/N=C/c2ccc(C(=O)O)cc2)cc1 409135007 PIADOPYXLIZGAM-MDBUFAAASA-N 342.420 3.324 50 40 EGGB Br[C@H]1CCC[C@@H]2N=C(N/N=C/c3ccccc3)S[C@@H]12 5899385 XGUGXCYNVHMVAJ-PZDLHWBFSA-N 338.274 3.398 50 40 EGGB O=C(N/N=C/c1cccc(C(F)(F)F)c1)c1ccc2c(c1)OCO2 3474917 PXEXZJQHICLJET-DNTJNYDQSA-N 336.269 3.198 50 40 EGGB O=C(N/N=C/c1cccc2ccccc12)c1cc(=O)[nH]c2ccccc12 15905966 ASKBCYQWRHDDOH-LPYMAVHISA-N 341.370 3.445 50 40 EGGB O=C(N/N=C/c1ccc(O)cc1O)C(c1ccccc1)c1ccccc1 354684 QOJITGDLAXHZOF-HYARGMPZSA-N 346.386 3.380 50 40 EGGB CCCOc1ccc(C(=O)NNC(=O)c2cccc(Cl)c2)cc1 3369603 VLMYOGXSQPHPNW-UHFFFAOYSA-N 332.787 3.204 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)c(OC)c1 6586251 DUWMYYHVYABVNG-WYRKQZDXSA-N 328.412 3.306 50 40 EGGB COc1ccc(OC)c(/C=C(\C#N)C(=O)Nc2ccccc2F)c1 67190145 GXSPFQBOFCZPRM-UKTHLTGXSA-N 326.327 3.389 50 40 EGGB O=C(N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccco1 218153 USPBQZJLEFPRAJ-LICLKQGHSA-N 325.280 3.212 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)c2ccccc2C)cc1[N+](=O)[O-] 13586159 OYCZTJWPVBTZJU-LDADJPATSA-N 327.340 3.066 50 40 EGGB COc1ccc(/C=N/OC/C(O)=C(\C#N)c2nc3ccccc3[nH]2)cc1 101965447 DOKIOXKYJPIOTC-FKYZFISHSA-N 348.362 3.415 50 40 EGGB Cc1c(/C=N\NC(=O)c2cccc(N(C)C)c2)c2ccccc2n1C 4712077 HGPOLIQDVICDIR-BKUYFWCQSA-N 334.423 3.317 50 40 EGGB CCC(=O)NNC(=O)C12C[C@@H]3C[C@@H](C1)CC(c1ccc(C)cc1)(C3)C2 100846236 LPHGBLFYDJHJAF-AJHHTPGJSA-N 340.467 3.390 50 40 EGGB O=C(N/N=C/c1ccccn1)c1ccc(NC(=O)c2ccccc2)cc1 59514902 DFUILBVUPWBTGE-HYARGMPZSA-N 344.374 3.098 50 40 EGGB CSc1ccc([C@@H]2C(C#N)=C(N)N(C)C3=C2C(=O)CCC3)cc1 409130001 SXDLLCSSKDXTBW-MRXNPFEDSA-N 325.437 3.138 50 40 EGGB CC(C)N(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)CCl 79392558 BPLYHMXPIWRCTB-CYBMUJFWSA-N 332.872 3.109 50 40 EGGB COc1cc(CNC(=O)/C(C#N)=C\c2ccco2)c2ccccc2n1 98056024 JKXCYYLPWVIPAO-LCYFTJDESA-N 333.347 3.060 50 40 EGGB COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@H](C)Cl 35186624 XDBJUXZFTMVWEX-QMMMGPOBSA-N 325.714 3.296 50 40 EGGB CN(CCC#N)c1ccc(/C=C(\C#N)C(=O)NCc2ccccc2)cc1 13141400 HASTVTUCLQPEQT-XMHGGMMESA-N 344.418 3.260 50 40 EGGB CCOc1cc2c(cc1/C=C(\C#N)C(=O)NC1CCCCC1)OCO2 409106474 NNTUEKSWOZLXKI-RIYZIHGNSA-N 342.395 3.170 50 40 EGGB COc1cc(Cl)cc(/C=C(\C#N)C(=O)Nc2ccc(O)cc2)c1O 23410835 WHMQJZOHXZRDQE-IZZDOVSWSA-N 344.754 3.305 50 40 EGGB Fc1cc(F)c(CBr)cc1I 575467999 LGULFMXWOOKKCQ-UHFFFAOYSA-N 332.913 3.464 50 40 EGGB COc1ccccc1NC(=O)/C(C#N)=C/c1ccc(OC)c(OC)c1 7164473 APWDDDPRMNZZSC-GXDHUFHOSA-N 338.363 3.258 50 40 EGGB C/C(=N\NC(=O)CSc1nc2ccccc2o1)c1cccc(O)c1 13109022 LNEHJUKDZNEVEA-YBFXNURJSA-N 341.392 3.166 50 40 EGGB CCCCOc1ccc(C(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 2300941 ODUZPNJGTJZNGY-UDWIEESQSA-N 340.379 3.358 50 40 EGGB CC(=O)Oc1ccc(/C=C(\C#N)C(=O)N[C@H](C)c2ccccc2)cc1 408813677 QYIYIMFRTYHBDY-CRRKTRLDSA-N 334.375 3.396 50 40 EGGB O=C(COC(=O)CCCCBr)Nc1ccc(Cl)cc1 80338710 DHXUYCFMVHLNNQ-UHFFFAOYSA-N 348.624 3.387 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)c2cc(Cl)nc(Cl)c2)cc1 159145 ZUOPNJZTWUXTRK-GIJQJNRQSA-N 337.210 3.218 50 40 EGGB Cc1ccc(NCC(=O)N/N=C/c2cc(C)c(O)c(C)c2)cc1C 107922710 AMKSIMARGDNXJG-UFFVCSGVSA-N 325.412 3.188 50 40 EGGB N#CC(C#N)=Cc1cc(Br)c(I)o1 408862090 IEJJUBIAZXJDAT-UHFFFAOYSA-N 348.925 3.077 50 40 EGGB CCOC(=O)[C@H](C)Oc1ccc(C=C(C#N)C#N)cc1Br 36612552 WEPLBFALEXNZPI-JTQLQIEISA-N 349.184 3.210 50 40 EGGB COc1ccc(C(=O)NN)cc1OCc1ccc(Cl)c(Cl)c1 226322252 WLLOAAGLYMUEND-UHFFFAOYSA-N 341.194 3.185 50 40 EGGB CCOc1ccc(/C=N/NC(=O)COc2c(C)cccc2C)cc1 238219 FBVXAEFVFOBLDL-UDWIEESQSA-N 326.396 3.231 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@@H]1c1ccc(O)cc1 806309 IIHRDBQOQYKAJF-CYBMUJFWSA-N 336.376 3.062 50 40 EGGB Cc1cc(-c2ccc(/C=C(/C#N)C(=O)N(C)C)o2)cc([N+](=O)[O-])c1C 59334584 UYSXKGMXQRZNCA-ZSOIEALJSA-N 339.351 3.467 50 40 EGGB O=C1C[C@@]2(C[C@H](Cl)N=N2)C(=O)N1c1ccc(Cl)c(Cl)c1 5191180 VUUQJZSASNQOEH-SKDRFNHKSA-N 332.574 3.416 50 40 EGGB N#C/C(=C/c1cc2c(cc1Cl)OCO2)C(=O)NC1CCCCC1 33630701 QZJRUFDCBYOFNU-SDQBBNPISA-N 332.787 3.425 50 40 EGGB CN(C)c1ccc(C2=CC(C3CC3)=C(C#N)C(=C(C#N)C#N)N2)cc1 97985115 INDHOUGABMVMEL-UHFFFAOYSA-N 327.391 3.228 50 40 EGGB COc1ccc(C(=O)NNc2nc3ccc(C)cc3s2)c(OC)c1 4121379 WCKANHOZEBGNRO-UHFFFAOYSA-N 343.408 3.379 50 40 EGGB C[C@H](Cc1ccccc1)C(=O)N/N=C/c1c[nH]nc1-c1ccccc1 375094 SGGPRFPDFLQJPJ-QQHUYRGFSA-N 332.407 3.406 50 40 EGGB C/C(=C\C(=O)C(C)(C)C)NNC(=O)c1ccc(Br)cc1 59366644 HXAUMTJKCNYPMT-MDZDMXLPSA-N 339.233 3.203 50 40 EGGB O=C(N/N=C/c1ccc(N2CCCC2)o1)c1ccccc1-n1cccc1 59138256 BVJMQDSVSHRGJK-RCCKNPSSSA-N 348.406 3.434 50 40 EGGB Cc1c(Cl)cccc1NNC(=O)N[C@@H]1CCCc2c1cnn2C 47002063 RHQSHDDXEIZQGC-CQSZACIVSA-N 333.823 3.086 50 40 EGGB CC(C)Oc1ccccc1N/C=C(\C#N)C(=O)NCc1ccco1 3953669 PVTXVEUTCAXWIH-SDNWHVSQSA-N 325.368 3.203 50 40 EGGB C/C(CC(=O)Nc1ccccc1C(C)C)=N\NC(=O)c1ccccn1 4680452 MMFCBYOWZIVHSA-HYARGMPZSA-N 338.411 3.340 50 40 EGGB CCOc1cc(/C=N\NC(=O)[C@@H](C)Oc2ccc(C)cc2)ccc1O 32109252 MVUBCCAFGLMMOL-FAPYRAKZSA-N 342.395 3.017 50 40 EGGB CCOc1ccccc1NC(=O)/C(C#N)=C/c1cc(OC)ccc1O 1453985 DAJUXCFZQSJPON-GXDHUFHOSA-N 338.363 3.345 50 40 EGGB Fc1ccc(-n2c(CCl)cs/c2=N\C[C@H]2CCCO2)cc1 5694705 JMUFTNSKAXPVBS-QFVIEVDGSA-N 326.824 3.496 50 40 EGGB CCOc1cc(/C=C(/C#N)C(=O)Nc2ccc(OC)cc2)ccc1O 15222062 IRBOZZJOPVCULU-UVTDQMKNSA-N 338.363 3.345 50 40 EGGB CC1=C/C(=N\NC(=O)c2ccc3[nH]c(C)nc3c2)c2ccccc2C1=O 5490421 NXBZLEKHIJINRZ-HAVVHWLPSA-N 344.374 3.148 50 40 EGGB N#C/C(=C\c1cccc2c1OCCCO2)c1nnc2n1CCCCC2 53102708 FUVCBDGXNLIXGV-NTCAYCPXSA-N 336.395 3.230 50 40 EGGB O=C(Cc1ccccc1)N/N=C/c1cc(Cl)c(O)c2ncccc12 59459130 YGCATVQWXCANPB-SRZZPIQSSA-N 339.782 3.287 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)c2ccc3c(c2)OCO3)cc(OC)c1 44028805 QKQLPYCLZMXQIH-LHHJGKSTSA-N 337.331 3.222 50 40 EGGB O=C(CCSc1ccccc1)N/N=C/c1cccc([N+](=O)[O-])c1 233786 QETFPMJIYQNGTH-SFQUDFHCSA-N 329.381 3.227 50 40 EGGB COc1cccc(/C=N/NC(=O)COc2ccc(C(C)C)cc2)c1 516752 ASXGXSDEJFRKBF-UDWIEESQSA-N 326.396 3.348 50 40 EGGB CN(C)/C=C(\C#N)C(=O)CSc1ncc(C(F)(F)F)cc1Cl 3047088 NIURWWJPRSTLBW-SOFGYWHQSA-N 349.765 3.384 50 40 EGGB CC1=C(C#N)[C@@](NC(=O)c2cccc(Cl)c2)(C(F)(F)F)C(O)=N1 4581100 XGNPIYQRDQJJRF-ZDUSSCGKSA-N 343.692 3.139 50 40 EGGB O=C(CCc1ccccc1)N/N=C/c1cc(Br)ccc1O 253436 FJXZOKDMWBWBQU-WOJGMQOQSA-N 347.212 3.238 50 40 EGGB CCOC(=O)/C(C#N)=C(\O)c1ccc(NC(=O)c2ccccc2)cc1 102042095 NNMBZFABMCANRT-MSUUIHNZSA-N 336.347 3.295 50 40 EGGB COc1ccccc1N1C=C(C#N)S(=O)(=O)c2c(F)cccc21 38654598 BFCJIAPYUZYFNV-UHFFFAOYSA-N 330.340 3.125 50 40 EGGB C/C(CC(=O)Nc1cc(C)ccc1C)=N\NC(=O)Cc1cccs1 4526049 SZOGAUGSBQEUBI-XSFVSMFZSA-N 343.452 3.428 50 40 EGGB Cn1cc(C(=O)NNC(=O)[C@H]2CCCc3ccccc32)c2ccccc21 84314278 ACKIDOIPERBBPO-KRWDZBQOSA-N 347.418 3.059 50 40 EGGB CCOc1cc(/C=C(/C#N)C(=O)NCc2ccccc2)ccc1OC 27521734 AAZQRBUCVRWFBT-BOPFTXTBSA-N 336.391 3.317 50 40 EGGB Cc1ccccc1CSCC(=O)N/N=C/c1cccc([N+](=O)[O-])c1 221846 GTIFRXYCJDWDLP-VCHYOVAHSA-N 343.408 3.287 50 40 EGGB CSc1ccc(/C=N/NC(=O)C(=O)Nc2ccc(Cl)cc2)cc1 13922012 HDASDIBIJFOKAZ-VCHYOVAHSA-N 347.827 3.151 50 40 EGGB O=C(N/N=C/[C@H]1C[C@@H]2C=C[C@H]1C2)C(O)(c1ccccc1)c1ccccc1 1012122 MEIWVLWDWOXTGU-CLRNDVDNSA-N 346.430 3.237 50 40 EGGB N#C/C(=C/c1ccco1)c1nc(-c2ccc(O)c(C(N)=O)c2)cs1 96794869 HPJOVGIUNDSFQH-WDZFZDKYSA-N 337.360 3.272 50 40 EGGB N#C/C(=C\c1ccccc1C(=O)O)S(=O)(=O)c1ccc(Cl)cc1 1806569 VANJLLOQEBTIKR-NTEUORMPSA-N 347.779 3.377 50 40 EGGB CCOC(=O)/C(C#N)=C/c1cc(C)n(-c2cccc([N+](=O)[O-])c2)c1C 24221667 KCHNSJOAPLVDEK-OQLLNIDSSA-N 339.351 3.472 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@H]2[C@H]3CCCC[C@]23C)cc1[N+](=O)[O-] 100177041 MSIQBURIIGTNAF-POXTWVIISA-N 345.399 3.270 50 40 EGGB Cc1ccc(-c2nc3sccn3c2/C=C(\C#N)S(C)(=O)=O)cc1 4003182 MLNORKRHFLBKCG-UKTHLTGXSA-N 343.433 3.280 50 40 EGGB C/C(=N\NC(=O)c1cc2c(s1)CCCCC2)c1cn(C)nc1C 96297986 XGKBLDKIGBDVBJ-WOJGMQOQSA-N 330.457 3.213 50 40 EGGB Cc1ccc(/C=N/NC(=O)CCCc2ccc(O)cc2)cc1[N+](=O)[O-] 6034074 YQMTYFZGYZAJKC-XDHOZWIPSA-N 341.367 3.082 50 40 EGGB CCOc1cc(/C=N/NC(=O)CSCc2ccccc2)ccc1O 5336104 ISZSGHUDLGOMEF-YBFXNURJSA-N 344.436 3.174 50 40 EGGB Cc1ccc(C(O)(C(=O)N/N=C/c2ccco2)c2ccc(C)cc2)cc1 352346 KMYCMQJJHPETIQ-HYARGMPZSA-N 348.402 3.283 50 40 EGGB C=CCc1cc(/C=N/NC(=O)c2cccc(F)c2)cc(OCC)c1O 408844667 CTAXWDYVYSXUBS-CIAFOILYSA-N 342.370 3.422 50 40 EGGB COc1ccc(/C=C(\C#N)C(N)=O)c(OCc2ccccc2Cl)c1 408884410 WZWGECGWMGQDDV-RIYZIHGNSA-N 342.782 3.320 50 40 EGGB COc1cccc(/C=N/NC(=O)[C@H](C)Sc2ccc(C)cc2)c1O 409125048 MHLGJEJEGMMOQG-MDBUFAAASA-N 344.436 3.340 50 40 EGGB COc1cccc(NC(=O)/C(C#N)=C/c2c(OC)cccc2OC)c1 182248730 ORJZDONCJPHGPD-JLHYYAGUSA-N 338.363 3.258 50 40 EGGB Cc1ccc(CC(=O)N/N=C/c2cc3c(cc2Cl)OCO3)cc1 511988 ISRHWDBCCIZKCH-DJKKODMXSA-N 330.771 3.070 50 40 EGGB COc1ccccc1OCC(=O)N/N=C/c1ccc2ccccc2c1 353692 CEOITVNXAHLQKP-FYJGNVAPSA-N 334.375 3.378 50 40 EGGB COc1cccc(/C=N/NC(=O)CNc2ccc3ccccc3c2)c1 31095 VEZPTFDOIHQDEO-LPYMAVHISA-N 333.391 3.411 50 40 EGGB CCCC/C(C)=N\NC(=O)C(=O)Nc1cccc(C(F)(F)F)c1 59515766 RYDKCCYQDKORKV-JMIUGGIZSA-N 329.322 3.326 50 40 EGGB CC(C)Oc1ccc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc1Cl 1462394 UYJQZVNKWIUZOU-NHXNDTTKSA-N 348.830 3.329 50 40 EGGB COC(=O)N/N=C/c1cn(CCOc2ccccc2)c2ccccc12 2248842 OKAFGCQYRRMYKT-DEDYPNTBSA-N 337.379 3.410 50 40 EGGB CCOC(=O)/C=C(\C)N(C(=O)N(CCCl)N=O)c1ccccc1 16924427 JHFWJDZFORRELS-VAWYXSNFSA-N 339.779 3.302 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 5621105 WWVSVGBNFGHMCE-VCHYOVAHSA-N 347.758 3.411 50 40 EGGB N#C/C(=C\c1ccc(-c2ccc(F)cc2)o1)C(=O)NC[C@H]1CCCO1 48573 ZKSVTMHCALUBJN-IDKBZEPQSA-N 340.354 3.288 50 40 EGGB COc1ccccc1NC(=O)C/C(C)=N/NC(=O)C1CCCCC1 100923015 JBXKDWLKDFBWGI-DEDYPNTBSA-N 331.416 3.096 50 40 EGGB N#C/C(=C\c1cn(CCOc2ccccc2)c2ccccc12)C(N)=O 348639 CDGPWNMUZPRTAL-NTCAYCPXSA-N 331.375 3.113 50 40 EGGB O=C(CNc1ccccc1F)N/N=C1/CCCCc2ccccc21 33871100 XXNBVSGLRJDORY-XLNRJJMWSA-N 325.387 3.485 50 40 EGGB C/C(CC(=O)Nc1c(C)cc(C)cc1C)=N\NC(=O)c1cccnc1 4713826 KDCSSPLJQCCGLI-PXLXIMEGSA-N 338.411 3.141 50 40 EGGB O=C(CCCc1c[nH]c2ccccc12)NNC(=O)c1ccccc1F 3457982 VOULLBMHGHEOHQ-UHFFFAOYSA-N 339.370 3.091 50 40 EGGB C/C(=N\OCC(=O)N/N=C/c1ccc(Cl)cc1)c1cccs1 15906026 HSAGVNFZFSBNNM-HRRFGWGBSA-N 335.816 3.292 50 40 EGGB Cc1cc(C(=O)O)ccc1-c1ccc(/C=N/NC(=O)c2cccnc2)o1 408960293 KUWZSIUGCCMCNC-SRZZPIQSSA-N 349.346 3.112 50 40 EGGB COc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1cccs1 408879077 CLBXALHQXLMIPK-JXMROGBWSA-N 329.337 3.211 50 40 EGGB O=C(N/N=C(/C(=O)c1ccccc1)c1ccccc1)c1ccncc1 408723528 YFGYFAVYQNWMST-RELWKKBWSA-N 329.359 3.099 50 40 EGGB Cc1ccc(C(=O)NNC(=O)[C@H](C)Oc2ccc(Cl)cc2C)cc1 556450 XPPHXVKUWJOKNL-ZDUSSCGKSA-N 346.814 3.185 50 40 EGGB O=C(NN=C1CCCC1)C(=O)Nc1ccc(Oc2ccccc2)cc1 58885774 IURIAXZXRLYXND-UHFFFAOYSA-N 337.379 3.464 50 40 EGGB CCOc1ccc(/C=C(/C#N)C(=O)NC(C)C)cc1Br 408774126 BDNMYNJZZQFLQC-GHXNOFRVSA-N 337.217 3.279 50 40 EGGB Cc1c(C(=O)NN)c2ccccc2n1C(=O)c1ccc(C(C)C)cc1 216950578 YZHMWTKBQQOZBP-UHFFFAOYSA-N 335.407 3.365 50 40 EGGB O=C(Cc1c(F)cccc1Cl)NNC(=O)c1ccccc1Cl 5703840 USBNGXMLZCSFMY-UHFFFAOYSA-N 341.169 3.136 50 40 EGGB CCOC(=O)/C(C#N)=C/c1cc(C)n(-c2ccnn2C(C)C)c1C 23258421 PCNDJTZBWHBVFL-MHWRWJLKSA-N 326.400 3.342 50 40 EGGB Cc1ccn2c(C(=O)N/N=C/c3cccc(Cl)c3)c(C)nc2c1 59516182 BREUVIVMVUHQDM-VXLYETTFSA-N 326.787 3.368 50 40 EGGB NNC(=O)c1cn(C(=O)c2cc(Cl)ccc2Cl)c2ccccc12 216954605 BELDMHFIQUFWPA-UHFFFAOYSA-N 348.189 3.240 50 40 EGGB CO[Si](CCCc1c(F)c(F)c(F)c(F)c1F)(OC)OC 196424292 ATBYFXZUTXZYMA-UHFFFAOYSA-N 330.325 3.193 50 40 EGGB Cc1ccsc1/C=N/NC(=O)c1cc(Br)ccc1O 3180953 GMPCKFNZQJDHEM-VIZOYTHASA-N 339.214 3.289 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(O)cc2)c(OC)c1C 6418045 PTXKTJNHIIZICO-UVTDQMKNSA-N 338.363 3.264 50 40 EGGB C/C(=N\NC(=O)C1CC1)c1cccc(NC(=O)c2cccs2)c1 5381473 IKHIIDIRYKHUFH-YBFXNURJSA-N 327.409 3.251 50 40 EGGB C/C(=N\NC(=O)Cc1cn2ccsc2n1)c1ccc(Cl)s1 5695290 MHAMMCIKIQYTAZ-LZYBPNLTSA-N 338.845 3.194 50 40 EGGB CCc1ccc(CC(=O)N/N=C(\C)c2ccc3c(c2)OCCO3)cc1 409361663 CUGCHWCHOPJRCX-KGENOOAVSA-N 338.407 3.103 50 40 EGGB C[C@H](Oc1ccc(Cl)cc1)C(=O)N/N=C\c1ccc(N(C)C)cc1 32511858 JGVQGLKOEHARFQ-RQZLXBNYSA-N 345.830 3.324 50 40 EGGB CCOc1ccc(N2C(=O)C[C@]3(C[C@H](Cl)N=N3)C2=O)cc1Cl 4498635 OOFPJBMNIDQFGG-BXUZGUMPSA-N 342.182 3.162 50 40 EGGB C[C@@H]1Cc2cc(/C=C(\C#N)C(=O)NCCc3ccccc3)ccc2O1 2443836 KVRDSAKAGBCXNQ-DQPIFXJKSA-N 332.403 3.276 50 40 EGGB C/C(=N\NC(=O)CCC(=O)Nc1ccccc1Cl)c1ccco1 4525798 XLYOFVJMUFXMFN-YBFXNURJSA-N 333.775 3.192 50 40 EGGB COc1ccc2ccc(OC)c(/C=N/NC(=O)c3ccccn3)c2c1 409016054 UFXFUIIJSVRCAJ-CIAFOILYSA-N 335.363 3.016 50 40 EGGB O=C(NNc1ncnc2ccccc12)c1ccc(Br)cc1 6880563 BLWALFKSELDVBB-UHFFFAOYSA-N 343.184 3.149 50 40 EGGB Cc1cc2c(c(=O)[nH]1)[C@@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 18143866 CODMXGQDBDCUAA-GFCCVEGCSA-N 348.189 3.208 50 40 EGGB O=C(NNc1cccc(Cl)c1)c1cccnc1OCC(F)(F)F 37171342 UDNRHLGJAWADES-UHFFFAOYSA-N 345.708 3.433 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)cc1 6346429 YJCFTPZVUONYCQ-ZFJBLLOBSA-N 349.434 3.313 50 40 EGGB Cc1cccc2sc(NNC(=O)c3ccc(N(C)C)cc3)nc12 429754 FXRKAEGXANIJTO-UHFFFAOYSA-N 326.425 3.428 50 40 EGGB Cc1cccc2sc(NNC(=O)c3ccc4c(c3)OCCO4)nc12 5025714 KSFHUHNICWODPW-UHFFFAOYSA-N 341.392 3.133 50 40 EGGB Cc1cc(/C=C(\C#N)C(=O)NC2CCCC2)c(C)n1C[C@H]1CCCO1 24600699 ZRSFIVZSLRPAQJ-GTENMVSRSA-N 341.455 3.250 50 40 EGGB N#Cc1ccccc1-c1ccc(/C=N/NC(=O)CNc2ccccc2)o1 409385800 JKBBFYQUORMDQL-YDZHTSKRSA-N 344.374 3.380 50 40 EGGB Cc1ccc(NC(=O)/C(C#N)=C\c2ccccc2OCC(=O)O)cc1 44867251 KWQJZCRVTCKSFX-GDNBJRDFSA-N 336.347 3.004 50 40 EGGB O=C(N/N=C/c1c[nH]c2ccccc12)c1cccc(Cn2cccn2)c1 131956 YIICIXVSIPYJBX-LPYMAVHISA-N 343.390 3.177 50 40 EGGB COc1cc(/C=N/NC(=O)[C@H](C)Sc2ccccc2)ccc1O 313811 FABYGPDKXVGULB-HWQJWEFDSA-N 330.409 3.032 50 40 EGGB O=C(NN=C1CCC2(CC1)OCCO2)c1cc2c(s1)CCCCC2 43947196 OHHGULXDHNMILQ-UHFFFAOYSA-N 348.468 3.420 50 40 EGGB COc1cc(C(=O)N/N=C(\C)[C@@H]2C[C@H]3CC[C@H]2C3)cc(OC)c1OC 107904173 AVTPWNSWYYPBDO-OTPMKWMYSA-N 346.427 3.254 50 40 EGGB Cc1ccc(S(=O)(=O)N2CCC(C#N)=C(O)c3ccccc32)cc1 20459237 JQFVFEABZLBADO-UHFFFAOYSA-N 340.404 3.387 50 40 EGGB COc1cc(OC)cc(C(=O)N/N=C/c2cc(Cl)ccc2OC)c1 582456 NEZSFPAUWIIIKR-VXLYETTFSA-N 348.786 3.130 50 40 EGGB C[C@@H]1CCc2sc(C(=O)N/N=C/c3ccc(C(=O)O)cc3)cc2C1 3554611 AOWPUOWFYJGEIJ-VURRPDKYSA-N 342.420 3.335 50 40 EGGB CCOc1ccccc1OCC(=O)N/N=C/c1ccccc1Cl 3040002 GECXHZFLGBDCAX-YBFXNURJSA-N 332.787 3.268 50 40 EGGB O=C(COc1ccc(Cl)cc1Cl)N/N=C1/C[C@@H]2C=CC[C@H]12 5670677 UMUJMDVIMPFHEB-ADDLMTFNSA-N 325.195 3.440 50 40 EGGB CCOc1cc(C(=O)N/N=C\c2ccc(O)c(Cl)c2)ccc1OC 409324733 VEUXZUKUSGXSKA-GRSHGNNSSA-N 348.786 3.217 50 40 EGGB COc1ccc(/C=N/NC(=O)c2cccc(Br)c2)cc1 260133 ZWBBPCBDQLWRNP-LICLKQGHSA-N 333.185 3.222 50 40 EGGB CCOc1ccc(/C=N\NC(=O)c2ccc(OCC)c(OC)c2)cc1 409324232 SQZWCLWBHQZZMD-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB COc1ccc(OC)c(/C=N/NC(=O)CSCc2ccccc2)c1 20249021 SPIAQVGIQDYDDN-YBFXNURJSA-N 344.436 3.087 50 40 EGGB Cc1cc(N2CCCC2)c(F)cc1/C=N/NC(=O)c1ccccc1 33616612 CFHDVECPKLGBIP-FYJGNVAPSA-N 325.387 3.498 50 40 EGGB COc1ccc2nc(/C(C#N)=C\c3cc(OC)c4c(c3)OCO4)[nH]c2c1 409389879 AVVWYFRQWREMTC-XGICHPGQSA-N 349.346 3.373 50 40 EGGB COc1ccc(/C=N\NC(=O)c2ccc(OC)c(OC)c2)cc1Cl 409330522 AZOPLYWYFIWUKI-GRSHGNNSSA-N 348.786 3.130 50 40 EGGB COC(=O)c1ccc(/C=N\NC(=O)c2ccc(C)cc2Cl)cc1 33328623 HINAQWZRUFRKQE-GRSHGNNSSA-N 330.771 3.199 50 40 EGGB COC(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)NC(C)C)o2)cc1 96483388 QHBQDKMZJLZVAO-GDNBJRDFSA-N 338.363 3.165 50 40 EGGB COc1ccc(Cl)cc1C(=O)NNC(=O)CCC1CCCCC1 15893834 HTFDPPHAEFZTGH-UHFFFAOYSA-N 338.835 3.470 50 40 EGGB Cc1ccc(/C=N/NC(=O)Cc2ccccc2)cc1Br 409037848 NYJUKASTKMGALT-WOJGMQOQSA-N 331.213 3.450 50 40 EGGB COc1cc(C(=O)Nc2ccccc2)c(OC)cc1NC(=O)CCl 35655299 IYWYULCDROLXLJ-UHFFFAOYSA-N 348.786 3.133 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)c2sccc2C)cc([N+](=O)[O-])c1O 44028459 JZQALOZUXMCQSW-VZUCSPMQSA-N 344.348 3.469 50 40 EGGB CCOc1ccccc1/C=C(/C#N)C(=O)NCc1ccc(OC)cc1 255546526 AWXFCHARWBSYNR-ATVHPVEESA-N 336.391 3.317 50 40 EGGB O=C(Cc1ccccc1)N/N=C/c1ccc(OC(=O)c2ccco2)cc1 3077038 VVVDCLPIXGPZRZ-KGENOOAVSA-N 348.358 3.192 50 40 EGGB Cc1ccc(O)c(/C=N/NC(=O)CNc2ccc3ccccc3c2)c1 135243 ALUXLHKHHFWNSG-WSDLNYQXSA-N 333.391 3.416 50 40 EGGB O=[N+]([O-])c1cccc(S(=O)(=O)C[C@@H](Cl)c2ccccc2)c1 3151708 MKWHHDBUTVJAAV-CQSZACIVSA-N 325.773 3.349 50 40 EGGB C[C@H](Cl)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1 2650154 CUEWKBIHPPSWBE-VIFPVBQESA-N 336.741 3.108 50 40 EGGB CC(=O)/C(C#N)=C1\NC(=O)[C@@H](Cc2cc(Cl)ccc2Cl)S1 100968631 PPMIGUPFYAKEII-HLVNSREUSA-N 341.219 3.092 50 40 EGGB COc1ccc(CC(=O)N/N=C(\C)CCc2ccccc2)cc1OC 408781279 BSFJMCCGTKOPIR-RCCKNPSSSA-N 340.423 3.371 50 40 EGGB C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NNC(=O)c1ccccc1 12972914 SLWPUYCVNJCFEW-LBPRGKRZSA-N 331.803 3.387 50 40 EGGB CCOC(=O)C/C(C)=N/NC(=O)CCSc1ccc(Cl)cc1 408719655 JAEUORDRLRRGEK-GZTJUZNOSA-N 342.848 3.268 50 40 EGGB CCn1ncc(Cl)c1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253401058 MKOGKAIDGXIFMV-CYBMUJFWSA-N 346.818 3.007 50 40 EGGB COc1ccc(/C=N/NC(=O)Cc2ccc(Cl)cc2)c(OC)c1 14014037 INFKTRZGOCFFMO-YBFXNURJSA-N 332.787 3.050 50 40 EGGB CCOC(=O)[C@@H]1CCC/C1=N\NC(=O)[C@H](C)Sc1ccccc1 5326126 JFTJXEQGYCJKFG-KNAFEEHXSA-N 334.441 3.003 50 40 EGGB C/C(=N\NC(=O)COc1ccccc1F)c1cc2ccccc2o1 5164463 WAAIAVPUYIIDES-UDWIEESQSA-N 326.327 3.491 50 40 EGGB C/C(=N\NC(=O)[C@H]1COc2ccccc2O1)c1cc2ccccc2o1 5164235 BDZMSYXILSVXJO-BAOGCXAUSA-N 336.347 3.113 50 40 EGGB C=CCSC1=C(C#N)[C@H](c2ccccc2OCC)[C@@H](C#N)C(=O)N1 9357119 IBUQJZKOGSOOCN-CZUORRHYSA-N 339.420 3.093 50 40 EGGB O=C(COc1ccccc1-c1ccccc1)N/N=C/c1cccnc1 307930 ZPRWACBEXKZXCS-HYARGMPZSA-N 331.375 3.278 50 40 EGGB O=C(N/N=C/c1cc2ccccc2cc1O)c1cccc([N+](=O)[O-])c1 3100000 IBFZOCHICPQPGG-YBFXNURJSA-N 335.319 3.218 50 40 EGGB COc1ccc(O)c(/C(C)=N/NC(=O)c2cc(C)nc3ccccc23)c1 8429459 GFQRBBRQJKIKHB-LPYMAVHISA-N 349.390 3.411 50 40 EGGB COc1cc(/C=N/NC(=O)CSCc2ccccc2C)ccc1O 408786370 IPXFQISGLMKMAE-VXLYETTFSA-N 344.436 3.093 50 40 EGGB COc1ccc(OC)c(/C=N\NC(=O)Cc2ccc(C)cc2C)c1 216046526 JITQVAOMTJEBHD-NDENLUEZSA-N 326.396 3.013 50 40 EGGB COC(=O)c1ccc(/C=N/NC(=O)[C@H](C)Sc2ccccc2)cc1 47995 KYZRNQHPVHSHJV-HCZVKUGISA-N 342.420 3.104 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 13954539 TYWYHKOMUYSJDF-CPNJWEJPSA-N 341.367 3.456 50 40 EGGB CCCOc1ccc(C(=O)N/N=C/c2ccc([N+](=O)[O-])s2)cc1 2166141 KKULBPZGTBPDMV-MHWRWJLKSA-N 333.369 3.209 50 40 EGGB C[C@@H](Cc1ccccc1)C(=O)N/N=C/c1c[nH]nc1-c1ccccc1 375090 SGGPRFPDFLQJPJ-WXUSHSQQSA-N 332.407 3.406 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)cc1[N+](=O)[O-] 23382593 QBWNWEOAPIWZBX-SWKXHUPFSA-N 343.383 3.205 50 40 EGGB CCc1cc(C)cc(OCCOc2ccc(/C=N/NC(C)=O)cc2)c1 4510882 RDJFITGYOHDWTC-KGENOOAVSA-N 340.423 3.485 50 40 EGGB C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 20247892 UNFOLCBFDGQOGB-PBSOMRJOSA-N 329.381 3.226 50 40 EGGB Cc1cc(C)cc(NC(=O)C(=O)N/N=C/c2ccc(Cl)cc2)c1 13922362 DUHZRFOHEVOEAO-VXLYETTFSA-N 329.787 3.046 50 40 EGGB CC/C(=N\NC(=O)CNC(=O)c1ccc(Cl)cc1)c1ccccc1 14921594 LXJZGLZUYJTXMV-LTGZKZEYSA-N 343.814 3.000 50 40 EGGB Cc1cccc(C(=O)NNC(=S)Nc2ccc(F)c(Cl)c2)c1 39200 TUICOVIWIGIGDM-UHFFFAOYSA-N 337.807 3.419 50 40 EGGB Cc1cc(OCC(=O)N/N=C/c2cccc(O)c2)cc(C)c1Cl 504873 ZRSCPQRVIKIKDH-DJKKODMXSA-N 332.787 3.192 50 40 EGGB CCc1ccc(NC(=O)C(=O)N/N=C/c2c(F)cccc2Cl)cc1 3009055 WHOPOVLBEYOELI-KEBDBYFISA-N 347.777 3.130 50 40 EGGB C[C@H](Oc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2)cc1)C(=O)O 59249721 VBHXRASASJOPEN-WZMONFQBSA-N 336.347 3.084 50 40 EGGB O=C(CC(c1ccccc1)c1ccccc1)NNC(=O)c1ccco1 13021817 FUZOUCINYAFHHQ-UHFFFAOYSA-N 334.375 3.263 50 40 EGGB CCn1c(C)nc2cc(C(=O)N/N=C/c3c(F)cccc3F)ccc21 6319788 OYAMDSIMBKIPGK-UFFVCSGVSA-N 342.349 3.407 50 40 EGGB C=CCc1ccccc1OCC(=O)N/N=C/c1ccccc1OCC 218731 YBICWEYHFIQRRT-KGENOOAVSA-N 338.407 3.343 50 40 EGGB N#CC1=C(N)OC2=C(C(=O)CCC2)[C@H]1c1ccc(N2CCCC2)cc1 62513 CPVPZVIJNRXWGS-SFHVURJKSA-N 335.407 3.102 50 40 EGGB COc1cc([C@@H]2C(C#N)=C(N)Oc3c2ccc2[nH]ccc32)ccc1O 79475581 JCHZGXYNKFGNBP-KRWDZBQOSA-N 333.347 3.100 50 40 EGGB O=C(N/N=C/c1cccc(OC(=O)c2ccccc2)c1)c1ccncc1 1472542 AOWODOOTGOQNJG-HYARGMPZSA-N 345.358 3.065 50 40 EGGB CCOC(=O)[C@H](CC)/C(C)=N\NC(=O)c1cc2ccccc2cc1O 4508725 MUBIXMUEGHYIFS-GEYIUBJWSA-N 342.395 3.240 50 40 EGGB Cc1cccc(C)c1OCCCOc1ccc(/C=N/NC(N)=O)cc1 4599600 JZKWBDOPKRGIPD-FYJGNVAPSA-N 341.411 3.154 50 40 EGGB NNC(=O)c1ccc2nc(-c3ccccc3Br)sc2c1 73635152 NFCKZXQIAANBBU-UHFFFAOYSA-N 348.225 3.329 50 40 EGGB C#C[C@]1(O)CC[C@@H]2[C@H]3[C@H](CC[C@@]21C)[C@@]1(OO)CCC(=O)C=C1C[C@H]3C 504280254 RURMXFRHKGLDHX-HRXJDSDTSA-N 344.451 3.351 50 40 EGGB CC(=O)c1cc(C(=O)NN=C(c2ccccc2)c2ccccc2)n(C)c1 52989168 ZCSNCDOXURPSMB-UHFFFAOYSA-N 345.402 3.410 50 40 EGGB CC[C@H](C)c1ccccc1OCC(=O)NNc1nc(C)cc(C)n1 12849089 NOKQOYSCWXSSHC-LBPRGKRZSA-N 328.416 3.129 50 40 EGGB O=C(NNC(=O)C12CC3CC(CC(C3)C1)C2)[C@H]1C[C@H]1c1ccccc1 4109639 PIPKSJQWWUXIRL-QUUFEMHMSA-N 338.451 3.154 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)CSc2ccc(Cl)cc2)o1 409002018 RXTUNYAZHMRJHZ-RQZCQDPDSA-N 337.832 3.241 50 40 EGGB COc1cccc(/C=N/NC(N)=O)c1OCc1cccc2ccccc12 408893233 DDFWTFBPEPXILX-WSDLNYQXSA-N 349.390 3.430 50 40 EGGB Cc1cc(/C=N/NC(=O)CNc2ccccc2)c(C)n1CC(C)C 6297397 UTCFBBVSSHJXIH-SRZZPIQSSA-N 326.444 3.323 50 40 EGGB Cc1ccc(CC(=O)N/N=C/c2cccc(Br)c2)cc1 512105 SISIINAIOWVJFA-WOJGMQOQSA-N 331.213 3.450 50 40 EGGB C/C(=N\NC(=O)c1ccccc1O)c1ccc(Br)s1 4954397 AUHFAVGFRNBQSW-OVCLIPMQSA-N 339.214 3.370 50 40 EGGB C/C(=N\NC(=O)Cc1cccc2ccccc12)c1ccc(O)cc1O 108955971 GULABFDPESIVHE-FYJGNVAPSA-N 334.375 3.334 50 40 EGGB CC(C)c1ccc(OCC(=O)N/N=C\c2ccc3c(c2)OCO3)cc1 32109222 ZTVLMSHZZGUXLC-JMIUGGIZSA-N 340.379 3.068 50 40 EGGB O=C(Cl)[C@H]1CC(=O)N(c2cc(C(F)(F)F)ccc2Cl)C1 45953417 NEGWLWHTQKHUHG-LURJTMIESA-N 326.101 3.477 50 40 EGGB CCn1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c2ccccc21 487226 KVNHBBXSYUGIBB-KEBDBYFISA-N 335.363 3.154 50 40 EGGB O=C(NNc1ccc(F)cc1)NC1CCN(Cc2ccccc2)CC1 32779423 IAXYYBFDRVGKBF-UHFFFAOYSA-N 342.418 3.116 50 40 EGGB Cc1c2c([nH]c(=O)c1C)C=C[C@@H](Br)[C@H]2Br 1700659 BZLNSIIGHANXHH-GMSGAONNSA-N 333.023 3.218 50 40 EGGB O=C1OCC[C@H]1[PH](c1ccccc1)(c1ccccc1)c1ccccc1 104086726 QIWRPCXVCHGUNJ-OAQYLSRUSA-N 348.382 3.028 50 40 EGGB Cc1cc(C)nc(NNC(=O)C(C)(C)Oc2ccc(Cl)cc2)n1 11333980 NGMCICNDCHNNQZ-UHFFFAOYSA-N 334.807 3.048 50 40 EGGB O=C(N/N=C/c1ccc2c(c1)OCO2)c1csc2c1CCCC2 2764277 GYESMFLVQWBHQY-QGMBQPNBSA-N 328.393 3.120 50 40 EGGB C=CCOc1ccc(C(=O)N/N=C\c2ccc(O)cc2)cc1OCC 409317639 RIDAIXMDSFJUBM-MOSHPQCFSA-N 340.379 3.120 50 40 EGGB Cc1cc2c(c(=O)[nH]1)[C@@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 9331438 ZJJAKXMMWYGBAU-ZDUSSCGKSA-N 348.189 3.208 50 40 EGGB N#C/C(=C/c1ccc(OCC(=O)O)cc1)Cn1cnc2ccccc21 408691829 SLLPZDCYYPKOOF-DHDCSXOGSA-N 333.347 3.107 50 40 EGGB CCCC(=O)Nc1ccc(C(=O)N/N=C/c2ccc(C#N)cc2)cc1 357558 YWRMAMNHICTKDN-FYJGNVAPSA-N 334.379 3.061 50 40 EGGB C/C(=N\NC(=O)c1cnccn1)C(c1ccccc1)c1ccccc1 55355979 HXHLENJDPKZLEZ-HZHRSRAPSA-N 330.391 3.414 50 40 EGGB O=C(Nc1ccc(I)cc1)C(Cl)Cl 2019075 JAXXQYDCVCBDID-UHFFFAOYSA-N 329.952 3.033 50 40 EGGB COc1ccc(/C=N/NC(=O)c2sccc2-n2cccc2)cc1 1398747 HZVSKAXLZMMSFG-LDADJPATSA-N 325.393 3.311 50 40 EGGB N#C/C(=C\N=C(/S)C(N)=S)C(=O)c1ccc2ccccc2c1 8665252 OKOHHJCJFZITLL-UKTHLTGXSA-N 325.418 3.044 50 40 EGGB CC(=O)N/N=C/c1cn(Cc2cccc([N+](=O)[O-])c2)c2ccccc12 409012981 LSZJXLQQKGXECN-VXLYETTFSA-N 336.351 3.068 50 40 EGGB CCOc1cc(/C=N/NC(N)=O)ccc1OCc1cccc(Cl)c1 41223846 BPGHEBIPVCYKPA-KEBDBYFISA-N 347.802 3.320 50 40 EGGB N#C[C@@H](C(=O)N/N=C/c1ccc(N2CCCC2)cc1)c1ccccc1 7096214 PXTGIRHQLSNITB-QTCOBDOFSA-N 332.407 3.044 50 40 EGGB Cc1cc(C)nc(NNC(=O)[C@@H](C)Sc2ccccc2Cl)n1 48251930 RVGXAFTZAVAGLV-LLVKDONJSA-N 336.848 3.371 50 40 EGGB C[C@]12C(=O)[C@@H](C(c3ccccc3)=C1c1ccccc1)[C@H]1C(=O)OC(=O)[C@@H]12 104121288 HRWFTDUSOZZENY-PAODICLVSA-N 344.366 3.132 50 40 EGGB CCCCCC(=O)NNC(=O)c1ccc(COc2ccccc2)o1 13006551 YKZBMTKFBSQXTR-UHFFFAOYSA-N 330.384 3.200 50 40 EGGB Cc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)sc2ccccc32)o1 71411460 SFVXYFPOILDKQZ-AWEZNQCLSA-N 336.372 3.381 50 40 EGGB C[C@H]1CCC/C(=N/NC(=O)CCC(=O)N/N=C2/CCC[C@@H](C)C2)C1 5527956 AVGQWTXONGCGQY-WLUFFHHOSA-N 334.464 3.131 50 40 EGGB CCOc1ccc(C(=O)N/N=C(\C)c2cccc([N+](=O)[O-])c2)cc1 4750994 CWEOUHUJMWAWKE-LDADJPATSA-N 327.340 3.148 50 40 EGGB Cc1ccc[n+](/C(C(=O)c2ccc(Cl)cc2)=C(\C#N)C(=C=N)C#N)c1 409415802 UZGDUDMEGUCJNL-ISLYRVAYSA-N 347.785 3.252 50 40 EGGB O=[N+]([O-])c1ccc(S(=O)(=O)C[C@@H](Cl)c2ccccc2)cc1 126873 DOVCSFCXQWKXEM-CQSZACIVSA-N 325.773 3.349 50 40 EGGB Cc1ccc(/C(N=C=S)=N\CS(=O)(=O)c2ccccc2)cc1 12584351 MDLNGQYVDRTMFI-FBMGVBCBSA-N 330.434 3.276 50 40 EGGB Cc1cc(C)nc(NNC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)n1 29066177 PTQUPJWAOVKGSP-CQSZACIVSA-N 342.443 3.302 50 40 EGGB CCOc1cc(/C=N/NC(=O)[C@@H]2[C@H]3CCCC[C@]32C)ccc1OC 107903427 ZLIMSBWJFFCIJE-GNRCFQDZSA-N 330.428 3.370 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)cc(OC)c1O 3570408 CNEHNLFALIFFQP-CJMFJESPSA-N 344.411 3.011 50 40 EGGB O=C(Cc1ccc(Br)cc1)N/N=C/c1ccccc1F 5866563 MELIKLHOPAXVHT-VCHYOVAHSA-N 335.176 3.281 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)Nn2c(C)ccc2C)cc(Cl)c1O 409382155 LNZFVIFGRQHOIJ-MLPAPPSSSA-N 345.786 3.150 50 40 EGGB Cc1cc(/C=N\NC(=O)c2ccc(F)cc2)ccc1N1CCCC1 408853165 YXTOMZPENHLQBA-BKUYFWCQSA-N 325.387 3.498 50 40 EGGB CCOC(=O)/C(C#N)=C/c1cc(C)n(-c2ccc(C(=O)O)cc2)c1C 408841916 MHFBLRDWSMMWHJ-MHWRWJLKSA-N 338.363 3.262 50 40 EGGB COc1cc(/C=C(/C#N)c2ccc3c(c2)OCO3)cc([N+](=O)[O-])c1O 409366856 ZNTLAWYLANCYSJ-QCDXTXTGSA-N 340.291 3.102 50 40 EGGB CCOC(=O)[C@]1(C#N)C(=O)[C@H](c2ccccc2)[C@@H]2CCCCC2=C1C#N 13596308 UOSFJDGSTWTMSR-BLIXFSHQSA-N 348.402 3.436 50 40 EGGB CC(=O)N1CCc2cc(C(=O)NNc3cccc(Cl)c3)ccc21 30613652 QKSGGMLSBADIJP-UHFFFAOYSA-N 329.787 3.006 50 40 EGGB O=C(CBr)Nc1cccc(C(=O)NC2CCCCC2)c1 35605202 PBUDYQOOOWTKNQ-UHFFFAOYSA-N 339.233 3.083 50 40 EGGB Cn1cc([C@@H]2C[C@H]2C(=O)NN(Cc2ccccc2)c2ccccc2)cn1 64371056 MHZOEFGKLVGQHP-VQTJNVASSA-N 346.434 3.262 50 40 EGGB Cc1cccc(OCC(=O)N/N=C\c2cc(Cl)ccc2O)c1C 30838805 DTTWTFPESDNYRD-OCKHKDLRSA-N 332.787 3.192 50 40 EGGB CN(C)c1ccc(-n2cccc2/C=N/NC(=O)c2ccc(O)cc2)cc1 408953133 OKKFVWQGEMVBEQ-KGENOOAVSA-N 348.406 3.013 50 40 EGGB C=CCOc1ccc(/C=C(/C#N)C(=O)NCc2ccc(OC)cc2)cc1 408817182 KUZNLRXXVPJTGN-AQTBWJFISA-N 348.402 3.483 50 40 EGGB COc1ccc(OC)c(/C=C(\C#N)C(=O)Nc2ccccc2OC)c1 7065871 LQYOPZJNSBMJOW-GXDHUFHOSA-N 338.363 3.258 50 40 EGGB C[C@@]12CCCC[C@@H]1[C@@H]2C(=O)N/N=C/c1cc2c(cc1Cl)OCO2 17070552 MXYMIHPOASHEIG-KFYCXTJESA-N 334.803 3.345 50 40 EGGB COc1ccc(/C=N/NC(=O)c2cc3cccc(C)c3nc2C)cc1O 366224 YWEJTWBMFZIRKZ-SRZZPIQSSA-N 349.390 3.330 50 40 EGGB COc1ccc(Br)cc1C(=O)N/N=C/c1ccc(C)o1 126284 UXHLZBNUOIHVPD-LZYBPNLTSA-N 337.173 3.123 50 40 EGGB O=C(Cc1ccccc1)NN1C(=O)[C@@H](Cl)[C@H]1c1ccc(Cl)cc1 1632073 IDEHMCXAZMRSSG-JKSUJKDBSA-N 349.217 3.105 50 40 EGGB Cn1cnnc1SCc1ccc(C(=O)NN=C2CCCCC2)cc1 5164277 SPUMIFPVPJOCBT-UHFFFAOYSA-N 343.456 3.157 50 40 EGGB C/C(CC(=O)Nc1cc(Cl)c(Cl)cc1Cl)=N\NC(N)=O 16957740 JRVHNCBSQRBWBM-YAXRCOADSA-N 337.594 3.020 50 40 EGGB CCOC(=O)/C(C#N)=C/Nc1nc(SCc2ccccc2)ns1 100753225 PNDVXQLKHNRAKL-FMIVXFBMSA-N 346.437 3.213 50 40 EGGB CCOC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(F)cc1 3170533 IQMTXOJDJDSSJS-GXDHUFHOSA-N 338.342 3.073 50 40 EGGB Cc1ccc(Sc2oc(-c3ccccc3)nc2C(=O)NN)cc1 35673444 SCKMRSBUIBIZTR-UHFFFAOYSA-N 325.393 3.405 50 40 EGGB CC(C)N(C(=O)CCl)[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C 79392570 VBTAOJBKULDHHG-CHWSQXEVSA-N 332.872 3.298 50 40 EGGB CC(C)c1ccc(CCC(=O)NNC(=O)c2ccccc2F)cc1 40140322 RSJYPRXWEQLZIQ-UHFFFAOYSA-N 328.387 3.343 50 40 EGGB COc1cccc(/C=N/NC(=O)[C@@H](C)SCc2ccccc2)c1O 313810 YNVCTPFOBGAOGI-OTGIAGGSSA-N 344.436 3.173 50 40 EGGB Cc1ccc(/C=N/N(CCC#N)C(=O)c2ccc([N+](=O)[O-])cc2)cc1 27745797 ZSYUPLRUNNXICV-DEDYPNTBSA-N 336.351 3.293 50 40 EGGB O=C(O)c1cccc(-c2ccc(/C=N/NC(=O)c3ccccc3)o2)c1 4852598 PJJFNAZEEQRTHL-UDWIEESQSA-N 334.331 3.409 50 40 EGGB Cc1ccc(SCC(=O)N/N=C/c2cccc([N+](=O)[O-])c2)cc1 40961755 STIMKWAMSUPVEQ-LICLKQGHSA-N 329.381 3.146 50 40 EGGB CCOC(=O)/C(C#N)=C/c1cc(OCC)c(O)cc1Br 2773135 YUENGRASUZQZRV-BJMVGYQFSA-N 340.173 3.023 50 40 EGGB NNC(=O)/C=C/c1ccc(-c2ccc(Br)c(Cl)c2)o1 226302209 OAEUHWQNEPTVJW-ZZXKWVIFSA-N 341.592 3.366 50 40 EGGB COc1ccc([C@H]2C(C#N)=C(N)Oc3cc(O)ccc32)cc1Cl 203824 AQWVLDZLMLGJHI-MRXNPFEDSA-N 328.755 3.272 50 40 EGGB CC1(C)[C@@H]2CC=C(/C=N/NC(=O)Cc3cn4ccsc4n3)[C@H]1C2 7982237 FDVMBSPLULNHSQ-XHKVJSBLSA-N 328.441 3.033 50 40 EGGB COc1cc(Cl)c(/C=N/NC(=O)Cc2ccc(C)cc2)cc1OC 512065 UKABYHKCLJBHFO-RGVLZGJSSA-N 346.814 3.358 50 40 EGGB COc1ccc(CSC2=C(C#N)C(C)(C)[C@H](C#N)C(=O)N2)cc1F 9503710 LDIIYPRWDMFBPE-LLVKDONJSA-N 345.399 3.098 50 40 EGGB N#C/C(=C\c1ccc(Br)o1)S(=O)(=O)c1ccccc1 409432 RPRKJWJPFKSFOR-XYOKQWHBSA-N 338.182 3.380 50 40 EGGB O=C(NN=C1CCCC1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 58885734 RPXDVCHYHKAJLA-UHFFFAOYSA-N 347.724 3.344 50 40 EGGB Cc1ccsc1/C=N/NC(=O)C(=O)Nc1ccc(C(C)C)cc1 59435548 SNTANXBHJMSEJC-VCHYOVAHSA-N 329.425 3.269 50 40 EGGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@@H]1[C@]12C=C[C@@H](CC1)C2 100671771 LDIVSFFWSCEOTP-MCGXXNDWSA-N 332.359 3.319 50 40 EGGB Cc1cccc(C(=O)NNC(=O)c2ccc(OCC(C)C)cc2)c1C 2663740 YSZAUNFKBDUJCV-UHFFFAOYSA-N 340.423 3.413 50 40 EGGB COc1ccc(CC(=O)N/N=C\c2cccn2-c2ccccc2)cc1 408934029 CHJQHJDNNOSVEN-QNGOZBTKSA-N 333.391 3.179 50 40 EGGB NC(=O)N/N=C/c1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 7895036 LGNQBJDZKLDNAP-CAOOACKPSA-N 334.719 3.043 50 40 EGGB CCc1sc(C(=O)NNC(=O)c2c(F)cccc2Cl)cc1C 8277213 HPZOGADTFNZZIH-UHFFFAOYSA-N 340.807 3.486 50 40 EGGB CCOc1ccccc1C=NNC(=O)COc1cccc(Cl)c1 23397242 SRVTUESULJWIEG-UHFFFAOYSA-N 332.787 3.268 50 40 EGGB O=C1OC(=O)[C@H]2[C@H]1C1(Cl)c3ccccc3C2(Cl)c2ccccc21 101660237 CTMYKTZXKOHVNC-JDPPGYRCSA-N 345.181 3.294 50 40 EGGB CCOC(=O)C1=C(c2ccccc2)OC(N)=C(C#N)[C@@H]1c1ccccc1 293763 LJDWOPPGIKRIIK-KRWDZBQOSA-N 346.386 3.469 50 40 EGGB COc1ccc(C(=O)NN=C2CCN(Cc3ccccc3)CC2)cc1 59403008 GMERTCIIWNQKER-UHFFFAOYSA-N 337.423 3.077 50 40 EGGB CC(C)(C)c1ccc(CC(=O)N/N=C/c2ccc([N+](=O)[O-])o2)cc1 408566395 GBPICSMCFMHCKJ-WOJGMQOQSA-N 329.356 3.178 50 40 EGGB C/C(=N\NC(=O)c1ccncc1)c1cccc(NC(=O)c2ccco2)c1 5621239 SEHMYAPBPRQADG-LPYMAVHISA-N 348.362 3.081 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])cc(C)c2O)c(Cl)c1 36236344 CBYSFGBCQHJXBB-QGMBQPNBSA-N 347.758 3.335 50 40 EGGB O=C(Cc1cn2ccsc2n1)N/N=C1/CCCCc2ccccc21 97991636 JLZJRHWXPUFJMJ-SILNSSARSA-N 338.436 3.185 50 40 EGGB CC(=O)NNc1nc(C)c(C(=O)/C=C\c2ccc(Cl)cc2)s1 5808927 OAUVXOFAFALBGK-YVMONPNESA-N 335.816 3.464 50 40 EGGB COc1ccccc1[C@H]1[C@@H]2CCCC=C2C(C#N)=C(N)C1(C#N)C#N 66756 LPLWQZMMDQWUPY-RDTXWAMCSA-N 330.391 3.289 50 40 EGGB NC(=O)N/N=C/c1cc(Br)ccc1OCc1ccccc1 7894993 DOACKAVWFNESMM-GIJQJNRQSA-N 348.200 3.030 50 40 EGGB N#CC1=C(N)Nc2onc(-c3cccc(O)c3)c2[C@H]1c1ccccc1 100311781 LTZLRFSTKCEKKG-HNNXBMFYSA-N 330.347 3.298 50 40 EGGB N#CC1=C(S)N(c2ccccc2)[C@H](c2ccc(F)cc2)NC1=O 9111356 MTIXDDWAAOIRJP-OAHLLOKOSA-N 325.368 3.126 50 40 EGGB COc1cc(/C=N/NC(=O)NC23CC4CC(CC(C4)C2)C3)ccc1O 4897700 MVTPRRVVBKTNHH-RGVLZGJSSA-N 343.427 3.003 50 40 EGGB C[C@]12CCCC[C@@H]1[C@@H]2C(=O)N/N=C/c1ccc(Br)o1 408720635 AWISFTCZTGEBNJ-IKKDQCKNSA-N 325.206 3.319 50 40 EGGB Cc1ccc(CC(=O)N/N=C\c2ccc(Cl)c([N+](=O)[O-])c2)cc1 409366486 VGOCTIVGPYLAKW-ZDLGFXPLSA-N 331.759 3.249 50 40 EGGB Cc1ccc(/C=N/NC(=O)c2ccccc2O)cc1Br 562576 ALMQEYWONYIADW-RQZCQDPDSA-N 333.185 3.227 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)COc2cccc(C)c2C)cc1 4018511 TXVNNWGNYPOOHQ-HMMYKYKNSA-N 326.396 3.231 50 40 EGGB COc1ccc(/C=N/NC(=O)[C@@H](C)SCc2ccccc2)cc1 59371 FDLDGSUXMLEZQA-ONDHQXCVSA-N 328.437 3.467 50 40 EGGB COc1ccc(/C(C)=N\NC(=O)c2cc(-c3ccccc3)n[nH]2)cc1 13618586 LVFWIUBMGMTRED-MOSHPQCFSA-N 334.379 3.239 50 40 EGGB CC1(C)[C@@H]2C[C@@H]1CC=C2/C=N/NC(=O)Cc1cn2ccsc2n1 103202864 FDVMBSPLULNHSQ-GYICAMFKSA-N 328.441 3.033 50 40 EGGB C/C(=N/NC(=O)CNc1c(C)cccc1C)c1ccc([N+](=O)[O-])cc1 4077086 QONFTYCZLFBPRP-ZHZULCJRSA-N 340.383 3.164 50 40 EGGB CC(C)c1ccc2c(c1)/C(=N\NC(=O)c1c[nH]c3ccccc13)C(=O)N2 6171594 KWEFENOVHXTHDL-UHFFFAOYSA-N 346.390 3.378 50 40 EGGB COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C(\C#N)C(N)=S)o1 408541930 FWZXFTMDERSPJM-RMKNXTFCSA-N 329.337 3.056 50 40 EGGB COc1cccc(/C=N\NC(=O)Cc2ccc(C)cc2C)c1OC 216046332 MCTVFUVRLJDEKS-NDENLUEZSA-N 326.396 3.013 50 40 EGGB CCCOc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])cs2)cc1 4357430 XTYHWMIYNCQCBQ-CXUHLZMHSA-N 333.369 3.209 50 40 EGGB Cc1occc1C(=O)NNC(=O)C(c1ccccc1)c1ccccc1 378961 CYPOXBRYLJLRND-UHFFFAOYSA-N 334.375 3.181 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)CNc2ccc(C)cc2)cc1 57611181 SHHLQFQPEUHTFF-RCCKNPSSSA-N 325.412 3.346 50 40 EGGB COc1cc2c(cc1/C=N/NC(=O)[C@@H](C#N)c1ccccc1)CCCC2 409196715 WILKDTAFKQZMII-WQZUMXOESA-N 347.418 3.331 50 40 EGGB N#CC(C#N)=Cc1ccc(OCCOc2ccc([N+](=O)[O-])cc2)cc1 4182041 ZWWFQRUGBXOVHS-UHFFFAOYSA-N 335.319 3.483 50 40 EGGB CCOc1ccc(/C=N/NC(=O)CNc2ccccc2)c(OCC)c1 409384095 APSQZVWLJNTYJF-FYJGNVAPSA-N 341.411 3.046 50 40 EGGB C/C(=N\NC(=O)c1cccc(Cl)c1)c1ccc2c(c1)OCCO2 8043151 JPTZWZXARTWQOO-YBFXNURJSA-N 330.771 3.265 50 40 EGGB Cc1cc(-c2ccc(/C=C(/C#N)C(N)=O)o2)ccc1Br 207387911 GHAQUIGKCJWZFK-XFFZJAGNSA-N 331.169 3.410 50 40 EGGB CC1(C)[C@H]2CC[C@@](C(=O)O)(C2)[C@@]1(Br)CBr 100749280 OSNJXUXPWZALOC-BKDNQFJXSA-N 340.055 3.426 50 40 EGGB biogenic CCc1ccc(/C=N/NC(=O)c2ccc(Br)o2)s1 369591 ZDJVOYNPEDHNIE-VGOFMYFVSA-N 327.203 3.430 50 40 EGGB CC(C)(CCl)C(=O)Nc1cccc(NC(=O)C(C)(C)CCl)n1 3104460 VRZTVZBTJUBGJO-UHFFFAOYSA-N 346.258 3.489 50 40 EGGB NNC(=O)c1c(-c2ccccc2)csc1NC(=O)c1ccccc1 3141991 PZWXOASZOCDJDE-UHFFFAOYSA-N 337.404 3.271 50 40 EGGB CO[C@@H](C(=O)N/N=C/c1cccc(Br)c1)c1ccccc1 59371304 ABLNPULKRWSYFG-CLXYIWAZSA-N 347.212 3.287 50 40 EGGB O=C(COc1ccccc1)N/N=C(\c1ccccc1)c1cccnc1 4499152 IRDHZFDPTWRPGE-BSYVCWPDSA-N 331.375 3.029 50 40 EGGB Cc1c(C(=O)O)cccc1-c1ccc(/C=N\NC(=O)c2ccncc2)o1 408840989 HYQKFOHTWWIHOQ-NHDPSOOVSA-N 349.346 3.112 50 40 EGGB C=CCn1c(C)c(/C=N/NC(=O)[C@H](O)c2ccccc2)c2ccccc21 561533 XIPOLFAFJJKADI-YRXLECQKSA-N 347.418 3.319 50 40 EGGB CCOc1ccc(/C=N/NC(=O)COc2ccccc2OCC)cc1 3068673 PFASITSZCKJMFG-DEDYPNTBSA-N 342.395 3.013 50 40 EGGB C/C(=N\NC(=O)[C@@H]1COc2ccccc2O1)c1ccc(Cl)cc1 4694089 ZBNYUJQWPJBMBY-ZVCOJXFSSA-N 330.771 3.020 50 40 EGGB O=[N+]([O-])c1ccc([S@](=O)[C@H]2CCCC[C@@H]2Cl)c([N+](=O)[O-])c1 5215357 OMSWTTLZLNVEJO-UQKYIBTBSA-N 332.765 3.161 50 40 EGGB Cc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)c2ccccc2C3=O)cc1 20086647 CLYFIKGBPQXGNN-MRXNPFEDSA-N 342.354 3.136 50 40 EGGB Cc1cc(SC#N)ccc1NC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 102633175 DCJUMWRASSMCSD-GVARAGBVSA-N 328.393 3.030 50 40 EGGB COc1ccc(C)cc1[C@H](C)NC(=O)NNC(=O)c1ccc(C)cc1 10225024 ZVZNPFBPAVSBAM-AWEZNQCLSA-N 341.411 3.017 50 40 EGGB CCn1cc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c2ccccc21 408599096 ORRMOJMOJTUXQS-YBFXNURJSA-N 336.351 3.333 50 40 EGGB Cc1ccc(C)n1NC(=O)/C(C#N)=C\c1ccc(Br)o1 409376103 UMBMRLOZWXFMQA-XFFZJAGNSA-N 334.173 3.138 50 40 EGGB O=C(CNC1CCCCC1)N/N=C/c1ccc(-c2ccc(F)cc2)o1 409379960 DALUGNWXCVAAJF-WSDLNYQXSA-N 343.402 3.458 50 40 EGGB C[C@H](NC(=O)OCc1ccccc1)C(=O)NNc1ccccc1Cl 5641211 JUEDRCAMWYQAKS-LBPRGKRZSA-N 347.802 3.098 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)c2ccc(F)cc2)cc1OC 5597629 JTQABYWHXDNOIE-UDWIEESQSA-N 330.359 3.387 50 40 EGGB CCOC(=O)c1ccc(NC(=O)[C@H](Br)C(C)C)cc1 3097875 ZFPQUFOTIOUFRI-GFCCVEGCSA-N 328.206 3.221 50 40 EGGB CC(C)=C[C@H]1[C@@H](C(=O)NNC(=O)c2ccc3ccccc3n2)C1(C)C 31550348 ASSKLIRNSWATTK-YOEHRIQHSA-N 337.423 3.234 50 40 EGGB COC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1OCc1ccccc1F 509727 ODQWAXWKEMEGKL-GIJQJNRQSA-N 347.302 3.003 50 40 EGGB CCOC(=O)C/C(C)=N/NC(=O)[C@H](C)Sc1ccc(Cl)cc1 408729011 AFCJKRKGFOYDLB-MUOOZZNISA-N 342.848 3.266 50 40 EGGB COc1cccc(/C=N/NC(=O)CCSc2ccc(C)cc2)c1O 409148455 YTLCAVKGCCFSMP-XDHOZWIPSA-N 344.436 3.342 50 40 EGGB NNC(=O)c1ccc2nc(-c3cccc(Br)c3)sc2c1 73635159 NGVDOJPGJGXYRN-UHFFFAOYSA-N 348.225 3.329 50 40 EGGB N#CC1=C(N)n2c(nc3ccccc32)N[C@H]1c1ccnc2ccccc12 20086199 YSIMYVHONCOKHW-SFHVURJKSA-N 338.374 3.402 50 40 EGGB COc1cccc(/C=N/NC(=O)c2ccc(C(C)(C)C)cc2)c1O 512500 SQHOCELWQCYHGR-UDWIEESQSA-N 326.396 3.462 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@H]1c1cccc(F)c1 140048 ADTGQYDUFYTNEA-ZDUSSCGKSA-N 338.367 3.495 50 40 EGGB CC(C)c1ccc(NC(=O)C(=O)N/N=C/c2ccccc2F)cc1 59515506 IVOYTUVXRJZHNC-RGVLZGJSSA-N 327.359 3.038 50 40 EGGB CC(C)(C)OC(=O)N[C@@]12CC[C@@](C)(C(=O)[C@@H]1Br)C2(C)C 256049487 ADRKMYVTOLYUQX-LNHVQRHZSA-N 346.265 3.422 50 40 EGGB Cc1cc(C)n(Cc2cccc(C(=O)N/N=C/c3cccc(O)c3)c2)n1 130610 WOJNXZVEKFEGHF-CIAFOILYSA-N 348.406 3.018 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccccc2Cl)cc1[N+](=O)[O-] 566375 QIVMWZFZQXCEFT-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB Cc1nn(C)c2c1[C@@H](c1cccc(Cl)c1Cl)C(C#N)=C(N)O2 5792677 UCVDVGIKSCGHRQ-LBPRGKRZSA-N 335.194 3.254 50 40 EGGB Cc1cc(N2CCCC2)c(F)cc1/C=N/NC(=O)c1ccc(O)cc1 6545705 OJMDQGQPTDSRFR-CIAFOILYSA-N 341.386 3.204 50 40 EGGB NNC(=O)c1sc2cc(C(F)(F)F)cnc2c1-c1ccco1 4052991 UFLWPALZGYDNBZ-UHFFFAOYSA-N 327.287 3.179 50 40 EGGB COc1cc2c(cc1/C=N/NC(=O)c1ccc(C)c(Cl)c1)OCO2 409051325 KVIHPKDJQRREHU-UFWORHAWSA-N 346.770 3.150 50 40 EGGB C/C(=N\NC(=O)Cc1ccc(C)cc1C)c1ccc2c(c1)OCCO2 216047942 SFJCUKCZLHRVDZ-RCCKNPSSSA-N 338.407 3.158 50 40 EGGB CC(C)N(C[C@@H]1CCCCN1C(=O)CCl)C(=O)OC(C)(C)C 79408863 AUXPOJFEALAAGN-ZDUSSCGKSA-N 332.872 3.252 50 40 EGGB Cn1nnc2cc(/C=C(\C#N)C(=O)c3c[nH]c4ccccc34)ccc21 98052755 KQHZMQCNIMFVLN-MDWZMJQESA-N 327.347 3.239 50 40 EGGB Cc1ccc(O)c(/C=N/NC(=O)c2ccc(Br)cc2)c1 64378 ABBZNALNNRSGFS-RQZCQDPDSA-N 333.185 3.227 50 40 EGGB Cc1nc2ccccn2c1C(=O)N/N=C/c1ccccc1C(F)(F)F 6210478 GDQMIJRASDIXHQ-UFFVCSGVSA-N 346.312 3.425 50 40 EGGB CCOc1cc(/C=C(/C#N)C(N)=O)ccc1OCc1ccc(F)cc1 33410031 OJJOUNDEXRXQHO-DHDCSXOGSA-N 340.354 3.196 50 40 EGGB C/C(CC(=O)Nc1cccc(F)c1)=N\NC(=O)c1cccc(C)c1 4713783 XQJLNYUUCPUPJD-FYJGNVAPSA-N 327.359 3.269 50 40 EGGB FC(F)(F)C1(C(F)(F)F)N[C@H]2[C@@H](Cl)[C@@H]1C[C@H]2OCCCl 4580428 GCFPUWPAGCMEBN-BNHYGAARSA-N 346.098 3.073 50 40 EGGB Cc1c(C(=O)N/N=C/c2c(F)cccc2Cl)cccc1[N+](=O)[O-] 409185554 MKGBEPZDQQDBGT-QGMBQPNBSA-N 335.722 3.460 50 40 EGGB C[C@H](Br)C(=O)NC[C@H](OCC1CC1)c1ccccc1F 95097944 GQXCQUKGJJGJFG-HZMBPMFUSA-N 344.224 3.193 50 40 EGGB C/C(=N/NC(=O)C[n+]1ccccc1)c1ccc(-c2ccccc2)cc1 5826587 MZSCUEUFEOLUIU-XLNRJJMWSA-O 330.411 3.182 50 40 EGGB FC(F)(F)C1(C(F)(F)F)N[C@@H]2[C@H](Cl)C[C@H]1[C@H]2Br 2190288 JSDWVKURFFDIKI-NRXMZTRTSA-N 346.496 3.212 50 40 EGGB CCOC(=O)c1ccc(NC(=O)[C@@H](Br)C(C)C)cc1 3097876 ZFPQUFOTIOUFRI-LBPRGKRZSA-N 328.206 3.221 50 40 EGGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@@H]1[C@@]12C=C[C@@H](CC1)C2 406836 LDIVSFFWSCEOTP-RBOBLBHYSA-N 332.359 3.319 50 40 EGGB Cc1c(/C=N/NC(=O)[C@H](C)Oc2ccccc2)c2ccccc2n1C 2072771 FXOYODJLLXBKGK-PCXKXAPESA-N 335.407 3.404 50 40 EGGB COc1ccc(NC(=O)C(=O)NN=C2CCCCCC2)cc1Cl 58885812 ZWHDGAUUMPTGKC-UHFFFAOYSA-N 337.807 3.114 50 40 EGGB O=C(N/N=C1/CCCCc2ccccc21)c1ccc2c(c1)OCCO2 84606386 YXFHIPDEBWKODT-FXBPSFAMSA-N 336.391 3.318 50 40 EGGB Cc1cccc2c1N=C(O)/C2=N\NC(=O)COc1ccc(Cl)cc1 13146213 UTEKUXOZCAOUNR-UHFFFAOYSA-N 343.770 3.149 50 40 EGGB C/C(=N/NC(=O)c1ccc(Br)cc1)c1cc(O)ccc1O 4670426 WJHNYZUWLRWKHE-MFOYZWKCSA-N 349.184 3.014 50 40 EGGB COC(=O)C1=C(C)OC(n2cccc2)=C(C#N)[C@@H]1c1ccc(O)cc1 4751947 IHLZXERAPQZXSO-KRWDZBQOSA-N 336.347 3.147 50 40 EGGB Cc1ccc(/C=N/NC(=O)CNc2ccc(Cl)cc2)cc1[N+](=O)[O-] 409360903 GCCXBORTUGYHHI-DJKKODMXSA-N 346.774 3.119 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)c(F)c1 408968866 ZUWDYUIVBZJGMS-UFWORHAWSA-N 346.705 3.023 50 40 EGGB CCOc1ccc2nc(SCC(=O)/C(C#N)=C(/C)N)sc2c1 25748524 NJGCFGTVEUUZDF-LUAWRHEFSA-N 333.438 3.112 50 40 EGGB NNC(=O)c1ccc(-c2ccc(Br)c(C(F)(F)F)c2)o1 226359375 FQTOFTOKWPFPHM-UHFFFAOYSA-N 349.106 3.331 50 40 EGGB CNC(=O)/C(C#N)=C/c1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 83672 XMTRHNOVZVJPIS-RMKNXTFCSA-N 331.715 3.161 50 40 EGGB NNC(=O)c1[nH]c2ccc(Br)cc2c1-c1ccccc1 551590 JOMNNJPPADTBDU-UHFFFAOYSA-N 330.185 3.201 50 40 EGGB Nc1c(Cl)c(Cl)nc(C(=O)N/N=C2/C[C@@H]3C=CC[C@@H]23)c1Cl 36512075 BMGDJAKJQRFAJL-ATDVRCTASA-N 345.617 3.306 50 40 EGGB C=CCn1c(C)cc(C(=O)COC(=O)/C(C#N)=C\c2ccco2)c1C 6683556 NZUISBIQXFNONT-GDNBJRDFSA-N 338.363 3.217 50 40 EGGB CCOC(=O)/C(C#N)=C\c1ccc(-c2ccc(C(=O)OC)cc2)o1 33299874 JAJVAWVYULVHBH-UVTDQMKNSA-N 325.320 3.203 50 40 EGGB COc1cc(/C=C/C(=O)NN)cc(Cl)c1OCc1ccccc1C 226335183 XZEALQDARNVTCQ-BQYQJAHWSA-N 346.814 3.239 50 40 EGGB CC[C@H](Nc1ccc(C)cc1)C(=O)N/N=C/c1ccc([N+](=O)[O-])s1 369813 WMTCNTOLVJQKPU-FBJMNJBLSA-N 346.412 3.306 50 40 EGGB C[C@@H](Sc1ncccn1)C(=O)/C(C#N)=C1/Nc2ccccc2S1 102349534 IQBBAYNNODJIKQ-BXSDCGNMSA-N 340.433 3.479 50 40 EGGB O=C(NNC(=O)c1ccccc1Cc1ccccc1)c1ccccc1O 13021510 PGPWJZKEHGAEED-UHFFFAOYSA-N 346.386 3.058 50 40 EGGB O=C(CNc1ccccc1)N/N=C1\CCSc2ccc(F)cc21 6297418 NABQDPFEXLJGGV-HMMYKYKNSA-N 329.400 3.254 50 40 EGGB N#C/C(=C\c1ccc(OCc2ccccc2F)c(Cl)c1)C(N)=O 408881381 KWZJTDHXPHANSA-NTUHNPAUSA-N 330.746 3.450 50 40 EGGB O=C(O)[C@H](Br)[C@H](Br)c1ccc(F)cc1 526059820 OVVPLFMUTUDGCL-HTQZYQBOSA-N 325.959 3.110 50 40 EGGB N#CC1=C(N)Oc2c(ccc3cccnc23)[C@H]1c1ccc2c(c1)OCO2 5338222 BRCQFBWKIOXEDA-QGZVFWFLSA-N 343.342 3.182 50 40 EGGB C/C(=N\NC(=O)c1cc(Br)ccc1O)c1ccc(O)cc1 5621019 QPZKDXXAGZWVFQ-RQZCQDPDSA-N 349.184 3.014 50 40 EGGB O=C(NCCc1ccc(F)cc1)NNc1nc2ccccc2s1 40058090 DKVXYGAGQFOXPF-UHFFFAOYSA-N 330.388 3.304 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)c2[nH]ncc2Br)cc1 362181 VOHZOTILZQDFNJ-FRKPEAEDSA-N 335.205 3.060 50 40 EGGB COc1ccc([C@H]2C(C#N)=C(N)OC(C)=C2C(=O)OC(C)(C)C)cc1 2697925 DPUOKTNKCXIURH-INIZCTEOSA-N 342.395 3.119 50 40 EGGB NNC(=O)/C=C/c1ccc(OCc2ccccc2)c(Br)c1 226332300 WLXJXOYOHXFIQK-VQHVLOKHSA-N 347.212 3.031 50 40 EGGB O=C(CNc1cccc2ccccc12)N/N=C/c1ccccc1[N+](=O)[O-] 261702 GGEICWWBEVNXCZ-CIAFOILYSA-N 348.362 3.310 50 40 EGGB CC(=O)c1cccc(N/C=C(/C#N)S(=O)(=O)c2ccc(C)cc2)c1 100944704 YYAZYRLZGVKKLC-PDGQHHTCSA-N 340.404 3.448 50 40 EGGB O=C(NNC(=O)c1ccc(COc2ccccc2)cc1)c1ccccc1 3431138 LIPHFTLJKBNFNK-UHFFFAOYSA-N 346.386 3.340 50 40 EGGB CCOc1ccc([C@@H](O)CCC(=O)N/N=C/c2cccs2)cc1 58892604 TULMJBJWKIXDRF-IQFISFIMSA-N 332.425 3.111 50 40 EGGB O=C(CSCCc1ccccc1)N/N=C/c1cccc([N+](=O)[O-])c1 408724726 AEHBBESABBGBSC-LDADJPATSA-N 343.408 3.021 50 40 EGGB O=C(N/N=C/c1ccoc1)c1ccc(OC(F)(F)C(F)F)cc1 5944657 GCMNQMOGOJHJFX-FBCYGCLPSA-N 330.237 3.280 50 40 EGGB COC(=O)COc1ccc(/C=C(/C#N)c2nc3ccc(C)cc3[nH]2)cc1 33855651 MZMONAPEFQKECB-GDNBJRDFSA-N 347.374 3.487 50 40 EGGB CCCOc1ccc(/C=C(\C#N)C(=O)N2CCCC2)cc1OCC 192556800 QPYBZORXWKZBSQ-FOWTUZBSSA-N 328.412 3.403 50 40 EGGB CCOc1cc(/C=N/NC(=O)c2ccc(F)cc2)cc(Cl)c1O 96892968 FGADQTGSHQEDTI-DJKKODMXSA-N 336.750 3.347 50 40 EGGB COc1cc2ccccc2cc1C(=O)N/N=C/c1ccc(O)cc1O 3114983 NXZZTEBKGNESKZ-RGVLZGJSSA-N 336.347 3.024 50 40 EGGB N#CC(C#N)=Cc1cc(Br)cc(Br)c1O 5567099 RHUDAPGQBCMKIA-UHFFFAOYSA-N 327.963 3.348 50 40 EGGB NC(=O)N/N=C(\C=C\c1ccccc1)C[C@@H]1OC(=O)c2ccccc21 5899195 GATAKOZDABKIEB-YMGQHWIJSA-N 335.363 3.026 50 40 EGGB O=C(N/N=C/c1ccco1)[C@H]1Oc2ccccc2O[C@@H]1c1ccccc1 1470152 FCDVMPIMSLNVSI-DBLSVSNQSA-N 348.358 3.311 50 40 EGGB O[C@@H](COc1cccc2ccccc12)CN(CCCl)CCCl 6118680 URWCLWXLBSIIII-OAHLLOKOSA-N 342.266 3.359 50 40 EGGB CN(CC(=O)N/N=C/c1cccc(Br)c1)c1ccccc1 59782 NINQWRZEXJDZQS-WOJGMQOQSA-N 346.228 3.036 50 40 EGGB COc1ccccc1C(=O)NNc1nc2c(F)cc(F)cc2s1 4121498 CBBOQNFHQWXAEY-UHFFFAOYSA-N 335.335 3.340 50 40 EGGB CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(O)ccc32)cc1OC 203814 NJVBRWZHIJFNCW-GOSISDBHSA-N 338.363 3.018 50 40 EGGB COC(=O)c1ccc(C(=O)NNc2nc3ccc(C)cc3s2)cc1 4121385 HVISZTRBAQKHOG-UHFFFAOYSA-N 341.392 3.148 50 40 EGGB CCOc1cc([C@H]2C(C#N)=C(N)OC(C(C)(C)C)=C2C#N)ccc1O 1004514 ALFQUVGWFGCQBU-MRXNPFEDSA-N 339.395 3.422 50 40 EGGB COC(=O)c1ccc(/C=N/NC(=O)c2ccccc2-n2cccc2)cc1 1001385 ZZEIQFQPDUUVNH-KGENOOAVSA-N 347.374 3.028 50 40 EGGB CCCC[C@@H](CC)CNC(=O)NNC(=O)c1cn(C)c2ccccc12 29336735 FNJJECQZPLJQSN-CQSZACIVSA-N 344.459 3.339 50 40 EGGB CCC(CC)=NNC(=O)[C@H](NC(=O)c1ccccc1)c1ccccc1 4416300 SFIXPIMYZXRBOI-GOSISDBHSA-N 337.423 3.450 50 40 EGGB COc1cc(Cl)c(/C=C(\C#N)C(=O)n2nc(C)cc2C)cc1OC 409381939 IJGRWHVBEMABMT-AWNIVKPZSA-N 345.786 3.418 50 40 EGGB C#CCn1cc(/C=N/NC(=O)c2ccccc2OC)c2ccccc21 409368021 LNVRYHZCKWKTRY-FYJGNVAPSA-N 331.375 3.047 50 40 EGGB N#Cc1ccc(/C=N/NC(=O)Cc2cccc(C(F)(F)F)c2)cc1 573117 BNKGUTARWJTFEZ-SSDVNMTOSA-N 331.297 3.270 50 40 EGGB O=[N+]([O-])c1ccc(CBr)c(I)c1 1870470 CSGDIBWHUNXCJM-UHFFFAOYSA-N 341.930 3.094 50 40 EGGB COc1ccc(CC(=O)N/N=C(\C)c2ccc(C)c(C)c2)cc1OC 409362762 KBOSABCINQKUAR-RCCKNPSSSA-N 340.423 3.404 50 40 EGGB COc1ccc(CNC(=O)/C(C#N)=C\c2ccc(OC)c(C)c2)cc1 408811631 LSBOQHYMBGPHMA-BOPFTXTBSA-N 336.391 3.236 50 40 EGGB C/C(=N\NC(=O)Cc1ccc(C)cc1C)c1cccc([N+](=O)[O-])c1 216047466 BVZMBTBWCMMVNR-XMHGGMMESA-N 325.368 3.295 50 40 EGGB COc1ccc([N+](=O)[O-])cc1NC(=O)/C(C#N)=C/c1ccc(C)cc1 408889970 LXYHEGMMPZAXKU-NTEUORMPSA-N 337.335 3.458 50 40 EGGB CCOC(=O)[C@]1(C#N)C(N)=C(C#N)C2=C(CCC2)[C@@H]1c1ccccc1 35193597 JPYJMELVGHVDJM-PXNSSMCTSA-N 333.391 3.074 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@H]2C)cc1OC 7158000 PAQUYLBHAIVTAD-KEMCMDKTSA-N 328.412 3.306 50 40 EGGB CCOc1ccc(/C=C(/C#N)S(=O)(=O)c2ccccc2)cc1OC 32120416 FKBRDMWOZJEFPP-WJDWOHSUSA-N 343.404 3.432 50 40 EGGB N#C/C(=C\C1=Cc2ccccc2OC1)C(=O)NCCc1ccccc1 574670 JBYXTRQPXCQPPQ-CPNJWEJPSA-N 330.387 3.271 50 40 EGGB C[C@@]1(C(=O)Nc2c(F)c(F)c(F)c(F)c2F)C[C@H]1Br 2311934 HQOLHAYYEOJGGN-HOKCGOGBSA-N 344.077 3.494 50 40 EGGB Cc1ccsc1[C@H]1C(C#N)=C(N)Oc2n[nH]c(C(F)(F)F)c21 5818644 OPAIFEZWBFLGTE-ZETCQYMHSA-N 326.303 3.017 50 40 EGGB Cc1cc(/C=N/NC(=O)c2ccccc2Br)c(C)n1C 408770785 AMSQFALHHWPUKA-RQZCQDPDSA-N 334.217 3.168 50 40 EGGB COc1ccc(CC(=O)N/N=C(\C)c2cc(C)ccc2C)cc1OC 409366847 ZLJWILKBRYKMFO-RCCKNPSSSA-N 340.423 3.404 50 40 EGGB Cc1ccc(NC(=O)COC(=O)c2ccc(C=C(C#N)C#N)cc2)cc1 409214298 XGCHARNGHRRLNB-UHFFFAOYSA-N 345.358 3.221 50 40 EGGB N#Cc1ccc(/C=N/NC(=O)CNc2cccc(C(F)(F)F)c2)cc1 33729425 JWRQPTBESSLZEI-AUEPDCJTSA-N 346.312 3.139 50 40 EGGB O=C(CNc1ccccc1)N/N=C/c1ccc(Br)cc1 251819 ZYTZFEJSJSNLAT-VCHYOVAHSA-N 332.201 3.011 50 40 EGGB COc1ccc(S(=O)(=O)/C(C#N)=C\Nc2ccc(F)cc2)cc1 102737448 GSWNZCWXQLAXJK-WJDWOHSUSA-N 332.356 3.085 50 40 EGGB C/C(=N\NC(=O)CNc1cccc2ccccc12)c1ccc(O)cc1O 409392044 NIRRYSDQYDCKIJ-LPYMAVHISA-N 349.390 3.203 50 40 EGGB Cc1c(C(=O)Nc2ccc(SC#N)cc2)nnn1-c1ccccc1 4511656 QAAKFILMTHUYQD-UHFFFAOYSA-N 335.392 3.401 50 40 EGGB C=CCn1c(C)c(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)c2ccccc21 408820193 UKZWDEIQCBDKKH-MOKGIYGOSA-N 349.434 3.338 50 40 EGGB Cc1cc(N2CCOCC2)ccc1/C=C(/C#N)C(=O)Nc1ccccc1 409068903 ULVNMWZAXUPZPI-JXAWBTAJSA-N 347.418 3.377 50 40 EGGB CCc1cc(C)cc(OCCOc2ccc(/C=N/NC(N)=O)cc2)c1 4510888 UCEOVHHKNYCAIL-FYJGNVAPSA-N 341.411 3.017 50 40 EGGB O=C(N/N=C/c1cccc(F)c1)C(O)(c1ccccc1)c1ccccc1 3064617 WSFZCSDJQLHUDR-HZHRSRAPSA-N 348.377 3.212 50 40 EGGB COc1ccccc1NC(=O)N/N=C\c1cc(OC)c(OC)cc1C 408548819 LQNABJSLHABROD-ODLFYWEKSA-N 343.383 3.176 50 40 EGGB N#C/C(=C\c1ccccc1OCc1ccc(F)cc1Cl)C(N)=O 17067892 YXTHDIJBBJYBMS-NTUHNPAUSA-N 330.746 3.450 50 40 EGGB N#CC1=C(S)NC(=N)[C@H](C(=O)Nc2ccccc2)C12CCCCC2 14671712 HOVPAEIABJXDNZ-CQSZACIVSA-N 340.452 3.437 50 40 EGGB N#C/C(=C/Nc1cccc2cccnc12)S(=O)(=O)c1ccccc1 100439154 ZRPXYMQGBXYMSQ-SSZFMOIBSA-N 335.388 3.486 50 40 EGGB CC(=O)c1cccc(N2Cc3ccccc3/C2=N\C(=O)CCl)c1 12504581 BOIOQQLTDKMNRQ-CZIZESTLSA-N 326.783 3.421 50 40 EGGB C#CCOc1c(Cl)cc(/C=C(\C#N)C(=O)NCCC)cc1OCC 4599670 QUZACZZAJJKVFD-NTEUORMPSA-N 346.814 3.184 50 40 EGGB O=C(CSc1nc2ccccc2s1)N/N=C1/C[C@H]2C=CC[C@H]12 96708541 WXDJVUBAJRYXDR-IEVFTTQPSA-N 329.450 3.457 50 40 EGGB O=C(CBr)Nc1cccc(C(=O)N2CCCCCC2)c1 35605401 OZHRKMVPKHVSNE-UHFFFAOYSA-N 339.233 3.036 50 40 EGGB Cc1cc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)c(C)n1-c1ccccc1 7159838 ZDHNCLQVQLHLLN-YWFITGJYSA-N 349.434 3.296 50 40 EGGB Cc1ccccc1NC(=O)N/N=C\c1ccc(O[C@@H](C)C(=O)O)cc1 208350703 AVLMJLUIONKRKX-JFENUBAZSA-N 341.367 3.003 50 40 EGGB CC(C)COc1ccc(C(=O)NNC(=O)c2ccc(Cl)cc2)cc1 568800 AEDPJALBZUYSFL-UHFFFAOYSA-N 346.814 3.450 50 40 EGGB COc1ccc(CCCC(=O)N/N=C\c2ccccc2O)cc1C 4534851 UWFYVDIZGGVYDP-MOSHPQCFSA-N 326.396 3.182 50 40 EGGB CCc1ccc(CC(=O)N/N=C(\C)c2ccc(OC)cc2OC)cc1 409365715 WKQMUUKMXMHDBX-KGENOOAVSA-N 340.423 3.349 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2O)c(Cl)c1 9190614 AQCJJCAENGEFOS-CAOOACKPSA-N 333.731 3.026 50 40 EGGB O=C(NNC(=O)C1c2ccccc2Oc2ccccc21)c1ccccc1 6790455 CHIDVWIFFCZJQN-UHFFFAOYSA-N 344.370 3.385 50 40 EGGB Cc1c(Cl)cccc1NC(=O)NNC(=O)CCc1ccccc1 15933961 GTMAQXAEGFVSER-UHFFFAOYSA-N 331.803 3.434 50 40 EGGB C/C(=N\NC(=O)CSc1ccccc1)c1ccc2c(c1)OCCO2 408831499 VXAHBDFBQOGFFI-CPNJWEJPSA-N 342.420 3.090 50 40 EGGB CCCCNC(=O)/C(C#N)=C/c1cnn(Cc2ccccc2Cl)c1 17699295 NVEVOIGDAAYDEX-CXUHLZMHSA-N 342.830 3.408 50 40 EGGB N#C/C(=C/c1cc(Br)ccc1O)C(=O)NC1CCCC1 409191284 UMABZHVERZSSRI-XFFZJAGNSA-N 335.201 3.120 50 40 EGGB CCOc1ccc(C(=O)NN)cc1COc1ccccc1C(C)C 224561667 ZODVCGONNIWZEE-UHFFFAOYSA-N 328.412 3.391 50 40 EGGB Cc1cccc(OCC(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)c1 59045 HENILGQKCQSUFO-GIJQJNRQSA-N 347.758 3.086 50 40 EGGB COc1ccc(C(=O)NNc2nc3c(F)cc(F)cc3s2)cc1 429776 SVVKBXDSAXGURQ-UHFFFAOYSA-N 335.335 3.340 50 40 EGGB CC(C)COc1ccc(/C=N/NC(=O)c2ccc(C#N)cc2F)cc1 564279 GJWOZPVLHPNNEU-SSDVNMTOSA-N 339.370 3.496 50 40 EGGB O=C(N/N=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccccn1 520222 AEUZRDRWZPDOKL-YBFXNURJSA-N 336.307 3.014 50 40 EGGB CCOC(=O)[C@@]1(C#N)C(=O)[C@@H](c2ccccc2)[C@@H]2CCCCC2=C1C#N 4910837 UOSFJDGSTWTMSR-PLMTUMEDSA-N 348.402 3.436 50 40 EGGB O=C(CCl)N(Cc1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 4976342 NFFUWGHGMRTPJZ-UHFFFAOYSA-N 349.730 3.275 50 40 EGGB N#C/C(=C/C=C/c1ccco1)C(=O)N1CCN(c2ccccc2)CC1 59332919 XWGQKARJNPFOFV-FBIGONLHSA-N 333.391 3.092 50 40 EGGB Cc1cc(/C=C(\C#N)C(=O)NCc2ccco2)c(C)n1-c1cccnc1 37858825 ROMNKFLHMPMTJP-LICLKQGHSA-N 346.390 3.306 50 40 EGGB CCn1c(C)nc2cc(C(=O)N/N=C(\C)c3ccc(C#N)cc3)ccc21 5657939 DCKQMDANCKAREW-YDZHTSKRSA-N 345.406 3.390 50 40 EGGB C=CCOc1ccc(Cl)cc1/C=C(\C#N)c1n[nH]c(N)c1C#N 8565354 PYJKJHASIUUJNV-IZZDOVSWSA-N 325.759 3.146 50 40 EGGB Cc1ccc(CC(=O)N/N=C\c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 216045884 PEHHXGKOQUEJON-ODLFYWEKSA-N 325.368 3.213 50 40 EGGB O=C(N/N=C/c1ccc(O)cc1)[C@H](c1ccccc1)N1CCCCC1 1698283 LOOMXCCCBNBOIO-QTKYHAHDSA-N 337.423 3.070 50 40 EGGB CCOc1ccc(C(=O)N/N=C(\C)c2ccc(OC)cc2OC)cc1 250709 KPCGNLMQZQFOQP-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB O=C(COc1ccccc1-c1ccccc1)N/N=C/c1ccncc1 307912 PZIRXASKSPFFPZ-HYARGMPZSA-N 331.375 3.278 50 40 EGGB Cn1cc(/C=N/NC(=O)c2cc(-c3ccccc3)n[nH]2)c2ccccc21 4045411 RDVQIBVDVSBKSN-CIAFOILYSA-N 343.390 3.332 50 40 EGGB CCC1=C(C(=O)OC)[C@@H](c2c(F)cccc2Cl)C(C#N)=C(N)O1 4652919 SIMSEZFDIJFKPW-GFCCVEGCSA-N 336.750 3.124 50 40 EGGB Cc1c(C(=O)NN)c2ccccc2n1C(=O)Cc1ccc(Cl)cc1 216952219 TVKCDEOFIWPZJT-UHFFFAOYSA-N 341.798 3.090 50 40 EGGB COc1ccc(/C(C)=N\NC(=O)CCc2ccccc2)c(OC)c1 12403857 WPQALEXYLDOMOC-ZHZULCJRSA-N 326.396 3.177 50 40 EGGB O=C(N/N=C(\c1ccc(O)cc1)c1ccc(F)cc1)c1ccncc1 16400116 FYMSPUOXPIBELX-PYCFMQQDSA-N 335.338 3.109 50 40 EGGB C[C@@H]1CC(C)(C)N(C)c2cc(Cl)c(/C=N/NC(=O)CC#N)cc21 208248229 LOCXJYSSWPXWHQ-JZOCJUILSA-N 332.835 3.426 50 40 EGGB CCCC1=C(C(=O)OCC)[C@H](c2ccc(C)cc2)C(C#N)=C(N)O1 71037 UQVPSMNKVTWLGT-MRXNPFEDSA-N 326.396 3.420 50 40 EGGB Cc1ccc([N+](=O)[O-])cc1NC(C#N)=C1C(=O)c2ccccc2C1=O 149277 ILBRTMZGIUBLPH-UHFFFAOYSA-N 333.303 3.172 50 40 EGGB COc1cc(/C=C(\C#N)c2nc(N)c3ccccc3n2)cc(OC)c1 32922436 CJHHFOQLSJBGHK-NTUHNPAUSA-N 332.363 3.293 50 40 EGGB C[C@H]1CCCCN1c1c([N+](=O)[O-])cc(C(=O)Cl)cc1[N+](=O)[O-] 26508760 ABOMGKXEZHYVBC-QMMMGPOBSA-N 327.724 3.261 50 40 EGGB C[C@H](NC(=O)/C(C#N)=C\c1ccco1)c1cccc(-n2ccnc2)c1 98014013 KUYDEQMHUNYEKE-HNDQUVLASA-N 332.363 3.250 50 40 EGGB C/C(CCc1ccccc1)=N\NC(=O)C(=O)Nc1cc(C)ccc1C 5542441 PJRMANKDZKIKFP-CJLVFECKSA-N 337.423 3.367 50 40 EGGB COc1cccc([C@@H]2C(C#N)=C(N)N3C(=C2C#N)Nc2ccccc23)c1 494324 BOSOPCOGHIDIQR-GOSISDBHSA-N 341.374 3.154 50 40 EGGB Nc1c(Cl)c(Cl)nc(C(=O)N/N=C2/C[C@H]3C=CC[C@H]23)c1Cl 36512078 BMGDJAKJQRFAJL-ZZBWHZSISA-N 345.617 3.306 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)CC[C@H](O)c2ccccc2)o1 83333625 NTXGFGUWCZDPIG-TYSUYXETSA-N 343.427 3.090 50 40 EGGB C[C@@H](SCc1ccccc1)C(=O)N/N=C/c1ccc2c(c1)OCO2 313768 FXADSQLHWMYJFX-BUESGFEBSA-N 342.420 3.187 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@H](c2cccc([N+](=O)[O-])c2)[C@@H]2CCCC=C12 19907364 CFCRPALWGIWYGO-NVXWUHKLSA-N 345.362 3.188 50 40 EGGB COc1cc(/C=C(\C#N)S(=O)(=O)c2ccc(C)cc2)ccc1O 33286546 VDYAQJOPYRKHTJ-OQLLNIDSSA-N 329.377 3.048 50 40 EGGB CCC(=O)NNC(=O)CSc1nc2c(C)c(C)ccc2cc1CC 4849426 XRGDGRTYWYLDSP-UHFFFAOYSA-N 345.468 3.064 50 40 EGGB O=C(Cc1cn2ccsc2n1)NNc1ccccc1C(F)(F)F 68773695 WFXZNGRUHPJDAU-UHFFFAOYSA-N 340.330 3.100 50 40 EGGB Cc1cc2c(cc1C)CN(c1ccc(/C=N/NC(=O)CC#N)cc1)C2 826168 YOQVWVUDSWIJAD-SSDVNMTOSA-N 332.407 3.187 50 40 EGGB CCN1C(=O)/C(=N\NC(=O)c2ccc(C(C)(C)C)cc2)c2ccccc21 11613907 WYISZIRVUGSNMP-PYCFMQQDSA-N 349.434 3.485 50 40 EGGB COc1cc(C)c(/C=C(/C#N)C(=O)NC2CCCCC2)cc1OC 6418626 XRGTYNNTBYOGSI-GDNBJRDFSA-N 328.412 3.368 50 40 EGGB CCCC1=C(C(=O)OCC)[C@H](c2ccc(OC)cc2)C(C#N)=C(N)O1 71041 NNUVQEQMXDTDPP-MRXNPFEDSA-N 342.395 3.120 50 40 EGGB Cc1ccc(NCC(=O)N/N=C/C=C/c2cccc([N+](=O)[O-])c2)cc1 3102533 BIBOXVBVSKFVMA-YWYWFQEUSA-N 338.367 3.131 50 40 EGGB C[C@@]12[C@H]3[C@@H]4C[C@@H]5[C@@H]3[C@](O)(c3ccccc3)[C@@H]1[C@@H]5[C@@H]4[C@@H]2Br 100940619 SZCGKEUXKLALMI-SLUVSUPGSA-N 331.253 3.416 50 40 EGGB COc1ccccc1/C=N/NC(=O)CSCc1ccc(C)cc1 59473074 TVVKXGCAQKVXPE-YBFXNURJSA-N 328.437 3.387 50 40 EGGB CCOc1cccc(/C=N/NC(=O)c2cc3c(s2)CCCC3)c1O 2658716 JOAPIUOMCYSXEI-YBFXNURJSA-N 344.436 3.495 50 40 EGGB COc1cccc(/C=C(\C#N)C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c1 4673238 DWQJZMFEUUPBAO-NTEUORMPSA-N 337.335 3.458 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2F)cc1OC 7156485 WHUYXBATTHCGTB-UKTHLTGXSA-N 326.327 3.389 50 40 EGGB C/C(=N\NC(=O)CNc1cccc(C(F)(F)F)c1)c1cccnc1 7987646 KCJIPAHFMVPOAN-SSDVNMTOSA-N 336.317 3.053 50 40 EGGB Cc1ccc(C(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)c(Cl)c1 408563474 MPCUYGKDLVQDML-UHFFFAOYSA-N 346.736 3.452 50 40 EGGB COc1ccc(C(=O)N/N=C/c2ccc(Cl)cc2Cl)c(O)c1 409392883 STFAUPOEJFPORX-QGMBQPNBSA-N 339.178 3.472 50 40 EGGB COc1cc(/C=C(/C#N)c2ccc(C(=O)O)cc2)cc(OC)c1OC 408541793 FVOUEZMCXHMXRV-NVNXTCNLSA-N 339.347 3.475 50 40 EGGB C#CCOc1ccc2ccccc2c1/C=N\NC(=O)c1ccncc1 38365867 OKAZEZNZLINADI-HMAPJEAMSA-N 329.359 3.011 50 40 EGGB C#C[C@]1(O)CC[C@@H]2[C@@H]3[C@H](CC[C@@]21C)[C@@]1(OO)CCC(=O)C=C1C[C@H]3C 1569999102 RURMXFRHKGLDHX-SYLAHVFFSA-N 344.451 3.351 50 40 EGGB O=C(NCCCl)N1CCn2cccc2[C@@H]1c1ccc(F)c(F)c1 4854446 LAHRDCOYDZYPIH-HNNXBMFYSA-N 339.773 3.120 50 40 EGGB CCOc1ccc(NC(=O)/C(C#N)=C/c2cccc(OC)c2O)cc1 408744688 MNFVJWPSOVWYKY-SDNWHVSQSA-N 338.363 3.345 50 40 EGGB ClCc1nc(-c2ccc(N3CCc4ccccc4C3)nc2)no1 98063846 RTYOCBSLEFWAFT-UHFFFAOYSA-N 326.787 3.433 50 40 EGGB C/C(=N\NC(=O)c1ccc(Br)cc1)c1ccc(O)cc1 5289010 XPEHTSFWYLTKGA-LICLKQGHSA-N 333.185 3.309 50 40 EGGB Cc1cc2c(cc1/C=C(\C#N)C(=O)N[C@@H]1CCCC[C@H]1C)OCO2 5006603 FFTNFDAMRYEIRM-AWDJIVMYSA-N 326.396 3.326 50 40 EGGB Cn1/c(=N\NC(=O)c2cccc(OC(F)F)c2)sc2ccccc21 3360803 VFKBJGYCPDYLFX-CAPFRKAQSA-N 349.362 3.087 50 40 EGGB COc1ccc(OCC(=O)N/N=C\c2cccn2-c2ccccc2)cc1 408844339 CLSAKTIKRFSTKC-STZFKDTASA-N 349.390 3.015 50 40 EGGB O=c1c2ccccc2n2c(CCl)nnc2n1CCc1ccccc1 408712779 QALXELABUBQITD-UHFFFAOYSA-N 338.798 3.026 50 40 EGGB O=C(N/N=C/c1ccc(O)cc1)c1ccc(NC(=O)c2ccco2)cc1 6334169 HNNLBBBYASHVLG-UDWIEESQSA-N 349.346 3.001 50 40 EGGB Cc1cc(Br)cc(/C=N/NC(=O)c2ccoc2C)c1O 4501915 VHTHLBJWAAQOTN-FRKPEAEDSA-N 337.173 3.128 50 40 EGGB Cc1ccc(/C=N/NC(=O)Cc2ccc(Br)cc2)c(O)c1 4735295 OYSWHSQRVZMEIT-VCHYOVAHSA-N 347.212 3.156 50 40 EGGB COc1cc(N2CCCCC2)ccc1/C=N\NC(=O)c1ccco1 409228573 ZJGWSNDHDVAOTJ-UYRXBGFRSA-N 327.384 3.042 50 40 EGGB O=C(N/N=C/[C@]1(c2ccccc2)CC1(Cl)Cl)c1ccncc1 547871 RDXHINJFDIFCKG-BBJIBYMTSA-N 334.206 3.313 50 40 EGGB Cc1ccc(SCC(=O)N/N=C/c2ccc(OCC#N)cc2)cc1 8158758 JTSSRJFZIMJAPH-UDWIEESQSA-N 339.420 3.140 50 40 EGGB COc1ccc2cc([C@H](C)C(=O)NNC(=O)CC(C)C)ccc2c1 10160680 FQFSYXPOGVTNGO-ZDUSSCGKSA-N 328.412 3.145 50 40 EGGB N#C/C(=C\c1csc(C2CC2)n1)C(=O)Nc1ccc(C(=O)O)cc1 63276406 FPISTVASUWKOCU-KPKJPENVSA-N 339.376 3.264 50 40 EGGB CC(C)Oc1ccc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])cc1 33447356 OJQLPCXBMZIJSG-UNOMPAQXSA-N 341.367 3.075 50 40 EGGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1O)c1cccc2ccccc12 8520505 BCWUBIXWGYUDED-YBFXNURJSA-N 335.319 3.218 50 40 EGGB CCC(=O)NNC(=O)c1ccc(COc2ccc(Cl)c(C)c2)cc1 12806843 KRBPZEICHASUER-UHFFFAOYSA-N 346.814 3.398 50 40 EGGB C/C(=N/NC(=O)COc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 5638488 VKIUSWRVULEHGV-WQRHYEAKSA-N 347.758 3.167 50 40 EGGB CN(C)c1nc(N)nc(/C(C#N)=C\c2ccc(-c3ccccc3)cc2)n1 96931700 YIPIBWFKEAHSNY-ATVHPVEESA-N 342.406 3.251 50 40 EGGB Cc1ccc(-c2nc(CNC(=O)/C(C#N)=C\c3ccco3)co2)cc1 98052852 WQLRQMRNFIBGHS-DHDCSXOGSA-N 333.347 3.466 50 40 EGGB CCOc1ccccc1/C=N\NC(=O)COc1cccc(C)c1C 30843257 QCUIPRWMMDVCIH-NDENLUEZSA-N 326.396 3.231 50 40 EGGB Cc1cc(/C=N/NC(=O)Cc2cccs2)c(C)n1C[C@@H]1CCCO1 8334315 GEDVRCWXWBJQEG-ZVCOJXFSSA-N 345.468 3.038 50 40 EGGB COc1ccc2c(c1O)-c1cc(O)cc3c1[C@H](C2)N(CCCl)CC3 1561315 VVQWGUWJTOACKC-HNNXBMFYSA-N 345.826 3.468 50 40 EGGB COc1ccc(/C=C(\C#N)S(=O)(=O)c2ccc(F)cc2)cc1OC 6790250 YUYQQCGDPRIZDP-OQLLNIDSSA-N 347.367 3.181 50 40 EGGB C#CCn1cc(/C=N\NC(=O)Cc2ccc(F)cc2)c2ccccc21 409221158 LTBQUJJLUWCYDX-XKZIYDEJSA-N 333.366 3.106 50 40 EGGB Cn1cc(/C=C(\C#N)C(=O)N2CCCC2)c(-c2cc3ccccc3o2)n1 63276188 FTUPHWGWGSQPEH-XNTDXEJSSA-N 346.390 3.363 50 40 EGGB Cc1ccc(COc2c(Cl)cc(C(=O)NN)cc2Cl)cc1 226322129 UIJWYGQPCAQQPD-UHFFFAOYSA-N 325.195 3.484 50 40 EGGB C#CCn1cc(/C=C(\C#N)C(=O)NCc2ccco2)c2ccccc21 253723 UQGPVQAEYHBYQD-RVDMUPIBSA-N 329.359 3.091 50 40 EGGB COc1ccc(NCC(=O)N/N=C(\C)c2cc3ccccc3o2)cc1 5119798 TZRKIMMKWJCKMZ-FYJGNVAPSA-N 337.379 3.394 50 40 EGGB CCOc1ccccc1C(=O)NNC(=O)c1oc2ccccc2c1C 14346998 DDQCIEBLYKCCRF-UHFFFAOYSA-N 338.363 3.215 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C\c2cc(OC)ccc2OC)cc1 67189773 OYZDEEWAMLFIBS-UVTDQMKNSA-N 338.363 3.258 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)CC(=O)NC2CCCCC2)cc1 335724 ZTXLWVUHTOFEPF-DEDYPNTBSA-N 329.444 3.099 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 6346408 YJCFTPZVUONYCQ-MNOULKQQSA-N 349.434 3.313 50 40 EGGB COc1cc(OC)cc(C(=O)NNc2nc3ccc(F)cc3s2)c1 4121408 JXAUKTNCOUNKIV-UHFFFAOYSA-N 347.371 3.210 50 40 EGGB COc1ccccc1OCC(=O)N/N=C/c1ccc(C(C)C)cc1 510847 QULWIPIKQAAUBS-UDWIEESQSA-N 326.396 3.348 50 40 EGGB COC(=O)/C(C#N)=C\c1ccc(N2CCC(c3ccccc3)=N2)cc1 34737163 VTYWTKYZGZCILX-LGMDPLHJSA-N 331.375 3.381 50 40 EGGB C/C(=N\NC(=O)c1ccc(Br)o1)c1ccc(F)cc1 5381899 RWIONBHPAPVZQA-LZYBPNLTSA-N 325.137 3.335 50 40 EGGB CCOc1ccc2oc(C(=O)N/N=C\c3ccc(N(C)C)o3)cc2c1 409187403 QAHOYRZZGRRZPH-ODLFYWEKSA-N 341.367 3.254 50 40 EGGB Cn1ccc(C(=O)N/N=C(/C=C/c2ccccc2)c2ccccc2)n1 15188326 BAPBSBHTCXNYSV-CXPPDOQTSA-N 330.391 3.268 50 40 EGGB Cc1cc(C(=O)NNC(=O)c2ccc(Cl)cc2)c2ccccc2n1 7985607 UDELEHJERKSUDU-UHFFFAOYSA-N 339.782 3.271 50 40 EGGB CC(C)(C)OC(=O)N1CCC[C@H](I)CC1 44682259 JQFSVNKXRCIGOH-VIFPVBQESA-N 325.190 3.211 50 40 EGGB in-vitro N#CC1=C(N)N2C(=C(C#N)C13CCCCC3)S[C@@H]1CCCC[C@@]12O 4163513 DSKJGGWWLWYRDX-RDTXWAMCSA-N 342.468 3.060 50 40 EGGB COc1ccc(OC)c(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)c1 408798011 DJORIJPPGCTRTO-WYRKQZDXSA-N 328.412 3.306 50 40 EGGB Cc1cc(-n2nc(C)c(C(=O)Cl)n2)c(C)cc1Br 45957960 XDWVCAKRNYQIQT-UHFFFAOYSA-N 328.597 3.334 50 40 EGGB O=C(O)Cc1ccc(OCCCCCI)cc1 1592055949 QFTMWVCXRIDYMZ-UHFFFAOYSA-N 348.180 3.298 50 40 EGGB O=C(COc1ccc2ccccc2c1)N/N=C/c1ccc(C(=O)O)cc1 3030447 KAMSVKDCXAFNEZ-CIAFOILYSA-N 348.358 3.067 50 40 EGGB O=C(CNc1cccc2ccccc12)N/N=C/c1ccc(C(=O)O)cc1 50582 KDRSGAHOYNISDK-WSDLNYQXSA-N 347.374 3.100 50 40 EGGB N#Cc1ccc(/C=N/NC(=O)CSc2ccc(Cl)cc2)cc1 7993717 ATVIQFZGEVZJGW-VXLYETTFSA-N 329.812 3.454 50 40 EGGB CCC(CC)=NNC(=O)c1c(C)nc2ccc(Br)cn12 59515958 LRGRWKHNYBDTSA-UHFFFAOYSA-N 337.221 3.311 50 40 EGGB Cc1ccc(NC(=O)/C(C#N)=C/c2ccccc2OCC(=O)O)cc1 7157360 KWQJZCRVTCKSFX-XNTDXEJSSA-N 336.347 3.004 50 40 EGGB O=C(CCSc1ccccc1)NNC(=O)c1ccccc1Cl 8204356 QWXLBLNMIOCMMQ-UHFFFAOYSA-N 334.828 3.283 50 40 EGGB C[C@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(C(=O)O)cc1 408786263 NMMKHOOGGZQBJP-HWQJWEFDSA-N 328.393 3.016 50 40 EGGB COC(=O)/C(C#N)=C\c1ccc(-c2ccc(Cl)c(C(=O)OC)c2)o1 252497319 QDNLBIBEYUIQBX-XFFZJAGNSA-N 345.738 3.467 50 40 EGGB N#C/C(=C/c1cccnc1)S(=O)(=O)c1ccc(Br)cc1 96891613 GAVYYTOQLZZCNI-ZSOIEALJSA-N 349.209 3.182 50 40 EGGB CN(C)c1ccc(C(=O)N/N=C/c2ccc(Br)cc2)cc1 58968 RKRZWUONIRWODN-WOJGMQOQSA-N 346.228 3.279 50 40 EGGB O=C(COc1cccc2ccccc12)N/N=C/c1ccccc1C(=O)O 2685736 VTZSZSPFBXLBHP-CIAFOILYSA-N 348.358 3.067 50 40 EGGB COC(=O)c1ccc(/C=N/NC(=O)CCSc2ccccc2)cc1 59474302 GDOJPUYDQWTBLS-CPNJWEJPSA-N 342.420 3.106 50 40 EGGB N#CC1=C(N)Oc2c(c(=O)[nH]c3ccccc23)[C@@H]1c1cccc(Cl)c1 4386418 BSTWTWKSHJILFJ-OAHLLOKOSA-N 349.777 3.400 50 40 EGGB C#CCOc1cccc(/C=C(/C#N)C(=O)Nc2ccc(OC)cc2)c1 408935467 HFYCTLHHZRAUTL-VBKFSLOCSA-N 332.359 3.253 50 40 EGGB O=C(OCc1ccccc1)N1CCC[C@@H](I)C1 79436630 AEWKGKKUTPDGLB-GFCCVEGCSA-N 345.180 3.223 50 40 EGGB C/C(=N\NC(=O)[C@@H](O)c1ccccc1)c1ccc(Br)cc1 5288783 DIRCDVYWZCHSQU-LZNAANCOSA-N 347.212 3.023 50 40 EGGB CCCOc1ccc(C(=O)N/N=C\c2ccccc2OC)cc1OC 6324541 IIKVLZPEXUHVKI-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB Cc1ccc(Sc2ccc(/C=C(/C#N)C(N)=O)cc2[N+](=O)[O-])cc1 6814847 ZSWHLYMZSXMLQW-JYRVWZFOSA-N 339.376 3.447 50 40 EGGB C[C@@H](Oc1ccccc1)C(=O)N/N=C\c1c(O)ccc2ccccc12 54202482 NNFYLENZBBRQJS-SFDYMUJDSA-N 334.375 3.463 50 40 EGGB COc1ccc2cc(/C=N/NC(=O)c3cccnc3)c(Cl)nc2c1 59401601 ILBZVWMVENFOIB-KEBDBYFISA-N 340.770 3.056 50 40 EGGB C#CCOc1ccc(/C=C(/C#N)C(=O)NCCCc2ccccc2)cc1 409239504 NVSNLAMLHHMXAS-SILNSSARSA-N 344.414 3.355 50 40 EGGB C[C@@H]1Oc2ccccc2C=C1/C=N/NC(=O)c1cccc([N+](=O)[O-])c1 501795 FBRNSPYWACXQHM-MKFNJMOCSA-N 337.335 3.175 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(C)cc2Cl)cc1OC 578629 FVXJJHSRLXJHKV-VXLYETTFSA-N 332.787 3.430 50 40 EGGB N#CC1=C(S)NC(=S)[C@@H]([n+]2ccccc2)[C@@H]1c1ccc(F)cc1 34475629 TZQOMGDUKXLKSP-CABCVRRESA-O 342.444 3.034 50 40 EGGB CC1(C)C(=O)[C@@]2(Br)CC[C@]1(CC#N)[C@H]2Br 109275398 OJTCQBIJBRMLII-PPKCKEKNSA-N 335.039 3.186 50 40 EGGB CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc(O)c(OC)c2)cc1 4722809 VQCYVLOPTHUABU-UVTDQMKNSA-N 338.363 3.345 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)c(F)c2)cc1 409107331 OSNWDPDOCYFHHL-FYJGNVAPSA-N 325.387 3.498 50 40 EGGB Cc1c(/C=C(\C#N)C(=O)Nc2cccc(C(F)(F)F)c2)cnn1C 17068737 SLWDOBWWEXZJIF-IZZDOVSWSA-N 334.301 3.293 50 40 EGGB O=C(N/N=C/c1cccs1)C(O)(c1ccccc1)c1ccccc1 115074 XPSMCLHLXHOBGX-XSFVSMFZSA-N 336.416 3.134 50 40 EGGB Cc1[nH]nc2c1[C@H](c1cccc(OC3CCCC3)c1)C(C#N)=C(N)O2 4631720 NGDXGDLWXPPGNT-QGZVFWFLSA-N 336.395 3.258 50 40 EGGB CC(=O)N/N=C(\C)c1ccc(Br)cc1Br 4985037 DYKGWLQKWRYMOW-AWNIVKPZSA-N 334.011 3.072 50 40 EGGB CC(/C=N/NC(=O)CCn1nnc2ccccc21)=C\c1ccccc1 4981080 JPSONCIEDWDVCX-IOJOKMQUSA-N 333.395 3.027 50 40 EGGB Cc1cccc2c(NNC(=O)C3C4CC5CC(C4)CC3C5)ncnc12 97105513 AYPWLURNJNVNTF-UHFFFAOYSA-N 336.439 3.454 50 40 EGGB CCC(=O)C1=NN(c2ccccc2)[C@H](N)C(C#N)=C1c1ccccc1 96318820 HOZAYRBJYKAEIZ-FQEVSTJZSA-N 330.391 3.104 50 40 EGGB Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccc3ccccc3c2)c1 12753838 KKURTMPOPPNYQQ-UHFFFAOYSA-N 348.402 3.297 50 40 EGGB COc1ccc(OCC(=O)N/N=C/c2c(F)cccc2Cl)cc1 6182016 AICDCINJGPMKSN-DJKKODMXSA-N 336.750 3.017 50 40 EGGB C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1cccc2c1OCCO2 58915771 BQYJIXDPOVEVEZ-KZKLBEMASA-N 342.420 3.089 50 40 EGGB COc1ccc(OC)c(/C=N/NC(=O)CCSc2ccccc2)c1 59473806 FWSVTJRTCCIYSY-CPNJWEJPSA-N 344.436 3.336 50 40 EGGB Cc1cc(/C=C(/C#N)C(=O)NC2CCCC2)c(C)n1-c1cccnc1 409189415 GITBVEJGCLRPOV-BOPFTXTBSA-N 334.423 3.455 50 40 EGGB CCn1cc(/C=N/NC(=O)CNC2CCCCC2)c2ccccc21 409382422 MBZLHALVZTUDDS-CIAFOILYSA-N 326.444 3.034 50 40 EGGB CCOc1ccccc1OCC(=O)N/N=C(\CC)c1ccccc1 5414567 NUOADXQGYQXIMR-CAPFRKAQSA-N 326.396 3.395 50 40 EGGB COc1ccccc1[C@H]1C(C#N)=C(N)Oc2[nH]nc(-c3ccccc3)c21 9013612 CJUYLVDEBLBETR-INIZCTEOSA-N 344.374 3.303 50 40 EGGB N#CC(C#N)=Cc1cn(CC(=O)N2CCCCCC2)c2ccccc12 798074 RVEMAJPPXVEBJI-UHFFFAOYSA-N 332.407 3.474 50 40 EGGB COc1ccc2cc(/C=N/NC(=O)c3ccncc3)c(Cl)nc2c1 2405086 SMRSYAKCXPQQOH-KEBDBYFISA-N 340.770 3.056 50 40 EGGB O=C(CCn1c2c(c3ccccc31)CCCC2)NN=Cc1ccccn1 245130841 VAGBEFJJOGALQA-UHFFFAOYSA-N 346.434 3.456 50 40 EGGB COc1cc(OC)cc(C(=O)Oc2ccc([N+](=O)[O-])cc2Cl)c1 3294327 ZXRNOXMQMIGBJR-UHFFFAOYSA-N 337.715 3.485 50 40 EGGB COc1cc(OC)c(/C=N/NC(=O)c2ccccc2C)cc1Cl 9201391 JFDFZTOXONLNTG-VXLYETTFSA-N 332.787 3.430 50 40 EGGB Cc1[nH]nc2c1[C@H](c1cccc(OCCC(C)C)c1)C(C#N)=C(N)O2 8845682 UHUXBGQREYHIJE-QGZVFWFLSA-N 338.411 3.361 50 40 EGGB C/C(=N\NC(=O)CNc1ccc2c(c1)OCO2)c1ccc(Cl)cc1 409149791 QYYROPOJZFBSNN-RGVLZGJSSA-N 345.786 3.021 50 40 EGGB O=C(CNc1cccc(C(F)(F)F)c1)N/N=C/c1ccc(F)cc1 408535680 ZOTCRVHUTFKFJX-LSFURLLWSA-N 339.292 3.407 50 40 EGGB C[C@@H](O[Si](C)(C)C(C)(C)C)C(C)(C)C(=O)ON1C(=O)CCC1=O 198122453 ZSJZQTOBJOVMEI-LLVKDONJSA-N 343.496 3.030 50 40 EGGB in-vitro CCOc1ccc(C(=O)N/N=C/c2cc(OC)ccc2OCC)cc1 3162146 DNNCYSSRAGUKTG-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB O=C(Cc1cccc2ccccc12)NNC(=S)NCc1ccccc1 11050210 WXKNVSKRTVKSEL-UHFFFAOYSA-N 349.459 3.078 50 40 EGGB OC[C@H](Br)C[C@](F)(Cl)C(F)(F)Br 16159153 ZXCKYRIOJOZVFC-QWWZWVQMSA-N 334.357 3.025 50 40 EGGB C=CCc1cccc(/C=N/NC(=O)CNc2cccc(Cl)c2)c1O 234099 SHGJWVOIEQXIBI-SRZZPIQSSA-N 343.814 3.336 50 40 EGGB COc1ccc(C(=O)N/N=C/c2ccc(N3CCCCC3)cc2)cc1 408962257 XRVVMKNKFGFIPQ-RCCKNPSSSA-N 337.423 3.449 50 40 EGGB O=C(F)[C@](F)(OC(F)(F)C(F)(F)Br)C(F)(F)F 103540902 COIQPZUVUUGETI-REOHCLBHSA-N 342.939 3.308 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)c2ccc(Br)cc2)cc1 85677 BXHWROLCHIMZSN-WOJGMQOQSA-N 346.228 3.279 50 40 EGGB Cc1ccc(C(=O)N(N)c2oc(-c3ccc(C)cc3)nc2C#N)cc1 27026347 DZPXLHYFBTXRFC-UHFFFAOYSA-N 332.363 3.351 50 40 EGGB O=C(C(Cl)Cl)N1Cc2cc3c(cc2[C@H]2CC=CC[C@H]21)OCO3 1711682 VQGNJGNSKWRJHO-ZYHUDNBSSA-N 340.206 3.363 50 40 EGGB Cc1oc(-c2cccs2)nc1C(=O)NNc1ccccc1[N+](=O)[O-] 47075181 ZOIRCEABHMTOTM-UHFFFAOYSA-N 344.352 3.377 50 40 EGGB Cc1ccc(OCC(=O)N/N=C\c2cc(Cl)ccc2O)c(C)c1 30843462 XIHIWQHJRMFHBR-OCKHKDLRSA-N 332.787 3.192 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2ccc(OC)cc2)cc1OCC 408720159 UXLPPFMEKBTJMS-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB COc1ccc(C(=O)N/N=C2/Nc3cccc4cccc2c34)cc1OC 1295187 KNXIALNDCCLCEP-UHFFFAOYSA-N 347.374 3.374 50 40 EGGB Cc1cccc(C(=O)NNc2nc3ccc([N+](=O)[O-])cc3s2)c1 59417520 LFDJHQQQZHFJHW-UHFFFAOYSA-N 328.353 3.270 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2cccc([N+](=O)[O-])c2O)c(Cl)c1 9190615 LMTKQQVUCJSNKR-CAOOACKPSA-N 333.731 3.026 50 40 EGGB CC(C)(C)c1n[nH]c2c1[C@@H](c1ccc(F)cc1F)C(C#N)=C(N)O2 4312117 PIXSJUWTMYECOL-LBPRGKRZSA-N 330.338 3.204 50 40 EGGB O=C(N/N=C\c1ccc(O)c(O)c1)C(c1ccccc1)c1ccccc1 409393258 WNMZYKPQNWUTPZ-HMAPJEAMSA-N 346.386 3.380 50 40 EGGB Cc1ccccc1NC(=S)NNC(=O)Cc1c[nH]c2ccccc12 16311606 SORHTPFHZRNRHV-UHFFFAOYSA-N 338.436 3.037 50 40 EGGB Cc1nc2ccccc2n1CC(=O)N/N=C/C1=CC[C@@H]2C[C@H]1C2(C)C 24036401 MJDNFXQZNIBKAB-XKQKCCJTSA-N 336.439 3.439 50 40 EGGB C#C[C@]1(O)CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(OO)[C@@H]3CC[C@@]21C 256461459 UOTMWSQOLMXLKR-JBKQDOAHSA-N 330.424 3.105 50 40 EGGB O=C(NNc1ncccn1)c1cc2ccccc2n1Cc1ccccc1 52410086 LFWSXBONPTZJBP-UHFFFAOYSA-N 343.390 3.237 50 40 EGGB C[C@H](O)COc1ccccc1P(c1ccccc1)c1ccccc1 104225134 ZATSGOFXQDKSKL-KRWDZBQOSA-N 336.371 3.204 50 40 EGGB COC(=O)c1ccc(-c2ccc(/C=N/NC(=O)c3ccccc3)o2)cc1 6179996 WMAUEOTVVCJQML-FYJGNVAPSA-N 348.358 3.497 50 40 EGGB COCc1nnc(NC(=O)CCCC[C@@H]2CCSS2)s1 72325896 PHMOGRSDAJNIGB-SECBINFHSA-N 333.504 3.337 50 40 EGGB biogenic N#C/C(=C\c1cccc(Oc2nc(Cl)ncc2F)c1)C(N)=S 33772553 MADQPHPATCHXTL-RUDMXATFSA-N 334.763 3.254 50 40 EGGB Cc1ccc(CN2C(=O)/C(=N\OC(=O)CCl)c3ccccc32)cc1 3064080 OYPAXQQXHMHAAQ-JZJYNLBNSA-N 342.782 3.028 50 40 EGGB CCOc1ccc2ccccc2c1/C=C(\C#N)C(=O)NCCCOC 6210043 GBNNQWCTPPABQW-DTQAZKPQSA-N 338.407 3.298 50 40 EGGB CC1(C)CC(=O)C2=C(C1)[C@@H](c1ccc([N+](=O)[O-])cc1)C(C#N)=C(N)O2 4728981 CNFAIMXMKSCBKK-OAHLLOKOSA-N 339.351 3.046 50 40 EGGB CCCC[C@H](C(=O)NN)N1c2c(OC)cccc2[C@@H](C)CC1(C)C 223230216 MLFKSAGBZBRVEV-DZGCQCFKSA-N 333.476 3.336 50 40 EGGB CCOC(=O)C1=COC(N)=C(C#N)[C@H]1c1ccc(Cl)cc1Cl 5458035 IUVKPMOOVPXVQB-CYBMUJFWSA-N 339.178 3.248 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2ccccc2OC)c(OCC)c1 169878305 BGIIBQFFILUEDG-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2ccc3ccccc3n2)c(O)c1 3275158 IQWZOANPRBFVDC-UDWIEESQSA-N 335.363 3.103 50 40 EGGB C=C(C)CSC1=C(C#N)[C@H](c2ccc(O)c(OC)c2)CC(=O)N1 80894 MPSUUKLRZQZSKB-LBPRGKRZSA-N 330.409 3.049 50 40 EGGB O=C(CCc1ccccc1)NNC(=O)CSc1ccc(Cl)cc1 12805023 ZSZHJDUVWKTKMO-UHFFFAOYSA-N 348.855 3.212 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2cc3c(s2)CCCC3)c(O)c1 2658714 JQQPVHRVZKXQJU-YBFXNURJSA-N 344.436 3.495 50 40 EGGB COc1ccc(F)c([C@H]2C(C#N)=C(N)Oc3n[nH]c(C(C)(C)C)c32)c1 6507130 FQKJPBSMRQGUQJ-ZDUSSCGKSA-N 342.374 3.073 50 40 EGGB O=C(NNC(=S)Nc1ccccc1)C12CC3CC(CC(C3)C1)C2 6514417 FHEDTWXEHBPTNW-UHFFFAOYSA-N 329.469 3.221 50 40 EGGB CCOc1cccc(NC(=O)/C(C#N)=C\c2ccc3c(c2)OCO3)c1 408746360 SBSDAXPWFYNEDT-ZSOIEALJSA-N 336.347 3.360 50 40 EGGB CC[C@H](C)n1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cn1 253407280 VULZJESLZSJDKS-ZBEGNZNMSA-N 340.427 3.305 50 40 EGGB Cc1cccc(/C=N/NC(=O)CSc2nc3ccccc3n2C)c1 186681 LTPBXWLDJYPIPS-YBFXNURJSA-N 338.436 3.124 50 40 EGGB COc1ccccc1C(=O)N/N=C/c1ccc(Br)s1 368561 QKXSLYXEPIMBJU-OVCLIPMQSA-N 339.214 3.283 50 40 EGGB Cc1cc(Br)cc(/C=N/NC(=O)OC(C)(C)C)c1O 507563 MPTCUXFSTQNDQX-VIZOYTHASA-N 329.194 3.322 50 40 EGGB CSc1ccc(/C=C/C(=O)NNC(=O)c2cc(C)oc2C)cc1 7987387 FJCZWVXKBGCZKT-RMKNXTFCSA-N 330.409 3.093 50 40 EGGB Cc1cc(C)nc(NNC(=O)C2c3ccccc3Oc3ccccc32)n1 13005127 SABFXQQTFCRJHA-UHFFFAOYSA-N 346.390 3.474 50 40 EGGB O=C(CC12CC3CC(CC(C3)C1)C2)N/N=C/c1ccc2c(c1)OCO2 6222109 NVCFRFOUFYIFIK-SRZZPIQSSA-N 340.423 3.472 50 40 EGGB COc1cc(/C=N\NC(=O)Cc2ccc(F)cc2)ccc1OC(C)C 409235401 PEQPZFJBKKJYJA-MTJSOVHGSA-N 344.386 3.314 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)NCCCc2ccccc2)cc1O 409241401 XFKNJKUQAHMSNL-ATVHPVEESA-N 336.391 3.057 50 40 EGGB NNC(=O)c1cn(Cc2cccc(Br)c2)c2ccccc12 216946885 ITVVXXFKPYVDST-UHFFFAOYSA-N 344.212 3.056 50 40 EGGB CC(C)(C)OC(=O)N(C1CC1)[C@H]1CC[C@H](NC(=O)CCl)CC1 242688570 VSXGVCAUDSLWGJ-HAQNSBGRSA-N 330.856 3.052 50 40 EGGB COc1cc2c(cc1OC)/C(=N/NC(=O)c1cccc(F)c1)CCC2 241162 XWTZBXHQDZAUIO-LTGZKZEYSA-N 342.370 3.313 50 40 EGGB COc1ccc2ccccc2c1/C=N/NC(=O)COc1ccccc1 493629 CVKXWOMSSBMUOI-FYJGNVAPSA-N 334.375 3.378 50 40 EGGB C/C(=N/NC(=O)c1cc(-c2ccc(C)s2)n[nH]1)c1ccc(O)cc1 13646045 LSEBPFLWLPNZKS-WQRHYEAKSA-N 340.408 3.306 50 40 EGGB FC(F)(F)C1(C(F)(F)F)N[C@@H]2[C@H](OCCCl)C[C@@H]1[C@H]2Cl 100121929 GCFPUWPAGCMEBN-DBRKOABJSA-N 346.098 3.073 50 40 EGGB COCCn1c(C)cc(/C=C(\C#N)C(=O)NCc2cccs2)c1C 53678718 CFQXEAURGHPZJW-MHWRWJLKSA-N 343.452 3.036 50 40 EGGB C/C(CC(=O)Nc1ccc(C)cc1)=N\NC(=O)c1cccc(C)c1O 5363191 KHCZZYPAWXKAAL-KGENOOAVSA-N 339.395 3.144 50 40 EGGB CCNc1ccc(C(=O)N/N=C(\C)c2cccs2)cc1[N+](=O)[O-] 4871628 SVJXEPBULPSOOH-LICLKQGHSA-N 332.385 3.242 50 40 EGGB C/C(=N\NC(=O)Cc1ccc(C)c(C)c1)c1ccc2c(c1)OCCO2 408589028 KKJNNLUHZHZGGJ-RCCKNPSSSA-N 338.407 3.158 50 40 EGGB N#CC(C#N)=Cc1c(Oc2ccccc2F)nc2ccccn2c1=O 5562011 DGTDCCIQYSUVFO-UHFFFAOYSA-N 332.294 3.056 50 40 EGGB CN1c2ccccc2N2C[C@](C)(CI)S[C@H]12 12585348 IGTPWOWACKHSLZ-NEPJUHHUSA-N 346.237 3.167 50 40 EGGB CC(C)c1[nH]nc2c1[C@H](c1ccc(N3CCCC3)cc1)C(C#N)=C(N)O2 8783466 ZRLWCPUJNUIIMM-MRXNPFEDSA-N 349.438 3.351 50 40 EGGB Cc1ccc2cc(/C=N/NC(=O)[C@H](N)CC(C)C)c(Cl)nc2c1 2396009 UEPBZLWAKQQJEI-UMXKZIAQSA-N 332.835 3.020 50 40 EGGB CCOc1ccc(/C=N\NC(=O)c2ccc(OC)c(OCC)c2)cc1 409337067 WIZCTQGBLHXSMH-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB Cc1ccccc1OCC(=O)N/N=C/c1c(C)n(C)c2ccccc12 548850 OVSGUIZCISBUMO-CIAFOILYSA-N 335.407 3.324 50 40 EGGB N#C/C(=C\c1cc([N+](=O)[O-])c(Cl)cc1Cl)c1n[nH]c(N)c1C#N 5387420 GSPUWEVLPCJQGD-LREOWRDNSA-N 349.137 3.143 50 40 EGGB CC/C(=N\NC(=O)Cc1ccccc1)c1ccc(OC)c(OC)c1 6377799 CLGBLSJWBUYTAO-CAPFRKAQSA-N 326.396 3.177 50 40 EGGB O=C(CSc1nc2ccccc2o1)N/N=C/c1ccccc1F 550714 CQJGDOKETFKBQL-GIJQJNRQSA-N 329.356 3.209 50 40 EGGB Cc1cc(C(=O)NNC(=O)C2CCCC2)c(C)n1-c1ccccc1 8027093 RRHAQBRPLFUQNT-UHFFFAOYSA-N 325.412 3.045 50 40 EGGB Cc1cc(C)nc(SCC(=O)N/N=C/C2=CC[C@@H]3C[C@H]2C3(C)C)n1 20986466 HPLPZQOBHWAKRR-XQQXVPSESA-N 344.484 3.280 50 40 EGGB NNC(=O)c1cc(-c2ccc3ccccc3c2)n(-c2ccccc2)n1 408724061 DINFMLFPVWBKOC-UHFFFAOYSA-N 328.375 3.296 50 40 EGGB COc1ccc(CNC(=O)/C(C#N)=C/c2ccc(C)cc2)c(OC)c1 408869060 QWOBCCKLZJUWEQ-LICLKQGHSA-N 336.391 3.236 50 40 EGGB O=C(COc1ccc(C2SCCS2)cc1)N/N=C/c1ccoc1 408570919 ZNFKTKFFFZBUQF-RQZCQDPDSA-N 348.449 3.287 50 40 EGGB C[C@@H](Br)C(=O)NC[C@H](OCC1CC1)c1ccc(F)cc1 95097951 DNJXWELCUUGIDI-YGRLFVJLSA-N 344.224 3.193 50 40 EGGB O=C(N/N=C\c1ccc(O)cc1O)c1ccc(Cl)cc1Cl 95938410 OBHLSQRWTKOAIG-IDUWFGFVSA-N 325.151 3.169 50 40 EGGB CCCc1ccc(OCC(=O)N/N=C/c2ccc(N(C)C)cc2)cc1 354373 XDDDWFQELMTYKX-KGENOOAVSA-N 339.439 3.234 50 40 EGGB N#C/C(=C\c1ccc(O)cc1)C(=O)NCCc1c[nH]c2ccccc12 308826 DXQRKIQMSMDAKO-LFIBNONCSA-N 331.375 3.139 50 40 EGGB COc1c(O)ccc(/C=C(\C#N)c2nc3ccccc3[nH]2)c1[N+](=O)[O-] 4149747 XGWZHVFLPYFERU-DHZHZOJOSA-N 336.307 3.249 50 40 EGGB C/C(=N/NC(=O)COc1cc(C)cc(C)c1)c1ccc([N+](=O)[O-])cc1 13980939 LZSYHTLURZERSH-RGEXLXHISA-N 341.367 3.131 50 40 EGGB C[C@H]1C(=O)OC(=O)N1C(=O)OCC1c2ccccc2-c2ccccc21 97950108 KWBSZLYHMUTNEJ-NSHDSACASA-N 337.331 3.303 50 40 EGGB CC[C@H](Nc1ccccc1)C(=O)N/N=C/c1ccc(OC)c(OC)c1 252369 DISRLMCMQNBOBY-UOEVCUDDSA-N 341.411 3.045 50 40 EGGB O=C(CCc1ccccc1)N/N=C/c1ccc(Cl)c([N+](=O)[O-])c1 587025 DBSQXUFRMDJJDW-WOJGMQOQSA-N 331.759 3.331 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@H](c2ccccc2[N+](=O)[O-])[C@H]2CCCC=C12 573506 NGPHAOADWCMDAH-GUYCJALGSA-N 345.362 3.188 50 40 EGGB C=CCSC1=C(C#N)[C@@H](c2ccc(C)cc2)[C@@H](C(=O)OC)C(O)=N1 9059006 LPPNOYWIDPVYKN-HUUCEWRRSA-N 342.420 3.492 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)Nc2nc(Cl)cc(Cl)n2)cc1 3203974 WVZHBLXXNBMVOS-UXBLZVDNSA-N 349.177 3.338 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2ccc(N3CCCC3)cc2)cc1 408677804 UZZOWLSATOPBEX-RCCKNPSSSA-N 337.423 3.449 50 40 EGGB CN(C)c1ccc(-n2cccc2/C=N/NC(=O)c2ccccc2)cc1 408951337 ISUQDIHVWFHHTJ-RCCKNPSSSA-N 332.407 3.307 50 40 EGGB C=CCOc1ccccc1/C=N\NC(=O)c1ccc(OC)c(OC)c1 6441719 DJJIQCKPRIARKG-MOSHPQCFSA-N 340.379 3.033 50 40 EGGB CN1/C(=C(\C#N)C(=O)c2coc3ccccc3c2=O)Nc2ccccc21 11847450 GDNNZXQKZQDFQL-DEDYPNTBSA-N 343.342 3.273 50 40 EGGB O=C(CCCCl)Nc1nc2ccc(N3CCOCC3)cc2s1 20133654 DBVNYGHDHGQHDX-UHFFFAOYSA-N 339.848 3.090 50 40 EGGB CC(C)(C)C(=O)[C@@H](Br)[C@@H](O)C(Cl)(Cl)Cl 494577 FYTCKBXKBUXJLV-INEUFUBQSA-N 326.445 3.096 50 40 EGGB COc1cccc(C(=O)NNC(=O)c2ccc(Cl)c(Cl)c2)c1 290057 BWHQPNMJRCOTSK-UHFFFAOYSA-N 339.178 3.077 50 40 EGGB N#C/C(C1=N[C@@H](c2ccccc2)CO1)=C1/N[C@H](c2ccccc2)CO1 4975857 QVVGSAYHUSBCQV-HRAVSZKSSA-N 331.375 3.253 50 40 EGGB Cc1ccc(N2C(S)=C(C#N)C(=O)N[C@@H]2c2cccs2)cc1 352227 ZKGGZUXUYOGYSQ-AWEZNQCLSA-N 327.434 3.357 50 40 EGGB N#CC1=C(N)OC(c2ccccc2)=C(C#N)[C@@H]1c1ccc([N+](=O)[O-])cc1 367189 WBDPEIZLRLOXCT-KRWDZBQOSA-N 344.330 3.337 50 40 EGGB C[C@@H](Oc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2)cc1)C(=O)O 59249722 VBHXRASASJOPEN-LKKYZFDUSA-N 336.347 3.084 50 40 EGGB CCOc1ccc(Cl)cc1/C=N/NC(=O)CNC1CCCCC1 409382497 NSPZEMPUGQEZES-RGVLZGJSSA-N 337.851 3.111 50 40 EGGB C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H]1CC=CCC1 12755004 LYIUQXVDDRKCRI-GDBMZVCRSA-N 338.407 3.111 50 40 EGGB COc1cccc(/C=C(\C#N)S(=O)(=O)c2ccc(C)cc2)c1OC 148234 YQPVYAAWSFLBED-LFIBNONCSA-N 343.404 3.351 50 40 EGGB O=C1C[C@@]2(C[C@H](Cl)N=N2)C(=O)N1c1cc(Cl)cc(Cl)c1 5150022 VKUPXVAZFTYJHJ-SKDRFNHKSA-N 332.574 3.416 50 40 EGGB O=C(Cn1c2ccccc2c2ccccc21)N/N=C/c1ccncc1 5800561 JWTKILFRIJXJHO-LPYMAVHISA-N 328.375 3.340 50 40 EGGB COc1ccc(C)c2sc(NNC(=O)COc3ccccc3)nc12 251233 MNDZKOPKVNSNSA-UHFFFAOYSA-N 343.408 3.135 50 40 EGGB COc1cccc(NC(=O)/C(C#N)=C/c2ccc(OC(C)=O)cc2)c1 6822191 NICOULXTYGRVTK-XNTDXEJSSA-N 336.347 3.166 50 40 EGGB C=CCc1cc(/C=N/NC(=O)Cc2ccccc2)cc(OCC)c1O 59249371 RJIVYGUZCIQBPG-KGENOOAVSA-N 338.407 3.212 50 40 EGGB COc1ccc(N(CCC#N)C(=O)/C(C#N)=C/c2ccc(C)o2)cc1 1770590 WTYGNTDQGIYXGR-NTCAYCPXSA-N 335.363 3.450 50 40 EGGB Cc1nn(-c2ccccc2)c2sc(C(=O)N/N=C/c3ccc[nH]3)cc12 3353530 NEQZKAKBKKJKNO-RGVLZGJSSA-N 349.419 3.487 50 40 EGGB C/C(=N\NC(=O)c1ccc(O)cc1)c1ccc(Br)cc1 4579193 UGWBDNRNXICOAG-LICLKQGHSA-N 333.185 3.309 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1ccc(N2CCCC2)cc1F 409236893 GRDPCBNGHAHNHP-XKZIYDEJSA-N 343.377 3.258 50 40 EGGB CC(=O)N/N=C/c1cn(Cc2ccc([N+](=O)[O-])cc2)c2ccccc12 409011381 GIGDYPWPAFDPJE-VXLYETTFSA-N 336.351 3.068 50 40 EGGB COc1ccc(CBr)c(I)c1 116551545 YDWMABQHIGGOFZ-UHFFFAOYSA-N 326.959 3.195 50 40 EGGB C=CCOc1cccc(/C=N/NC(=O)c2ccc(OC)cc2OC)c1 8207434 CRXWKDPTHDHIDM-DEDYPNTBSA-N 340.379 3.033 50 40 EGGB O=C(N/N=C/c1ccc2c(c1)OCO2)c1cccc(C(F)(F)F)c1 1753855 ZQQPKFPXIKHQAT-DNTJNYDQSA-N 336.269 3.198 50 40 EGGB COc1cc(C(=O)N/N=C(\C)c2ccc(F)cc2)cc(OC)c1OC 4964981 CFLZMLNEJWIGNT-RGVLZGJSSA-N 346.358 3.006 50 40 EGGB CN(C)c1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1c(F)cccc1F 12414055 AFOUFJKEDQQTOG-MRXNPFEDSA-N 327.334 3.249 50 40 EGGB O=C(N/N=C/c1ccc(-c2ccccc2C(=O)O)o1)c1ccccc1 113853644 GEDUINBLZVUJNS-UDWIEESQSA-N 334.331 3.409 50 40 EGGB Cc1nn(-c2ccccc2)c2nc(-c3cccs3)cc(C(=O)NN)c12 3886074 CXCDZHIYBLZXCO-UHFFFAOYSA-N 349.419 3.061 50 40 EGGB C/C(=N/NC(=O)CCn1nnc2ccccc21)c1ccc(Cl)cc1 13647747 YQQPVUOEEONHDS-UNOMPAQXSA-N 341.802 3.015 50 40 EGGB C[C@H](NC(=O)COC(=O)/C(C#N)=C\c1ccccc1)c1ccccc1 6175511 ZPQKYQBNBIVRAS-BRYHAGSVSA-N 334.375 3.014 50 40 EGGB C[C@H]1CCC/C(=N/NC(=O)CCC(=O)N/N=C2/CCC[C@H](C)C2)C1 5529105 AVGQWTXONGCGQY-MVMWICHISA-N 334.464 3.131 50 40 EGGB COc1cccc(C(=O)N/N=C/c2cc(C)n(-c3ccccn3)c2C)c1 409223261 FAMHTCLNOHUEKB-LPYMAVHISA-N 348.406 3.262 50 40 EGGB CCCOc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(CCC)c32)cc1 5051883 HMKDRPAEAOLHAM-MRXNPFEDSA-N 338.411 3.369 50 40 EGGB CC(C)CNC(=S)N(C)NC(=O)C1CCC(C(C)(C)C)CC1 21558539 LFPOXNXJNPXUCK-UHFFFAOYSA-N 327.538 3.332 50 40 EGGB O=C(COc1ccc(-c2ccccc2)cc1)N/N=C/c1cccnc1 565782 PJDQPRUGSWQNKJ-HYARGMPZSA-N 331.375 3.278 50 40 EGGB CCC[C@@H]1CCc2c(sc(NC(=O)CCCl)c2C(N)=O)C1 2085402 VOSJLZBVFQIVJZ-SECBINFHSA-N 328.865 3.319 50 40 EGGB O=C(NNC(=S)Nc1ccc(F)c(Cl)c1)c1ccccc1F 6322854 CFYILGXIXWOQPE-UHFFFAOYSA-N 341.770 3.250 50 40 EGGB NNC(=O)c1cc(-c2cccc3ccccc23)n(-c2ccccc2)n1 408724106 FLHXQESOAWKMEX-UHFFFAOYSA-N 328.375 3.296 50 40 EGGB COc1ccccc1C(=O)N/N=C\c1ccc(Cl)c([N+](=O)[O-])c1 33561918 UMQAOJKMAAOOKQ-MFOYZWKCSA-N 333.731 3.021 50 40 EGGB Cc1ccc(C23C[C@@H]4C[C@@H](CC(NC(=O)NN(C)C)(C4)C2)C3)cc1 12414277 HFELPSPVCLBGHH-BANKROOTSA-N 327.472 3.361 50 40 EGGB N#C/C(=C\c1ccc(-c2ccccc2[N+](=O)[O-])o1)C(=O)N1CCCC1 15188624 LBDASFINDYQLEF-ACCUITESSA-N 337.335 3.384 50 40 EGGB CC(C)(C)OC(=O)N1CCC(B2OC(C)(C)C(C)(C)O2)=C(C#N)C1 606302549 YTFXBYLNKWXJPL-UHFFFAOYSA-N 334.225 3.079 50 40 EGGB Cc1cccc(C)c1OCC(=O)N/N=C/c1cn(C)c2ccccc12 58691 BGISILJAOPBVCK-SRZZPIQSSA-N 335.407 3.324 50 40 EGGB COc1cccc(/C=N/NC(=O)c2ccc(NC(=O)C(C)C)cc2)c1 8558533 GAZZRGHTYJFDNR-UDWIEESQSA-N 339.395 3.054 50 40 EGGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1cc(F)ccc1F 8768170 DTSZQNMCXCZULL-HNNXBMFYSA-N 330.334 3.416 50 40 EGGB Cc1ccc(C)c(OCCC(=O)NNC(=O)c2ccccc2Cl)c1 6402432 XQGNKKFNJINMRH-UHFFFAOYSA-N 346.814 3.187 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)NC2CCCC2)cc(Cl)c1O 4616722 WYVLGMATAAUFBH-KPKJPENVSA-N 334.803 3.410 50 40 EGGB CCOC(=O)c1ccc(-c2ccc(/C=C(\C#N)C(=O)N(C)C)o2)cc1 4723456 FVUFARMMGMMHMZ-RVDMUPIBSA-N 338.363 3.118 50 40 EGGB O=C(NNC(=O)c1ccc(Cl)c(Cl)c1)NC1CCCCC1 5670546 RKRUGMWUDHOADK-UHFFFAOYSA-N 330.215 3.270 50 40 EGGB O=C(Cc1cccc2ccccc12)NNc1ncnc2ccccc12 6787175 KHZKANIMCSJSDQ-UHFFFAOYSA-N 328.375 3.469 50 40 EGGB COC(=O)/C(C#N)=C\c1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 6027115 ZINLVHHXJXWNRW-UVTDQMKNSA-N 337.335 3.443 50 40 EGGB CC(C)Oc1ccccc1/C=N/NC(=O)c1ccc([N+](=O)[O-])cc1 6538961 RYKPEGAIFXESIR-WOJGMQOQSA-N 327.340 3.146 50 40 EGGB N#C/C(=C\c1cccc([N+](=O)[O-])c1)C(=O)NCc1ccc(Cl)cc1 3253685 XXZRGQBDDYNHKS-RIYZIHGNSA-N 341.754 3.472 50 40 EGGB CCCCN1C(=O)/C(=N\NC(=O)c2cccs2)c2ccccc21 5898184 SKZQWPIHDDFDRB-SDXDJHTJSA-N 327.409 3.029 50 40 EGGB COc1cc(C)c([C@H]2C(C#N)=C(N)Oc3[nH]nc(C)c32)cc1C(C)C 5818170 RCTUWCPIXTZDAY-KRWDZBQOSA-N 338.411 3.377 50 40 EGGB CN(C)NC(=O)c1ccc2nc(-c3ccco3)c(-c3ccco3)nc2c1 408979679 RQIMEIGEMUKXLG-UHFFFAOYSA-N 348.362 3.356 50 40 EGGB O=C(NNC(=O)c1ccc(-c2ccc(Cl)cc2)o1)c1ccncc1 569218 AERFPMXAICQOPX-UHFFFAOYSA-N 341.754 3.070 50 40 EGGB CC[C@@H]1CCc2sc(C(=O)N/N=C/c3ccc(O)c(O)c3)cc2C1 8525878 LMWRZPDOEMJSSU-VURRPDKYSA-N 344.436 3.438 50 40 EGGB CCOC(=O)c1cccc(N/C=C(\C#N)C(=O)Nc2ccccc2)c1 57413977 PHYJZIKHZRTOQM-FYWRMAATSA-N 335.363 3.321 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(Cl)cc2)c(OC)c1OC 2795778 MMISXKWIZRGHNV-VXLYETTFSA-N 348.786 3.130 50 40 EGGB CC1(C)CC(=O)C2=C(C1)O[C@H](c1cccc([N+](=O)[O-])c1)C(C#N)=C2N 4565753 WEAYAJWRMSXOJH-QGZVFWFLSA-N 339.351 3.046 50 40 EGGB CCOc1ccc(Cl)cc1/C=N/NC(=O)c1ccc(OC)cc1O 409392872 SPWZLSYEBYESOK-VXLYETTFSA-N 348.786 3.217 50 40 EGGB COC(=O)/C(C#N)=C\c1ccc(-c2ccc(Cl)c(C(=O)O)c2)o1 252499809 SEYABGYKXNUJSR-POHAHGRESA-N 331.711 3.378 50 40 EGGB CC(C)(C)OC(=O)N1C[C@@H](O[Si](C)(C)C(C)(C)C)C[C@@H](N)C1 953078846 HIINYWMBJLPVTB-OLZOCXBDSA-N 330.545 3.345 50 40 EGGB CCOc1cc(/C=N/NC(N)=O)ccc1OCc1ccccc1Cl 255970 RMZXQYPTRPWVIN-KEBDBYFISA-N 347.802 3.320 50 40 EGGB O=C(NNC(=O)c1ccc(C(F)(F)F)cc1)c1ccc(Cl)cc1 2651379 MUKTZUODNGGMOS-UHFFFAOYSA-N 342.704 3.434 50 40 EGGB Cc1cc(=O)c2c(o1)OC(N)=C(C#N)[C@H]2c1c(Cl)cccc1Cl 125117 PENWFVIONMCANV-LBPRGKRZSA-N 349.173 3.473 50 40 EGGB O=C(N/N=C/c1ccccc1)C(=O)Nc1cc(Cl)cc(Cl)c1 59101666 IVWNDPZRCOZNBA-GIJQJNRQSA-N 336.178 3.082 50 40 EGGB CCn1c(C)cc2c(c1=O)[C@H](c1ccc(Cl)cc1)C(C#N)=C(N)O2 2334543 ABONZUVKEHVMFO-OAHLLOKOSA-N 341.798 3.048 50 40 EGGB C/C(=N\NC(=O)c1ccccc1Br)c1ccccc1O 12362531 XAAJWPBARIIECV-LICLKQGHSA-N 333.185 3.309 50 40 EGGB Cc1cc2c(cc1C)CN(CC(=O)N/N=C/c1cccc(Cl)c1)C2 409206017 LNIZLAIJAKMTFK-ZVBGSRNCSA-N 341.842 3.423 50 40 EGGB CC(C)(C)OC(=O)N1[C@H](CO)C[C@@H]1CO[Si](C)(C)C(C)(C)C 953122895 ZHTYVWVJOUGBNM-QWHCGFSZSA-N 331.529 3.379 50 40 EGGB Cc1ccc2nc(C)c(C(=O)N/N=C/c3ccc(Cl)cc3)n2c1 59444019 QQDKOGHHIBVJSF-DJKKODMXSA-N 326.787 3.368 50 40 EGGB O=C(N/N=C/c1ccc[nH]1)c1ccccc1OCc1ccc(F)cc1 3283268 BVBFXYRKINZEDU-WSDLNYQXSA-N 337.354 3.497 50 40 EGGB O=S(=O)(O)c1ccc(CC(CCl)(CCl)CCl)cc1 1774075 GMOAJTYKVPCATB-UHFFFAOYSA-N 331.648 3.179 50 40 EGGB C#CCOc1cccc(/C=N/NC(=O)c2ccc(OCCC)cc2)c1 20197612 VDNGIFBWIZSDSP-RCCKNPSSSA-N 336.391 3.251 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2cc3cc(OC)ccc3[nH]2)cc1 2433258 HEQLAUWICHEQDS-UDWIEESQSA-N 337.379 3.339 50 40 EGGB N#CC1=C(N)N2C(=C(C#N)C13CCCCC3)S[C@H]1CCCC[C@]12O 2620810 DSKJGGWWLWYRDX-KSSFIOAISA-N 342.468 3.060 50 40 EGGB N#C/C(=C/c1ccc(-c2ccc(F)cc2Br)o1)C(N)=O 252484634 GBXAWQXTVLXPDE-YVMONPNESA-N 335.132 3.240 50 40 EGGB C=CCOc1ccc(C(=O)N/N=C\c2ccccc2O)cc1OCC 6355068 VOEKLGBLAFWWNU-MOSHPQCFSA-N 340.379 3.120 50 40 EGGB COC(=O)c1ccc(C)c(-c2ccc(/C=C(/C#N)C(=O)N(C)C)o2)c1 408843899 BAMGQVMXZMIKAP-ZROIWOOFSA-N 338.363 3.037 50 40 EGGB C=C(C)CSC1=C(C#N)[C@@H](c2ccc3c(c2)OCO3)CC(=O)N1 9110941 QHJUTGWSZREWIP-GFCCVEGCSA-N 328.393 3.063 50 40 EGGB C[C@]12CCCC[C@H]1[C@@H]2C(=O)N/N=C/c1cc2c(cc1Cl)OCO2 17070553 MXYMIHPOASHEIG-WEKJFGCDSA-N 334.803 3.345 50 40 EGGB CCOC(=O)/C(C#N)=C1/C(=O)N2c3c1cc(C)cc3[C@H](C)CC2(C)C 544240 NRYGQUMWIKAUDL-IUDBQGPFSA-N 338.407 3.468 50 40 EGGB CCc1nn(C)c(C(=O)N/N=C/c2ccc(Cl)cc2)c1Cl 130050 SUVUWNFJUPQELR-CAOOACKPSA-N 325.199 3.053 50 40 EGGB COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ncc(C)s2)c1C 10442668 KLPANPMNLGDNTF-OVCLIPMQSA-N 344.440 3.062 50 40 EGGB CC[C@@H](Nc1cccc(C)c1)C(=O)N/N=C/c1ccc2c(c1)OCO2 369846 GORLDIWBVGFBEX-MBTVCVBTSA-N 339.395 3.065 50 40 EGGB C/C(=N\NC(=O)[C@H]1COc2ccccc2O1)c1ccc(Cl)cc1 4694090 ZBNYUJQWPJBMBY-YDDPGSGASA-N 330.771 3.020 50 40 EGGB C/C(=N\NC(=O)COc1ccc(C)c(C)c1)c1cc([N+](=O)[O-])cs1 4694194 LMBRJMRTXXNCDN-SFQUDFHCSA-N 347.396 3.192 50 40 EGGB Nc1ccc([N+](=O)[O-])cc1SSc1cc([N+](=O)[O-])ccc1N 5590467 PEYNJTZILVSHOP-UHFFFAOYSA-N 338.370 3.467 50 40 EGGB Cc1ccc(NC(=S)NNC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)cc1 8685947 LLWBZGOISSXWHX-SJORKVTESA-N 339.464 3.425 50 40 EGGB CC1(C)COc2ccc(/C=N/NC(=O)Cc3ccccc3)cc2OC1 225371074 XWGZNAZKSGROCY-CIAFOILYSA-N 338.407 3.177 50 40 EGGB CSc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2C)cc1 5921560 GOSJWRYXQUITRB-LICLKQGHSA-N 329.381 3.389 50 40 EGGB C=CCNC(=O)/C(C#N)=C\c1ccc(OC)c(OCc2ccccc2)c1 33431703 CTMUTJQVBXJCAW-PDGQHHTCSA-N 348.402 3.483 50 40 EGGB CCOc1ccc(/C=C(\C#N)C(=O)NCc2cccs2)cc1OC 59534253 GZODFUKOOKSTBO-NTEUORMPSA-N 342.420 3.379 50 40 EGGB Cc1cc(C)n(C(=O)/C(C#N)=C/c2cc([N+](=O)[O-])ccc2Cl)n1 409381713 IUVRROLRONDMCM-WUXMJOGZSA-N 330.731 3.309 50 40 EGGB Cc1ccc(OCCCOc2ccc(/C=N/NC(N)=O)cc2)cc1C 4673323 SPWJHRXLPBBJBU-FYJGNVAPSA-N 341.411 3.154 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)NC2CCCC2)cc1Br 5720644 ZGLDPEHDNUZHFB-WQLSENKSSA-N 349.228 3.423 50 40 EGGB CCOc1ccccc1NC(=O)/C(C#N)=C\c1ccc(O)c(OC)c1 6271012 YBMULXMOJDHDSI-UVTDQMKNSA-N 338.363 3.345 50 40 EGGB COc1ccccc1C(=O)NNC(=O)c1ccc(Cl)c(Cl)c1 290054 JWNXYENMEGJRRF-UHFFFAOYSA-N 339.178 3.077 50 40 EGGB C=CCOc1ccc([C@H]2C(C#N)=C(N)Oc3cc(N)ccc32)cc1OC 8846191 HKBVGXBGXNHWJE-LJQANCHMSA-N 349.390 3.060 50 40 EGGB O=C(N/N=C\c1ccncc1)c1cc2cc(Br)ccc2o1 33437557 NGQFXFVMUJCWMN-NVMNQCDNSA-N 344.168 3.354 50 40 EGGB COc1ccc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)cc1 313891 OHWJLAQDASJOAD-UDWIEESQSA-N 326.396 3.494 50 40 EGGB CCn1c(C)c(/C=N/NC(=O)c2ccc3c(c2)OCO3)c2ccccc21 487278 DVNJVYSKGBMUMT-SRZZPIQSSA-N 349.390 3.462 50 40 EGGB Cc1cc(C(=O)O)ccc1-c1ccc(/C=C(/C#N)C(=O)NC(C)C)o1 208171648 MZWMMIJGPQLEKB-ZROIWOOFSA-N 338.363 3.385 50 40 EGGB COc1cc(C(=O)NN)ccc1OCc1ccc(Cl)cc1Cl 226319790 GKAIATAUEJTHMP-UHFFFAOYSA-N 341.194 3.185 50 40 EGGB C/C(=N\NC(=O)c1cccc(Br)c1)c1ccccc1O 100004284 LKYCGOVBIABECZ-LICLKQGHSA-N 333.185 3.309 50 40 EGGB Cc1cc(C(=O)N/N=C/c2ccc([N+](=O)[O-])s2)c2ccccc2n1 254078 GINMSOQRMYHPRM-RQZCQDPDSA-N 340.364 3.277 50 40 EGGB N#CC(C(=O)CN1CC[C@@H]2CCCC[C@@H]2C1)=C1Nc2ccccc2N1 7612863 WFRPBXVKZBFGCV-LSDHHAIUSA-N 336.439 3.340 50 40 EGGB O=C(OCc1ccccc1)N1CCC[C@H](I)C1 79436625 AEWKGKKUTPDGLB-LBPRGKRZSA-N 345.180 3.223 50 40 EGGB BrC[C@H]1CCCN(c2cccc(Br)n2)C1 79440401 WQGVRSFFTWZNBZ-SECBINFHSA-N 334.055 3.455 50 40 EGGB COc1ccccc1/C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12 33323650 OIGJNOOPAAQMQX-ATVHPVEESA-N 345.402 3.442 50 40 EGGB COc1cccc(C(=O)N/N=C/c2ccc(N3CCCCC3)cc2)c1 564199 VGBDXGMTYOQWNU-RCCKNPSSSA-N 337.423 3.449 50 40 EGGB O=C1c2ccccc2C(=O)c2c(NC(=O)[C@@H](Cl)CCl)cccc21 5082458 NMNHTHKXGSVAQT-LBPRGKRZSA-N 348.185 3.247 50 40 EGGB CCCOC(=O)/C(C#N)=C/c1cc2c(cc1Br)OCO2 2199250 ULNRYXNNJZYEMQ-ONNFQVAWSA-N 338.157 3.038 50 40 EGGB CCOC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(C)cc1 3273755 WFJMPSGEBMQODJ-LFIBNONCSA-N 334.379 3.242 50 40 EGGB COc1cc(/C=N/NC(=O)c2ccc(F)cc2)ccc1OC(C)C 8812346 PHIRMGYJLYCEMV-RGVLZGJSSA-N 330.359 3.385 50 40 EGGB Cc1cc(C(=O)O)ccc1-c1ccc(/C=N/NC(=O)c2ccncc2)o1 35804770 SBKHRYBZFCFCNI-SRZZPIQSSA-N 349.346 3.112 50 40 EGGB CN1C(=O)/C(=C(/C#N)C(=O)Nc2ccc(Cl)cc2)c2ccccc21 59145966 QORDQVQSBSBODD-PEZBUJJGSA-N 337.766 3.232 50 40 EGGB CCOc1ccccc1/C=N/NC(=O)c1c(C)nc2ccc(C)cn12 59444029 UDLXBORGSWKORQ-RGVLZGJSSA-N 336.395 3.114 50 40 EGGB O=C(COc1ccccc1F)N/N=C/c1ccc(C(F)(F)F)cc1 6684972 PXBAJNHLPYXNPT-ZVBGSRNCSA-N 340.276 3.374 50 40 EGGB COc1ccc([C@@H]2C(C#N)=C(N)Oc3n[nH]c(-c4ccccc4)c32)cc1 4891236 WRINBBKPZKSBMR-MRXNPFEDSA-N 344.374 3.303 50 40 EGGB N#C/C(=C\c1ccc(OCc2ccccc2C#N)cc1)C(=O)NC1CC1 409204609 BGIOGPXFPWSCBI-WOJGMQOQSA-N 343.386 3.323 50 40 EGGB Cc1ccc2ncnc(Oc3ncccc3NC(=O)CCl)c2c1 163317 FVOFOUNUDDVHSX-UHFFFAOYSA-N 328.759 3.303 50 40 EGGB COc1ccc(-c2cc(C(=O)N/N=C3/CCC[C@@H](C)C3)[nH]n2)cc1 40161308 GGEFMHPONHSLRZ-NODXGKJPSA-N 326.400 3.381 50 40 EGGB CN(NC(=O)Cc1cc(Cl)c2c(c1)OCCCO2)c1ccccc1 53372014 ZCENYJGPQYWUEG-UHFFFAOYSA-N 346.814 3.211 50 40 EGGB COc1ccc2c(c1)c(C(=O)CI)c(C)n2C 34925363 IWDPQQZCTAJEGR-UHFFFAOYSA-N 343.164 3.113 50 40 EGGB CCOc1ccc(C(=O)N/N=C/c2ccc(OC(C)C)cc2O)cc1 20764403 SXUIWSORAGYWNH-UDWIEESQSA-N 342.395 3.342 50 40 EGGB COc1cc(Cl)c(/C=N/NC(=O)c2ccccc2OC)cc1OC 66202226 AGNSDSBYNBGHQL-VXLYETTFSA-N 348.786 3.130 50 40 EGGB Cc1cc(C)cc(O[C@@H](C)C(=O)NN=Cc2ccc(N(C)C)cc2)c1 8700749 PBMPMCKIGYVELX-INIZCTEOSA-N 339.439 3.287 50 40 EGGB COCCNC(=O)N/N=C(\C)c1ccc(Oc2ccccc2)c(F)c1 98055349 OMRSIFOGIXHZQP-FYJGNVAPSA-N 345.374 3.288 50 40 EGGB Cc1cc(/C=N\NC(=O)Cc2ccccc2)c(C)n1-c1ccc(O)cc1 408996060 KUFVRKOQFSVSED-HMAPJEAMSA-N 347.418 3.493 50 40 EGGB COc1ccc(C)cc1NC(=O)/C(C#N)=C/c1ccc(OCC#N)cc1 408801477 TZBYWPGETWAKDX-FOWTUZBSSA-N 347.374 3.452 50 40 EGGB C[C@H](Br)C(=O)NC[C@H](OCC1CC1)c1cccc(F)c1 95097938 MKRMIZKGIWOFKC-HZMBPMFUSA-N 344.224 3.193 50 40 EGGB O=C(COc1cccc2ccccc12)N/N=C/c1ccccc1[N+](=O)[O-] 261343 OQFDKPDSYRKRPG-UDWIEESQSA-N 349.346 3.277 50 40 EGGB CC[C@H](C(=O)N/N=C/c1ccc(OC)c(OC)c1)c1ccccc1 5953945 KNPAESYCFPKZAX-UOEVCUDDSA-N 326.396 3.348 50 40 EGGB Cc1c(Cl)cccc1NNC(=O)N[C@H]1CCCc2c1cnn2C 47002065 RHQSHDDXEIZQGC-AWEZNQCLSA-N 333.823 3.086 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)OCCOc2ccccc2F)cc1 7896398 XWEDQXCQYKYFNX-NTCAYCPXSA-N 341.338 3.363 50 40 EGGB Cc1nc2ccccc2n1CC(=O)N/N=C/C1=CC[C@H]2C[C@@H]1C2(C)C 24036399 MJDNFXQZNIBKAB-BBQGRHSISA-N 336.439 3.439 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)c2ccccc2O)cc1OCC 408858675 KHSMRRPLEFBHKB-DEDYPNTBSA-N 340.379 3.120 50 40 EGGB CC[C@@H](C)n1nccc1[C@@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2 253402307 OCRCDVGALNMZHM-BZNIZROVSA-N 340.427 3.305 50 40 EGGB C=CCOc1ccc(/C=C(/C#N)C(=O)NC(C)C)cc1Br 5633221 KTEZAEFTWSMQKW-JYRVWZFOSA-N 349.228 3.445 50 40 EGGB COc1cccc(C(=O)N/N=C/c2ccc(OCC(C)C)cc2)c1 169878653 TXMVSOXSQAGGLT-UDWIEESQSA-N 326.396 3.494 50 40 EGGB CC(C)(O)C(=O)N/N=C/c1ccccc1OCc1ccccc1Cl 32578393 VKXNZFIMDMDGGJ-RGVLZGJSSA-N 346.814 3.140 50 40 EGGB C/C(CC(=O)Nc1ccc(C)c(Cl)c1)=N\NC(=O)c1ccco1 4610860 SXEUJNPIJVWAMY-YBFXNURJSA-N 333.775 3.376 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 4953592 YGVRPIZQFDQOKA-GXDHUFHOSA-N 337.335 3.458 50 40 EGGB COc1ccccc1/C=N/NC(=O)CSCc1ccccc1C 408781630 DDDBKLIHHCABBI-YBFXNURJSA-N 328.437 3.387 50 40 EGGB CC[C@@H](C)NC(=O)/C(C#N)=C/c1ccc(OC)c(Br)c1 408812356 LQPBBWPUJGMBDA-CEXMDJMXSA-N 337.217 3.279 50 40 EGGB C/C(=N\NC(=O)CSCc1cccc([N+](=O)[O-])c1)c1cccs1 408724914 CDCQRETZLKNMNE-LFIBNONCSA-N 349.437 3.430 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@@H]1c1ccccc1F 140816 STXWLFRYUMGSKK-CYBMUJFWSA-N 338.367 3.495 50 40 EGGB Cc1n[nH]c2c1[C@H](c1ccc(OC3CCCC3)cc1)C(C#N)=C(N)O2 4631711 YLCYAPUAXRFAOM-QGZVFWFLSA-N 336.395 3.258 50 40 EGGB C#CCOc1cccc(/C=C(/C#N)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 408942153 XVDSTCCNPOGIEG-GDNBJRDFSA-N 347.330 3.152 50 40 EGGB COc1ccccc1/C=N/NC(=O)c1cccc(Br)c1 362248 QEJDRXVJAXGUPX-LICLKQGHSA-N 333.185 3.222 50 40 EGGB O=C(NNC(=S)Nc1ccccc1)c1csc2c1CCCC2 568033 VRCKYCRWABDLLA-UHFFFAOYSA-N 331.466 3.258 50 40 EGGB COc1cc(C(=O)N/N=C(\C)c2ccc(C)s2)cc(OC)c1OC 5618521 GHLWMQZYXUDQBE-WOJGMQOQSA-N 348.424 3.236 50 40 EGGB N#C/C(=C\c1cc(Cl)ccc1OCc1ccc(C#N)cc1)C(N)=O 408923544 FXRJAOGTPLCOSH-VIZOYTHASA-N 337.766 3.183 50 40 EGGB COc1ccc(CNC(=O)/C(C#N)=C/c2ccc(F)cc2)c(OC)c1 408865945 DZRBGUHACLJGAS-OQLLNIDSSA-N 340.354 3.066 50 40 EGGB C[C@@H](NC(=O)/C(C#N)=C\c1ccc2c(c1)OCCO2)c1ccccc1 6383254 QAMDMVMVUMNVMI-RQNDZEIBSA-N 334.375 3.242 50 40 EGGB O=C(N/N=C/c1ccco1)[C@@H]1Oc2ccccc2O[C@@H]1c1ccccc1 33534222 FCDVMPIMSLNVSI-MULLOCEMSA-N 348.358 3.311 50 40 EGGB COc1cc(/C=N\NC(=O)C23CC4CC(CC(C4)C2)C3)ccc1O 36635154 QQLDUAREXRIMNR-JAIQZWGSSA-N 328.412 3.067 50 40 EGGB COc1cc(/C=N/NC(=O)c2ccccc2Cl)cc(OC)c1OC 249477 YFGIMVYTUHTQFC-VXLYETTFSA-N 348.786 3.130 50 40 EGGB O=[N+]([O-])c1ccc([S@@](=O)[C@@H]2CCCC[C@@H]2Cl)c([N+](=O)[O-])c1 5215354 OMSWTTLZLNVEJO-KJKXQFFYSA-N 332.765 3.161 50 40 EGGB C#CCOc1ccc(/C=N/NC(=O)c2ccc(F)cc2)cc1OCC 7894207 FXQGFWFOTUYCKF-FYJGNVAPSA-N 340.354 3.000 50 40 EGGB CCCC(CCC)=NNC(=O)C(=O)Nc1cc(Cl)ccc1OC 59516310 RNJNFTNVWMPMDD-UHFFFAOYSA-N 339.823 3.360 50 40 EGGB O=C(N/N=C/c1ccc2ccccc2c1O)c1ccccc1[N+](=O)[O-] 2749022 SQFYLIMYEDBQJY-YBFXNURJSA-N 335.319 3.218 50 40 EGGB O=C(CBr)c1cccc(I)c1F 169795979 XHSZHDOJQDQCBR-UHFFFAOYSA-N 342.933 3.008 50 40 EGGB Cc1cc(C)c(OCC(=O)N/N=C/c2ccccc2[N+](=O)[O-])c(C)c1 356775 LOXRNOPETNUMIQ-VXLYETTFSA-N 341.367 3.049 50 40 EGGB CCO[Si](OCC)(OCC)c1ccccc1C#C[Si](C)(C)C 575182233 MBGKHXJHXMNWGO-UHFFFAOYSA-N 336.580 3.171 50 40 EGGB C#CCOc1ccc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cc1 4454767 BIKVYXUOLRBDQC-GOSISDBHSA-N 348.402 3.149 50 40 EGGB Cn1c(/C(C#N)=C\c2ccc(OCC(=O)O)cc2)nc2ccccc21 44720925 NUYUMAJKOAOYKV-UVTDQMKNSA-N 333.347 3.101 50 40 EGGB C=CCn1cc(/C=N/NC(=O)c2ccccc2[N+](=O)[O-])c2ccccc21 408599200 PWCHYXPCLZRIIE-UDWIEESQSA-N 348.362 3.499 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@@H](c2ccc3c(c2)OCO3)[C@H]2CCCC=C12 35185237 LMOAEQHNEPYZAY-KSSFIOAISA-N 344.374 3.009 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)COc2ccccc2C)cc1 40910504 LPMPQAKWHRCCRZ-DEDYPNTBSA-N 326.396 3.313 50 40 EGGB Cc1nn(-c2ccccc2)c(Cl)c1/C=N/NC(=O)c1ccco1 241926 FAGJHGPKZZNRMU-VCHYOVAHSA-N 328.759 3.191 50 40 EGGB Cc1cc(/C=N/NC(=O)c2ccncc2)c(C)n1-c1ccccc1F 3174992 PQNSDVKTAUSBPC-WSDLNYQXSA-N 336.370 3.392 50 40 EGGB Cc1cc(SCC(=O)N/N=C/c2cccnc2)nc2ccccc12 4091500 SNFBTPAOLKWTGD-RGVLZGJSSA-N 336.420 3.181 50 40 EGGB C/C(CC(=O)Nc1cccc(Cl)c1C)=N\NC(=O)c1ccncc1 5809954 VVHPEDACSPTYLO-SRZZPIQSSA-N 344.802 3.178 50 40 EGGB Cc1ccc(NNC(=O)c2cnc(-c3cccc([N+](=O)[O-])c3)nc2)cc1 106113405 SWISIVGQHLQVKH-UHFFFAOYSA-N 349.350 3.117 50 40 EGGB CC(C)(C)c1nn(-c2ccccc2)cc1C(=O)N1CC=C(C#N)CC1 95981278 KRBHMXISOFWXKI-UHFFFAOYSA-N 334.423 3.466 50 40 EGGB N#C/C(=C/c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1ccc(O)cc1 409377697 KNDLSVDOFTWMPP-XFFZJAGNSA-N 343.726 3.499 50 40 EGGB Cc1cccc(NC(=O)N/N=C\c2ccc(O)c([N+](=O)[O-])c2)c1C 408963693 OMUMPXYAMVFCLX-MFOYZWKCSA-N 328.328 3.073 50 40 EGGB C=CCSC1=C(C#N)[C@@H](c2ccccc2OCC)[C@@H](C#N)C(=O)N1 9357121 IBUQJZKOGSOOCN-CJNGLKHVSA-N 339.420 3.093 50 40 EGGB COc1cccc(/C=N/NC(=O)c2ccc(Cl)c(Cl)c2)c1O 62772 SWNBEGAHABHYPX-QGMBQPNBSA-N 339.178 3.472 50 40 EGGB CCOc1cc(/C=N/NC(=O)[C@@H]2[C@H]3CCCC[C@@]32C)ccc1OC 102034337 ZLIMSBWJFFCIJE-FUIRCSSXSA-N 330.428 3.370 50 40 EGGB CC1=C(C(=O)OCCCCl)[C@H](c2ccccc2Cl)NC(=O)N1 4091272 BIZKUIXKMWFZST-ZDUSSCGKSA-N 343.210 3.140 50 40 EGGB Cc1ccc(/C=N\NC(=O)COc2ccc(Cl)cc2C)c(O)c1 19877982 XEJNDAGMTKEDTC-OCKHKDLRSA-N 332.787 3.192 50 40 EGGB O=C(N/N=C(\c1ccccc1)c1ccccn1)c1ccc([N+](=O)[O-])cc1 17072054 ADZSNFXKLNDXFU-DYTRJAOYSA-N 346.346 3.172 50 40 EGGB COc1ccc2[nH]c(C(=O)N/N=C(\C)c3ccccc3OC)cc2c1 9095107 DWOQTLCXRRUVKE-CIAFOILYSA-N 337.379 3.339 50 40 EGGB CC(C)N1C(=O)/C(=C(\C#N)C(=O)Nc2ccccc2)c2ccccc21 141503464 LEQZBUMNEVCMLP-FBMGVBCBSA-N 331.375 3.357 50 40 EGGB O=C(N/N=C/c1ccc(N2CCOCC2)cc1)c1cc2ccccc2o1 4106935 DUDKANXJSAKTFE-KGENOOAVSA-N 349.390 3.033 50 40 EGGB CCc1cccc2c(/C=N/NC(=O)[C@H](C#N)c3ccccc3)c[nH]c12 8088015 BXCFEBVOQZEFBC-ZMPUUUETSA-N 330.391 3.488 50 40 EGGB COc1ccc(-n2nc3c(c2NC(=O)[C@H](C)Cl)CSC3)cc1 4223307 MVDZYCYNJQZMRG-VIFPVBQESA-N 337.832 3.194 50 40 EGGB C=CCOc1ccc(/C=N\NC(=O)c2ccc(F)cc2)cc1OC 58885275 MLQVKLIICMMUDZ-NDENLUEZSA-N 328.343 3.163 50 40 EGGB Cc1cc(/C=N\NC(=O)COc2cccc(Cl)c2)cc(C)c1O 108322139 MKKVOMHHGIRNNV-OCKHKDLRSA-N 332.787 3.192 50 40 EGGB C/C(=N\NC(=O)CSCc1ccccc1)c1ccc([N+](=O)[O-])cc1 20248503 JTXVXIXSNASXQD-QGOAFFKASA-N 343.408 3.368 50 40 EGGB CCOc1ccc(/C=C(\C#N)C(=O)NCc2ccco2)cc1OCC 192724984 ZMXVIMKHALRXNK-XNTDXEJSSA-N 340.379 3.300 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/c2cc([N+](=O)[O-])c(C)s2)cc1C 137829 GTQKZPFAWXFCDT-CAOOACKPSA-N 347.396 3.111 50 40 EGGB COc1ccc(-c2cc(C(=O)N/N=C3/CCC[C@H](C)C3)[nH]n2)cc1 40161309 GGEFMHPONHSLRZ-DSVMPHHWSA-N 326.400 3.381 50 40 EGGB O=C(Nc1cccc(I)c1)C(Cl)Cl 458173 TYBATNTZVQOXLU-UHFFFAOYSA-N 329.952 3.033 50 40 EGGB O=C(N/N=C/c1cc(Cl)c(O)c2ncccc12)c1ccccc1 59459120 KPSUPNCMZXSKRR-KEBDBYFISA-N 325.755 3.358 50 40 EGGB CSc1ccc(/C=N/NC(=O)C(=O)Nc2cccc(Cl)c2)cc1 59444369 HLLWDXGTTDVZSS-VCHYOVAHSA-N 347.827 3.151 50 40 EGGB CC/C(=N\NC(=O)COc1ccccc1OC)c1ccc(F)cc1 5164353 MQBNEMUZYCIHJO-HMMYKYKNSA-N 330.359 3.144 50 40 EGGB C/C(=N\NC(=O)C(=O)Nc1ccccc1Cl)c1ccc(C)cc1 13882116 BDGCKPOAIDQYIS-UDWIEESQSA-N 329.787 3.127 50 40 EGGB CCn1cccc1/C=C(/C#N)C(=O)NCCc1c[nH]c2ccccc12 408947643 CTNYETBHYYUQOT-VBKFSLOCSA-N 332.407 3.255 50 40 EGGB Cc1nn([C@H](C)C(=O)N/N=C/c2ccc(F)s2)c(C)c1Cl 252478608 AQHTUSODXRYZTJ-JPEBENEDSA-N 328.800 3.065 50 40 EGGB COc1cc(/C=N/NC(=O)c2cccc(Cl)c2)ccc1OC(C)=O 112590 CADYFQRETOZGPE-VXLYETTFSA-N 346.770 3.038 50 40 EGGB CC(C)c1ccc(OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1 568882 JUMVQBUZHPIHJZ-UHFFFAOYSA-N 346.814 3.303 50 40 EGGB CCCC/C=N/NC(=O)c1cccc(C(=O)N/N=C/CCCC)c1 4855145 ABWJXBJOSHYPTF-KVOOEGMKSA-N 330.432 3.498 50 40 EGGB C=CCSC1=C(C#N)[C@H](c2ccccc2C)[C@H](C(=O)OC)C(O)=N1 2296629 HXTRQANFUURSHF-GJZGRUSLSA-N 342.420 3.492 50 40 EGGB COc1ccnc(NNC(=O)c2ccc(-c3ccccc3Cl)o2)n1 46364225 QXMREKDMVLDJIW-UHFFFAOYSA-N 344.758 3.156 50 40 EGGB N#C/C(=C\c1ccc(O)c(O)c1)C(=O)Nc1nc2ccccc2s1 4670367 PJWSGTLPGNRRQK-YRNVUSSQSA-N 337.360 3.253 50 40 EGGB COc1ccc(C(=O)N/N=C\c2ccc(N3CCCC3)c(C)c2)cc1 408851283 AWZFTXHZZNJJKH-STZFKDTASA-N 337.423 3.368 50 40 EGGB O=C(CCc1ccccc1O)N/N=C/c1ccc2ccccc2c1O 408562964 HAVJYNHEKHFDQG-FYJGNVAPSA-N 334.375 3.334 50 40 EGGB COc1ccc(-n2c(C)cc(/C=N/NC(=O)c3ccco3)c2C)cc1 408999049 RFTCZDGLUQMCSO-UDWIEESQSA-N 337.379 3.460 50 40 EGGB COc1cc(C)ccc1C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1Cl 409119612 SHZARKMCYLPRAP-GIJQJNRQSA-N 347.758 3.329 50 40 EGGB COc1ccc(C(=O)/C(C#N)=C\c2cc(OC)c(O)c(OC)c2)cc1 72120191 KYBUIVGBLBRAGS-ZSOIEALJSA-N 339.347 3.208 50 40 EGGB Cc1ccc(C(C)C)cc1OCC(=O)NNC(=O)Nc1ccccc1 51750 KHUOOZPQVDVJPW-UHFFFAOYSA-N 341.411 3.350 50 40 EGGB C=CCc1cc(/C=C(/C#N)C(=O)N(C)C)cc(OCC)c1OCC 59334881 ZPLWRGYGAVRHNU-WJDWOHSUSA-N 328.412 3.208 50 40 EGGB COc1cc(/C=N/NC(=O)CCSc2ccc(C)cc2)ccc1O 409140238 QBSOGEORXXBWOO-XDHOZWIPSA-N 344.436 3.342 50 40 EGGB Cc1ccc2nc(/C(C#N)=C\c3ccc4c(c3)n(C)c(=O)n4C)[nH]c2c1 12364223 HIYWWNKKQXYDSZ-ZROIWOOFSA-N 343.390 3.126 50 40 EGGB Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2cccc(Cl)c2)c1C 12778205 GSFYXQXYUHQOSU-ZDUSSCGKSA-N 346.814 3.185 50 40 EGGB N#C/C(=C\c1c[nH]c2cc(Cl)ccc12)C(=O)NCc1cccnc1 61719388 SYKSVSRIXXQUSV-AWNIVKPZSA-N 336.782 3.440 50 40 EGGB Cc1cc(C)nc(NNC(=O)[C@H](C)Sc2ccccc2Cl)n1 48251932 RVGXAFTZAVAGLV-NSHDSACASA-N 336.848 3.371 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2)ccc1OCC#N 212796431 XOYCOJZANDCGMM-PTNGSMBKSA-N 333.347 3.143 50 40 EGGB NNC(=O)CCc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1 226345255 SSGZMEAEWRGBTP-UHFFFAOYSA-N 339.222 3.495 50 40 EGGB COc1ccc(CC(=O)N/N=C(\c2ccccc2)c2ccncc2)cc1 369542 RUBDLUQVTUUWQD-DARPEHSRSA-N 345.402 3.202 50 40 EGGB N#CC1=C2SC[C@@](O)(c3ccccc3)N2C(=O)C[C@H]1c1ccccc1 544540 UNAZSKRCBSOLLX-OXJNMPFZSA-N 348.427 3.330 50 40 EGGB CCOc1ccc(/C=N/NC(=O)[C@H]2[C@H]3CCCC[C@]23C)cc1OC 100216239 DZVFTTHPJVLOEH-DLVQAKNOSA-N 330.428 3.370 50 40 EGGB Cc1c(C(=O)N/N=C/c2ccc(C(C)C)cc2)sc(N)c1C#N 408723829 SIKDUMNBCCYEIP-AWQFTUOYSA-N 326.425 3.398 50 40 EGGB CC1=NN(c2ccccc2)C(=O)[C@H]1/C=C(/C#N)C(=O)Nc1ccccc1 408741723 KUSCOODDFLMTLO-NZHZHZHDSA-N 344.374 3.114 50 40 EGGB COc1ccc(S(=O)(=O)/C(C#N)=C/c2ccc(F)cc2F)cc1 80345421 JLLFFSRUQKBDTO-OVCLIPMQSA-N 335.331 3.312 50 40 EGGB COc1cccc(/C=C(\C#N)C(=O)c2ccc3c(c2)OCO3)c1OC 44028898 URTBXCSFENAABH-RIYZIHGNSA-N 337.331 3.222 50 40 EGGB C/C(=N\NC(=O)[C@@H]1COc2ccccc2O1)c1ccc(Cl)s1 5164208 FFMYEPDTPWQSSE-UWONZBIMSA-N 336.800 3.082 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)Nc2cccnc2)ccc1OC(C)C 8691965 CHONOEHMTNFAAV-OQLLNIDSSA-N 337.379 3.423 50 40 EGGB CC1(C)[C@H]2C[C@@H]1[C@]1(C)OB([C@@H](N)CCCCBr)O[C@@H]1C2 230830686 PVVJGTPJGQMPGM-AIUMHDJVSA-N 344.102 3.146 50 40 EGGB CC(C)=C[C@H]1[C@H](C(=O)NNC(=O)c2ccc3ccccc3n2)C1(C)C 31550352 ASSKLIRNSWATTK-WMLDXEAASA-N 337.423 3.234 50 40 EGGB CC[C@@H](Nc1ccc(C)cc1)C(=O)N/N=C/c1ccc([N+](=O)[O-])s1 369817 WMTCNTOLVJQKPU-NGWPFTMJSA-N 346.412 3.306 50 40 EGGB Cc1cc(C)nc(N2N[C@@H](c3ccc(Cl)cc3)C(C#N)=C2O)n1 14162632 JVVFZIQFQQBUEE-AWEZNQCLSA-N 327.775 3.106 50 40 EGGB C/C(CC(=O)Nc1cccc(C(F)(F)F)c1)=N\NC(=O)C(C)C 5293682 WMZIHNFHEJCYLA-KEBDBYFISA-N 329.322 3.182 50 40 EGGB CCCOc1ccc(C(=O)NNC(=S)Nc2ccccc2F)cc1 6786521 WYROKXDXBOUCCT-UHFFFAOYSA-N 347.415 3.246 50 40 EGGB COc1ccc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CCC3)cc1Cl 555586 SFNIEGIQQIPXNJ-HNNXBMFYSA-N 330.771 3.163 50 40 EGGB C/C(CC(=O)Nc1ccc(C)c(Cl)c1)=N\NC(=O)c1ccccn1 4670504 SGBNDKWZDDHUOY-CIAFOILYSA-N 344.802 3.178 50 40 EGGB NC(=O)N/N=C/c1cn(Cc2ccc(Cl)cc2)c2ccccc12 409383911 OMBRAQRSQQZORB-AWQFTUOYSA-N 326.787 3.345 50 40 EGGB N#C/C(=C/c1ccc(N2CCCC2)c(F)c1)C(=O)NC1CCCC1 409192622 FOYMLAQEWANIET-PTNGSMBKSA-N 327.403 3.392 50 40 EGGB CCOc1ccc(/C=C(\C#N)C(=O)Nc2nccs2)cc1OC 142460 WFNVYNHZFXLQAU-XYOKQWHBSA-N 329.381 3.096 50 40 EGGB CCc1ccc(/C=N/NC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3)C2)cc1 342609 HEOORIMEZOPHAG-MNOULKQQSA-N 349.434 3.061 50 40 EGGB CN1/C(=C(\C#N)C(=O)c2ccc([N+](=O)[O-])s2)Nc2ccccc21 100812941 ODIIKWJWSCLGFT-OQLLNIDSSA-N 326.337 3.136 50 40 EGGB COCCOC(=O)/C(C#N)=C/c1cccc(OCc2ccccc2)c1 3506193 LXWDVWJLUBVIMG-LDADJPATSA-N 337.375 3.362 50 40 EGGB COc1ccccc1N[C@H](C)C(=O)N/N=C(/C)c1ccc(C)cc1 4619267 PPIIADHXFFOZDK-XWCAUFEOSA-N 325.412 3.344 50 40 EGGB Cn1cccc1/C=C(/C#N)C(=O)Nc1ccc(Br)cc1 409098356 PPAGGQBUJJYVKW-LUAWRHEFSA-N 330.185 3.333 50 40 EGGB COC(=O)COc1ccc(/C=C(/C#N)Cn2cnc3ccccc32)cc1 408691609 IHXMTOVFRJOUNX-YBEGLDIGSA-N 347.374 3.195 50 40 EGGB COc1cc(/C=N\NC(=O)c2cc3ccccc3o2)ccc1OCC#N 408857699 VWQYZGDOWBAMEH-MTJSOVHGSA-N 349.346 3.108 50 40 EGGB CC(C)(C)OC(=O)N1CCC[C@H](CCI)C1 95085114 ZCEOHFLQAXHPEA-SNVBAGLBSA-N 339.217 3.459 50 40 EGGB O=C(N/N=C/c1cccn1-c1ccccc1)c1ccc([N+](=O)[O-])cc1 2437855 CASCRCBNDZRCQY-CPNJWEJPSA-N 334.335 3.149 50 40 EGGB CSc1ccc(/C=N/NC(=O)C(=O)Nc2ccccc2Cl)cc1 5721364 TXUBDEQYHJNDRA-VCHYOVAHSA-N 347.827 3.151 50 40 EGGB COc1cc(/C=C(/C#N)C(N)=O)ccc1OCc1cccc(Cl)c1 13635736 CBNOPFCANHCPCF-AUWJEWJLSA-N 342.782 3.320 50 40 EGGB CCCC1=C(C(=O)OCC)[C@@H](c2ccc(C)cc2)C(C#N)=C(N)O1 71034 UQVPSMNKVTWLGT-INIZCTEOSA-N 326.396 3.420 50 40 EGGB O=C(NNc1ncnc2ccccc12)c1ccc(C(F)(F)F)cc1 32830953 XPJGUDPJVXEESK-UHFFFAOYSA-N 332.285 3.406 50 40 EGGB CCOC(=O)c1ccc(NC2=NC[C@@H](CBr)S2)cc1 283679 RBXLIZZKZONKDN-LLVKDONJSA-N 343.246 3.142 50 40 EGGB C#CCn1c(C)c(/C=N/NC(=O)COc2ccccc2)c2ccccc21 408534517 VUYUGJUDYMGCJM-HYARGMPZSA-N 345.402 3.112 50 40 EGGB NNC(=O)/C=C/c1cccc(OCc2cccc(Br)c2)c1 216897071 LQWPFPFIGVGERH-BQYQJAHWSA-N 347.212 3.031 50 40 EGGB CC1=C(C#N)[C@@](NC(=O)c2ccc(Cl)cc2)(C(F)(F)F)C(O)=N1 4615325 LPUAUDYMPLRLLO-ZDUSSCGKSA-N 343.692 3.139 50 40 EGGB CCN(CC)c1ccc(/C=C(/C#N)C(=O)NCc2cccnc2)cc1 13774723 IJSFBCSUMGOJKQ-PDGQHHTCSA-N 334.423 3.151 50 40 EGGB O=C(CN1CCCCCC1=O)NN(c1ccccc1)c1ccccc1 54564961 SQRKOQRSNHEXFW-UHFFFAOYSA-N 337.423 3.259 50 40 EGGB C=CCc1cc(/C=C(/C#N)C(=O)N(CC)CC)cc(OCC)c1O 59678233 RFBQBTPOJGTLHG-WJDWOHSUSA-N 328.412 3.295 50 40 EGGB CC(C)Oc1ccccc1/C=N/NC(=O)c1cccc([N+](=O)[O-])c1 4544307 ZGYZVTOVWFRFDS-WOJGMQOQSA-N 327.340 3.146 50 40 EGGB O=C(NNc1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 14907502 VLFOYWMECGHHOS-UHFFFAOYSA-N 325.246 3.371 50 40 EGGB CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc([N+](=O)[O-])o2)cc1 408742589 BDKBCPDAGQXNNE-LUAWRHEFSA-N 327.296 3.132 50 40 EGGB C#CCOc1ccc(OC)cc1/C=N/NC(=O)c1ccc(Cl)cc1 409366960 YJULHYSQQXJUSN-UDWIEESQSA-N 342.782 3.125 50 40 EGGB N#C/C(=C/c1ccc(OCC(=O)O)cc1)c1nc2ccc(F)cc2[nH]1 408569060 YURDQNMZTRLNGB-GHXNOFRVSA-N 337.310 3.230 50 40 EGGB CC1(C)Cc2cc(/C=N\NC(=O)c3ccc([N+](=O)[O-])cc3)ccc2O1 408710926 XGATWPPBXWWNKO-ODLFYWEKSA-N 339.351 3.072 50 40 EGGB Cc1ccc(C(=O)n2c(C)c(C(=O)NN)c3ccccc32)cc1Cl 216955275 OVWCPTBHDUCNKD-UHFFFAOYSA-N 341.798 3.204 50 40 EGGB COc1ccc(C(=O)NNc2nc3c(F)cccc3s2)cc1OC 429764 ZYFFHSLYULEDJA-UHFFFAOYSA-N 347.371 3.210 50 40 EGGB Nc1c(Cl)c(Cl)nc(C(=O)N/N=C/c2ccsc2)c1Cl 21841807 JWOWOZGMGFUMEB-HQYXKAPLSA-N 349.630 3.449 50 40 EGGB CCn1c(C)nc2cc(C(=O)N/N=C/c3ccc(N(C)C)cc3)ccc21 523546 CVKIUXBWIWJZCM-FYJGNVAPSA-N 349.438 3.195 50 40 EGGB O=C(Cl)OC[C@H]1c2ccccc2-c2ccc(S(=O)(=O)O)cc21 2523037 RDNRMPYXJPJOLS-AWEZNQCLSA-N 338.768 3.421 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@@H](c2ccc(Cl)cc2)[C@H]2SCC=C12 1260708 CMNLBGZMBLGANO-GJZGRUSLSA-N 338.823 3.249 50 40 EGGB O=C(NNC(=S)NC1CCCCC1)c1ccc2ccccc2c1 6560995 MTIARELYHKXOEN-UHFFFAOYSA-N 327.453 3.281 50 40 EGGB CCCC1=NN(c2ccccc2)C(=O)/C1=C(/C)NNC(=O)CC(C)C 103918415 HUMUFSGOIAUDJR-JXAWBTAJSA-N 342.443 3.130 50 40 EGGB CCOc1cccc2cc(/C(C)=N/NC(=O)c3cccn3C)oc12 61466480 XXOAJIFADJRTTP-XDHOZWIPSA-N 325.368 3.324 50 40 EGGB O=C(CSc1nc2ccccc2s1)N/N=C1\C[C@H]2C=CC[C@H]12 20932088 WXDJVUBAJRYXDR-OUQHDXKZSA-N 329.450 3.457 50 40 EGGB CCc1ccc(CC(=O)N/N=C\c2cc(Cl)c(O)c(OC)c2)cc1 409364277 OQLKQLOSARTORD-JAIQZWGSSA-N 346.814 3.309 50 40 EGGB CCOc1ccc(/C=C(\C#N)C(=O)NCCCOC)c2ccccc12 5006528 QVTXRZNJYGKVPM-DTQAZKPQSA-N 338.407 3.298 50 40 EGGB CCOc1ccc([C@@H]2C(C#N)=C(N)Nc3nc4ccccc4n32)cc1 55175182 BQBXPPRMJHGRGX-QGZVFWFLSA-N 331.379 3.144 50 40 EGGB N#CC1=C(N)N2C(=C(C#N)[C@@H]1c1ccccc1F)Nc1ccccc12 495074 UFKXIRLBYIOVFG-QGZVFWFLSA-N 329.338 3.284 50 40 EGGB CCCC(CCC)=NNC(=O)C(=O)Nc1ccc(OC)c(Cl)c1 4525742 NMSFEBMCIZZMRL-UHFFFAOYSA-N 339.823 3.360 50 40 EGGB O=C(CSc1cccc2cccc(Cl)c12)NNC(=O)C1CC1 26968134 RBBLUDDLWPLSFN-UHFFFAOYSA-N 334.828 3.143 50 40 EGGB O=C(NNC(=O)c1ccc(OCc2ccccc2)cc1)c1ccccc1 3379749 JEUKGLXPGUYFDG-UHFFFAOYSA-N 346.386 3.340 50 40 EGGB COc1cc2c(cc1/C=C(\C#N)C(=O)Nc1ccccc1C)OCO2 409087184 GTHNPNKUJGGXGW-VGOFMYFVSA-N 336.347 3.278 50 40 EGGB O=C(COc1ccc(Cl)cc1Cl)N/N=C1/C[C@H]2C=CC[C@H]12 5670673 UMUJMDVIMPFHEB-JBIUFTNLSA-N 325.195 3.440 50 40 EGGB CCOc1cc2c(cc1/C=N\NC(=O)c1cccc(Cl)c1)OCO2 409103283 XSVZVMSVDIKLGG-OCKHKDLRSA-N 346.770 3.231 50 40 EGGB CC(=O)NC1=C(C#N)[C@@H](c2ccccc2)C2=C(CC(C)(C)CC2=O)O1 72408121 DPVHQOWDXRLALW-QGZVFWFLSA-N 336.391 3.315 50 40 EGGB Cc1ccc(NC(=O)CCC(=O)N/N=C/c2ccc(C)o2)c(C)c1 6189625 UKDYWCMFIIYJNB-YBFXNURJSA-N 327.384 3.074 50 40 EGGB CC(C)(C)OC(=O)NN=C1CCC(=NNC(=O)OC(C)(C)C)CC1 59382592 JPUJOAXIRIBWEP-UHFFFAOYSA-N 340.424 3.322 50 40 EGGB Cc1ccccc1[C@@H]1C(C#N)=C(N)Oc2c1c(=O)[nH]c1ccccc21 8017734 QCABAXQOPMDVRM-MRXNPFEDSA-N 329.359 3.055 50 40 EGGB FC(F)(Br)C(F)(F)CCI 63148587 RVTKVMQIEJXBMP-UHFFFAOYSA-N 334.876 3.435 50 40 EGGB in-vitro Cc1cc(C(=O)NNC(=O)C2CCCCC2)c(C)n1-c1ccccc1 8027040 AYKWKOFNOIMZEI-UHFFFAOYSA-N 339.439 3.435 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)Nc2ccccc2C(C)=O)ccc1O 408763797 QXVZBCHMYITQFH-ZROIWOOFSA-N 336.347 3.149 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)c2ccccc12 44023138 XPPMKDZGQANOJG-SFKKXYGYSA-N 336.391 3.051 50 40 EGGB O=C(N/N=C\c1cccs1)c1ccc2c(c1)OCC1(CC1)CO2 225369184 YFNAKVIUMIFHJN-NVMNQCDNSA-N 328.393 3.063 50 40 EGGB COc1cccc(C(=O)/C(C#N)=C/Nc2nc(C)cc(Cl)n2)c1 96307519 UEOIJTCGBKFRIR-FMIVXFBMSA-N 328.759 3.149 50 40 EGGB C[C@@H](Oc1cccc(Cl)c1)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 3167220 FJJPNLVZUIQNBS-VDCVXVNISA-N 347.758 3.166 50 40 EGGB CCc1ccc(/C(C)=N/NC(=O)c2cc(OC)cc(OC)c2)cc1 8339108 QHRHJHBFDUMSCL-DEDYPNTBSA-N 326.396 3.420 50 40 EGGB N#CC1=C(N)N2C(=C(C#N)C13CCCCC3)S[C@H]1CCCC[C@@]12O 4163512 DSKJGGWWLWYRDX-KBXCAEBGSA-N 342.468 3.060 50 40 EGGB Cc1cc(N(C)NC(=O)c2ccc(Cl)cc2)nc(Cl)c1C#N 12446168 PRTZMVYHUKFQAI-UHFFFAOYSA-N 335.194 3.350 50 40 EGGB CSc1nc2nc(C(Cl)Cl)nc(-c3ccccc3)n2n1 101425421 IOVYBNFLNMHZLT-UHFFFAOYSA-N 326.212 3.384 50 40 EGGB N#Cc1ccc(C(=O)N/N=C/c2cccc(Br)c2)cc1 57787488 XMBDZMPBLCVHBE-VCHYOVAHSA-N 328.169 3.085 50 40 EGGB COC(=O)c1ccc(N/C=C(/C#N)C(=O)Nc2ccc(F)cc2)cc1 11692037 GIFNEIQGKGZYSE-QBFSEMIESA-N 339.326 3.070 50 40 EGGB Cn1c(/C(C#N)=C\c2ccccc2[N+](=O)[O-])nnc1-c1ccccc1 60037100 HQSBEIFQXYWOJI-PTNGSMBKSA-N 331.335 3.454 50 40 EGGB Cc1ccc(C(=O)OCC(=O)C(C#N)=C2Nc3ccccc3N2)s1 6506483 UMVPEYVNHPEPBJ-UHFFFAOYSA-N 339.376 3.055 50 40 EGGB CC/C(=N\NC(=O)COc1ccc(CC)cc1)c1ccc(O)cc1 5877706 WKNQHFYAIODGJP-CZIZESTLSA-N 326.396 3.264 50 40 EGGB O=C(NN[C@@H]1c2ccccc2C(=O)N1C1CCCCC1)c1ccccc1 199417585 IHIMAAJZJZDFHF-IBGZPJMESA-N 349.434 3.408 50 40 EGGB O=C(N/N=C/c1csc([N+](=O)[O-])c1)c1cc2ccccc2cc1O 2699332 GMJOHDZNZDZMEE-CAOOACKPSA-N 341.348 3.279 50 40 EGGB CCn1cccc1/C=N/NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 107987887 YSPRAQHOUVXGQZ-LICLKQGHSA-N 342.380 3.395 50 40 EGGB N#Cc1c(F)cccc1C(=O)[C@H](Br)CBr 308793956 JKMLKHKTLZKZGJ-MRVPVSSYSA-N 334.970 3.038 50 40 EGGB O=C(N/N=C(\C=N\O)c1ccccc1)c1cccc(Br)c1 18286036 ADHPRXQTEYDCTN-WGUKNHOESA-N 346.184 3.043 50 40 EGGB CCOc1cccc(/C=C(/C#N)C(=O)NCCc2ccccc2)c1O 223168235 OQHMZTLLWHIPLN-LGMDPLHJSA-N 336.391 3.057 50 40 EGGB CCOc1cc(/C=C(/C#N)C(=O)Nc2ccc(F)cc2)ccc1O 96930602 SKALUMZTYNERIV-LCYFTJDESA-N 326.327 3.476 50 40 EGGB CCOC(=O)/C(C(=O)CCl)=C(\C)Nc1ccc(OCC)cc1 100459264 HEJSPLIPYFBNBB-RVDMUPIBSA-N 325.792 3.142 50 40 EGGB N#C/C(=C\c1ccc(-c2ccccc2C(=O)O)o1)C(=O)N1CCCC1 409367622 GHRJFIGRVRVCEP-ACCUITESSA-N 336.347 3.174 50 40 EGGB CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)CCl)c2C(N)=O)C1 5383718 FZKXCISDXTZGHZ-MRVPVSSYSA-N 328.865 3.175 50 40 EGGB O=C(NN=C1CCCCCCC1)C(=O)NN=C1CCCCCCC1 5290012 HRIPFJZQAJMJBG-UHFFFAOYSA-N 334.464 3.419 50 40 EGGB Brc1cnc(C(Br)Br)nc1 100027007 LUVQPRWYNSKDFT-UHFFFAOYSA-N 330.805 3.028 50 40 EGGB C/C(=N\NC(=O)c1ccc2c(c1)OCCO2)c1cc2ccccc2o1 17697239 RZVAVICQQBDNHX-UDWIEESQSA-N 336.347 3.358 50 40 EGGB Cc1cc(/C=C(/C#N)C(=O)NC2CCCC2)c(C)n1-c1ccncc1 409195080 RERYLRKWCUSYOX-ATVHPVEESA-N 334.423 3.455 50 40 EGGB COc1ccc(Cl)cc1NC(=O)C(=O)NN=C1CCCCCC1 5514100 UYHLQSAYRUIBLQ-UHFFFAOYSA-N 337.807 3.114 50 40 EGGB C/C(=N\NC(=O)c1c[nH]c2ccccc12)c1ccc(C(=O)O)s1 5516953 BIKYBMFKFAOGFO-GIJQJNRQSA-N 327.365 3.082 50 40 EGGB O=C(CCCC[C@H]1CCSS1)NCCc1ccc(O)c(O)c1 9909330 LSCVFMCTEXGPFX-ZDUSSCGKSA-N 341.498 3.471 50 40 EGGB N#C/C(=C/c1ccccc1[N+](=O)[O-])C(=O)NCCCc1ccccc1 409254276 WNJYWDBOOAVRBU-LGMDPLHJSA-N 335.363 3.251 50 40 EGGB CC[C@@H](Nc1ccc(C)cc1C)C(=O)N/N=C/c1ccc(O)cc1 370662 POCPDLQGNPIOKW-XNHPLOEXSA-N 325.412 3.350 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1 308799 DJTDRRLTLJZTHN-SFQUDFHCSA-N 345.402 3.442 50 40 EGGB O=C(Nc1ccc2oc(=O)ccc2c1)N(CCCl)CCCl 1698335 GIWGOUQTTMWFBC-UHFFFAOYSA-N 329.183 3.105 50 40 EGGB COc1cccc(/C=N/NC(=O)CSCc2ccc(C)cc2)c1 59473544 NRUOZRMNSGISKQ-YBFXNURJSA-N 328.437 3.387 50 40 EGGB CO[C@H](C(=O)N/N=C/c1cccc(Br)c1)c1ccccc1 59371302 ABLNPULKRWSYFG-LZNAANCOSA-N 347.212 3.287 50 40 EGGB C#CCn1cc(/C=N/NC(=O)CNc2ccc(C)cc2)c2ccccc21 408529454 JRUTUVVSTQJNAQ-YDZHTSKRSA-N 344.418 3.145 50 40 EGGB CCCOc1ccc(C(=O)N/N=C(\C)c2ccc(O)cc2O)cc1 216064674 BLCYJJHSJYQDFT-XDHOZWIPSA-N 328.368 3.041 50 40 EGGB O=C(CSCCc1ccccc1)N/N=C/c1ccc([N+](=O)[O-])cc1 5603062 FUUXRHGEPNXTBC-LDADJPATSA-N 343.408 3.021 50 40 EGGB COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N(C)OC)c2C)cc1 24454601 FKPKZKUSUSOYTD-LFIBNONCSA-N 339.395 3.030 50 40 EGGB C[C@H](Oc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2)cc1)C(=O)O 4723180 VBHXRASASJOPEN-JMRXEAOASA-N 336.347 3.084 50 40 EGGB CCOC(=O)/C(C#N)=C\c1ccc(-c2ccc([N+](=O)[O-])cc2OC)o1 6480618 UPJSSLFALRZUMZ-FLIBITNWSA-N 342.307 3.333 50 40 EGGB Cc1nc2c(OCc3ccccc3)cccn2c(=O)c1CCCl 22054541 DFZLZGAIWJGCIJ-UHFFFAOYSA-N 328.799 3.363 50 40 EGGB in-vitro CC[C@H](c1c(F)c(F)c(F)c(F)c1F)[Si](OC)(OC)OC 170014118 LPIFBANUODTLGU-ZCFIWIBFSA-N 330.325 3.293 50 40 EGGB N#C/C(C1=N[C@H](c2ccccc2)CO1)=C1/N[C@@H](c2ccccc2)CO1 100931484 QVVGSAYHUSBCQV-MNSPPERESA-N 331.375 3.253 50 40 EGGB Cn1cc([C@H]2C[C@H]2C(=O)NN(Cc2ccccc2)c2ccccc2)cn1 68237383 MHZOEFGKLVGQHP-WOJBJXKFSA-N 346.434 3.262 50 40 EGGB CCOc1ccccc1/C=N\NC(=O)c1ccc(OCC)c(OC)c1 6355780 GCTALYOIGKSKDT-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB O=C(NC[C@@H]1c2ccccc2CCN1C(=O)CCl)C1CCCCC1 61837 UCJWLIDMRLKKDY-QGZVFWFLSA-N 348.874 3.048 50 40 EGGB C/C(CC(=O)Nc1ccc(N(C)C)cc1)=N\NC(=O)C1CCCCC1 100523017 JBMYJFCDNXRGET-KGENOOAVSA-N 344.459 3.154 50 40 EGGB COc1ccc(C(=O)N/N=C/c2cc(Cl)c(OC)c(OC)c2)cc1 478786 SREXBOKGGYZNPB-VXLYETTFSA-N 348.786 3.130 50 40 EGGB CC(C)(C)c1ccc(/C=N/NC(=O)C(=O)Nc2ccc(F)cc2)cc1 59488458 DNWVTJAFZYGNSC-CIAFOILYSA-N 341.386 3.212 50 40 EGGB O=C(CCl)NCCSCc1ccc(Br)s1 4206332 KODFJQLYAYTMRM-UHFFFAOYSA-N 328.684 3.099 50 40 EGGB C/C(=N/NC(=O)Cn1ccc2ccccc21)c1ccc([N+](=O)[O-])cc1 4676388 CGINKDYOZJXGSX-UYRXBGFRSA-N 336.351 3.090 50 40 EGGB CCc1ccc(CC(=O)N/N=C(\C)c2ccc(OC)c(OC)c2)cc1 409364913 RHICUDUQTKUEMV-KGENOOAVSA-N 340.423 3.349 50 40 EGGB COC1=CC(C=O)=C/C(=C/C=C2/N(C)c3ccccc3C2(C)C)C1=O 34799124 NFYVCGAXKDNNJO-SUQUQSPJSA-N 335.403 3.463 50 40 EGGB COc1cc(/C=N/NC(N)=O)ccc1OCc1cccc2ccccc12 559065 JJWQBNONCJLTLR-WSDLNYQXSA-N 349.390 3.430 50 40 EGGB COc1ccc(C(=O)NNc2nc3c(F)cccc3s2)c(OC)c1 4121337 HZLQARFFGRJERL-UHFFFAOYSA-N 347.371 3.210 50 40 EGGB O=C(N/N=C(\c1ccccc1)c1cccnc1)c1ccc([N+](=O)[O-])cc1 4651824 LDRYZCRDWDHDEX-DYTRJAOYSA-N 346.346 3.172 50 40 EGGB O=C(N/N=C/c1ccc(C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 4699151 XKDMDBORBLASNN-DJKKODMXSA-N 337.257 3.378 50 40 EGGB CCn1c(C)c(/C=N/NC(=O)[C@@H](O)c2ccccc2)c2ccccc21 409268057 XXVMWBPFZYFFAB-IOVUBPJKSA-N 335.407 3.153 50 40 EGGB CCOC(=O)/C(C#N)=C/c1ccc(-c2ccc(F)c([N+](=O)[O-])c2)o1 408830009 MTQNMZCTXBBOFH-YRNVUSSQSA-N 330.271 3.464 50 40 EGGB C/C=C1\CC[N@@+]2(C)CC[C@]34C(=C(C=O)[C@H]1C[C@H]32)N(C)c1ccccc14 585176247 BAXHNXNALPIROW-ZGOSNOHWSA-N 335.471 3.416 50 40 EGGB O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C(Cl)Cl 151874 NDJLQTLZXNNYTC-UHFFFAOYSA-N 332.168 3.461 50 40 EGGB O=C(NNc1ccc(F)cc1)[C@H]1CC(c2ccc(Cl)s2)=NO1 56422207 AZCHYEWUMGOCHN-LLVKDONJSA-N 339.779 3.177 50 40 EGGB COc1cc(/C=N/NC(=O)/C=C/c2ccc(Cl)cc2)ccc1O 9094792 OZHNXMKODBGUSB-QJEBJFPOSA-N 330.771 3.218 50 40 EGGB CCOc1ccc(C(=O)N/N=C\c2cccc(OC)c2)cc1OCC 409323152 NYUDLFWWQZSLFO-MOSHPQCFSA-N 342.395 3.257 50 40 EGGB CN(C)c1ccc(/C=C(/C#N)C(=O)Nc2ccc(N(C)C)cc2)cc1 408773170 HFFHHVHPTVNIAE-SSZFMOIBSA-N 334.423 3.364 50 40 EGGB Cc1ccn2c(C(=O)N/N=C\c3ccc(Cl)cc3)c(C)nc2c1 33284161 HNELMKCJXUBJAZ-GRSHGNNSSA-N 326.787 3.368 50 40 EGGB Cc1cc(C)nc(N2N[C@H](c3ccc(Cl)cc3)C(C#N)=C2O)n1 14162635 JVVFZIQFQQBUEE-CQSZACIVSA-N 327.775 3.106 50 40 EGGB O=C(NNC(=S)NCc1ccccc1)c1ccc2ccccc2c1 6602147 UYIJOGDIJPBZAZ-UHFFFAOYSA-N 335.432 3.149 50 40 EGGB Cc1cc(/C=C(\C#N)C(=O)NC2CC2)c(C)n1-c1ccc2c(c1)OCO2 8056224 OLWBNFSMDUFKPV-OVCLIPMQSA-N 349.390 3.008 50 40 EGGB CNC(=O)/C(C#N)=C/c1ccc2c(ccn2Cc2cccc(F)c2)c1 409232162 OHGYYCLMRBXRPK-LICLKQGHSA-N 333.366 3.482 50 40 EGGB CCOc1ccc(/C=N\NC(=O)Cc2ccc(OCC)cc2)cc1 408711864 OGTNTDPMJJAUMD-ZHZULCJRSA-N 326.396 3.177 50 40 EGGB COc1cc(/C=N/NC(=O)[C@@H]2[C@H]3CCCC[C@@]32C)cc(Cl)c1O 408949480 FNVYQTQPIQZUTR-KAADNQLTSA-N 336.819 3.331 50 40 EGGB Cc1cc(/C=N\NC(=O)Cc2ccccc2[N+](=O)[O-])c(C)n1C(C)C 34888162 ASUFSBSCBHJCPE-ODLFYWEKSA-N 342.399 3.287 50 40 EGGB O=C(N/N=c1\ccc([N+](=O)[O-])c[nH]1)Nc1ccc(-c2ccccc2)cc1 18204201 OWQBBHIKUQUZTI-UHFFFAOYSA-N 349.350 3.227 50 40 EGGB COc1ccc(-n2nc3c(c2NC(=O)[C@@H](C)Cl)CSC3)cc1 4223308 MVDZYCYNJQZMRG-SECBINFHSA-N 337.832 3.194 50 40 EGGB N#Cc1ccccc1-c1ccc(/C=N/NC(=O)c2ccccc2N)o1 573160 MBVARACUKGUGRZ-WSDLNYQXSA-N 330.347 3.164 50 40 EGGB CN(C)C(=O)/C(C#N)=C\c1ccc(OCc2ccccc2C#N)cc1 59333554 DIGYCUYJDNXRGC-WQRHYEAKSA-N 331.375 3.132 50 40 EGGB COc1ccc(/C=C(\C#N)c2nc(O)c3ccccc3n2)cc1[N+](=O)[O-] 3899769 BIZMJSFUEYPGPO-XYOKQWHBSA-N 348.318 3.316 50 40 EGGB CCc1ccc(CC(=O)N/N=C/c2cc3c(cc2Cl)OCO3)cc1 409361249 BRBIYJKQNYUMLJ-KEBDBYFISA-N 344.798 3.324 50 40 EGGB COC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(=O)F 1772820751 UTRMRNQMIIOSSX-UHFFFAOYSA-N 328.077 3.263 50 40 EGGB N#C/C(=C/c1ccc(O)cc1)C(=O)NCCc1c[nH]c2ccccc12 13425342 DXQRKIQMSMDAKO-WJDWOHSUSA-N 331.375 3.139 50 40 EGGB C=CCOc1ccc(/C=C(\C#N)C(=O)NC(C)C)cc1Br 4506772 KTEZAEFTWSMQKW-MDWZMJQESA-N 349.228 3.445 50 40 EGGB Cc1cc(C)nc(SCC(=O)N/N=C/c2ccc(Cl)s2)n1 8336699 WQNRZYNLVZSFEJ-GIDUJCDVSA-N 340.861 3.051 50 40 EGGB Cc1nn(C)c(Cl)c1/C=N/NC(=O)c1ccc(C(F)(F)F)cc1 160018 DOWHSXJSXVYMPW-FBCYGCLPSA-N 344.724 3.165 50 40 EGGB CCN(CC)C(=O)CSC(Nc1ccc(F)cc1)=C(C#N)C#N 2314049 FPTJRXIYDREKLB-UHFFFAOYSA-N 332.404 3.098 50 40 EGGB COc1cc2c(cc1/C=C(\C#N)C(=O)NCc1ccco1)CCCC2 4512795 GLPBGGNAOXNYPM-LICLKQGHSA-N 336.391 3.390 50 40 EGGB Cc1cc(C)nc(NNC(=O)C2c3ccccc3-c3ccccc32)n1 14201576 YPGIMMBVXCOOFJ-UHFFFAOYSA-N 330.391 3.349 50 40 EGGB Cc1cc(C)n(CC(=O)N/N=C/c2ccc(-c3ccccc3)cc2)n1 6686951 XTHLWJWHEWBXQC-FYJGNVAPSA-N 332.407 3.317 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)COc2ccccc2Cl)cc1 48572884 FAWSDGYZQIJUSQ-UDWIEESQSA-N 344.798 3.434 50 40 EGGB O=C(N/N=C/c1ccc(OC(=O)c2ccccc2)cc1)c1cccnc1 64323 WHIOEHMATHMRLX-LPYMAVHISA-N 345.358 3.065 50 40 EGGB N#CC1=C(N)Nc2onc(-c3cccc(O)c3)c2[C@@H]1c1ccccc1 100311786 LTZLRFSTKCEKKG-OAHLLOKOSA-N 330.347 3.298 50 40 EGGB C=CCc1ccccc1OCCOc1ccc(/C=N/NC(C)=O)cc1 4499478 OTNDEMNJYGZFRL-RCCKNPSSSA-N 338.407 3.343 50 40 EGGB COc1cc(/C=N/NC(=O)[C@H](C)Sc2ccc(C)cc2)ccc1O 409111796 CFHWCANARLRRAX-MDBUFAAASA-N 344.436 3.340 50 40 EGGB Cc1cc(N2C[C@@H](C(=O)Cl)CC2=O)cc(C)c1Br 45889613 VVUAPWYYNKKJPZ-VIFPVBQESA-N 330.609 3.184 50 40 EGGB ClCCN(/C=C\c1nnnn1-c1ccc(Cl)cc1)CCCl 100018125 LUDRYDBKICJHDC-YVMONPNESA-N 346.649 3.066 50 40 EGGB Cc1ccccc1OCC(=O)N/N=C/c1ccc(N2CCCCC2)o1 219213 KIOPLQMJNAQYRN-DEDYPNTBSA-N 341.411 3.107 50 40 EGGB CC(C)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(C(N)=O)cc2)cc1 143477 OAOARHWWFHMOBZ-GZTJUZNOSA-N 333.391 3.455 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@H]1c1cccc(O)c1 4312113 QMZZODRESWLZCW-HNNXBMFYSA-N 330.347 3.000 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3cccs3)c2[C@@H]1c1cccc(O)c1 91262 NIAPVJIOPFTASB-CYBMUJFWSA-N 336.376 3.062 50 40 EGGB Cc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)cc1 6908819 UGSPHLPCTORPBB-MRXNPFEDSA-N 329.359 3.055 50 40 EGGB COc1ccc(CC(=O)N/N=C/c2ccc(C)c(C)c2C)cc1OC 59401548 FGHTZYPQFFYKNB-CIAFOILYSA-N 340.423 3.322 50 40 EGGB NNC(=O)/C=C/c1ccc(-c2ccc(Br)cc2Cl)o1 73638309 OGPRJFNGWFJCIK-ZZXKWVIFSA-N 341.592 3.366 50 40 EGGB CCc1sc(C(=O)NNC(=O)Cc2ccccc2Cl)cc1C 8294218 OASQZOYXBMLFFB-UHFFFAOYSA-N 336.844 3.276 50 40 EGGB CSc1ccc(/C=N/NC(=O)c2cccc(NC(C)=O)c2)cc1 582870 HHXMFNULBFPPIU-WOJGMQOQSA-N 327.409 3.131 50 40 EGGB Cc1cccc(-n2c(=O)c3ccccc3n3c(CCl)nnc23)c1C 15424621 CUBZZDYOHRDAEL-UHFFFAOYSA-N 338.798 3.389 50 40 EGGB COc1cc(OC)cc(C(=O)N/N=C(\C)c2cc(C)ccc2C)c1 8339134 CMNSXILMQDAAPO-XSFVSMFZSA-N 326.396 3.475 50 40 EGGB C=CCNC(=O)/C(C#N)=C/c1ccc(OCc2ccccc2)c(OC)c1 1795076 BIOGTIPBYYFHCK-LDADJPATSA-N 348.402 3.483 50 40 EGGB CCCCCN(C(=O)CCl)[C@H](C)c1nc2ccccc2c(=O)[nH]1 4025588 IVJGDDFALSUZPX-GFCCVEGCSA-N 335.835 3.242 50 40 EGGB COc1ccc(/C=C(\C#N)c2nc3ccccc3[nH]2)cc1OCC(=O)O 8017442 DDVCJJKFYLLLPX-MDWZMJQESA-N 349.346 3.099 50 40 EGGB Cc1cc2c(c(=O)[nH]1)[C@H](c1c(Cl)cccc1Cl)C(C#N)=C(N)O2 18143863 CODMXGQDBDCUAA-LBPRGKRZSA-N 348.189 3.208 50 40 EGGB O=C(N/N=C/c1ccc(-c2ccc(F)cc2F)o1)c1ccncc1 408602398 NHVNXZIEBSUUSV-UFFVCSGVSA-N 327.290 3.384 50 40 EGGB CC(=O)Nc1ccc(/C=C(\C#N)C(=O)c2ccc3c(c2)OCO3)cc1 44028835 KAXVGBVOMLEMMS-OVCLIPMQSA-N 334.331 3.164 50 40 EGGB COC(=O)c1cc([N+](=O)[O-])c(CBr)c(C(F)(F)F)c1 585672919 PMMKUBKVOYTPJV-UHFFFAOYSA-N 342.067 3.295 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)c2ccccc2C)cc1[N+](=O)[O-] 13586161 LVGZMQDPUIMGNR-CPNJWEJPSA-N 341.367 3.456 50 40 EGGB CC(=O)N/N=C\c1cc(C)n(-c2sc3c(c2C#N)CCCC3)c1C 15227128 KGCWZHSLXOEXSI-JMIUGGIZSA-N 340.452 3.376 50 40 EGGB Cc1c(Cl)cccc1NC(=O)CCC(=O)N/N=C/c1ccco1 2165942 CTISXDRMQSFRDX-VCHYOVAHSA-N 333.775 3.110 50 40 EGGB COc1ccc(S(=O)(=O)/C(C#N)=C/Nc2ccc(F)cc2)cc1 13624314 GSWNZCWXQLAXJK-LFIBNONCSA-N 332.356 3.085 50 40 EGGB Cc1c(C(=O)NN)c2ccccc2n1Cc1ccc(F)cc1Cl 216948267 PFMDHTJMVCMKMC-UHFFFAOYSA-N 331.778 3.394 50 40 EGGB CCOc1ccccc1/C=C(/C#N)C(=O)Nc1cccc(C(=O)O)c1 33410112 DIGUJGMHYHHYQF-GDNBJRDFSA-N 336.347 3.329 50 40 EGGB CC(C)(C)OC(=O)NCCC(=O)NNc1ccccc1C(F)(F)F 57881482 LVXJLKJBNWLPRQ-UHFFFAOYSA-N 347.337 3.063 50 40 EGGB CC(C)(C)c1ccc(OCCC(=O)NNC(=O)c2ccccc2)cc1 8038288 KFIBVMAHGASZIP-UHFFFAOYSA-N 340.423 3.214 50 40 EGGB Cc1ccc(N[C@@H]2SC(=O)N(CCBr)C2=O)c(C)c1 36626563 FEJPIDVYQBYICQ-LLVKDONJSA-N 343.246 3.132 50 40 EGGB Cc1c(C(=O)NNC(=O)c2ccc3ccccc3c2)cccc1[N+](=O)[O-] 5724491 NBJZYBNOVSPXQI-UHFFFAOYSA-N 349.346 3.131 50 40 EGGB Cc1cc2c(c(=O)[nH]1)[C@H](c1ccc(Cl)c(Cl)c1)C(C#N)=C(N)O2 16995085 ZJJAKXMMWYGBAU-CYBMUJFWSA-N 348.189 3.208 50 40 EGGB CC(C)(C)OC(=O)NNC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 17398246 CDILKIAMHODJIT-UHFFFAOYSA-N 329.400 3.216 50 40 EGGB Cc1ccc(S(=O)(=O)/C(C#N)=C\c2ccc3c(c2)OCCO3)cc1 33471319 WHJPCHPXDFNEKE-YBEGLDIGSA-N 341.388 3.105 50 40 EGGB COc1cc2cc(C(=O)N/N=C/c3ccc(F)cc3)[nH]c2cc1OC 540597 PCVIXTLGBSTDNZ-KEBDBYFISA-N 341.342 3.088 50 40 EGGB Cc1ccc(NC(=O)/C(C#N)=C/c2ccc(N3CCOCC3)cc2)cc1 563926 OOAFYMQXYWVYAB-NBVRZTHBSA-N 347.418 3.377 50 40 EGGB C/C(=N\NC(=O)NC1CCCC1)c1nc2ccccc2n1C(F)F 65672348 OLLABGFRBAXFNX-UFFVCSGVSA-N 335.358 3.397 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)n2nc(C)cc2C)cc(Cl)c1O 409376198 VSZRZIBIFLDGLN-LFYBBSHMSA-N 331.759 3.115 50 40 EGGB C[C@@H](Oc1ccc(Cl)cc1)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 353701 LSCFRXVUDRXROT-VDCVXVNISA-N 347.758 3.166 50 40 EGGB O=C(N/N=C/c1cc2c(cc1Cl)OCO2)c1ccc(Cl)cc1 487299 XBNNHQMHAKXDFJ-CNHKJKLMSA-N 337.162 3.486 50 40 EGGB CCN(Cc1ccccc1)C(=O)COC(=O)/C(C#N)=C\c1ccccc1 6173400 YECCRORFOWJLJC-UYRXBGFRSA-N 348.402 3.185 50 40 EGGB COC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c1ccc(Cl)cc1Cl 59407 KFRJRTRZOYKJJP-CYBMUJFWSA-N 339.178 3.248 50 40 EGGB CC1(C)C(=O)[C@]2(Br)CC[C@]1(CC#N)[C@@H]2Br 103708638 OJTCQBIJBRMLII-SWPVVBRQSA-N 335.039 3.186 50 40 EGGB COc1ccc2cc([C@H](C)C(=O)NNC(=O)c3ccco3)ccc2c1 12909871 GOVFNALLAUBPIP-LBPRGKRZSA-N 338.363 3.006 50 40 EGGB COc1cccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)c1OC 5130779 CYSBBLVCWACWGZ-IBPDUVOYSA-N 328.412 3.306 50 40 EGGB N#C[C@H](C(=O)N/N=C/c1ccc(N2CCCC2)cc1)c1ccccc1 7096386 PXTGIRHQLSNITB-OMNSNBSWSA-N 332.407 3.044 50 40 EGGB COc1cc(OC)cc(C(=O)N/N=C/c2cccc(OC(C)C)c2)c1 370797 FRVVSNVOYXWDPP-UDWIEESQSA-N 342.395 3.255 50 40 EGGB CC[C@@H](C)c1ccccc1OCC(=O)N/N=C/c1ccc(O)cc1O 586874 CPAJBILXWKPOEJ-AYPRBGQRSA-N 342.395 3.140 50 40 EGGB O=C(NNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1 4595370 VMQXDTFJIRHUNK-UHFFFAOYSA-N 325.246 3.371 50 40 EGGB COc1ccc(Cl)cc1N/C=C(\C#N)C(=O)NCc1ccco1 1911128 SOYJNMRUOSMSSE-PKNBQFBNSA-N 331.759 3.077 50 40 EGGB CC(C)C(=O)/C(C#N)=C\c1cc2ccccc2nc1N1CCOCC1 48325495 YSZSGUACPDFNPH-ATVHPVEESA-N 335.407 3.203 50 40 EGGB CCOC(=O)[C@]1(C#N)C(=O)[C@@H](c2ccccc2)[C@H]2CCCCC2=C1C#N 4910830 UOSFJDGSTWTMSR-MDKPJZGXSA-N 348.402 3.436 50 40 EGGB O=C(Cc1cn2ccsc2n1)NNc1cccc(C(F)(F)F)c1 68774770 YREGNVAXOOBCKE-UHFFFAOYSA-N 340.330 3.100 50 40 EGGB C/C(=N\NC(=O)CSc1ccccc1)c1ccc([N+](=O)[O-])cc1 408781995 FZFIZFGUGQESMZ-SFQUDFHCSA-N 329.381 3.227 50 40 EGGB CCOc1ccccc1NC(=O)CCC(=O)OC(CCl)CCl 2750906 JTIFHBCMOOTHSI-UHFFFAOYSA-N 348.226 3.193 50 40 EGGB Cc1ccc(-c2nn3c(nc2=O)-c2ccccc2N[C@@H]3CCl)cc1 101459284 ZNXHRTXFQCMGNC-HNNXBMFYSA-N 338.798 3.444 50 40 EGGB Cc1n[nH]c2c1[C@@H](c1ccc(OC3CCCC3)cc1)C(C#N)=C(N)O2 4631710 YLCYAPUAXRFAOM-KRWDZBQOSA-N 336.395 3.258 50 40 EGGB Cc1cccc(OCCCOc2ccccc2/C=N/NC(N)=O)c1C 4673479 DEAFGISIKBPWSO-FYJGNVAPSA-N 341.411 3.154 50 40 EGGB O=C(CCC1CCCC1)NNC(=O)c1ccccc1-n1cccc1 5701646 HONREMKQGNMYOL-UHFFFAOYSA-N 325.412 3.209 50 40 EGGB CC1=C(C#N)C(=O)N(C2CCCC2)C(=O)/C1=C\c1ccc(N(C)C)cc1 16806580 RTFLNXCYRFKPAP-PDGQHHTCSA-N 349.434 3.287 50 40 EGGB COC(=O)c1ccc(N/C=C(\C#N)C(=O)Nc2ccc(F)cc2)cc1 95346246 GIFNEIQGKGZYSE-ACCUITESSA-N 339.326 3.070 50 40 EGGB CN(C)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(Cl)cn2)cc1 288244 WTSGDFBOZXINBJ-UKTHLTGXSA-N 326.787 3.347 50 40 EGGB CCN(CC)c1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(O)cc1 5322063 PZOFBUVPLCOOTK-IBGZPJMESA-N 335.407 3.457 50 40 EGGB Cc1ccc([C@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)o1 5547669 TXZHQCNTRZIUOW-QGZVFWFLSA-N 332.363 3.300 50 40 EGGB COc1cccc2cc(C(=O)N/N=C/c3ccc([N+](=O)[O-])cc3)oc12 8169028 GIVDHLZHCNSKCD-VCHYOVAHSA-N 339.307 3.114 50 40 EGGB CCc1c(OC)ccc(/C=N/NC(=O)c2ccc(OC)cc2)c1OC 5470391 DFRJVJDRXUOQJZ-UDWIEESQSA-N 342.395 3.039 50 40 EGGB COc1cc([C@H]2C(C#N)=C(SC)NC3=C2C(=O)CCC3)ccc1O 20065972 GNFSYWLSJRQLFR-INIZCTEOSA-N 342.420 3.193 50 40 EGGB CC1(C)[C@@H]2CC=C(/C=N/NC(=O)Cc3cn4ccsc4n3)[C@@H]1C2 103202859 FDVMBSPLULNHSQ-YPUXSBLJSA-N 328.441 3.033 50 40 EGGB C/C(=N\NC(=O)c1cccc(Br)c1)c1ccc(O)cc1O 13899419 CLHSUFOABNGYHU-RQZCQDPDSA-N 349.184 3.014 50 40 EGGB Cc1ccc(OCC(=O)N/N=C\c2cn(C)c3ccccc23)cc1C 9614432 LVLLXMWJSUZMOE-NHDPSOOVSA-N 335.407 3.324 50 40 EGGB C[C@@H](SCc1ccccc1)C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 50174 DAHOJDPPEVWZNB-VBEHJTROSA-N 343.408 3.367 50 40 EGGB Cc1ccc(NC(=O)C(=O)N/N=C/c2ccccc2Cl)cc1C 3072729 ASPAZRFHGFSTMW-VXLYETTFSA-N 329.787 3.046 50 40 EGGB COc1ccc(CCCC(=O)N/N=C/c2ccc(O)cc2)cc1C 226071 PFWCPBPYYMWNLV-DEDYPNTBSA-N 326.396 3.182 50 40 EGGB COc1cccc([C@H]2C(C#N)=C(N)Oc3oc4ccccc4c(=O)c32)c1 125712 VDPSMWGIWNQYJT-INIZCTEOSA-N 346.342 3.020 50 40 EGGB COc1ccc(/C=N/NC(=O)CC23CC4CC(CC(C4)C2)C3)cc1O 6049113 SZJOANMHICETBL-CIAFOILYSA-N 342.439 3.457 50 40 EGGB Cc1ccc(CC(=O)N/N=C/c2ccc(OC(C)C)cc2O)c(C)c1 20194841 PAWNSPSDWRPWQU-CIAFOILYSA-N 340.423 3.489 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2C)cc1 408863263 MKAPPIAPIRHDAO-XDHOZWIPSA-N 339.351 3.232 50 40 EGGB Cc1cc(/C=N\NC(=O)Cc2cccc(C(F)(F)F)c2)c(C)n1C 408778002 NVNOXURDGMYFBO-FBHDLOMBSA-N 337.345 3.354 50 40 EGGB O=C(CNc1cccc(Br)c1)N/N=C/c1ccccc1 60543 SOVAJDOSQNIGPU-VCHYOVAHSA-N 332.201 3.011 50 40 EGGB O=C(COc1cccc([N+](=O)[O-])c1)N/N=C/c1cccc2ccccc12 59042 DQBQVWPIUGGTDW-UDWIEESQSA-N 349.346 3.277 50 40 EGGB O=C(N/N=C1/C(=O)N(Cc2ccccc2)c2ccccc21)C1CCCC1 102172598 BJXLAGYZQRXZIY-ZBJSNUHESA-N 347.418 3.244 50 40 EGGB COc1ccc(Br)cc1/C=N/NC(=O)c1ccc(C)o1 2740662 PILIIPMMJUGGNK-LZYBPNLTSA-N 337.173 3.123 50 40 EGGB N#C[C@@H](C(=O)N/N=C/c1cccc(Br)c1)c1ccccc1 409198444 ARQMAQNJEHARTM-SKCQWOFPSA-N 342.196 3.207 50 40 EGGB CCOc1ccc(/C=N\NC(=O)c2ccc(F)cc2)cc1OCC 30774258 MFDLTLREMIDDRW-NDENLUEZSA-N 330.359 3.387 50 40 EGGB COc1cc(C)c(/C=C(/C#N)C(=O)NCc2ccccc2)cc1OC 123795321 FFIMLBLDQROAEE-YVLHZVERSA-N 336.391 3.236 50 40 EGGB Cc1ccc(-c2cc(C(=O)N/N=C/c3ccc(F)s3)n[nH]2)cc1 252489868 KDDXFVHHMZLWEL-GIJQJNRQSA-N 328.372 3.350 50 40 EGGB Cc1ccc(N[C@H](C)C(=O)N/N=C/c2cccc([N+](=O)[O-])c2)c(C)c1 370266 DLTQPKQERBBAGV-HIPSJFSSSA-N 340.383 3.162 50 40 EGGB O=C1OCC[C@@H]1[PH](c1ccccc1)(c1ccccc1)c1ccccc1 104086729 QIWRPCXVCHGUNJ-NRFANRHFSA-N 348.382 3.028 50 40 EGGB CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccccc2C(=O)O)cc1 13345048 GBDZPIJRAOQSAX-SDNWHVSQSA-N 336.347 3.329 50 40 EGGB C#CCn1c(C)c(/C=N/NC(=O)c2ccc(OC)cc2)c2ccccc21 409264467 KJXSKDIVKGIWEN-HYARGMPZSA-N 345.402 3.355 50 40 EGGB Cc1ccc(COC(=O)NNC(=S)NCc2ccccc2)cc1C 5942602 PJCPCBXLSZUBEK-UHFFFAOYSA-N 343.452 3.109 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(F)cc2)c(OC)c1 16215407 SFAOOJUABFAIAH-LCYFTJDESA-N 326.327 3.389 50 40 EGGB O=C(N/N=C/c1cccs1)C(=O)Nc1cc(Cl)cc(Cl)c1 59101879 WMMZIAQXIRCGCV-FRKPEAEDSA-N 342.207 3.144 50 40 EGGB Cn1cc(/C=C(\C#N)C(=O)NC2CC2)c(-c2cc3ccccc3o2)n1 63276253 VNLSGWYGEIZQPD-MDWZMJQESA-N 332.363 3.019 50 40 EGGB CC(=O)N(/N=C1\Sc2ccccc2C1=O)c1ccccc1[N+](=O)[O-] 4825701 DAHLTWROPNUAFI-MSUUIHNZSA-N 341.348 3.250 50 40 EGGB O=C(O)c1ccccc1C(=O)c1ccc2c3c(cccc13)C(=O)OC2=O 8438833 DGBAMUAAHLUWJE-UHFFFAOYSA-N 346.294 3.080 50 40 EGGB N#CC1=C(N)C(C#N)(C#N)[C@H](c2ccccc2[N+](=O)[O-])[C@@H]2CCCC=C12 492517 NGPHAOADWCMDAH-DYVFJYSZSA-N 345.362 3.188 50 40 EGGB CC[C@@H](Nc1ccccc1)C(=O)N/N=C/c1ccc(OC)c(OC)c1 252373 DISRLMCMQNBOBY-RBYWHNRPSA-N 341.411 3.045 50 40 EGGB O=C(CCSc1ccccc1)N/N=C/c1ccc([N+](=O)[O-])cc1 233790 MKFGYCYFIBCJDB-SFQUDFHCSA-N 329.381 3.227 50 40 EGGB CCOC(=O)NNC(=O)[C@H](Sc1ccccc1)c1ccccc1 12996254 VUCWDRGHJMIRPY-OAHLLOKOSA-N 330.409 3.297 50 40 EGGB CCOc1cc(/C=N\NC(=O)c2ccc(F)cc2)cc(Cl)c1O 30822064 FGADQTGSHQEDTI-OCKHKDLRSA-N 336.750 3.347 50 40 EGGB Cc1cccc(NCC(=O)N/N=C/c2cccc(Br)c2)c1 58908 FFRBDQWUCNLGLB-VXLYETTFSA-N 346.228 3.320 50 40 EGGB N#C/C(=C\c1ccc(F)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1F 337271 VGCAELDMOATONB-YRNVUSSQSA-N 329.262 3.419 50 40 EGGB CN1CCN(c2ccccc2NC(=O)[C@H](Cl)c2ccccc2)CC1 1401293 IPCPEIMNVATWDY-GOSISDBHSA-N 343.858 3.357 50 40 EGGB COc1cc(C(=O)N/N=C(\C)c2ccc(C)cc2)cc(OC)c1OC 4965129 MQUIKJMFPGOVTJ-DEDYPNTBSA-N 342.395 3.175 50 40 EGGB COc1ccc(C(=O)N/N=C/c2ccc(OC(C)C)cc2)cc1OC 43913958 ORFSESQQDLKAPH-UDWIEESQSA-N 342.395 3.255 50 40 EGGB CC(C)(C)OC(=O)C[C@@H](CBr)NC(=O)OC(C)(C)C 96024967 YVZBCOHGRDGBDM-VIFPVBQESA-N 338.242 3.006 50 40 EGGB COc1cccc(/C=N/NC(=O)COc2cc(C)c(Cl)c(C)c2)c1 504858 VKUJPESKPKIURS-KEBDBYFISA-N 346.814 3.495 50 40 EGGB Cn1cc(CCC(=O)NN(Cc2ccccc2)c2ccccc2)cn1 54814499 LXMZZJVPMKKIRG-UHFFFAOYSA-N 334.423 3.091 50 40 EGGB CN(C)c1ccc(/C=C/C=N\NC(=O)Cc2ccc(F)cc2)cc1 409238765 LWWYPMSIBDOAQR-PVXXHHJBSA-N 325.387 3.250 50 40 EGGB Cn1cccc1/C=N\NC(=O)COc1ccccc1-c1ccccc1 30734312 XMXQMFFLWZNFDH-STZFKDTASA-N 333.391 3.221 50 40 EGGB O=C(Cl)[C@@H]1CC(=O)N(c2ccc(Br)cc2Cl)C1 45953102 FHBHVBVCWGDRPU-ZCFIWIBFSA-N 337.000 3.221 50 40 EGGB CC[C@@H](C)n1cc([C@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cn1 253407276 VULZJESLZSJDKS-BZNIZROVSA-N 340.427 3.305 50 40 EGGB O=C(N/N=C\c1c(O)ccc2ccccc12)c1ccc2c(c1)OCCO2 16525817 YBEZVRAAYZWBKS-MTJSOVHGSA-N 348.358 3.081 50 40 EGGB CCCCOc1ccccc1C1C(C#N)=C(N)SC(N)=C1C#N 19868132 IFRFTMIAPYSWCT-UHFFFAOYSA-N 326.425 3.084 50 40 EGGB C/C(OC/C(=N\NC(N)=O)c1ccccc1)=C(/C#N)c1ccccc1 5369177 DSFONTMHPQRKNF-JOQKXGKBSA-N 334.379 3.030 50 40 EGGB O=C(N/N=C/c1ccc([N+](=O)[O-])o1)c1cc(Cl)ccc1Cl 40503 DOZWCBFJFLYVHB-GIDUJCDVSA-N 328.111 3.259 50 40 EGGB CCOC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1cccs1 5010250 NXCORYAOLLSZLY-BENRWUELSA-N 326.377 3.470 50 40 EGGB C/C(=N\NC(=O)Cc1ccc(C(C)(C)C)cc1)c1ccc(O)cc1O 408568741 WOIBHENYFWBBPR-FYJGNVAPSA-N 340.423 3.478 50 40 EGGB Clc1nc(N2CCOCC2)c2sc(CBr)cc2n1 85223588 DDGJOTNSVPHXNT-UHFFFAOYSA-N 348.653 3.076 50 40 EGGB Cc1cc(C)c(OCC(=O)N/N=C/c2cccc([N+](=O)[O-])c2)c(C)c1 356795 LQBSQBTVMSKEDB-VXLYETTFSA-N 341.367 3.049 50 40 EGGB CCOc1cc(/C=C/C(=O)NN)ccc1OCc1ccc(Cl)cc1 226365244 RWLAYWCJENGXKH-UXBLZVDNSA-N 346.814 3.321 50 40 EGGB COc1cc(/C=N/NC(=O)c2cc(C)nc3ccccc23)ccc1O 254230 QJHHCUSXBQCZNU-RGVLZGJSSA-N 335.363 3.021 50 40 EGGB COC(=O)c1ccc(/C=N/NC(=O)CSc2ccc(C)cc2)cc1 8515745 FYTBFQAAABHUND-YBFXNURJSA-N 342.420 3.024 50 40 EGGB COc1cc(/C=C(\C#N)c2nc3ccccc3[nH]2)cc2c1OCCO2 7000988 RNKFOLXMJZABGN-MDWZMJQESA-N 333.347 3.407 50 40 EGGB Cc1ccc(C(=O)NNC(=O)c2c(-c3ccccc3)noc2C)c(C)c1 8143076 DIDJYTVOFZSESW-UHFFFAOYSA-N 349.390 3.342 50 40 EGGB COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)CCl 8428151 RQWIUDDMUHTLEC-UHFFFAOYSA-N 348.786 3.133 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2cc(O)ccc2[N+](=O)[O-])c(Cl)c1 36239625 CEMPPLVZFQEKDK-CAOOACKPSA-N 333.731 3.026 50 40 EGGB C[Si](CCCOC[C@@]1(O[Si](C)(C)C)CO1)O[Si](C)(C)C 198364359 MWYAICWFDRATCU-CYBMUJFWSA-N 335.645 3.444 50 40 EGGB Cc1c([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cnn1C(C)C 253407982 WZGLHBTZJFMXKE-INIZCTEOSA-N 340.427 3.223 50 40 EGGB COc1ccc(O)c(/C=N/NC(=O)Cc2cccc3ccccc23)c1 6170187 PSTKCOUSBDXNFX-FYJGNVAPSA-N 334.375 3.247 50 40 EGGB COc1ccc(/C=N\NC(=O)COc2ccc(C)cc2C)cc1Cl 30843143 BPBNRBGDWLINNE-JMIUGGIZSA-N 346.814 3.495 50 40 EGGB COS(=O)(=O)O[C@@]1(SC)C=C(c2ccccc2)SS1 1596925 RTCCROIEELDMET-LLVKDONJSA-N 336.481 3.347 50 40 EGGB Cc1cc(/C=N/NC(=O)c2ccc3c(c2)OCO3)c(C)n1CC(C)C 3527076 OATZRXZAKWAPJK-AWQFTUOYSA-N 341.411 3.254 50 40 EGGB COc1ccc(Cl)cc1/C=N/NC(=O)c1ccc(C#N)cc1F 408968762 YSOPEKIAADBZPK-AWQFTUOYSA-N 331.734 3.123 50 40 EGGB CCCC[C@@H](C(=O)NN)N1c2c(OC)cccc2C(C)=CC1(C)C 223228907 ITHKWCQMBKWGJE-HNNXBMFYSA-N 331.460 3.246 50 40 EGGB C[C@H](Oc1ccccc1)C(=O)NN=Cc1c(O)ccc2ccccc12 245238415 NNFYLENZBBRQJS-AWEZNQCLSA-N 334.375 3.463 50 40 EGGB Fc1c(I)ccc(CBr)c1F 98210422 AQUJXZZRKFABFU-UHFFFAOYSA-N 332.913 3.464 50 40 EGGB COC(=O)/C(C#N)=C/c1nc(-c2ccc(C)cc2)nn1-c1ccccc1 27562188 MGCBYIXMYVQIQF-FOWTUZBSSA-N 344.374 3.323 50 40 EGGB CC(C)N(C(=O)CCl)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 100178137 LUIXCSYCYVMOGU-BETUJISGSA-N 332.872 3.298 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)ccc1O 3239558 MZSOJRLAAQYJGW-LDXHQZPJSA-N 328.412 3.393 50 40 EGGB CN(NC(=O)c1ccc2ccccc2c1)C(=S)NCc1ccccc1 6602402 MFGYFSGSKKEYAH-UHFFFAOYSA-N 349.459 3.491 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@@]32C)c(OC)c1 408955181 OEOVXXUXGYQGDB-BFBBCPQRSA-N 330.428 3.370 50 40 EGGB C[C@H](Sc1cc(C#N)ccn1)C(=O)C(C#N)=C1Nc2ccccc2N1 102157115 HEJVZWCNTAEVGN-NSHDSACASA-N 347.403 3.276 50 40 EGGB C[C@@H](Sc1cc(C#N)ccn1)C(=O)C(C#N)=C1Nc2ccccc2N1 102157118 HEJVZWCNTAEVGN-LLVKDONJSA-N 347.403 3.276 50 40 EGGB O=C(CCSc1ccccc1)N/N=C/c1ccccc1[N+](=O)[O-] 59473564 WZULPQWIXKQNMU-SFQUDFHCSA-N 329.381 3.227 50 40 EGGB COc1cc(/C=N/NC(=O)COc2c(C)cccc2C)ccc1C 408916599 YJKNDRCKQPOZKF-RGVLZGJSSA-N 326.396 3.150 50 40 EGGB CC(C)N(C(=O)OC(C)(C)C)[C@H]1CCCC[C@H]1NC(=O)CCl 79408904 JLKNZCQOVZICNM-OLZOCXBDSA-N 332.872 3.298 50 40 EGGB CC[C@](C)(OC)C(=O)Nc1ccc(OCCBr)cc1 225601631 UHEMOJPVWVNZFN-AWEZNQCLSA-N 330.222 3.214 50 40 EGGB CCOc1ccccc1NC(=O)/C(C#N)=C/c1ccc2c(c1)OCO2 3424356 RMVPCWUOBDLRLA-NTEUORMPSA-N 336.347 3.360 50 40 EGGB COC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@H]2c1ccccc1C 1426965 WGFGHLLWRDDUSR-CQSZACIVSA-N 340.404 3.370 50 40 EGGB COc1c(/C=N/NC(=O)c2ccccc2O)sc2ccccc12 503761 SIHJTBQVGFAQIS-VCHYOVAHSA-N 326.377 3.379 50 40 EGGB CC1(C)CC(=O)C2=C(C1)O[C@@H](c1ccccc1[N+](=O)[O-])C(C#N)=C2N 4565647 PXDSGRQJMWMHOZ-KRWDZBQOSA-N 339.351 3.046 50 40 EGGB O=C(COc1cccc2cccnc12)N/N=C/c1ccccc1Cl 408752326 HUDFCCXDVZXUMY-SRZZPIQSSA-N 339.782 3.417 50 40 EGGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)c2ccccc2Cl)c1 13425508 STCVLLJXMOGJAF-RGVLZGJSSA-N 329.787 3.452 50 40 EGGB COc1cc(OC)cc(C(=O)N/N=C(\C)c2ccc(C)cc2C)c1 8339121 GOYITHXHKQTVCK-XSFVSMFZSA-N 326.396 3.475 50 40 EGGB COc1cccc2c(/C=C(\C#N)C(=O)NCCc3ccccc3)c[nH]c12 40267129 PTILERFUZBAQRF-FOWTUZBSSA-N 345.402 3.442 50 40 EGGB CCOC(=O)C1=C(C)NC(SCC#N)=C(C#N)[C@H]1c1cccs1 20609356 WVZMUKDLYWGMJC-AWEZNQCLSA-N 345.449 3.264 50 40 EGGB C[C@H]1[C@H](C)N(C(=O)CCCl)c2ccccc2N1C(=O)CCCl 1713562 JVSATVSUNHATHC-RYUDHWBXSA-N 343.254 3.401 50 40 EGGB O=C(CCC(=O)N/N=C/C1CCCCC1)N/N=C/C1CCCCC1 6158094 QLVFIWNITWWWHM-IWGRKNQJSA-N 334.464 3.131 50 40 EGGB Cc1occc1C(=O)NNC(=O)C1(c2cccc(Cl)c2)CCC1 24926486 XAHBCEPPVSYYFS-UHFFFAOYSA-N 332.787 3.124 50 40 EGGB CCN(CC)c1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1ccccc1 409001671 QEDOMNMFZNYSKT-CPNJWEJPSA-N 340.383 3.205 50 40 EGGB CCOc1ccc(/C=N/NC(=O)COc2ccc(C)cc2C)cc1 3030379 WSGVHAVBKUFAEZ-UDWIEESQSA-N 326.396 3.231 50 40 EGGB O=C(CCN1CCCCC1)N/N=C/c1ccc(Cl)cc1Cl 3206685 BEXCNOXVDRBKOY-WOJGMQOQSA-N 328.243 3.320 50 40 EGGB Cc1cc(/C=N/NC(=O)Cc2cccs2)c(C)n1C[C@H]1CCCO1 8334351 GEDVRCWXWBJQEG-YDDPGSGASA-N 345.468 3.038 50 40 EGGB COc1ccc(Cl)cc1/C=N/NC(=O)CNc1ccc(C)cc1 224565 BMSBVOYHWBHIHK-KEBDBYFISA-N 331.803 3.219 50 40 EGGB CCOC(=O)[C@]1(C#N)C(=O)C(C#N)=C2CCCC[C@H]2[C@H]1c1ccccc1 4557873 JPWFTLNBFYFNII-BLIXFSHQSA-N 348.402 3.436 50 40 EGGB O=C(NNc1cccc(Cl)c1)[C@H]1CCCN1Cc1ccccc1 57154255 WJLMQVMLECJBMW-QGZVFWFLSA-N 329.831 3.448 50 40 EGGB C=CCN1C(=O)/C(=N\NC(=O)c2ccccc2Cl)c2ccccc21 100389767 MUWJQUCXRPKGSN-SILNSSARSA-N 339.782 3.007 50 40 EGGB COc1ccc2cc([C@@H](C)C(=O)NNC(=O)c3ccco3)ccc2c1 12909867 GOVFNALLAUBPIP-GFCCVEGCSA-N 338.363 3.006 50 40 EGGB COC(=O)N/N=C/c1ccccc1OCCOc1c(C)cccc1C 4525962 CUDFPZCSLBXCHZ-DEDYPNTBSA-N 342.395 3.451 50 40 EGGB C/C(=N\NC(=O)CSc1ccccc1)c1cccc([N+](=O)[O-])c1 408782701 ISIHWCYGDAUWLI-SFQUDFHCSA-N 329.381 3.227 50 40 EGGB C=CCSC1=C(C#N)[C@H](c2ccc(C)cc2)[C@H](C(=O)OC)C(O)=N1 8973459 LPPNOYWIDPVYKN-GJZGRUSLSA-N 342.420 3.492 50 40 EGGB COc1ccc(Br)cc1/C=N/NC(=O)Cc1ccccc1 3155058 KURFZJVAGXTTQP-WOJGMQOQSA-N 347.212 3.151 50 40 EGGB CC1=C(C)[C@@H](OCCCl)N(c2cc(O)c(Cl)cc2F)C1=O 2299467 LAWHMBRQYRNJHZ-CQSZACIVSA-N 334.174 3.449 50 40 EGGB C/C(=N/NC(=O)Cn1ccc2ccccc21)c1cccc([N+](=O)[O-])c1 4676441 LVXFTNMLZQKLDW-UYRXBGFRSA-N 336.351 3.090 50 40 EGGB CC1(CC(=O)N/N=C/c2ccc(-c3cccc(Cl)c3)o2)OCCO1 5614253 LALHBKSRCQVUNR-YBFXNURJSA-N 348.786 3.203 50 40 EGGB Cc1ccc(CC(=O)N/N=C/c2ccc(Br)o2)cc1C 33860219 MHADHPMQWQGWDW-RQZCQDPDSA-N 335.201 3.352 50 40 EGGB O=C(N/N=C/c1ccc(O)c(Br)c1)c1ccc(F)cc1 3572300 ZFHBZLRCLAHZHO-CAOOACKPSA-N 337.148 3.058 50 40 EGGB CCOC(=O)/C(C#N)=C/Nc1nc2c(s1)CCc1ccccc1-2 7067338 IEMITPCFUIWTCQ-ZRDIBKRKSA-N 325.393 3.291 50 40 EGGB COc1cccc([C@H]2NC(=S)NC(C(C)(C)C)=C2C#N)c1OC 409370842 BSFQGYPZRPJQQS-CYBMUJFWSA-N 331.441 3.046 50 40 EGGB Cc1ccc(C)n1NC(=O)/C(C#N)=C/c1cc2c(cc1Cl)OCO2 409380380 MCCOIAFNRPCICA-WLRTZDKTSA-N 343.770 3.164 50 40 EGGB Cc1ccc(OCCn2cc(/C=C(\C#N)C(N)=O)c3ccccc32)cc1 13424367 BQRXIRZNQZFHRT-FOWTUZBSSA-N 345.402 3.421 50 40 EGGB O=C(NNC(=O)c1ccc2ccccc2c1O)Nc1ccc(F)cc1 15933960 SCXIDWQTCIWKOE-UHFFFAOYSA-N 339.326 3.151 50 40 EGGB Cc1ccsc1/C=N/NC(=O)CSCc1ccc([N+](=O)[O-])cc1 58915707 NSLLWVRPUCWLPO-LZYBPNLTSA-N 349.437 3.348 50 40 EGGB CCOC(=O)/C(C#N)=C/NCc1ccc(-c2ccc3c(c2)CCO3)cc1 60789862 UKGLQNQMHBNJBO-XMHGGMMESA-N 348.402 3.349 50 40 EGGB CCOC(=O)/C(C#N)=C(/O)c1ccc(NC(=O)c2cccs2)cc1 102042042 WCFZFTVLRWEIKU-FYWRMAATSA-N 342.376 3.356 50 40 EGGB CC[C@@H](C)c1ccc(OCC(=O)N/N=C/c2ccccc2O)cc1 1319323 WUEVMJMZLPTARA-MQMKENTISA-N 326.396 3.435 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)c2c(C)nc3sccn23)cc1 59459680 FLYHBDPFQVKXEK-WOJGMQOQSA-N 340.408 3.033 50 40 EGGB CC(C)N(C[C@@H]1CCCN(C(=O)CCl)C1)C(=O)OC(C)(C)C 79408870 XSJFKVZKJCKELP-CYBMUJFWSA-N 332.872 3.109 50 40 EGGB O=C(N[C@@H](Cc1ccccc1)[C@H](O)CCl)OCc1ccccc1 44563644 YNJAOKKAXVGEIH-DLBZAZTESA-N 333.815 3.124 50 40 EGGB Cc1ccccc1OCC(=O)N/N=C/c1cc([N+](=O)[O-])ccc1Cl 584673 GKZHBUZFCHOWLF-GIJQJNRQSA-N 347.758 3.086 50 40 EGGB CCOc1ccc(C(=O)N/N=C/c2ccc(OC)c(OCC)c2)cc1 8082317 DAEOSKPZSCDHSW-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB Cc1ccc(Cn2cc(/C=N\NC(=O)CC#N)c3ccccc32)cc1 13286046 GGEJVJZSWIUQNC-UUYOSTAYSA-N 330.391 3.362 50 40 EGGB CCN1c2cc(C)c(/C=N/NC(=O)CC#N)cc2[C@H](C)CC1(C)C 208320099 YIDYEJXWTOPZTA-STCDJXRXSA-N 326.444 3.471 50 40 EGGB O=C(N/N=C/c1ccco1)C(=O)Nc1ccc(Oc2ccccc2)cc1 5604126 QAEVCGRDVRTSKC-DEDYPNTBSA-N 349.346 3.161 50 40 EGGB COc1ccc(/C=N/NC(=O)CNc2ccc(C)cc2)cc1Cl 223211 AIXPKOOWQXNUJH-KEBDBYFISA-N 331.803 3.219 50 40 EGGB COc1ccccc1[C@H]1C(C#N)=C(N)Oc2c1c(=O)oc1ccccc21 517966 ISBLNJXMYQHIRW-INIZCTEOSA-N 346.342 3.020 50 40 EGGB biogenic N#CC1=C(S)N(c2ccc(F)cc2)[C@@H](c2cccs2)NC1=O 352253 UFUGIGWDNIDTBB-ZDUSSCGKSA-N 331.397 3.187 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)[C@H](OC)c2ccccc2)cc1 4199147 ZJRZYHNQDKAAMI-SQVRNEIYSA-N 326.396 3.313 50 40 EGGB COP(=O)(OC)C(C)(C)C/C(C)=N/NC(=O)c1ccccc1 71405166 URWYHRMDTMIXIH-FOWTUZBSSA-N 326.333 3.447 50 40 EGGB CCCOc1ccc(C(=O)N/N=C\c2ccccc2O)cc1OCC 6324646 FLDWPBICASOBTN-MOSHPQCFSA-N 342.395 3.344 50 40 EGGB N#CC1=C(N)OC(c2ccccc2)=C(C#N)[C@H]1c1ccc([N+](=O)[O-])cc1 367188 WBDPEIZLRLOXCT-QGZVFWFLSA-N 344.330 3.337 50 40 EGGB CC/C(=N/NC(=O)c1ccncc1)c1ccc(Br)cc1 4897319 CQJGCSWNJXIVET-JXAWBTAJSA-N 332.201 3.388 50 40 EGGB CCOC(=O)c1ccc(N/C=C2/C(=O)OC(=O)c3ccccc32)cc1 102931397 GEKQNGTUJXFEPH-LFIBNONCSA-N 337.331 3.013 50 40 EGGB Cc1ccc(SCCOc2cccc(/C=N/NC(N)=O)c2)cc1 4616971 KWUXCBRUHROURS-XDHOZWIPSA-N 329.425 3.168 50 40 EGGB COc1cccc(C=C(C#N)C#N)c1OCc1ccc(C(=O)O)cc1 409186652 GASVLDJCCDOFIJ-UHFFFAOYSA-N 334.331 3.403 50 40 EGGB COc1ccc([N+](=O)[O-])cc1C(=O)N/N=C(\C)c1ccc(Cl)cc1 409266857 LKMCOFGWUODYRW-VCHYOVAHSA-N 347.758 3.411 50 40 EGGB Cc1ccc(N[C@H]2SC(=O)N(CCBr)C2=O)c(C)c1 36626562 FEJPIDVYQBYICQ-NSHDSACASA-N 343.246 3.132 50 40 EGGB CN(C)c1ccc(/C=N/NC(=O)CCSc2ccccc2)cc1 408728121 VXCVMRFBWOZALB-XMHGGMMESA-N 327.453 3.385 50 40 EGGB Br[C@@H]1CCC[C@@H]2N=C(N/N=C/c3ccccc3)S[C@@H]21 229901996 XGUGXCYNVHMVAJ-VYXLAMQESA-N 338.274 3.398 50 40 EGGB Cc1ccsc1[C@H]1C(C#N)=C(N)Oc2c1c(=O)[nH]c1ccccc21 17070610 UVSHJMQLNIEFTD-ZDUSSCGKSA-N 335.388 3.116 50 40 EGGB O=C(COc1ccc(Cl)cc1)N/N=C/c1cc(Cl)ccc1O 50458 VKWBCKBWFYDAGK-QGMBQPNBSA-N 339.178 3.228 50 40 EGGB COC(=O)c1cc(F)ccc1C(Br)Br 100494595 PBSWHAFPOGGXEV-UHFFFAOYSA-N 325.959 3.401 50 40 EGGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@H]1[C@]12C=C[C@@H](CC1)C2 100671772 LDIVSFFWSCEOTP-XITNVPRNSA-N 332.359 3.319 50 40 EGGB C/C(CC(=O)Nc1cccc(Cl)c1)=N\NC(=O)c1cccc(O)c1 100090137 BTDPQUGFMYXYRX-RGVLZGJSSA-N 345.786 3.180 50 40 EGGB N#C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 33530229 PCNSAKBBVNHVNR-WQLSENKSSA-N 338.279 3.049 50 40 EGGB CC(C)(C)OC(=O)N1CC[C@H](O)[C@H]1CO[Si](C)(C)C(C)(C)C 196773192 FDXATUMQSJXBAG-OLZOCXBDSA-N 331.529 3.379 50 40 EGGB CCOc1ccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)cc1 8081962 UOHRBPDIAOQLBY-VCHYOVAHSA-N 347.758 3.411 50 40 EGGB O=C(CCc1ccccc1)NNC(=O)c1cc(Cl)ccc1Cl 577841 QTCNMVBVUCQMBM-UHFFFAOYSA-N 337.206 3.387 50 40 EGGB CC(C)Oc1ccccc1/C=N/NC(=O)[C@H](C)Oc1ccccc1 23410729 WFFUXHJZXROAIH-NPRIEWAGSA-N 326.396 3.391 50 40 EGGB CC[C@@H](Nc1ccc(OC)cc1)C(=O)N/N=C/c1ccccc1F 369866 OCJNPJKIZJLNML-XNHPLOEXSA-N 329.375 3.175 50 40 EGGB N#C/C(=C\c1ccc(O)c(Br)c1)C(=O)N1CCCCC1 1408573 RUGLWSUELHHMAY-XYOKQWHBSA-N 335.201 3.074 50 40 EGGB Cc1ccccc1CSCC(=O)N/N=C/c1ccc(C(=O)O)cc1 408785083 XMBXRIFXLDCZPW-VXLYETTFSA-N 342.420 3.077 50 40 EGGB COc1ccc(CCCC(=O)N/N=C\c2ccc(N(C)C)cc2)cc1 33294359 JXCBLTGXAVSAOQ-QNGOZBTKSA-N 339.439 3.234 50 40 EGGB COc1ccc(/C=N/NC(=O)c2ccc(C)cc2OC)cc1Cl 408889335 CQSXZGYDSJSFSW-VXLYETTFSA-N 332.787 3.430 50 40 EGGB O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1ccccc1-n1cccc1 5899386 PRQJDOKLDIKRTN-CPNJWEJPSA-N 334.335 3.149 50 40 EGGB Cc1ccc(C(O)(C(=O)NNc2ccccn2)c2ccc(C)cc2)cc1 211459 JYLXQQVVSIIMIO-UHFFFAOYSA-N 347.418 3.078 50 40 EGGB CC1(C)C(C#N)=C(SCc2cccc3cccnc23)NC(=O)[C@@H]1C#N 8935378 ZUKXCFVKVYEIPB-AWEZNQCLSA-N 348.431 3.499 50 40 EGGB C=CCc1cc(/C=C(/C#N)C(=O)NCc2ccc(OC)cc2)ccc1O 408817906 YROFWKJKLXLTGC-PDGQHHTCSA-N 348.402 3.353 50 40 EGGB O=C1c2ccccc2C(=O)c2c(NCCBr)cccc21 3844861 ZVDDRMGRVWVGQR-UHFFFAOYSA-N 330.181 3.269 50 40 EGGB biogenic O=C(N/N=C\c1ccccc1F)c1ccc2c(c1)OCC1(CC1)CO2 225368876 BVPASNRGHYRXPF-FBHDLOMBSA-N 340.354 3.141 50 40 EGGB Cc1cccc(NC(=O)C(=O)N/N=C/c2ccccc2Cl)c1C 5548659 JLXWESCKDXHNLM-VXLYETTFSA-N 329.787 3.046 50 40 EGGB COc1ccc(-n2cccc2/C=N/NC(=O)Cc2ccccc2)cc1 408949330 BANCIJZABMJNOG-RCCKNPSSSA-N 333.391 3.179 50 40 EGGB CN(C)c1ccc(NC(=O)/C(C#N)=C\c2cccc([N+](=O)[O-])c2)cc1 408783429 PAUIFDFXRJYDFE-UVTDQMKNSA-N 336.351 3.206 50 40 EGGB O=C(N/N=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccco1 15145932 PMNXSLNPIBGZLR-LICLKQGHSA-N 325.280 3.212 50 40 EGGB COc1ccc(C(=O)NN/C=C/c2cccc(Br)c2)cc1 6181830 CENYZIMVPARTTO-MDZDMXLPSA-N 347.212 3.363 50 40 EGGB Cc1cc(C(=O)NNC(=O)[C@@H]2C[C@H]3C=C[C@H]2C3)c(C)n1-c1ccccc1 102222628 MAUUEIYFIFXFPJ-TXPKVOOTSA-N 349.434 3.067 50 40 EGGB CC(=O)NNC(=O)CCc1nc(-c2ccccc2)c(-c2ccccc2)o1 32878695 NOQPIONIAXZCDA-UHFFFAOYSA-N 349.390 3.109 50 40 EGGB C[C@@H](Br)C(=O)Nc1sc2c(c1C#N)CC(C)(C)OC2 545855 YZLUQKQFLQJIRE-SSDOTTSWSA-N 343.246 3.193 50 40 EGGB CC(/C=C/c1ccccc1F)=N/NC(=O)Cc1ccc([N+](=O)[O-])cc1 4697479 CZSCMWUMBHVTOQ-DUTWELIKSA-N 341.342 3.482 50 40 EGGB CCOc1ccc(CC(=O)N/N=C/c2cccc(OCC)c2)cc1 10475901 AFPFXEBGPDYEKU-XSFVSMFZSA-N 326.396 3.177 50 40 EGGB O=C(N/N=C/c1ccc(Cl)c(Cl)c1)c1ccc(O)cc1O 5943783 CQDFAZISPHSWEX-REZTVBANSA-N 325.151 3.169 50 40 EGGB N#C/C(C(=O)Nc1ccccc1Br)=C(/O)Br 936069018 ARTWAXGDTWECKT-TWGQIWQCSA-N 345.978 3.076 50 40 EGGB O=C(N/N=C/c1cccc(Cl)c1)c1cncc(Br)c1 257400 BESLBALJYTZBGN-UBKPWBPPSA-N 338.592 3.261 50 40 EGGB Cc1ccc([C@@H]2C(C#N)=C(N)Oc3c2c(C)nn3-c2ccccc2)o1 5547683 TXZHQCNTRZIUOW-KRWDZBQOSA-N 332.363 3.300 50 40 EGGB Cc1cccc([C@H]2C(C#N)=C(N)Oc3c2c(=O)[nH]c2ccccc32)c1 17067454 HNFHMJNGAMEDFH-INIZCTEOSA-N 329.359 3.055 50 40 EGGB COc1ccc(CSCC(=O)N/N=C/c2ccccc2OC)cc1 59503542 TWRUCGHJPXERNM-YBFXNURJSA-N 344.436 3.087 50 40 EGGB CC(=O)N/N=C/c1ccc(OCCOc2ccc(C)c(C)c2)cc1 4510736 JEOIAPXMJQBVGL-DEDYPNTBSA-N 326.396 3.231 50 40 EGGB CCOc1cc(C(=O)NN)cc(Cl)c1OCc1cccc(F)c1 216836545 BUMNINGWPAJEDL-UHFFFAOYSA-N 338.766 3.060 50 40 EGGB O=C(N/N=C/c1ccc(F)s1)c1cc(Br)cs1 252485533 GXVXUQZOBFMVJB-YIXHJXPBSA-N 333.207 3.475 50 40 EGGB Cc1nn(CCC#N)c(C)c1CCC(=O)NNc1cccc(Cl)c1 30615989 MHJKEQWZRVLRJJ-UHFFFAOYSA-N 345.834 3.143 50 40 EGGB O=C(NNC(=S)Nc1ccccc1)c1c(O)ccc2ccccc12 5672427 PKZQIQCCIXAYSU-UHFFFAOYSA-N 337.404 3.177 50 40 EGGB COc1cc(/C=C(\C#N)C(=O)NCc2ccco2)ccc1OC(C)C 3570382 XXSLRBLOYPGFOU-OQLLNIDSSA-N 340.379 3.299 50 40 EGGB COc1cccc2sc(NNC(=O)c3c(F)cccc3F)nc12 4121323 YBZHULPXNHZQDB-UHFFFAOYSA-N 335.335 3.340 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)c2c(Br)cnn2C)cc1 482898 KDOKWLSUBAHSLZ-CAOOACKPSA-N 349.232 3.070 50 40 EGGB COc1cc(/C=N/NC(N)=O)cc(Cl)c1OCc1ccc(C)cc1 478820 XCSFXDRYKOWIIF-AWQFTUOYSA-N 347.802 3.238 50 40 EGGB C/C(=N/OCC(=O)N/N=C/c1ccc(Cl)cc1)c1cccs1 5479925 HSAGVNFZFSBNNM-QOHRFTQFSA-N 335.816 3.292 50 40 EGGB O=C(/C=C/c1ccccc1)NNC(=O)c1cc2ccccc2cc1O 4550893 RRSHRAKRPSSAJB-ZHACJKMWSA-N 332.359 3.020 50 40 EGGB CC(C)C(=O)/C(C#N)=C1/NC(=O)[C@@H](Cc2ccc(Cl)cc2)S1 4540086 JCBLYOYUOZSFDB-OPCAMPFDSA-N 334.828 3.074 50 40 EGGB Cc1ccc2nc(C)c(C(=O)N/N=C/c3cccc(Cl)c3)n2c1 478677 CJPZJGRYWDXARF-DJKKODMXSA-N 326.787 3.368 50 40 EGGB C[C@]12CC[C@H]3[C@@H](CC[C@]45O[C@H]4C(O)=C(C#N)C[C@]35C)[C@@H]1CC[C@@H]2O 118912542 KVJXBPDAXMEYOA-AJUHELNSSA-N 329.440 3.467 50 40 EGGB CC(C)(C)c1ccc(CC(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 408566154 DPOOZMSSGJHNMK-CIAFOILYSA-N 338.407 3.406 50 40 EGGB CCCC[C@H](C(=O)NN)N1c2cc(OC)ccc2C(C)=CC1(C)C 223228696 VIUDSPQYZMIQHF-MRXNPFEDSA-N 331.460 3.246 50 40 EGGB N#C/C(=C\c1cccc(Cl)c1Cl)C(=O)NC[C@H]1CCCO1 4211314 QOEPMWFQTMPWII-YTRUQHMWSA-N 325.195 3.196 50 40 EGGB CCOC(=O)[C@@H](/C(C)=N/NC(=O)[C@@H]1C[C@@H]1c1ccccc1)C(C)C 4587771 CHCWYMNYPFSZEB-IFHMPGMBSA-N 330.428 3.118 50 40 EGGB Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N/N=C/c1ccccc1O 243883 JKIVNUHKXOHSIA-NJDFMEINSA-N 332.787 3.272 50 40 EGGB COc1cc(/C=N/NC(=O)c2ccccc2Cl)ccc1OCC#N 6580958 UJAGDTFAUWZOKD-RGVLZGJSSA-N 343.770 3.015 50 40 EGGB N#CC1=C(N)Oc2n[nH]c(-c3ccc(F)cc3)c2[C@@H]1c1ccc(O)cc1 9109624 CUJBWMXEYXZZJN-OAHLLOKOSA-N 348.337 3.140 50 40 EGGB biogenic,in-vitro C[C@@H]1CCC/C(=N/NC(=O)CCC(=O)N/N=C2/CCC[C@@H](C)C2)C1 5527957 AVGQWTXONGCGQY-QFOMLOHJSA-N 334.464 3.131 50 40 EGGB CN(C)c1ccc(-n2cccc2/C=N\NC(=O)c2ccccc2O)cc1 408850273 JVWROROKSCQUML-STZFKDTASA-N 348.406 3.013 50 40 EGGB C/C(=N/NC(=O)CSc1nc2ccccc2o1)c1ccccc1O 4898723 QRIMJFHUJBMUCE-ODLFYWEKSA-N 341.392 3.166 50 40 EGGB Cc1nc2ccccc2n1CC(=O)N/N=C/C1=CC[C@@H]2C[C@@H]1C2(C)C 102407129 MJDNFXQZNIBKAB-GJSZRHCTSA-N 336.439 3.439 50 40 EGGB C[C@@]1(CO)CCC[C@]2(C)[C@@H]1CC[C@H]1C[C@@H]3C=C[C@]12[C@H]1C(=O)OC(=O)[C@@H]13 104073737 AWKLTAVAULXADV-IXZNZYAZSA-N 344.451 3.093 50 40 EGGB CCOC(=O)/C(C#N)=C1/S[C@H](CC)C(=O)N1c1ccc(C)cc1 2329358 DTQPZMQMENZSNJ-LBFFYKKLSA-N 330.409 3.152 50 40 EGGB O=C(N/N=C\c1ccc(F)cc1)C(F)(F)C(F)(F)C(F)(F)F 100307356 IPIWVHFJIXVGLA-SDPNRITHSA-N 334.166 3.109 50 40 EGGB O=C(CC(c1ccccc1)c1ccccc1)NNC(=O)c1cccnc1 12892318 QNSIMFQUSAZEHK-UHFFFAOYSA-N 345.402 3.065 50 40 EGGB CC(C)(C)OC(=O)NNC(=O)C(c1ccccc1)c1ccccc1 12932239 FTEKKBJZEQOORY-UHFFFAOYSA-N 326.396 3.374 50 40 EGGB CCC[C@H](C(=O)OCC)/C(C)=N\NC(=O)COc1cc(C)cc(C)c1 408949108 DSNLMYNDKFUVGX-SWEXZPIWSA-N 348.443 3.154 50 40 EGGB CCOC(=O)c1c(C)c(C)n(Cc2ccco2)c1NC(=O)CCl 4205251 JAITUPCKCYANBH-UHFFFAOYSA-N 338.791 3.100 50 40 EGGB COc1ccc([C@H]2C(C#N)=C(C(C)(C)C)OC(N)=C2C=N)c(OC)c1 4888584 KYVKSKHFWZSWCK-INIZCTEOSA-N 341.411 3.461 50 40 EGGB O=C(COc1cccc(Br)c1)N/N=C\c1ccsc1 409001486 WCWVCVSYYLCSFM-CHHVJCJISA-N 339.214 3.040 50 40 EGGB Cc1nc2ccc(Br)cn2c1C(=O)NN=C1CCCC1 408721753 YBQZPHSKPNYDND-UHFFFAOYSA-N 335.205 3.065 50 40 EGGB C=CCOc1ccc(C(=O)N/N=C\c2ccc(OC)cc2)cc1OC 409325621 YWPJGVDIVLPKPN-MOSHPQCFSA-N 340.379 3.033 50 40 EGGB Cc1ccc(CC(=O)N/N=C\c2ccc(O)c(Br)c2)cc1 409361037 OPZABUZFWXKOQR-ZDLGFXPLSA-N 347.212 3.156 50 40 EGGB Cc1cc(N2C[C@H](C(=O)Cl)CC2=O)c(C)cc1Br 45952785 GSFSXAXJMDLACT-SECBINFHSA-N 330.609 3.184 50 40 EGGB COc1ccc(/C=N/NC(=O)COc2cc(C)c(Cl)c(C)c2)cc1 345145 QACOGAJXMLPXLF-KEBDBYFISA-N 346.814 3.495 50 40 EGGB Cc1ccc(-n2nc(C)c3c2OC(N)=C(C#N)[C@H]3c2ccoc2)cc1 499706 IPVHWOSWRVBKFJ-QGZVFWFLSA-N 332.363 3.300 50 40 EGGB Cc1ccc(C(=O)NNC(=O)C2(c3cccc(F)c3)CCCC2)s1 84205175 MAKNBXQLVZKKBI-UHFFFAOYSA-N 346.427 3.469 50 40 EGGB COc1cc(/C=N/NC(=O)c2ccc(C)cc2Cl)cc(OC)c1O 4827432 IFRWDGSGHPFKAM-DJKKODMXSA-N 348.786 3.135 50 40 EGGB CCCCOC(=O)CSC1=C(C#N)[C@@H](c2ccccc2)CC(=O)N1 2474155 XHTWWDXDQVSRLE-CQSZACIVSA-N 344.436 3.102 50 40 EGGB NC(=O)c1cccc(C(=O)NN(c2ccccc2)c2ccccc2)c1 28994128 FGZYIPGFTADSPE-UHFFFAOYSA-N 331.375 3.269 50 40 EGGB CC(C)COc1ccc(C(=O)N/N=C/c2ccc(N(C)C)o2)cc1 2768385 AMRORVXGVWPUKL-YBFXNURJSA-N 329.400 3.144 50 40 EGGB COc1cccc(/C=N\NC(=O)Cc2ccc(F)cc2)c1OC(C)C 409246897 KSYBORVTFRRDCG-MTJSOVHGSA-N 344.386 3.314 50 40 EGGB COc1ccc(Br)cc1/C=C(/C#N)C(=O)NC1CCCC1 33595911 XAGDURLPEXGSJO-WQLSENKSSA-N 349.228 3.423 50 40 EGGB Cc1cccc(NC(=O)NNC(=O)c2cc3ccccc3cc2O)c1 20408283 FPQMEASSIAIERE-UHFFFAOYSA-N 335.363 3.320 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)Nc2ccccc2)c(O)c1 357725 UUNHSZLCPVQYSC-CPNJWEJPSA-N 326.400 3.394 50 40 EGGB CCOc1ccccc1OCC(=O)N/N=C/c1ccc(Cl)cc1 3039995 FMOVLTKMLOSBPJ-YBFXNURJSA-N 332.787 3.268 50 40 EGGB CC12CC3C[C@]([C@H](Cl)C(=O)O)(C1)C[C@]([C@H](Cl)C(=O)O)(C3)C2 104110380 ZUPVATIOXGRXBN-SOUXLNKSSA-N 335.227 3.347 50 40 EGGB COc1cccc(-c2n[nH]c3c2[C@@H](c2ccc(C)o2)C(C#N)=C(N)O3)c1 5818370 XDXFDTWRMBZNAH-OAHLLOKOSA-N 348.362 3.205 50 40 EGGB NNC(=O)c1cnc(-c2cccc(Cl)c2)nc1Nc1ccccc1 223462593 PSPQZUVWIBXWKS-UHFFFAOYSA-N 339.786 3.144 50 40 EGGB Cc1ccc(/C=C(\C#N)C(=O)NCCc2ccccc2)cc1[N+](=O)[O-] 7158735 DYOHCEBJNCQWPR-GZTJUZNOSA-N 335.363 3.169 50 40 EGGB CC(C)(c1ccc(OCC(=O)O)cc1)c1ccc(OOC(=O)O)cc1 584577839 TYHAIXRNNGICOB-UHFFFAOYSA-N 346.335 3.464 50 40 EGGB COc1ccc([C@@H]2NC(N)=C(C#N)C3=C2[C@H](C)CCC3)cc1OC 1652466 GUWTUEWWTLWBKU-ZMZPIMSZSA-N 325.412 3.159 50 40 EGGB CC1(C)[C@H]2CC[C@@](C(=O)O)(C2)[C@]1(Br)CBr 100319121 OSNJXUXPWZALOC-SWPVVBRQSA-N 340.055 3.426 50 40 EGGB CC(C)(C)C/C(=N\NC(=O)CN1CCCCCC1=O)c1ccccc1 96035555 GODAHHSGFJTQMH-HEHNFIMWSA-N 343.471 3.346 50 40 EGGB CNC(=O)/C(C#N)=C\c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1 5033775 SAWLPJARSBXWLA-TWGQIWQCSA-N 331.715 3.161 50 40 EGGB Cc1ccc(C(C)C)c(OCC(=O)NN=C(CCl)CCl)c1 4860668 CMOBWYXXERBDRC-UHFFFAOYSA-N 331.243 3.447 50 40 EGGB CCOC(=O)[C@@H]1C(O)=NC(SC)=C(C#N)[C@@H]1c1ccccc1OC 9087732 LAIJDBBITHATCX-KBPBESRZSA-N 346.408 3.026 50 40 EGGB CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=N/c1ccc(N(C)C)cc1 408743419 TWPNXLKBDOTWJX-HKOYGPOVSA-N 342.406 3.341 50 40 EGGB CN(NC(=O)c1cnn(Cc2ccccc2Cl)c1)c1ccccc1 32850738 CKCRSJKJTQVRLH-UHFFFAOYSA-N 340.814 3.366 50 40 EGGB CCOc1cccc(/C=N\NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 33309738 HNIOTTOCKAMPKQ-WQRHYEAKSA-N 327.340 3.066 50 40 EGGB C#Cc1ccc(C(=O)NNc2ccc(C#N)cc2C(F)(F)F)cc1 1634871223 USWQZONTVNBCOP-UHFFFAOYSA-N 329.281 3.315 50 40 EGGB CCOc1ccc(/C=N/NC(=O)Cc2ccc(C)c(C)c2)cc1OC 561556 YXWOSQJWCTWKAJ-FYJGNVAPSA-N 340.423 3.404 50 40 EGGB Cc1ccc(C(=O)N/N=C/c2ccc(OC3CSC3)cc2)cc1 8372068 DWUYETYFTIQLIT-VXLYETTFSA-N 326.421 3.253 50 40 EGGB C/C(=N/NC(=O)c1cc(C2CC2)n[nH]1)c1ccc(Br)cc1 5685636 YRARASNMJRPMNV-MFOYZWKCSA-N 347.216 3.204 50 40 EGGB CCOc1cc(/C=C(\C#N)C(=O)NCc2cccs2)ccc1O 270371 XTXCYBWEWIEPMG-MDWZMJQESA-N 328.393 3.076 50 40 EGGB COc1cc(OC)cc(C(=O)N/N=C(\C)c2ccc(C)c(C)c2)c1 6685727 AUBYQPZCDAZNKW-XSFVSMFZSA-N 326.396 3.475 50 40 EGGB Cc1ccc(SCC(=O)N/N=C/c2ccc([N+](=O)[O-])cc2)cc1 8515351 QBGTZKRNBRDLFY-LICLKQGHSA-N 329.381 3.146 50 40 EGGB CC1(C)[C@]2(C)CC[C@@]1(C(=O)N1CCCCC1)[C@@H](Br)C2=O 2106594 SPFWMAKXCTWFLU-XZJROXQQSA-N 342.277 3.158 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)[C@H](C)NC(=O)c2ccccc2)cc1 2711728 PHZRBIAPXLHJAL-PCXKXAPESA-N 337.423 3.079 50 40 EGGB CNC(=O)/C(C#N)=C/c1ccc(-c2ccc(Cl)c([N+](=O)[O-])c2)o1 6169455 TYNQLXXTSMXZOP-UXBLZVDNSA-N 331.715 3.161 50 40 EGGB C/C(=N\NC(=O)c1ccccc1Br)c1cc(O)ccc1O 100062588 BAZJWHQQXWYWEM-RQZCQDPDSA-N 349.184 3.014 50 40 EGGB C[C@@H](Oc1ccc(Cl)cc1)C(=O)NN=Cc1ccc(N(C)C)cc1 23397230 JGVQGLKOEHARFQ-CYBMUJFWSA-N 345.830 3.324 50 40 EGGB C[C@@H](NC(=O)/C(C#N)=C\c1ccco1)c1cccc(-n2ccnc2)c1 98014014 KUYDEQMHUNYEKE-VQCBNXJZSA-N 332.363 3.250 50 40 EGGB CCC[C@@H](C(=O)OCC)/C(C)=N\NC(=O)COc1cc(C)cc(C)c1 408949090 DSNLMYNDKFUVGX-MNTXUITRSA-N 348.443 3.154 50 40 EGGB N#C/C(=C\c1ccccc1Cc1ccccc1Br)C(N)=O 408865433 CJTKUHBMPAEWLP-XNTDXEJSSA-N 341.208 3.432 50 40 EGGB COc1ccc(/C=C(/C#N)C(=O)Nc2ccccc2C(C)=O)cc1O 408767638 ZHYPCMIJTKCMAS-ZROIWOOFSA-N 336.347 3.149 50 40 EGGB COCCCNC(=O)/C(C#N)=C/c1cc(C(C)C)c(OC)cc1C 408802041 YGMNRMLQCGUKHC-MHWRWJLKSA-N 330.428 3.187 50 40 EGGB COc1ccc(-c2csc([C@H](C#N)C(=O)CCl)n2)cc1OC 11765331 LYYSKRIKALCSIJ-SNVBAGLBSA-N 336.800 3.242 50 40 EGGB O=C(N/N=C/c1ccc(Cl)c(Cl)c1)c1cc(O)cc(O)c1 13322292 YLAZKVFNXGJJKV-REZTVBANSA-N 325.151 3.169 50 40 EGGB O=C1C=C(NNC(=O)c2cccc(Cl)c2)C[C@@H](c2ccco2)C1 408751556 XZUUGJUZUGPMPU-GFCCVEGCSA-N 330.771 3.198 50 40 EGGB C/C(=N\NC(=O)c1ccc(N/N=C(\C)c2ccc[nH]2)cc1)c1ccc[nH]1 7422115 JVEXMWJLLLIRAE-MSKUYSOUSA-N 348.410 3.333 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)c2ccc(Cl)cc2)cc1[N+](=O)[O-] 409311297 FTUWNLPPQPQBEW-VCHYOVAHSA-N 347.758 3.411 50 40 EGGB O=C(N/N=C/c1ccccc1Cl)C(=O)Nc1cccc(Cl)c1 3008767 MFJKYZIOIQFBDP-GIJQJNRQSA-N 336.178 3.082 50 40 EGGB Cc1ccc(C)c(NC(=O)C(=O)N/N=C/c2ccc(Cl)cc2)c1 3147954 FRPJMGKZPXZNCB-VXLYETTFSA-N 329.787 3.046 50 40 EGGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1 253407 PHMPEEGSCFCVTI-CXUHLZMHSA-N 348.156 3.121 50 40 EGGB O=C(NNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)c1ccccc1 1415096 NSDYJCSNGVOURE-UHFFFAOYSA-N 340.364 3.475 50 40 EGGB COc1ccccc1/C=N/NC(=O)COc1c(C)ccc(C)c1C 12844060 QYQYXBQDTPWJLX-RGVLZGJSSA-N 326.396 3.150 50 40 EGGB COc1ccc(/C=C(\C#N)S(=O)(=O)c2ccc(F)cc2)c(OC)c1 13141579 JDXWHSDTPUNVAF-CXUHLZMHSA-N 347.367 3.181 50 40 EGGB COc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)cc1OC 20248367 BKXFQIHQIHPXKF-KZKLBEMASA-N 344.436 3.335 50 40 EGGB CC(CCI)CCI 60230803 JZQMFKNWCOSKMT-UHFFFAOYSA-N 337.970 3.273 50 40 EGGB CCOC(=O)[C@@H](CC)/C(C)=N\NC(=O)COc1c(C)cc(C)cc1C 408951511 JAHJHQOWBRVIPV-UKEODDKASA-N 348.443 3.072 50 40 EGGB CCCC[C@H](C(=O)NN)N1c2c(OC)cccc2[C@H](C)CC1(C)C 260619465 MLFKSAGBZBRVEV-UKRRQHHQSA-N 333.476 3.336 50 40 EGGB O=C(N/N=C/c1cccs1)c1ccc(NC(=O)c2ccco2)cc1 6334189 DGPDBEPRFYZGBZ-WOJGMQOQSA-N 339.376 3.357 50 40 EGGB CC(C)(C)[C@@]1(OCSC#N)C(=O)N=CN=CN1Cc1ccccc1 4977934 XUPPDGISSSYVIA-KRWDZBQOSA-N 344.440 3.016 50 40 EGGB O=C(OCc1ccccc1)N1CCC[C@@H]1CI 79436611 RKUASCJHUMQZEQ-GFCCVEGCSA-N 345.180 3.223 50 40 EGGB CN(C)c1cccc(C(=O)N/N=C/c2ccc(N3CCCC3)cc2)c1 564015 VGSFVHHBKZWBCS-RCCKNPSSSA-N 336.439 3.117 50 40 EGGB O=C(NNC(=O)C1(c2ccccc2)CCC1)c1ccc2ccccc2n1 32904157 LKVZNKMSZHWORD-UHFFFAOYSA-N 345.402 3.118 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@H]2CCCC[C@@H]2C)cc1[N+](=O)[O-] 23382596 QBWNWEOAPIWZBX-KTAQLRSZSA-N 343.383 3.205 50 40 EGGB CC(=O)Oc1ccc(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)cc1 408720212 VWDAHARETZLFSO-KZKLBEMASA-N 342.420 3.243 50 40 EGGB CCCCOc1ccc(/C=C(\C#N)C(=O)N2CCCC2)cc1OC 43079528 VJUZWUDIWNIFAA-FOWTUZBSSA-N 328.412 3.403 50 40 EGGB COc1ccc2[nH]cc(/C=C(\C#N)C(=O)NCCc3ccccc3)c2c1 44918295 FYVJHELVZAITIY-LFIBNONCSA-N 345.402 3.442 50 40 EGGB O=C(Cc1ccc(Cl)cc1)N/N=C/c1ccc(Br)o1 219527 WYYWQZYXKHDBGQ-LZYBPNLTSA-N 341.592 3.388 50 40 EGGB COc1ccc(/C=C/C(=O)Oc2ccc([N+](=O)[O-])cc2)cc1OC 6153360 PIWSXXKXAADPDX-ONNFQVAWSA-N 329.308 3.231 50 40 EGGB C=CCOc1ccc(/C=N/NC(=O)c2cccc(OC)c2)cc1OC 409183672 FLVOUYWIJXZLBH-DEDYPNTBSA-N 340.379 3.033 50 40 EGGB C[C@@H](Br)C(=O)c1ccc(I)cc1 36903484 ZVIUWJYHZBDPQF-ZCFIWIBFSA-N 338.970 3.257 50 40 EGGB Cc1nc(C)c(C(=O)N/N=C/c2ccc3ccccc3c2O)s1 224138519 WERRJNSPRHAHLZ-GIJQJNRQSA-N 325.393 3.383 50 40 EGGB CO[C@@H]1CCN(C(=O)/C(C#N)=C/C(C)C)C[C@H]1Cc1ccccc1 585288950 BYPQQJDGYXTLNS-CDEWEUSKSA-N 326.440 3.199 50 40 EGGB CC(C)Oc1ccc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 169879675 CRZFVKAHPKXWBQ-WOJGMQOQSA-N 327.340 3.146 50 40 EGGB C[C@H](Sc1ccccc1)C(=O)N/N=C/c1ccccc1C(=O)O 20246287 TUKMUBCBFJPBEM-HWQJWEFDSA-N 328.393 3.016 50 40 EGGB NC(=O)N/N=C/c1cn(-c2ccccc2)nc1-c1cc2ccccc2o1 3572435 RDCZZSMEDVUTIH-SRZZPIQSSA-N 345.362 3.288 50 40 EGGB N#C/C(=C/c1ccc(Oc2cnccn2)cc1)C(=O)NC1CCCC1 96433629 NESLOKWGOABWOQ-PTNGSMBKSA-N 334.379 3.235 50 40 EGGB Cc1c(C(=O)N/N=C/c2cccc3ccccc23)sc(N)c1C#N 5724409 HHJUJQGMMIEVOL-UFFVCSGVSA-N 334.404 3.428 50 40 EGGB COc1cccc(/C=N/NC(=O)CSc2nc3ccccc3o2)c1 60137 AIVNIBHZGKPSNI-VCHYOVAHSA-N 341.392 3.079 50 40 EGGB CCSC1=C(C#N)[C@H](c2ccc(C)cc2)[C@@H](C(=O)OC)C(O)=N1 189683 MDCHVJODMWTRQK-UONOGXRCSA-N 330.409 3.326 50 40 EGGB COC(=O)c1ccc(/C=C(\C#N)C(=O)Nc2ccc(OC)cc2)cc1 1083628 WVESZPHGVYNUMW-RVDMUPIBSA-N 336.347 3.027 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)c2ccccc2O)cc1OCC 58634163 MJDNIMUNTRDESX-DEDYPNTBSA-N 342.395 3.344 50 40 EGGB COC(=O)N/N=C/c1ccccc1OCCOc1ccccc1Cl 4525973 VJVBUWWZKMXIRZ-XDHOZWIPSA-N 348.786 3.488 50 40 EGGB C/C(CC(=O)Nc1ccc(F)cc1)=N\NC(=O)c1ccc(F)cc1 14923228 KMSIIFIHOQGUPT-SRZZPIQSSA-N 331.322 3.099 50 40 EGGB O=C(N/N=C/c1cc(Br)ccc1F)c1ccc(O)cc1 7945212 URLYUBKKBDLCPQ-CAOOACKPSA-N 337.148 3.058 50 40 EGGB C[Si]1(C)O[Si](C)(C)O[Si](C)(CCl)O[Si](C)(C)O1 195767003 KDACIXJUXOJZLX-UHFFFAOYSA-N 331.065 3.022 50 40 EGGB Cc1cc(N2C[C@@H](C(=O)Cl)CC2=O)c(C)cc1Br 45952787 GSFSXAXJMDLACT-VIFPVBQESA-N 330.609 3.184 50 40 EGGB O=C(N/N=C/[C@@H]1C[C@H]2C=C[C@@H]1C2)C(O)(c1ccccc1)c1ccccc1 374146 MEIWVLWDWOXTGU-WEQRKAIBSA-N 346.430 3.237 50 40 EGGB CCOc1ccc(/C(C)=N/NC(=O)c2ccc(OC)c(OC)c2)cc1 13958045 XWIICCYAVRRILO-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB NC(=O)N/N=C/c1ccc(OCc2ccccc2)c(Br)c1 6223281 RYOAYRXJEASCGL-GIJQJNRQSA-N 348.200 3.030 50 40 EGGB Cc1cc(C=C(C#N)C#N)c(C)n1-c1ccc(N2CCOCC2)cc1 786662 NODUFPASYGGCKS-UHFFFAOYSA-N 332.407 3.361 50 40 EGGB CCN(CC)c1ccc(/C=N/NC(=O)[C@@H](C#N)c2ccccc2)cc1 6630012 GEAYDAVGZUKJFB-OMNSNBSWSA-N 334.423 3.290 50 40 EGGB O=C(/C=C/NNC(=O)c1ccncc1)c1ccc(-c2ccccc2)cc1 59425780 BJKLSSTZVCAUAT-NTCAYCPXSA-N 343.386 3.380 50 40 EGGB O=C(Cc1cccs1)N/N=C\c1cc(Cl)cc(Cl)c1O 15938525 WYCNUOZHGJOTQL-APSNUPSMSA-N 329.208 3.453 50 40 EGGB CN(C)c1cccc(C(=O)NNC(=O)Nc2cccc3ccccc23)c1 11007148 DJMYDXXTRNGJFJ-UHFFFAOYSA-N 348.406 3.372 50 40 EGGB O=C(CSc1nc2ccccc2s1)N/N=C/c1ccc(O)cc1 191798 MAYOAVBVPRQXKE-RQZCQDPDSA-N 343.433 3.244 50 40 EGGB O=C(/C=C/c1cccc2ccccc12)NNC(=O)Cc1ccccc1 586231 SHXSBLHBSGWDFL-BUHFOSPRSA-N 330.387 3.243 50 40 EGGB CC1(C)CC(=O)[C@@H](C(=O)/C=C/c2ccccc2)C(=O)[C@H]1Br 104832366 FTZWJPQHMYAASF-MOIGAOQCSA-N 349.224 3.217 50 40 EGGB O=C(N/N=C/[C@@H]1C[C@@H]2CC[C@@H]1C2)C(O)(c1ccccc1)c1ccccc1 100453550 AVOCCHZHHHQNLQ-SOEUKBEVSA-N 348.446 3.461 50 40 EGGB COc1ccccc1/C=C/C=C(\C#N)C(=O)Nc1ccccc1C(=O)O 13343893 UQHQEPDEFPWYPY-SKAFZBRJSA-N 348.358 3.495 50 40 EGGB COc1cc(OC)c(/C=N/NC(=O)c2ccc(Cl)cc2)c(OC)c1 3573736 ZXBUOLZGOJWJEQ-VXLYETTFSA-N 348.786 3.130 50 40 EGGB C/C(=N\NC(=O)c1nc(Cl)c(Cl)c(N)c1Cl)c1ccco1 20885234 JZUVNEABFOKPBZ-BLLMUTORSA-N 347.589 3.371 50 40 EGGB CC1(C)C(=O)[C@]2(Br)CC[C@@]1(CC#N)[C@@H]2Br 85398913 OJTCQBIJBRMLII-XROYCOCOSA-N 335.039 3.186 50 40 EGGB COc1cc(OC)cc(C(=O)NNc2nc3c(F)cccc3s2)c1 429763 VYFAIIZDJHTDRU-UHFFFAOYSA-N 347.371 3.210 50 40 EGGB CCOc1ccc(/C=N/NC(=O)c2cccc([N+](=O)[O-])c2C)cc1 566066 PPXYHDRNSYSQLI-WOJGMQOQSA-N 327.340 3.066 50 40 EGGB C[C@@H](NC(=O)/C(C#N)=C\c1ccco1)c1cccc(-n2cccn2)c1 98056155 YJKBNEISEVERNW-IZCBMXNHSA-N 332.363 3.250 50 40 EGGB CC(C)(C)C(=O)[C@H](Br)[C@@H](O)C(Cl)(Cl)Cl 3165587 FYTCKBXKBUXJLV-UJURSFKZSA-N 326.445 3.096 50 40 EGGB CCOC(=O)/C(C#N)=C/Nc1ccc(C(=O)N2CCCCCC2)cc1 14836286 PMKQNNLRBGJKQM-JQIJEIRASA-N 341.411 3.085 50 40 EGGB COc1cccc(/C=C(\C#N)C(=O)NCCCc2ccccc2)c1O 409240937 MGRUAJZXEBSJHK-GHRIWEEISA-N 336.391 3.057 50 40 EGGB COc1cc2ccccc2cc1[C@@H]1C(C#N)=C(N)Oc2n[nH]c(C)c21 141952 PJZMEOCALZKGAP-QGZVFWFLSA-N 332.363 3.098 50 40 EGGB N#CCC(=O)N/N=C/c1ccc(OCc2ccc(Cl)cc2)cc1 59140354 YTHPAAJRXFLCJR-RGVLZGJSSA-N 327.771 3.283 50 40 EGGB O=C(NCCCn1nc(C(F)(F)F)cc1C1CC1)C(Cl)Cl 2778237 FPIDYSFJDKJQFF-UHFFFAOYSA-N 344.164 3.089 50 40 EGGB N#CC1=C(S)N(c2ccccc2)[C@@H](c2ccc(F)cc2)NC1=O 9111357 MTIXDDWAAOIRJP-HNNXBMFYSA-N 325.368 3.126 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)Nc2ccc(N(C)C)cc2)ccc1O 408774949 DSGMJWICCJKKNN-UVTDQMKNSA-N 337.379 3.012 50 40 EGGB CC/C(=N\NC(=O)c1ccc(OC)cc1)c1ccc(OC)c(OC)c1 408719583 GSIVAASCOBHSKU-CAPFRKAQSA-N 342.395 3.257 50 40 EGGB O=C(N/N=C/c1ccc(F)s1)c1cc(-c2ccc(O)cc2)on1 252495819 PBPXCOVAXCOYIL-CAOOACKPSA-N 331.328 3.012 50 40 EGGB O=C(CS[C@@H]1CCc2ccccc21)N/N=C\c1ccccc1O 17126188 RCABVSNSNNHAIS-HPKGMJOESA-N 326.421 3.263 50 40 EGGB COc1cccc(C(=O)N/N=C/c2ccc(Br)s2)c1 6248394 IMHSWHSMDWBLET-OVCLIPMQSA-N 339.214 3.283 50 40 EGGB O=C(NNc1ccccc1[N+](=O)[O-])c1sccc1-n1cccc1 32899398 NDZCPEVLTHOYFR-UHFFFAOYSA-N 328.353 3.204 50 40 EGGB CCc1ccccc1NC(=O)C(=O)N/N=C/c1ccc(C(C)C)cc1 3080059 LZFKLDKRBOFEJH-FYJGNVAPSA-N 337.423 3.461 50 40 EGGB CC(C)CNC(=O)Cc1ccc(N(CCCl)CCCl)cc1 1727164 SDFVECCUCPYRMJ-UHFFFAOYSA-N 331.287 3.285 50 40 EGGB COc1cc(Cl)c(/C=N/NC(=O)c2ccc(F)cc2)cc1OC 8812231 ATBFLPRTZZYKPU-DJKKODMXSA-N 336.750 3.260 50 40 EGGB C#CCOc1ccc(/C=N/NC(=O)c2cc3ccccc3o2)cc1OC 4738864 NPZAQXCDJUYMJI-FYJGNVAPSA-N 348.358 3.217 50 40 EGGB O=C(c1ccc(F)cc1F)[C@H](Br)CBr 307673958 DICOBNUDFYNVID-SSDOTTSWSA-N 327.950 3.306 50 40 EGGB N#C/C(=C/c1ccc(-c2cc(C(=O)O)ccc2Cl)o1)C(N)=S 34746773 ATXCXIRLCCPNQH-UITAMQMPSA-N 332.768 3.491 50 40 EGGB O=C(N/N=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccco1 502421 AWSZRBKWUUNTEO-LICLKQGHSA-N 325.280 3.212 50 40 EGGB C/C(=N\NC(=O)COc1ccc2ccccc2c1)c1ccccc1O 100039650 ZJYIONSJLBZQHS-KGENOOAVSA-N 334.375 3.465 50 40 EGGB COc1cccc(/C=N/NC(=O)COc2ccc(Cl)c(C)c2)c1 566267 KOUCCCJUAZEZIQ-VXLYETTFSA-N 332.787 3.186 50 40 EGGB Cc1ccsc1/C=N/NC(=O)CCn1nc(C(F)(F)F)cc1C 2783930 XODUNMDGNSRGOY-QGMBQPNBSA-N 344.362 3.121 50 40 EGGB O=C(/C=C/c1c(Cl)cccc1Cl)NNC(=O)c1ccco1 8354903 ILEFTQUCFKRBJA-VOTSOKGWSA-N 325.151 3.061 50 40 EGGB CCOC(=O)N[C@H](CC(=O)N/N=C/c1cccs1)c1ccccc1 408978594 JHJWTNBJLPROJV-GYZOOYGHSA-N 345.424 3.076 50 40 EGGB N#C[C@H](C(=O)N/N=C/c1ccc(Br)cc1)c1ccccc1 409193436 CNJNNAZUVWEYMN-BKQORJHRSA-N 342.196 3.207 50 40 EGGB CNC(=O)/C(C#N)=C/c1c(-c2ccccc2)[nH]c2ccc(OC)cc12 408786214 HDCMEMAQBSOOQS-GXDHUFHOSA-N 331.375 3.496 50 40 EGGB O=C(N/N=C/c1ccc(-c2ccc(F)cc2)o1)[C@H](O)c1ccccc1 561523 NVASVYKTSHBQRF-AGKWGAAGSA-N 338.338 3.269 50 40 EGGB CCOC(=O)/C(C#N)=C/c1ccc(-c2cccc(C(=O)OC)c2)o1 240386 ROYFMJDXZFMIKW-GXDHUFHOSA-N 325.320 3.203 50 40 EGGB N#C/C(=C/c1ccc(O)c([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1 16428186 QJRYQBRQRGAIJB-XFFZJAGNSA-N 343.726 3.499 50 40 EGGB CC(=O)N/N=C/c1cc(C)n(-c2sc3c(c2C#N)CCCC3)c1C 529715 KGCWZHSLXOEXSI-KEBDBYFISA-N 340.452 3.376 50 40 EGGB COc1cc(Br)ccc1C(=O)N/N=C/c1cccs1 126293 IAMBKMRMHLYELJ-OVCLIPMQSA-N 339.214 3.283 50 40 EGGB COc1ccc(CC(=O)N/N=C\c2ccccc2Cl)cc1OC 59515917 FOGFJYAFFCDTBC-ODLFYWEKSA-N 332.787 3.050 50 40 EGGB COC(=O)c1ccc(/C=C(\C#N)c2nc(-c3ccc(C)cc3)no2)o1 96401018 QUGHOJNMKWLTAB-UKTHLTGXSA-N 335.319 3.489 50 40 EGGB CCOc1cc(/C=N/NC(=O)[C@@H](C)Sc2ccccc2)ccc1O 313839 PMZSWXBRNRGYAQ-KZKLBEMASA-N 344.436 3.422 50 40 EGGB CCn1c2ccccc2c2cc(NC(=O)C/C(C)=N/NC=O)ccc21 5318810 LPSQQDJVHHSLIK-LPYMAVHISA-N 336.395 3.265 50 40 EGGB O=C(NNC(=O)C12C[C@H]3C[C@@H](CC(Cl)(C3)C1)C2)c1ccccc1 102953974 XPVLRBASAJJZPO-LGBHXNNWSA-N 332.831 3.025 50 40 EGGB CSC(SC)=C(C#N)c1nc(-c2ccc3c(c2)OCO3)no1 57354745 QFFDRIKSWGZKQU-UHFFFAOYSA-N 333.394 3.383 50 40 EGGB COC(=O)c1ccc(/C=N/NC(=O)c2ccc(C)c(Cl)c2)cc1 59148748 MLLUEPPBCWUOPO-VXLYETTFSA-N 330.771 3.199 50 40 EGGB Cc1ccc(Cl)cc1NC(=O)C(=O)N/N=C/c1sccc1C 59435552 IHGNDSKBXXVSBA-CAOOACKPSA-N 335.816 3.107 50 40 EGGB CCOc1cc(/C=N/NC(=O)CSc2ccccc2)ccc1O 59166847 VPUCYZZLQRDVLP-WOJGMQOQSA-N 330.409 3.033 50 40 EGGB Cc1cc(C)cc(OCC(=O)NNC(=O)C[C@@H](C)c2ccccc2)c1 3410923 IUZBZWONMVKTAA-MRXNPFEDSA-N 340.423 3.023 50 40 EGGB CCOc1ccc(/C=C(\C#N)c2nnc3n2CCCCC3)cc1OC 6209540 UMRZFIWVWGDIMZ-RVDMUPIBSA-N 338.411 3.476 50 40 EGGB C#CCOc1c(Cl)cc(/C=C(/C#N)C(=O)NC(C)C)cc1OCC 408775527 HXTZALDLLJMUOX-ZSOIEALJSA-N 346.814 3.182 50 40 EGGB C#CCn1cc(/C=C(/C#N)C(=O)NCc2ccccc2)c2ccccc21 408747334 MJERLDWQMDSGRU-AQTBWJFISA-N 339.398 3.498 50 40 EGGB O=C(N/N=C/c1ccc(N2CCCC2)c(F)c1)c1ccc(F)cc1 409103131 AXEDDQKZNOLWTF-CIAFOILYSA-N 329.350 3.329 50 40 EGGB N#C/C(=C\c1ccc(Sc2nc3ccccc3s2)o1)C(N)=O 408991944 PHCSUGKIWPJORV-VQHVLOKHSA-N 327.390 3.433 50 40 EGGB COc1ccc(C(=O)NNc2nc3c(OC)cccc3s2)cc1 4121310 DNKOMIKGQYAYBB-UHFFFAOYSA-N 329.381 3.070 50 40 EGGB Cc1ccccc1/C=N/NC(=O)CSc1nc2ccccc2o1 528855 KKLCJVQEAOLJEV-VCHYOVAHSA-N 325.393 3.379 50 40 EGGB COc1cc(CCN(CCCl)CCCl)cc(OC)c1OC 1693123 ZNHVWFHMHYWCOI-UHFFFAOYSA-N 336.259 3.035 50 40 EGGB CCOc1ccc(/C=C(\C#N)C(=O)n2nc(C)cc2C)cc1OC 408975366 ATXOXVBEHTYLRA-OQLLNIDSSA-N 325.368 3.155 50 40 EGGB C/C(=N/NC(=O)CSc1nc2ccccc2o1)c1cccc(O)c1 552190 LNEHJUKDZNEVEA-ODLFYWEKSA-N 341.392 3.166 50 40 EGGB N#C/C(=C\[C@@H]1C[C@H](Cl)C[C@H](Cl)[C@@H]1O)C1CCC([N+](=O)[O-])CC1 5328069 NUBBBMPTQGNFID-MUUNBYKZSA-N 347.242 3.258 50 40 EGGB CCOc1ccc(C(=O)N/N=C(\C)c2ccc(OC)c(OC)c2)cc1 5475439 LNYQEZMJQIVXKN-DEDYPNTBSA-N 342.395 3.257 50 40 EGGB FC(F)(F)C1(C(F)(F)F)N[C@H]2[C@@H](Cl)[C@H]1C[C@H]2OCCCl 100121926 GCFPUWPAGCMEBN-MVIOUDGNSA-N 346.098 3.073 50 40 EGGB CC[C@H](C)c1ccc(OCC(=O)NNC(=O)c2cccs2)cc1 505702 PVGDOJJHYQYMPP-LBPRGKRZSA-N 332.425 3.102 50 40 EGGB CC(C)(C)C(=O)[C@@H](Br)[C@H](O)C(Cl)(Cl)Cl 3165585 FYTCKBXKBUXJLV-XINAWCOVSA-N 326.445 3.096 50 40 EGGB Cc1cc2c(c(=O)n1Cc1ccccc1)[C@@H](C(C)C)C(C#N)=C(N)O2 2350926 COWKDLCFYIHKQN-KRWDZBQOSA-N 335.407 3.031 50 40 EGGB C=CCOC(=O)C1=C(C)N2CCSC2=C(C#N)[C@@H]1c1ccco1 3342395 SHZATTGRCNSHFK-OAHLLOKOSA-N 328.393 3.164 50 40 EGGB COc1cccc(C(=O)N/N=C/c2cc(OC)c(OC)cc2Cl)c1 408589957 NQDWGONYGHDULG-VXLYETTFSA-N 348.786 3.130 50 40 EGGB C[C@@H](Oc1cccc(Cl)c1)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 137753 LSENQVUCBMQKOM-VDCVXVNISA-N 347.758 3.166 50 40 EGGB CC(=O)/C(C#N)=C1/NC(=O)[C@H](Cc2cc(Cl)ccc2Cl)S1 16661275 PPMIGUPFYAKEII-GVIGZQTCSA-N 341.219 3.092 50 40 EGGB Cc1cc(C)nc(NNC(=O)c2ccccc2-c2ccccc2C#N)n1 21127586 CXZHWJRJXPLDTM-UHFFFAOYSA-N 343.390 3.389 50 40 EGGB N#C/C(=C\c1cn(CCC(N)=O)c2ccccc12)c1cccc(C#N)c1 108230573 ICVWQAYMYNPHNX-GZTJUZNOSA-N 340.386 3.453 50 40 EGGB CCCC/C(C)=N\NC(=O)C(=O)Nc1ccc(Br)cc1 59515743 ULWIYRGBRSCUIV-YVLHZVERSA-N 340.221 3.070 50 40 EGGB Cc1cc(C)nc(NNC(=O)Cc2c(Cl)cccc2Cl)n1 13000678 GHIZFGAVXAUVPE-UHFFFAOYSA-N 325.199 3.086 50 40 EGGB O=C(N/N=C/c1ccc([N+](=O)[O-])s1)NC12CC3CC(CC(C3)C1)C2 4897912 LNRNBAZOSCEDNG-RQZCQDPDSA-N 348.428 3.258 50 40 EGGB CCOc1cc2c(cc1/C=N\NC(=O)c1ccc(Cl)cc1)OCO2 409108231 SORZTIRFJUFCPC-OCKHKDLRSA-N 346.770 3.231 50 40 EGGB CC(/C=C/c1ccccc1)=N\NC(=O)c1nn(C)cc1Br 12362412 JCLDKVDHFGDVHU-WRFVMNGSSA-N 347.216 3.002 50 40 EGGB COc1cc(/C=C/C(=O)NN)ccc1OCc1cccc2ccccc12 226337820 ZSTLJUUOFPKRSF-ZRDIBKRKSA-N 348.402 3.431 50 40 EGGB O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)c1cccc(O)c1 6686526 UJUKNQCZKGMQQQ-REZTVBANSA-N 325.151 3.169 50 40 EGGB C/C(=C/C(=O)c1ccc(Br)cc1)NNC(=O)c1ccco1 408948308 CPZZRLCDKOYMJA-KTKRTIGZSA-N 349.184 3.063 50 40 EGGB CCOc1cc(/C=N/NC(=O)Cc2ccc(C)c(C)c2)ccc1OC 561543 KTNPTVCRFQBOJZ-FYJGNVAPSA-N 340.423 3.404 50 40 EGGB COc1ccc2c(c1)c(C(=O)NN=Cc1cccs1)c(C)n2C 252679852 SDFCFNZDJVCIDD-UHFFFAOYSA-N 327.409 3.321 50 40 EGGB C=CCOc1ccccc1/C=N/NC(=O)Cc1ccc(OCC)cc1 10475912 JWVYMOPUNOHICC-RCCKNPSSSA-N 338.407 3.343 50 40 EGGB COc1ccc(C(=O)N/N=C/c2ccc(N3CCCC3)c(F)c2)cc1 409070763 ZFEHGXNMLQDBKK-FYJGNVAPSA-N 341.386 3.198 50 40 EGGB C=CCc1cc(/C=C(\C#N)C(=O)N[C@@H](C)CC)cc(OCC)c1O 408811553 KKLGWMRJVSAIOP-RKPNYOAGSA-N 328.412 3.341 50 40 EGGB CC(=O)Nc1cccc(/C(C)=N/NC(=O)CSc2ccccc2)c1 408840553 GSZQCLCZNNUYRB-DEDYPNTBSA-N 341.436 3.278 50 40 EGGB CC[C@H](C)Oc1c(Br)cc(/C=N/NC(C)=O)cc1OC 409013365 URPBXBBXTAAPHT-VKPPLCHCSA-N 343.221 3.105 50 40 EGGB CN(C)c1ccc([N+](=O)[O-])cc1/C=N/NC(=O)c1cccc(Cl)c1 408997879 OSVBZIBZMSNIFT-VCHYOVAHSA-N 346.774 3.078 50 40 EGGB Cc1ccc(-c2ccc(/C=C(\C#N)C(N)=C(C#N)C#N)o2)c([N+](=O)[O-])c1 100488044 ACSKFHYDWUAFOV-KPKJPENVSA-N 345.318 3.330 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C/c2cc(OC)ccc2OC)cc1 59433072 OYZDEEWAMLFIBS-GXDHUFHOSA-N 338.363 3.258 50 40 EGGB C=CCc1cc(/C=N/NC(=O)c2ccccc2F)cc(OCC)c1O 59249803 KKTJSRQITRGMRH-CIAFOILYSA-N 342.370 3.422 50 40 EGGB Cc1cc(/C=N/NC(=O)c2ccc(F)cc2)c(C)n1-c1ccccn1 409248103 FZXDHYHOADQIST-WSDLNYQXSA-N 336.370 3.392 50 40 EGGB CCNC(=O)/C(C#N)=C/c1ccc(-c2ccc(C(=O)O)c(Cl)c2)o1 408820418 XOSLJOPRGGYVLO-YRNVUSSQSA-N 344.754 3.341 50 40 EGGB O=C(O)c1ccc(-c2ccc(/C=N/NC(=O)c3ccccc3)o2)cc1 5601357 HNFCBRCGOIARKG-UDWIEESQSA-N 334.331 3.409 50 40 EGGB CC(C)(C)c1ccc(CC(=O)N/N=C/c2ccc(O)c(O)c2)cc1 107875822 NRSGMEFOTHFKSW-UDWIEESQSA-N 326.396 3.088 50 40 EGGB C=CCN1C(=O)/C(=C(\C#N)C(=O)Nc2ccccc2)c2ccccc21 409389582 QMSOAIZULJWRAV-FBMGVBCBSA-N 329.359 3.135 50 40 EGGB O=C(CCCc1nc2ccccc2s1)N/N=C\c1ccc(O)cc1 35982082 BSVLYPQUVUKUAR-UNOMPAQXSA-N 339.420 3.475 50 40 EGGB CC[C@@H](C)n1cc([C@@H]2C(C#N)=C(N)OC3=C2C(=O)CC(C)(C)C3)cn1 253407274 VULZJESLZSJDKS-BDJLRTHQSA-N 340.427 3.305 50 40 EGGB CCOC(=O)c1ccc(NC2=NC[C@H](CBr)S2)cc1 283681 RBXLIZZKZONKDN-NSHDSACASA-N 343.246 3.142 50 40 EGGB Cc1ccccc1OCC(=O)N/N=C/c1ccccc1Br 59502239 GVEAADXULFCULC-VCHYOVAHSA-N 347.212 3.287 50 40 EGGB C/C(=N\NC(=O)CN1C(=O)c2cccc3cccc1c23)c1cccs1 106824816 SPWFQDUAWNZWFG-UDWIEESQSA-N 349.415 3.402 50 40 EGGB COc1ccc(C(=O)NNC(=O)C2CCC(C(C)(C)C)CC2)cc1 2628508 PRTVVPYZXNWMGN-UHFFFAOYSA-N 332.444 3.309 50 40 EGGB C/C(=N\NC(=O)c1cccn1C)c1ccc(N2CCCCC2)c(F)c1 61466434 BURKYRUTGMUVGZ-KGENOOAVSA-N 342.418 3.309 50 40 EGGB CCOc1ccc(/C=N/NC(=O)Cc2ccccc2)cc1OCC 4702548 LYFDMGRFQIYZAO-XSFVSMFZSA-N 326.396 3.177 50 40 EGGB Cc1cccc(NC(=O)/C(C#N)=C/c2ccc(N3CCOCC3)cc2)c1 4710710 QPJMKTXQXZYHID-NBVRZTHBSA-N 347.418 3.377 50 40 EGGB Cc1ccc(NC(=O)/C(C#N)=C\c2ccc(O)c([N+](=O)[O-])c2)c(C)c1 33328154 FJCTURFOOXVAIU-ZSOIEALJSA-N 337.335 3.463 50 40 EGGB COC(=O)c1ccc(/C=C(/C#N)C(=O)Nc2cccc(OC)c2)cc1 48288754 XLZURMAEGSBAFD-GDNBJRDFSA-N 336.347 3.027 50 40 EGGB O=C(CN1CCCCC1)N/N=C/c1cccc(Oc2ccccc2)c1 233623 GMHACZFKOHQMLB-RCCKNPSSSA-N 337.423 3.415 50 40 EGGB CCOc1ccc(C(=O)N/N=C(\C)c2ccc3c(c2)OCCO3)cc1 6683866 VRHZLGZJEVQCEN-DEDYPNTBSA-N 340.379 3.011 50 40 EGGB C#C[C@]1(O)CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(OO)[C@@H]3CC[C@]21C 256461455 UOTMWSQOLMXLKR-GPBSYSOESA-N 330.424 3.105 50 40 EGGB C#CCOc1ccc2ccccc2c1/C=N/NC(=O)c1ccccc1N 6312109 VKNRYKRUYBSVKS-OEAKJJBVSA-N 343.386 3.198 50 40 EGGB O=[N+]([O-])c1cc(-n2cnc3c(Cl)ncnc32)ccc1CCCl 1657424 JPAGERFXBKXMLN-UHFFFAOYSA-N 338.154 3.158 50 40 EGGB COc1cccc(C(=O)N/N=C/c2cc([N+](=O)[O-])ccc2Cl)c1 4891089 DRUMIZDSUAPISA-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB CCCCCOc1ccc(/C=C(\C#N)C(=O)NC[C@@H]2CCCO2)cc1 26688690 PVHAAQPKDLXVJE-UMEYKSNOSA-N 342.439 3.458 50 40 EGGB O=C(O)c1cccc(-n2cccc2/C=N\NC(=O)c2cccs2)c1 409105407 JAYMHKVNRYJQKT-WQRHYEAKSA-N 339.376 3.001 50 40 EGGB COc1cc(OC)c(/C=N/NC(=O)c2cccc(C)c2)cc1Cl 408591791 VEILWLSQDFPDTA-VXLYETTFSA-N 332.787 3.430 50 40 EGGB O=C(COc1cccc2ccccc12)N/N=C/c1ccc2c(c1)OCO2 515569 QSLDHAQEVZRXHI-SRZZPIQSSA-N 348.358 3.098 50 40 EGGB COc1ccccc1C(=O)N/N=C/c1cc(C)n(-c2ccccn2)c1C 6044058 RPSGTHGRLMCDCR-LPYMAVHISA-N 348.406 3.262 50 40 EGGB COc1ccc(/C=N/NC(=O)Cc2ccc(Cl)cc2)cc1OC 13138789 DKKKLXOHUNFRPL-YBFXNURJSA-N 332.787 3.050 50 40 EGGB CC(C)NC(=O)/C(C#N)=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1 15188758 ABTDPFPMCWHKDO-FMIVXFBMSA-N 325.324 3.286 50 40 EGGB Cc1ccc(C)c(OCC(=O)NNC(=O)c2cccc3ccccc23)c1 549284 GLGARKXNCOKJDZ-UHFFFAOYSA-N 348.402 3.297 50 40 EGGB COc1ccccc1[C@@H]1[C@H]2CCCC=C2C(C#N)=C(N)C1(C#N)C#N 66763 LPLWQZMMDQWUPY-KSSFIOAISA-N 330.391 3.289 50 40 EGGB Cc1ccc([C@@]23C=C[C@@](c4ccccc4)(C2)[C@H]2C(=O)OC(=O)[C@@H]23)cc1 104258067 NGVNZZVUDLWVTA-RPHTVSPISA-N 330.383 3.460 50 40 EGGB COc1ccccc1C(=O)NNc1nc(-c2ccc(Cl)cc2)no1 69709766 ADZFQWNOTPZOKW-UHFFFAOYSA-N 344.758 3.156 50 40 EGGB CCCN1C(=O)/C(=N/NC(=O)c2ccc(Cl)cc2)c2ccccc21 18173327 UMGNXPWOIJKJCI-CAPFRKAQSA-N 341.798 3.231 50 40 EGGB COc1ccccc1/C=N/NC(=O)COc1ccc(C(C)C)cc1 58493 LEZBAJISUGATDQ-UDWIEESQSA-N 326.396 3.348 50 40 EGGB Br[C@@H]1CCC[C@@H]2N=C(N/N=C/c3ccccc3)S[C@H]21 5899390 XGUGXCYNVHMVAJ-YSHGPUTJSA-N 338.274 3.398 50 40 EGGB N#CC1=C(N)Oc2c(c(=O)oc3ccccc23)[C@@H]1Cc1ccccc1 52365 REJHAVZZXNQRJQ-CQSZACIVSA-N 330.343 3.206 50 40 EGGB Cc1cccc(/C=N/NC(=O)COc2cc(C)c(Cl)c(C)c2)c1O 30937388 MLDSRBGQCVZZFU-AWQFTUOYSA-N 346.814 3.500 50 40 EGGB N#CCCn1cc(/C=C(\C#N)C(=O)O)c(-c2ccc(Cl)cc2)n1 3394119 JJFLKWZLSDRZGB-XYOKQWHBSA-N 326.743 3.109 50 40 EGGB CC/C(=N\NC(=O)c1cc(O)c(O)c(O)c1)c1ccc(Cl)cc1 13957637 DQMNCNLDVNLUSP-LDADJPATSA-N 334.759 3.001 50 40 EGGB COc1ccc(OC)c(/C=C(\C#N)c2nc(O)c3ccccc3n2)c1 17044000 NPJUDFYRNIOEHH-UKTHLTGXSA-N 333.347 3.417 50 40 EGGB COc1ccc(Cl)cc1/C=N/NC(=O)c1ccc(NC(C)=O)cc1 581934 XLWZDDGUYVYIHX-VXLYETTFSA-N 345.786 3.071 50 40 EGGB Cc1nc2ccccc2cc1C(=O)N/N=C/c1ccc([N+](=O)[O-])cc1 366234 KTKIQMXTYUDITL-YBFXNURJSA-N 334.335 3.215 50 40 EGGB COc1ccc(C(=O)N/N=C/c2cn(C(C)=O)c3ccccc23)cc1 4131983 RMKHVTHDWIOANC-RGVLZGJSSA-N 335.363 3.074 50 40 EGGB O=C(N/N=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1)c1cccnc1 323591 DSNVGTOOEYTJFH-YBFXNURJSA-N 336.307 3.014 50 40 EGGB C/C(N)=C(\C#N)C(=O)CSc1nc2ccccc2n1CC(C)C 104382371 UKGYEVSWJWOFAQ-SEYXRHQNSA-N 328.441 3.110 50 40 EGGB CCCOc1ccc(/C=N/NC(=O)Cc2cccs2)cc1OC 2759424 GEUZHQBWXNFHHM-LDADJPATSA-N 332.425 3.238 50 40 EGGB COc1cccc(/C=N\NC(=O)COc2ccccc2C(C)C)c1O 32655517 XLMAVKMKZCIPNH-JAIQZWGSSA-N 342.395 3.053 50 40 EGGB COC(=O)c1ccc(/C=N/NC(=O)c2cc3ccccc3cc2O)cc1 262854 FQOBDTXUHKVURM-CIAFOILYSA-N 348.358 3.096 50 40 EGGB Cn1cc(/C=C/C(=O)NN(Cc2ccccc2)c2ccccc2)cn1 32255827 OKMKNMMEYWZCDN-OUKQBFOZSA-N 332.407 3.171 50 40 EGGB O=C(CNc1ccc2ccccc2c1)N/N=C/c1cccc([N+](=O)[O-])c1 31053 DSAYKZKJLILUKJ-CIAFOILYSA-N 348.362 3.310 50 40 EGGB CCSC1=C(C#N)[C@@H](c2ccc(C)cc2)[C@@H](C(=O)OC)C(O)=N1 189681 MDCHVJODMWTRQK-ZIAGYGMSSA-N 330.409 3.326 50 40 EGGB O=C1CCP(c2ccccc2)(c2ccccc2)(c2ccccc2)O1 104162380 HSWXWJMLISBJLN-UHFFFAOYSA-N 334.355 3.378 50 40 EGGB Cc1ccc(S(=O)(=O)C(C#N)=C2N(C)c3ccccc3N2C)cc1 3334020 XNOAMIOOKQJEQB-UHFFFAOYSA-N 339.420 3.048 50 40 EGGB COC(=O)COc1ccc(/C=C(\C#N)c2nc3ccccc3[nH]2)cc1 15009159 XDNKHLULSVPQOW-GXDHUFHOSA-N 333.347 3.179 50 40 EGGB Cn1c(=O)oc2cc(N/C=C(\C#N)c3nc4ccccc4o3)ccc21 16363988 PACJKMOGAJCUDQ-ZHACJKMWSA-N 332.319 3.249 50 40 EGGB CC(=O)N/N=C/c1cccc(OCCOc2ccc(C)c(C)c2)c1 6215782 YNCMIHWQWANPFO-DEDYPNTBSA-N 326.396 3.231 50 40 EGGB COc1cc(/C=N/NC(=O)c2ccc(Cl)cc2)ccc1OC(C)=O 485131 IPEUTYJKOMFSQA-VXLYETTFSA-N 346.770 3.038 50 40 EGGB Cc1ccc(C(=O)NNC(=O)N(C)Cc2ccc(C)cc2C)cc1 12567690 KVWNKMJYWZOFRZ-UHFFFAOYSA-N 325.412 3.098 50 40 EGGB COc1cc(Cl)c(/C=N/NC(=O)Cc2ccccc2)cc1OC 66202172 OGDJAHLFQZNUTB-YBFXNURJSA-N 332.787 3.050 50 40 EGGB C[C@H](O)CC[PH](c1ccccc1)(c1ccccc1)c1ccccc1 104097323 MIGDNRRWAOAHCE-IBGZPJMESA-N 336.415 3.484 50 40 EGGB O=C(CCl)N(Cc1cc(=O)[nH]c2ccccc12)C1CCCCC1 12492243 MJTLEXTUBSECJN-UHFFFAOYSA-N 332.831 3.428 50 40 EGGB N#CCCn1cc(/C=C(/C#N)C(=O)O)c(-c2ccc(Cl)cc2)n1 3394121 JJFLKWZLSDRZGB-WQLSENKSSA-N 326.743 3.109 50 40 EGGB COc1ccc(Cl)cc1C(=O)N/N=C/c1ccccc1[N+](=O)[O-] 4155643 MWOQMWOIANVLAA-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB CCOc1ccc(C(=O)N/N=C/c2ccc(Br)o2)cc1 20763955 YVEXPSQPTLBCQQ-CXUHLZMHSA-N 337.173 3.205 50 40 EGGB C=CCSC1=C(C#N)[C@@H](c2ccccc2)[C@@H](C(=O)OC)C(O)=N1 9088809 KPVWIOKNPVWYNO-ZIAGYGMSSA-N 328.393 3.184 50 40 EGGB CCOc1cc(/C=N/NC(=O)CCSc2ccccc2)ccc1O 48017 PJEQWILUYFLUOW-CPNJWEJPSA-N 344.436 3.423 50 40 EGGB COc1ccccc1OCC(=O)N/N=C(\C)CCc1ccccc1 8182343 SMAXLWIBLCKXSL-HMMYKYKNSA-N 326.396 3.199 50 40 EGGB CCOC(=O)/C(C#N)=C(\O)c1ccc(NC(=O)c2cccs2)cc1 100538564 WCFZFTVLRWEIKU-SQFISAMPSA-N 342.376 3.356 50 40 EGGB CCO/C=N/C1=C(C#N)[C@@H](c2ccccc2)C(C(=O)OCC)=C(C)O1 101521574 GVEPBHXPLBXEQU-KKJJZKEWSA-N 340.379 3.437 50 40 EGGB COc1ccc(/C(C)=N/NC(=O)CC(C)C)cc1Br 8512092 DUEYWMCSHFADRC-MHWRWJLKSA-N 327.222 3.344 50 40 EGGB CCOc1cccc(/C=N/NC(=O)COc2ccccc2Cl)c1 4544300 ZTWATRXWQZUCNH-YBFXNURJSA-N 332.787 3.268 50 40 EGGB O=C(N/N=C\c1ccc(F)cc1)c1ccc2c(c1)OCC1(CC1)CO2 225368923 QTANFJSMMCCRMQ-FBHDLOMBSA-N 340.354 3.141 50 40 EGGB COc1ccc(C(=O)N/N=C/c2cccc(OC)c2OC(C)C)cc1 8228728 OKYVKHMOQNDRPF-UDWIEESQSA-N 342.395 3.255 50 40 EGGB CCCC1=C(C(=O)OCC)[C@H](c2ccccc2OC)C(C#N)=C(N)O1 76500 WMHBSSALMXHBOA-MRXNPFEDSA-N 342.395 3.120 50 40 EGGB O=C(N/N=C/c1ccccc1Cl)c1cncc(Br)c1 289398 KDPKVGATBDRSQG-REZTVBANSA-N 338.592 3.261 50 40 EGGB N#C/C(=C\c1cn(CCC(N)=O)c2ccccc12)c1ccc(C#N)cc1 582376 PMKPWMCEMWXBEY-GZTJUZNOSA-N 340.386 3.453 50 40 EGGB O=C(c1cc([N+](=O)[O-])ccc1F)C(Br)Br 1857793404 ZALCGFJRCUJXQM-UHFFFAOYSA-N 340.930 3.033 50 40 EGGB Cc1ccccc1OCC(=O)N/N=C/c1c(O)ccc2ccccc12 535357 RSWARHJAPJOCFC-CIAFOILYSA-N 334.375 3.383 50 40 EGGB COc1cccc(C(=O)N/N=C/c2ccc(Cl)c([N+](=O)[O-])c2)c1 59445237 UMWDKNHMQHAYSD-RQZCQDPDSA-N 333.731 3.021 50 40 EGGB CCN(CC)C(=O)CSC(Nc1cccc(F)c1)=C(C#N)C#N 2280390 SPTURRRAUDIHFP-UHFFFAOYSA-N 332.404 3.098 50 40 EGGB O=C(CSCc1ccccc1Cl)N/N=C/c1ccc(O)cc1 59167146 CKIRKZOUDNRORN-GIJQJNRQSA-N 334.828 3.429 50 40 EGGB CN(C)c1ccc(-n2cccc2/C=N/NC(=O)Cc2ccccc2)cc1 408949343 BETHNPVOXUFLAV-CJLVFECKSA-N 346.434 3.236 50 40 EGGB C/C(=N\OCC(=O)C(C#N)=C1Nc2ccccc2N1)c1ccccc1 16137271 GMXXSUFGEUGTSI-YDZHTSKRSA-N 332.363 3.269 50 40 EGGB Cc1[nH]c2ccc(O)cc2c1C(=O)N/N=C/c1ccc(N(C)C)cc1 5336499 GAWMAQNGETUFDI-RGVLZGJSSA-N 336.395 3.012 50 40 EGGB COc1cccc(/C=N/NC(=O)CCCc2ccc(OC)c(C)c2)c1 61700 OQUWJIAIXPMDQP-KGENOOAVSA-N 340.423 3.485 50 40 EGGB O=C(N/N=C/c1cccc([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 564195 XZIWGPCWTXQGJI-DJKKODMXSA-N 337.257 3.378 50 40 EGGB CC(C)(C)OC(=O)N/N=C(\N)COc1cc(Cl)cc(Cl)c1 43769306 BOGCKFVKLWHDNU-UHFFFAOYSA-N 334.203 3.169 50 40 EGGB COc1ccc2c(c1)C(=C(C#N)C#N)C(=O)N2CCc1ccccc1 5478283 BLNGJDYGUUGBOH-UHFFFAOYSA-N 329.359 3.085 50 40 EGGB Cc1ccc(C(=O)NNC2=C(C(=O)C(F)(F)F)CCC2)cc1Cl 409095779 JCEGYTHWQYUIHS-UHFFFAOYSA-N 346.736 3.452 50 40 EGGB COc1ccc(CCNC(=O)/C(C#N)=C\c2cccs2)cc1OC 33361074 SPKCAWOSGAMXBR-KAMYIIQDSA-N 342.420 3.031 50 40 EGGB CC(C)N(C(=O)CCl)[C@H]1CCCC[C@H]1NC(=O)OC(C)(C)C 79392572 VBTAOJBKULDHHG-OLZOCXBDSA-N 332.872 3.298 50 40 EGGB I[C@H]1CC[C@@H]2CCN(Cc3ccccc3)[C@H]12 953065071 JHPRIOWQXAZKHT-RDBSUJKOSA-N 327.209 3.475 50 40 EGGB Cc1cc(C)cc(OCC(=O)NNC(=O)C[C@H](C)c2ccccc2)c1 3410925 IUZBZWONMVKTAA-INIZCTEOSA-N 340.423 3.023 50 40 EGGB COc1ccc(C(=O)NNc2nc3c(OC)ccc(C)c3s2)cc1 251222 NBNVWCZSNKONIK-UHFFFAOYSA-N 343.408 3.379 50 40 EGGB Cc1ccc(C)c(OCC(=O)N/N=C/c2cn(C)c3ccccc23)c1 565436 IQUVKYYZFUIQTO-SRZZPIQSSA-N 335.407 3.324 50 40 EGGB CCCC1=C(C(=O)OCC)[C@@H](c2cccc(F)c2)C(C#N)=C(N)O1 71015 RRNUTTMVYJMSPT-HNNXBMFYSA-N 330.359 3.251 50 40 EGGB CC1(C)[C@@H]2CC[C@@](C(=O)O)(C2)[C@@]1(Br)CBr 2505758 OSNJXUXPWZALOC-PPKCKEKNSA-N 340.055 3.426 50 40 EGGB CCc1cccc(CC)c1NC(=O)C(=O)N/N=C/c1ccc(C)cc1 7782089 PQWKUIKPTRMDRD-FYJGNVAPSA-N 337.423 3.209 50 40 EGGB Cc1cc2c(c(=O)n1C)[C@H](c1ccc(C(C)C)cc1)C(C#N)=C(N)O2 2219098 QXQJPEKXYAFSHT-QGZVFWFLSA-N 335.407 3.035 50 40 EGGB Cc1ccsc1C(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2 5787774 BCWWJERXDHUXDQ-UHFFFAOYSA-N 332.469 3.424 50 40 EGGB N#Cc1ccccc1COc1ccc(/C=N/NC(=O)c2ccco2)cc1 1098650 IPIBSWXGOXGBNL-LPYMAVHISA-N 345.358 3.494 50 40 EGGB C=CCOc1cccc(/C=N/NC(=O)[C@@H](C)Sc2ccccn2)c1 18195108 ZKDOLNOLXQEUCQ-GNUZOCDUSA-N 341.436 3.277 50 40 EGGB O=C(CNc1ccccc1)N/N=C/C1=Cc2cc(Cl)ccc2OC1 54279350 KGRFHMOXJSFXOJ-UFFVCSGVSA-N 341.798 3.330 50 40 EGGB C/C(=C\C(=O)NNC(=O)c1cn(C)c2ccccc12)c1ccccc1 56182473 DTMWLRCEAFRYLI-WYMLVPIESA-N 333.391 3.043 50 40 EGGB COc1c(Cl)cc(C(=O)Cl)cc1I 26508597 ZPDSIFBJCUZZGA-UHFFFAOYSA-N 330.936 3.332 50 40 EGGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)c2sccc2C)c1 2656099 JQRVAJGPYPIIEJ-UHFFFAOYSA-N 346.452 3.328 50 40 EGGB C/C(=N\NC(=O)c1cccc(N2CCCC2=O)c1)c1cccs1 5282554 WTDPGQVVIHQFGE-LDADJPATSA-N 327.409 3.029 50 40 EGGB C#CCOc1ccc(/C=C(/C#N)C(=O)N[C@@H](C)c2ccccc2)cc1 68722950 DGVILGQSRVNSIF-UYPHOHSBSA-N 330.387 3.483 50 40 EGGB C[C@]12CCCC[C@H]1[C@H]2C(=O)N/N=C/c1ccc(Br)o1 408720638 AWISFTCZTGEBNJ-YRHSEYJUSA-N 325.206 3.319 50 40 EGGB Cc1cc(N2CCCC2)ccc1/C=N/NC(=O)c1ccccc1F 408961387 SJUHIQNXLYZOLZ-FYJGNVAPSA-N 325.387 3.498 50 40 EGGB COc1cc(/C=C(/C#N)C(=O)C(C)C)c([N+](=O)[O-])cc1OC(F)F 44027111 QUWYVXKOKCFVDX-WMZJFQQLSA-N 340.282 3.337 50 40 EGGB COc1ccc(NCC(=O)N/N=C/C2=CC[C@H]3C[C@H]2C3(C)C)cc1 102375193 BXMHXFSWPUDQHW-WLLOATOISA-N 327.428 3.202 50 40 EGGB COc1c(Cl)cc(/C=C(/C#N)C(=O)N(C)C)cc1Br 59333975 MRWZQUGARHBRMD-WTKPLQERSA-N 343.608 3.106 50 40 EGGB O=C(/C=C/c1cc(Cl)ccc1Cl)NNC(=O)c1ccco1 12680787 KYJOCLMWSFOHLX-ZZXKWVIFSA-N 325.151 3.061 50 40 EGGB N#C/C(=C/c1ccc(-c2ccc(Cl)cc2)o1)C(=O)N1CCOCC1 33319119 OEEQCFQVGXCLIL-KAMYIIQDSA-N 342.782 3.366 50 40 EGGB O=C(N/N=C/c1ccc(Br)o1)c1ccccc1Cl 3158438 LRLAWCNXTWYADX-VIZOYTHASA-N 327.565 3.459 50 40 EGGB CN(C)c1ccc(C(=O)N/N=C(\c2ccccc2)c2ccncc2)cc1 4045950 KLNYUHWQXNCZIQ-BSYVCWPDSA-N 344.418 3.330 50 40 EGGB O=C(Nc1ccc2c(c1)OCO2)[C@@H](Br)c1ccccc1 162866 PECMYRCEBXUXOF-AWEZNQCLSA-N 334.169 3.490 50 40 EGGB COC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@H]2c1ccsc1 1427829 MDUWEXISNYPIIX-LLVKDONJSA-N 332.406 3.123 50 40 EGGB COC(=O)c1c(C)sc2c1OC(N)=C(C#N)[C@H]2c1ccc(C)cc1 1426959 UWEZYYBKBMYMBP-CQSZACIVSA-N 340.404 3.370 50 40 EGGB CCN(CC)c1ccc(/C=C(/C#N)C(=O)NCc2ccccc2)c(O)c1 4090246 ZQMCRNVPVGGMBB-PDGQHHTCSA-N 349.434 3.462 50 40 EGGB CCOC(=O)N/N=C(\C)c1ccc(OC(F)F)cc1OC(F)F 4979672 CSNXFLCGKQPPCT-CNHKJKLMSA-N 338.257 3.360 50 40 EGGB C/C(=N\NC(=O)Cc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1C 5538259 KXORAGMWHHXNQY-XMHGGMMESA-N 325.368 3.295 50 40 EGGB CC(C)(C)c1ccc(OCC(=O)N/N=C\c2ccccc2O)cc1 23397357 XMYMLKHWDKQLQB-NDENLUEZSA-N 326.396 3.219 50 40 EGGB COc1cc(/C=C(\C#N)S(=O)(=O)c2ccc(C)cc2)cc(OC)c1 6646355 AMPSNMMVWZWMNA-VCHYOVAHSA-N 343.404 3.351 50 40 EGGB CC(=O)NNC(=O)c1ccccc1Nc1cccc(C(F)(F)F)c1 9834584 HXUDNZOBNWWYMG-UHFFFAOYSA-N 337.301 3.230 50 40 EGGB C=CCc1cc(/C=N\NC(=O)c2cccs2)cc(OCC)c1O 408848659 RTBGHWIOAPTRES-WQRHYEAKSA-N 330.409 3.345 50 40 EGGB Cc1ccc(C(C)C)c(OCC(=O)N/N=C/c2ccc(O)c(O)c2)c1 50319 DQIWFFDDQUMPCZ-KEBDBYFISA-N 342.395 3.059 50 40 EGGB C[C@H](Sc1nccn1C)C(=O)/C(C#N)=C1/Nc2ccccc2S1 102367056 NFDJPEOMANUMEO-NVRAKJRWSA-N 342.449 3.423 50 40 EGGB COc1ccc(N/C=C(/C#N)C(=O)NCc2ccccc2)cc1Cl 102984697 FRGGQAADJYJNTR-OWBHPGMISA-N 341.798 3.484 50 40 EGGB COc1ccc2[nH]cc(/C=C(\C#N)C(=O)Nc3ccc(OC)nc3)c2c1 61719001 UFQXBWNIQIQBOS-KPKJPENVSA-N 348.362 3.126 50 40 EGGB CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)CCl 4219045 KZQZHZHQFYJXQX-UHFFFAOYSA-N 328.199 3.366 50 40 EGGB Cc1ccc(/C=N/NC(=O)c2ccccc2Br)c(O)c1 4827351 GODSDTSQJYMPFF-RQZCQDPDSA-N 333.185 3.227 50 40 EGGB CC(=O)Oc1ccc(/C=N/NC(=O)c2ccccc2-n2cccc2)cc1 408759230 ADKCCOZSKCCSJA-KGENOOAVSA-N 347.374 3.167 50 40 EGGB NC(=O)N/N=C/c1cccc(OCCCOc2ccccc2Cl)c1 41108622 PGBOJYMRZMKGJK-UDWIEESQSA-N 347.802 3.190 50 40 EGGB O=C(N/N=C/c1c(O)ccc2ccccc12)c1ccccc1[N+](=O)[O-] 252817 WEAYKRIXTFCBTK-YBFXNURJSA-N 335.319 3.218 50 40 EGGB COc1cc(OC)c(OC)cc1/C=N/NC(=O)c1cccc(Cl)c1 5526572 QUDUKNQHKGQBES-VXLYETTFSA-N 348.786 3.130 50 40 EGGB C[C@H]1CCc2sc(C(=O)N/N=C/c3ccc(C(=O)O)cc3)cc2C1 3554607 AOWPUOWFYJGEIJ-VSMYLPJWSA-N 342.420 3.335 50 40 EGGB C/C(=N\NC(=O)CNc1cccc(Br)c1)c1ccccc1 5221635 DDTDPGJJXBJVSH-XDHOZWIPSA-N 346.228 3.401 50 40 EGGB CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1ccccc1OCC#N 9296398 FNLGCLKLIHPBFZ-QGZVFWFLSA-N 349.390 3.040 50 40 EGGB NC(=O)NCCCCCC(=O)NN(c1ccccc1)c1ccccc1 69351621 SRIXQELRMNHCAO-UHFFFAOYSA-N 340.427 3.085 50 40 EGGB C#CCOc1c(Cl)cc(/C=C(\C#N)C(=O)OCC)cc1OCC 408817279 LDBCWCAFZALKPS-MDWZMJQESA-N 333.771 3.221 50 40 EGGB Cn1cc(/C=C(/C#N)C(=O)Nc2cccc(C(=O)O)c2)c2ccccc21 408545520 ZLKYOXBMGAWQMH-ZROIWOOFSA-N 345.358 3.422 50 40 EGGB COc1ccccc1NCC(=O)N/N=C(\C)c1cc2ccccc2o1 6297846 DVLUYWLSFYJOKB-FYJGNVAPSA-N 337.379 3.394 50 40 EGGB CCOC(=O)NNC(=O)c1ccccc1OCc1ccc(Cl)cc1 21771498 VEMGXAAOMXRDNG-UHFFFAOYSA-N 348.786 3.310 50 40 EGGB Cc1ccc([C@@H]2C(C#N)=C(N)Oc3[nH]nc(-c4ccc(F)cc4)c32)o1 92411 SRANNWQNLBONBT-AWEZNQCLSA-N 336.326 3.335 50 40 EGGB CC[C@@H](C)c1ccc(OCC(=O)N/N=C/c2cccc(O)c2)cc1 1320250 DFMOLUAOGVSRES-MQMKENTISA-N 326.396 3.435 50 40 EGGB Cc1ccc(-n2c(C)cc(/C=N/NC(N)=O)c2C)cc1Br 4739811 NACKFRAGVHKGJH-QGMBQPNBSA-N 349.232 3.167 50 40 EGGB C[C@@H](NC(=O)/C(C#N)=C\c1cccc([N+](=O)[O-])c1O)c1ccccc1 409235216 ATODFQGCHBRBRJ-DYTQJMLRSA-N 337.335 3.085 50 40 EGGB O=C(N/N=C/c1cccc2ccccc12)C(=O)NC1CCCCCC1 409007840 ZPDGISHMAMRVIR-KGENOOAVSA-N 337.423 3.129 50 40 EGGB COc1ccc(O)c(/C(C)=N/NC(=O)Cc2ccc(C)cc2C)c1 20195536 GSIIPQNSMCTQJJ-XSFVSMFZSA-N 326.396 3.101 50 40 EGGB Cc1cc(C)nc(SCC(=O)N/N=C\c2ccc(C(C)C)cc2)n1 32679253 DJNCBIRXUCYVDQ-GRSHGNNSSA-N 342.468 3.459 50 40 EGGB O=C(O)COc1cccc(/C=N/NC(=O)c2cccc3ccccc23)c1 1098919 HDJMXXZKGWFCDX-CIAFOILYSA-N 348.358 3.067 50 40 EGGB Cc1cccc(OCC(=O)N/N=C/c2cn(C)c3ccccc23)c1C 565542 YSBRBUDYPBVSKW-SRZZPIQSSA-N 335.407 3.324 50 40 EGGB Cc1cc(OCC(=O)N/N=C/c2ccccc2O)cc(C)c1Cl 504701 MAFGGQJTWWPDHA-DJKKODMXSA-N 332.787 3.192 50 40 EGGB Cc1ccc(OCC(=O)N/N=C/c2c(O)ccc3ccccc23)cc1 584689 XUUIUOKZUUTBIH-CIAFOILYSA-N 334.375 3.383 50 40 EGGB C[C@H]1CCc2sc(C(=O)N/N=C/c3cccc(O)c3O)cc2C1 3393659 PZXDJZABXDFMHL-NTOSSWPYSA-N 330.409 3.048 50 40 EGGB COc1ccc(S(=O)(=O)/C(C#N)=C/Nc2cccc(F)c2)cc1 6662208 ZJCZCLKWSRDZEM-LFIBNONCSA-N 332.356 3.085 50 40 EGGB CCOc1nc2c([nH]1)OC(N)=C(C#N)[C@@H]2c1ccccc1C(C)(C)C 5817625 PNMLFEJQEUKYRJ-AWEZNQCLSA-N 338.411 3.324 50 40 EGGB C/C(=N\NC(=O)CNc1ccc(C)cc1)c1ccc(-n2ccnc2)cc1 7009692 VRZNLVVOWCGDPG-XQNSMLJCSA-N 347.422 3.133 50 40 EGGB N#C/C(=C\c1ccc(Cc2ccccc2Br)cc1)C(N)=O 408868160 MOWYJEBNKHCWRR-XNTDXEJSSA-N 341.208 3.432 50 40 EGGB Cc1cc(C)nc(NNC(=O)c2ccc(-n3c(C)ccc3C)cc2)n1 22235880 MFFRVVRRYBSIJN-UHFFFAOYSA-N 335.411 3.258 50 40 EGGB O=C(Cc1ccc(F)cc1)N/N=C\c1ccc(Cl)c([N+](=O)[O-])c1 111669180 CPNQFGDMROUESE-NVMNQCDNSA-N 335.722 3.080 50 40 EGGB Cc1cccc(C)c1OCCCOc1ccccc1/C=N/NC(N)=O 4603839 ABDKAYZGKACRIP-FYJGNVAPSA-N 341.411 3.154 50 40 EGGB C[C@@H](Sc1ccccc1)C(=O)N/N=C/c1ccc(C(=O)O)cc1 408786264 NMMKHOOGGZQBJP-MBNTZHJCSA-N 328.393 3.016 50 40 EGGB N#CC1=C(N)/C(=C\c2ccccc2)C(=N)N(c2cccc(Cl)c2)C1=O 22079666 SUDVDKBCWHKNRB-MRDWGVERSA-N 348.793 3.484 50 40 EGGB CCCCSC1=C(C#N)[C@H](c2ccccc2OC)[C@H](C#N)C(=O)N1 9374647 DAXHIKRBUFIOKG-XJKSGUPXSA-N 341.436 3.317 50 40 EGGB Cc1ccc(O)c(/C=N/NC(=O)Cc2ccc(Br)cc2)c1 4735235 HVVCOSNMEKMGLR-VCHYOVAHSA-N 347.212 3.156 50 40 EGGB O=C1C=C(NNC(=O)CCc2ccccc2)C[C@H](c2ccccc2)C1 408751385 JZQVLGHCPYFAGO-SFHVURJKSA-N 334.419 3.271 50 40 EGGB CC(C)CC(=O)NNC(=O)CSc1cc(Cl)ccc1Cl 8293434 ZSKJWMNPMMGTGY-UHFFFAOYSA-N 335.256 3.279 50 40 EGGB Cc1cc2c(c(=O)[nH]1)[C@@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 17159510 IWPZVQYNWSOADD-ZDUSSCGKSA-N 348.189 3.208 50 40 EGGB COc1ccc(OCCCOc2ccccc2/C=N/NC(C)=O)cc1 9144635 MOBVLTYVMIMYGD-XSFVSMFZSA-N 342.395 3.013 50 40 EGGB COc1ccc(CSCC(=O)N/N=C/c2cccc(C)c2)cc1 408768111 SYQYACDSGSIRLZ-YBFXNURJSA-N 328.437 3.387 50 40 EGGB CCCC(=O)Nc1ccc(C(=O)N/N=C/c2ccccc2OC)cc1 60280 HCBAYQSJHQXSFU-DEDYPNTBSA-N 339.395 3.198 50 40 EGGB C[C@H]1CCc2cc(C(=O)N/N=C/c3cccc(O)c3O)sc2C1 13322282 IGJUMVHHZJSVTP-NTOSSWPYSA-N 330.409 3.048 50 40 EGGB N#C/C(=C\Nc1ccc(Br)cc1)C(=O)NCc1ccco1 5904007 BQEPTDMNEBZIJR-PKNBQFBNSA-N 346.184 3.178 50 40 EGGB COc1cc(OC)c(/C=N/NC(=O)Cc2ccccc2)cc1Cl 408587019 DOAGATKKWXDOIU-YBFXNURJSA-N 332.787 3.050 50 40 EGGB COc1cc(C)c(/C=N/NC(=O)c2ccccc2Cl)cc1OC 107638801 KZOXGAHCENVAKP-VXLYETTFSA-N 332.787 3.430 50 40 EGGB COc1cc(/C=C(/C#N)c2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1O 107706856 PKEFNXBFWUDHMK-MLPAPPSSSA-N 340.291 3.071 50 40 EGGB O=C(NCc1ccc(Cl)cc1)C(=O)NN=C1CCCCCCC1 59515683 ZINZQRQBBOGQRD-UHFFFAOYSA-N 335.835 3.173 50 40 EGGB C/C(=N\NC(=O)c1c(C)nc2ccccn12)c1ccc(Cl)cc1 5070964 AGILTJDRJZNNLR-RGVLZGJSSA-N 326.787 3.450 50 40 EGGB O=C(N/N=C(\C(=O)c1ccccc1)c1ccccc1)c1cccnc1 408722850 GSFACXRQCILDSY-PYCFMQQDSA-N 329.359 3.099 50 40 EGGB C/C(=N\NC(=O)CSCc1ccccc1C)c1ccccc1O 16362800 FCSJDSUYBLBPGH-XMHGGMMESA-N 328.437 3.474 50 40 EGGB CC1=CC(C)(C)N(C)c2ccc(/C=N/NC(=O)c3ccncc3)cc21 208440522 QRBPQXHZDDGJQI-LPYMAVHISA-N 334.423 3.477 50 40 EGGB COc1ccccc1N(/N=C1/Sc2ccccc2C1=O)C(C)=O 227365 QYEYTJAHIFEBPH-ISLYRVAYSA-N 326.377 3.350 50 40 EGGB O=C(NNC(=O)c1cccc2ccccc12)c1ccc2ccccc2n1 46577698 COYDGKNBRGZBBK-UHFFFAOYSA-N 341.370 3.463 50 40 EGGB C/C(CC(=O)Nc1ccc(C)c(Cl)c1)=N\NC(=O)c1cccnc1 5027188 IPGOXSVVDGXJBL-CIAFOILYSA-N 344.802 3.178 50 40 EGGB CC1=C(C#N)[C@@](NC(=O)c2ccccc2Cl)(C(F)(F)F)C(O)=N1 5072024 HCOVOTDAKLSWFD-ZDUSSCGKSA-N 343.692 3.139 50 40 EGGB COc1cc(/C=N/NC(=O)CCc2ccccc2)cc(Cl)c1O 408953616 MFPAOCCZUZJNND-YBFXNURJSA-N 332.787 3.137 50 40 EGGB CCOC(=O)C/C(C)=N/NC(=O)CSCc1ccccc1Cl 408720326 YYSYINMWNWVMFA-GZTJUZNOSA-N 342.848 3.019 50 40 EGGB COc1ccc(/C=C(/C#N)c2ccc(C(=O)O)cc2)c(OC)c1OC 408543903 QNQBCOQTGCXBBK-GDNBJRDFSA-N 339.347 3.475 50 40 EGGB O=C(O)[C@@H](Br)[C@H](Br)c1ccc(F)cc1 526059822 OVVPLFMUTUDGCL-SFYZADRCSA-N 325.959 3.110 50 40 EGGB O=C(OCc1ccccc1)N1CC[C@@H](CI)C1 79436619 OSVYLTGJLWNTOH-LBPRGKRZSA-N 345.180 3.080 50 40 EGGB CC(C)N(C[C@H]1CCCCN1C(=O)CCl)C(=O)OC(C)(C)C 79408865 AUXPOJFEALAAGN-CYBMUJFWSA-N 332.872 3.252 50 40 EGGB CC[C@@H](C(=O)N/N=C/c1ccc(F)s1)n1nc(C)c(Cl)c1C 252484270 FTISJEXZJRAYDX-MIUNIBSDSA-N 342.827 3.455 50 40 EGGB O=C(CCCC[C@H]1CCSS1)N1CC(Oc2cccnc2)C1 238866359 LWAMRBZMJWWUNX-HNNXBMFYSA-N 338.498 3.385 50 40 EGGB O=C(CCCC[C@@H]1CCSS1)Nc1ccc(-n2cnnn2)cc1 25358545 SKNGASZTBZDQBM-CQSZACIVSA-N 349.485 3.315 50 40 EGGB biogenic COc1cc(/C=C(/C#N)c2nc3ccc(F)cc3[nH]2)cc(OC)c1O 408566210 FGGIZPNLQYXKLM-WZUFQYTHSA-N 339.326 3.489 50 40 EGGB Cc1cc(/C=N/NC(=O)Cc2ccccc2)c(C)n1-c1ccccn1 409232989 UBHAEJWIVYIEFX-HYARGMPZSA-N 332.407 3.182 50 40 EGGB COc1ccc(/C(C#N)=C/c2ccc(OCC(N)=O)c(Cl)c2)cc1 408583149 RWSXKNCQZZYNSN-RIYZIHGNSA-N 342.782 3.277 50 40 EGGB CCOC(=O)[C@@H]1CCC/C1=N\NC(=O)[C@H](C)SCc1ccccc1 408719101 DLUALPRVXCTUPB-FCWMDHMBSA-N 348.468 3.144 50 40 EGGB CC(=O)c1ccccc1NC(=O)/C(C#N)=C\c1ccc([N+](=O)[O-])cc1 408759506 GHJHJZSIBPIQIF-UVTDQMKNSA-N 335.319 3.343 50 40 EGGB C/C(=N/NC(=O)CSc1nc2ccccc2[nH]1)c1cccs1 55514 LVQQDRZDLSJXHR-ZDLGFXPLSA-N 330.438 3.257 50 40 EGGB CCOC(=O)N/N=C/c1ccc(-c2ccc(C(=O)OCC)cc2)o1 179196 YOYAUVGXFOTSCM-WOJGMQOQSA-N 330.340 3.203 50 40 EGGB NNC(=O)c1ccc(Cc2ccccc2)n1Cc1ccc(Cl)cc1 226028094 NWGZRGXPSPATIP-UHFFFAOYSA-N 339.826 3.384 50 40 EGGB Cc1cc(C)n(Cc2ccc(C(=O)N/N=C/c3ccccc3O)cc2)n1 130603 XARONFZDPTWECA-CIAFOILYSA-N 348.406 3.018 50 40 EGGB N#C/C(=C/c1cc(Br)cs1)C(=O)NCc1ccco1 16430245 GASLOHVGUFWNLW-WTKPLQERSA-N 337.198 3.327 50 40 EGGB CCOc1ccc(C(=O)NNC(=O)/C=C/c2ccccc2Cl)cc1 6453376 BHHDGAPTTMBSPW-FMIVXFBMSA-N 344.798 3.213 50 40 EGGB CN1/C(=C\C=N\NC(=O)c2ccc(O)cc2)C(C)(C)c2ccccc21 12488975 KARVXBYKRRJYIH-LBBNCXDASA-N 335.407 3.419 50 40 EGGB N#CC1=C(N)Oc2[nH]nc(-c3ccccc3)c2[C@@H]1c1ccc(F)cc1 6681848 WLMMSPQFGSWFGJ-OAHLLOKOSA-N 332.338 3.434 50 40 EGGB CC(=O)Nc1ccc(NC(=O)/C(C#N)=C/c2cc(F)ccc2F)cc1 40549499 JJOXZPQGPMYRBC-MDWZMJQESA-N 341.317 3.469 50 40 EGGB Cc1ccsc1/C=N/NC(=O)C(=O)Nc1cccc2ccccc12 59435556 RASRLDXCAHPLAO-YBFXNURJSA-N 337.404 3.299 50 40 EGGB COc1ccc(C(=O)NNc2ccccc2C(F)(F)F)c(OC)c1 45481013 AIDOCLRMGGTVDB-UHFFFAOYSA-N 340.301 3.480 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@@H](C)c2ccccc2)c(OC)c1 28356008 WSGIKSUAZJSRCJ-MPMPPSQCSA-N 336.391 3.488 50 40 EGGB COc1ccc(/C=C(\C#N)C(N)=O)cc1COc1ccc2c(c1)CCC2 2779200 CNWAQGZQTJPKRT-RQZCQDPDSA-N 348.402 3.155 50 40 EGGB N#C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCO2)c1cccc([N+](=O)[O-])c1 107799481 DAAKBLXYYRIQFS-UUILKARUSA-N 339.263 3.296 50 40 EGGB CCN(C(C)=O)c1nc(/C=C(\C#N)c2nc3ccccc3[nH]2)cs1 9366860 VMTYYHATVYYFAC-XYOKQWHBSA-N 337.408 3.456 50 40 EGGB Cc1ccc(NC(=O)/C(C#N)=C2\SCC(=O)N2c2ccccc2)cc1 4523349 XAESPIMKFMAKGD-MNDPQUGUSA-N 349.415 3.449 50 40 EGGB CC(=O)Oc1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@@H]2C)cc1 408797720 GWYGVMLFIINUFI-RMSYLZOUSA-N 326.396 3.214 50 40 EGGB N#C/C(=C\C1=Cc2ccccc2OC1)S(=O)(=O)c1ccc(F)cc1 80345343 RMKVAKNLYNLQBU-LICLKQGHSA-N 341.363 3.483 50 40 EGGB N#CC1=C(S)NC(=N)[C@@H](C(=O)Nc2ccccc2)C12CCCCC2 14671713 HOVPAEIABJXDNZ-AWEZNQCLSA-N 340.452 3.437 50 40 EGGB C[C@H]1C[C@H]1C(=O)NNc1nnc(-c2ccccc2)n1-c1ccccc1 31670831 OPELCFXDNGDSMN-XJKSGUPXSA-N 333.395 3.033 50 40 EGGB Cc1cc(N2CCCC2)c(F)cc1/C=N\NC(=O)c1ccccc1O 107642783 RXEOOQQSAWEPSO-MTJSOVHGSA-N 341.386 3.204 50 40 EGGB CC(C)C(=O)Nc1ccc(C(=O)N/N=C/[C@@H]2C[C@H]3C=C[C@H]2C3)cc1 101640810 WRZUEYJMJKCXGJ-YMFLCDSDSA-N 325.412 3.209 50 40 EGGB Cc1ccc(/C=N\NC(=O)C(F)(F)C(F)(F)C(F)(F)F)cc1 32115671 BMXZBALCQKLYON-IOXNKQMXSA-N 330.203 3.278 50 40 EGGB COc1cc(/C=N/NC(N)=O)cc(Cl)c1OCc1ccccc1C 408924721 NWSTYXHVTYOZKU-AWQFTUOYSA-N 347.802 3.238 50 40 EGGB COc1ccc(OC)c(/C=N\NC(=O)c2ccccc2-n2cccc2)c1 72341234 LKTWXYLAMSWIIU-STZFKDTASA-N 349.390 3.258 50 40 EGGB COc1ccc(/C=C(\C#N)C(=O)N[C@@H]2CCCC[C@H]2C)cc1OC 7158003 PAQUYLBHAIVTAD-LDXHQZPJSA-N 328.412 3.306 50 40 EGGB COc1ccc(NC(=O)C/C(C)=N/NC(=O)c2ccco2)cc1Cl 101509531 OAHBXJBHYCWOJF-VXLYETTFSA-N 349.774 3.076 50 40 EGGB Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)Nc2ccccc2)c1 357785 OFEBMMDPMPKHJK-UHFFFAOYSA-N 341.411 3.350 50 40 EGGB Cn1cc(/C=N/NC(=O)COc2cccc(Cl)c2)c2ccccc21 353789 GCBDWGWXJWEXOK-KEBDBYFISA-N 341.798 3.361 50 40 EGGB CCOc1cc(/C=N/NC(=O)[C@@H]2[C@@H]3CCCC[C@]32C)ccc1OC 107903435 ZLIMSBWJFFCIJE-QQSSKNFGSA-N 330.428 3.370 50 40 EGGB CC(C)c1ccc(/C=N/NC(=O)C(=O)N[C@@H](C)c2ccccc2)cc1 59386593 PFBKOZGBRSHQSJ-PCXKXAPESA-N 337.423 3.138 50 40 EGGB COc1ccc(NC(=O)/C(C#N)=C/c2cn(C)c3ccccc23)cn1 61719115 CDHHQNKZMDNTJV-UKTHLTGXSA-N 332.363 3.128 50 40 EGGB COc1ccc(/C=N/NC(=O)[C@H](C)Sc2ccccc2)cc1OC 20248369 BKXFQIHQIHPXKF-HCZVKUGISA-N 344.436 3.335 50 40 EGGB Cc1ccc2[nH]c(/C(C#N)=C\c3ccc(N4CCOCC4)o3)nc2c1 4539105 AKPVXTOQBCLSOY-KAMYIIQDSA-N 334.379 3.365 50 40 EGGB COc1cccc(OC)c1/C=C(\C#N)C(=O)Nc1ccc(F)cc1 179026287 UCFBYLANLDOJBE-ZRDIBKRKSA-N 326.327 3.389 50 40 EGGB C=C1CC(C(=O)N/N=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 408729704 IKPZMOROFGMZHC-VCHYOVAHSA-N 325.324 3.271 50 40 EGGB O=C(Cc1ccccc1[N+](=O)[O-])N/N=C\c1cccn1-c1ccccc1 34690598 CTPVTLKPETVCOP-ZHZULCJRSA-N 348.362 3.078 50 40 EGGB C#CCn1cc(/C=C(/C#N)C(=O)NCc2ccco2)c2ccccc21 253725 UQGPVQAEYHBYQD-PTNGSMBKSA-N 329.359 3.091 50 40 EGGB CC(C)(C)S(=O)(=O)/C(C#N)=C\Nc1cc(C(F)(F)F)ccn1 5249997 GEZURSNQHBDLLU-NTMALXAHSA-N 333.335 3.091 50 40 EGGB CCCCOc1ccc(/C=C(\C#N)C(=O)NC[C@H]2CCCO2)cc1 2697170 VUVWKXITOVSGSH-FXFXYLOPSA-N 328.412 3.068 50 40 EGGB Cc1cc(/C=N/NC(=O)c2ccc(C#N)cc2F)c(C)n1C(C)C 564311 LXYKJEFPMJFWGU-UFFVCSGVSA-N 326.375 3.461 50 40 EGGB Cc1cccc(Cn2cc(/C=N/NC(=O)CC#N)c3ccccc32)c1 59140331 PNLJGYFCDKWTQG-WSDLNYQXSA-N 330.391 3.362 50 40 EGGB C[C@H](Oc1ccccc1)C(=O)N/N=C\c1c(O)ccc2ccccc12 54202480 NNFYLENZBBRQJS-DTHVTWRFSA-N 334.375 3.463 50 40 EGGB Cc1cc(N2CCCC2)ccc1/C=N/NC(=O)c1ccc(F)cc1 59151286 GZWDZADMQBURJJ-FYJGNVAPSA-N 325.387 3.498 50 40 EGGB C[C@H](Sc1ccccc1)C(=O)N/N=C/c1cccc([N+](=O)[O-])c1 20249039 YTRIFOIWDXXWNA-OOIIIRTPSA-N 329.381 3.226 50 40 EGGB CCn1c(C)c(/C=N/NC(=O)COc2ccccc2)c2ccccc21 408526905 DJOFAGPKAOUPSN-FYJGNVAPSA-N 335.407 3.499 50 40 EGGB O=C(N/N=C\c1cccs1)C(O)(c1ccccc1)c1ccccc1 31906035 XPSMCLHLXHOBGX-ZHZULCJRSA-N 336.416 3.134 50 40 EGGB NNC(=O)c1ccc(CC2CCCCC2)n1Cc1ccc(F)cc1 226024371 AWFKWHMCYYPJKH-UHFFFAOYSA-N 329.419 3.402 50 40 EGGB CCOC(=O)C1=C(N)OC(c2ccccc2)=C(C#N)[C@@H]1c1ccccc1 5457824 HBDFDBNLZKJQES-KRWDZBQOSA-N 346.386 3.469 50 40 EGGB O=C(CSCc1ccccc1)NNC(=O)c1ccc(Cl)cc1 5736378 FMSLTAHENNUSRS-UHFFFAOYSA-N 334.828 3.034 50 40 EGGB C[C@@]12C(=O)[C@@H](C(c3ccccc3)=C1c1ccccc1)[C@H]1C(=O)OC(=O)[C@@H]12 104121284 HRWFTDUSOZZENY-FIQUECFISA-N 344.366 3.132 50 40 EGGB Cc1cc(C(=O)NNC(=O)c2oc3ccccc3c2C)c(C)s1 24179182 MAWNGXTYYSYYJN-UHFFFAOYSA-N 328.393 3.494 50 40 EGGB Cc1ccc(S[C@H](C)C(=O)N/N=C/c2ccc3c(c2)OCO3)cc1 409132899 KVBZDAPDZREACN-BUESGFEBSA-N 342.420 3.355 50 40 EGGB O=C(NNC(=O)c1ccc(-c2ccc(F)cc2)s1)c1cccnc1 9532318 NSLCPRUGHHUECU-UHFFFAOYSA-N 341.367 3.024 50 40 EGGB CCOc1ccccc1OCC(=O)N/N=C(/CC)c1ccccc1 33777866 NUOADXQGYQXIMR-SILNSSARSA-N 326.396 3.395 50 40 EGGB CO[C@H]1CN(C(=O)/C(C#N)=C/C(C)C)CC[C@@H]1Cc1ccccc1 585289328 IDILYCWZXNOCNZ-PUKZFDJSSA-N 326.440 3.199 50 40 EGGB